data_r8guzsf
# 
_audit.revision_id     1_0 
_audit.creation_date   2023-06-28 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      8guz 
_cell.length_a      41.2700 
_cell.length_b      232.8400 
_cell.length_c      41.4320 
_cell.angle_alpha   90.0000 
_cell.angle_beta    93.9560 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             "   data as used in refinement and resulting electron density maps." 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.045 
# 
_entry.id   8guz 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               8guz 
_symmetry.space_group_name_H-M   "P 1 21 1" 
_symmetry.Int_Tables_number      4 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.pdbx_r_free_flag 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.F_calc 
_refln.phase_calc 
_refln.pdbx_HL_A_iso 
_refln.pdbx_HL_B_iso 
_refln.pdbx_HL_C_iso 
_refln.pdbx_HL_D_iso 
_refln.pdbx_FWT 
_refln.pdbx_PHWT 
_refln.pdbx_DELFWT 
_refln.pdbx_DELPHWT 
_refln.fom 
1 1 1 -19 0   1  o 19 3.01210e+00 2.10241e+00 3.26621e+01 0.000   6.02571e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.00001e+01 0.000   2.66201e+00 180.000 0.5389 
1 1 1 -19 0   2  o 18 1.01108e+01 2.97437e+00 1.94865e+02 0.000   7.92311e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.95130e+02 0.000   2.64282e-01 0.000   1.0000 
1 1 1 -19 0   3  o 19 4.51285e+00 2.76429e+00 1.18934e+01 180.000 -2.39941e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.90520e+01 180.000 1.71586e+01 180.000 0.2354 
1 1 1 -19 0   4  o 8  4.06660e+00 2.59345e+00 1.25464e+02 180.000 -2.52387e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.90973e+01 180.000 9.63671e+01 0.000   0.9872 
1 1 1 -19 0   5  o 16 1.33579e+01 2.56064e+00 2.16862e+02 0.000   1.50857e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.96868e+02 0.000   8.00065e+01 0.000   1.0000 
1 1 1 -19 0   6  o 14 3.78976e+00 2.53227e+00 4.49940e+01 0.000   9.07254e-01  0.00000e+00  0.00000e+00 0.00000e+00 5.98032e+01 0.000   1.48092e+01 0.000   0.7198 
1 1 1 -19 1   1  o 4  7.68352e+00 1.95761e+00 2.01652e+02 65.015  5.79399e+00  1.24340e+01  0.00000e+00 0.00000e+00 8.39474e+01 65.015  1.17704e+02 245.015 0.9628 
1 1 1 -19 1   2  o 1  4.41555e+00 1.44181e+00 1.08719e+02 185.836 -6.03610e+00 -6.16929e-01 0.00000e+00 0.00000e+00 4.68480e+01 185.836 6.18710e+01 5.836   0.9134 
1 1 1 -19 1   3  o 4  4.69877e+00 1.51401e+00 8.84733e+01 28.278  4.44312e+00  2.39017e+00  0.00000e+00 0.00000e+00 7.34843e+01 28.278  1.49890e+01 208.278 0.8944 
1 1 1 -19 1   4  o 5  3.99509e+00 1.35050e+00 1.23273e+02 11.491  6.75449e+00  1.37306e+00  0.00000e+00 0.00000e+00 1.88924e+01 11.491  1.04381e+02 191.491 0.9243 
1 1 1 -19 1   5  o 18 4.85927e+00 1.56464e+00 5.35846e+01 213.997 -2.69687e+00 -1.81888e+00 0.00000e+00 0.00000e+00 1.00981e+02 213.997 4.73964e+01 213.997 0.8271 
1 1 1 -19 1   6  o 7  5.72758e+00 1.78471e+00 1.13719e+02 45.688  4.84312e+00  4.96079e+00  0.00000e+00 0.00000e+00 8.97635e+01 45.688  2.39552e+01 225.688 0.9248 
1 1 1 -19 2   1  o 6  5.32969e+00 1.58989e+00 7.94470e+01 41.936  3.58863e+00  3.22402e+00  0.00000e+00 0.00000e+00 1.03496e+02 41.936  2.40491e+01 41.936  0.8891 
1 1 1 -19 2   2  o 4  5.25016e+00 1.56514e+00 5.69942e+01 92.604  -1.57547e-01 3.46474e+00  0.00000e+00 0.00000e+00 1.12998e+02 92.604  5.60042e+01 92.604  0.8394 
1 1 1 -19 2   3  o 3  5.49232e+00 1.62184e+00 9.06262e+01 194.249 -5.42571e+00 -1.37782e+00 0.00000e+00 0.00000e+00 1.01053e+02 194.249 1.04273e+01 194.249 0.9056 
1 1 1 -19 2   4  o 1  8.04510e+00 1.79992e+00 1.65003e+02 312.087 9.01382e+00  -9.98027e+00 0.00000e+00 0.00000e+00 1.32976e+02 312.087 3.20272e+01 132.087 0.9621 
1 1 1 -19 2   5  o 10 5.18309e+00 1.59695e+00 2.14854e+01 107.582 -4.10173e-01 1.29441e+00  0.00000e+00 0.00000e+00 8.99383e+01 107.582 6.84529e+01 107.582 0.5590 
1 1 1 -19 2   6  o 2  4.79558e+00 1.57478e+00 3.41082e+01 269.832 -5.96029e-03 -2.03432e+00 0.00000e+00 0.00000e+00 9.54661e+01 269.832 6.13579e+01 269.832 0.7033 
1 1 1 -19 3   1  o 2  4.01014e+00 1.36719e+00 7.36271e+01 53.370  2.34668e+00  3.15640e+00  0.00000e+00 0.00000e+00 5.96497e+01 53.370  1.39774e+01 233.370 0.8609 
1 1 1 -19 3   2  o 9  4.35464e+00 1.44078e+00 9.29802e+01 65.116  2.18020e+00  4.70021e+00  0.00000e+00 0.00000e+00 5.77565e+01 65.116  3.52237e+01 245.116 0.8974 
1 1 1 -19 3   3  o 9  9.73855e+00 1.97651e+00 1.92733e+02 302.068 8.77889e+00  -1.40120e+01 0.00000e+00 0.00000e+00 1.71023e+02 302.068 2.17105e+01 122.068 0.9693 
1 1 1 -19 3   4  o 5  7.80045e+00 1.90838e+00 1.47770e+02 328.249 9.20710e+00  -5.69778e+00 0.00000e+00 0.00000e+00 1.38314e+02 328.249 9.45582e+00 148.249 0.9526 
1 1 1 -19 3   5  o 6  4.90637e+00 1.56503e+00 9.87598e+01 57.738  3.22995e+00  5.11679e+00  0.00000e+00 0.00000e+00 7.35430e+01 57.738  2.52168e+01 237.738 0.9131 
1 1 1 -19 3   6  o 10 4.74851e+00 1.57476e+00 1.11952e+02 315.105 4.68347e+00  -4.66637e+00 0.00000e+00 0.00000e+00 5.60421e+01 315.105 5.59094e+01 135.105 0.9209 
1 1 1 -19 4   1  o 12 6.26403e+00 1.77322e+00 6.46873e+01 2.638   4.06032e+00  1.87092e-01  0.00000e+00 0.00000e+00 1.44719e+02 2.638   8.00316e+01 2.638   0.8660 
1 1 1 -19 4   2  o 13 8.03944e+00 1.91164e+00 9.74369e+01 70.864  2.36451e+00  6.81460e+00  0.00000e+00 0.00000e+00 1.90279e+02 70.864  9.28418e+01 70.864  0.9278 
1 1 1 -19 4   3  o 12 4.73380e+00 1.51213e+00 5.37552e+01 310.116 2.05187e+00  -2.43529e+00 0.00000e+00 0.00000e+00 9.63317e+01 310.116 4.25765e+01 310.116 0.8227 
1 1 1 -19 4   4  o 4  4.00716e+00 1.35392e+00 3.97865e+01 119.997 -1.11248e+00 1.92715e+00  0.00000e+00 0.00000e+00 7.30605e+01 119.997 3.32740e+01 119.997 0.7315 
1 1 1 -19 4   5  o 11 6.80732e+00 1.77242e+00 1.44162e+02 311.535 6.79453e+00  -7.67043e+00 0.00000e+00 0.00000e+00 1.04513e+02 311.535 3.96488e+01 131.535 0.9499 
1 1 1 -19 4   6  f 0  5.91460e+00 1.79863e+00 1.11010e+02 153.259 -6.17737e+00 3.11238e+00  0.00000e+00 0.00000e+00 9.90707e+01 153.259 1.19396e+01 333.259 0.9246 
1 1 1 -19 5   1  o 2  5.38286e+00 1.67446e+00 8.42740e+01 55.773  2.76728e+00  4.06781e+00  0.00000e+00 0.00000e+00 1.00978e+02 55.773  1.67036e+01 55.773  0.8915 
1 1 1 -19 5   2  o 10 4.78402e+00 1.55372e+00 8.75204e+01 338.403 4.59689e+00  -1.81979e+00 0.00000e+00 0.00000e+00 7.70875e+01 338.403 1.04328e+01 158.403 0.8921 
1 1 1 -19 5   4  o 3  3.70512e+00 1.28214e+00 2.70051e+01 1.819   1.47033e+00  4.66903e-02  0.00000e+00 0.00000e+00 5.69948e+01 1.819   2.99897e+01 1.819   0.5889 
1 1 1 -19 5   5  o 7  1.21059e+01 1.83976e+00 2.27115e+02 236.379 -1.51541e+01 -2.27906e+01 0.00000e+00 0.00000e+00 2.29866e+02 236.379 2.75131e+00 236.379 0.9816 
1 1 1 -19 5   6  o 7  4.84809e+00 1.58502e+00 1.21619e+02 21.099  6.78730e+00  2.61892e+00  0.00000e+00 0.00000e+00 5.13021e+01 21.099  7.03171e+01 201.099 0.9285 
1 1 1 -19 6   1  o 18 5.45470e+00 1.71819e+00 3.73821e+01 318.130 1.59696e+00  -1.43138e+00 0.00000e+00 0.00000e+00 1.14258e+02 318.130 7.68755e+01 318.130 0.7201 
1 1 1 -19 6   2  o 2  8.97826e+00 1.88046e+00 1.20336e+02 209.970 -8.80125e+00 -5.07536e+00 0.00000e+00 0.00000e+00 2.08447e+02 209.970 8.81108e+01 209.970 0.9494 
1 1 1 -19 6   4  o 19 4.65349e+00 1.51861e+00 6.41380e+01 342.665 3.52702e+00  -1.10090e+00 0.00000e+00 0.00000e+00 8.82561e+01 342.665 2.41181e+01 342.665 0.8507 
1 1 1 -19 6   5  o 15 4.49278e+00 1.49270e+00 7.21658e+01 312.357 2.79227e+00  -3.06254e+00 0.00000e+00 0.00000e+00 7.79541e+01 312.357 5.78830e+00 312.357 0.8689 
1 1 1 -19 6   6  o 10 9.50752e+00 2.03756e+00 1.45687e+02 127.581 -7.50597e+00 9.75322e+00  0.00000e+00 0.00000e+00 2.04374e+02 127.581 5.86878e+01 127.581 0.9585 
1 1 1 -19 7   1  o 15 9.29038e+00 2.00912e+00 1.78294e+02 290.115 4.90968e+00  -1.34052e+01 0.00000e+00 0.00000e+00 1.67542e+02 290.115 1.07519e+01 110.115 0.9643 
1 1 1 -19 7   2  o 4  3.76463e+00 1.30475e+00 3.81747e+01 53.399  1.20697e+00  1.62514e+00  0.00000e+00 0.00000e+00 6.37164e+01 53.399  2.55417e+01 53.399  0.7017 
1 1 1 -19 7   4  o 19 5.77787e+00 1.68345e+00 1.11006e+02 45.816  4.97872e+00  5.12267e+00  0.00000e+00 0.00000e+00 9.52063e+01 45.816  1.58002e+01 225.816 0.9271 
1 1 1 -19 7   5  f 0  3.87484e+00 1.32211e+00 1.90396e+02 170.840 -1.05534e+01 1.70164e+00  0.00000e+00 0.00000e+00 4.85341e+01 350.840 2.38930e+02 350.840 0.9520 
1 1 1 -19 7   6  o 18 8.01329e+00 1.93253e+00 1.18096e+02 204.416 -8.24201e+00 -3.74154e+00 0.00000e+00 0.00000e+00 1.72190e+02 204.416 5.40943e+01 204.416 0.9430 
1 1 1 -19 8   1  o 14 4.66511e+00 1.52981e+00 4.38316e+01 198.193 -2.33184e+00 -7.66349e-01 0.00000e+00 0.00000e+00 9.30237e+01 198.193 4.91921e+01 198.193 0.7600 
1 1 1 -19 8   2  o 2  5.17690e+00 1.62790e+00 1.27598e+02 188.701 -7.31294e+00 -1.11915e+00 0.00000e+00 0.00000e+00 5.80376e+01 188.701 6.95605e+01 8.701   0.9297 
1 1 1 -19 8   4  f 0  5.50726e+00 1.65663e+00 7.16396e+01 158.580 -4.17004e+00 1.63587e+00  0.00000e+00 0.00000e+00 1.14867e+02 158.580 4.32273e+01 158.580 0.8797 
1 1 1 -19 8   5  o 19 4.72464e+00 1.54112e+00 5.15096e+01 237.169 -1.62707e+00 -2.52175e+00 0.00000e+00 0.00000e+00 9.56706e+01 237.169 4.41610e+01 237.169 0.8101 
1 1 1 -19 8   6  o 4  5.01355e+00 1.54850e+00 7.58576e+01 28.316  4.24404e+00  2.28673e+00  0.00000e+00 0.00000e+00 9.53629e+01 28.316  1.95054e+01 28.316  0.8891 
1 1 1 -19 9   1  o 5  5.73861e+00 1.71564e+00 9.40950e+01 193.978 -5.51750e+00 -1.37338e+00 0.00000e+00 0.00000e+00 1.06861e+02 193.978 1.27657e+01 193.978 0.9072 
1 1 1 -19 9   2  o 5  6.63629e+00 1.87076e+00 1.13658e+02 311.125 4.69364e+00  -5.37562e+00 0.00000e+00 0.00000e+00 1.23612e+02 311.125 9.95339e+00 311.125 0.9270 
1 1 1 -19 9   4  o 16 4.02374e+00 1.37397e+00 3.75863e+01 116.877 -9.54784e-01 1.88384e+00  0.00000e+00 0.00000e+00 7.32138e+01 116.877 3.56274e+01 116.877 0.7153 
1 1 1 -19 9   5  o 18 5.49806e+00 1.70502e+00 1.04085e+02 93.746  -4.09367e-01 6.25170e+00  0.00000e+00 0.00000e+00 8.96434e+01 93.746  1.44414e+01 273.746 0.9163 
1 1 1 -19 9   6  o 5  4.76000e+00 1.48779e+00 8.06401e+01 148.667 -4.35031e+00 2.64842e+00  0.00000e+00 0.00000e+00 8.30951e+01 148.667 2.45499e+00 148.667 0.8955 
1 1 1 -19 10  1  o 4  4.80891e+00 1.51270e+00 6.31113e+01 48.954  2.42021e+00  2.77961e+00  0.00000e+00 0.00000e+00 9.47138e+01 48.954  3.16025e+01 48.954  0.8502 
1 1 1 -19 10  2  o 11 5.68785e+00 1.73721e+00 1.26647e+02 165.922 -7.43084e+00 1.86351e+00  0.00000e+00 0.00000e+00 7.78532e+01 165.922 4.87934e+01 345.922 0.9322 
1 1 1 -19 10  4  o 11 5.89085e+00 1.70994e+00 7.25251e+01 132.457 -3.14942e+00 3.44211e+00  0.00000e+00 0.00000e+00 1.28158e+02 132.457 5.56333e+01 132.457 0.8850 
1 1 1 -19 10  5  o 6  6.56553e+00 1.86322e+00 6.91097e+01 5.758   4.40307e+00  4.43986e-01  0.00000e+00 0.00000e+00 1.52583e+02 5.758   8.34729e+01 5.758   0.8781 
1 1 1 -19 10  6  o 10 4.87018e+00 1.57129e+00 8.33550e+01 184.442 -5.06230e+00 -3.93253e-01 0.00000e+00 0.00000e+00 8.41013e+01 184.442 7.46352e-01 184.442 0.8952 
1 1 1 -19 11  1  o 8  5.56143e+00 1.69806e+00 1.13759e+02 134.515 -4.84963e+00 4.93239e+00  0.00000e+00 0.00000e+00 8.47189e+01 134.515 2.90403e+01 314.515 0.9246 
1 1 1 -19 11  2  o 4  1.00588e+01 2.00527e+00 1.83958e+02 273.027 8.61817e-01  -1.62949e+01 0.00000e+00 0.00000e+00 1.91885e+02 273.027 7.92720e+00 273.027 0.9689 
1 1 1 -19 11  4  f 0  4.02793e+00 1.38320e+00 2.38156e+01 265.595 -1.02129e-01 -1.32572e+00 0.00000e+00 0.00000e+00 6.16325e+01 265.595 3.78169e+01 265.595 0.5511 
1 1 1 -19 11  5  o 4  5.97977e+00 1.79713e+00 1.12968e+02 48.456  4.57584e+00  5.16411e+00  0.00000e+00 0.00000e+00 9.95850e+01 48.456  1.33833e+01 228.456 0.9244 
1 1 1 -19 11  6  o 8  6.50544e+00 1.83877e+00 1.34374e+02 164.824 -8.65362e+00 2.34727e+00  0.00000e+00 0.00000e+00 1.01126e+02 164.824 3.32478e+01 344.824 0.9425 
1 1 1 -19 12  1  o 13 4.61470e+00 1.52394e+00 8.58690e+01 103.873 -1.17792e+00 4.76926e+00  0.00000e+00 0.00000e+00 7.28889e+01 103.873 1.29801e+01 283.873 0.8913 
1 1 1 -19 12  2  o 3  5.54482e+00 1.66771e+00 6.07832e+01 275.860 3.84429e-01  -3.74534e+00 0.00000e+00 0.00000e+00 1.21796e+02 275.860 6.10128e+01 275.860 0.8538 
1 1 1 -19 12  4  o 13 5.73043e+00 1.72721e+00 4.35484e+01 294.963 1.16646e+00  -2.50575e+00 0.00000e+00 0.00000e+00 1.30902e+02 294.963 8.73534e+01 294.963 0.7909 
1 1 1 -19 12  5  o 9  5.59436e+00 1.72083e+00 9.23851e+01 69.968  1.90826e+00  5.23389e+00  0.00000e+00 0.00000e+00 1.02319e+02 69.968  9.93355e+00 69.968  0.9051 
1 1 1 -19 12  6  o 1  6.03498e+00 1.75268e+00 3.20779e+01 297.524 9.76847e-01  -1.87456e+00 0.00000e+00 0.00000e+00 1.33798e+02 297.524 1.01720e+02 297.524 0.7156 
1 1 1 -19 13  1  o 1  5.60013e+00 1.71216e+00 5.79655e+01 286.948 1.02357e+00  -3.35888e+00 0.00000e+00 0.00000e+00 1.23962e+02 286.948 6.59969e+01 286.948 0.8417 
1 1 1 -19 13  2  o 12 6.70264e+00 1.83388e+00 7.82478e+01 14.649  5.03568e+00  1.31630e+00  0.00000e+00 0.00000e+00 1.53844e+02 14.649  7.55966e+01 14.649  0.8979 
1 1 1 -19 13  4  o 9  3.91945e+00 1.34899e+00 6.03368e+01 247.247 -1.34652e+00 -3.21067e+00 0.00000e+00 0.00000e+00 6.64063e+01 247.247 6.06955e+00 247.247 0.8401 
1 1 1 -19 13  5  o 8  6.08892e+00 1.82184e+00 4.18031e+01 138.915 -1.92459e+00 1.67805e+00  0.00000e+00 0.00000e+00 1.38629e+02 138.915 9.68259e+01 138.915 0.7707 
1 1 1 -19 13  6  o 15 4.83666e+00 1.56757e+00 9.70895e+01 307.663 3.59506e+00  -4.65775e+00 0.00000e+00 0.00000e+00 7.20526e+01 307.663 2.50369e+01 127.663 0.9105 
1 1 1 -19 14  1  f 0  4.27190e+00 1.42645e+00 8.05204e+01 338.294 4.23397e+00  -1.68544e+00 0.00000e+00 0.00000e+00 6.48958e+01 338.294 1.56246e+01 158.294 0.8820 
1 1 1 -19 14  2  o 2  4.51807e+00 1.49112e+00 8.02960e+01 356.301 4.57507e+00  -2.95785e-01 0.00000e+00 0.00000e+00 7.35041e+01 356.301 6.79187e+00 176.301 0.8828 
1 1 1 -19 14  4  o 1  5.81608e+00 1.74079e+00 9.97859e+01 180.310 -6.35981e+00 -3.44537e-02 0.00000e+00 0.00000e+00 1.05625e+02 180.310 5.83877e+00 180.310 0.9176 
1 1 1 -19 14  5  o 14 5.33324e+00 1.66671e+00 5.74506e+01 240.224 -1.77562e+00 -3.10342e+00 0.00000e+00 0.00000e+00 1.15812e+02 240.224 5.83610e+01 240.224 0.8450 
1 1 1 -19 14  6  o 3  1.06862e+01 1.94970e+00 2.13327e+02 22.873  1.97123e+01  8.31571e+00  0.00000e+00 0.00000e+00 1.87380e+02 22.873  2.59462e+01 202.873 0.9763 
1 1 1 -19 15  1  o 14 4.33786e+00 1.45228e+00 3.21255e+01 72.657  5.39826e-01  1.72864e+00  0.00000e+00 0.00000e+00 7.90626e+01 72.657  4.69371e+01 72.657  0.6642 
1 1 1 -19 15  2  o 2  6.54906e+00 1.69773e+00 1.28327e+02 320.317 7.04030e+00  -5.84142e+00 0.00000e+00 0.00000e+00 1.09976e+02 320.317 1.83511e+01 140.317 0.9436 
1 1 1 -19 15  4  o 12 7.93993e+00 1.95384e+00 8.82303e+01 159.714 -6.03908e+00 2.23227e+00  0.00000e+00 0.00000e+00 1.92503e+02 159.714 1.04273e+02 159.714 0.9187 
1 1 1 -19 15  5  o 7  4.91285e+00 1.58950e+00 6.65783e+01 340.789 3.81845e+00  -1.33057e+00 0.00000e+00 0.00000e+00 9.68412e+01 340.789 3.02628e+01 340.789 0.8652 
1 1 1 -19 15  6  o 1  4.75596e+00 1.55840e+00 5.50763e+01 35.756  2.64957e+00  1.90781e+00  0.00000e+00 0.00000e+00 9.61252e+01 35.756  4.10490e+01 35.756  0.8278 
1 1 1 -19 16  1  o 18 5.07098e+00 1.61369e+00 7.25301e+01 244.676 -1.81796e+00 -3.84169e+00 0.00000e+00 0.00000e+00 9.82154e+01 244.676 2.56853e+01 244.676 0.8725 
1 1 1 -19 16  2  o 10 6.46504e+00 1.82724e+00 1.53356e+02 188.547 -9.73555e+00 -1.46308e+00 0.00000e+00 0.00000e+00 8.29054e+01 188.547 7.04509e+01 8.547   0.9478 
1 1 1 -19 16  4  o 14 3.51394e+00 1.23229e+00 3.11803e+01 164.645 -1.63539e+00 4.49086e-01  0.00000e+00 0.00000e+00 5.55018e+01 164.645 2.43215e+01 164.645 0.6410 
1 1 1 -19 16  5  o 8  1.27687e+01 1.79167e+00 2.09128e+02 342.617 2.70924e+01  -8.48162e+00 0.00000e+00 0.00000e+00 2.73045e+02 342.617 6.39173e+01 342.617 0.9822 
1 1 1 -19 17  1  o 18 5.05611e+00 1.59254e+00 3.31861e+01 68.385  7.34911e-01  1.85480e+00  0.00000e+00 0.00000e+00 1.02803e+02 68.385  6.96165e+01 68.385  0.6970 
1 1 1 -19 17  2  o 15 6.46868e+00 1.76935e+00 1.27903e+02 328.109 7.35086e+00  -4.57391e+00 0.00000e+00 0.00000e+00 1.06630e+02 328.109 2.12735e+01 148.109 0.9403 
1 1 1 -19 17  3  o 11 4.29862e+00 1.42105e+00 5.91365e+01 252.032 -1.09294e+00 -3.37013e+00 0.00000e+00 0.00000e+00 8.05075e+01 252.032 2.13710e+01 252.032 0.8433 
1 1 1 -19 17  4  o 13 6.05094e+00 1.73715e+00 1.25453e+02 319.072 6.13445e+00  -5.31914e+00 0.00000e+00 0.00000e+00 9.25592e+01 319.072 3.28942e+01 139.072 0.9362 
1 1 1 -19 17  5  f 0  5.22981e+00 1.66152e+00 9.39436e+01 90.449  -4.48466e-02 5.72394e+00  0.00000e+00 0.00000e+00 8.85823e+01 90.449  5.36131e+00 270.449 0.9078 
1 1 1 -19 18  1  o 12 5.28832e+00 1.63387e+00 6.79827e+01 285.695 1.12155e+00  -3.99136e+00 0.00000e+00 0.00000e+00 1.09332e+02 285.695 4.13494e+01 285.695 0.8689 
1 1 1 -19 18  2  o 11 1.02353e+01 2.06025e+00 2.84063e+02 44.481  1.77182e+01  1.74001e+01  0.00000e+00 0.00000e+00 1.02530e+02 44.481  1.81534e+02 224.481 0.9797 
1 1 1 -19 18  3  o 10 5.54654e+00 1.64391e+00 9.11472e+01 172.029 -5.89395e+00 8.25344e-01  0.00000e+00 0.00000e+00 1.03617e+02 172.029 1.24694e+01 172.029 0.9116 
1 1 1 -19 19  1  o 4  5.42579e+00 1.68194e+00 9.75472e+01 337.816 5.60995e+00  -2.28753e+00 0.00000e+00 0.00000e+00 9.36530e+01 337.816 3.89420e+00 157.816 0.9133 
1 1 1 -19 19  2  o 13 5.72968e+00 1.72906e+00 8.86561e+01 8.684   5.55139e+00  8.47944e-01  0.00000e+00 0.00000e+00 1.11464e+02 8.684   2.28080e+01 8.684   0.9059 
1 1 1 -19 19  3  o 17 5.29345e+00 1.65509e+00 1.13606e+02 276.261 7.44717e-01  -6.78761e+00 0.00000e+00 0.00000e+00 7.47009e+01 276.261 3.89049e+01 96.261  0.9236 
1 1 1 -19 20  1  o 12 5.25221e+00 1.62772e+00 6.76170e+01 114.404 -1.74801e+00 3.85269e+00  0.00000e+00 0.00000e+00 1.09063e+02 114.404 4.14463e+01 114.404 0.8718 
1 1 1 -19 20  2  o 7  4.78865e+00 1.50330e+00 4.12564e+01 346.858 2.51711e+00  -5.87686e-01 0.00000e+00 0.00000e+00 1.01614e+02 346.858 6.03576e+01 346.858 0.7739 
1 1 1 -19 20  3  o 17 7.07334e+00 1.90398e+00 1.02608e+02 298.555 3.29852e+00  -6.06126e+00 0.00000e+00 0.00000e+00 1.49232e+02 298.555 4.66233e+01 298.555 0.9244 
1 1 1 -19 21  1  o 5  4.14905e+00 1.38900e+00 2.14120e+01 37.937  9.66906e-01  7.53729e-01  0.00000e+00 0.00000e+00 6.19494e+01 37.937  4.05374e+01 37.937  0.5208 
1 1 1 -19 21  2  o 16 5.07903e+00 1.61199e+00 1.36266e+02 311.791 5.40226e+00  -6.04407e+00 0.00000e+00 0.00000e+00 4.70181e+01 311.791 8.92476e+01 131.791 0.9361 
1 1 1 -19 21  3  o 10 4.88514e+00 1.56186e+00 1.22131e+02 243.532 -3.21534e+00 -6.45792e+00 0.00000e+00 0.00000e+00 5.24379e+01 243.532 6.96932e+01 63.532  0.9278 
1 1 1 -19 22  1  o 6  4.72496e+00 1.49821e+00 2.99408e+01 268.169 -5.74951e-02 -1.79895e+00 0.00000e+00 0.00000e+00 9.07361e+01 268.169 6.07953e+01 268.169 0.6620 
1 1 1 -19 22  2  o 18 3.73574e+00 1.28871e+00 7.84473e+01 78.364  8.77594e-01  4.26154e+00  0.00000e+00 0.00000e+00 4.76652e+01 78.364  3.07821e+01 258.363 0.8758 
1 1 1 -19 22  3  o 10 4.39350e+00 1.46184e+00 3.17830e+01 263.332 -2.10763e-01 -1.80277e+00 0.00000e+00 0.00000e+00 8.07239e+01 263.332 4.89409e+01 263.332 0.6649 
1 1 1 -19 23  1  o 7  5.12110e+00 1.59370e+00 9.84654e+01 339.475 5.57798e+00  -2.08828e+00 0.00000e+00 0.00000e+00 8.16425e+01 339.475 1.68228e+01 159.475 0.9117 
1 1 1 -19 23  2  o 6  6.54853e+00 1.79689e+00 1.23843e+02 170.687 -8.17113e+00 1.33999e+00  0.00000e+00 0.00000e+00 1.12793e+02 170.687 1.10495e+01 350.687 0.9375 
1 1 1 -19 23  3  o 17 4.78734e+00 1.53812e+00 5.57898e+01 309.353 2.17723e+00  -2.65507e+00 0.00000e+00 0.00000e+00 9.86186e+01 309.353 4.28288e+01 309.353 0.8376 
1 1 1 -19 24  1  o 4  1.00957e+01 1.76633e+00 1.58388e+02 127.326 -1.01095e+01 1.32580e+01  0.00000e+00 0.00000e+00 2.19185e+02 127.326 6.07970e+01 127.326 0.9695 
1 1 1 -19 24  2  o 6  5.95086e+00 1.67783e+00 1.35347e+02 325.706 7.39116e+00  -5.04083e+00 0.00000e+00 0.00000e+00 8.07834e+01 325.706 5.45640e+01 145.706 0.9423 
1 1 1 -19 24  3  o 2  4.82903e+00 1.52095e+00 5.12711e+01 150.776 -2.81276e+00 1.57353e+00  0.00000e+00 0.00000e+00 1.02175e+02 150.776 5.09038e+01 150.776 0.8252 
1 1 1 -19 25  1  o 17 4.22197e+00 1.38408e+00 3.72054e+01 147.092 -1.90752e+00 1.23438e+00  0.00000e+00 0.00000e+00 8.29393e+01 147.092 4.57340e+01 147.092 0.7378 
1 1 1 -19 25  2  o 17 3.79151e+00 1.30845e+00 5.31772e+01 54.663  1.78805e+00  2.52193e+00  0.00000e+00 0.00000e+00 6.61350e+01 54.663  1.29578e+01 54.663  0.8165 
1 1 1 -19 26  1  o 19 4.45247e+00 1.47165e+00 1.05325e+02 191.202 -6.21580e+00 -1.23097e+00 0.00000e+00 0.00000e+00 5.22007e+01 191.202 5.31246e+01 11.202  0.9173 
1 1 1 -19 26  2  o 4  5.49924e+00 1.58197e+00 1.87952e+02 294.144 5.25159e+00  -1.17160e+01 0.00000e+00 0.00000e+00 1.55415e+01 294.144 1.72410e+02 114.144 0.9602 
1 1 1 -19 27  1  o 1  4.18793e+00 1.40871e+00 4.81191e+01 8.017   2.81288e+00  3.96198e-01  0.00000e+00 0.00000e+00 8.06852e+01 8.017   3.25661e+01 8.017   0.7975 
1 1 1 -19 27  2  o 11 6.77092e+00 1.75424e+00 1.10843e+02 66.514  3.25084e+00  7.48150e+00  0.00000e+00 0.00000e+00 1.33506e+02 66.514  2.26630e+01 66.514  0.9365 
1 1 1 -19 28  1  o 17 4.69634e+00 1.50557e+00 4.99498e+01 66.328  1.23762e+00  2.82318e+00  0.00000e+00 0.00000e+00 9.78181e+01 66.328  4.78683e+01 66.328  0.8159 
1 1 1 -19 28  2  o 15 6.10988e+00 1.75458e+00 1.90153e+02 259.094 -2.39582e+00 -1.24349e+01 0.00000e+00 0.00000e+00 3.57696e+01 259.094 1.54384e+02 79.094  0.9597 
1 1 1 -19 29  1  o 17 5.86357e+00 1.67871e+00 1.09463e+02 33.788  6.14560e+00  4.11229e+00  0.00000e+00 0.00000e+00 1.00744e+02 33.788  8.71833e+00 213.788 0.9297 
1 1 1 -19 29  2  o 11 5.02467e+00 1.55513e+00 5.53826e+01 242.980 -1.59835e+00 -3.13419e+00 0.00000e+00 0.00000e+00 1.07629e+02 242.980 5.22466e+01 242.980 0.8420 
1 1 1 -19 30  1  o 10 3.88314e+00 1.31095e+00 7.42305e+01 292.935 1.68734e+00  -3.98775e+00 0.00000e+00 0.00000e+00 5.67957e+01 292.935 1.74348e+01 112.935 0.8751 
1 1 1 -19 30  2  o 4  3.99629e+00 1.30534e+00 8.09554e+01 159.373 -4.56675e+00 1.71894e+00  0.00000e+00 0.00000e+00 5.61439e+01 159.373 2.48115e+01 339.373 0.8905 
1 1 1 -19 31  1  o 11 5.61031e+00 1.70246e+00 1.06757e+02 262.198 -9.15361e-01 -6.68059e+00 0.00000e+00 0.00000e+00 9.27913e+01 262.198 1.39659e+01 82.198  0.9225 
1 1 1 -19 31  2  o 17 4.83643e+00 1.50094e+00 1.22466e+02 81.539  1.14095e+00  7.66957e+00  0.00000e+00 0.00000e+00 5.13742e+01 81.539  7.10922e+01 261.539 0.9331 
1 1 1 -19 32  1  o 8  4.50137e+00 1.47461e+00 6.92300e+01 0.578   4.15742e+00  4.19748e-02  0.00000e+00 0.00000e+00 8.16258e+01 0.578   1.23958e+01 0.578   0.8693 
1 1 1 -19 32  2  o 8  5.00737e+00 1.57602e+00 4.67480e+01 95.034  -2.62571e-01 2.98067e+00  0.00000e+00 0.00000e+00 1.09366e+02 95.034  6.26180e+01 95.034  0.8094 
1 1 1 -19 33  1  f 0  4.62620e+00 1.50712e+00 9.75840e+01 4.757   6.06271e+00  5.04556e-01  0.00000e+00 0.00000e+00 6.53448e+01 4.757   3.22392e+01 184.757 0.9136 
1 1 1 -19 33  2  o 16 5.17013e+00 1.60210e+00 8.45875e+01 312.570 3.70302e+00  -4.03124e+00 0.00000e+00 0.00000e+00 9.52874e+01 312.570 1.06999e+01 312.570 0.9033 
1 1 1 -19 34  1  o 14 5.93042e+00 1.70797e+00 8.92325e+01 264.348 -6.01558e-01 -6.07860e+00 0.00000e+00 0.00000e+00 1.19695e+02 264.348 3.04620e+01 264.348 0.9140 
1 1 1 -19 34  2  o 9  5.16485e+00 1.60318e+00 8.93906e+01 155.766 -5.26628e+00 2.37046e+00  0.00000e+00 0.00000e+00 9.13572e+01 155.766 1.96656e+00 155.766 0.9087 
1 1 1 -19 35  1  o 15 5.99599e+00 1.71158e+00 1.06154e+02 304.496 4.28555e+00  -6.23642e+00 0.00000e+00 0.00000e+00 1.09073e+02 304.496 2.91921e+00 304.496 0.9314 
1 1 1 -19 35  2  o 13 7.19098e+00 1.84083e+00 1.31214e+02 329.567 8.75349e+00  -5.14232e+00 0.00000e+00 0.00000e+00 1.31679e+02 329.567 4.65247e-01 329.567 0.9494 
1 1 1 -19 36  1  o 2  5.21822e+00 1.51981e+00 8.53512e+01 198.874 -5.92747e+00 -2.02644e+00 0.00000e+00 0.00000e+00 9.89063e+01 198.874 1.35551e+01 198.874 0.9163 
1 1 1 -19 36  2  o 17 6.02488e+00 1.74430e+00 7.18063e+01 14.430  4.91752e+00  1.26538e+00  0.00000e+00 0.00000e+00 1.35852e+02 14.430  6.40456e+01 14.430  0.8952 
1 1 1 -19 37  1  o 8  1.12449e+01 1.81732e+00 2.06847e+02 255.582 -6.41395e+00 -2.49491e+01 0.00000e+00 0.00000e+00 2.17957e+02 255.582 1.11108e+01 255.582 0.9804 
1 1 1 -19 37  2  o 10 5.41235e+00 1.65565e+00 8.07007e+01 52.308  3.42919e+00  4.43821e+00  0.00000e+00 0.00000e+00 1.08048e+02 52.308  2.73475e+01 52.308  0.9058 
1 1 1 -19 38  1  o 15 5.49337e+00 1.68810e+00 1.36057e+02 108.011 -2.88725e+00 8.88029e+00  0.00000e+00 0.00000e+00 6.39202e+01 108.011 7.21370e+01 288.011 0.9448 
1 1 1 -19 38  2  o 17 5.02227e+00 1.45546e+00 7.05044e+01 329.762 4.65265e+00  -2.71207e+00 0.00000e+00 0.00000e+00 1.03811e+02 329.762 3.33064e+01 329.762 0.9016 
1 1 1 -19 39  1  o 18 4.65333e+00 1.47482e+00 5.91667e+01 86.862  2.25281e-01  4.10861e+00  0.00000e+00 0.00000e+00 9.64019e+01 86.862  3.72353e+01 86.862  0.8678 
1 1 1 -19 39  2  f 0  7.94086e+00 1.89724e+00 1.85073e+02 240.284 -7.72377e+00 -1.35323e+01 0.00000e+00 0.00000e+00 1.10608e+02 240.284 7.44647e+01 60.284  0.9674 
1 1 1 -19 40  1  o 1  5.61857e+00 1.56323e+00 1.10991e+02 242.215 -3.83784e+00 -7.28358e+00 0.00000e+00 0.00000e+00 9.18350e+01 242.215 1.91562e+01 62.215  0.9371 
1 1 1 -19 40  2  o 12 6.38724e+00 1.63576e+00 1.06625e+02 285.225 2.22972e+00  -8.19281e+00 0.00000e+00 0.00000e+00 1.24239e+02 285.225 1.76141e+01 285.225 0.9391 
1 1 1 -19 41  1  o 12 5.46521e+00 1.53276e+00 7.23401e+01 107.995 -1.72592e+00 5.31335e+00  0.00000e+00 0.00000e+00 1.18250e+02 107.995 4.59103e+01 107.995 0.9054 
1 1 1 -19 41  2  o 5  4.82737e+00 1.51607e+00 6.39027e+01 41.949  3.28783e+00  2.95508e+00  0.00000e+00 0.00000e+00 9.91976e+01 41.949  3.52949e+01 41.949  0.8780 
1 1 1 -19 42  1  o 16 5.26280e+00 1.56792e+00 7.26822e+01 316.022 3.75459e+00  -3.62298e+00 0.00000e+00 0.00000e+00 1.09365e+02 316.022 3.66824e+01 316.022 0.8982 
1 1 1 -19 42  2  o 17 3.83638e+00 1.30217e+00 6.90092e+01 223.559 -3.27220e+00 -3.11157e+00 0.00000e+00 0.00000e+00 6.10121e+01 223.559 7.99709e+00 43.559  0.8808 
1 1 1 -19 43  1  o 17 4.48247e+00 1.44695e+00 7.31345e+01 357.771 5.02071e+00  -1.95446e-01 0.00000e+00 0.00000e+00 8.11688e+01 357.771 8.03428e+00 357.771 0.8939 
1 1 1 -19 43  2  o 6  6.73816e+00 1.72769e+00 1.79338e+02 161.056 -1.38727e+01 4.76172e+00  0.00000e+00 0.00000e+00 7.09089e+01 161.056 1.08430e+02 341.056 0.9653 
1 1 1 -19 44  1  o 4  4.96180e+00 1.55099e+00 1.15467e+02 222.093 -5.84369e+00 -5.27897e+00 0.00000e+00 0.00000e+00 6.29995e+01 222.093 5.24672e+01 42.093  0.9342 
1 1 1 -19 44  2  o 14 3.41282e+00 1.18153e+00 5.75236e+01 161.729 -3.49578e+00 1.15415e+00  0.00000e+00 0.00000e+00 5.40797e+01 161.729 3.44393e+00 341.729 0.8500 
1 1 1 -19 45  1  o 5  3.91881e+00 1.27963e+00 5.84762e+01 98.377  -5.85150e-01 3.97352e+00  0.00000e+00 0.00000e+00 7.18954e+01 98.377  1.34192e+01 98.377  0.8641 
1 1 1 -19 45  2  o 4  6.86451e+00 1.72404e+00 1.33171e+02 9.467   1.08987e+01  1.81742e+00  0.00000e+00 0.00000e+00 1.18627e+02 9.467   1.45443e+01 189.467 0.9536 
1 1 1 -19 46  1  o 5  5.59637e+00 1.62892e+00 4.36305e+01 168.481 -3.16893e+00 6.45814e-01  0.00000e+00 0.00000e+00 1.34288e+02 168.481 9.06580e+01 168.481 0.8259 
1 1 1 -19 47  1  o 17 3.43373e+00 1.19441e+00 2.71077e+01 89.854  4.99350e-03  1.95491e+00  0.00000e+00 0.00000e+00 6.41126e+01 89.854  3.70049e+01 89.854  0.6902 
1 1 1 -19 48  1  o 3  4.27794e+00 1.40978e+00 4.89010e+01 29.859  2.97290e+00  1.70664e+00  0.00000e+00 0.00000e+00 8.89354e+01 29.859  4.00344e+01 29.859  0.8372 
1 1 1 -18 0   1  o 5  1.45411e+01 2.17845e+00 1.40030e+02 0.000   1.12791e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.19754e+02 0.000   2.79723e+02 0.000   1.0000 
1 1 1 -18 0   2  o 3  9.95970e+00 2.97188e+00 2.98321e+02 180.000 -1.11879e+01 -0.00000e+00 0.00000e+00 0.00000e+00 8.47814e+01 180.000 2.13539e+02 0.000   1.0000 
1 1 1 -18 0   3  o 3  3.76913e+00 2.40993e+00 5.30050e+01 0.000   1.00979e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.79055e+01 0.000   4.90050e+00 0.000   0.7657 
1 1 1 -18 0   4  f 0  3.17126e+00 2.15672e+00 7.90074e+01 0.000   1.46630e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.04404e+01 0.000   4.85669e+01 180.000 0.8989 
1 1 1 -18 0   5  o 12 5.08580e+00 2.90915e+00 5.63556e+01 180.000 -1.11666e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.00954e+02 180.000 4.45985e+01 180.000 0.8064 
1 1 1 -18 0   6  o 10 2.74304e+00 1.94297e+00 1.52195e+01 180.000 -2.74087e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.28876e+01 180.000 2.33188e+00 0.000   0.2674 
1 1 1 -18 0   7  o 13 2.73310e+00 1.94545e+00 7.33120e+01 0.000   1.31434e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.72098e+01 0.000   5.61022e+01 180.000 0.8654 
1 1 1 -18 0   8  o 6  3.66553e+00 2.45351e+00 3.92023e+01 180.000 -7.62878e-01 0.00000e+00  0.00000e+00 0.00000e+00 5.08663e+01 180.000 1.16640e+01 180.000 0.6428 
1 1 1 -18 1   1  o 10 6.66675e+00 1.68446e+00 5.60227e+01 137.293 -2.76642e+00 2.55344e+00  0.00000e+00 0.00000e+00 1.63109e+02 137.293 1.07086e+02 137.293 0.8538 
1 1 1 -18 1   2  o 14 9.40423e+00 1.76299e+00 1.69208e+02 36.741  1.18472e+01  8.84376e+00  0.00000e+00 0.00000e+00 1.80071e+02 36.741  1.08634e+01 36.741  0.9656 
1 1 1 -18 1   3  o 11 5.88205e+00 1.65235e+00 1.22602e+02 241.858 -3.55838e+00 -6.65247e+00 0.00000e+00 0.00000e+00 8.78896e+01 241.858 3.47123e+01 61.858  0.9312 
1 1 1 -18 1   4  o 18 4.35901e+00 1.42324e+00 4.38705e+01 106.814 -6.94253e-01 2.29749e+00  0.00000e+00 0.00000e+00 8.22693e+01 106.814 3.83988e+01 106.814 0.7537 
1 1 1 -18 1   5  o 15 3.50411e+00 1.21931e+00 6.55917e+01 102.646 -6.64764e-01 2.96274e+00  0.00000e+00 0.00000e+00 4.36328e+01 102.646 2.19590e+01 282.646 0.8126 
1 1 1 -18 1   6  o 2  5.28652e+00 1.62192e+00 1.12510e+02 68.157  2.44812e+00  6.10751e+00  0.00000e+00 0.00000e+00 7.39504e+01 68.157  3.85593e+01 248.157 0.9205 
1 1 1 -18 1   7  o 9  4.32360e+00 1.44939e+00 9.77231e+01 241.727 -2.49504e+00 -4.63905e+00 0.00000e+00 0.00000e+00 5.10810e+01 241.727 4.66421e+01 61.727  0.8992 
1 1 1 -18 1   8  o 15 7.09142e+00 1.92730e+00 7.13721e+01 143.520 -3.78039e+00 2.79533e+00  0.00000e+00 0.00000e+00 1.68806e+02 143.520 9.74336e+01 143.520 0.8860 
1 1 1 -18 2   1  o 2  4.06153e+00 1.36144e+00 3.50424e+01 288.749 5.69876e-01  -1.67894e+00 0.00000e+00 0.00000e+00 6.76432e+01 288.749 3.26008e+01 288.749 0.6567 
1 1 1 -18 2   2  f 0  5.90931e+00 1.68312e+00 1.33613e+02 115.962 -3.37726e+00 6.93617e+00  0.00000e+00 0.00000e+00 7.84002e+01 115.962 5.52124e+01 295.962 0.9327 
1 1 1 -18 2   3  o 14 1.12939e+01 1.69623e+00 2.17866e+02 263.694 -2.74599e+00 -2.48504e+01 0.00000e+00 0.00000e+00 2.07402e+02 263.694 1.04639e+01 83.694  0.9798 
1 1 1 -18 2   4  o 9  1.13767e+01 1.67841e+00 1.88205e+02 87.399  1.02426e+00  2.25450e+01  0.00000e+00 0.00000e+00 2.38814e+02 87.399  5.06090e+01 87.399  0.9776 
1 1 1 -18 2   5  o 4  5.55033e+00 1.58891e+00 8.19260e+01 47.132  3.23563e+00  3.48591e+00  0.00000e+00 0.00000e+00 1.06995e+02 47.132  2.50695e+01 47.132  0.8874 
1 1 1 -18 2   6  o 6  4.54392e+00 1.49303e+00 1.36232e+02 65.700  3.08006e+00  6.82152e+00  0.00000e+00 0.00000e+00 2.57861e+01 65.700  1.10446e+02 245.700 0.9306 
1 1 1 -18 2   7  o 17 4.17499e+00 1.41356e+00 8.32579e+01 318.937 3.34914e+00  -2.91789e+00 0.00000e+00 0.00000e+00 5.71332e+01 318.937 2.61247e+01 138.937 0.8786 
1 1 1 -18 2   8  o 7  6.48334e+00 1.85205e+00 1.24810e+02 159.205 -7.48683e+00 2.84317e+00  0.00000e+00 0.00000e+00 1.07000e+02 159.205 1.78107e+01 339.205 0.9353 
1 1 1 -18 3   1  o 2  5.27840e+00 1.56180e+00 1.20683e+02 155.920 -6.35236e+00 2.83892e+00  0.00000e+00 0.00000e+00 6.72875e+01 155.920 5.33955e+01 335.920 0.9251 
1 1 1 -18 3   2  o 2  6.65689e+00 1.67544e+00 1.64201e+02 16.763  1.02754e+01  3.09515e+00  0.00000e+00 0.00000e+00 7.96156e+01 16.763  8.45858e+01 196.763 0.9522 
1 1 1 -18 3   3  o 3  4.71271e+00 1.49660e+00 6.93026e+01 355.827 3.77999e+00  -2.75779e-01 0.00000e+00 0.00000e+00 8.55379e+01 355.827 1.62353e+01 355.827 0.8549 
1 1 1 -18 3   4  o 10 5.44376e+00 1.54196e+00 3.97905e+01 157.155 -2.30926e+00 9.72849e-01  0.00000e+00 0.00000e+00 1.20235e+02 157.155 8.04448e+01 157.155 0.7656 
1 1 1 -18 3   5  o 14 1.48518e+01 1.49585e+00 3.10834e+02 10.702  5.03405e+01  9.51376e+00  0.00000e+00 0.00000e+00 2.53243e+02 10.702  5.75912e+01 190.702 0.9902 
1 1 1 -18 3   6  o 13 5.55227e+00 1.65262e+00 1.38187e+02 80.315  1.39804e+00  8.19148e+00  0.00000e+00 0.00000e+00 6.13091e+01 80.315  7.68777e+01 260.315 0.9377 
1 1 1 -18 3   7  o 6  7.72302e+00 1.94158e+00 1.52306e+02 217.545 -8.31491e+00 -6.39072e+00 0.00000e+00 0.00000e+00 1.28809e+02 217.545 2.34970e+01 37.545  0.9511 
1 1 1 -18 3   8  o 9  6.77238e+00 1.67897e+00 1.24233e+02 349.027 9.24263e+00  -1.79213e+00 0.00000e+00 0.00000e+00 1.20496e+02 349.027 3.73695e+00 169.027 0.9453 
1 1 1 -18 4   1  o 16 6.20646e+00 1.71725e+00 1.06505e+02 96.883  -7.57538e-01 6.27528e+00  0.00000e+00 0.00000e+00 1.12605e+02 96.883  6.10031e+00 96.883  0.9171 
1 1 1 -18 4   2  o 8  4.30215e+00 1.40026e+00 5.90629e+01 345.793 2.87797e+00  -7.28597e-01 0.00000e+00 0.00000e+00 7.45867e+01 345.793 1.55237e+01 345.793 0.8076 
1 1 1 -18 4   3  o 2  4.45874e+00 1.45096e+00 1.04462e+02 255.386 -1.40574e+00 -5.39119e+00 0.00000e+00 0.00000e+00 5.06359e+01 255.386 5.38260e+01 75.386  0.9051 
1 1 1 -18 4   4  o 8  8.82358e+00 1.75002e+00 1.40185e+02 121.477 -6.48463e+00 1.05917e+01  0.00000e+00 0.00000e+00 1.84652e+02 121.477 4.44672e+01 121.477 0.9589 
1 1 1 -18 4   5  o 18 6.84992e+00 1.80033e+00 1.20663e+02 77.217  1.67210e+00  7.36994e+00  0.00000e+00 0.00000e+00 1.24017e+02 77.217  3.35389e+00 77.217  0.9313 
1 1 1 -18 4   6  o 14 9.53813e+00 1.90173e+00 1.89090e+02 61.749  7.81050e+00  1.45355e+01  0.00000e+00 0.00000e+00 1.65115e+02 61.749  2.39752e+01 241.749 0.9692 
1 1 1 -18 4   7  o 15 6.66571e+00 1.85959e+00 1.84839e+02 279.274 1.86951e+00  -1.14489e+01 0.00000e+00 0.00000e+00 5.90177e+01 279.274 1.25821e+02 99.274  0.9559 
1 1 1 -18 4   8  o 3  6.30576e+00 1.83823e+00 1.12811e+02 43.032  5.19565e+00  4.85053e+00  0.00000e+00 0.00000e+00 1.10576e+02 43.032  2.23524e+00 223.032 0.9267 
1 1 1 -18 5   1  o 13 5.61652e+00 1.58610e+00 8.15827e+01 264.147 -4.85453e-01 -4.73568e+00 0.00000e+00 0.00000e+00 1.10307e+02 264.147 2.87244e+01 264.147 0.8875 
1 1 1 -18 5   2  o 1  4.75902e+00 1.49686e+00 7.87810e+01 291.118 1.48460e+00  -3.84386e+00 0.00000e+00 0.00000e+00 8.01075e+01 291.118 1.32649e+00 291.118 0.8680 
1 1 1 -18 5   3  o 11 7.06883e+00 1.85249e+00 1.64922e+02 348.476 1.04703e+01  -2.13475e+00 0.00000e+00 0.00000e+00 9.36931e+01 348.476 7.12286e+01 168.476 0.9520 
1 1 1 -18 5   4  o 14 4.74577e+00 1.51969e+00 8.49678e+01 282.033 9.87224e-01  -4.63153e+00 0.00000e+00 0.00000e+00 7.66278e+01 282.033 8.34001e+00 102.033 0.8869 
1 1 1 -18 5   5  o 18 6.54303e+00 1.77917e+00 1.15455e+02 97.932  -9.65857e-01 6.93209e+00  0.00000e+00 0.00000e+00 1.16816e+02 97.932  1.36135e+00 97.932  0.9255 
1 1 1 -18 5   6  o 14 4.94840e+00 1.53222e+00 8.42734e+01 8.268   4.85500e+00  7.05502e-01  0.00000e+00 0.00000e+00 8.46877e+01 8.268   4.14234e-01 8.268   0.8912 
1 1 1 -18 5   7  o 4  3.65961e+00 1.26090e+00 3.13587e+01 293.596 6.51850e-01  -1.49228e+00 0.00000e+00 0.00000e+00 5.63635e+01 293.596 2.50048e+01 293.596 0.6263 
1 1 1 -18 5   8  o 4  4.51381e+00 1.48219e+00 4.49595e+01 336.012 2.39261e+00  -1.06465e+00 0.00000e+00 0.00000e+00 8.91661e+01 336.012 4.42066e+01 336.012 0.7773 
1 1 1 -18 6   1  o 16 5.21806e+00 1.59056e+00 4.50322e+01 7.186   2.41483e+00  3.04453e-01  0.00000e+00 0.00000e+00 1.07148e+02 7.186   6.21162e+01 7.186   0.7576 
1 1 1 -18 6   2  o 6  9.08506e+00 1.74204e+00 1.28532e+02 142.925 -8.76637e+00 6.62395e+00  0.00000e+00 0.00000e+00 2.04607e+02 142.925 7.60745e+01 142.925 0.9533 
1 1 1 -18 6   3  o 8  5.44599e+00 1.59638e+00 7.78009e+01 44.438  3.28328e+00  3.21945e+00  0.00000e+00 0.00000e+00 1.07031e+02 44.438  2.92304e+01 44.438  0.8832 
1 1 1 -18 6   4  o 2  4.75909e+00 1.50602e+00 3.47477e+01 327.337 1.58866e+00  -1.01845e+00 0.00000e+00 0.00000e+00 8.91956e+01 327.337 5.44480e+01 327.337 0.6783 
1 1 1 -18 6   5  o 8  1.03087e+01 1.85740e+00 1.95939e+02 108.759 -5.72770e+00 1.68647e+01  0.00000e+00 0.00000e+00 1.88186e+02 108.759 7.75237e+00 288.759 0.9715 
1 1 1 -18 6   6  o 2  8.80143e+00 1.92646e+00 1.72847e+02 336.984 1.25989e+01  -5.35208e+00 0.00000e+00 0.00000e+00 1.51813e+02 336.984 2.10345e+01 156.984 0.9628 
1 1 1 -18 6   7  o 2  6.67294e+00 1.81783e+00 1.83301e+02 267.202 -5.77986e-01 -1.18267e+01 0.00000e+00 0.00000e+00 6.10475e+01 267.202 1.22254e+02 87.202  0.9568 
1 1 1 -18 6   8  o 10 5.58760e+00 1.72168e+00 3.33537e+01 181.850 -2.02090e+00 -6.52835e-02 0.00000e+00 0.00000e+00 1.16449e+02 181.850 8.30950e+01 181.850 0.7013 
1 1 1 -18 7   1  o 5  3.88219e+00 1.31239e+00 4.45272e+01 45.932  1.48390e+00  1.53298e+00  0.00000e+00 0.00000e+00 6.28506e+01 45.932  1.83233e+01 45.932  0.7185 
1 1 1 -18 7   2  f 0  7.64770e+00 1.86379e+00 2.10033e+02 270.809 1.97733e-01  -1.39977e+01 0.00000e+00 0.00000e+00 7.34091e+01 270.809 1.36623e+02 90.809  0.9636 
1 1 1 -18 7   3  o 5  4.37073e+00 1.44418e+00 4.18658e+01 28.657  1.92832e+00  1.05386e+00  0.00000e+00 0.00000e+00 8.03577e+01 28.657  3.84919e+01 28.657  0.7277 
1 1 1 -18 7   4  o 15 6.25039e+00 1.73358e+00 3.98115e+01 140.768 -1.89341e+00 1.54599e+00  0.00000e+00 0.00000e+00 1.42280e+02 140.768 1.02469e+02 140.768 0.7588 
1 1 1 -18 7   5  o 10 5.24322e+00 1.61698e+00 4.86676e+01 285.400 6.95635e-01  -2.52552e+00 0.00000e+00 0.00000e+00 1.07668e+02 285.400 5.90007e+01 285.400 0.7774 
1 1 1 -18 7   6  o 13 4.85505e+00 1.54487e+00 1.57332e+01 244.105 -3.88908e-01 -8.01115e-01 0.00000e+00 0.00000e+00 5.98369e+01 244.105 4.41036e+01 244.105 0.4063 
1 1 1 -18 7   7  o 5  4.49084e+00 1.48667e+00 1.24815e+02 203.620 -6.23412e+00 -2.72615e+00 0.00000e+00 0.00000e+00 3.38667e+01 203.620 9.09481e+01 23.620  0.9233 
1 1 1 -18 7   8  o 3  4.91397e+00 1.57912e+00 1.18065e+02 166.161 -6.77137e+00 1.66808e+00  0.00000e+00 0.00000e+00 5.57306e+01 166.161 6.23344e+01 346.161 0.9252 
1 1 1 -18 8   1  o 3  7.30887e+00 1.68564e+00 1.27962e+02 248.874 -3.28602e+00 -8.50423e+00 0.00000e+00 0.00000e+00 1.37471e+02 248.874 9.50972e+00 248.874 0.9435 
1 1 1 -18 8   2  o 18 1.54128e+01 1.41104e+00 2.38363e+02 84.002  4.45103e+00  4.23617e+01  0.00000e+00 0.00000e+00 3.47442e+02 84.002  1.09079e+02 84.002  0.9882 
1 1 1 -18 8   3  o 15 5.33802e+00 1.59472e+00 4.65808e+01 223.413 -1.96160e+00 -1.85584e+00 0.00000e+00 0.00000e+00 1.14475e+02 223.413 6.78942e+01 223.413 0.7851 
1 1 1 -18 8   4  o 12 1.41726e+01 1.54797e+00 1.79334e+02 301.452 1.47148e+01  -2.40576e+01 0.00000e+00 0.00000e+00 3.55045e+02 301.452 1.75711e+02 301.452 0.9821 
1 1 1 -18 8   5  o 16 1.78651e+01 1.35938e+00 2.45429e+02 134.774 -3.73257e+01 3.76218e+01  0.00000e+00 0.00000e+00 4.33268e+02 134.774 1.87839e+02 134.774 0.9905 
1 1 1 -18 8   6  o 13 6.93238e+00 1.75895e+00 9.98993e+01 323.032 5.30993e+00  -3.99668e+00 0.00000e+00 0.00000e+00 1.44812e+02 323.032 4.49123e+01 323.032 0.9214 
1 1 1 -18 8   7  o 13 7.91688e+00 1.94155e+00 1.97344e+02 196.433 -1.34572e+01 -3.96917e+00 0.00000e+00 0.00000e+00 9.46295e+01 196.433 1.02714e+02 16.433  0.9637 
1 1 1 -18 8   8  o 4  5.52567e+00 1.72362e+00 9.00003e+01 108.799 -1.73573e+00 5.09882e+00  0.00000e+00 0.00000e+00 1.00439e+02 108.799 1.04388e+01 108.799 0.9016 
1 1 1 -18 9   1  o 5  4.55089e+00 1.48016e+00 2.56462e+01 174.222 -1.28892e+00 1.30419e-01  0.00000e+00 0.00000e+00 6.91878e+01 174.222 4.35417e+01 174.222 0.5414 
1 1 1 -18 9   2  o 19 4.69519e+00 1.48869e+00 5.94920e+01 13.650  3.16694e+00  7.69063e-01  0.00000e+00 0.00000e+00 8.99298e+01 13.650  3.04378e+01 13.650  0.8274 
1 1 1 -18 9   3  o 1  6.08913e+00 1.70545e+00 1.03181e+02 325.428 5.21904e+00  -3.59662e+00 0.00000e+00 0.00000e+00 1.11460e+02 325.428 8.27809e+00 325.428 0.9173 
1 1 1 -18 9   4  o 16 5.87742e+00 1.67307e+00 1.00563e+02 334.103 5.43200e+00  -2.63733e+00 0.00000e+00 0.00000e+00 1.05436e+02 334.103 4.87386e+00 334.103 0.9130 
1 1 1 -18 9   5  o 11 4.47595e+00 1.44117e+00 5.69342e+01 264.919 -2.75762e-01 -3.10164e+00 0.00000e+00 0.00000e+00 8.34985e+01 264.919 2.65643e+01 264.919 0.8181 
1 1 1 -18 9   6  o 17 4.04829e+00 1.33724e+00 1.15925e+02 80.057  1.02287e+00  5.83506e+00  0.00000e+00 0.00000e+00 2.53947e+01 80.057  9.05302e+01 260.057 0.9112 
1 1 1 -18 9   7  o 11 8.42638e+00 1.83917e+00 1.48745e+02 144.144 -9.77047e+00 7.06130e+00  0.00000e+00 0.00000e+00 1.60045e+02 144.144 1.12998e+01 144.144 0.9576 
1 1 1 -18 9   8  o 2  5.70721e+00 1.67212e+00 8.55825e+01 59.731  2.76605e+00  4.73945e+00  0.00000e+00 0.00000e+00 1.11535e+02 59.731  2.59527e+01 59.731  0.9036 
1 1 1 -18 10  1  o 7  4.82951e+00 1.52533e+00 1.36830e+02 252.961 -2.20448e+00 -7.19292e+00 0.00000e+00 0.00000e+00 3.62276e+01 252.961 1.00603e+02 72.961  0.9309 
1 1 1 -18 10  2  o 4  4.74424e+00 1.49238e+00 1.16952e+02 356.895 6.44616e+00  -3.49659e-01 0.00000e+00 0.00000e+00 5.07138e+01 356.895 6.62385e+01 176.895 0.9189 
1 1 1 -18 10  3  o 18 5.01325e+00 1.52853e+00 2.95014e+01 291.238 6.25856e-01  -1.61039e+00 0.00000e+00 0.00000e+00 9.52525e+01 291.238 6.57510e+01 291.238 0.6476 
1 1 1 -18 10  4  o 16 5.87279e+00 1.69541e+00 8.13183e+01 173.997 -4.78056e+00 5.02720e-01  0.00000e+00 0.00000e+00 1.19046e+02 173.997 3.77281e+01 173.997 0.8887 
1 1 1 -18 10  5  o 6  7.18884e+00 1.81303e+00 8.14994e+01 348.143 5.45722e+00  -1.14575e+00 0.00000e+00 0.00000e+00 1.68076e+02 348.143 8.65763e+01 348.143 0.9052 
1 1 1 -18 10  6  o 5  7.79844e+00 1.73080e+00 1.76375e+02 216.085 -1.08572e+01 -7.91277e+00 0.00000e+00 0.00000e+00 1.11048e+02 216.085 6.53266e+01 36.085  0.9620 
1 1 1 -18 10  7  o 6  6.81057e+00 1.80071e+00 7.88552e+01 57.781  2.82603e+00  4.48440e+00  0.00000e+00 0.00000e+00 1.55687e+02 57.781  7.68321e+01 57.781  0.8999 
1 1 1 -18 10  8  o 18 4.48965e+00 1.48122e+00 6.44498e+01 176.555 -3.84952e+00 2.31740e-01  0.00000e+00 0.00000e+00 8.27491e+01 176.555 1.82993e+01 176.555 0.8578 
1 1 1 -18 11  1  o 4  7.95361e+00 1.89979e+00 2.00327e+02 14.218  1.37227e+01  3.47701e+00  0.00000e+00 0.00000e+00 9.47905e+01 14.218  1.05537e+02 194.218 0.9640 
1 1 1 -18 11  2  o 9  8.41028e+00 1.86025e+00 1.11962e+02 317.388 6.31759e+00  -5.81174e+00 0.00000e+00 0.00000e+00 1.92019e+02 317.388 8.00566e+01 317.388 0.9398 
1 1 1 -18 11  3  o 11 9.72323e+00 1.83315e+00 1.92928e+02 179.845 -1.78150e+01 4.80371e-02  0.00000e+00 0.00000e+00 1.70045e+02 179.845 2.28831e+01 359.845 0.9715 
1 1 1 -18 11  4  o 2  4.96685e+00 1.57173e+00 6.96723e+01 257.685 -8.17212e-01 -3.74350e+00 0.00000e+00 0.00000e+00 9.36808e+01 257.685 2.40085e+01 257.685 0.8567 
1 1 1 -18 11  5  o 8  6.28310e+00 1.70905e+00 9.34911e+01 168.407 -5.86727e+00 1.20365e+00  0.00000e+00 0.00000e+00 1.26312e+02 168.407 3.28210e+01 168.407 0.9122 
1 1 1 -18 11  6  o 3  6.21525e+00 1.75677e+00 1.03465e+02 303.460 3.40435e+00  -5.15120e+00 0.00000e+00 0.00000e+00 1.14399e+02 303.460 1.09331e+01 303.460 0.9150 
1 1 1 -18 11  7  o 1  5.23999e+00 1.58683e+00 6.77350e+01 44.757  2.88089e+00  2.85659e+00  0.00000e+00 0.00000e+00 1.05850e+02 44.757  3.81149e+01 44.757  0.8657 
1 1 1 -18 11  8  o 5  6.35045e+00 1.70752e+00 2.80445e+01 64.188  8.72816e-01  1.80454e+00  0.00000e+00 0.00000e+00 1.41503e+02 64.188  1.13459e+02 64.188  0.6985 
1 1 1 -18 12  1  o 5  4.10310e+00 1.37516e+00 2.50738e+01 230.731 -8.18926e-01 -1.00164e+00 0.00000e+00 0.00000e+00 6.03439e+01 230.731 3.52700e+01 230.731 0.5409 
1 1 1 -18 12  2  o 14 6.19836e+00 1.72526e+00 1.62334e+02 229.648 -6.48785e+00 -7.63613e+00 0.00000e+00 0.00000e+00 6.38129e+01 229.648 9.85214e+01 49.648  0.9487 
1 1 1 -18 12  3  o 18 6.11761e+00 1.66078e+00 5.26506e+01 88.815  7.10584e-02  3.43495e+00  0.00000e+00 0.00000e+00 1.44255e+02 88.815  9.16039e+01 88.815  0.8377 
1 1 1 -18 12  4  o 13 6.73680e+00 1.78491e+00 1.16049e+02 348.621 7.36400e+00  -1.48205e+00 0.00000e+00 0.00000e+00 1.24675e+02 348.621 8.62618e+00 348.621 0.9308 
1 1 1 -18 12  5  o 13 3.89005e+00 1.31545e+00 5.69858e+01 137.087 -2.15669e+00 2.00502e+00  0.00000e+00 0.00000e+00 6.32266e+01 137.087 6.24077e+00 137.087 0.8058 
1 1 1 -18 12  6  o 16 4.58173e+00 1.48611e+00 4.44159e+01 354.467 2.41045e+00  -2.33514e-01 0.00000e+00 0.00000e+00 8.83138e+01 354.467 4.38979e+01 354.467 0.7562 
1 1 1 -18 12  7  o 10 4.17045e+00 1.39978e+00 4.37271e+01 94.154  -1.71937e-01 2.36739e+00  0.00000e+00 0.00000e+00 7.60451e+01 94.154  3.23180e+01 94.154  0.7505 
1 1 1 -18 12  8  o 10 6.06784e+00 1.77127e+00 1.24283e+02 234.085 -4.75090e+00 -6.55944e+00 0.00000e+00 0.00000e+00 9.28046e+01 234.085 3.14780e+01 54.085  0.9361 
1 1 1 -18 13  1  o 11 4.76231e+00 1.50061e+00 6.99970e+01 262.576 -4.97957e-01 -3.82159e+00 0.00000e+00 0.00000e+00 8.72041e+01 262.576 1.72070e+01 262.576 0.8577 
1 1 1 -18 13  2  o 18 7.77903e+00 1.71397e+00 1.53905e+02 288.720 3.95495e+00  -1.16707e+01 0.00000e+00 0.00000e+00 1.32840e+02 288.720 2.10640e+01 108.720 0.9585 
1 1 1 -18 13  3  o 8  4.10391e+00 1.37399e+00 1.06291e+02 93.372  -3.19494e-01 5.42193e+00  0.00000e+00 0.00000e+00 3.60193e+01 93.372  7.02716e+01 273.372 0.9025 
1 1 1 -18 13  4  o 18 5.00039e+00 1.56813e+00 3.97643e+01 265.574 -1.70194e-01 -2.19883e+00 0.00000e+00 0.00000e+00 1.00123e+02 265.574 6.03587e+01 265.574 0.7288 
1 1 1 -18 13  5  f 0  4.88817e+00 1.55802e+00 1.15575e+02 228.383 -4.19589e+00 -4.72315e+00 0.00000e+00 0.00000e+00 5.63239e+01 228.383 5.92513e+01 48.383  0.9170 
1 1 1 -18 13  6  f 0  5.62129e+00 1.70074e+00 5.90257e+01 332.474 3.02816e+00  -1.57810e+00 0.00000e+00 0.00000e+00 1.21108e+02 332.474 6.20824e+01 332.474 0.8365 
1 1 1 -18 13  7  o 5  7.41769e+00 1.86476e+00 1.00747e+02 282.867 1.58543e+00  -6.94055e+00 0.00000e+00 0.00000e+00 1.62321e+02 282.867 6.15740e+01 282.867 0.9268 
1 1 1 -18 13  8  f 0  4.10860e+00 1.38545e+00 1.42399e+01 303.300 4.59765e-01  -6.99914e-01 0.00000e+00 0.00000e+00 4.63463e+01 303.300 3.21063e+01 303.300 0.3858 
1 1 1 -18 14  1  f 0  1.42059e+01 1.55874e+00 2.38868e+02 216.840 -3.10710e+01 -2.32775e+01 0.00000e+00 0.00000e+00 3.00776e+02 216.840 6.19082e+01 216.840 0.9870 
1 1 1 -18 14  2  o 2  6.57770e+00 1.75177e+00 8.29464e+01 313.068 3.73683e+00  -3.99774e+00 0.00000e+00 0.00000e+00 1.45537e+02 313.068 6.25905e+01 313.068 0.9033 
1 1 1 -18 14  3  o 11 5.24893e+00 1.55929e+00 1.26113e+02 129.390 -4.62693e+00 5.63494e+00  0.00000e+00 0.00000e+00 6.11670e+01 129.390 6.49461e+01 309.390 0.9286 
1 1 1 -18 14  4  o 5  1.21441e+01 1.65881e+00 2.04032e+02 312.612 1.67856e+01  -1.82466e+01 0.00000e+00 0.00000e+00 2.52620e+02 312.612 4.85882e+01 312.612 0.9796 
1 1 1 -18 14  5  o 11 7.51772e+00 1.81746e+00 7.50629e+01 141.002 -4.12776e+00 3.34230e+00  0.00000e+00 0.00000e+00 1.84427e+02 141.002 1.09364e+02 141.002 0.9001 
1 1 1 -18 14  6  o 2  4.38439e+00 1.43226e+00 9.52991e+01 334.648 4.65606e+00  -2.20608e+00 0.00000e+00 0.00000e+00 5.53165e+01 334.648 3.99827e+01 154.648 0.8968 
1 1 1 -18 14  7  o 6  4.48010e+00 1.47819e+00 9.00450e+01 207.192 -4.46975e+00 -2.29631e+00 0.00000e+00 0.00000e+00 6.31999e+01 207.192 2.68451e+01 27.192  0.8940 
1 1 1 -18 14  8  o 6  5.07825e+00 1.55903e+00 3.79230e+01 183.433 -2.34281e+00 -1.40524e-01 0.00000e+00 0.00000e+00 1.07108e+02 183.433 6.91854e+01 183.433 0.7473 
1 1 1 -18 15  1  o 18 1.28849e+01 1.63717e+00 2.02924e+02 89.581  2.07007e-01  2.83404e+01  0.00000e+00 0.00000e+00 2.84120e+02 89.581  8.11957e+01 89.581  0.9822 
1 1 1 -18 15  2  o 11 7.40981e+00 1.81587e+00 1.46167e+02 162.821 -9.93732e+00 3.07214e+00  0.00000e+00 0.00000e+00 1.24701e+02 162.821 2.14653e+01 342.821 0.9506 
1 1 1 -18 15  3  o 5  4.92590e+00 1.47322e+00 4.45511e+01 169.087 -2.51115e+00 4.84182e-01  0.00000e+00 0.00000e+00 1.01380e+02 169.087 5.68291e+01 169.087 0.7711 
1 1 1 -18 15  4  o 9  5.24583e+00 1.61732e+00 7.31727e+01 251.915 -1.22363e+00 -3.74702e+00 0.00000e+00 0.00000e+00 1.00242e+02 251.915 2.70693e+01 251.915 0.8612 
1 1 1 -18 15  5  o 18 4.88444e+00 1.48181e+00 5.16575e+01 147.349 -2.49792e+00 1.60059e+00  0.00000e+00 0.00000e+00 9.95821e+01 147.349 4.79246e+01 147.349 0.8075 
1 1 1 -18 15  6  o 8  1.46618e+01 1.56969e+00 2.39874e+02 171.082 -3.90217e+01 6.12282e+00  0.00000e+00 0.00000e+00 3.14583e+02 171.082 7.47093e+01 171.082 0.9873 
1 1 1 -18 15  7  f 0  5.36877e+00 1.64802e+00 1.06631e+02 46.011  4.39468e+00  4.55260e+00  0.00000e+00 0.00000e+00 8.17705e+01 46.011  2.48610e+01 226.011 0.9172 
1 1 1 -18 15  8  o 19 6.60585e+00 1.78489e+00 1.12390e+02 280.148 1.35529e+00  -7.57149e+00 0.00000e+00 0.00000e+00 1.23027e+02 280.148 1.06378e+01 280.148 0.9325 
1 1 1 -18 16  1  o 14 6.07139e+00 1.72780e+00 8.62375e+01 143.928 -4.31154e+00 3.14078e+00  0.00000e+00 0.00000e+00 1.24184e+02 143.928 3.79460e+01 143.928 0.9006 
1 1 1 -18 16  2  o 1  5.72385e+00 1.70339e+00 9.41537e+01 27.709  4.78045e+00  2.51078e+00  0.00000e+00 0.00000e+00 1.04346e+02 27.709  1.01923e+01 27.709  0.9019 
1 1 1 -18 16  3  f 0  1.13418e+01 1.74612e+00 1.37931e+02 189.158 -1.52281e+01 -2.45489e+00 0.00000e+00 0.00000e+00 2.83428e+02 189.158 1.45497e+02 189.158 0.9670 
1 1 1 -18 16  4  o 2  4.94565e+00 1.56365e+00 1.52045e+02 6.785   7.93016e+00  9.43445e-01  0.00000e+00 0.00000e+00 2.54623e+01 6.785   1.26583e+02 186.785 0.9351 
1 1 1 -18 16  5  o 19 7.71683e+00 1.83162e+00 7.27008e+01 41.278  4.04354e+00  3.54964e+00  0.00000e+00 0.00000e+00 1.94050e+02 41.278  1.21349e+02 41.278  0.9015 
1 1 1 -18 16  6  o 13 4.08462e+00 1.38026e+00 9.63749e+01 43.669  3.68481e+00  3.51750e+00  0.00000e+00 0.00000e+00 4.37317e+01 43.669  5.26432e+01 223.669 0.8955 
1 1 1 -18 16  7  o 4  4.15722e+00 1.39491e+00 6.29945e+01 352.461 3.53898e+00  -4.68333e-01 0.00000e+00 0.00000e+00 7.13540e+01 352.461 8.35951e+00 352.461 0.8447 
1 1 1 -18 16  8  o 5  1.10768e+01 1.85558e+00 1.56417e+02 228.462 -1.13218e+01 -1.27801e+01 0.00000e+00 0.00000e+00 2.54288e+02 228.462 9.78717e+01 228.462 0.9703 
1 1 1 -18 17  1  o 15 1.04334e+01 1.68719e+00 1.79953e+02 64.405  8.21138e+00  1.71420e+01  0.00000e+00 0.00000e+00 2.10830e+02 64.405  3.08775e+01 64.405  0.9733 
1 1 1 -18 17  2  o 13 4.26724e+00 1.40710e+00 5.83314e+01 160.167 -2.85102e+00 1.02830e+00  0.00000e+00 0.00000e+00 7.49365e+01 160.167 1.66051e+01 160.167 0.8122 
1 1 1 -18 17  3  o 17 5.96502e+00 1.70035e+00 5.53668e+01 117.184 -1.53285e+00 2.98459e+00  0.00000e+00 0.00000e+00 1.35557e+02 117.184 8.01897e+01 117.184 0.8332 
1 1 1 -18 17  4  o 9  6.10135e+00 1.70113e+00 5.18637e+01 129.627 -2.06965e+00 2.49934e+00  0.00000e+00 0.00000e+00 1.41699e+02 129.627 8.98349e+01 129.627 0.8266 
1 1 1 -18 17  5  o 5  5.21950e+00 1.61919e+00 5.00061e+01 123.307 -1.58803e+00 2.41693e+00  0.00000e+00 0.00000e+00 1.10428e+02 123.307 6.04217e+01 123.307 0.8017 
1 1 1 -18 17  6  o 13 5.20402e+00 1.62418e+00 6.12914e+01 141.980 -2.75050e+00 2.15048e+00  0.00000e+00 0.00000e+00 1.06267e+02 141.980 4.49758e+01 141.980 0.8407 
1 1 1 -18 17  7  o 8  6.42906e+00 1.77231e+00 3.89756e+01 247.906 -9.79059e-01 -2.41187e+00 0.00000e+00 0.00000e+00 1.51831e+02 247.906 1.12856e+02 247.906 0.7758 
1 1 1 -18 17  8  o 10 6.34211e+00 1.82092e+00 7.41758e+01 0.544   4.73266e+00  4.49051e-02  0.00000e+00 0.00000e+00 1.40739e+02 0.544   6.65636e+01 0.544   0.8868 
1 1 1 -18 18  1  o 3  3.47537e+00 1.20871e+00 6.28880e+01 159.452 -2.83600e+00 1.06304e+00  0.00000e+00 0.00000e+00 4.57126e+01 159.452 1.71754e+01 339.452 0.8121 
1 1 1 -18 18  2  f 0  4.92932e+00 1.51136e+00 1.07912e+02 222.851 -4.43038e+00 -4.10994e+00 0.00000e+00 0.00000e+00 6.51278e+01 222.851 4.27838e+01 42.851  0.9130 
1 1 1 -18 18  3  o 7  5.89523e+00 1.71031e+00 9.27846e+01 85.756  4.08327e-01  5.50269e+00  0.00000e+00 0.00000e+00 1.11971e+02 85.756  1.91864e+01 85.756  0.9042 
1 1 1 -18 18  4  o 12 5.08019e+00 1.56292e+00 2.14287e+01 224.383 -8.75101e-01 -8.56470e-01 0.00000e+00 0.00000e+00 8.00132e+01 224.383 5.85845e+01 224.383 0.5203 
1 1 1 -18 18  5  o 15 4.51604e+00 1.45548e+00 3.10946e+01 203.423 -1.59778e+00 -6.92199e-01 0.00000e+00 0.00000e+00 8.15139e+01 203.423 5.04194e+01 203.423 0.6504 
1 1 1 -18 18  6  o 7  5.28519e+00 1.63795e+00 1.55448e+02 241.162 -4.33823e+00 -7.87876e+00 0.00000e+00 0.00000e+00 3.53630e+01 241.162 1.20085e+02 61.162  0.9427 
1 1 1 -18 18  7  o 16 3.94179e+00 1.34833e+00 7.64031e+01 23.455  3.87450e+00  1.68106e+00  0.00000e+00 0.00000e+00 5.50319e+01 23.455  2.13712e+01 203.455 0.8716 
1 1 1 -18 18  8  f 0  4.17832e+00 1.41393e+00 1.09152e+02 157.221 -5.66049e+00 2.37701e+00  0.00000e+00 0.00000e+00 3.68506e+01 157.221 7.23015e+01 337.221 0.9145 
1 1 1 -18 19  1  o 5  7.53574e+00 1.70200e+00 1.17366e+02 27.577  7.95643e+00  4.15552e+00  0.00000e+00 0.00000e+00 1.55929e+02 27.577  3.85629e+01 27.577  0.9425 
1 1 1 -18 19  2  o 6  5.54820e+00 1.50437e+00 1.30744e+02 253.391 -2.40091e+00 -8.04923e+00 0.00000e+00 0.00000e+00 6.94311e+01 253.391 6.13132e+01 73.391  0.9384 
1 1 1 -18 19  3  o 7  6.17362e+00 1.75428e+00 1.19988e+02 52.912  4.20469e+00  5.56206e+00  0.00000e+00 0.00000e+00 9.94235e+01 52.912  2.05641e+01 232.912 0.9252 
1 1 1 -18 19  4  f 0  5.07734e+00 1.59086e+00 1.54176e+02 87.980  3.04330e-01  8.63044e+00  0.00000e+00 0.00000e+00 2.90185e+01 87.980  1.25158e+02 267.980 0.9402 
1 1 1 -18 19  5  o 11 4.24332e+00 1.37925e+00 3.70291e+01 237.979 -1.02330e+00 -1.63628e+00 0.00000e+00 0.00000e+00 7.45569e+01 237.979 3.75278e+01 237.979 0.6859 
1 1 1 -18 19  6  o 2  5.50431e+00 1.67886e+00 5.10620e+01 202.945 -2.75347e+00 -1.16568e+00 0.00000e+00 0.00000e+00 1.19528e+02 202.945 6.84657e+01 202.945 0.8092 
1 1 1 -18 19  7  o 15 5.45665e+00 1.62789e+00 1.54349e+02 312.733 6.54902e+00  -7.08893e+00 0.00000e+00 0.00000e+00 4.32621e+01 312.733 1.11087e+02 132.733 0.9467 
1 1 1 -18 19  8  o 10 5.42464e+00 1.67753e+00 1.27471e+02 226.588 -5.50912e+00 -5.82338e+00 0.00000e+00 0.00000e+00 6.64039e+01 226.588 6.10674e+01 46.588  0.9354 
1 1 1 -18 20  1  o 1  4.90894e+00 1.52973e+00 7.91988e+01 76.833  1.00785e+00  4.30815e+00  0.00000e+00 0.00000e+00 8.66456e+01 76.833  7.44671e+00 76.833  0.8781 
1 1 1 -18 20  2  o 8  4.54989e+00 1.48052e+00 8.54729e+01 349.873 4.50167e+00  -8.04096e-01 0.00000e+00 0.00000e+00 6.88798e+01 349.873 1.65931e+01 169.873 0.8824 
1 1 1 -18 20  3  o 13 7.47795e+00 1.72786e+00 1.20206e+02 174.686 -8.56156e+00 7.96409e-01  0.00000e+00 0.00000e+00 1.49766e+02 174.686 2.95604e+01 174.686 0.9399 
1 1 1 -18 20  4  o 6  6.37570e+00 1.77281e+00 7.69663e+01 203.143 -4.37305e+00 -1.86918e+00 0.00000e+00 0.00000e+00 1.40146e+02 203.143 6.31798e+01 203.143 0.8874 
1 1 1 -18 20  5  o 7  1.10436e+01 1.72340e+00 1.90526e+02 48.055  1.37954e+01  1.53511e+01  0.00000e+00 0.00000e+00 2.22452e+02 48.055  3.19263e+01 48.055  0.9755 
1 1 1 -18 20  6  o 9  8.50101e+00 1.78332e+00 1.62476e+02 180.155 -1.37990e+01 -3.72982e-02 0.00000e+00 0.00000e+00 1.51045e+02 180.155 1.14312e+01 0.155   0.9631 
1 1 1 -18 20  7  o 10 4.83123e+00 1.52773e+00 9.47310e+01 14.923  5.44146e+00  1.45023e+00  0.00000e+00 0.00000e+00 7.27441e+01 14.923  2.19869e+01 194.923 0.9062 
1 1 1 -18 20  8  o 6  5.87790e+00 1.75098e+00 1.22485e+02 102.894 -1.76330e+00 7.70289e+00  0.00000e+00 0.00000e+00 8.73598e+01 102.894 3.51252e+01 282.894 0.9344 
1 1 1 -18 21  1  o 12 6.82234e+00 1.77295e+00 7.74418e+01 280.870 9.26848e-01  -4.82665e+00 0.00000e+00 0.00000e+00 1.56524e+02 280.870 7.90820e+01 280.870 0.8914 
1 1 1 -18 21  2  o 2  7.48543e+00 1.79462e+00 1.42411e+02 160.426 -9.21455e+00 3.27652e+00  0.00000e+00 0.00000e+00 1.30209e+02 160.426 1.22019e+01 340.426 0.9474 
1 1 1 -18 21  3  o 18 4.67772e+00 1.48854e+00 6.06016e+01 330.914 2.93120e+00  -1.63052e+00 0.00000e+00 0.00000e+00 8.90770e+01 330.914 2.84753e+01 330.914 0.8331 
1 1 1 -18 21  4  o 18 6.65661e+00 1.70459e+00 7.25610e+01 203.643 -4.48385e+00 -1.96299e+00 0.00000e+00 0.00000e+00 1.54996e+02 203.643 8.24349e+01 203.643 0.8909 
1 1 1 -18 21  5  o 5  3.89753e+00 1.31895e+00 5.46379e+01 236.152 -1.57975e+00 -2.35554e+00 0.00000e+00 0.00000e+00 6.44559e+01 236.152 9.81804e+00 236.152 0.7971 
1 1 1 -18 21  6  o 11 1.39838e+01 1.59966e+00 2.10306e+02 34.695  2.73977e+01  1.89674e+01  0.00000e+00 0.00000e+00 3.17081e+02 34.695  1.06775e+02 34.695  0.9849 
1 1 1 -18 21  7  o 16 3.99936e+00 1.35322e+00 9.56649e+01 191.275 -5.32021e+00 -1.06068e+00 0.00000e+00 0.00000e+00 4.23786e+01 191.275 5.32863e+01 11.275  0.9024 
1 1 1 -18 21  8  o 11 6.81405e+00 1.83234e+00 1.06473e+02 195.886 -7.18671e+00 -2.04527e+00 0.00000e+00 0.00000e+00 1.35752e+02 195.886 2.92783e+01 195.886 0.9305 
1 1 1 -18 22  1  o 19 4.51503e+00 1.44559e+00 5.86314e+01 68.354  1.11845e+00  2.81830e+00  0.00000e+00 0.00000e+00 8.24693e+01 68.354  2.38380e+01 68.354  0.8123 
1 1 1 -18 22  2  o 14 4.13109e+00 1.37291e+00 1.09763e+02 202.881 -5.00894e+00 -2.11389e+00 0.00000e+00 0.00000e+00 3.35704e+01 202.881 7.61921e+01 22.881  0.9026 
1 1 1 -18 22  3  o 19 7.92705e+00 1.86651e+00 1.75975e+02 98.593  -1.91346e+00 1.26629e+01  0.00000e+00 0.00000e+00 1.16332e+02 98.593  5.96437e+01 278.593 0.9601 
1 1 1 -18 22  4  o 10 4.75594e+00 1.48929e+00 1.39921e+02 63.630  3.58275e+00  7.22677e+00  0.00000e+00 0.00000e+00 3.08464e+01 63.630  1.09074e+02 243.630 0.9358 
1 1 1 -18 22  5  o 16 5.62511e+00 1.64851e+00 1.82592e+01 350.715 1.07962e+00  -1.76508e-01 0.00000e+00 0.00000e+00 8.49558e+01 350.715 6.66966e+01 350.715 0.4787 
1 1 1 -18 22  6  f 0  5.47123e+00 1.63365e+00 1.44120e+02 152.670 -7.82798e+00 4.04543e+00  0.00000e+00 0.00000e+00 5.31057e+01 152.670 9.10142e+01 332.670 0.9414 
1 1 1 -18 22  7  o 18 5.88492e+00 1.73035e+00 9.14662e+01 14.475  5.61527e+00  1.44956e+00  0.00000e+00 0.00000e+00 1.13165e+02 14.475  2.16983e+01 14.475  0.9091 
1 1 1 -18 22  8  o 3  4.37212e+00 1.45086e+00 1.52269e+01 74.222  2.47237e-01  8.75015e-01  0.00000e+00 0.00000e+00 5.38085e+01 74.222  3.85817e+01 74.222  0.4133 
1 1 1 -18 23  1  o 6  5.81805e+00 1.65264e+00 5.98437e+01 151.077 -3.22754e+00 1.78342e+00  0.00000e+00 0.00000e+00 1.30471e+02 151.077 7.06275e+01 151.077 0.8503 
1 1 1 -18 23  2  f 0  8.65837e+00 1.81911e+00 1.19004e+02 340.014 9.17495e+00  -3.33680e+00 0.00000e+00 0.00000e+00 1.96266e+02 340.014 7.72621e+01 340.014 0.9473 
1 1 1 -18 23  3  o 18 4.78787e+00 1.51040e+00 7.94639e+01 76.929  9.93196e-01  4.27773e+00  0.00000e+00 0.00000e+00 8.18011e+01 76.929  2.33716e+00 76.929  0.8771 
1 1 1 -18 23  4  o 4  6.55725e+00 1.75108e+00 2.88765e+01 295.602 8.27933e-01  -1.72787e+00 0.00000e+00 0.00000e+00 1.43078e+02 295.602 1.14201e+02 295.602 0.6835 
1 1 1 -18 23  5  o 5  4.99585e+00 1.57378e+00 9.79319e+01 269.768 -2.24668e-02 -5.54501e+00 0.00000e+00 0.00000e+00 7.52976e+01 269.768 2.26343e+01 89.768  0.9047 
1 1 1 -18 23  6  o 17 6.53632e+00 1.78527e+00 9.06649e+01 13.567  5.79171e+00  1.39762e+00  0.00000e+00 0.00000e+00 1.37503e+02 13.567  4.68376e+01 13.567  0.9117 
1 1 1 -18 23  7  o 4  4.40845e+00 1.45056e+00 6.44085e+01 254.661 -1.02390e+00 -3.73289e+00 0.00000e+00 0.00000e+00 8.03145e+01 254.661 1.59060e+01 254.661 0.8584 
1 1 1 -18 24  1  o 16 6.34462e+00 1.75985e+00 9.65461e+01 166.462 -5.86614e+00 1.41241e+00  0.00000e+00 0.00000e+00 1.26246e+02 166.462 2.97000e+01 166.462 0.9129 
1 1 1 -18 24  2  o 7  5.99426e+00 1.66764e+00 6.01561e+01 34.668  3.10696e+00  2.14879e+00  0.00000e+00 0.00000e+00 1.36686e+02 34.668  7.65300e+01 34.668  0.8544 
1 1 1 -18 24  3  o 13 5.08789e+00 1.53427e+00 6.26226e+01 315.876 2.59642e+00  -2.51824e+00 0.00000e+00 0.00000e+00 1.02863e+02 315.876 4.02404e+01 315.876 0.8470 
1 1 1 -18 24  4  o 4  5.42303e+00 1.63722e+00 6.64429e+01 63.443  1.67197e+00  3.34511e+00  0.00000e+00 0.00000e+00 1.10967e+02 63.443  4.45246e+01 63.443  0.8527 
1 1 1 -18 24  5  f 0  3.63813e+00 1.25333e+00 6.72347e+01 309.366 2.18708e+00  -2.66583e+00 0.00000e+00 0.00000e+00 4.96629e+01 309.366 1.75718e+01 129.366 0.8384 
1 1 1 -18 24  6  o 3  4.28157e+00 1.39760e+00 1.00134e+02 67.882  2.19664e+00  5.40466e+00  0.00000e+00 0.00000e+00 4.89880e+01 67.882  5.11458e+01 247.882 0.9097 
1 1 1 -18 24  7  o 10 5.09191e+00 1.52215e+00 7.14571e+01 294.772 1.90888e+00  -4.13652e+00 0.00000e+00 0.00000e+00 1.00285e+02 294.772 2.88276e+01 294.772 0.8819 
1 1 1 -18 25  1  o 19 1.09512e+01 1.70281e+00 1.74755e+02 242.262 -9.04018e+00 -1.71916e+01 0.00000e+00 0.00000e+00 2.35477e+02 242.262 6.07225e+01 242.262 0.9739 
1 1 1 -18 25  2  o 15 9.17401e+00 1.73347e+00 2.10911e+02 4.300   1.91868e+01  1.44270e+00  0.00000e+00 0.00000e+00 1.32379e+02 4.300   7.85317e+01 184.300 0.9737 
1 1 1 -18 25  3  o 4  1.03587e+01 1.75705e+00 1.14711e+02 175.726 -1.19464e+01 8.92853e-01  0.00000e+00 0.00000e+00 2.66065e+02 175.726 1.51354e+02 175.726 0.9573 
1 1 1 -18 25  4  o 12 4.93489e+00 1.49417e+00 8.05266e+01 37.951  3.70835e+00  2.89222e+00  0.00000e+00 0.00000e+00 8.72066e+01 37.951  6.67995e+00 37.951  0.8860 
1 1 1 -18 25  5  o 13 5.25093e+00 1.58692e+00 1.25702e+02 311.218 4.92859e+00  -5.62624e+00 0.00000e+00 0.00000e+00 6.15551e+01 311.218 6.41468e+01 131.218 0.9305 
1 1 1 -18 25  6  o 10 8.04897e+00 1.84134e+00 8.70036e+01 199.040 -6.55045e+00 -2.26067e+00 0.00000e+00 0.00000e+00 1.97947e+02 199.040 1.10943e+02 199.040 0.9247 
1 1 1 -18 25  7  o 5  4.57777e+00 1.49704e+00 5.24054e+01 212.834 -2.56853e+00 -1.65746e+00 0.00000e+00 0.00000e+00 9.01086e+01 212.834 3.77032e+01 212.834 0.8141 
1 1 1 -18 26  1  o 1  4.88801e+00 1.51069e+00 8.18530e+01 339.949 4.33422e+00  -1.58192e+00 0.00000e+00 0.00000e+00 8.42588e+01 339.949 2.40586e+00 339.949 0.8836 
1 1 1 -18 26  2  o 14 5.97735e+00 1.50314e+00 3.42749e+01 66.771  9.70419e-01  2.26105e+00  0.00000e+00 0.00000e+00 1.40447e+02 66.771  1.06172e+02 66.771  0.7606 
1 1 1 -18 26  3  f 0  4.78365e+00 1.49986e+00 1.39130e+02 176.141 -7.98444e+00 5.38614e-01  0.00000e+00 0.00000e+00 3.26511e+01 176.141 1.06478e+02 356.141 0.9353 
1 1 1 -18 26  4  o 15 6.24565e+00 1.69092e+00 1.48408e+02 24.755  8.71425e+00  4.01830e+00  0.00000e+00 0.00000e+00 7.83240e+01 24.755  7.00842e+01 204.755 0.9464 
1 1 1 -18 26  5  o 10 8.80186e+00 1.77794e+00 1.66462e+02 213.718 -1.22175e+01 -8.15358e+00 0.00000e+00 0.00000e+00 1.59145e+02 213.718 7.31723e+00 33.718  0.9653 
1 1 1 -18 26  6  o 8  5.94617e+00 1.63205e+00 4.35838e+01 196.062 -2.84570e+00 -8.19316e-01 0.00000e+00 0.00000e+00 1.40128e+02 196.062 9.65438e+01 196.062 0.8071 
1 1 1 -18 26  7  o 16 4.44068e+00 1.45015e+00 7.74401e+01 51.428  2.81330e+00  3.52766e+00  0.00000e+00 0.00000e+00 7.21021e+01 51.428  5.33803e+00 231.428 0.8807 
1 1 1 -18 27  1  o 10 4.43055e+00 1.41573e+00 8.71438e+01 282.236 1.04366e+00  -4.81254e+00 0.00000e+00 0.00000e+00 6.47769e+01 282.236 2.23668e+01 102.236 0.8916 
1 1 1 -18 27  2  f 0  4.00089e+00 1.34166e+00 8.75268e+01 253.650 -1.32321e+00 -4.51035e+00 0.00000e+00 0.00000e+00 4.86784e+01 253.650 3.88484e+01 73.650  0.8859 
1 1 1 -18 27  3  o 17 4.85785e+00 1.45346e+00 1.10815e+02 332.067 5.56467e+00  -2.95041e+00 0.00000e+00 0.00000e+00 6.01676e+01 332.067 5.06476e+01 152.067 0.9168 
1 1 1 -18 27  4  o 10 5.36816e+00 1.58643e+00 4.97805e+01 234.112 -1.76021e+00 -2.43274e+00 0.00000e+00 0.00000e+00 1.17043e+02 234.112 6.72623e+01 234.112 0.8102 
1 1 1 -18 27  5  o 14 6.00059e+00 1.62517e+00 1.06545e+02 169.848 -7.00319e+00 1.25396e+00  0.00000e+00 0.00000e+00 1.06556e+02 169.848 1.09079e-02 169.848 0.9268 
1 1 1 -18 27  6  o 3  5.14714e+00 1.56158e+00 1.36242e+02 9.822   8.29784e+00  1.43661e+00  0.00000e+00 0.00000e+00 4.86831e+01 9.822   8.75590e+01 189.822 0.9386 
1 1 1 -18 27  7  o 17 4.82027e+00 1.50676e+00 1.58881e+02 173.489 -9.57330e+00 1.09264e+00  0.00000e+00 0.00000e+00 1.55792e+01 173.489 1.43302e+02 353.489 0.9466 
1 1 1 -18 28  1  f 0  4.60306e+00 1.45970e+00 9.34509e+01 272.596 2.27219e-01  -5.01150e+00 0.00000e+00 0.00000e+00 6.47568e+01 272.596 2.86940e+01 92.596  0.8938 
1 1 1 -18 28  2  o 17 4.71633e+00 1.49377e+00 7.49921e+01 165.127 -3.89741e+00 1.03508e+00  0.00000e+00 0.00000e+00 8.17196e+01 165.127 6.72744e+00 165.127 0.8648 
1 1 1 -18 28  3  o 2  5.21014e+00 1.56320e+00 1.42156e+02 55.772  4.70343e+00  6.91370e+00  0.00000e+00 0.00000e+00 4.54904e+01 55.772  9.66658e+01 235.772 0.9381 
1 1 1 -18 28  4  o 17 3.01608e+00 1.06800e+00 1.60300e+01 241.159 -3.72061e-01 -6.75638e-01 0.00000e+00 0.00000e+00 2.55631e+01 241.159 9.53309e+00 241.159 0.3596 
1 1 1 -18 28  5  o 2  4.03039e+00 1.33143e+00 5.16880e+01 59.892  1.44411e+00  2.49038e+00  0.00000e+00 0.00000e+00 7.19480e+01 59.892  2.02600e+01 59.892  0.8006 
1 1 1 -18 28  6  o 11 5.55210e+00 1.62333e+00 8.95968e+01 161.265 -5.48267e+00 1.85956e+00  0.00000e+00 0.00000e+00 1.03563e+02 161.265 1.39666e+01 161.265 0.9090 
1 1 1 -18 28  7  o 8  5.46971e+00 1.58702e+00 6.91613e+01 237.359 -2.52991e+00 -3.94972e+00 0.00000e+00 0.00000e+00 1.16049e+02 237.359 4.68881e+01 237.359 0.8857 
1 1 1 -18 29  1  o 13 5.89202e+00 1.62839e+00 8.89605e+01 178.813 -5.46711e+00 1.13238e-01  0.00000e+00 0.00000e+00 1.15674e+02 178.813 2.67135e+01 178.813 0.9032 
1 1 1 -18 29  2  o 16 8.09211e+00 1.78894e+00 1.58524e+02 48.533  8.24054e+00  9.32496e+00  0.00000e+00 0.00000e+00 1.39615e+02 48.533  1.89089e+01 228.533 0.9589 
1 1 1 -18 29  3  o 14 3.85945e+00 1.27646e+00 3.23109e+01 308.503 1.06309e+00  -1.33631e+00 0.00000e+00 0.00000e+00 6.30143e+01 308.503 3.07034e+01 308.503 0.6434 
1 1 1 -18 29  4  o 4  1.09953e+01 1.68800e+00 2.13874e+02 241.086 -1.20171e+01 -2.17565e+01 0.00000e+00 0.00000e+00 1.99235e+02 241.086 1.46390e+01 61.086  0.9797 
1 1 1 -18 29  5  o 15 3.72993e+00 1.27112e+00 2.72717e+01 9.749   1.49592e+00  2.57019e-01  0.00000e+00 0.00000e+00 5.85438e+01 9.749   3.12721e+01 9.749   0.6005 
1 1 1 -18 29  6  o 17 4.78361e+00 1.49149e+00 6.11543e+01 107.007 -1.13122e+00 3.69838e+00  0.00000e+00 0.00000e+00 9.59691e+01 107.007 3.48149e+01 107.007 0.8582 
1 1 1 -18 29  7  o 8  8.20953e+00 1.83046e+00 1.19604e+02 30.485  8.72433e+00  5.13585e+00  0.00000e+00 0.00000e+00 1.78311e+02 30.485  5.87071e+01 30.485  0.9492 
1 1 1 -18 30  1  o 9  4.68183e+00 1.47639e+00 7.51954e+01 337.788 3.90150e+00  -1.59313e+00 0.00000e+00 0.00000e+00 8.16465e+01 337.788 6.45107e+00 337.788 0.8713 
1 1 1 -18 30  2  o 2  6.20303e+00 1.62778e+00 1.31064e+02 13.641  8.53298e+00  2.07073e+00  0.00000e+00 0.00000e+00 9.32319e+01 13.641  3.78317e+01 193.641 0.9412 
1 1 1 -18 30  3  o 8  8.08069e+00 1.79396e+00 1.83228e+02 275.865 1.47591e+00  -1.43688e+01 0.00000e+00 0.00000e+00 1.16005e+02 275.865 6.72231e+01 95.865  0.9647 
1 1 1 -18 30  4  o 11 5.95845e+00 1.66528e+00 1.15671e+02 122.712 -4.03305e+00 6.27934e+00  0.00000e+00 0.00000e+00 9.69121e+01 122.712 1.87592e+01 302.712 0.9304 
1 1 1 -18 30  5  o 18 4.92006e+00 1.53670e+00 7.72212e+01 44.605  3.32424e+00  3.27871e+00  0.00000e+00 0.00000e+00 8.96071e+01 44.605  1.23859e+01 44.605  0.8851 
1 1 1 -18 30  6  o 2  3.70334e+00 1.24353e+00 7.39291e+01 70.735  1.43997e+00  4.12000e+00  0.00000e+00 0.00000e+00 5.02495e+01 70.735  2.36795e+01 250.735 0.8762 
1 1 1 -18 30  7  o 12 5.20602e+00 1.61267e+00 1.00143e+02 294.251 2.58879e+00  -5.74669e+00 0.00000e+00 0.00000e+00 8.23102e+01 294.251 1.78327e+01 114.251 0.9168 
1 1 1 -18 31  1  o 6  8.12896e+00 1.79728e+00 1.71951e+02 64.954  5.76088e+00  1.23284e+01  0.00000e+00 0.00000e+00 1.28863e+02 64.954  4.30885e+01 244.954 0.9625 
1 1 1 -18 31  2  o 14 4.69305e+00 1.46863e+00 1.22445e+02 287.225 2.07248e+00  -6.68477e+00 0.00000e+00 0.00000e+00 4.44085e+01 287.225 7.80367e+01 107.225 0.9255 
1 1 1 -18 31  3  o 14 5.14777e+00 1.56582e+00 7.26205e+01 174.466 -4.27880e+00 4.14584e-01  0.00000e+00 0.00000e+00 1.00081e+02 174.466 2.74605e+01 174.466 0.8741 
1 1 1 -18 31  4  o 15 4.21426e+00 1.37703e+00 9.42374e+01 164.844 -5.13208e+00 1.39012e+00  0.00000e+00 0.00000e+00 5.12386e+01 164.844 4.29988e+01 344.844 0.9003 
1 1 1 -18 31  5  o 16 5.28262e+00 1.59324e+00 1.35710e+02 327.436 7.09614e+00  -4.53183e+00 0.00000e+00 0.00000e+00 5.42211e+01 327.436 8.14892e+01 147.436 0.9386 
1 1 1 -18 31  6  o 3  4.47388e+00 1.43998e+00 1.25462e+02 301.455 3.89090e+00  -6.36052e+00 0.00000e+00 0.00000e+00 3.38018e+01 301.455 9.16605e+01 121.455 0.9303 
1 1 1 -18 32  1  o 16 6.10787e+00 1.66882e+00 1.03530e+02 107.260 -1.99073e+00 6.40734e+00  0.00000e+00 0.00000e+00 1.12990e+02 107.260 9.45984e+00 107.260 0.9221 
1 1 1 -18 32  2  o 9  6.30877e+00 1.71613e+00 1.38100e+02 266.089 -6.16263e-01 -9.01520e+00 0.00000e+00 0.00000e+00 9.03980e+01 266.089 4.77016e+01 86.089  0.9429 
1 1 1 -18 32  3  o 13 5.02213e+00 1.48333e+00 5.14809e+01 237.382 -1.71328e+00 -2.67711e+00 0.00000e+00 0.00000e+00 1.07017e+02 237.382 5.55364e+01 237.382 0.8224 
1 1 1 -18 32  4  o 8  3.99273e+00 1.33218e+00 6.75933e+01 357.974 3.72315e+00  -1.31711e-01 0.00000e+00 0.00000e+00 6.28477e+01 357.974 4.74560e+00 177.974 0.8521 
1 1 1 -18 32  5  o 16 4.40318e+00 1.40876e+00 7.10945e+01 271.869 1.39031e-01  -4.26029e+00 0.00000e+00 0.00000e+00 7.61267e+01 271.869 5.03224e+00 271.869 0.8729 
1 1 1 -18 32  6  o 13 3.92625e+00 1.32428e+00 5.98900e+01 127.032 -2.03605e+00 2.69881e+00  0.00000e+00 0.00000e+00 6.54937e+01 127.032 5.60375e+00 127.032 0.8346 
1 1 1 -18 33  1  o 17 6.76393e+00 1.65960e+00 1.60447e+02 50.745  7.39724e+00  9.05205e+00  0.00000e+00 0.00000e+00 8.81714e+01 50.745  7.22752e+01 230.745 0.9562 
1 1 1 -18 33  2  o 6  6.86862e+00 1.68658e+00 1.16908e+02 215.672 -6.89696e+00 -4.95092e+00 0.00000e+00 0.00000e+00 1.30839e+02 215.672 1.39304e+01 215.672 0.9391 
1 1 1 -18 33  3  o 16 6.02378e+00 1.58325e+00 9.55369e+01 1.914   6.58746e+00  2.20148e-01  0.00000e+00 0.00000e+00 1.17281e+02 1.914   2.17441e+01 1.914   0.9207 
1 1 1 -18 33  4  o 8  5.30427e+00 1.54651e+00 1.20541e+02 239.369 -3.97582e+00 -6.71446e+00 0.00000e+00 0.00000e+00 6.92984e+01 239.369 5.12422e+01 59.369  0.9335 
1 1 1 -18 33  5  o 13 4.83046e+00 1.53225e+00 5.82835e+01 151.211 -3.16409e+00 1.73866e+00  0.00000e+00 0.00000e+00 9.83541e+01 151.211 4.00705e+01 151.211 0.8467 
1 1 1 -18 33  6  o 18 7.27846e+00 1.71903e+00 1.10447e+02 279.888 1.55147e+00  -8.90012e+00 0.00000e+00 0.00000e+00 1.52124e+02 279.888 4.16763e+01 279.888 0.9429 
1 1 1 -18 34  1  o 13 5.46970e+00 1.58843e+00 9.07976e+01 16.897  5.42437e+00  1.64777e+00  0.00000e+00 0.00000e+00 9.98594e+01 16.897  9.06181e+00 16.897  0.9069 
1 1 1 -18 34  2  o 18 3.40949e+00 1.17359e+00 6.62998e+01 83.517  3.88961e-01  3.42296e+00  0.00000e+00 0.00000e+00 4.34504e+01 83.517  2.28494e+01 263.517 0.8382 
1 1 1 -18 34  3  o 10 5.72321e+00 1.61843e+00 6.38513e+01 353.645 4.09785e+00  -4.56370e-01 0.00000e+00 0.00000e+00 1.26785e+02 353.645 6.29339e+01 353.645 0.8681 
1 1 1 -18 34  4  o 12 4.76413e+00 1.49317e+00 1.18393e+02 196.497 -6.82683e+00 -2.02176e+00 0.00000e+00 0.00000e+00 5.08782e+01 196.497 6.75145e+01 16.497  0.9268 
1 1 1 -18 34  5  o 10 4.45207e+00 1.41882e+00 8.97953e+01 99.815  -9.51114e-01 5.49798e+00  0.00000e+00 0.00000e+00 6.45541e+01 99.815  2.52412e+01 279.815 0.9053 
1 1 1 -18 34  6  o 12 4.02207e+00 1.32239e+00 3.87108e+01 337.149 2.17480e+00  -9.16483e-01 0.00000e+00 0.00000e+00 7.65159e+01 337.149 3.78052e+01 337.149 0.7489 
1 1 1 -18 35  1  o 15 6.07927e+00 1.66764e+00 1.42162e+02 35.441  7.67650e+00  5.46369e+00  0.00000e+00 0.00000e+00 7.87072e+01 35.441  6.34546e+01 215.441 0.9453 
1 1 1 -18 35  2  o 12 4.96955e+00 1.51004e+00 1.29818e+02 127.474 -4.77998e+00 6.23515e+00  0.00000e+00 0.00000e+00 4.84216e+01 127.474 8.13963e+01 307.474 0.9340 
1 1 1 -18 35  3  o 14 3.45441e+00 1.18561e+00 6.21144e+01 220.274 -2.59766e+00 -2.20095e+00 0.00000e+00 0.00000e+00 4.86805e+01 220.274 1.34338e+01 40.274  0.8360 
1 1 1 -18 35  4  o 9  7.65747e+00 1.70600e+00 5.72084e+01 340.078 4.51698e+00  -1.63709e+00 0.00000e+00 0.00000e+00 2.03624e+02 340.078 1.46416e+02 340.078 0.8886 
1 1 1 -18 35  5  o 17 5.68668e+00 1.50641e+00 4.80706e+01 177.592 -3.45622e+00 1.45312e-01  0.00000e+00 0.00000e+00 1.34617e+02 177.592 8.65461e+01 177.592 0.8389 
1 1 1 -18 35  6  o 7  7.32381e+00 1.78086e+00 1.03703e+02 345.972 7.86943e+00  -1.96618e+00 0.00000e+00 0.00000e+00 1.58562e+02 345.972 5.48596e+01 345.972 0.9362 
1 1 1 -18 36  1  o 1  5.83046e+00 1.64407e+00 9.14965e+01 153.555 -5.43374e+00 2.70259e+00  0.00000e+00 0.00000e+00 1.13158e+02 153.555 2.16618e+01 153.555 0.9134 
1 1 1 -18 36  2  o 10 8.45848e+00 1.76515e+00 1.22670e+02 44.301  7.74869e+00  7.56183e+00  0.00000e+00 0.00000e+00 1.86727e+02 44.301  6.40569e+01 44.301  0.9526 
1 1 1 -18 36  3  o 6  5.33406e+00 1.52736e+00 9.81816e+01 262.136 -8.82404e-01 -6.38877e+00 0.00000e+00 0.00000e+00 8.98383e+01 262.136 8.34328e+00 82.136  0.9188 
1 1 1 -18 36  4  o 3  3.94895e+00 1.26513e+00 6.28920e+01 138.267 -2.91090e+00 2.59649e+00  0.00000e+00 0.00000e+00 6.72090e+01 138.267 4.31705e+00 138.267 0.8596 
1 1 1 -18 36  5  o 6  4.24776e+00 1.37698e+00 1.06157e+02 208.803 -5.46674e+00 -3.00580e+00 0.00000e+00 0.00000e+00 4.28086e+01 208.803 6.33488e+01 28.804  0.9159 
1 1 1 -18 36  6  f 0  5.80748e+00 1.65227e+00 1.26398e+02 61.135  4.17239e+00  7.56932e+00  0.00000e+00 0.00000e+00 8.24530e+01 61.135  4.39445e+01 241.135 0.9402 
1 1 1 -18 37  1  o 7  4.81128e+00 1.50039e+00 2.52227e+01 176.894 -1.52194e+00 8.25873e-02  0.00000e+00 0.00000e+00 8.60798e+01 176.894 6.08571e+01 176.894 0.6021 
1 1 1 -18 37  2  o 11 6.63992e+00 1.64776e+00 8.44852e+01 25.851  5.70189e+00  2.76263e+00  0.00000e+00 0.00000e+00 1.49354e+02 25.851  6.48693e+01 25.851  0.9173 
1 1 1 -18 37  3  o 12 4.83463e+00 1.43485e+00 4.62741e+01 47.425  2.02184e+00  2.20064e+00  0.00000e+00 0.00000e+00 1.03781e+02 47.425  5.75069e+01 47.425  0.8091 
1 1 1 -18 37  4  o 18 4.60120e+00 1.44547e+00 4.19604e+01 227.823 -1.77279e+00 -1.95667e+00 0.00000e+00 0.00000e+00 9.54801e+01 227.823 5.35197e+01 227.823 0.7794 
1 1 1 -18 37  5  f 0  4.73786e+00 1.47572e+00 5.56560e+01 250.237 -1.20283e+00 -3.34768e+00 0.00000e+00 0.00000e+00 9.74430e+01 250.237 4.17871e+01 250.237 0.8440 
1 1 1 -18 38  1  o 13 6.41795e+00 1.67860e+00 1.19183e+02 240.139 -4.20392e+00 -7.32230e+00 0.00000e+00 0.00000e+00 1.12299e+02 240.139 6.88393e+00 60.139  0.9388 
1 1 1 -18 38  2  o 19 7.14357e+00 1.72327e+00 1.40238e+02 48.667  7.16486e+00  8.14609e+00  0.00000e+00 0.00000e+00 1.21035e+02 48.667  1.92027e+01 228.667 0.9527 
1 1 1 -18 38  3  o 17 4.27646e+00 1.37743e+00 2.55771e+01 140.542 -1.21747e+00 1.00211e+00  0.00000e+00 0.00000e+00 7.52273e+01 140.542 4.96502e+01 140.542 0.6146 
1 1 1 -18 38  4  o 8  6.07321e+00 1.63433e+00 6.23402e+01 13.768  4.23933e+00  1.03876e+00  0.00000e+00 0.00000e+00 1.41574e+02 13.768  7.92341e+01 13.768  0.8762 
1 1 1 -18 38  5  o 19 6.03801e+00 1.65877e+00 1.62434e+02 182.122 -1.14546e+01 -4.24535e-01 0.00000e+00 0.00000e+00 5.83831e+01 182.122 1.04050e+02 2.123   0.9553 
1 1 1 -18 39  1  o 16 9.02346e+00 1.68980e+00 1.76164e+02 215.871 -1.42752e+01 -1.03225e+01 0.00000e+00 0.00000e+00 1.60498e+02 215.871 1.56662e+01 35.871  0.9712 
1 1 1 -18 39  2  o 17 4.19404e+00 1.36133e+00 1.07990e+02 358.220 6.60683e+00  -2.05354e-01 0.00000e+00 0.00000e+00 4.02645e+01 358.220 6.77254e+01 178.220 0.9209 
1 1 1 -18 39  3  o 15 5.89148e+00 1.52814e+00 1.37625e+02 211.480 -8.88198e+00 -5.43853e+00 0.00000e+00 0.00000e+00 7.71837e+01 211.480 6.04415e+01 31.480  0.9507 
1 1 1 -18 39  4  o 12 5.81741e+00 1.62001e+00 5.29155e+01 121.333 -1.85575e+00 3.04824e+00  0.00000e+00 0.00000e+00 1.35345e+02 121.333 8.24300e+01 121.333 0.8446 
1 1 1 -18 39  5  o 14 4.85652e+00 1.49172e+00 3.93739e+01 167.367 -2.48037e+00 5.55908e-01  0.00000e+00 0.00000e+00 1.03667e+02 167.367 6.42932e+01 167.367 0.7695 
1 1 1 -18 40  1  o 15 5.37795e+00 1.59389e+00 1.18744e+02 263.102 -9.37676e-01 -7.75087e+00 0.00000e+00 0.00000e+00 7.41121e+01 263.102 4.46319e+01 83.102  0.9336 
1 1 1 -18 40  2  o 9  3.99721e+00 1.31826e+00 9.67108e+01 171.831 -5.76312e+00 8.27323e-01  0.00000e+00 0.00000e+00 4.28220e+01 171.831 5.38888e+01 351.831 0.9095 
1 1 1 -18 40  3  o 15 5.85886e+00 1.62700e+00 1.05900e+02 138.965 -5.42242e+00 4.71950e+00  0.00000e+00 0.00000e+00 1.02500e+02 138.965 3.40022e+00 318.965 0.9276 
1 1 1 -18 40  4  o 12 5.45059e+00 1.58459e+00 9.75232e+01 48.443  4.37802e+00  4.93863e+00  0.00000e+00 0.00000e+00 9.47513e+01 48.443  2.77188e+00 228.443 0.9208 
1 1 1 -18 40  5  o 17 4.26573e+00 1.37948e+00 1.03372e+02 130.927 -4.12322e+00 4.75539e+00  0.00000e+00 0.00000e+00 4.62900e+01 130.927 5.70821e+01 310.927 0.9167 
1 1 1 -18 41  1  o 8  4.42696e+00 1.41668e+00 8.02587e+01 253.516 -1.36193e+00 -4.60259e+00 0.00000e+00 0.00000e+00 7.08179e+01 253.516 9.44082e+00 73.516  0.8885 
1 1 1 -18 41  2  o 9  8.06601e+00 1.79496e+00 1.36730e+02 189.667 -1.11676e+01 -1.90224e+00 0.00000e+00 0.00000e+00 1.58821e+02 189.667 2.20908e+01 189.667 0.9548 
1 1 1 -18 41  3  f 0  7.76994e+00 1.73256e+00 1.87873e+02 57.712  8.33769e+00  1.31948e+01  0.00000e+00 0.00000e+00 1.00342e+02 57.712  8.75318e+01 237.712 0.9674 
1 1 1 -18 41  4  o 7  4.77732e+00 1.46885e+00 5.59766e+01 265.517 -2.81546e-01 -3.59143e+00 0.00000e+00 0.00000e+00 9.88966e+01 265.517 4.29200e+01 265.517 0.8463 
1 1 1 -18 41  5  o 6  5.23884e+00 1.46797e+00 6.79279e+01 271.266 1.04850e-01  -4.74487e+00 0.00000e+00 0.00000e+00 1.09929e+02 271.266 4.20009e+01 271.266 0.8871 
1 1 1 -18 42  1  o 5  9.81780e+00 1.69549e+00 1.44747e+02 227.265 -1.05855e+01 -1.14574e+01 0.00000e+00 0.00000e+00 2.19999e+02 227.265 7.52519e+01 227.265 0.9674 
1 1 1 -18 42  2  o 3  6.09530e+00 1.64607e+00 8.97186e+01 97.155  -7.74544e-01 6.17021e+00  0.00000e+00 0.00000e+00 1.24438e+02 97.155  3.47197e+01 97.155  0.9156 
1 1 1 -18 42  3  o 8  6.19964e+00 1.65423e+00 1.09997e+02 25.614  7.24310e+00  3.47254e+00  0.00000e+00 0.00000e+00 1.12360e+02 25.614  2.36257e+00 25.614  0.9355 
1 1 1 -18 42  4  o 19 3.96130e+00 1.28292e+00 5.82857e+01 173.549 -3.57448e+00 4.04161e-01  0.00000e+00 0.00000e+00 7.00804e+01 173.549 1.17947e+01 173.549 0.8460 
1 1 1 -18 42  5  o 6  5.17115e+00 1.56735e+00 6.30790e+01 296.329 1.80178e+00  -3.64095e+00 0.00000e+00 0.00000e+00 1.08253e+02 296.329 4.51737e+01 296.329 0.8659 
1 1 1 -18 43  1  o 7  5.42373e+00 1.53549e+00 1.10270e+02 114.466 -3.19007e+00 7.01086e+00  0.00000e+00 0.00000e+00 8.39647e+01 114.466 2.63053e+01 294.466 0.9326 
1 1 1 -18 43  2  o 3  6.08175e+00 1.65594e+00 1.07529e+02 316.937 5.61923e+00  -5.25157e+00 0.00000e+00 0.00000e+00 1.10069e+02 316.937 2.54090e+00 316.937 0.9325 
1 1 1 -18 43  3  o 13 5.78164e+00 1.62165e+00 7.29980e+01 132.778 -3.44039e+00 3.71813e+00  0.00000e+00 0.00000e+00 1.25339e+02 132.778 5.23407e+01 132.778 0.8949 
1 1 1 -18 43  4  o 13 4.99348e+00 1.47212e+00 8.94728e+01 249.136 -2.11675e+00 -5.55364e+00 0.00000e+00 0.00000e+00 8.48375e+01 249.136 4.63534e+00 69.136  0.9115 
1 1 1 -18 43  5  o 13 4.24429e+00 1.38555e+00 5.40055e+01 25.053  3.08048e+00  1.43995e+00  0.00000e+00 0.00000e+00 8.17049e+01 25.053  2.76994e+01 25.053  0.8357 
1 1 1 -18 44  1  o 1  7.55546e+00 1.58185e+00 1.66269e+02 104.318 -3.84077e+00 1.50485e+01  0.00000e+00 0.00000e+00 1.14319e+02 104.318 5.19497e+01 284.318 0.9673 
1 1 1 -18 44  2  o 3  8.75421e+00 1.77175e+00 8.15706e+01 237.743 -4.09340e+00 -6.48578e+00 0.00000e+00 0.00000e+00 2.31541e+02 237.743 1.49970e+02 237.743 0.9323 
1 1 1 -18 44  3  o 11 4.25787e+00 1.37100e+00 4.55307e+01 37.678  2.23344e+00  1.72483e+00  0.00000e+00 0.00000e+00 8.43633e+01 37.678  3.88326e+01 37.678  0.7959 
1 1 1 -18 44  4  o 6  6.57374e+00 1.72500e+00 1.50230e+02 311.133 7.20244e+00  -8.24668e+00 0.00000e+00 0.00000e+00 8.97157e+01 311.133 6.05141e+01 131.133 0.9532 
1 1 1 -18 44  5  o 11 1.11238e+01 1.62896e+00 1.94510e+02 157.955 -2.55140e+01 1.03316e+01  0.00000e+00 0.00000e+00 2.23233e+02 157.955 2.87222e+01 157.955 0.9817 
1 1 1 -18 45  1  o 3  3.58240e+00 1.20680e+00 5.96030e+01 75.449  8.85643e-01  3.41206e+00  0.00000e+00 0.00000e+00 5.62515e+01 75.449  3.35152e+00 255.449 0.8424 
1 1 1 -18 45  2  o 3  9.52482e+00 1.65668e+00 1.67104e+02 267.291 -8.81981e-01 -1.86379e+01 0.00000e+00 0.00000e+00 1.88325e+02 267.291 2.12209e+01 267.291 0.9728 
1 1 1 -18 45  3  o 12 4.12631e+00 1.33984e+00 3.95417e+01 317.821 1.77572e+00  -1.60893e+00 0.00000e+00 0.00000e+00 7.95727e+01 317.821 4.00310e+01 317.821 0.7532 
1 1 1 -18 45  4  o 19 3.93605e+00 1.30028e+00 8.69438e+01 136.238 -3.92336e+00 3.75730e+00  0.00000e+00 0.00000e+00 4.90736e+01 136.238 3.78702e+01 316.238 0.9025 
1 1 1 -18 45  5  o 16 3.96210e+00 1.32319e+00 3.62997e+01 86.019  1.65646e-01  2.38048e+00  0.00000e+00 0.00000e+00 7.76732e+01 86.019  4.13735e+01 86.019  0.7520 
1 1 1 -18 46  1  o 16 5.60148e+00 1.59895e+00 9.10413e+01 10.403  6.06500e+00  1.11348e+00  0.00000e+00 0.00000e+00 1.05668e+02 10.403  1.46266e+01 10.403  0.9149 
1 1 1 -18 46  2  o 15 3.63047e+00 1.22203e+00 9.81717e+01 217.587 -4.57364e+00 -3.52058e+00 0.00000e+00 0.00000e+00 2.83520e+01 217.587 6.98197e+01 37.587  0.9087 
1 1 1 -18 46  3  o 16 5.00873e+00 1.44153e+00 2.20194e+01 16.171  1.50541e+00  4.36531e-01  0.00000e+00 0.00000e+00 9.55145e+01 16.171  7.34951e+01 16.171  0.6124 
1 1 1 -18 46  4  o 12 4.71384e+00 1.46480e+00 4.67490e+01 180.129 -3.07284e+00 -6.92095e-03 0.00000e+00 0.00000e+00 1.00372e+02 180.129 5.36226e+01 180.129 0.8152 
1 1 1 -18 47  1  o 11 3.59400e+00 1.21352e+00 6.00712e+01 315.598 2.50990e+00  -2.45807e+00 0.00000e+00 0.00000e+00 5.60433e+01 315.598 4.02789e+00 135.598 0.8418 
1 1 1 -18 47  2  o 3  4.85137e+00 1.47778e+00 1.04828e+02 157.674 -6.49652e+00 2.66781e+00  0.00000e+00 0.00000e+00 6.74099e+01 157.674 3.74178e+01 337.674 0.9258 
1 1 1 -18 47  3  o 3  3.67062e+00 1.24841e+00 4.85866e+01 191.777 -2.88957e+00 -6.02476e-01 0.00000e+00 0.00000e+00 6.48188e+01 191.777 1.62322e+01 191.777 0.8064 
1 1 1 -18 47  4  o 5  4.08852e+00 1.31394e+00 7.95357e+01 350.798 5.26797e+00  -8.53433e-01 0.00000e+00 0.00000e+00 6.14202e+01 350.798 1.81155e+01 170.798 0.9006 
1 1 1 -18 48  1  o 5  5.53241e+00 1.57355e+00 7.96108e+01 144.891 -4.61790e+00 3.24659e+00  0.00000e+00 0.00000e+00 1.12838e+02 144.891 3.32274e+01 144.891 0.9065 
1 1 1 -18 48  2  o 15 7.24187e+00 1.63259e+00 8.81331e+01 14.967  7.55110e+00  2.01858e+00  0.00000e+00 0.00000e+00 1.71124e+02 14.967  8.29904e+01 14.967  0.9336 
1 1 1 -18 48  3  o 8  6.96996e+00 1.67831e+00 1.36519e+02 104.373 -2.88828e+00 1.12710e+01  0.00000e+00 0.00000e+00 1.18755e+02 104.373 1.77641e+01 284.373 0.9560 
1 1 1 -18 48  4  o 4  3.13575e+00 1.09139e+00 5.13058e+01 296.337 1.43810e+00  -2.90500e+00 0.00000e+00 0.00000e+00 4.78734e+01 296.337 3.43240e+00 116.337 0.8264 
1 1 1 -18 49  1  o 14 1.34079e+01 1.47486e+00 1.61004e+02 288.239 9.71921e+00  -2.94942e+01 0.00000e+00 0.00000e+00 3.45107e+02 288.239 1.84102e+02 288.239 0.9838 
1 1 1 -18 49  2  o 13 6.11906e+00 1.67750e+00 9.47092e+01 120.226 -3.56811e+00 6.12433e+00  0.00000e+00 0.00000e+00 1.22645e+02 120.226 2.79363e+01 120.226 0.9265 
1 1 1 -18 49  3  o 14 3.53425e+00 1.20055e+00 3.57503e+01 34.497  1.91497e+00  1.31599e+00  0.00000e+00 0.00000e+00 6.50214e+01 34.497  2.92711e+01 34.497  0.7444 
1 1 1 -18 49  4  o 2  4.72612e+00 1.43358e+00 9.02715e+01 241.151 -3.19377e+00 -5.79781e+00 0.00000e+00 0.00000e+00 7.63082e+01 241.151 1.39633e+01 61.151  0.9210 
1 1 1 -18 50  1  o 7  9.60775e+00 1.68788e+00 1.95395e+02 57.722  1.23186e+01  1.95025e+01  0.00000e+00 0.00000e+00 1.65125e+02 57.722  3.02700e+01 237.722 0.9781 
1 1 1 -18 50  2  f 0  5.23758e+00 1.55423e+00 6.84402e+01 211.042 -4.20311e+00 -2.52970e+00 0.00000e+00 0.00000e+00 1.10480e+02 211.042 4.20401e+01 211.042 0.8911 
1 1 1 -18 50  3  o 14 7.40190e+00 1.71018e+00 1.54587e+02 50.180  9.01527e+00  1.08128e+01  0.00000e+00 0.00000e+00 1.18643e+02 50.180  3.59434e+01 230.180 0.9638 
1 1 1 -18 51  1  o 18 4.45452e+00 1.39754e+00 5.41609e+01 341.914 3.65796e+00  -1.19461e+00 0.00000e+00 0.00000e+00 9.23489e+01 341.914 3.81880e+01 341.914 0.8574 
1 1 1 -18 51  2  o 17 4.18901e+00 1.35133e+00 1.06625e+02 221.545 -5.54694e+00 -4.91525e+00 0.00000e+00 0.00000e+00 4.26713e+01 221.545 6.39533e+01 41.545  0.9299 
1 1 1 -18 51  3  o 17 3.94338e+00 1.29717e+00 6.66005e+01 327.422 3.85699e+00  -2.46454e+00 0.00000e+00 0.00000e+00 6.66742e+01 327.422 7.37311e-02 327.422 0.8826 
1 1 1 -18 52  1  o 4  4.23359e+00 1.35864e+00 7.50521e+01 327.076 4.40648e+00  -2.85329e+00 0.00000e+00 0.00000e+00 7.09022e+01 327.076 4.14986e+00 147.076 0.8989 
1 1 1 -18 52  2  o 10 5.30254e+00 1.52190e+00 9.86044e+01 296.570 3.19723e+00  -6.39311e+00 0.00000e+00 0.00000e+00 8.98001e+01 296.570 8.80431e+00 116.570 0.9271 
1 1 1 -18 52  3  o 5  5.83331e+00 1.59753e+00 1.00103e+02 41.034  5.66627e+00  4.93149e+00  0.00000e+00 0.00000e+00 1.07802e+02 41.034  7.69911e+00 41.034  0.9308 
1 1 1 -18 53  1  o 9  6.90615e+00 1.65393e+00 5.72995e+01 238.981 -2.61295e+00 -4.34536e+00 0.00000e+00 0.00000e+00 1.79731e+02 238.981 1.22432e+02 238.981 0.8950 
1 1 1 -18 53  2  o 9  4.56633e+00 1.39533e+00 5.12183e+01 26.416  3.32853e+00  1.65348e+00  0.00000e+00 0.00000e+00 9.77972e+01 26.416  4.65789e+01 26.416  0.8517 
1 1 1 -18 53  3  o 18 8.33465e+00 1.74072e+00 1.15983e+02 144.379 -9.34451e+00 6.69513e+00  0.00000e+00 0.00000e+00 1.88887e+02 144.379 7.29045e+01 144.379 0.9555 
1 1 1 -18 54  1  o 5  4.37859e+00 1.38881e+00 1.13468e+02 343.731 7.56574e+00  -2.20795e+00 0.00000e+00 0.00000e+00 4.33760e+01 343.731 7.00924e+01 163.731 0.9342 
1 1 1 -18 54  2  o 10 7.19417e+00 1.65038e+00 1.41679e+02 139.880 -9.95757e+00 8.39106e+00  0.00000e+00 0.00000e+00 1.23138e+02 139.880 1.85405e+01 319.880 0.9608 
1 1 1 -18 54  3  o 4  8.43008e+00 1.69175e+00 1.29383e+02 307.549 8.32530e+00  -1.08305e+01 0.00000e+00 0.00000e+00 1.81259e+02 307.549 5.18765e+01 307.549 0.9627 
1 1 1 -18 55  1  o 2  3.33547e+00 1.13878e+00 4.34603e+01 96.257  -3.16629e-01 2.88773e+00  0.00000e+00 0.00000e+00 5.91848e+01 96.257  1.57244e+01 96.257  0.8027 
1 1 1 -18 55  2  f 0  3.99583e+00 1.31652e+00 7.93174e+01 343.927 5.22607e+00  -1.50578e+00 0.00000e+00 0.00000e+00 5.88461e+01 343.927 2.04712e+01 163.927 0.9027 
1 1 1 -18 56  1  o 3  5.29426e+00 1.56714e+00 1.66713e+02 308.427 7.44822e+00  -9.38831e+00 0.00000e+00 0.00000e+00 2.75627e+01 308.427 1.39150e+02 128.427 0.9573 
1 1 1 -18 56  2  o 2  3.71979e+00 1.23563e+00 7.59787e+01 28.447  4.52994e+00  2.45418e+00  0.00000e+00 0.00000e+00 5.17861e+01 28.447  2.41926e+01 208.447 0.8968 
1 1 1 -18 57  1  o 10 4.01234e+00 1.30203e+00 4.67552e+01 7.138   3.26671e+00  4.09099e-01  0.00000e+00 0.00000e+00 8.07958e+01 7.138   3.40406e+01 7.138   0.8295 
1 1 1 -18 57  2  o 15 5.50140e+00 1.56110e+00 7.42048e+01 247.484 -2.19588e+00 -5.29703e+00 0.00000e+00 0.00000e+00 1.17089e+02 247.484 4.28845e+01 247.484 0.9080 
1 1 1 -18 58  1  o 8  3.43821e+00 1.16899e+00 6.59505e+01 274.957 4.22134e-01  -4.86685e+00 0.00000e+00 0.00000e+00 5.13929e+01 274.957 1.45577e+01 94.957  0.8906 
1 1 1 -18 58  2  o 2  3.56772e+00 1.20410e+00 4.17984e+01 2.310   3.10320e+00  1.25198e-01  0.00000e+00 0.00000e+00 6.98741e+01 2.310   2.80757e+01 2.310   0.8175 
1 1 1 -18 59  1  o 18 3.93882e+00 1.29311e+00 1.03588e+02 207.352 -6.59911e+00 -3.41363e+00 0.00000e+00 0.00000e+00 3.67635e+01 207.352 6.68246e+01 27.352  0.9300 
1 1 1 -18 60  1  o 18 3.22904e+00 1.11339e+00 2.94014e+01 133.142 -1.41547e+00 1.51038e+00  0.00000e+00 0.00000e+00 5.82904e+01 133.142 2.88890e+01 133.142 0.7089 
1 1 1 -18 61  1  o 6  5.01389e+00 1.47703e+00 5.21375e+01 119.743 -2.12288e+00 3.71530e+00  0.00000e+00 0.00000e+00 1.15597e+02 119.743 6.34595e+01 119.743 0.8735 
1 1 1 -18 62  1  o 9  3.80264e+00 1.26397e+00 9.43783e+01 38.484  5.75426e+00  4.57453e+00  0.00000e+00 0.00000e+00 4.09393e+01 38.484  5.34389e+01 218.484 0.9293 
1 1 1 -17 0   1  o 12 3.20120e+00 2.12518e+00 6.51865e+01 0.000   1.07880e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.22490e+01 0.000   3.29375e+01 180.000 0.7928 
1 1 1 -17 0   2  o 17 3.73318e+00 2.34555e+00 7.36981e+01 0.000   1.29535e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.95472e+01 0.000   2.41509e+01 180.000 0.8605 
1 1 1 -17 0   3  o 13 6.85878e+00 3.01263e+00 1.41747e+02 180.000 -3.46985e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.20657e+02 180.000 2.10901e+01 0.000   0.9981 
1 1 1 -17 0   4  o 12 1.29073e+01 2.14355e+00 2.05802e+02 0.000   1.36438e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.88520e+02 0.000   8.27178e+01 0.000   1.0000 
1 1 1 -17 0   5  o 8  1.55518e+01 1.92298e+00 2.22411e+02 180.000 -1.90859e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.72617e+02 180.000 1.50206e+02 180.000 1.0000 
1 1 1 -17 0   6  o 9  2.49629e+00 1.79010e+00 5.08227e+01 0.000   8.19746e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.35748e+01 0.000   3.72479e+01 180.000 0.6749 
1 1 1 -17 0   7  o 18 3.57942e+00 2.32828e+00 1.45648e+02 180.000 -2.69680e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.02195e+01 0.000   1.55867e+02 0.000   0.9910 
1 1 1 -17 0   8  f 0  2.55164e+00 1.81381e+00 2.54481e+01 0.000   4.35512e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.44418e+01 0.000   1.10063e+01 180.000 0.4099 
1 1 1 -17 0   9  o 16 1.16672e+01 4.18594e+00 1.59286e+02 0.000   4.38033e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.84994e+02 0.000   1.25708e+02 0.000   0.9997 
1 1 1 -17 1   1  o 14 7.64614e+00 1.79710e+00 2.05938e+02 83.385  1.57239e+00  1.35583e+01  0.00000e+00 0.00000e+00 7.66622e+01 83.385  1.29276e+02 263.385 0.9626 
1 1 1 -17 1   2  o 3  5.24042e+00 1.47041e+00 3.13654e+01 274.824 1.45654e-01  -1.72576e+00 0.00000e+00 0.00000e+00 9.90038e+01 274.824 6.76384e+01 274.824 0.6485 
1 1 1 -17 1   3  f 0  5.77560e+00 1.60624e+00 1.10340e+02 49.418  4.04193e+00  4.71873e+00  0.00000e+00 0.00000e+00 9.23556e+01 49.418  1.79843e+01 229.418 0.9155 
1 1 1 -17 1   4  o 6  5.18765e+00 1.52795e+00 5.64919e+01 87.274  1.42109e-01  2.98516e+00  0.00000e+00 0.00000e+00 1.04263e+02 87.274  4.77716e+01 87.274  0.8091 
1 1 1 -17 1   5  o 9  6.78641e+00 1.64145e+00 1.25787e+02 347.947 7.81751e+00  -1.66920e+00 0.00000e+00 0.00000e+00 1.17039e+02 347.947 8.74821e+00 167.947 0.9352 
1 1 1 -17 1   6  o 7  1.10900e+01 1.66844e+00 1.27631e+02 192.915 -1.38012e+01 -3.16482e+00 0.00000e+00 0.00000e+00 2.80996e+02 192.915 1.53366e+02 192.915 0.9640 
1 1 1 -17 1   7  o 12 7.44188e+00 1.76170e+00 1.44730e+02 57.769  5.51478e+00  8.74666e+00  0.00000e+00 0.00000e+00 1.25296e+02 57.769  1.94332e+01 237.768 0.9503 
1 1 1 -17 1   8  o 19 4.94915e+00 1.54844e+00 4.39444e+01 263.265 -2.86915e-01 -2.42944e+00 0.00000e+00 0.00000e+00 9.93192e+01 263.265 5.53748e+01 263.265 0.7590 
1 1 1 -17 1   9  o 8  8.53901e+00 2.10447e+00 1.98557e+02 53.268  7.82283e+00  1.04828e+01  0.00000e+00 0.00000e+00 1.14011e+02 53.268  8.45459e+01 233.268 0.9610 
1 1 1 -17 2   1  o 19 6.08867e+00 1.63231e+00 1.00060e+02 201.085 -5.43862e+00 -2.09696e+00 0.00000e+00 0.00000e+00 1.12580e+02 201.085 1.25200e+01 201.085 0.9096 
1 1 1 -17 2   2  o 14 5.76921e+00 1.63292e+00 1.28868e+02 294.295 2.92478e+00  -6.47922e+00 0.00000e+00 0.00000e+00 7.62463e+01 294.295 5.26213e+01 114.295 0.9267 
1 1 1 -17 2   3  o 4  5.23569e+00 1.53481e+00 7.25463e+01 82.474  5.06250e-01  3.83174e+00  0.00000e+00 0.00000e+00 9.96752e+01 82.474  2.71289e+01 82.474  0.8581 
1 1 1 -17 2   4  o 10 4.42813e+00 1.41033e+00 1.13462e+02 85.740  4.08091e-01  5.47891e+00  0.00000e+00 0.00000e+00 3.97951e+01 85.740  7.36665e+01 265.740 0.9037 
1 1 1 -17 2   5  o 18 4.86869e+00 1.48883e+00 1.41171e+02 67.014  2.74855e+00  6.47948e+00  0.00000e+00 0.00000e+00 3.13165e+01 67.014  1.09855e+02 247.014 0.9260 
1 1 1 -17 2   6  o 14 7.07226e+00 1.64601e+00 6.38249e+01 263.689 -5.03477e-01 -4.55271e+00 0.00000e+00 0.00000e+00 1.74768e+02 263.689 1.10944e+02 263.689 0.8826 
1 1 1 -17 2   7  o 13 1.26361e+01 1.60389e+00 2.07885e+02 119.556 -1.37807e+01 2.43014e+01  0.00000e+00 0.00000e+00 2.65852e+02 119.556 5.79668e+01 119.556 0.9819 
1 1 1 -17 2   8  o 19 6.11132e+00 1.70508e+00 5.22436e+01 359.110 3.23689e+00  -5.02757e-02 0.00000e+00 0.00000e+00 1.40294e+02 359.110 8.80503e+01 359.110 0.8261 
1 1 1 -17 2   9  o 19 9.17832e+00 1.98961e+00 1.73894e+02 221.766 -9.86518e+00 -8.80984e+00 0.00000e+00 0.00000e+00 1.62230e+02 221.766 1.16643e+01 41.766  0.9614 
1 1 1 -17 3   1  o 6  8.68632e+00 1.69087e+00 1.41943e+02 313.586 7.85189e+00  -8.24934e+00 0.00000e+00 0.00000e+00 1.76562e+02 313.586 3.46188e+01 313.586 0.9550 
1 1 1 -17 3   2  o 5  8.64860e+00 1.63596e+00 1.33830e+02 22.987  1.02159e+01  4.33373e+00  0.00000e+00 0.00000e+00 1.82643e+02 22.987  4.88129e+01 22.987  0.9538 
1 1 1 -17 3   3  o 11 6.48586e+00 1.71828e+00 1.36492e+02 253.720 -2.25328e+00 -7.71562e+00 0.00000e+00 0.00000e+00 9.61004e+01 253.720 4.03918e+01 73.720  0.9356 
1 1 1 -17 3   4  o 17 1.77654e+01 1.23033e+00 3.10829e+02 31.920  5.69132e+01  3.54525e+01  0.00000e+00 0.00000e+00 3.64447e+02 31.920  5.36181e+01 31.920  0.9925 
1 1 1 -17 3   5  o 2  7.39923e+00 1.50209e+00 1.19674e+02 254.107 -2.46372e+00 -8.65316e+00 0.00000e+00 0.00000e+00 1.47195e+02 254.107 2.75210e+01 254.107 0.9427 
1 1 1 -17 3   6  o 4  9.95242e+00 1.71054e+00 1.32672e+02 222.427 -9.49090e+00 -8.67465e+00 0.00000e+00 0.00000e+00 2.32620e+02 222.427 9.99489e+01 222.427 0.9603 
1 1 1 -17 3   7  o 16 6.03714e+00 1.68867e+00 9.85697e+01 89.572  4.47228e-02  5.98881e+00  0.00000e+00 0.00000e+00 1.11689e+02 89.572  1.31195e+01 89.572  0.9122 
1 1 1 -17 3   8  o 17 5.96504e+00 1.72406e+00 1.02018e+02 271.802 1.91634e-01  -6.09012e+00 0.00000e+00 0.00000e+00 1.05855e+02 271.802 3.83772e+00 271.802 0.9138 
1 1 1 -17 3   9  o 18 6.26454e+00 1.83673e+00 4.74168e+01 85.457  2.14794e-01  2.70322e+00  0.00000e+00 0.00000e+00 1.40185e+02 85.457  9.27679e+01 85.457  0.7862 
1 1 1 -17 4   1  f 0  7.25431e+00 1.69274e+00 9.73064e+01 324.560 5.30585e+00  -3.77624e+00 0.00000e+00 0.00000e+00 1.58833e+02 324.560 6.15266e+01 324.560 0.9197 
1 1 1 -17 4   2  o 18 1.27837e+01 1.42577e+00 2.78653e+02 240.488 -1.90802e+01 -3.37082e+01 0.00000e+00 0.00000e+00 2.05403e+02 240.488 7.32508e+01 60.488  0.9870 
1 1 1 -17 4   3  o 7  6.62260e+00 1.72863e+00 2.06259e+02 90.500  -1.07643e-01 1.23245e+01  0.00000e+00 0.00000e+00 3.70682e+01 90.500  1.69191e+02 270.500 0.9585 
1 1 1 -17 4   4  o 17 7.30256e+00 1.69938e+00 1.57048e+02 302.920 5.73510e+00  -8.85829e+00 0.00000e+00 0.00000e+00 1.09018e+02 302.920 4.80301e+01 122.920 0.9514 
1 1 1 -17 4   5  o 13 6.83323e+00 1.68968e+00 1.45738e+02 52.591  5.50553e+00  7.19869e+00  0.00000e+00 0.00000e+00 1.00828e+02 52.591  4.49102e+01 232.591 0.9431 
1 1 1 -17 4   6  o 4  7.68860e+00 1.75499e+00 1.22008e+02 304.559 5.03692e+00  -7.31267e+00 0.00000e+00 0.00000e+00 1.54781e+02 304.559 3.27726e+01 304.559 0.9419 
1 1 1 -17 4   7  o 16 5.41120e+00 1.54516e+00 1.29214e+02 147.102 -6.48627e+00 4.19579e+00  0.00000e+00 0.00000e+00 6.35080e+01 147.102 6.57060e+01 327.102 0.9328 
1 1 1 -17 4   8  o 13 5.22039e+00 1.60801e+00 4.32541e+01 44.621  1.73735e+00  1.71451e+00  0.00000e+00 0.00000e+00 1.07735e+02 44.621  6.44809e+01 44.621  0.7584 
1 1 1 -17 4   9  o 6  4.33086e+00 1.46976e+00 1.09155e+02 314.969 3.86493e+00  -3.86910e+00 0.00000e+00 0.00000e+00 3.98453e+01 314.969 6.93093e+01 134.969 0.9032 
1 1 1 -17 5   1  o 8  9.73752e+00 1.66516e+00 2.16121e+02 0.042   1.97373e+01  1.43006e-02  0.00000e+00 0.00000e+00 1.48134e+02 0.042   6.79875e+01 180.041 0.9743 
1 1 1 -17 5   2  f 0  4.00485e+00 1.29468e+00 2.27894e+01 157.059 -9.87191e-01 4.17840e-01  0.00000e+00 0.00000e+00 4.96227e+01 157.059 2.68332e+01 157.059 0.4713 
1 1 1 -17 5   3  o 5  4.43750e+00 1.38340e+00 9.69722e+01 350.884 4.70780e+00  -7.55394e-01 0.00000e+00 0.00000e+00 5.40219e+01 350.884 4.29503e+01 170.884 0.8877 
1 1 1 -17 5   4  o 5  5.97682e+00 1.62170e+00 9.74734e+01 13.285  5.46487e+00  1.29030e+00  0.00000e+00 0.00000e+00 1.09887e+02 13.285  1.24135e+01 13.285  0.9059 
1 1 1 -17 5   5  o 3  8.88723e+00 1.74682e+00 1.97490e+02 188.666 -1.52662e+01 -2.32681e+00 0.00000e+00 0.00000e+00 1.31333e+02 188.666 6.61565e+01 8.666   0.9671 
1 1 1 -17 5   6  o 9  4.79187e+00 1.50774e+00 9.98063e+01 209.383 -4.61809e+00 -2.60036e+00 0.00000e+00 0.00000e+00 6.50097e+01 209.383 3.47966e+01 29.383  0.8999 
1 1 1 -17 5   7  f 0  4.36540e+00 1.36743e+00 4.41382e+01 22.963  2.20006e+00  9.32192e-01  0.00000e+00 0.00000e+00 8.12650e+01 22.963  3.71269e+01 22.963  0.7524 
1 1 1 -17 5   8  o 4  8.06570e+00 2.00046e+00 1.46510e+02 180.976 -9.88543e+00 -1.68435e-01 0.00000e+00 0.00000e+00 1.45085e+02 180.976 1.42597e+00 0.976   0.9480 
1 1 1 -17 5   9  o 2  5.90721e+00 1.80515e+00 1.47644e+02 306.681 4.85208e+00  -6.51408e+00 0.00000e+00 0.00000e+00 6.30175e+01 306.681 8.46263e+01 126.681 0.9363 
1 1 1 -17 6   1  o 18 6.87661e+00 1.64211e+00 8.12164e+01 264.906 -4.73682e-01 -5.31332e+00 0.00000e+00 0.00000e+00 1.56551e+02 264.906 7.53341e+01 264.906 0.9006 
1 1 1 -17 6   2  o 7  6.43681e+00 1.64480e+00 1.51938e+02 187.834 -9.23630e+00 -1.27076e+00 0.00000e+00 0.00000e+00 8.13504e+01 187.834 7.05874e+01 7.834   0.9447 
1 1 1 -17 6   3  o 13 5.16964e+00 1.52618e+00 5.59392e+01 46.567  2.02408e+00  2.13793e+00  0.00000e+00 0.00000e+00 1.03727e+02 46.567  4.77877e+01 46.567  0.8058 
1 1 1 -17 6   4  o 17 6.38493e+00 1.70954e+00 1.71983e+02 132.806 -6.83150e+00 7.37591e+00  0.00000e+00 0.00000e+00 6.00351e+01 132.806 1.11948e+02 312.805 0.9489 
1 1 1 -17 6   5  o 13 1.14695e+01 1.64723e+00 2.46656e+02 27.853  2.33312e+01  1.23286e+01  0.00000e+00 0.00000e+00 1.83760e+02 27.853  6.28961e+01 207.853 0.9809 
1 1 1 -17 6   6  o 14 7.07033e+00 1.74120e+00 1.07226e+02 197.598 -6.89880e+00 -2.18815e+00 0.00000e+00 0.00000e+00 1.43572e+02 197.598 3.63457e+01 197.598 0.9281 
1 1 1 -17 6   7  o 17 5.90475e+00 1.65796e+00 7.68190e+01 70.657  1.54199e+00  4.39277e+00  0.00000e+00 0.00000e+00 1.22632e+02 70.657  4.58125e+01 70.657  0.8847 
1 1 1 -17 6   8  o 15 4.67619e+00 1.54811e+00 8.23500e+01 242.207 -2.01911e+00 -3.83065e+00 0.00000e+00 0.00000e+00 7.37075e+01 242.207 8.64245e+00 62.207  0.8751 
1 1 1 -17 6   9  o 18 4.56073e+00 1.52876e+00 7.52954e+01 269.322 -4.70136e-02 -3.97050e+00 0.00000e+00 0.00000e+00 7.45146e+01 269.322 7.80872e-01 89.322  0.8624 
1 1 1 -17 7   1  o 11 7.71703e+00 1.76147e+00 1.35817e+02 292.315 3.53695e+00  -8.61773e+00 0.00000e+00 0.00000e+00 1.44068e+02 292.315 8.25030e+00 292.315 0.9447 
1 1 1 -17 7   2  o 8  6.05728e+00 1.64366e+00 1.42264e+02 18.917  7.77513e+00  2.66463e+00  0.00000e+00 0.00000e+00 7.54729e+01 18.917  6.67908e+01 198.917 0.9370 
1 1 1 -17 7   3  f 0  4.80933e+00 1.47756e+00 3.71594e+01 240.776 -9.14158e-01 -1.63410e+00 0.00000e+00 0.00000e+00 8.73941e+01 240.776 5.02347e+01 240.776 0.6757 
1 1 1 -17 7   4  o 11 4.88719e+00 1.50269e+00 3.69711e+01 207.360 -1.66244e+00 -8.60262e-01 0.00000e+00 0.00000e+00 8.94647e+01 207.360 5.24936e+01 207.360 0.6756 
1 1 1 -17 7   5  o 17 6.10307e+00 1.61298e+00 1.22808e+02 86.632  4.19013e-01  7.11954e+00  0.00000e+00 0.00000e+00 9.36366e+01 86.632  2.91711e+01 266.632 0.9270 
1 1 1 -17 7   6  o 9  3.77179e+00 1.22975e+00 7.51532e+01 196.048 -3.59725e+00 -1.03476e+00 0.00000e+00 0.00000e+00 4.77920e+01 196.048 2.73612e+01 16.048  0.8529 
1 1 1 -17 7   7  o 7  4.89574e+00 1.47476e+00 9.75615e+01 170.882 -5.45259e+00 8.75153e-01  0.00000e+00 0.00000e+00 7.14496e+01 170.882 2.61119e+01 350.882 0.9042 
1 1 1 -17 7   8  o 15 4.59374e+00 1.51397e+00 7.21671e+01 271.750 1.16403e-01  -3.81080e+00 0.00000e+00 0.00000e+00 7.77710e+01 271.750 5.60383e+00 271.750 0.8559 
1 1 1 -17 7   9  o 14 5.79111e+00 1.76114e+00 8.07710e+01 190.234 -4.55481e+00 -8.22356e-01 0.00000e+00 0.00000e+00 1.14215e+02 190.234 3.34439e+01 190.234 0.8840 
1 1 1 -17 8   1  o 3  1.09948e+01 1.60568e+00 1.87756e+02 164.574 -1.94206e+01 5.35886e+00  0.00000e+00 0.00000e+00 2.23731e+02 164.574 3.59743e+01 164.574 0.9749 
1 1 1 -17 8   2  o 17 3.95981e+00 1.30874e+00 6.71562e+01 123.613 -1.71375e+00 2.57808e+00  0.00000e+00 0.00000e+00 5.69208e+01 123.613 1.02354e+01 303.613 0.8168 
1 1 1 -17 8   3  o 5  6.84147e+00 1.59243e+00 1.26777e+02 157.793 -7.85551e+00 3.20681e+00  0.00000e+00 0.00000e+00 1.19474e+02 157.793 7.30303e+00 337.793 0.9391 
1 1 1 -17 8   4  o 4  7.32557e+00 1.65101e+00 9.06123e+01 159.513 -5.89310e+00 2.20179e+00  0.00000e+00 0.00000e+00 1.66537e+02 159.513 7.59242e+01 159.513 0.9167 
1 1 1 -17 8   5  o 10 1.08284e+01 1.60153e+00 2.22479e+02 343.116 2.20782e+01  -6.70126e+00 0.00000e+00 0.00000e+00 1.82710e+02 343.116 3.97686e+01 163.116 0.9781 
1 1 1 -17 8   6  o 4  9.29726e+00 1.81090e+00 2.16143e+02 219.548 -1.36840e+01 -1.12994e+01 0.00000e+00 0.00000e+00 1.29025e+02 219.548 8.71180e+01 39.548  0.9714 
1 1 1 -17 8   7  o 1  9.86985e+00 1.64088e+00 1.66534e+02 59.508  8.37173e+00  1.42170e+01  0.00000e+00 0.00000e+00 1.98667e+02 59.508  3.21338e+01 59.508  0.9692 
1 1 1 -17 8   8  o 4  4.65053e+00 1.51999e+00 6.34120e+01 356.433 3.37062e+00  -2.10104e-01 0.00000e+00 0.00000e+00 8.45659e+01 356.433 2.11539e+01 356.433 0.8344 
1 1 1 -17 8   9  o 14 8.79903e+00 2.15443e+00 1.57988e+02 229.100 -6.97944e+00 -8.05742e+00 0.00000e+00 0.00000e+00 1.61019e+02 229.100 3.03010e+00 229.100 0.9519 
1 1 1 -17 9   1  o 5  7.89867e+00 1.75547e+00 6.95192e+01 32.533  4.12765e+00  2.63294e+00  0.00000e+00 0.00000e+00 2.00632e+02 32.533  1.31113e+02 32.533  0.8909 
1 1 1 -17 9   2  o 6  7.74352e+00 1.63787e+00 1.52424e+02 226.548 -7.76572e+00 -8.19721e+00 0.00000e+00 0.00000e+00 1.31144e+02 226.548 2.12800e+01 46.548  0.9546 
1 1 1 -17 9   3  o 15 4.67456e+00 1.45528e+00 6.80642e+01 174.666 -3.36175e+00 3.13880e-01  0.00000e+00 0.00000e+00 8.14283e+01 174.666 1.33641e+01 174.666 0.8344 
1 1 1 -17 9   4  o 4  6.81940e+00 1.72222e+00 1.89401e+02 318.116 8.73011e+00  -7.82878e+00 0.00000e+00 0.00000e+00 6.03425e+01 318.116 1.29059e+02 138.116 0.9564 
1 1 1 -17 9   5  o 17 7.79829e+00 1.71213e+00 9.37431e+01 260.124 -1.20623e+00 -6.92876e+00 0.00000e+00 0.00000e+00 1.82488e+02 260.124 8.87446e+01 260.124 0.9259 
1 1 1 -17 9   6  o 5  5.75419e+00 1.63573e+00 1.09673e+02 71.775  1.94027e+00  5.89253e+00  0.00000e+00 0.00000e+00 9.16382e+01 71.775  1.80348e+01 251.775 0.9154 
1 1 1 -17 9   7  o 4  4.74977e+00 1.50564e+00 1.16138e+02 50.546  3.82983e+00  4.65351e+00  0.00000e+00 0.00000e+00 4.93750e+01 50.546  6.67628e+01 230.546 0.9128 
1 1 1 -17 9   8  o 19 4.53926e+00 1.51045e+00 4.95165e+01 354.843 2.46129e+00  -2.22124e-01 0.00000e+00 0.00000e+00 8.23535e+01 354.843 3.28370e+01 354.843 0.7618 
1 1 1 -17 9   9  o 13 1.34378e+01 1.97891e+00 2.24399e+02 259.047 -4.91291e+00 -2.53866e+01 0.00000e+00 0.00000e+00 2.77408e+02 259.047 5.30083e+01 259.047 0.9805 
1 1 1 -17 10  1  o 11 4.12712e+00 1.31109e+00 3.71686e+01 355.603 1.77788e+00  -1.36707e-01 0.00000e+00 0.00000e+00 6.72003e+01 355.603 3.00317e+01 355.603 0.6587 
1 1 1 -17 10  2  o 15 4.76555e+00 1.46901e+00 1.73716e+01 23.121  8.02188e-01  3.42517e-01  0.00000e+00 0.00000e+00 5.56217e+01 23.121  3.82501e+01 23.121  0.3993 
1 1 1 -17 10  3  o 4  6.62095e+00 1.64980e+00 1.23520e+02 44.805  5.50514e+00  5.46774e+00  0.00000e+00 0.00000e+00 1.13275e+02 44.805  1.02450e+01 224.805 0.9331 
1 1 1 -17 10  4  o 13 4.35137e+00 1.37993e+00 1.15578e+02 277.243 7.05635e-01  -5.55246e+00 0.00000e+00 0.00000e+00 3.53189e+01 277.243 8.02592e+01 97.243  0.9056 
1 1 1 -17 10  5  o 11 5.25208e+00 1.55529e+00 3.60332e+01 207.550 -1.78188e+00 -9.29563e-01 0.00000e+00 0.00000e+00 1.04487e+02 207.550 6.84535e+01 207.550 0.6994 
1 1 1 -17 10  6  o 19 5.31888e+00 1.60570e+00 1.49771e+02 27.300  7.08638e+00  3.65762e+00  0.00000e+00 0.00000e+00 4.02911e+01 27.300  1.09480e+02 207.300 0.9350 
1 1 1 -17 10  7  o 13 4.78460e+00 1.50067e+00 5.91662e+01 109.895 -1.05545e+00 2.91639e+00  0.00000e+00 0.00000e+00 9.01020e+01 109.895 3.09358e+01 109.895 0.8172 
1 1 1 -17 10  8  o 15 8.57940e+00 2.04838e+00 1.64290e+02 283.744 2.62680e+00  -1.07397e+01 0.00000e+00 0.00000e+00 1.47693e+02 283.744 1.65968e+01 103.744 0.9536 
1 1 1 -17 10  9  o 9  5.33066e+00 1.70112e+00 1.02022e+02 117.785 -2.60881e+00 4.95125e+00  0.00000e+00 0.00000e+00 8.18349e+01 117.785 2.01874e+01 297.785 0.9056 
1 1 1 -17 11  1  o 14 6.76878e+00 1.68974e+00 1.00742e+02 33.611  5.24451e+00  3.48591e+00  0.00000e+00 0.00000e+00 1.37465e+02 33.611  3.67229e+01 33.611  0.9167 
1 1 1 -17 11  2  o 10 6.07029e+00 1.66963e+00 1.47503e+02 188.985 -8.26436e+00 -1.30672e+00 0.00000e+00 0.00000e+00 7.09486e+01 188.985 7.65548e+01 8.985   0.9382 
1 1 1 -17 11  3  o 5  4.96996e+00 1.46959e+00 3.47970e+01 322.783 1.45489e+00  -1.10499e+00 0.00000e+00 0.00000e+00 9.22911e+01 322.783 5.74941e+01 322.783 0.6672 
1 1 1 -17 11  4  o 10 6.21527e+00 1.57446e+00 7.86067e+01 205.720 -4.48425e+00 -2.16007e+00 0.00000e+00 0.00000e+00 1.33886e+02 205.720 5.52792e+01 205.720 0.8929 
1 1 1 -17 11  5  o 11 8.98905e+00 1.71349e+00 1.34964e+02 29.827  1.01121e+01  5.79754e+00  0.00000e+00 0.00000e+00 1.93812e+02 29.827  5.88483e+01 29.827  0.9561 
1 1 1 -17 11  6  o 16 9.61181e+00 1.64897e+00 1.29785e+02 261.740 -1.74649e+00 -1.20306e+01 0.00000e+00 0.00000e+00 2.22090e+02 261.740 9.23049e+01 261.740 0.9579 
1 1 1 -17 11  7  o 11 1.24936e+01 1.48562e+00 2.45809e+02 223.257 -2.47273e+01 -2.32668e+01 0.00000e+00 0.00000e+00 2.24052e+02 223.257 2.17573e+01 43.257  0.9852 
1 1 1 -17 11  8  o 15 1.29504e+01 1.93201e+00 2.75146e+02 47.291  2.03629e+01  2.20597e+01  0.00000e+00 0.00000e+00 2.10368e+02 47.291  6.47777e+01 227.290 0.9832 
1 1 1 -17 11  9  o 3  4.73189e+00 1.55290e+00 5.24318e+01 61.823  1.34798e+00  2.51641e+00  0.00000e+00 0.00000e+00 9.14941e+01 61.823  3.90624e+01 61.823  0.7986 
1 1 1 -17 12  1  o 14 6.65498e+00 1.73002e+00 1.15765e+02 238.997 -3.57633e+00 -5.95141e+00 0.00000e+00 0.00000e+00 1.20511e+02 238.997 4.74647e+00 238.997 0.9249 
1 1 1 -17 12  2  o 2  6.52828e+00 1.66987e+00 1.55844e+02 51.254  5.94762e+00  7.41176e+00  0.00000e+00 0.00000e+00 8.09950e+01 51.254  7.48486e+01 231.254 0.9458 
1 1 1 -17 12  3  f 0  1.02224e+01 1.67114e+00 1.75203e+02 350.991 1.65586e+01  -2.62530e+00 0.00000e+00 0.00000e+00 2.04697e+02 350.991 2.94941e+01 350.991 0.9697 
1 1 1 -17 12  4  o 11 5.44769e+00 1.57365e+00 2.87252e+01 273.975 1.10530e-01  -1.59071e+00 0.00000e+00 0.00000e+00 1.00321e+02 273.975 7.15961e+01 273.975 0.6186 
1 1 1 -17 12  5  o 7  1.01164e+01 1.66739e+00 1.56043e+02 318.323 1.16590e+01  -1.03794e+01 0.00000e+00 0.00000e+00 2.18339e+02 318.323 6.22960e+01 318.323 0.9674 
1 1 1 -17 12  6  o 16 5.41484e+00 1.59712e+00 1.22593e+02 124.850 -4.01044e+00 5.75945e+00  0.00000e+00 0.00000e+00 6.89646e+01 124.850 5.36288e+01 304.850 0.9257 
1 1 1 -17 12  7  o 8  5.37239e+00 1.56239e+00 8.12951e+01 265.051 -4.18555e-01 -4.83376e+00 0.00000e+00 0.00000e+00 1.01192e+02 265.051 1.98972e+01 265.051 0.8898 
1 1 1 -17 12  8  o 9  6.24532e+00 1.83172e+00 3.82180e+01 283.289 4.91904e-01  -2.08270e+00 0.00000e+00 0.00000e+00 1.33112e+02 283.289 9.48936e+01 283.289 0.7195 
1 1 1 -17 12  9  o 8  4.05602e+00 1.39199e+00 7.89638e+01 277.223 5.16839e-01  -4.07781e+00 0.00000e+00 0.00000e+00 5.50587e+01 277.223 2.39051e+01 97.223  0.8676 
1 1 1 -17 13  1  o 13 1.12159e+01 1.58608e+00 1.62739e+02 310.622 1.16703e+01  -1.36054e+01 0.00000e+00 0.00000e+00 2.55601e+02 310.622 9.28621e+01 310.622 0.9717 
1 1 1 -17 13  2  o 14 4.75815e+00 1.42169e+00 1.19991e+02 114.172 -2.53079e+00 5.63857e+00  0.00000e+00 0.00000e+00 4.70121e+01 114.172 7.29787e+01 294.172 0.9151 
1 1 1 -17 13  3  o 19 6.13427e+00 1.54740e+00 1.14527e+02 322.176 5.59223e+00  -4.34153e+00 0.00000e+00 0.00000e+00 1.03260e+02 322.176 1.12667e+01 142.176 0.9264 
1 1 1 -17 13  4  o 3  4.23815e+00 1.36943e+00 4.31088e+01 261.223 -3.21680e-01 -2.08342e+00 0.00000e+00 0.00000e+00 7.28771e+01 261.223 2.97683e+01 261.223 0.7148 
1 1 1 -17 13  5  o 2  5.96904e+00 1.64630e+00 6.37442e+01 246.538 -1.44844e+00 -3.33723e+00 0.00000e+00 0.00000e+00 1.29879e+02 246.538 6.61348e+01 246.538 0.8480 
1 1 1 -17 13  6  f 0  5.33925e+00 1.59702e+00 1.03290e+02 238.766 -3.02262e+00 -4.98419e+00 0.00000e+00 0.00000e+00 8.22991e+01 238.766 2.09912e+01 58.766  0.9096 
1 1 1 -17 13  7  o 14 7.65130e+00 1.75765e+00 9.67836e+01 140.360 -5.56749e+00 4.61241e+00  0.00000e+00 0.00000e+00 1.74256e+02 140.360 7.74728e+01 140.360 0.9280 
1 1 1 -17 13  8  o 7  6.06773e+00 1.78389e+00 1.87434e+02 329.859 9.55541e+00  -5.54810e+00 0.00000e+00 0.00000e+00 3.31865e+01 329.859 1.54248e+02 149.860 0.9536 
1 1 1 -17 13  9  o 10 4.99692e+00 1.61341e+00 7.84798e+01 213.422 -3.61165e+00 -2.38345e+00 0.00000e+00 0.00000e+00 8.80321e+01 213.422 9.55228e+00 213.422 0.8750 
1 1 1 -17 14  1  o 10 6.40829e+00 1.66455e+00 1.12408e+02 114.717 -2.83283e+00 6.15417e+00  0.00000e+00 0.00000e+00 1.14610e+02 114.717 2.20150e+00 114.717 0.9229 
1 1 1 -17 14  2  o 9  7.25110e+00 1.65971e+00 1.41561e+02 139.882 -7.40196e+00 6.23704e+00  0.00000e+00 0.00000e+00 1.21765e+02 139.882 1.97965e+01 319.882 0.9468 
1 1 1 -17 14  3  o 18 6.48298e+00 1.64290e+00 1.63524e+02 312.244 6.78954e+00  -7.47626e+00 0.00000e+00 0.00000e+00 7.22765e+01 312.244 9.12471e+01 132.244 0.9491 
1 1 1 -17 14  4  o 3  7.55220e+00 1.71637e+00 1.98535e+02 273.849 9.38976e-01  -1.39554e+01 0.00000e+00 0.00000e+00 8.00839e+01 273.849 1.18451e+02 93.849  0.9636 
1 1 1 -17 14  5  o 6  4.66957e+00 1.45414e+00 6.34175e+01 71.230  1.02196e+00  3.00711e+00  0.00000e+00 0.00000e+00 8.34399e+01 71.230  2.00225e+01 71.230  0.8222 
1 1 1 -17 14  6  o 16 5.74982e+00 1.58964e+00 5.41189e+01 310.409 2.14153e+00  -2.51544e+00 0.00000e+00 0.00000e+00 1.28273e+02 310.409 7.41542e+01 310.409 0.8301 
1 1 1 -17 14  7  o 19 6.06744e+00 1.66799e+00 5.02170e+01 314.788 2.22202e+00  -2.23850e+00 0.00000e+00 0.00000e+00 1.39869e+02 314.788 8.96519e+01 314.788 0.8208 
1 1 1 -17 14  8  o 2  7.94030e+00 1.94865e+00 1.25531e+02 170.716 -8.57701e+00 1.40208e+00  0.00000e+00 0.00000e+00 1.59218e+02 170.716 3.36876e+01 170.716 0.9406 
1 1 1 -17 14  9  o 11 1.05100e+01 2.06827e+00 1.44841e+02 39.628  9.56708e+00  7.92257e+00  0.00000e+00 0.00000e+00 2.38926e+02 39.628  9.40852e+01 39.628  0.9589 
1 1 1 -17 15  1  f 0  6.97874e+00 1.65448e+00 4.75850e+01 200.562 -2.94082e+00 -1.10315e+00 0.00000e+00 0.00000e+00 1.72031e+02 200.562 1.24446e+02 200.562 0.8199 
1 1 1 -17 15  2  o 15 6.01541e+00 1.56401e+00 8.65244e+01 14.618  5.02750e+00  1.31123e+00  0.00000e+00 0.00000e+00 1.20588e+02 14.618  3.40640e+01 14.618  0.8977 
1 1 1 -17 15  3  o 11 1.04430e+01 1.67667e+00 1.65272e+02 66.622  6.38977e+00  1.47817e+01  0.00000e+00 0.00000e+00 2.22277e+02 66.622  5.70052e+01 66.622  0.9684 
1 1 1 -17 15  4  o 6  1.13824e+01 1.61173e+00 2.64641e+02 211.735 -2.44094e+01 -1.50960e+01 0.00000e+00 0.00000e+00 1.63487e+02 211.735 1.01154e+02 31.735  0.9824 
1 1 1 -17 15  5  o 7  6.23285e+00 1.63635e+00 8.77591e+01 353.938 5.22708e+00  -5.55125e-01 0.00000e+00 0.00000e+00 1.26567e+02 353.938 3.88076e+01 353.938 0.8990 
1 1 1 -17 15  6  o 12 1.03432e+01 1.63331e+00 1.77225e+02 19.364  1.78192e+01  6.26268e+00  0.00000e+00 0.00000e+00 2.07384e+02 19.364  3.01588e+01 19.364  0.9732 
1 1 1 -17 15  7  o 13 4.61488e+00 1.40787e+00 4.93260e+01 115.164 -1.22825e+00 2.61448e+00  0.00000e+00 0.00000e+00 9.18369e+01 115.164 4.25110e+01 115.164 0.8014 
1 1 1 -17 15  8  o 4  4.38280e+00 1.48131e+00 2.35135e+01 97.189  -1.53229e-01 1.21472e+00  0.00000e+00 0.00000e+00 6.34194e+01 97.189  3.99059e+01 97.189  0.5203 
1 1 1 -17 15  9  o 8  7.68465e+00 1.85434e+00 9.64329e+01 201.272 -6.53403e+00 -2.54388e+00 0.00000e+00 0.00000e+00 1.74441e+02 201.272 7.80083e+01 201.272 0.9257 
1 1 1 -17 16  1  o 3  7.99030e+00 1.71253e+00 1.67529e+02 80.414  2.03522e+00  1.20512e+01  0.00000e+00 0.00000e+00 1.26318e+02 80.414  4.12102e+01 260.414 0.9582 
1 1 1 -17 16  2  o 8  5.33460e+00 1.52319e+00 8.17436e+01 204.061 -4.07109e+00 -1.81779e+00 0.00000e+00 0.00000e+00 9.81086e+01 204.061 1.63650e+01 204.061 0.8791 
1 1 1 -17 16  3  f 0  7.41416e+00 1.51781e+00 1.05153e+02 103.220 -1.82840e+00 7.78309e+00  0.00000e+00 0.00000e+00 1.60537e+02 103.220 5.53843e+01 103.220 0.9352 
1 1 1 -17 16  4  o 15 8.49037e+00 1.65846e+00 1.34496e+02 182.423 -1.05707e+01 -4.47255e-01 0.00000e+00 0.00000e+00 1.74788e+02 182.423 4.02920e+01 182.423 0.9515 
1 1 1 -17 16  5  o 18 5.29250e+00 1.52505e+00 6.59189e+01 135.434 -2.72585e+00 2.68481e+00  0.00000e+00 0.00000e+00 1.07455e+02 135.434 4.15366e+01 135.434 0.8565 
1 1 1 -17 16  6  o 4  1.00352e+01 1.66919e+00 2.50779e+02 299.012 1.22841e+01  -2.21499e+01 0.00000e+00 0.00000e+00 1.25005e+02 299.012 1.25775e+02 119.012 0.9801 
1 1 1 -17 16  7  o 15 8.15277e+00 1.81751e+00 1.50079e+02 209.754 -1.02091e+01 -5.83586e+00 0.00000e+00 0.00000e+00 1.47551e+02 209.754 2.52810e+00 29.754  0.9565 
1 1 1 -17 16  8  o 3  6.74324e+00 1.87751e+00 1.27739e+02 323.914 6.30938e+00  -4.59847e+00 0.00000e+00 0.00000e+00 1.12260e+02 323.914 1.54796e+01 143.914 0.9336 
1 1 1 -17 16  9  o 17 6.73502e+00 1.83635e+00 1.03773e+02 349.644 6.58116e+00  -1.20259e+00 0.00000e+00 0.00000e+00 1.32653e+02 349.644 2.88800e+01 349.644 0.9219 
1 1 1 -17 17  1  o 8  7.06386e+00 1.67566e+00 1.61644e+02 256.928 -2.41274e+00 -1.03916e+01 0.00000e+00 0.00000e+00 9.64234e+01 256.928 6.52202e+01 76.929  0.9519 
1 1 1 -17 17  2  o 15 8.89575e+00 1.64428e+00 1.32861e+02 81.982  1.56889e+00  1.11382e+01  0.00000e+00 0.00000e+00 1.92747e+02 81.982  5.98859e+01 81.982  0.9545 
1 1 1 -17 17  3  o 17 5.94910e+00 1.61810e+00 1.36288e+02 314.628 5.64770e+00  -5.72159e+00 0.00000e+00 0.00000e+00 7.69765e+01 314.628 5.93117e+01 134.628 0.9356 
1 1 1 -17 17  4  o 14 4.61285e+00 1.39352e+00 8.33017e+01 109.193 -1.48610e+00 4.26911e+00  0.00000e+00 0.00000e+00 7.22634e+01 109.193 1.10383e+01 289.193 0.8809 
1 1 1 -17 17  5  o 8  5.43433e+00 1.58737e+00 8.44279e+00 200.840 -4.51659e-01 -1.71927e-01 0.00000e+00 0.00000e+00 4.03681e+01 200.840 3.19253e+01 200.840 0.2348 
1 1 1 -17 17  6  o 7  5.00277e+00 1.52251e+00 4.97256e+01 335.393 2.50012e+00  -1.14500e+00 0.00000e+00 0.00000e+00 1.01208e+02 335.393 5.14820e+01 335.393 0.7896 
1 1 1 -17 17  7  o 5  5.25678e+00 1.58148e+00 1.02597e+02 121.110 -3.13903e+00 5.20167e+00  0.00000e+00 0.00000e+00 8.06797e+01 121.110 2.19174e+01 301.109 0.9135 
1 1 1 -17 17  8  o 3  6.69815e+00 1.80502e+00 1.23799e+02 47.734  5.29744e+00  5.82871e+00  0.00000e+00 0.00000e+00 1.14740e+02 47.734  9.05869e+00 227.734 0.9342 
1 1 1 -17 17  9  o 9  6.13192e+00 1.72486e+00 1.07386e+02 266.400 -4.30447e-01 -6.84085e+00 0.00000e+00 0.00000e+00 1.08319e+02 266.400 9.32516e-01 266.400 0.9239 
1 1 1 -17 18  1  o 13 1.62958e+01 1.27915e+00 2.46414e+02 240.981 -2.30199e+01 -4.14962e+01 0.00000e+00 0.00000e+00 3.72348e+02 240.981 1.25934e+02 240.981 0.9894 
1 1 1 -17 18  2  f 0  6.81900e+00 1.59377e+00 1.68290e+02 302.563 6.05496e+00  -9.48136e+00 0.00000e+00 0.00000e+00 8.12939e+01 302.563 8.69960e+01 122.563 0.9545 
1 1 1 -17 18  3  o 5  6.19917e+00 1.65908e+00 1.33482e+02 77.574  1.72080e+00  7.80984e+00  0.00000e+00 0.00000e+00 8.86523e+01 77.574  4.48299e+01 257.574 0.9352 
1 1 1 -17 18  4  o 7  5.49627e+00 1.59476e+00 1.79529e+02 91.529  -2.72648e-01 1.02153e+01  0.00000e+00 0.00000e+00 2.02971e+01 91.529  1.59232e+02 271.529 0.9497 
1 1 1 -17 18  5  o 17 5.48528e+00 1.58588e+00 1.32814e+02 205.038 -6.95587e+00 -3.24917e+00 0.00000e+00 0.00000e+00 6.27832e+01 205.038 7.00311e+01 25.038  0.9324 
1 1 1 -17 18  6  o 5  3.97139e+00 1.29430e+00 8.31665e+01 254.158 -1.17291e+00 -4.13345e+00 0.00000e+00 0.00000e+00 4.94481e+01 254.158 3.37184e+01 74.158  0.8740 
1 1 1 -17 18  7  o 9  6.61302e+00 1.86615e+00 1.18276e+02 198.097 -6.70875e+00 -2.19239e+00 0.00000e+00 0.00000e+00 1.15469e+02 198.097 2.80754e+00 18.097  0.9262 
1 1 1 -17 18  8  o 8  8.66195e+00 2.05580e+00 1.77562e+02 232.630 -7.54199e+00 -9.87517e+00 0.00000e+00 0.00000e+00 1.39054e+02 232.630 3.85072e+01 52.630  0.9589 
1 1 1 -17 18  9  o 3  5.17000e+00 1.67131e+00 1.05015e+02 317.025 4.28728e+00  -3.99452e+00 0.00000e+00 0.00000e+00 7.41371e+01 317.025 3.08781e+01 137.025 0.9101 
1 1 1 -17 19  1  o 9  5.28974e+00 1.50732e+00 1.52832e+02 3.793   8.32541e+00  5.51960e-01  0.00000e+00 0.00000e+00 3.75789e+01 3.793   1.15253e+02 183.793 0.9380 
1 1 1 -17 19  2  o 17 6.07525e+00 1.61351e+00 1.47218e+02 338.230 8.26050e+00  -3.29889e+00 0.00000e+00 0.00000e+00 7.22265e+01 338.230 7.49911e+01 158.230 0.9420 
1 1 1 -17 19  3  o 8  6.25287e+00 1.64971e+00 7.75453e+01 141.382 -3.53051e+00 2.82017e+00  0.00000e+00 0.00000e+00 1.33485e+02 141.382 5.59396e+01 141.382 0.8809 
1 1 1 -17 19  4  o 13 7.46929e+00 1.71758e+00 1.35108e+02 225.603 -6.76324e+00 -6.90724e+00 0.00000e+00 0.00000e+00 1.35589e+02 225.603 4.80801e-01 225.603 0.9468 
1 1 1 -17 19  5  o 7  6.52064e+00 1.72036e+00 1.14591e+02 116.043 -3.06120e+00 6.26453e+00  0.00000e+00 0.00000e+00 1.16126e+02 116.043 1.53466e+00 116.043 0.9252 
1 1 1 -17 19  6  o 1  6.22799e+00 1.67452e+00 7.39264e+01 277.705 6.26815e-01  -4.63318e+00 0.00000e+00 0.00000e+00 1.36704e+02 277.705 6.27778e+01 277.705 0.8853 
1 1 1 -17 19  7  o 12 4.91557e+00 1.58710e+00 1.43024e+02 106.042 -2.10086e+00 7.30609e+00  0.00000e+00 0.00000e+00 3.17505e+01 106.042 1.11273e+02 286.042 0.9317 
1 1 1 -17 19  8  o 11 4.60579e+00 1.53425e+00 1.02951e+02 345.646 5.39957e+00  -1.38175e+00 0.00000e+00 0.00000e+00 5.59662e+01 345.646 4.69848e+01 165.646 0.9052 
1 1 1 -17 19  9  o 9  3.92015e+00 1.35175e+00 7.26131e+01 106.302 -1.07517e+00 3.67638e+00  0.00000e+00 0.00000e+00 5.52438e+01 106.302 1.73693e+01 286.302 0.8567 
1 1 1 -17 20  1  o 3  7.85541e+00 1.68841e+00 9.48351e+01 104.965 -1.82657e+00 6.83347e+00  0.00000e+00 0.00000e+00 1.84399e+02 104.965 8.95643e+01 104.965 0.9263 
1 1 1 -17 20  2  o 18 8.59487e+00 1.64496e+00 1.10638e+02 205.161 -8.39138e+00 -3.94177e+00 0.00000e+00 0.00000e+00 2.00603e+02 205.161 8.99658e+01 205.161 0.9444 
1 1 1 -17 20  3  o 5  4.38955e+00 1.39342e+00 8.66731e+01 135.948 -2.95838e+00 2.86203e+00  0.00000e+00 0.00000e+00 5.92723e+01 135.948 2.74008e+01 315.948 0.8678 
1 1 1 -17 20  4  o 6  4.99897e+00 1.52531e+00 2.73158e+01 314.135 9.77487e-01  -1.00745e+00 0.00000e+00 0.00000e+00 8.20218e+01 314.135 5.47060e+01 314.135 0.5714 
1 1 1 -17 20  5  o 12 1.27317e+01 1.59104e+00 3.05665e+02 166.799 -3.82573e+01 8.97402e+00  0.00000e+00 0.00000e+00 1.74961e+02 166.799 1.30704e+02 346.799 0.9872 
1 1 1 -17 20  6  o 3  4.11927e+00 1.34667e+00 3.82785e+01 297.994 8.93499e-01  -1.68083e+00 0.00000e+00 0.00000e+00 6.89285e+01 297.994 3.06500e+01 297.994 0.6813 
1 1 1 -17 20  7  o 15 4.44422e+00 1.48800e+00 1.07564e+02 89.975  2.40206e-03  5.59760e+00  0.00000e+00 0.00000e+00 4.60194e+01 89.975  6.15449e+01 269.975 0.9056 
1 1 1 -17 20  8  o 10 6.16907e+00 1.84095e+00 4.50717e+01 63.167  1.19704e+00  2.36636e+00  0.00000e+00 0.00000e+00 1.38469e+02 63.167  9.33978e+01 63.167  0.7806 
1 1 1 -17 20  9  o 5  8.11444e+00 2.07598e+00 1.29500e+02 317.195 6.38834e+00  -5.91664e+00 0.00000e+00 0.00000e+00 1.61097e+02 317.195 3.15972e+01 317.195 0.9407 
1 1 1 -17 21  1  o 11 8.98922e+00 1.68819e+00 1.49733e+02 73.105  3.71257e+00  1.22236e+01  0.00000e+00 0.00000e+00 1.81405e+02 73.105  3.16715e+01 73.105  0.9600 
1 1 1 -17 21  2  o 8  1.15557e+01 1.55918e+00 1.88793e+02 232.751 -1.29802e+01 -1.70707e+01 0.00000e+00 0.00000e+00 2.43809e+02 232.751 5.50169e+01 232.751 0.9764 
1 1 1 -17 21  3  o 4  1.44253e+01 1.36389e+00 2.81756e+02 41.056  3.67316e+01  3.19931e+01  0.00000e+00 0.00000e+00 2.65162e+02 41.056  1.65947e+01 221.056 0.9897 
1 1 1 -17 21  4  o 17 8.01643e+00 1.72852e+00 1.94100e+02 229.545 -9.17799e+00 -1.07630e+01 0.00000e+00 0.00000e+00 1.01674e+02 229.545 9.24255e+01 49.545  0.9640 
1 1 1 -17 21  5  o 9  6.14548e+00 1.65211e+00 1.06331e+02 53.390  3.97525e+00  5.35068e+00  0.00000e+00 0.00000e+00 1.10237e+02 53.390  3.90624e+00 53.390  0.9216 
1 1 1 -17 21  6  f 0  5.16904e+00 1.51768e+00 1.34786e+02 315.492 5.38564e+00  -5.29401e+00 0.00000e+00 0.00000e+00 4.90857e+01 315.492 8.57003e+01 135.492 0.9312 
1 1 1 -17 21  7  o 1  4.72667e+00 1.53486e+00 1.10689e+02 11.171  5.82236e+00  1.14981e+00  0.00000e+00 0.00000e+00 5.36773e+01 11.171  5.70121e+01 191.171 0.9113 
1 1 1 -17 21  8  o 1  4.70043e+00 1.55713e+00 4.77564e+01 166.122 -2.38389e+00 5.88982e-01  0.00000e+00 0.00000e+00 8.84129e+01 166.122 4.06566e+01 166.122 0.7601 
1 1 1 -17 21  9  o 17 7.09845e+00 1.91828e+00 1.46087e+01 219.489 -7.35952e-01 -6.06435e-01 0.00000e+00 0.00000e+00 1.01511e+02 219.489 8.69021e+01 219.489 0.4297 
1 1 1 -17 22  1  o 12 5.10454e+00 1.50082e+00 6.92658e+01 27.966  3.17576e+00  1.68618e+00  0.00000e+00 0.00000e+00 9.64175e+01 27.966  2.71518e+01 27.966  0.8459 
1 1 1 -17 22  2  f 0  5.75479e+00 1.60225e+00 4.16017e+01 85.248  1.89968e-01  2.28513e+00  0.00000e+00 0.00000e+00 1.21772e+02 85.248  8.01705e+01 85.248  0.7405 
1 1 1 -17 22  3  o 15 4.45670e+00 1.40299e+00 7.90925e+01 286.078 1.14092e+00  -3.95842e+00 0.00000e+00 0.00000e+00 6.90890e+01 286.078 1.00035e+01 106.078 0.8680 
1 1 1 -17 22  4  o 19 1.02824e+01 1.61185e+00 2.09548e+02 141.082 -1.73873e+01 1.40388e+01  0.00000e+00 0.00000e+00 1.75078e+02 141.082 3.44702e+01 321.082 0.9774 
1 1 1 -17 22  5  o 2  6.81169e+00 1.70985e+00 1.61963e+02 80.478  1.79289e+00  1.06886e+01  0.00000e+00 0.00000e+00 8.61640e+01 80.478  7.57989e+01 260.478 0.9527 
1 1 1 -17 22  6  o 15 4.54926e+00 1.43142e+00 1.17361e+02 279.360 1.05213e+00  -6.38276e+00 0.00000e+00 0.00000e+00 4.23448e+01 279.360 7.50158e+01 99.360  0.9191 
1 1 1 -17 22  7  o 18 5.49963e+00 1.66695e+00 1.22984e+02 72.489  2.02627e+00  6.42203e+00  0.00000e+00 0.00000e+00 7.05805e+01 72.489  5.24037e+01 252.488 0.9224 
1 1 1 -17 22  8  o 12 6.29112e+00 1.84618e+00 1.53981e+02 35.456  7.15844e+00  5.09772e+00  0.00000e+00 0.00000e+00 7.17006e+01 35.456  8.22801e+01 215.456 0.9413 
1 1 1 -17 22  9  o 5  4.81407e+00 1.58246e+00 8.79750e+01 112.375 -1.91951e+00 4.66286e+00  0.00000e+00 0.00000e+00 7.59179e+01 112.375 1.20571e+01 292.375 0.8944 
1 1 1 -17 23  1  o 12 3.63822e+00 1.20417e+00 6.55439e+01 208.328 -2.52863e+00 -1.36315e+00 0.00000e+00 0.00000e+00 4.61401e+01 208.328 1.94037e+01 28.328  0.8001 
1 1 1 -17 23  2  o 11 5.08226e+00 1.53589e+00 5.32003e+01 311.784 1.93726e+00  -2.16796e+00 0.00000e+00 0.00000e+00 1.03234e+02 311.784 5.00340e+01 311.784 0.8029 
1 1 1 -17 23  3  o 3  8.35582e+00 1.68650e+00 7.54648e+01 305.437 3.41194e+00  -4.79450e+00 0.00000e+00 0.00000e+00 2.15964e+02 305.437 1.40499e+02 305.437 0.9105 
1 1 1 -17 23  4  o 12 5.73363e+00 1.61490e+00 1.58339e+02 244.036 -4.11192e+00 -8.44401e+00 0.00000e+00 0.00000e+00 4.90550e+01 244.036 1.09284e+02 64.036  0.9452 
1 1 1 -17 23  5  o 15 4.76198e+00 1.46781e+00 7.77056e+01 146.724 -3.54420e+00 2.32598e+00  0.00000e+00 0.00000e+00 8.10804e+01 146.724 3.37483e+00 146.724 0.8721 
1 1 1 -17 23  6  o 8  1.34127e+01 1.46732e+00 2.28906e+02 292.588 1.39420e+01  -3.35136e+01 0.00000e+00 0.00000e+00 2.76277e+02 292.588 4.73713e+01 292.588 0.9861 
1 1 1 -17 23  7  o 14 7.94638e+00 2.01338e+00 2.34602e+02 80.444  2.47908e+00  1.47257e+01  0.00000e+00 0.00000e+00 5.82421e+01 80.444  1.76360e+02 260.444 0.9659 
1 1 1 -17 23  8  o 4  9.40685e+00 2.08527e+00 2.44381e+02 214.454 -1.51832e+01 -1.04171e+01 0.00000e+00 0.00000e+00 1.04234e+02 214.454 1.40147e+02 34.454  0.9725 
1 1 1 -17 23  9  o 9  6.99460e+00 1.90173e+00 1.32420e+02 0.111   8.80319e+00  1.70035e-02  0.00000e+00 0.00000e+00 1.18208e+02 0.111   1.42122e+01 180.111 0.9414 
1 1 1 -17 24  1  o 1  4.26438e+00 1.36551e+00 1.03276e+02 186.078 -5.24192e+00 -5.58209e-01 0.00000e+00 0.00000e+00 4.38520e+01 186.078 5.94238e+01 6.078   0.8993 
1 1 1 -17 24  2  f 0  5.28582e+00 1.54635e+00 6.44120e+01 76.209  8.66446e-01  3.52991e+00  0.00000e+00 0.00000e+00 1.07384e+02 76.209  4.29720e+01 76.209  0.8478 
1 1 1 -17 24  3  o 1  1.48531e+01 1.23937e+00 2.08925e+02 43.268  2.74950e+01  2.58808e+01  0.00000e+00 0.00000e+00 3.52395e+02 43.268  1.43470e+02 43.268  0.9867 
1 1 1 -17 24  4  o 19 6.95510e+00 1.54905e+00 6.35488e+01 97.109  -5.67038e-01 4.54693e+00  0.00000e+00 0.00000e+00 1.71386e+02 97.109  1.07837e+02 97.109  0.8827 
1 1 1 -17 24  5  o 16 6.05600e+00 1.66015e+00 7.42912e+01 30.321  3.92857e+00  2.29759e+00  0.00000e+00 0.00000e+00 1.29872e+02 30.321  5.55809e+01 30.321  0.8818 
1 1 1 -17 24  6  o 1  3.41616e+00 1.17683e+00 4.12395e+01 156.893 -1.92221e+00 8.20154e-01  0.00000e+00 0.00000e+00 5.16538e+01 156.893 1.04143e+01 156.893 0.7120 
1 1 1 -17 24  7  o 4  5.06015e+00 1.61637e+00 1.07449e+02 234.537 -3.42570e+00 -4.80920e+00 0.00000e+00 0.00000e+00 6.83889e+01 234.537 3.90596e+01 54.537  0.9109 
1 1 1 -17 24  8  o 16 6.85189e+00 1.95583e+00 9.89890e+01 150.086 -5.11455e+00 2.94264e+00  0.00000e+00 0.00000e+00 1.38822e+02 150.086 3.98331e+01 150.086 0.9108 
1 1 1 -17 24  9  o 15 4.65259e+00 1.51236e+00 8.06471e+01 35.598  3.80022e+00  2.72048e+00  0.00000e+00 0.00000e+00 7.61100e+01 35.598  4.53710e+00 215.598 0.8852 
1 1 1 -17 25  1  o 4  4.71825e+00 1.45632e+00 6.65410e+01 101.680 -6.81467e-01 3.29647e+00  0.00000e+00 0.00000e+00 8.43749e+01 101.680 1.78339e+01 101.680 0.8338 
1 1 1 -17 25  2  o 1  6.27601e+00 1.59430e+00 1.19205e+02 190.330 -7.25985e+00 -1.32331e+00 0.00000e+00 0.00000e+00 1.04414e+02 190.330 1.47914e+01 10.330  0.9295 
1 1 1 -17 25  3  o 19 6.85667e+00 1.53579e+00 4.24424e+01 197.370 -3.02467e+00 -9.46141e-01 0.00000e+00 0.00000e+00 1.73356e+02 197.370 1.30914e+02 197.370 0.8218 
1 1 1 -17 25  4  o 17 4.88262e+00 1.43278e+00 9.98730e+01 159.873 -5.38289e+00 1.97278e+00  0.00000e+00 0.00000e+00 6.97721e+01 159.873 3.01009e+01 339.873 0.9080 
1 1 1 -17 25  5  o 18 5.13253e+00 1.50907e+00 5.48975e+01 100.224 -5.65741e-01 3.13669e+00  0.00000e+00 0.00000e+00 1.06568e+02 100.224 5.16710e+01 100.224 0.8229 
1 1 1 -17 25  6  o 15 5.18609e+00 1.47263e+00 1.44983e+02 218.040 -7.18428e+00 -5.62104e+00 0.00000e+00 0.00000e+00 4.18770e+01 218.040 1.03106e+02 38.040  0.9435 
1 1 1 -17 25  7  o 11 4.43404e+00 1.43689e+00 9.15895e+01 248.068 -1.85666e+00 -4.61121e+00 0.00000e+00 0.00000e+00 5.94115e+01 248.068 3.21780e+01 68.068  0.8927 
1 1 1 -17 25  8  o 18 6.69850e+00 1.98897e+00 1.17963e+02 146.292 -5.64744e+00 3.76747e+00  0.00000e+00 0.00000e+00 1.17650e+02 146.292 3.13172e-01 326.292 0.9231 
1 1 1 -17 25  9  o 11 4.95536e+00 1.60975e+00 1.01767e+02 221.208 -4.46607e+00 -3.91092e+00 0.00000e+00 0.00000e+00 7.01096e+01 221.208 3.16573e+01 41.208  0.9114 
1 1 1 -17 26  1  o 12 8.77013e+00 1.62678e+00 1.36767e+02 47.227  7.87480e+00  8.51219e+00  0.00000e+00 0.00000e+00 1.84794e+02 47.227  4.80265e+01 47.227  0.9559 
1 1 1 -17 26  2  o 8  4.02556e+00 1.31856e+00 1.36094e+02 110.343 -2.21269e+00 5.96778e+00  0.00000e+00 0.00000e+00 5.49956e+00 110.343 1.30595e+02 290.343 0.9177 
1 1 1 -17 26  3  o 6  5.01094e+00 1.49946e+00 4.04164e+01 94.575  -1.79949e-01 2.24857e+00  0.00000e+00 0.00000e+00 1.00749e+02 94.575  6.03324e+01 94.575  0.7356 
1 1 1 -17 26  4  o 3  1.05271e+01 1.46516e+00 1.60541e+02 199.393 -1.83415e+01 -6.45652e+00 0.00000e+00 0.00000e+00 2.31755e+02 199.393 7.12134e+01 199.393 0.9739 
1 1 1 -17 26  5  o 9  6.12921e+00 1.45971e+00 1.20818e+02 284.734 2.11871e+00  -8.05670e+00 0.00000e+00 0.00000e+00 9.89269e+01 284.734 2.18914e+01 104.734 0.9379 
1 1 1 -17 26  6  o 18 4.39089e+00 1.39691e+00 5.48483e+01 106.967 -8.61077e-01 2.82232e+00  0.00000e+00 0.00000e+00 8.03430e+01 106.967 2.54948e+01 106.967 0.8063 
1 1 1 -17 26  7  o 19 4.93166e+00 1.50032e+00 4.49818e+01 208.625 -2.26245e+00 -1.23482e+00 0.00000e+00 0.00000e+00 1.00467e+02 208.625 5.54852e+01 208.625 0.7732 
1 1 1 -17 26  8  f 0  6.45514e+00 1.85721e+00 1.23139e+02 62.727  3.44002e+00  6.67252e+00  0.00000e+00 0.00000e+00 1.05792e+02 62.727  1.73471e+01 242.727 0.9308 
1 1 1 -17 26  9  o 5  4.00421e+00 1.38200e+00 6.50882e+01 15.841  3.48033e+00  9.87534e-01  0.00000e+00 0.00000e+00 6.39846e+01 15.841  1.10362e+00 195.841 0.8470 
1 1 1 -17 27  1  o 16 3.93563e+00 1.28888e+00 7.62480e+01 205.367 -3.45645e+00 -1.63881e+00 0.00000e+00 0.00000e+00 5.30373e+01 205.367 2.32107e+01 25.367  0.8565 
1 1 1 -17 27  2  o 19 7.09471e+00 1.68479e+00 1.52520e+02 171.325 -1.05863e+01 1.61515e+00  0.00000e+00 0.00000e+00 1.06368e+02 171.325 4.61524e+01 351.325 0.9521 
1 1 1 -17 27  3  o 6  3.97142e+00 1.30116e+00 7.75895e+01 192.371 -3.62915e+00 -7.95981e-01 0.00000e+00 0.00000e+00 5.19250e+01 192.371 2.56645e+01 12.371  0.8516 
1 1 1 -17 27  4  o 5  6.55321e+00 1.55712e+00 6.97399e+01 25.965  4.44514e+00  2.16472e+00  0.00000e+00 0.00000e+00 1.53924e+02 25.965  8.41838e+01 25.965  0.8921 
1 1 1 -17 27  5  o 12 4.71242e+00 1.39742e+00 1.28078e+02 121.121 -3.64522e+00 6.03779e+00  0.00000e+00 0.00000e+00 3.87365e+01 121.121 8.93416e+01 301.121 0.9261 
1 1 1 -17 27  6  o 19 4.93475e+00 1.45178e+00 1.08524e+02 98.681  -9.69678e-01 6.35115e+00  0.00000e+00 0.00000e+00 6.45450e+01 98.681  4.39792e+01 278.681 0.9185 
1 1 1 -17 27  7  o 14 4.91246e+00 1.52279e+00 1.23935e+02 308.766 4.51830e+00  -5.62644e+00 0.00000e+00 0.00000e+00 4.99234e+01 308.766 7.40115e+01 128.766 0.9279 
1 1 1 -17 27  8  o 2  9.94439e+00 2.00660e+00 2.04036e+02 111.251 -6.28788e+00 1.61685e+01  0.00000e+00 0.00000e+00 1.63748e+02 111.251 4.02879e+01 291.251 0.9707 
1 1 1 -17 27  9  o 5  4.94071e+00 1.60635e+00 5.98914e+01 310.338 2.32578e+00  -2.73875e+00 0.00000e+00 0.00000e+00 9.91306e+01 310.338 3.92392e+01 310.338 0.8458 
1 1 1 -17 28  1  o 19 4.55469e+00 1.31048e+00 5.16601e+01 319.550 2.24950e+00  -1.91788e+00 0.00000e+00 0.00000e+00 8.92568e+01 319.550 3.75967e+01 319.550 0.8067 
1 1 1 -17 28  2  o 6  1.08202e+01 1.53928e+00 1.49385e+02 66.393  6.75394e+00  1.54540e+01  0.00000e+00 0.00000e+00 2.52792e+02 66.393  1.03408e+02 66.393  0.9699 
1 1 1 -17 28  3  o 7  5.95503e+00 1.60967e+00 1.40465e+02 193.579 -8.52548e+00 -2.05923e+00 0.00000e+00 0.00000e+00 7.41371e+01 193.579 6.63281e+01 13.579  0.9411 
1 1 1 -17 28  4  o 19 5.57703e+00 1.55385e+00 1.09873e+02 140.220 -5.10085e+00 4.24678e+00  0.00000e+00 0.00000e+00 8.66821e+01 140.220 2.31913e+01 320.220 0.9212 
1 1 1 -17 28  5  f 0  7.49773e+00 1.71865e+00 1.59626e+02 345.973 1.16279e+01  -2.90496e+00 0.00000e+00 0.00000e+00 1.14710e+02 345.973 4.49158e+01 165.973 0.9573 
1 1 1 -17 28  6  o 13 5.45274e+00 1.58013e+00 4.82841e+01 91.618  -8.18392e-02 2.89659e+00  0.00000e+00 0.00000e+00 1.18713e+02 91.618  7.04285e+01 91.618  0.8021 
1 1 1 -17 28  7  o 13 8.73297e+00 1.75527e+00 1.90784e+02 338.486 1.56620e+01  -6.17383e+00 0.00000e+00 0.00000e+00 1.32240e+02 338.486 5.85448e+01 158.486 0.9698 
1 1 1 -17 28  8  o 10 8.00465e+00 2.03211e+00 1.61465e+02 225.737 -7.63788e+00 -7.83698e+00 0.00000e+00 0.00000e+00 1.29195e+02 225.737 3.22703e+01 45.737  0.9532 
1 1 1 -17 28  9  o 10 5.15147e+00 1.69706e+00 6.19865e+01 13.942  3.51697e+00  8.73130e-01  0.00000e+00 0.00000e+00 1.04100e+02 13.942  4.21131e+01 13.942  0.8473 
1 1 1 -17 29  1  o 5  4.30570e+00 1.37076e+00 4.47981e+01 117.710 -1.03707e+00 1.97448e+00  0.00000e+00 0.00000e+00 7.61033e+01 117.710 3.13052e+01 117.710 0.7322 
1 1 1 -17 29  2  o 10 8.63050e+00 1.68965e+00 1.89862e+02 237.856 -8.28506e+00 -1.31852e+01 0.00000e+00 0.00000e+00 1.30059e+02 237.856 5.98033e+01 57.856  0.9673 
1 1 1 -17 29  3  o 5  5.16847e+00 1.49946e+00 5.41575e+01 19.115  2.97568e+00  1.03128e+00  0.00000e+00 0.00000e+00 1.08201e+02 19.115  5.40439e+01 19.115  0.8204 
1 1 1 -17 29  4  o 5  8.02899e+00 1.70868e+00 1.62213e+02 85.531  1.00786e+00  1.28952e+01  0.00000e+00 0.00000e+00 1.32803e+02 85.531  2.94094e+01 265.531 0.9605 
1 1 1 -17 29  5  o 12 1.10079e+01 1.53176e+00 1.67098e+02 17.915  2.04075e+01  6.59735e+00  0.00000e+00 0.00000e+00 2.43662e+02 17.915  7.65638e+01 17.915  0.9764 
1 1 1 -17 29  6  o 12 4.53128e+00 1.42903e+00 6.97266e+01 338.445 3.40050e+00  -1.34327e+00 0.00000e+00 0.00000e+00 7.71229e+01 338.445 7.39639e+00 338.445 0.8489 
1 1 1 -17 29  7  o 19 6.55350e+00 1.69711e+00 1.23273e+02 134.670 -5.67386e+00 5.73962e+00  0.00000e+00 0.00000e+00 1.10617e+02 134.670 1.26560e+01 314.670 0.9358 
1 1 1 -17 29  8  o 15 4.26818e+00 1.44409e+00 5.26765e+01 330.460 2.49774e+00  -1.41546e+00 0.00000e+00 0.00000e+00 7.73896e+01 330.460 2.47131e+01 330.460 0.8000 
1 1 1 -17 29  9  o 18 5.36481e+00 1.71229e+00 1.13309e+02 265.525 -5.17936e-01 -6.61775e+00 0.00000e+00 0.00000e+00 7.47336e+01 265.525 3.85755e+01 85.525  0.9213 
1 1 1 -17 30  1  o 5  9.31085e+00 1.59323e+00 9.91706e+01 308.837 6.13515e+00  -7.62052e+00 0.00000e+00 0.00000e+00 2.39100e+02 308.837 1.39930e+02 308.837 0.9474 
1 1 1 -17 30  2  o 16 5.39754e+00 1.53241e+00 1.36306e+02 234.105 -4.75259e+00 -6.56659e+00 0.00000e+00 0.00000e+00 5.73003e+01 234.105 7.90056e+01 54.105  0.9361 
1 1 1 -17 30  3  o 11 5.34664e+00 1.52326e+00 1.02338e+02 90.509  -5.36893e-02 6.04758e+00  0.00000e+00 0.00000e+00 8.45692e+01 90.509  1.77692e+01 270.509 0.9131 
1 1 1 -17 30  4  o 7  4.20077e+00 1.33690e+00 4.54719e+01 305.362 1.34260e+00  -1.89190e+00 0.00000e+00 0.00000e+00 7.40597e+01 305.362 2.85878e+01 305.362 0.7439 
1 1 1 -17 30  5  o 13 4.44015e+00 1.36765e+00 5.82982e+01 249.767 -1.16666e+00 -3.16536e+00 0.00000e+00 0.00000e+00 8.32475e+01 249.767 2.49493e+01 249.767 0.8342 
1 1 1 -17 30  6  o 11 6.35768e+00 1.63517e+00 1.35018e+02 251.216 -2.96463e+00 -8.71642e+00 0.00000e+00 0.00000e+00 9.41002e+01 251.216 4.09174e+01 71.216  0.9440 
1 1 1 -17 30  7  o 12 5.23270e+00 1.58387e+00 1.59798e+02 256.756 -2.13440e+00 -9.06863e+00 0.00000e+00 0.00000e+00 2.87096e+01 256.756 1.31089e+02 76.756  0.9447 
1 1 1 -17 30  8  o 1  4.89107e+00 1.53714e+00 6.82537e+01 212.285 -3.37301e+00 -2.13112e+00 0.00000e+00 0.00000e+00 9.25486e+01 212.285 2.42949e+01 212.285 0.8631 
1 1 1 -17 30  9  f 0  6.52094e+00 1.94622e+00 7.99447e+01 70.252  1.62728e+00  4.53280e+00  0.00000e+00 0.00000e+00 1.40586e+02 70.252  6.06411e+01 70.252  0.8889 
1 1 1 -17 31  1  o 2  4.26258e+00 1.35496e+00 6.08149e+01 192.421 -3.12077e+00 -6.87365e-01 0.00000e+00 0.00000e+00 7.37746e+01 192.421 1.29597e+01 192.421 0.8235 
1 1 1 -17 31  2  o 8  5.84099e+00 1.58065e+00 7.88611e+01 180.881 -4.90746e+00 -7.55084e-02 0.00000e+00 0.00000e+00 1.20583e+02 180.881 4.17220e+01 180.881 0.8912 
1 1 1 -17 31  3  o 5  5.64255e+00 1.57145e+00 4.97753e+01 195.853 -2.93503e+00 -8.33475e-01 0.00000e+00 0.00000e+00 1.25988e+02 195.853 7.62126e+01 195.853 0.8137 
1 1 1 -17 31  4  o 11 4.15509e+00 1.32202e+00 3.19088e+01 350.020 1.70120e+00  -2.99349e-01 0.00000e+00 0.00000e+00 7.09962e+01 350.020 3.90874e+01 350.020 0.6475 
1 1 1 -17 31  5  o 8  4.71139e+00 1.43961e+00 1.05020e+02 238.620 -3.06941e+00 -5.03237e+00 0.00000e+00 0.00000e+00 5.89270e+01 238.620 4.60933e+01 58.620  0.9107 
1 1 1 -17 31  6  o 2  3.76378e+00 1.25632e+00 5.07982e+01 159.515 -2.47342e+00 9.24050e-01  0.00000e+00 0.00000e+00 6.11843e+01 159.515 1.03860e+01 159.515 0.7794 
1 1 1 -17 31  7  o 12 4.85929e+00 1.51756e+00 1.26500e+02 272.397 2.99179e-01  -7.14811e+00 0.00000e+00 0.00000e+00 4.53008e+01 272.397 8.11995e+01 92.397  0.9272 
1 1 1 -17 31  8  o 10 5.29602e+00 1.64491e+00 4.96051e+01 101.393 -5.90726e-01 2.93154e+00  0.00000e+00 0.00000e+00 1.13634e+02 101.393 6.40284e+01 101.393 0.8093 
1 1 1 -17 31  9  o 1  6.11920e+00 1.86147e+00 1.00539e+02 258.686 -1.18116e+00 -5.90378e+00 0.00000e+00 0.00000e+00 1.11915e+02 258.686 1.13762e+01 258.686 0.9127 
1 1 1 -17 32  1  o 4  4.14563e+00 1.28459e+00 6.23435e+01 85.479  2.62344e-01  3.31794e+00  0.00000e+00 0.00000e+00 6.98362e+01 85.479  7.49271e+00 85.479  0.8316 
1 1 1 -17 32  2  o 2  4.25246e+00 1.34744e+00 5.59471e+01 191.039 -2.93702e+00 -5.72965e-01 0.00000e+00 0.00000e+00 7.59193e+01 191.039 1.99723e+01 191.039 0.8094 
1 1 1 -17 32  3  o 18 9.33206e+00 1.55140e+00 1.57295e+02 196.473 -1.49512e+01 -4.42106e+00 0.00000e+00 0.00000e+00 1.88269e+02 196.473 3.09740e+01 196.473 0.9674 
1 1 1 -17 32  4  o 15 5.98682e+00 1.50721e+00 7.83268e+01 99.938  -9.31694e-01 5.31735e+00  0.00000e+00 0.00000e+00 1.28166e+02 99.938  4.98388e+01 99.938  0.9019 
1 1 1 -17 32  5  o 7  5.95087e+00 1.59496e+00 6.21296e+01 165.208 -3.89766e+00 1.02921e+00  0.00000e+00 0.00000e+00 1.34478e+02 165.208 7.23488e+01 165.208 0.8647 
1 1 1 -17 32  6  o 6  7.31399e+00 1.66842e+00 1.07390e+02 357.862 8.15542e+00  -3.04505e-01 0.00000e+00 0.00000e+00 1.54065e+02 357.862 4.66742e+01 357.862 0.9366 
1 1 1 -17 32  7  o 4  7.28063e+00 1.70386e+00 1.72358e+02 180.485 -1.30250e+01 -1.10192e-01 0.00000e+00 0.00000e+00 9.43536e+01 180.485 7.80042e+01 0.485   0.9608 
1 1 1 -17 32  8  o 5  5.71104e+00 1.74133e+00 1.41314e+02 55.247  4.87074e+00  7.02025e+00  0.00000e+00 0.00000e+00 6.30284e+01 55.247  7.82859e+01 235.246 0.9395 
1 1 1 -17 32  9  o 19 6.65901e+00 1.96360e+00 1.31071e+02 227.118 -5.60214e+00 -6.03235e+00 0.00000e+00 0.00000e+00 1.06300e+02 227.118 2.47705e+01 47.118  0.9371 
1 1 1 -17 33  1  o 18 4.25309e+00 1.33019e+00 2.34326e+01 323.556 1.01916e+00  -7.52593e-01 0.00000e+00 0.00000e+00 6.34766e+01 323.556 4.00440e+01 323.556 0.5330 
1 1 1 -17 33  2  o 1  4.76143e+00 1.41939e+00 6.66850e+01 2.674   3.80328e+00  1.77629e-01  0.00000e+00 0.00000e+00 8.93897e+01 2.674   2.27047e+01 2.674   0.8557 
1 1 1 -17 33  3  o 6  4.56270e+00 1.41555e+00 9.93962e+01 277.785 7.09879e-01  -5.19221e+00 0.00000e+00 0.00000e+00 5.75468e+01 277.785 4.18494e+01 97.785  0.8987 
1 1 1 -17 33  4  o 13 6.01273e+00 1.40283e+00 1.14673e+02 215.888 -7.10982e+00 -5.14438e+00 0.00000e+00 0.00000e+00 1.01732e+02 215.888 1.29419e+01 35.888  0.9412 
1 1 1 -17 33  5  f 0  1.40972e+01 1.27383e+00 1.65306e+02 35.530  2.42051e+01  1.72845e+01  0.00000e+00 0.00000e+00 3.64132e+02 35.530  1.98826e+02 35.530  0.9830 
1 1 1 -17 33  6  o 8  6.48178e+00 1.48571e+00 1.64942e+02 121.755 -6.83927e+00 1.10499e+01  0.00000e+00 0.00000e+00 7.27175e+01 121.755 9.22250e+01 301.755 0.9607 
1 1 1 -17 33  7  o 7  6.38426e+00 1.61354e+00 5.91069e+01 23.432  3.85582e+00  1.67114e+00  0.00000e+00 0.00000e+00 1.52857e+02 23.432  9.37505e+01 23.432  0.8709 
1 1 1 -17 33  8  o 1  5.94787e+00 1.58235e+00 9.56842e+01 291.044 2.45355e+00  -6.37721e+00 0.00000e+00 0.00000e+00 1.13511e+02 291.044 1.78271e+01 291.044 0.9236 
1 1 1 -17 33  9  o 11 4.57846e+00 1.51347e+00 3.32086e+01 95.857  -2.02296e-01 1.97199e+00  0.00000e+00 0.00000e+00 8.77921e+01 95.857  5.45834e+01 95.857  0.6949 
1 1 1 -17 34  1  o 9  5.62453e+00 1.59523e+00 1.57853e+02 118.107 -4.31958e+00 8.08759e+00  0.00000e+00 0.00000e+00 4.56334e+01 118.107 1.12220e+02 298.107 0.9438 
1 1 1 -17 34  2  o 18 9.62010e+00 1.61422e+00 1.68657e+02 3.194   1.65247e+01  9.22148e-01  0.00000e+00 0.00000e+00 1.88517e+02 3.194   1.98600e+01 3.194   0.9693 
1 1 1 -17 34  3  o 8  3.88808e+00 1.28761e+00 7.17113e+01 221.089 -2.79824e+00 -2.44010e+00 0.00000e+00 0.00000e+00 5.49928e+01 221.089 1.67185e+01 41.089  0.8515 
1 1 1 -17 34  4  o 10 1.05336e+01 1.44828e+00 1.09227e+02 110.447 -4.76250e+00 1.27739e+01  0.00000e+00 0.00000e+00 2.78483e+02 110.447 1.69257e+02 110.447 0.9626 
1 1 1 -17 34  5  o 18 6.15012e+00 1.43980e+00 1.12388e+02 298.625 3.80298e+00  -6.96792e+00 0.00000e+00 0.00000e+00 1.07211e+02 298.625 5.17637e+00 118.625 0.9347 
1 1 1 -17 34  6  o 2  6.47811e+00 1.61991e+00 7.73236e+01 314.729 3.70360e+00  -3.73877e+00 0.00000e+00 0.00000e+00 1.44956e+02 314.729 6.76326e+01 314.729 0.8991 
1 1 1 -17 34  7  o 17 4.19755e+00 1.34967e+00 8.30881e+01 49.629  3.04861e+00  3.58575e+00  0.00000e+00 0.00000e+00 5.86986e+01 49.629  2.43895e+01 229.629 0.8861 
1 1 1 -17 34  8  o 3  5.33165e+00 1.64282e+00 1.00549e+02 228.169 -4.10581e+00 -4.58717e+00 0.00000e+00 0.00000e+00 8.51506e+01 228.169 1.53980e+01 48.169  0.9147 
1 1 1 -17 35  1  o 7  5.24558e+00 1.44927e+00 4.14074e+01 221.220 -1.95638e+00 -1.71389e+00 0.00000e+00 0.00000e+00 1.14525e+02 221.220 7.31177e+01 221.220 0.7755 
1 1 1 -17 35  2  o 11 6.56168e+00 1.63481e+00 1.24010e+02 48.967  5.65293e+00  6.49537e+00  0.00000e+00 0.00000e+00 1.12224e+02 48.967  1.17858e+01 228.967 0.9400 
1 1 1 -17 35  3  o 3  5.91082e+00 1.55010e+00 1.06404e+02 170.344 -7.13694e+00 1.21426e+00  0.00000e+00 0.00000e+00 1.03531e+02 170.344 2.87222e+00 350.344 0.9281 
1 1 1 -17 35  4  o 4  4.37078e+00 1.38961e+00 9.51893e+01 192.054 -5.08668e+00 -1.08625e+00 0.00000e+00 0.00000e+00 5.48514e+01 192.054 4.03379e+01 12.054  0.8979 
1 1 1 -17 35  5  o 18 6.29549e+00 1.61158e+00 1.41090e+02 37.241  7.69883e+00  5.85241e+00  0.00000e+00 0.00000e+00 8.65838e+01 37.241  5.45061e+01 217.241 0.9468 
1 1 1 -17 35  6  o 4  4.63668e+00 1.44603e+00 7.19772e+01 132.822 -2.66493e+00 2.87566e+00  0.00000e+00 0.00000e+00 8.02498e+01 132.822 8.27263e+00 132.822 0.8604 
1 1 1 -17 35  7  o 1  5.22178e+00 1.49364e+00 8.66907e+01 278.289 7.95843e-01  -5.46273e+00 0.00000e+00 0.00000e+00 9.32781e+01 278.289 6.58739e+00 278.289 0.9042 
1 1 1 -17 35  8  o 15 5.58212e+00 1.72137e+00 9.28678e+01 289.371 1.91721e+00  -5.45293e+00 0.00000e+00 0.00000e+00 1.00278e+02 289.371 7.41056e+00 289.371 0.9088 
1 1 1 -17 36  1  o 6  5.57352e+00 1.54608e+00 9.49798e+01 109.170 -2.00708e+00 5.77313e+00  0.00000e+00 0.00000e+00 1.00275e+02 109.170 5.29534e+00 109.170 0.9141 
1 1 1 -17 36  2  o 19 4.75138e+00 1.44405e+00 5.80308e+01 256.142 -8.17490e-01 -3.31370e+00 0.00000e+00 0.00000e+00 9.41662e+01 256.142 3.61354e+01 256.142 0.8364 
1 1 1 -17 36  3  o 3  7.72959e+00 1.64005e+00 1.32117e+02 187.132 -1.05868e+01 -1.32459e+00 0.00000e+00 0.00000e+00 1.49429e+02 187.132 1.73123e+01 187.132 0.9519 
1 1 1 -17 36  4  o 5  9.30333e+00 1.52628e+00 1.58744e+02 220.024 -1.28955e+01 -1.08297e+01 0.00000e+00 0.00000e+00 1.86194e+02 220.024 2.74497e+01 220.024 0.9698 
1 1 1 -17 36  5  o 7  6.82055e+00 1.60601e+00 5.62176e+01 178.328 -4.15044e+00 1.21156e-01  0.00000e+00 0.00000e+00 1.70189e+02 178.328 1.13972e+02 178.328 0.8691 
1 1 1 -17 36  6  f 0  5.24667e+00 1.43992e+00 1.51315e+02 307.832 5.97206e+00  -7.69019e+00 0.00000e+00 0.00000e+00 3.82916e+01 307.832 1.13023e+02 127.832 0.9472 
1 1 1 -17 36  7  o 8  4.42766e+00 1.41621e+00 1.09276e+02 154.437 -5.67868e+00 2.71627e+00  0.00000e+00 0.00000e+00 4.54200e+01 154.437 6.38559e+01 334.437 0.9167 
1 1 1 -17 36  8  o 12 5.25296e+00 1.67158e+00 1.38626e+02 33.988  6.78768e+00  4.57629e+00  0.00000e+00 0.00000e+00 4.87059e+01 33.988  8.99201e+01 213.988 0.9368 
1 1 1 -17 37  1  o 4  5.23898e+00 1.49155e+00 7.31789e+01 32.029  3.89202e+00  2.43476e+00  0.00000e+00 0.00000e+00 1.04089e+02 32.029  3.09100e+01 32.029  0.8829 
1 1 1 -17 37  2  o 16 9.54676e+00 1.55077e+00 1.07566e+02 218.504 -8.90423e+00 -7.08374e+00 0.00000e+00 0.00000e+00 2.41549e+02 218.504 1.33983e+02 218.504 0.9550 
1 1 1 -17 37  3  o 3  6.44668e+00 1.62374e+00 1.61563e+02 25.318  1.00720e+01  4.76486e+00  0.00000e+00 0.00000e+00 7.37469e+01 25.318  8.78160e+01 205.318 0.9540 
1 1 1 -17 37  4  o 1  7.98708e+00 1.50157e+00 9.44185e+01 20.080  7.82260e+00  2.85953e+00  0.00000e+00 0.00000e+00 1.91934e+02 20.080  9.75155e+01 20.080  0.9379 
1 1 1 -17 37  5  o 2  3.60032e+00 1.19768e+00 7.42793e+01 344.651 3.81946e+00  -1.04839e+00 0.00000e+00 0.00000e+00 4.42397e+01 344.651 3.00397e+01 164.651 0.8620 
1 1 1 -17 37  6  o 8  4.94635e+00 1.49780e+00 3.89278e+01 101.310 -4.50753e-01 2.25381e+00  0.00000e+00 0.00000e+00 1.00936e+02 101.310 6.20079e+01 101.310 0.7412 
1 1 1 -17 37  7  o 3  5.12463e+00 1.46184e+00 1.02972e+02 39.483  5.28739e+00  4.35601e+00  0.00000e+00 0.00000e+00 7.74463e+01 39.483  2.55259e+01 219.483 0.9238 
1 1 1 -17 37  8  o 12 5.20941e+00 1.62042e+00 1.03785e+02 197.684 -5.97893e+00 -1.90634e+00 0.00000e+00 0.00000e+00 7.79433e+01 197.684 2.58421e+01 17.685  0.9164 
1 1 1 -17 38  1  o 14 4.06700e+00 1.31981e+00 4.15720e+01 87.118  1.09531e-01  2.17549e+00  0.00000e+00 0.00000e+00 7.14090e+01 87.118  2.98370e+01 87.118  0.7250 
1 1 1 -17 38  2  o 5  5.45789e+00 1.56634e+00 1.35775e+02 190.442 -8.10059e+00 -1.49290e+00 0.00000e+00 0.00000e+00 6.00704e+01 190.442 7.57048e+01 10.442  0.9372 
1 1 1 -17 38  3  o 13 1.18096e+01 1.47718e+00 2.01678e+02 24.349  2.55638e+01  1.15691e+01  0.00000e+00 0.00000e+00 2.41992e+02 24.349  4.03137e+01 24.349  0.9820 
1 1 1 -17 38  4  o 19 1.07873e+01 1.49250e+00 1.64059e+02 201.024 -1.94807e+01 -7.48723e+00 0.00000e+00 0.00000e+00 2.38250e+02 201.024 7.41912e+01 201.024 0.9757 
1 1 1 -17 38  5  o 16 4.53285e+00 1.38856e+00 3.39822e+01 226.338 -1.29819e+00 -1.36029e+00 0.00000e+00 0.00000e+00 8.32180e+01 226.338 4.92358e+01 226.338 0.6771 
1 1 1 -17 38  6  o 2  6.52117e+00 1.58056e+00 8.16693e+01 197.197 -5.79346e+00 -1.79307e+00 0.00000e+00 0.00000e+00 1.45536e+02 197.197 6.38663e+01 197.197 0.9134 
1 1 1 -17 38  7  o 12 7.34484e+00 1.69678e+00 1.32393e+02 105.782 -2.88826e+00 1.02189e+01  0.00000e+00 0.00000e+00 1.33961e+02 105.782 1.56715e+00 105.782 0.9517 
1 1 1 -17 38  8  o 2  6.20710e+00 1.78698e+00 1.61208e+02 318.581 8.03453e+00  -7.08809e+00 0.00000e+00 0.00000e+00 6.37331e+01 318.581 9.74752e+01 138.581 0.9521 
1 1 1 -17 39  1  o 8  1.04300e+01 1.55101e+00 1.95183e+02 16.567  2.18930e+01  6.51282e+00  0.00000e+00 0.00000e+00 1.95586e+02 16.567  4.03147e-01 16.567  0.9779 
1 1 1 -17 39  2  o 17 5.01428e+00 1.42800e+00 1.28011e+02 161.812 -7.42442e+00 2.43929e+00  0.00000e+00 0.00000e+00 5.12187e+01 161.812 7.67921e+01 341.812 0.9336 
1 1 1 -17 39  3  o 11 9.08495e+00 1.57182e+00 1.41060e+02 288.116 4.20884e+00  -1.28645e+01 0.00000e+00 0.00000e+00 1.93368e+02 288.116 5.23082e+01 288.116 0.9623 
1 1 1 -17 39  4  o 9  7.82941e+00 1.62770e+00 1.25776e+02 162.279 -1.00103e+01 3.19875e+00  0.00000e+00 0.00000e+00 1.58835e+02 162.279 3.30587e+01 162.279 0.9512 
1 1 1 -17 39  5  o 18 1.05692e+01 1.48195e+00 1.72620e+02 17.653  2.07444e+01  6.60182e+00  0.00000e+00 0.00000e+00 2.21546e+02 17.653  4.89257e+01 17.653  0.9768 
1 1 1 -17 39  6  o 14 3.53654e+00 1.19745e+00 5.47306e+01 243.153 -1.30970e+00 -2.58744e+00 0.00000e+00 0.00000e+00 5.34954e+01 243.153 1.23516e+00 63.153  0.8023 
1 1 1 -17 39  7  o 4  4.89628e+00 1.39116e+00 6.02346e+01 57.300  2.19762e+00  3.42310e+00  0.00000e+00 0.00000e+00 1.01336e+02 57.300  4.11015e+01 57.300  0.8661 
1 1 1 -17 39  8  o 8  3.93849e+00 1.34894e+00 7.52019e+01 120.631 -2.22874e+00 3.76392e+00  0.00000e+00 0.00000e+00 5.61787e+01 120.631 1.90233e+01 300.631 0.8765 
1 1 1 -17 40  1  o 17 6.34642e+00 1.61522e+00 1.05710e+02 190.135 -6.78856e+00 -1.21357e+00 0.00000e+00 0.00000e+00 1.19030e+02 190.135 1.33207e+01 190.135 0.9244 
1 1 1 -17 40  2  o 13 5.53299e+00 1.54209e+00 8.70650e+01 14.551  5.01928e+00  1.30282e+00  0.00000e+00 0.00000e+00 1.03033e+02 14.551  1.59683e+01 14.551  0.8975 
1 1 1 -17 40  3  f 0  3.13509e+00 1.08030e+00 4.22437e+01 33.806  1.70536e+00  1.14188e+00  0.00000e+00 0.00000e+00 4.24364e+01 33.806  1.92678e-01 33.806  0.7062 
1 1 1 -17 40  4  o 10 3.13578e+00 1.09095e+00 3.68090e+01 313.874 1.27247e+00  -1.32348e+00 0.00000e+00 0.00000e+00 4.33469e+01 313.874 6.53788e+00 313.874 0.6689 
1 1 1 -17 40  5  o 1  4.67597e+00 1.40030e+00 7.56779e+01 20.105  4.24290e+00  1.55312e+00  0.00000e+00 0.00000e+00 8.15703e+01 20.105  5.89238e+00 20.105  0.8809 
1 1 1 -17 40  6  o 16 3.73273e+00 1.22148e+00 4.79596e+01 158.963 -2.49294e+00 9.58781e-01  0.00000e+00 0.00000e+00 6.34200e+01 158.963 1.54604e+01 158.963 0.7824 
1 1 1 -17 40  7  o 10 3.89994e+00 1.28089e+00 4.24888e+01 9.101   2.53752e+00  4.06505e-01  0.00000e+00 0.00000e+00 7.22697e+01 9.101   2.97808e+01 9.101   0.7724 
1 1 1 -17 40  8  o 10 4.95267e+00 1.59545e+00 8.29318e+01 337.746 4.67824e+00  -1.91426e+00 0.00000e+00 0.00000e+00 8.56770e+01 337.746 2.74519e+00 337.746 0.8946 
1 1 1 -17 41  1  o 8  1.56682e+01 1.26085e+00 3.12702e+02 326.489 5.62966e+01  -3.72775e+01 0.00000e+00 0.00000e+00 2.83021e+02 326.489 2.96811e+01 146.489 0.9926 
1 1 1 -17 41  2  o 19 6.32119e+00 1.57850e+00 7.58114e+01 124.203 -2.99772e+00 4.41052e+00  0.00000e+00 0.00000e+00 1.42082e+02 124.203 6.62705e+01 124.203 0.9006 
1 1 1 -17 41  3  o 14 5.01402e+00 1.47803e+00 6.19944e+01 297.798 1.70872e+00  -3.24107e+00 0.00000e+00 0.00000e+00 1.00851e+02 297.798 3.88561e+01 297.798 0.8492 
1 1 1 -17 41  4  o 11 4.63043e+00 1.41112e+00 5.73812e+01 63.492  1.42595e+00  2.85907e+00  0.00000e+00 0.00000e+00 8.83051e+01 63.492  3.09239e+01 63.492  0.8234 
1 1 1 -17 41  5  o 17 4.32760e+00 1.36418e+00 9.20142e+01 300.631 2.68347e+00  -4.53198e+00 0.00000e+00 0.00000e+00 5.65356e+01 300.631 3.54786e+01 120.631 0.8992 
1 1 1 -17 41  6  o 7  1.09135e+01 1.52163e+00 1.35950e+02 270.675 2.17366e-01  -1.84522e+01 0.00000e+00 0.00000e+00 2.68787e+02 270.675 1.32837e+02 270.675 0.9725 
1 1 1 -17 41  7  o 9  5.83768e+00 1.59664e+00 1.11371e+02 357.228 7.70525e+00  -3.73017e-01 0.00000e+00 0.00000e+00 9.60440e+01 357.228 1.53270e+01 177.228 0.9327 
1 1 1 -17 41  8  o 15 3.84507e+00 1.29367e+00 5.04034e+01 52.583  1.79300e+00  2.34367e+00  0.00000e+00 0.00000e+00 6.75580e+01 52.583  1.71546e+01 52.583  0.8063 
1 1 1 -17 42  1  o 3  5.15637e+00 1.49027e+00 7.74404e+01 183.441 -4.66154e+00 -2.80334e-01 0.00000e+00 0.00000e+00 9.73682e+01 183.441 1.99278e+01 183.441 0.8851 
1 1 1 -17 42  2  o 12 4.74293e+00 1.43125e+00 6.52541e+01 291.032 1.35075e+00  -3.51296e+00 0.00000e+00 0.00000e+00 8.97239e+01 291.032 2.44699e+01 291.032 0.8538 
1 1 1 -17 42  3  o 13 5.65574e+00 1.57097e+00 8.98431e+01 278.845 8.94883e-01  -5.75080e+00 0.00000e+00 0.00000e+00 1.06851e+02 278.845 1.70079e+01 278.845 0.9095 
1 1 1 -17 42  4  o 5  5.67773e+00 1.48463e+00 7.25565e+01 356.587 4.89517e+00  -2.91926e-01 0.00000e+00 0.00000e+00 1.20742e+02 356.587 4.81851e+01 356.587 0.8911 
1 1 1 -17 42  5  o 17 3.86462e+00 1.28911e+00 1.85373e+01 46.331  6.96307e-01  7.29445e-01  0.00000e+00 0.00000e+00 4.77481e+01 46.331  2.92107e+01 46.331  0.4494 
1 1 1 -17 42  6  o 14 4.07116e+00 1.30469e+00 1.30876e+01 246.544 -3.06826e-01 -7.07123e-01 0.00000e+00 0.00000e+00 4.26963e+01 246.544 2.96087e+01 246.544 0.3594 
1 1 1 -17 42  7  f 0  6.22487e+00 1.69352e+00 1.24310e+02 173.070 -8.46289e+00 1.02860e+00  0.00000e+00 0.00000e+00 9.84126e+01 173.070 2.58973e+01 353.070 0.9394 
1 1 1 -17 42  8  o 15 5.16814e+00 1.50418e+00 1.05383e+02 190.883 -6.94732e+00 -1.33572e+00 0.00000e+00 0.00000e+00 7.67585e+01 190.883 2.86243e+01 10.883  0.9264 
1 1 1 -17 43  1  o 1  1.55966e+01 1.29779e+00 2.31534e+02 349.843 4.91719e+01  -8.80919e+00 0.00000e+00 0.00000e+00 3.59761e+02 349.843 1.28226e+02 349.843 0.9899 
1 1 1 -17 43  2  o 8  9.71980e+00 1.57732e+00 1.45731e+02 201.297 -1.50491e+01 -5.86641e+00 0.00000e+00 0.00000e+00 2.14515e+02 201.297 6.87835e+01 201.297 0.9685 
1 1 1 -17 43  3  o 6  4.56303e+00 1.42010e+00 7.62443e+01 264.393 -4.06209e-01 -4.13780e+00 0.00000e+00 0.00000e+00 7.54250e+01 264.393 8.19307e-01 84.393  0.8693 
1 1 1 -17 43  4  o 15 5.20617e+00 1.51364e+00 7.70231e+01 12.829  4.61718e+00  1.05142e+00  0.00000e+00 0.00000e+00 9.93561e+01 12.829  2.23331e+01 12.829  0.8869 
1 1 1 -17 43  5  o 5  9.65490e+00 1.58086e+00 1.10551e+02 230.325 -7.90484e+00 -9.52999e+00 0.00000e+00 0.00000e+00 2.42713e+02 230.325 1.32162e+02 230.325 0.9587 
1 1 1 -17 43  6  o 19 3.36820e+00 1.15466e+00 1.39053e+02 173.828 -7.63168e+00 8.25321e-01  0.00000e+00 0.00000e+00 1.93217e+01 353.828 1.58374e+02 353.828 0.9324 
1 1 1 -17 43  7  o 17 5.84283e+00 1.59514e+00 7.98051e+01 217.098 -4.58821e+00 -3.46981e+00 0.00000e+00 0.00000e+00 1.22316e+02 217.098 4.25108e+01 217.098 0.9083 
1 1 1 -17 44  1  o 9  5.85143e+00 1.58803e+00 2.01913e+02 141.375 -9.89183e+00 7.90371e+00  0.00000e+00 0.00000e+00 1.31142e+01 141.375 1.88798e+02 321.375 0.9597 
1 1 1 -17 44  2  o 1  4.94813e+00 1.46612e+00 6.76214e+01 211.899 -3.29473e+00 -2.05074e+00 0.00000e+00 0.00000e+00 9.49704e+01 211.899 2.73490e+01 211.899 0.8588 
1 1 1 -17 44  3  o 5  4.47662e+00 1.39238e+00 8.14337e+01 323.618 3.71654e+00  -2.73827e+00 0.00000e+00 0.00000e+00 6.97986e+01 323.618 1.16351e+01 143.618 0.8837 
1 1 1 -17 44  4  o 10 5.57501e+00 1.51888e+00 4.70120e+01 138.846 -2.34408e+00 2.04875e+00  0.00000e+00 0.00000e+00 1.27181e+02 138.846 8.01686e+01 138.846 0.8180 
1 1 1 -17 44  5  o 17 3.80242e+00 1.25905e+00 9.82392e+01 252.376 -1.70196e+00 -5.35740e+00 0.00000e+00 0.00000e+00 3.32267e+01 252.376 6.50126e+01 72.376  0.9060 
1 1 1 -17 44  6  o 3  5.31805e+00 1.47469e+00 1.64072e+02 89.283  1.46208e-01  1.16868e+01  0.00000e+00 0.00000e+00 2.97796e+01 89.283  1.34292e+02 269.283 0.9562 
1 1 1 -17 44  7  o 8  5.87206e+00 1.62586e+00 6.79706e+01 301.251 2.48247e+00  -4.09081e+00 0.00000e+00 0.00000e+00 1.30624e+02 301.251 6.26534e+01 301.251 0.8881 
1 1 1 -17 45  1  o 18 7.51604e+00 1.66926e+00 1.60426e+02 260.507 -2.08969e+00 -1.24964e+01 0.00000e+00 0.00000e+00 1.15746e+02 260.507 4.46799e+01 80.507  0.9597 
1 1 1 -17 45  2  o 2  4.77702e+00 1.37533e+00 1.11701e+02 109.971 -2.33437e+00 6.42387e+00  0.00000e+00 0.00000e+00 5.71035e+01 109.971 5.45971e+01 289.971 0.9236 
1 1 1 -17 45  3  o 5  6.61388e+00 1.66305e+00 6.03881e+01 142.685 -3.38660e+00 2.58134e+00  0.00000e+00 0.00000e+00 1.60266e+02 142.685 9.98781e+01 142.685 0.8728 
1 1 1 -17 45  4  o 6  5.28606e+00 1.50487e+00 8.08553e+01 16.875  4.95051e+00  1.50175e+00  0.00000e+00 0.00000e+00 1.00285e+02 16.875  1.94298e+01 16.875  0.8973 
1 1 1 -17 45  5  o 7  7.54004e+00 1.66604e+00 9.80965e+01 292.128 3.11007e+00  -7.64844e+00 0.00000e+00 0.00000e+00 1.71564e+02 292.128 7.34673e+01 292.128 0.9373 
1 1 1 -17 45  6  f 0  5.33920e+00 1.57439e+00 3.66757e+01 129.439 -1.49964e+00 1.82317e+00  0.00000e+00 0.00000e+00 1.15744e+02 129.439 7.90679e+01 129.439 0.7490 
1 1 1 -17 45  7  o 15 6.11230e+00 1.60529e+00 1.05616e+02 359.660 7.88258e+00  -4.67520e-02 0.00000e+00 0.00000e+00 1.11803e+02 359.660 6.18682e+00 359.660 0.9342 
1 1 1 -17 46  1  o 9  1.04048e+01 1.50836e+00 1.68571e+02 330.941 1.81646e+01  -1.00934e+01 0.00000e+00 0.00000e+00 2.20049e+02 330.941 5.14785e+01 330.941 0.9756 
1 1 1 -17 46  2  o 11 1.16390e+01 1.47072e+00 1.88669e+02 62.623  1.22717e+01  2.36975e+01  0.00000e+00 0.00000e+00 2.48138e+02 62.623  5.94686e+01 62.623  0.9811 
1 1 1 -17 46  3  o 2  7.49063e+00 1.56179e+00 7.13691e+01 279.183 9.83294e-01  -6.08245e+00 0.00000e+00 0.00000e+00 1.90538e+02 279.183 1.19169e+02 279.183 0.9148 
1 1 1 -17 46  4  o 12 4.40255e+00 1.36533e+00 5.21226e+01 319.264 2.34476e+00  -2.01939e+00 0.00000e+00 0.00000e+00 8.51864e+01 319.264 3.30638e+01 319.264 0.8167 
1 1 1 -17 46  5  o 18 7.00994e+00 1.66033e+00 1.29796e+02 126.812 -6.18454e+00 8.26346e+00  0.00000e+00 0.00000e+00 1.24330e+02 126.812 5.46552e+00 306.812 0.9502 
1 1 1 -17 46  6  o 18 4.23586e+00 1.35730e+00 1.08177e+02 5.144   6.40520e+00  5.76585e-01  0.00000e+00 0.00000e+00 4.01129e+01 5.144   6.80637e+01 185.144 0.9186 
1 1 1 -17 46  7  o 18 5.73160e+00 1.54990e+00 1.23365e+02 262.243 -1.19911e+00 -8.80304e+00 0.00000e+00 0.00000e+00 8.21637e+01 262.243 4.12011e+01 82.243  0.9419 
1 1 1 -17 47  1  o 19 3.36953e+00 1.14888e+00 1.36273e+02 230.974 -4.42521e+00 -5.45971e+00 0.00000e+00 0.00000e+00 1.68586e+01 50.974  1.53132e+02 50.974  0.9258 
1 1 1 -17 47  2  o 17 8.01801e+00 1.61882e+00 1.57907e+02 54.774  8.17207e+00  1.15734e+01  0.00000e+00 0.00000e+00 1.37740e+02 54.774  2.01666e+01 234.774 0.9640 
1 1 1 -17 47  3  o 11 8.47148e+00 1.53167e+00 1.15957e+02 151.814 -1.03951e+01 5.57055e+00  0.00000e+00 0.00000e+00 1.93747e+02 151.814 7.77897e+01 151.814 0.9566 
1 1 1 -17 47  4  o 12 3.01602e+00 1.03493e+00 7.56866e+01 21.194  3.75309e+00  1.45527e+00  0.00000e+00 0.00000e+00 2.38663e+01 21.194  5.18203e+01 201.194 0.8645 
1 1 1 -17 47  5  o 3  3.72898e+00 1.23635e+00 2.47446e+01 239.999 -7.40145e-01 -1.28194e+00 0.00000e+00 0.00000e+00 5.93521e+01 239.999 3.46075e+01 239.999 0.5912 
1 1 1 -17 47  6  o 13 7.72029e+00 1.65704e+00 1.67082e+02 287.142 4.47679e+00  -1.45141e+01 0.00000e+00 0.00000e+00 1.17255e+02 287.142 4.98274e+01 107.142 0.9665 
1 1 1 -17 47  7  o 12 7.95758e+00 1.64398e+00 9.69890e+01 36.508  7.31086e+00  5.41130e+00  0.00000e+00 0.00000e+00 1.88747e+02 36.508  9.17584e+01 36.508  0.9433 
1 1 1 -17 48  1  o 3  7.68246e+00 1.56029e+00 1.30988e+02 41.873  8.72164e+00  7.81808e+00  0.00000e+00 0.00000e+00 1.50198e+02 41.873  1.92103e+01 41.873  0.9563 
1 1 1 -17 48  2  o 2  4.45646e+00 1.38444e+00 6.92951e+01 266.126 -2.77815e-01 -4.10249e+00 0.00000e+00 0.00000e+00 7.85857e+01 266.126 9.29060e+00 266.126 0.8677 
1 1 1 -17 48  3  o 16 3.86453e+00 1.27624e+00 4.20549e+01 40.496  1.83672e+00  1.56846e+00  0.00000e+00 0.00000e+00 6.95032e+01 40.496  2.74483e+01 40.496  0.7555 
1 1 1 -17 48  4  o 3  6.43754e+00 1.57352e+00 4.23568e+01 207.902 -2.87025e+00 -1.51984e+00 0.00000e+00 0.00000e+00 1.60833e+02 207.902 1.18476e+02 207.902 0.8268 
1 1 1 -17 48  5  o 14 6.53815e+00 1.51436e+00 1.42957e+02 292.713 4.54377e+00  -1.08552e+01 0.00000e+00 0.00000e+00 9.55679e+01 292.713 4.73893e+01 112.713 0.9565 
1 1 1 -17 48  6  o 11 6.99336e+00 1.59181e+00 7.37740e+01 87.929  2.29099e-01  6.33683e+00  0.00000e+00 0.00000e+00 1.70661e+02 87.929  9.68870e+01 87.929  0.9174 
1 1 1 -17 48  7  o 7  3.46124e+00 1.17563e+00 7.90342e+01 195.878 -4.60692e+00 -1.31040e+00 0.00000e+00 0.00000e+00 3.79822e+01 195.878 4.10519e+01 15.878  0.8883 
1 1 1 -17 49  1  o 12 5.69248e+00 1.54152e+00 1.32098e+02 275.499 8.83442e-01  -9.17562e+00 0.00000e+00 0.00000e+00 7.35631e+01 275.499 5.85349e+01 95.500  0.9441 
1 1 1 -17 49  2  o 17 4.24692e+00 1.30447e+00 6.14006e+01 301.351 1.97499e+00  -3.24178e+00 0.00000e+00 0.00000e+00 7.74787e+01 301.351 1.60781e+01 301.351 0.8552 
1 1 1 -17 49  3  o 2  1.05893e+01 1.52688e+00 1.53748e+02 7.175   1.99081e+01  2.50627e+00  0.00000e+00 0.00000e+00 2.40616e+02 7.175   8.68685e+01 7.175   0.9748 
1 1 1 -17 49  4  o 4  4.68453e+00 1.41503e+00 5.89383e+01 29.226  3.37695e+00  1.88932e+00  0.00000e+00 0.00000e+00 9.45431e+01 29.226  3.56048e+01 29.226  0.8583 
1 1 1 -17 49  5  f 0  1.22662e+01 1.49584e+00 2.06882e+02 217.190 -2.56544e+01 -1.94656e+01 0.00000e+00 0.00000e+00 2.53573e+02 217.190 4.66908e+01 217.190 0.9843 
1 1 1 -17 49  6  o 8  6.09366e+00 1.60991e+00 8.39395e+01 28.357  5.47357e+00  2.95430e+00  0.00000e+00 0.00000e+00 1.28625e+02 28.357  4.46853e+01 28.357  0.9156 
1 1 1 -17 49  7  o 12 6.44621e+00 1.63692e+00 1.18047e+02 207.146 -8.27603e+00 -4.24344e+00 0.00000e+00 0.00000e+00 1.13675e+02 207.146 4.37177e+00 27.146  0.9446 
1 1 1 -17 50  1  o 8  4.48129e+00 1.33127e+00 6.48812e+01 310.463 2.67834e+00  -3.14008e+00 0.00000e+00 0.00000e+00 8.39935e+01 310.463 1.91123e+01 310.463 0.8682 
1 1 1 -17 50  2  o 2  4.87497e+00 1.39230e+00 6.03562e+01 353.930 3.97248e+00  -4.22445e-01 0.00000e+00 0.00000e+00 1.00555e+02 353.930 4.01990e+01 353.930 0.8633 
1 1 1 -17 50  3  o 16 7.28199e+00 1.56692e+00 1.13017e+02 164.240 -9.60684e+00 2.71123e+00  0.00000e+00 0.00000e+00 1.50839e+02 164.240 3.78218e+01 164.240 0.9485 
1 1 1 -17 50  4  o 18 4.23683e+00 1.31485e+00 1.02521e+02 44.565  4.50838e+00  4.44045e+00  0.00000e+00 0.00000e+00 4.57910e+01 44.565  5.67304e+01 224.565 0.9172 
1 1 1 -17 50  5  o 13 6.77712e+00 1.65489e+00 1.19704e+02 315.547 6.82727e+00  -6.69824e+00 0.00000e+00 0.00000e+00 1.24802e+02 315.547 5.09811e+00 315.547 0.9462 
1 1 1 -17 50  6  o 7  3.07309e+00 1.05597e+00 5.08161e+01 26.315  2.53875e+00  1.25553e+00  0.00000e+00 0.00000e+00 4.24529e+01 26.315  8.36319e+00 206.314 0.7968 
1 1 1 -17 50  7  o 17 3.96703e+00 1.28757e+00 7.41241e+01 151.476 -4.33418e+00 2.35558e+00  0.00000e+00 0.00000e+00 6.04898e+01 151.476 1.36343e+01 331.476 0.8918 
1 1 1 -17 51  1  o 14 7.86856e+00 1.64989e+00 1.99456e+02 178.297 -1.79152e+01 5.32768e-01  0.00000e+00 0.00000e+00 9.30537e+01 178.297 1.06402e+02 358.297 0.9717 
1 1 1 -17 51  2  o 18 4.03483e+00 1.27176e+00 7.41236e+01 288.086 1.39704e+00  -4.27782e+00 0.00000e+00 0.00000e+00 6.16619e+01 288.086 1.24617e+01 108.086 0.8803 
1 1 1 -17 51  3  o 16 6.39742e+00 1.62477e+00 1.15151e+02 50.283  5.63124e+00  6.77869e+00  0.00000e+00 0.00000e+00 1.14891e+02 50.283  2.60187e-01 230.283 0.9414 
1 1 1 -17 51  4  o 11 4.34975e+00 1.34330e+00 2.01344e+01 48.849  8.17140e-01  9.35029e-01  0.00000e+00 0.00000e+00 6.70998e+01 48.849  4.69654e+01 48.849  0.5255 
1 1 1 -17 51  5  o 2  3.58459e+00 1.21045e+00 3.39009e+01 247.116 -7.74357e-01 -1.83456e+00 0.00000e+00 0.00000e+00 6.12622e+01 247.116 2.73613e+01 247.116 0.6963 
1 1 1 -17 51  6  o 9  4.81850e+00 1.46287e+00 1.32672e+02 161.902 -8.49864e+00 2.77741e+00  0.00000e+00 0.00000e+00 4.02556e+01 161.902 9.24165e+01 341.902 0.9423 
1 1 1 -17 51  7  o 18 7.70958e+00 1.63765e+00 7.09478e+01 137.817 -5.30335e+00 4.80594e+00  0.00000e+00 0.00000e+00 2.01022e+02 137.817 1.30074e+02 137.817 0.9272 
1 1 1 -17 52  1  o 6  3.53115e+00 1.17310e+00 5.63516e+01 145.727 -2.76606e+00 1.88498e+00  0.00000e+00 0.00000e+00 5.61258e+01 145.727 2.25752e-01 325.727 0.8327 
1 1 1 -17 52  2  o 7  4.91637e+00 1.43538e+00 7.46492e+01 58.884  2.61407e+00  4.33072e+00  0.00000e+00 0.00000e+00 9.34834e+01 58.884  1.88342e+01 58.884  0.8947 
1 1 1 -17 52  3  o 3  5.18285e+00 1.48912e+00 3.47931e+01 246.326 -9.27801e-01 -2.11618e+00 0.00000e+00 0.00000e+00 1.12220e+02 246.326 7.74265e+01 246.326 0.7427 
1 1 1 -17 52  4  o 13 5.73687e+00 1.49432e+00 1.21807e+02 282.129 1.95302e+00  -9.08764e+00 0.00000e+00 0.00000e+00 8.49561e+01 282.129 3.68512e+01 102.129 0.9446 
1 1 1 -17 52  5  o 15 4.81062e+00 1.44694e+00 8.09718e+01 186.362 -5.25330e+00 -5.85763e-01 0.00000e+00 0.00000e+00 8.39981e+01 186.362 3.02632e+00 186.362 0.8996 
1 1 1 -17 52  6  o 2  4.80823e+00 1.45894e+00 5.41628e+01 270.037 2.33768e-03  -3.65244e+00 0.00000e+00 0.00000e+00 1.01232e+02 270.037 4.70691e+01 270.037 0.8487 
1 1 1 -17 52  7  o 5  5.33058e+00 1.56052e+00 1.63972e+02 82.630  1.56551e+00  1.21037e+01  0.00000e+00 0.00000e+00 3.03064e+01 82.630  1.33666e+02 262.630 0.9581 
1 1 1 -17 53  1  o 14 4.21933e+00 1.33146e+00 8.03448e+01 327.593 4.11515e+00  -2.61230e+00 0.00000e+00 0.00000e+00 6.33411e+01 327.593 1.70037e+01 147.593 0.8904 
1 1 1 -17 53  2  o 3  8.88795e+00 1.56504e+00 1.43447e+02 282.550 3.34511e+00  -1.50266e+01 0.00000e+00 0.00000e+00 1.84999e+02 282.550 4.15517e+01 282.550 0.9670 
1 1 1 -17 53  3  o 11 4.14175e+00 1.29218e+00 5.80444e+01 287.962 1.15144e+00  -3.55167e+00 0.00000e+00 0.00000e+00 7.67708e+01 287.962 1.87264e+01 287.962 0.8524 
1 1 1 -17 53  4  o 11 3.59414e+00 1.19693e+00 4.90135e+01 73.011  8.52209e-01  2.78934e+00  0.00000e+00 0.00000e+00 6.11787e+01 73.011  1.21651e+01 73.011  0.8036 
1 1 1 -17 53  5  o 7  5.13905e+00 1.47966e+00 1.44535e+02 160.241 -9.31084e+00 3.34453e+00  0.00000e+00 0.00000e+00 4.11550e+01 160.241 1.03380e+02 340.241 0.9480 
1 1 1 -17 53  6  o 15 9.64583e+00 1.64558e+00 1.71665e+02 49.424  1.35348e+01  1.58045e+01  0.00000e+00 0.00000e+00 1.86664e+02 49.424  1.49996e+01 49.424  0.9757 
1 1 1 -17 53  7  o 19 5.23432e+00 1.47996e+00 8.03214e+01 152.785 -5.28913e+00 2.72003e+00  0.00000e+00 0.00000e+00 1.01149e+02 152.785 2.08276e+01 152.785 0.9115 
1 1 1 -17 54  1  f 0  5.06266e+00 1.42757e+00 6.16558e+01 184.906 -4.35380e+00 -3.73703e-01 0.00000e+00 0.00000e+00 1.08012e+02 184.906 4.63559e+01 184.906 0.8764 
1 1 1 -17 54  2  o 13 4.05055e+00 1.30072e+00 1.14951e+02 340.993 6.79005e+00  -2.33888e+00 0.00000e+00 0.00000e+00 2.86052e+01 340.993 8.63462e+01 160.993 0.9275 
1 1 1 -17 54  3  o 12 5.85739e+00 1.42294e+00 8.55775e+01 141.639 -5.48521e+00 4.34148e+00  0.00000e+00 0.00000e+00 1.21389e+02 141.639 3.58114e+01 141.639 0.9255 
1 1 1 -17 54  4  o 1  3.73323e+00 1.23408e+00 2.20116e+01 163.381 -1.25359e+00 3.74166e-01  0.00000e+00 0.00000e+00 5.56035e+01 163.381 3.35919e+01 163.381 0.5450 
1 1 1 -17 54  5  o 12 7.13731e+00 1.60901e+00 9.34562e+01 78.333  1.68389e+00  8.15508e+00  0.00000e+00 0.00000e+00 1.61639e+02 78.333  6.81831e+01 78.333  0.9379 
1 1 1 -17 54  6  o 8  4.19053e+00 1.29434e+00 6.32593e+01 216.843 -3.60384e+00 -2.70024e+00 0.00000e+00 0.00000e+00 7.71964e+01 216.843 1.39371e+01 216.843 0.8804 
1 1 1 -17 54  7  o 10 3.59786e+00 1.19835e+00 9.24187e+01 53.913  3.68352e+00  5.05382e+00  0.00000e+00 0.00000e+00 3.29268e+01 53.913  5.94920e+01 233.913 0.9161 
1 1 1 -17 55  1  o 9  6.46127e+00 1.60652e+00 9.75221e+01 215.479 -6.23470e+00 -4.44377e+00 0.00000e+00 0.00000e+00 1.32777e+02 215.479 3.52548e+01 215.479 0.9322 
1 1 1 -17 55  2  o 1  6.93354e+00 1.60624e+00 8.15618e+01 104.153 -1.68033e+00 6.66335e+00  0.00000e+00 0.00000e+00 1.63225e+02 104.153 8.16637e+01 104.153 0.9241 
1 1 1 -17 55  3  o 3  3.76771e+00 1.23261e+00 4.03638e+01 304.049 1.37810e+00  -2.03935e+00 0.00000e+00 0.00000e+00 6.90489e+01 304.049 2.86851e+01 304.049 0.7607 
1 1 1 -17 55  4  o 15 4.98996e+00 1.44848e+00 1.01187e+02 40.831  5.20856e+00  4.50075e+00  0.00000e+00 0.00000e+00 7.47024e+01 40.831  2.64849e+01 220.831 0.9242 
1 1 1 -17 55  5  o 2  3.95531e+00 1.24914e+00 7.31901e+01 82.448  6.28476e-01  4.74066e+00  0.00000e+00 0.00000e+00 6.06495e+01 82.448  1.25406e+01 262.448 0.8881 
1 1 1 -17 55  6  o 9  4.72674e+00 1.44027e+00 5.35919e+01 341.768 3.71581e+00  -1.22402e+00 0.00000e+00 0.00000e+00 1.01148e+02 341.768 4.75564e+01 341.768 0.8601 
1 1 1 -17 55  7  o 1  7.75079e+00 1.64890e+00 9.63661e+01 217.709 -7.68425e+00 -5.94109e+00 0.00000e+00 0.00000e+00 1.82730e+02 217.709 8.63636e+01 217.709 0.9470 
1 1 1 -17 56  1  o 3  4.38394e+00 1.35210e+00 3.79510e+01 95.446  -2.33256e-01 2.44667e+00  0.00000e+00 0.00000e+00 8.94761e+01 95.446  5.15251e+01 95.446  0.7603 
1 1 1 -17 56  2  o 5  3.16889e+00 1.08671e+00 9.29990e+01 160.283 -5.01170e+00 1.79616e+00  0.00000e+00 0.00000e+00 1.59939e+01 160.283 7.70051e+01 340.283 0.9004 
1 1 1 -17 56  3  o 5  7.49791e+00 1.64811e+00 1.42260e+02 346.197 1.20908e+01  -2.97039e+00 0.00000e+00 0.00000e+00 1.32173e+02 346.197 1.00871e+01 166.197 0.9590 
1 1 1 -17 56  4  o 10 3.90026e+00 1.27165e+00 3.66210e+01 156.528 -2.12699e+00 9.23588e-01  0.00000e+00 0.00000e+00 7.40008e+01 156.528 3.73798e+01 156.528 0.7438 
1 1 1 -17 56  5  o 11 3.48982e+00 1.16596e+00 6.89955e+01 76.738  1.04607e+00  4.43840e+00  0.00000e+00 0.00000e+00 4.82768e+01 76.738  2.07188e+01 256.738 0.8821 
1 1 1 -17 56  6  o 7  4.26933e+00 1.32285e+00 3.80446e+01 298.565 1.24649e+00  -2.28957e+00 0.00000e+00 0.00000e+00 8.80644e+01 298.565 5.00198e+01 298.565 0.7761 
1 1 1 -17 56  7  o 15 6.07120e+00 1.60358e+00 1.01290e+02 29.379  7.08460e+00  3.98847e+00  0.00000e+00 0.00000e+00 1.14818e+02 29.379  1.35280e+01 29.379  0.9363 
1 1 1 -17 57  1  o 19 4.32885e+00 1.35953e+00 8.62302e+01 143.068 -4.35249e+00 3.27180e+00  0.00000e+00 0.00000e+00 6.31464e+01 143.068 2.30838e+01 323.068 0.9028 
1 1 1 -17 57  2  o 14 3.99688e+00 1.28511e+00 5.24174e+01 191.139 -3.17119e+00 -6.24421e-01 0.00000e+00 0.00000e+00 7.36432e+01 191.139 2.12258e+01 191.139 0.8258 
1 1 1 -17 57  3  o 14 5.15346e+00 1.49976e+00 6.89709e+01 39.210  3.74082e+00  3.05200e+00  0.00000e+00 0.00000e+00 1.05911e+02 39.210  3.69397e+01 39.210  0.8892 
1 1 1 -17 57  4  o 3  6.75874e+00 1.57554e+00 1.59612e+02 302.160 7.62891e+00  -1.21331e+01 0.00000e+00 0.00000e+00 8.89236e+01 302.160 7.06881e+01 122.160 0.9645 
1 1 1 -17 57  5  o 13 3.45898e+00 1.15677e+00 5.11280e+01 29.681  3.01889e+00  1.72062e+00  0.00000e+00 0.00000e+00 5.95177e+01 29.681  8.38970e+00 29.681  0.8398 
1 1 1 -17 57  6  o 12 5.16808e+00 1.45708e+00 5.63562e+01 184.891 -4.38104e+00 -3.74874e-01 0.00000e+00 0.00000e+00 1.16156e+02 184.891 5.97995e+01 184.891 0.8772 
1 1 1 -17 58  1  o 1  6.81241e+00 1.64609e+00 5.93600e+01 53.560  2.91335e+00  3.94578e+00  0.00000e+00 0.00000e+00 1.72648e+02 53.560  1.13288e+02 53.560  0.8911 
1 1 1 -17 58  2  o 10 5.10924e+00 1.44886e+00 2.95139e+01 23.989  1.94596e+00  8.65965e-01  0.00000e+00 0.00000e+00 1.10576e+02 23.989  8.10618e+01 23.989  0.7180 
1 1 1 -17 58  3  o 9  4.19617e+00 1.32118e+00 2.15562e+01 19.719  1.32953e+00  4.76535e-01  0.00000e+00 0.00000e+00 7.02991e+01 19.719  4.87429e+01 19.719  0.5737 
1 1 1 -17 58  4  o 2  6.21675e+00 1.53822e+00 1.44698e+02 291.485 4.57550e+00  -1.16247e+01 0.00000e+00 0.00000e+00 8.26020e+01 291.485 6.20960e+01 111.485 0.9591 
1 1 1 -17 58  5  o 4  3.99722e+00 1.23914e+00 3.80278e+01 121.854 -1.47060e+00 2.36683e+00  0.00000e+00 0.00000e+00 8.26745e+01 121.854 4.46467e+01 121.854 0.7929 
1 1 1 -17 58  6  o 16 4.03369e+00 1.29602e+00 7.21954e+01 252.867 -1.50123e+00 -4.86977e+00 0.00000e+00 0.00000e+00 6.52430e+01 252.867 6.95236e+00 72.867  0.8956 
1 1 1 -17 59  1  o 16 4.81968e+00 1.45995e+00 3.52505e+01 273.324 1.37909e-01  -2.37428e+00 0.00000e+00 0.00000e+00 1.03074e+02 273.324 6.78232e+01 273.324 0.7511 
1 1 1 -17 59  2  o 13 4.17780e+00 1.33501e+00 4.78234e+01 231.041 -2.02844e+00 -2.50857e+00 0.00000e+00 0.00000e+00 8.38411e+01 231.041 3.60177e+01 231.041 0.8254 
1 1 1 -17 59  3  o 15 3.98696e+00 1.27281e+00 1.29176e+01 318.723 6.70110e-01  -5.88227e-01 0.00000e+00 0.00000e+00 4.89403e+01 318.723 3.60227e+01 318.723 0.4067 
1 1 1 -17 59  4  o 14 4.72307e+00 1.39037e+00 4.05813e+01 313.787 2.13050e+00  -2.22268e+00 0.00000e+00 0.00000e+00 1.06254e+02 313.787 6.56724e+01 313.787 0.8156 
1 1 1 -17 59  5  o 6  4.80842e+00 1.40720e+00 9.45802e+01 220.649 -5.43446e+00 -4.66595e+00 0.00000e+00 0.00000e+00 7.52090e+01 220.649 1.93712e+01 40.649  0.9273 
1 1 1 -17 59  6  o 12 3.82008e+00 1.22611e+00 4.58783e+01 240.416 -1.56339e+00 -2.75390e+00 0.00000e+00 0.00000e+00 7.35122e+01 240.416 2.76339e+01 240.416 0.8216 
1 1 1 -17 60  1  o 9  1.09618e+01 1.49644e+00 1.66039e+02 55.818  1.46900e+01  2.16306e+01  0.00000e+00 0.00000e+00 2.44672e+02 55.818  7.86326e+01 55.818  0.9807 
1 1 1 -17 60  2  f 0  3.64956e+00 1.20551e+00 9.06304e+01 337.548 5.59757e+00  -2.31308e+00 0.00000e+00 0.00000e+00 3.66045e+01 337.548 5.40259e+01 157.548 0.9132 
1 1 1 -17 60  3  o 9  4.76830e+00 1.37944e+00 4.74566e+01 136.955 -2.68206e+00 2.50500e+00  0.00000e+00 0.00000e+00 1.07052e+02 136.955 5.95958e+01 136.955 0.8495 
1 1 1 -17 60  4  o 5  4.78010e+00 1.42609e+00 1.04155e+02 207.257 -6.53782e+00 -3.36814e+00 0.00000e+00 0.00000e+00 6.51298e+01 207.257 3.90252e+01 27.257  0.9293 
1 1 1 -17 60  5  o 1  5.14906e+00 1.39230e+00 5.23664e+01 256.935 -9.64714e-01 -4.15727e+00 0.00000e+00 0.00000e+00 1.18791e+02 256.935 6.64246e+01 256.935 0.8731 
1 1 1 -17 61  1  o 16 6.86587e+00 1.67072e+00 1.21810e+02 283.337 2.45272e+00  -1.03456e+01 0.00000e+00 0.00000e+00 1.27802e+02 283.337 5.99231e+00 283.337 0.9517 
1 1 1 -17 61  2  o 13 8.61963e+00 1.58550e+00 1.74981e+02 158.953 -1.91886e+01 7.38369e+00  0.00000e+00 0.00000e+00 1.45920e+02 158.953 2.90605e+01 338.953 0.9754 
1 1 1 -17 61  3  o 19 5.25061e+00 1.47570e+00 1.17163e+02 212.516 -7.76540e+00 -4.95019e+00 0.00000e+00 0.00000e+00 7.18738e+01 212.516 4.52892e+01 32.516  0.9440 
1 1 1 -17 61  4  o 12 3.38935e+00 1.12847e+00 1.95540e+01 309.774 8.47001e-01  -1.01753e+00 0.00000e+00 0.00000e+00 5.14106e+01 309.774 3.18566e+01 309.774 0.5495 
1 1 1 -17 61  5  o 1  7.18671e+00 1.39898e+00 1.21257e+02 59.524  6.91140e+00  1.17447e+01  0.00000e+00 0.00000e+00 1.42078e+02 59.524  2.08218e+01 59.524  0.9626 
1 1 1 -17 62  1  o 11 6.53669e+00 1.68074e+00 1.41259e+02 259.139 -2.10090e+00 -1.09497e+01 0.00000e+00 0.00000e+00 9.69195e+01 259.139 4.43396e+01 79.139  0.9540 
1 1 1 -17 62  2  o 13 5.81605e+00 1.52119e+00 1.58408e+02 15.173  1.21686e+01  3.29989e+00  0.00000e+00 0.00000e+00 5.45558e+01 15.173  1.03852e+02 195.173 0.9595 
1 1 1 -17 62  3  o 8  4.88928e+00 1.43916e+00 8.16413e+01 198.210 -5.81137e+00 -1.91182e+00 0.00000e+00 0.00000e+00 8.87858e+01 198.210 7.14447e+00 198.210 0.9142 
1 1 1 -17 62  4  o 7  5.40284e+00 1.51607e+00 6.11721e+01 71.758  1.50079e+00  4.55332e+00  0.00000e+00 0.00000e+00 1.21683e+02 71.758  6.05111e+01 71.758  0.8884 
1 1 1 -17 62  5  o 3  3.57193e+00 1.18796e+00 4.54501e+01 40.029  2.35996e+00  1.98230e+00  0.00000e+00 0.00000e+00 6.54656e+01 40.029  2.00155e+01 40.029  0.8159 
1 1 1 -17 63  1  o 13 5.43329e+00 1.53103e+00 1.08046e+02 148.649 -7.11170e+00 4.33258e+00  0.00000e+00 0.00000e+00 8.65412e+01 148.649 2.15046e+01 328.649 0.9379 
1 1 1 -17 63  2  o 17 4.43036e+00 1.36335e+00 1.00789e+02 68.754  2.64235e+00  6.79623e+00  0.00000e+00 0.00000e+00 5.61955e+01 68.754  4.45939e+01 248.754 0.9287 
1 1 1 -17 63  3  o 17 3.90101e+00 1.23910e+00 7.99328e+01 104.057 -1.36409e+00 5.44802e+00  0.00000e+00 0.00000e+00 5.48029e+01 104.057 2.51299e+01 284.057 0.9060 
1 1 1 -17 63  4  o 12 3.75772e+00 1.23666e+00 2.99295e+00 31.199  1.72267e-01  1.04326e-01  0.00000e+00 0.00000e+00 1.13474e+01 31.199  8.35448e+00 31.199  0.1002 
1 1 1 -17 64  1  o 9  3.15094e+00 1.08143e+00 4.90068e+01 125.968 -1.91232e+00 2.63518e+00  0.00000e+00 0.00000e+00 5.05129e+01 125.968 1.50608e+00 125.968 0.8273 
1 1 1 -17 64  2  f 0  4.51531e+00 1.37378e+00 5.40794e+01 306.583 2.38029e+00  -3.20703e+00 0.00000e+00 0.00000e+00 9.46275e+01 306.583 4.05481e+01 306.583 0.8633 
1 1 1 -17 64  3  f 0  3.77200e+00 1.21684e+00 2.73763e+01 311.776 1.25316e+00  -1.40277e+00 0.00000e+00 0.00000e+00 6.99956e+01 311.776 4.26193e+01 311.776 0.6772 
1 1 1 -17 64  4  o 9  4.98391e+00 1.42636e+00 7.28631e+01 247.725 -2.17192e+00 -5.30227e+00 0.00000e+00 0.00000e+00 9.94685e+01 247.725 2.66054e+01 247.725 0.9079 
1 1 1 -17 65  1  o 9  6.56632e+00 1.59284e+00 1.22949e+02 152.286 -9.51821e+00 5.00002e+00  0.00000e+00 0.00000e+00 1.15746e+02 152.286 7.20351e+00 332.286 0.9523 
1 1 1 -17 65  2  o 9  4.97672e+00 1.43277e+00 9.65108e+01 35.387  5.94591e+00  4.22349e+00  0.00000e+00 0.00000e+00 7.97746e+01 35.387  1.67362e+01 215.387 0.9287 
1 1 1 -17 65  3  o 2  6.57019e+00 1.57862e+00 8.56423e+01 315.846 5.50824e+00  -5.34793e+00 0.00000e+00 0.00000e+00 1.47825e+02 315.846 6.21829e+01 315.846 0.9324 
1 1 1 -17 65  4  o 12 3.54146e+00 1.16110e+00 4.27757e+01 190.183 -3.23936e+00 -5.81845e-01 0.00000e+00 0.00000e+00 6.90668e+01 190.183 2.62910e+01 190.183 0.8294 
1 1 1 -17 66  1  o 5  3.31905e+00 1.12045e+00 5.48626e+00 161.232 -3.55133e-01 1.20676e-01  0.00000e+00 0.00000e+00 1.78616e+01 161.232 1.23753e+01 161.232 0.1843 
1 1 1 -17 66  2  o 7  4.75602e+00 1.36654e+00 8.87104e+01 325.390 5.76461e+00  -3.97827e+00 0.00000e+00 0.00000e+00 7.91667e+01 325.390 9.54375e+00 145.390 0.9256 
1 1 1 -17 66  3  o 2  3.27270e+00 1.09993e+00 3.39347e+01 130.228 -1.65313e+00 1.95425e+00  0.00000e+00 0.00000e+00 6.22531e+01 130.228 2.83184e+01 130.228 0.7713 
1 1 1 -17 67  1  o 12 3.34977e+00 1.13450e+00 5.28917e+01 28.689  3.46295e+00  1.89508e+00  0.00000e+00 0.00000e+00 5.72244e+01 28.689  4.33276e+00 28.689  0.8615 
1 1 1 -17 67  2  o 17 4.26495e+00 1.32682e+00 9.24932e+01 243.771 -3.23367e+00 -6.56330e+00 0.00000e+00 0.00000e+00 5.85642e+01 243.771 3.39289e+01 63.771  0.9289 
1 1 1 -17 67  3  o 2  4.69209e+00 1.38953e+00 9.99648e+01 7.882   7.98757e+00  1.10577e+00  0.00000e+00 0.00000e+00 6.73084e+01 7.882   3.26564e+01 187.882 0.9358 
1 1 1 -17 68  1  o 12 2.63850e+00 9.29096e-01 5.79004e+01 266.132 -2.61129e-01 -3.86183e+00 0.00000e+00 0.00000e+00 2.85045e+01 266.132 2.93959e+01 86.132  0.8584 
1 1 1 -17 68  2  o 15 4.23467e+00 1.31562e+00 6.06919e+01 91.791  -1.43352e-01 4.58495e+00  0.00000e+00 0.00000e+00 8.18281e+01 91.791  2.11362e+01 91.791  0.8828 
1 1 1 -17 68  3  o 18 3.64151e+00 1.18881e+00 9.67009e+01 242.128 -3.34794e+00 -6.33060e+00 0.00000e+00 0.00000e+00 3.19194e+01 242.128 6.47815e+01 62.128  0.9273 
1 1 1 -17 69  1  o 15 5.62730e+00 1.52900e+00 7.53204e+01 175.622 -6.32335e+00 4.84115e-01  0.00000e+00 0.00000e+00 1.21592e+02 175.622 4.62712e+01 175.622 0.9174 
1 1 1 -17 69  2  o 9  4.87051e+00 1.34884e+00 8.88495e+01 221.426 -6.00345e+00 -5.29766e+00 0.00000e+00 0.00000e+00 8.47766e+01 221.426 4.07293e+00 41.426  0.9353 
1 1 1 -17 69  3  o 5  4.90791e+00 1.43205e+00 8.23802e+01 307.360 4.13365e+00  -5.41446e+00 0.00000e+00 0.00000e+00 9.02045e+01 307.360 7.82432e+00 307.360 0.9234 
1 1 1 -17 70  1  o 6  3.27148e+00 1.10457e+00 1.77787e+01 114.371 -5.50923e-01 1.21616e+00  0.00000e+00 0.00000e+00 5.11732e+01 114.371 3.33945e+01 114.371 0.5527 
1 1 1 -17 70  2  o 14 3.92154e+00 1.25896e+00 9.35277e+01 33.755  6.03509e+00  4.03331e+00  0.00000e+00 0.00000e+00 4.51996e+01 33.755  4.83281e+01 213.755 0.9283 
1 1 1 -17 71  1  o 3  4.23505e+00 1.31562e+00 6.92043e+01 105.085 -1.40816e+00 5.22421e+00  0.00000e+00 0.00000e+00 7.64696e+01 105.085 7.26534e+00 105.085 0.9021 
1 1 1 -17 71  2  o 8  8.66685e+00 1.56456e+00 1.37549e+02 228.405 -1.16669e+01 -1.31430e+01 0.00000e+00 0.00000e+00 1.83123e+02 228.405 4.55736e+01 228.405 0.9711 
1 1 1 -17 72  1  o 13 7.21169e+00 1.60627e+00 9.08244e+01 21.852  9.03537e+00  3.62337e+00  0.00000e+00 0.00000e+00 1.69573e+02 21.852  7.87487e+01 21.852  0.9472 
1 1 1 -17 72  2  o 9  4.08859e+00 1.29440e+00 1.06391e+01 247.301 -3.26836e-01 -7.81373e-01 0.00000e+00 0.00000e+00 5.00322e+01 247.301 3.93930e+01 247.301 0.3896 
1 1 1 -16 0   1  o 3  2.64585e+00 1.83069e+00 1.31380e+02 180.000 -1.67176e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.69609e+01 0.000   1.68340e+02 0.000   0.9318 
1 1 1 -16 0   2  o 14 9.75528e+00 2.54125e+00 7.76117e+01 0.000   2.83006e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.93131e+02 0.000   2.15519e+02 0.000   0.9931 
1 1 1 -16 0   3  o 2  5.28085e+00 2.78967e+00 9.05003e+01 180.000 -1.71503e+00 0.00000e+00  0.00000e+00 0.00000e+00 9.87671e+01 180.000 8.26672e+00 180.000 0.9373 
1 1 1 -16 0   4  o 13 1.20822e+01 1.98173e+00 1.05013e+02 0.000   6.29326e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.56604e+02 0.000   2.51591e+02 0.000   1.0000 
1 1 1 -16 0   5  o 10 1.24307e+01 3.61941e+00 2.56609e+02 0.000   8.59995e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.17887e+02 0.000   3.87221e+01 180.000 1.0000 
1 1 1 -16 0   6  o 6  4.89245e+00 3.03476e+00 1.68232e+02 180.000 -2.79433e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.69460e+01 180.000 1.51286e+02 0.000   0.9925 
1 1 1 -16 0   7  o 12 4.12527e+00 2.68985e+00 4.89765e+01 180.000 -8.26178e-01 -0.00000e+00 0.00000e+00 0.00000e+00 5.76362e+01 180.000 8.65974e+00 180.000 0.6784 
1 1 1 -16 0   8  o 8  6.80121e+00 3.58162e+00 1.64292e+02 180.000 -3.14635e+00 0.00000e+00  0.00000e+00 0.00000e+00 9.35534e+01 180.000 7.07390e+01 0.000   0.9963 
1 1 1 -16 0   9  o 14 3.33278e+00 2.30120e+00 2.53370e+01 180.000 -4.37672e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.68156e+01 180.000 1.47859e+00 180.000 0.4117 
1 1 1 -16 0   10 o 6  8.20884e+00 3.80559e+00 1.48059e+02 0.000   3.33672e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.62773e+02 0.000   1.47144e+01 0.000   0.9975 
1 1 1 -16 0   11 o 19 7.39566e+00 3.82137e+00 7.47181e+01 180.000 -1.52912e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.80513e+02 180.000 1.05795e+02 180.000 0.9103 
1 1 1 -16 1   1  o 14 9.12287e+00 1.65238e+00 1.25716e+02 83.668  1.01879e+00  9.18062e+00  0.00000e+00 0.00000e+00 2.04180e+02 83.668  7.84646e+01 83.668  0.9442 
1 1 1 -16 1   2  o 11 4.99432e+00 1.47012e+00 1.12033e+02 356.468 4.92754e+00  -3.04108e-01 0.00000e+00 0.00000e+00 5.84373e+01 356.468 5.35958e+01 176.468 0.8919 
1 1 1 -16 1   3  o 15 7.12967e+00 1.67734e+00 1.25793e+02 72.517  2.26938e+00  7.20485e+00  0.00000e+00 0.00000e+00 1.28095e+02 72.517  2.30185e+00 72.517  0.9312 
1 1 1 -16 1   4  o 3  5.01615e+00 1.31427e+00 1.46337e+02 16.378  7.31377e+00  2.14951e+00  0.00000e+00 0.00000e+00 3.22595e+01 16.378  1.14078e+02 196.378 0.9319 
1 1 1 -16 1   5  f 0  6.66613e+00 1.89333e+00 2.31717e+02 208.650 -1.05194e+01 -5.74728e+00 0.00000e+00 0.00000e+00 1.18814e+01 208.650 2.19836e+02 28.650  0.9573 
1 1 1 -16 1   6  o 5  8.43955e+00 2.13086e+00 3.50749e+01 161.623 -1.92346e+00 6.38981e-01  0.00000e+00 0.00000e+00 1.90894e+02 161.623 1.55819e+02 161.623 0.7021 
1 1 1 -16 1   7  o 5  4.18624e+00 1.43499e+00 6.56593e+01 298.726 1.42676e+00  -2.60321e+00 0.00000e+00 0.00000e+00 6.31353e+01 298.726 2.52407e+00 118.726 0.8076 
1 1 1 -16 1   8  f 0  6.34834e+00 1.80369e+00 7.21056e+01 184.447 -3.88620e+00 -3.02219e-01 0.00000e+00 0.00000e+00 1.35518e+02 184.447 6.34120e+01 184.447 0.8595 
1 1 1 -16 1   9  o 7  7.62374e+00 2.05342e+00 9.33617e+01 328.944 4.82844e+00  -2.90760e+00 0.00000e+00 0.00000e+00 1.69253e+02 328.944 7.58915e+01 328.944 0.9063 
1 1 1 -16 1   10 o 4  5.80589e+00 1.83911e+00 5.64259e+01 164.207 -2.89529e+00 8.18891e-01  0.00000e+00 0.00000e+00 1.22239e+02 164.207 6.58128e+01 164.207 0.8106 
1 1 1 -16 1   11 o 12 9.23715e+00 2.27852e+00 1.90504e+02 79.882  2.19725e+00  1.23127e+01  0.00000e+00 0.00000e+00 1.45394e+02 79.882  4.51100e+01 259.882 0.9592 
1 1 1 -16 2   1  o 17 9.42502e+00 1.61719e+00 1.89839e+02 275.871 1.50059e+00  -1.45930e+01 0.00000e+00 0.00000e+00 1.58591e+02 275.871 3.12471e+01 95.871  0.9653 
1 1 1 -16 2   2  o 3  5.35064e+00 1.55093e+00 7.89401e+01 83.131  4.28054e-01  3.55339e+00  0.00000e+00 0.00000e+00 9.41148e+01 83.131  1.51747e+01 83.131  0.8451 
1 1 1 -16 2   3  f 0  5.04557e+00 1.51367e+00 5.55081e+01 132.916 -1.75362e+00 1.88609e+00  0.00000e+00 0.00000e+00 9.36242e+01 132.916 3.81161e+01 132.916 0.7730 
1 1 1 -16 2   4  o 6  8.36724e+00 1.38064e+00 1.18104e+02 357.680 9.90212e+00  -4.01139e-01 0.00000e+00 0.00000e+00 1.84993e+02 357.680 6.68891e+01 357.680 0.9481 
1 1 1 -16 2   5  o 1  6.32545e+00 1.73180e+00 1.47419e+02 160.474 -7.24297e+00 2.56862e+00  0.00000e+00 0.00000e+00 7.77251e+01 160.474 6.96936e+01 340.474 0.9325 
1 1 1 -16 2   6  o 13 7.74672e+00 2.12164e+00 1.53070e+02 327.782 6.90407e+00  -4.35079e+00 0.00000e+00 0.00000e+00 1.23602e+02 327.782 2.94680e+01 147.782 0.9366 
1 1 1 -16 2   7  o 19 6.72440e+00 1.92591e+00 4.92594e+01 233.023 -1.60646e+00 -2.13363e+00 0.00000e+00 0.00000e+00 1.51151e+02 233.023 1.01891e+02 233.023 0.7824 
1 1 1 -16 2   8  o 11 6.08067e+00 1.63143e+00 7.41787e+01 112.079 -1.59674e+00 3.93649e+00  0.00000e+00 0.00000e+00 1.27685e+02 112.079 5.35059e+01 112.079 0.8724 
1 1 1 -16 2   9  o 6  9.29032e+00 1.98777e+00 1.57489e+02 124.077 -6.76152e+00 9.99546e+00  0.00000e+00 0.00000e+00 1.80653e+02 124.077 2.31633e+01 124.077 0.9576 
1 1 1 -16 2   10 o 15 6.42068e+00 1.93956e+00 9.25762e+01 13.646  4.97575e+00  1.20804e+00  0.00000e+00 0.00000e+00 1.25836e+02 13.646  3.32602e+01 13.646  0.8961 
1 1 1 -16 2   11 f 0  7.56687e+00 2.25750e+00 2.05817e+02 197.115 -1.08033e+01 -3.32654e+00 0.00000e+00 0.00000e+00 6.80622e+01 197.115 1.37755e+02 17.115  0.9547 
1 1 1 -16 3   1  o 6  1.74875e+01 1.20177e+00 3.12252e+02 94.798  -4.58754e+00 5.46591e+01  0.00000e+00 0.00000e+00 3.51343e+02 94.798  3.90914e+01 94.798  0.9908 
1 1 1 -16 3   2  o 9  1.32208e+01 1.42007e+00 2.66470e+02 4.495   3.17596e+01  2.49655e+00  0.00000e+00 0.00000e+00 2.31476e+02 4.495   3.49943e+01 184.495 0.9842 
1 1 1 -16 3   3  o 15 5.53117e+00 1.40977e+00 4.35217e+01 337.586 2.16160e+00  -8.91568e-01 0.00000e+00 0.00000e+00 1.14303e+02 337.586 7.07814e+01 337.586 0.7462 
1 1 1 -16 3   4  o 16 1.33775e+01 1.32228e+00 2.41300e+02 197.419 -3.18470e+01 -9.99191e+00 0.00000e+00 0.00000e+00 2.62088e+02 197.419 2.07875e+01 197.419 0.9849 
1 1 1 -16 3   5  o 6  6.57682e+00 1.81403e+00 1.09670e+02 17.304  5.42600e+00  1.69043e+00  0.00000e+00 0.00000e+00 1.18061e+02 17.304  8.39060e+00 17.304  0.9071 
1 1 1 -16 3   6  o 12 7.08010e+00 2.04432e+00 9.65787e+01 270.079 6.75297e-03  -4.91329e+00 0.00000e+00 0.00000e+00 1.44071e+02 270.079 4.74928e+01 270.079 0.8913 
1 1 1 -16 3   7  o 4  8.00444e+00 2.07444e+00 1.00390e+02 190.690 -5.83402e+00 -1.10128e+00 0.00000e+00 0.00000e+00 1.77505e+02 190.690 7.71147e+01 190.690 0.9114 
1 1 1 -16 3   8  o 1  6.40362e+00 1.78398e+00 4.40423e+01 263.459 -2.76726e-01 -2.41336e+00 0.00000e+00 0.00000e+00 1.40432e+02 263.459 9.63894e+01 263.459 0.7571 
1 1 1 -16 3   9  f 0  3.04488e+00 1.51675e+00 1.85286e+01 80.704  1.01400e-01  6.19455e-01  0.00000e+00 0.00000e+00 1.61139e+01 80.704  2.41472e+00 260.703 0.2993 
1 1 1 -16 3   10 o 12 7.16739e+00 2.08755e+00 1.42856e+02 179.660 -8.12064e+00 4.81697e-02  0.00000e+00 0.00000e+00 1.11877e+02 179.660 3.09794e+01 359.660 0.9362 
1 1 1 -16 3   11 o 16 6.47578e+00 2.00127e+00 1.66703e+02 325.282 7.57781e+00  -5.25064e+00 0.00000e+00 0.00000e+00 6.50831e+01 325.282 1.01620e+02 145.282 0.9441 
1 1 1 -16 4   1  o 12 5.16504e+00 1.53900e+00 6.57340e+01 247.315 -1.11664e+00 -2.67135e+00 0.00000e+00 0.00000e+00 9.28952e+01 247.315 2.71613e+01 247.315 0.8019 
1 1 1 -16 4   2  o 17 1.79804e+01 1.18858e+00 2.79271e+02 9.966   4.99340e+01  8.77425e+00  0.00000e+00 0.00000e+00 4.02001e+02 9.966   1.22730e+02 9.966   0.9901 
1 1 1 -16 4   3  o 8  1.00753e+01 1.53683e+00 1.48382e+02 220.956 -1.02525e+01 -8.89848e+00 0.00000e+00 0.00000e+00 2.22408e+02 220.956 7.40266e+01 220.956 0.9624 
1 1 1 -16 4   4  o 11 8.02660e+00 1.65116e+00 1.78097e+02 108.764 -3.98446e+00 1.17285e+01  0.00000e+00 0.00000e+00 1.15913e+02 108.764 6.21836e+01 288.764 0.9587 
1 1 1 -16 4   5  o 3  5.29985e+00 1.61082e+00 7.47661e+01 99.811  -5.94142e-01 3.43573e+00  0.00000e+00 0.00000e+00 9.52469e+01 99.811  2.04808e+01 99.811  0.8404 
1 1 1 -16 4   6  o 3  7.51708e+00 2.03922e+00 4.45632e+01 37.126  1.92449e+00  1.45685e+00  0.00000e+00 0.00000e+00 1.71937e+02 37.126  1.27374e+02 37.126  0.7553 
1 1 1 -16 4   7  o 14 1.02651e+01 2.18836e+00 2.38618e+02 202.944 -1.55986e+01 -6.60309e+00 0.00000e+00 0.00000e+00 1.40691e+02 202.944 9.79275e+01 22.944  0.9700 
1 1 1 -16 4   8  o 16 7.80132e+00 2.52064e+00 1.20740e+02 82.851  6.64382e-01  5.29691e+00  0.00000e+00 0.00000e+00 1.46628e+02 82.851  2.58883e+01 82.851  0.9007 
1 1 1 -16 4   9  o 13 8.38433e+00 2.55604e+00 1.52554e+02 17.584  7.15853e+00  2.26868e+00  0.00000e+00 0.00000e+00 1.44064e+02 17.584  8.49027e+00 197.584 0.9308 
1 1 1 -16 4   10 o 11 6.36679e+00 1.98178e+00 4.01816e+01 278.555 3.22712e-01  -2.14528e+00 0.00000e+00 0.00000e+00 1.34733e+02 278.555 9.45516e+01 278.555 0.7237 
1 1 1 -16 4   11 o 12 4.79122e+00 1.63540e+00 1.17323e+02 118.150 -2.88621e+00 5.39401e+00  0.00000e+00 0.00000e+00 4.87269e+01 118.150 6.85958e+01 298.150 0.9141 
1 1 1 -16 5   1  o 12 4.78600e+00 1.47201e+00 1.10853e+02 350.329 4.61126e+00  -7.85816e-01 0.00000e+00 0.00000e+00 5.14174e+01 350.329 5.94361e+01 170.329 0.8853 
1 1 1 -16 5   2  o 10 1.02204e+01 1.57885e+00 1.70666e+02 317.899 1.08094e+01  -9.76735e+00 0.00000e+00 0.00000e+00 2.06783e+02 317.899 3.61170e+01 317.899 0.9650 
1 1 1 -16 5   3  o 10 4.47093e+00 1.39767e+00 7.34925e+01 57.740  1.71384e+00  2.71526e+00  0.00000e+00 0.00000e+00 6.74542e+01 57.740  6.03825e+00 237.740 0.8244 
1 1 1 -16 5   4  o 1  1.14367e+01 1.45883e+00 1.72227e+02 204.204 -1.72750e+01 -7.76516e+00 0.00000e+00 0.00000e+00 2.53018e+02 204.204 8.07913e+01 204.204 0.9732 
1 1 1 -16 5   5  o 3  1.17637e+01 1.69870e+00 2.03696e+02 165.977 -1.95011e+01 4.87040e+00  0.00000e+00 0.00000e+00 2.34010e+02 165.977 3.03142e+01 165.977 0.9748 
1 1 1 -16 5   6  o 10 8.70228e+00 2.13015e+00 1.55558e+02 71.666  2.91612e+00  8.79991e+00  0.00000e+00 0.00000e+00 1.57839e+02 71.666  2.28098e+00 71.666  0.9444 
1 1 1 -16 5   7  o 2  9.35391e+00 2.17248e+00 1.78052e+02 249.633 -4.04493e+00 -1.08956e+01 0.00000e+00 0.00000e+00 1.62574e+02 249.633 1.54790e+01 69.633  0.9560 
1 1 1 -16 5   8  o 5  5.23581e+00 2.16997e+00 2.87004e+01 204.341 -9.43157e-01 -4.26675e-01 0.00000e+00 0.00000e+00 6.26887e+01 204.341 3.39884e+01 204.341 0.4587 
1 1 1 -16 5   10 o 2  5.07484e+00 1.61232e+00 5.61985e+01 45.359  2.16104e+00  2.18829e+00  0.00000e+00 0.00000e+00 1.00885e+02 45.359  4.46860e+01 45.359  0.8154 
1 1 1 -16 5   11 o 4  5.64241e+00 1.81884e+00 2.02248e+01 224.708 -7.80519e-01 -7.72607e-01 0.00000e+00 0.00000e+00 8.24779e+01 224.708 6.22531e+01 224.708 0.4801 
1 1 1 -16 6   1  o 18 1.11274e+01 1.50808e+00 1.89685e+02 200.790 -1.70846e+01 -6.48657e+00 0.00000e+00 0.00000e+00 2.24624e+02 200.790 3.49381e+01 200.790 0.9722 
1 1 1 -16 6   2  o 4  3.84386e+00 1.27975e+00 1.03700e+01 294.914 1.74679e-01  -3.76080e-01 0.00000e+00 0.00000e+00 1.94909e+01 294.914 9.12086e+00 294.914 0.2030 
1 1 1 -16 6   3  o 9  4.47637e+00 1.40626e+00 1.65962e+01 107.097 -2.06166e-01 6.70288e-01  0.00000e+00 0.00000e+00 4.00103e+01 107.097 2.34140e+01 107.097 0.3307 
1 1 1 -16 6   4  o 3  5.13455e+00 1.52980e+00 6.48662e+01 282.251 6.53958e-01  -3.01169e+00 0.00000e+00 0.00000e+00 9.51760e+01 282.251 3.03098e+01 282.251 0.8159 
1 1 1 -16 6   5  o 13 9.40903e+00 1.60954e+00 1.55961e+02 56.908  7.05246e+00  1.08217e+01  0.00000e+00 0.00000e+00 1.88983e+02 56.908  3.30222e+01 56.908  0.9605 
1 1 1 -16 6   6  f 0  8.08396e+00 2.00669e+00 2.17457e+02 151.614 -1.13466e+01 6.13163e+00  0.00000e+00 0.00000e+00 7.85982e+01 151.614 1.38859e+02 331.613 0.9604 
1 1 1 -16 6   7  o 18 7.60092e+00 2.04237e+00 1.22561e+02 31.627  5.96976e+00  3.67651e+00  0.00000e+00 0.00000e+00 1.45451e+02 31.627  2.28896e+01 31.627  0.9257 
1 1 1 -16 6   8  o 19 6.47574e+00 2.34767e+00 1.13997e+02 5.740   4.57775e+00  4.60146e-01  0.00000e+00 0.00000e+00 1.03632e+02 5.740   1.03649e+01 185.740 0.8832 
1 1 1 -16 6   9  o 4  7.16365e+00 2.43125e+00 1.09478e+02 87.115  2.48811e-01  4.93683e+00  0.00000e+00 0.00000e+00 1.33393e+02 87.115  2.39152e+01 87.115  0.8920 
1 1 1 -16 6   10 o 15 6.98178e+00 2.48114e+00 1.28798e+02 291.796 2.08356e+00  -5.21042e+00 0.00000e+00 0.00000e+00 1.11279e+02 291.796 1.75190e+01 111.796 0.9059 
1 1 1 -16 6   11 o 2  7.28635e+00 1.88006e+00 1.24374e+02 112.569 -3.21400e+00 7.73295e+00  0.00000e+00 0.00000e+00 1.34798e+02 112.569 1.04238e+01 112.569 0.9382 
1 1 1 -16 7   1  o 9  4.44937e+00 1.40947e+00 5.06732e+01 143.433 -1.64596e+00 1.22093e+00  0.00000e+00 0.00000e+00 6.95745e+01 143.433 1.89013e+01 143.433 0.7057 
1 1 1 -16 7   2  o 7  6.04170e+00 1.65445e+00 1.64140e+02 247.591 -3.22601e+00 -7.82333e+00 0.00000e+00 0.00000e+00 5.29354e+01 247.591 1.11205e+02 67.591  0.9389 
1 1 1 -16 7   3  f 0  4.13461e+00 1.32355e+00 1.02475e+02 258.660 -8.19642e-01 -4.08693e+00 0.00000e+00 0.00000e+00 3.50188e+01 258.660 6.74564e+01 78.660  0.8697 
1 1 1 -16 7   4  o 7  1.09608e+01 1.52972e+00 1.28340e+02 258.205 -2.66025e+00 -1.27393e+01 0.00000e+00 0.00000e+00 2.73981e+02 258.205 1.45641e+02 258.205 0.9608 
1 1 1 -16 7   5  o 12 7.92163e+00 1.88019e+00 1.83653e+02 185.771 -1.09942e+01 -1.11117e+00 0.00000e+00 0.00000e+00 1.04683e+02 185.771 7.89704e+01 5.771   0.9536 
1 1 1 -16 7   6  o 13 1.02942e+01 2.11851e+00 2.00951e+02 69.544  4.98204e+00  1.33564e+01  0.00000e+00 0.00000e+00 1.77553e+02 69.544  2.33982e+01 249.544 0.9643 
1 1 1 -16 7   7  o 7  8.37484e+00 2.07450e+00 1.01091e+02 230.578 -3.97033e+00 -4.82981e+00 0.00000e+00 0.00000e+00 1.91159e+02 230.578 9.00675e+01 230.578 0.9161 
1 1 1 -16 7   8  f 0  4.10476e+00 1.89520e+00 1.10327e+02 141.597 -2.86320e+00 2.26960e+00  0.00000e+00 0.00000e+00 2.22341e+01 141.597 8.80925e+01 321.597 0.8487 
1 1 1 -16 7   9  o 4  5.67526e+00 2.22940e+00 1.02307e+02 329.548 3.55492e+00  -2.08998e+00 0.00000e+00 0.00000e+00 8.49374e+01 329.548 1.73701e+01 149.548 0.8681 
1 1 1 -16 7   10 o 19 7.96685e+00 2.40263e+00 1.62275e+02 51.127  5.30348e+00  6.57912e+00  0.00000e+00 0.00000e+00 1.21637e+02 51.127  4.06383e+01 231.127 0.9388 
1 1 1 -16 7   11 o 9  6.00167e+00 1.81346e+00 6.85769e+01 247.338 -1.53105e+00 -3.66701e+00 0.00000e+00 0.00000e+00 1.27664e+02 247.338 5.90874e+01 247.338 0.8625 
1 1 1 -16 8   1  o 14 6.35336e+00 1.61212e+00 1.32147e+02 86.883  3.98603e-01  7.32086e+00  0.00000e+00 0.00000e+00 9.38934e+01 86.883  3.82539e+01 266.883 0.9291 
1 1 1 -16 8   2  f 0  4.49883e+00 1.42423e+00 5.38669e+01 39.459  1.80508e+00  1.48582e+00  0.00000e+00 0.00000e+00 7.45875e+01 39.459  2.07205e+01 39.459  0.7462 
1 1 1 -16 8   3  o 8  8.44241e+00 1.56629e+00 8.71651e+01 63.325  2.87046e+00  5.71355e+00  0.00000e+00 0.00000e+00 2.09194e+02 63.325  1.22029e+02 63.325  0.9181 
1 1 1 -16 8   4  o 4  5.73080e+00 1.60609e+00 1.13896e+02 276.765 6.85499e-01  -5.77842e+00 0.00000e+00 0.00000e+00 8.52139e+01 276.765 2.86825e+01 96.765  0.9095 
1 1 1 -16 8   5  f 0  1.02629e+01 1.82599e+00 8.87277e+01 234.522 -4.13373e+00 -5.79995e+00 0.00000e+00 0.00000e+00 2.74343e+02 234.522 1.85616e+02 234.522 0.9269 
1 1 1 -16 8   6  o 1  1.05535e+01 1.79336e+00 2.04936e+02 94.463  -1.37963e+00 1.76745e+01  0.00000e+00 0.00000e+00 1.85957e+02 94.463  1.89784e+01 274.463 0.9714 
1 1 1 -16 8   7  o 12 5.38567e+00 1.72706e+00 1.05596e+02 3.593   5.12743e+00  3.21975e-01  0.00000e+00 0.00000e+00 7.83116e+01 3.593   2.72848e+01 183.593 0.8965 
1 1 1 -16 8   8  o 11 5.50618e+00 2.13363e+00 9.81216e+01 232.260 -2.32476e+00 -3.00354e+00 0.00000e+00 0.00000e+00 8.10643e+01 232.260 1.70573e+01 52.260  0.8553 
1 1 1 -16 8   9  o 15 3.72843e+00 1.76244e+00 5.37098e+01 293.908 7.70001e-01  -1.73693e+00 0.00000e+00 0.00000e+00 4.27355e+01 293.908 1.09743e+01 113.908 0.6806 
1 1 1 -16 8   11 o 9  7.55372e+00 1.92637e+00 1.16218e+02 114.594 -3.27391e+00 7.15282e+00  0.00000e+00 0.00000e+00 1.51264e+02 114.594 3.50459e+01 114.594 0.9341 
1 1 1 -16 9   1  o 17 1.48247e+01 1.30221e+00 2.46884e+02 21.907  3.49165e+01  1.40411e+01  0.00000e+00 0.00000e+00 3.13217e+02 21.907  6.63334e+01 21.907  0.9866 
1 1 1 -16 9   2  o 14 4.98703e+00 1.44014e+00 9.15392e+01 7.896   4.32468e+00  5.99795e-01  0.00000e+00 0.00000e+00 7.56789e+01 7.896   1.58603e+01 187.896 0.8763 
1 1 1 -16 9   3  o 5  5.20875e+00 1.49207e+00 1.22941e+02 245.735 -2.37550e+00 -5.26971e+00 0.00000e+00 0.00000e+00 5.80541e+01 245.735 6.48871e+01 65.735  0.9088 
1 1 1 -16 9   4  o 12 6.68371e+00 1.72849e+00 5.52042e+01 271.237 6.63712e-02  -3.07429e+00 0.00000e+00 0.00000e+00 1.52989e+02 271.237 9.77852e+01 271.237 0.8154 
1 1 1 -16 9   5  o 17 9.64283e+00 1.80274e+00 1.76191e+02 266.102 -9.14712e-01 -1.34234e+01 0.00000e+00 0.00000e+00 1.77895e+02 266.102 1.70405e+00 266.102 0.9621 
1 1 1 -16 9   6  o 12 6.64324e+00 1.73713e+00 6.55871e+01 180.880 -3.68465e+00 -5.65740e-02 0.00000e+00 0.00000e+00 1.49777e+02 180.880 8.41902e+01 180.880 0.8502 
1 1 1 -16 9   7  o 16 8.58472e+00 1.93828e+00 1.40124e+02 96.391  -1.06728e+00 9.52830e+00  0.00000e+00 0.00000e+00 1.69315e+02 96.391  2.91913e+01 96.391  0.9463 
1 1 1 -16 9   8  o 14 5.66596e+00 2.23243e+00 9.52864e+01 286.778 1.09033e+00  -3.61634e+00 0.00000e+00 0.00000e+00 8.88975e+01 286.778 6.38895e+00 106.778 0.8544 
1 1 1 -16 9   9  o 13 5.90121e+00 2.26949e+00 1.05620e+01 240.150 -2.15030e-01 -3.74714e-01 0.00000e+00 0.00000e+00 3.67868e+01 240.150 2.62248e+01 240.150 0.2111 
1 1 1 -16 9   11 o 18 6.46551e+00 1.73323e+00 1.00486e+02 39.951  5.07048e+00  4.24733e+00  0.00000e+00 0.00000e+00 1.25238e+02 39.951  2.47523e+01 39.951  0.9210 
1 1 1 -16 10  1  o 10 1.14186e+01 1.57244e+00 1.91000e+02 0.948   1.94422e+01  3.21667e-01  0.00000e+00 0.00000e+00 2.34853e+02 0.948   4.38522e+01 0.948   0.9739 
1 1 1 -16 10  2  o 5  8.37513e+00 1.68160e+00 9.93746e+01 304.723 3.98325e+00  -5.74764e+00 0.00000e+00 0.00000e+00 1.97207e+02 304.723 9.78320e+01 304.723 0.9255 
1 1 1 -16 10  3  o 2  5.79862e+00 1.57467e+00 9.35531e+01 221.251 -3.52613e+00 -3.09247e+00 0.00000e+00 0.00000e+00 1.02803e+02 221.251 9.24991e+00 221.251 0.8857 
1 1 1 -16 10  4  o 6  5.37982e+00 1.59083e+00 7.06448e+01 141.075 -2.65685e+00 2.14570e+00  0.00000e+00 0.00000e+00 1.01278e+02 141.075 3.06335e+01 141.075 0.8365 
1 1 1 -16 10  5  o 14 5.78514e+00 1.67954e+00 7.40252e+01 319.712 2.82914e+00  -2.39826e+00 0.00000e+00 0.00000e+00 1.13942e+02 319.712 3.99168e+01 319.712 0.8513 
1 1 1 -16 10  6  o 6  4.31289e+00 1.42333e+00 7.26662e+01 189.060 -3.11498e+00 -4.96694e-01 0.00000e+00 0.00000e+00 6.23066e+01 189.060 1.03597e+01 9.060   0.8208 
1 1 1 -16 10  7  o 12 5.86450e+00 1.72671e+00 8.13455e+01 333.384 3.85201e+00  -1.93032e+00 0.00000e+00 0.00000e+00 1.13977e+02 333.384 3.26315e+01 333.384 0.8744 
1 1 1 -16 10  8  o 18 5.89044e+00 2.27737e+00 7.83953e+01 155.693 -2.86652e+00 1.29474e+00  0.00000e+00 0.00000e+00 1.05419e+02 155.693 2.70237e+01 155.693 0.8202 
1 1 1 -16 10  9  o 14 5.51256e+00 2.21227e+00 9.40494e+01 281.011 7.10259e-01  -3.65005e+00 0.00000e+00 0.00000e+00 8.43865e+01 281.011 9.66284e+00 101.011 0.8518 
1 1 1 -16 10  10 o 4  6.64070e+00 2.47898e+00 1.04306e+02 50.274  2.69441e+00  3.24244e+00  0.00000e+00 0.00000e+00 1.15320e+02 50.274  1.10139e+01 50.274  0.8713 
1 1 1 -16 10  11 o 4  5.99821e+00 1.77114e+00 1.39038e+02 51.791  5.16674e+00  6.56372e+00  0.00000e+00 0.00000e+00 7.42605e+01 51.791  6.47770e+01 231.791 0.9381 
1 1 1 -16 11  1  o 3  7.86465e+00 1.70259e+00 1.09444e+02 246.809 -2.81617e+00 -6.57345e+00 0.00000e+00 0.00000e+00 1.69778e+02 246.809 6.03343e+01 246.809 0.9272 
1 1 1 -16 11  2  o 12 5.68708e+00 1.58877e+00 1.47221e+02 232.083 -4.42138e+00 -5.67613e+00 0.00000e+00 0.00000e+00 5.46428e+01 232.083 9.25777e+01 52.083  0.9276 
1 1 1 -16 11  3  o 10 1.33294e+01 1.30069e+00 2.39100e+02 288.355 1.05056e+01  -3.16637e+01 0.00000e+00 0.00000e+00 2.62826e+02 288.355 2.37268e+01 288.355 0.9849 
1 1 1 -16 11  4  o 4  7.60619e+00 1.85337e+00 1.05611e+02 104.490 -1.56306e+00 6.04845e+00  0.00000e+00 0.00000e+00 1.60551e+02 104.490 5.49395e+01 104.490 0.9160 
1 1 1 -16 11  5  o 10 8.71805e+00 1.76984e+00 1.75324e+02 19.857  1.18373e+01  4.27499e+00  0.00000e+00 0.00000e+00 1.43896e+02 19.857  3.14281e+01 199.857 0.9594 
1 1 1 -16 11  6  o 11 8.78245e+00 1.85726e+00 1.64923e+02 214.360 -9.45021e+00 -6.46103e+00 0.00000e+00 0.00000e+00 1.54954e+02 214.360 9.96936e+00 34.360  0.9553 
1 1 1 -16 11  7  o 16 7.73833e+00 1.64196e+00 1.62148e+02 139.473 -9.05639e+00 7.74234e+00  0.00000e+00 0.00000e+00 1.19936e+02 139.473 4.22120e+01 319.473 0.9571 
1 1 1 -16 11  9  o 16 4.67815e+00 2.06660e+00 1.27024e+02 76.699  1.08292e+00  4.58085e+00  0.00000e+00 0.00000e+00 3.05078e+01 76.699  9.65162e+01 256.699 0.8861 
1 1 1 -16 11  10 o 2  8.27246e+00 2.49678e+00 1.28552e+02 214.123 -5.30280e+00 -3.59335e+00 0.00000e+00 0.00000e+00 1.59757e+02 214.123 3.12054e+01 214.123 0.9182 
1 1 1 -16 11  11 o 18 4.51447e+00 1.51526e+00 6.72844e+01 312.432 2.44184e+00  -2.67116e+00 0.00000e+00 0.00000e+00 7.76756e+01 312.432 1.03912e+01 312.432 0.8471 
1 1 1 -16 12  1  o 10 9.29476e+00 1.61347e+00 1.17945e+02 321.352 7.46155e+00  -5.96674e+00 0.00000e+00 0.00000e+00 2.18781e+02 321.352 1.00836e+02 321.352 0.9461 
1 1 1 -16 12  2  o 18 7.64012e+00 1.58418e+00 1.59161e+02 138.309 -7.81889e+00 6.96410e+00  0.00000e+00 0.00000e+00 1.18838e+02 138.309 4.03231e+01 318.309 0.9510 
1 1 1 -16 12  3  o 1  6.48735e+00 1.50389e+00 8.14109e+01 322.851 3.95383e+00  -2.99554e+00 0.00000e+00 0.00000e+00 1.39939e+02 322.851 5.85284e+01 322.851 0.8925 
1 1 1 -16 12  4  o 5  6.81123e+00 1.79310e+00 1.43990e+02 60.461  3.97260e+00  7.01032e+00  0.00000e+00 0.00000e+00 9.94669e+01 60.461  4.45234e+01 240.461 0.9357 
1 1 1 -16 12  5  o 12 5.55322e+00 1.56974e+00 1.65278e+02 316.086 6.08059e+00  -5.85436e+00 0.00000e+00 0.00000e+00 3.36735e+01 316.086 1.31604e+02 136.086 0.9387 
1 1 1 -16 12  6  o 5  4.95691e+00 1.53674e+00 3.78521e+01 147.817 -1.50067e+00 9.44388e-01  0.00000e+00 0.00000e+00 8.62695e+01 147.817 4.84174e+01 147.817 0.6568 
1 1 1 -16 12  7  o 12 4.43085e+00 1.42482e+00 1.20190e+02 66.092  2.32916e+00  5.25418e+00  0.00000e+00 0.00000e+00 3.30827e+01 66.092  8.71069e+01 246.092 0.9082 
1 1 1 -16 12  8  o 7  1.34929e+01 1.89233e+00 1.58476e+02 230.701 -1.16426e+01 -1.42250e+01 0.00000e+00 0.00000e+00 3.40695e+02 230.701 1.82219e+02 230.701 0.9724 
1 1 1 -16 12  9  o 17 6.97383e+00 2.36994e+00 9.06491e+01 129.274 -2.63562e+00 3.22303e+00  0.00000e+00 0.00000e+00 1.39783e+02 129.274 4.91339e+01 129.274 0.8695 
1 1 1 -16 12  10 o 14 1.25502e+01 1.82283e+00 2.35643e+02 325.376 2.19621e+01  -1.51640e+01 0.00000e+00 0.00000e+00 2.31676e+02 325.376 3.96683e+00 145.376 0.9811 
1 1 1 -16 12  11 o 11 6.21564e+00 1.85535e+00 1.52788e+02 99.454  -1.47591e+00 8.86329e+00  0.00000e+00 0.00000e+00 6.92912e+01 99.454  8.34970e+01 279.454 0.9426 
1 1 1 -16 13  1  o 8  7.74281e+00 1.67294e+00 8.79792e+01 89.638  3.53350e-02  5.59934e+00  0.00000e+00 0.00000e+00 1.80515e+02 89.638  9.25360e+01 89.638  0.9056 
1 1 1 -16 13  2  o 16 5.77738e+00 1.58184e+00 8.85344e+01 165.791 -4.27293e+00 1.08196e+00  0.00000e+00 0.00000e+00 1.05448e+02 165.791 1.69138e+01 165.791 0.8776 
1 1 1 -16 13  3  o 8  8.63446e+00 1.65402e+00 1.05135e+02 114.561 -3.26465e+00 7.14335e+00  0.00000e+00 0.00000e+00 2.03172e+02 114.561 9.80376e+01 114.561 0.9340 
1 1 1 -16 13  4  o 6  4.25526e+00 1.42413e+00 6.80584e+01 353.981 2.90694e+00  -3.06502e-01 0.00000e+00 0.00000e+00 6.26460e+01 353.981 5.41245e+00 173.981 0.8041 
1 1 1 -16 13  5  o 4  6.29426e+00 1.73147e+00 1.60577e+02 316.429 6.15520e+00  -5.85564e+00 0.00000e+00 0.00000e+00 6.50135e+01 316.429 9.55639e+01 136.429 0.9392 
1 1 1 -16 13  6  o 6  6.40983e+00 1.75810e+00 1.71608e+02 149.996 -8.58031e+00 4.95454e+00  0.00000e+00 0.00000e+00 6.00862e+01 149.996 1.11522e+02 329.996 0.9481 
1 1 1 -16 13  7  o 6  1.10825e+01 1.65985e+00 1.89558e+02 117.308 -9.08648e+00 1.75989e+01  0.00000e+00 0.00000e+00 2.21726e+02 117.308 3.21686e+01 117.308 0.9744 
1 1 1 -16 13  8  o 19 1.02799e+01 2.05438e+00 1.40101e+02 52.506  6.57600e+00  8.57174e+00  0.00000e+00 0.00000e+00 2.32419e+02 52.506  9.23185e+01 52.506  0.9525 
1 1 1 -16 13  9  o 2  7.03829e+00 2.33832e+00 8.56621e+01 91.898  -1.33992e-01 4.04322e+00  0.00000e+00 0.00000e+00 1.45747e+02 91.898  6.00853e+01 91.898  0.8652 
1 1 1 -16 13  10 o 14 7.88610e+00 1.93663e+00 2.04269e+02 230.060 -8.69247e+00 -1.03812e+01 0.00000e+00 0.00000e+00 8.37560e+01 230.060 1.20513e+02 50.060  0.9623 
1 1 1 -16 13  11 o 8  4.49361e+00 1.47041e+00 3.58201e+01 286.582 5.63861e-01  -1.89361e+00 0.00000e+00 0.00000e+00 8.23442e+01 286.582 4.65241e+01 286.582 0.6938 
1 1 1 -16 14  1  o 14 1.00301e+01 1.60612e+00 2.30335e+02 136.722 -1.43127e+01 1.34772e+01  0.00000e+00 0.00000e+00 1.43798e+02 136.722 8.65361e+01 316.722 0.9742 
1 1 1 -16 14  2  f 0  4.42324e+00 1.38013e+00 1.12103e+02 313.646 3.26971e+00  -3.42801e+00 0.00000e+00 0.00000e+00 3.79907e+01 313.646 7.41118e+01 133.646 0.8869 
1 1 1 -16 14  3  o 14 4.90202e+00 1.46397e+00 1.28549e+02 126.772 -3.61648e+00 4.83926e+00  0.00000e+00 0.00000e+00 4.25464e+01 126.772 8.60026e+01 306.772 0.9130 
1 1 1 -16 14  4  o 5  1.57020e+01 1.47783e+00 2.46586e+02 286.438 1.07324e+01  -3.63767e+01 0.00000e+00 0.00000e+00 3.45212e+02 286.438 9.86261e+01 286.438 0.9867 
1 1 1 -16 14  5  o 11 6.61555e+00 1.79776e+00 6.12959e+01 200.607 -3.17827e+00 -1.19506e+00 0.00000e+00 0.00000e+00 1.49621e+02 200.607 8.83247e+01 200.607 0.8355 
1 1 1 -16 14  6  o 1  4.77461e+00 1.49040e+00 8.17452e+01 350.896 4.07967e+00  -6.53767e-01 0.00000e+00 0.00000e+00 7.63267e+01 350.896 5.41846e+00 170.896 0.8684 
1 1 1 -16 14  7  o 9  8.76283e+00 1.80184e+00 1.72359e+02 293.383 5.19124e+00  -1.20061e+01 0.00000e+00 0.00000e+00 1.48343e+02 293.383 2.40156e+01 113.383 0.9610 
1 1 1 -16 14  8  o 1  7.94993e+00 1.73587e+00 1.17615e+02 48.749  5.58483e+00  6.36814e+00  0.00000e+00 0.00000e+00 1.66358e+02 48.749  4.87429e+01 48.749  0.9390 
1 1 1 -16 14  9  o 3  9.59842e+00 2.12585e+00 1.15465e+02 233.324 -5.05147e+00 -6.78298e+00 0.00000e+00 0.00000e+00 2.26959e+02 233.324 1.11494e+02 233.324 0.9389 
1 1 1 -16 14  10 o 3  6.15273e+00 1.81703e+00 9.97259e+01 307.525 3.55535e+00  -4.62922e+00 0.00000e+00 0.00000e+00 1.12704e+02 307.525 1.29779e+01 307.525 0.9097 
1 1 1 -16 14  11 o 3  4.33457e+00 1.45994e+00 1.02295e+02 120.965 -2.85072e+00 4.75096e+00  0.00000e+00 0.00000e+00 4.63182e+01 120.965 5.59766e+01 300.965 0.9046 
1 1 1 -16 15  1  o 7  5.21129e+00 1.45799e+00 1.00321e+02 209.743 -4.16881e+00 -2.38200e+00 0.00000e+00 0.00000e+00 7.69661e+01 209.743 2.33546e+01 29.743  0.8886 
1 1 1 -16 15  2  o 10 1.89822e+01 1.12553e+00 3.40714e+02 51.359  4.62010e+01  5.77905e+01  0.00000e+00 0.00000e+00 3.80583e+02 51.359  3.98691e+01 51.359  0.9932 
1 1 1 -16 15  3  o 19 9.44406e+00 1.55926e+00 1.45980e+02 167.872 -1.23272e+01 2.64904e+00  0.00000e+00 0.00000e+00 2.00417e+02 167.872 5.44379e+01 167.872 0.9595 
1 1 1 -16 15  4  o 14 1.36852e+01 1.62890e+00 2.45755e+02 62.182  1.36781e+01  2.59236e+01  0.00000e+00 0.00000e+00 2.67953e+02 62.182  2.21987e+01 62.182  0.9828 
1 1 1 -16 15  5  o 1  7.84995e+00 1.82856e+00 1.17650e+02 117.143 -3.46511e+00 6.75897e+00  0.00000e+00 0.00000e+00 1.61423e+02 117.143 4.37730e+01 117.143 0.9316 
1 1 1 -16 15  6  o 5  6.02523e+00 1.72332e+00 1.01056e+02 169.304 -5.50128e+00 1.03907e+00  0.00000e+00 0.00000e+00 1.06964e+02 169.304 5.90784e+00 169.304 0.9056 
1 1 1 -16 15  7  o 15 8.85476e+00 1.64520e+00 1.77126e+02 29.543  1.29668e+01  7.34918e+00  0.00000e+00 0.00000e+00 1.48569e+02 29.543  2.85570e+01 209.543 0.9658 
1 1 1 -16 15  8  o 19 6.74702e+00 1.80920e+00 9.99022e+01 282.153 1.22985e+00  -5.71068e+00 0.00000e+00 0.00000e+00 1.33614e+02 282.153 3.37115e+01 282.153 0.9098 
1 1 1 -16 15  9  o 4  5.04243e+00 2.14608e+00 6.85964e+01 201.725 -2.36310e+00 -9.41609e-01 0.00000e+00 0.00000e+00 7.88688e+01 201.725 1.02725e+01 201.725 0.7697 
1 1 1 -16 15  10 o 14 1.04398e+01 1.89579e+00 1.96212e+02 122.558 -9.95723e+00 1.55948e+01  0.00000e+00 0.00000e+00 1.89115e+02 122.558 7.09696e+00 302.558 0.9726 
1 1 1 -16 15  11 o 1  5.21649e+00 1.67212e+00 1.67339e+01 197.122 -9.00289e-01 -2.77342e-01 0.00000e+00 0.00000e+00 6.73869e+01 197.122 5.06530e+01 197.122 0.4255 
1 1 1 -16 16  1  o 1  5.27330e+00 1.50423e+00 1.53160e+02 29.438  6.60691e+00  3.72861e+00  0.00000e+00 0.00000e+00 3.49069e+01 29.438  1.18253e+02 209.438 0.9315 
1 1 1 -16 16  2  o 15 1.04584e+01 1.47011e+00 1.66149e+02 173.066 -1.64938e+01 2.00599e+00  0.00000e+00 0.00000e+00 2.21719e+02 173.066 5.55705e+01 173.066 0.9694 
1 1 1 -16 16  3  f 0  6.72811e+00 1.62493e+00 5.89397e+01 217.449 -2.77671e+00 -2.12675e+00 0.00000e+00 0.00000e+00 1.57350e+02 217.449 9.84103e+01 217.449 0.8410 
1 1 1 -16 16  4  o 13 5.78124e+00 1.59255e+00 1.21013e+02 249.168 -2.21022e+00 -5.80873e+00 0.00000e+00 0.00000e+00 8.11497e+01 249.168 3.98632e+01 69.168  0.9156 
1 1 1 -16 16  5  o 14 5.53600e+00 1.65048e+00 1.53196e+02 162.894 -7.38151e+00 2.27172e+00  0.00000e+00 0.00000e+00 4.38544e+01 162.894 1.09342e+02 342.894 0.9328 
1 1 1 -16 16  6  o 11 1.02013e+01 1.81360e+00 1.72576e+02 263.292 -1.76679e+00 -1.50215e+01 0.00000e+00 0.00000e+00 2.03221e+02 263.292 3.06446e+01 263.292 0.9664 
1 1 1 -16 16  7  o 15 6.42208e+00 1.68230e+00 1.27788e+02 354.092 7.59433e+00  -7.85842e-01 0.00000e+00 0.00000e+00 1.00141e+02 354.092 2.76472e+01 174.092 0.9320 
1 1 1 -16 16  8  o 12 4.86514e+00 1.50858e+00 7.08491e+01 86.752  2.16405e-01  3.81360e+00  0.00000e+00 0.00000e+00 8.76058e+01 86.752  1.67568e+01 86.752  0.8562 
1 1 1 -16 16  9  o 15 4.34257e+00 1.45251e+00 5.41185e+01 154.520 -2.39429e+00 1.14099e+00  0.00000e+00 0.00000e+00 7.46749e+01 154.520 2.05564e+01 154.520 0.7806 
1 1 1 -16 16  10 o 11 5.42417e+00 1.69652e+00 9.21297e+01 260.189 -8.76353e-01 -5.06768e+00 0.00000e+00 0.00000e+00 9.24228e+01 260.189 2.93005e-01 260.189 0.8966 
1 1 1 -16 16  11 o 18 5.53434e+00 1.64909e+00 1.48158e+02 153.876 -8.06728e+00 3.95639e+00  0.00000e+00 0.00000e+00 4.95483e+01 153.876 9.86100e+01 333.875 0.9426 
1 1 1 -16 17  1  o 6  4.00761e+00 1.28245e+00 8.06648e+01 221.497 -2.55693e+00 -2.26197e+00 0.00000e+00 0.00000e+00 4.76696e+01 221.497 3.29952e+01 41.497  0.8365 
1 1 1 -16 17  2  o 9  1.00397e+01 1.59333e+00 1.69555e+02 104.562 -3.82607e+00 1.47284e+01  0.00000e+00 0.00000e+00 2.01669e+02 104.562 3.21140e+01 104.562 0.9666 
1 1 1 -16 17  3  o 7  4.61147e+00 1.39872e+00 3.71843e+01 231.114 -1.10237e+00 -1.36687e+00 0.00000e+00 0.00000e+00 7.79819e+01 231.114 4.07976e+01 231.114 0.6534 
1 1 1 -16 17  4  o 16 4.95192e+00 1.52334e+00 1.02510e+02 302.841 2.53690e+00  -3.93026e+00 0.00000e+00 0.00000e+00 6.49252e+01 302.841 3.75848e+01 122.841 0.8853 
1 1 1 -16 17  5  o 16 1.19151e+01 1.67437e+00 2.28604e+02 19.122  2.27870e+01  7.90075e+00  0.00000e+00 0.00000e+00 2.16504e+02 19.122  1.21001e+01 199.122 0.9790 
1 1 1 -16 17  6  o 19 4.02021e+00 1.35613e+00 4.08033e+01 165.915 -1.79176e+00 4.49547e-01  0.00000e+00 0.00000e+00 6.20297e+01 165.915 2.12264e+01 165.915 0.6710 
1 1 1 -16 17  7  o 15 1.18036e+01 1.67157e+00 1.28964e+02 71.334  4.55887e+00  1.34948e+01  0.00000e+00 0.00000e+00 3.04430e+02 71.334  1.75466e+02 71.334  0.9642 
1 1 1 -16 17  8  o 19 3.98794e+00 1.33119e+00 7.84472e+01 344.851 3.74180e+00  -1.01307e+00 0.00000e+00 0.00000e+00 5.17939e+01 344.851 2.66533e+01 164.851 0.8586 
1 1 1 -16 17  9  o 10 6.00570e+00 1.72462e+00 9.36005e+01 258.263 -1.14208e+00 -5.49688e+00 0.00000e+00 0.00000e+00 1.13106e+02 258.263 1.95056e+01 258.263 0.9059 
1 1 1 -16 17  10 o 4  8.35263e+00 1.89680e+00 2.13380e+02 72.388  4.83143e+00  1.52193e+01  0.00000e+00 0.00000e+00 9.34814e+01 72.388  1.19898e+02 252.388 0.9682 
1 1 1 -16 17  11 o 14 4.69486e+00 1.54966e+00 1.16394e+02 60.934  3.14810e+00  5.66385e+00  0.00000e+00 0.00000e+00 4.71581e+01 60.934  6.92357e+01 240.934 0.9192 
1 1 1 -16 18  1  o 8  8.92746e+00 1.53846e+00 1.62157e+02 224.791 -9.50674e+00 -9.43777e+00 0.00000e+00 0.00000e+00 1.66581e+02 224.791 4.42395e+00 224.791 0.9619 
1 1 1 -16 18  2  o 6  7.11571e+00 1.62170e+00 1.26609e+02 238.298 -4.18428e+00 -6.77454e+00 0.00000e+00 0.00000e+00 1.27873e+02 238.298 1.26454e+00 238.298 0.9349 
1 1 1 -16 18  3  f 0  4.13204e+00 1.30719e+00 1.22913e+02 158.793 -5.09333e+00 1.97625e+00  0.00000e+00 0.00000e+00 1.97226e+01 158.793 1.03191e+02 338.793 0.9031 
1 1 1 -16 18  4  o 3  5.66739e+00 1.66744e+00 1.00721e+02 219.639 -3.83236e+00 -3.17480e+00 0.00000e+00 0.00000e+00 9.25202e+01 219.639 8.20110e+00 39.639  0.8928 
1 1 1 -16 18  5  o 8  8.30593e+00 1.90005e+00 1.97003e+02 95.490  -1.21936e+00 1.26877e+01  0.00000e+00 0.00000e+00 1.07208e+02 95.490  8.97942e+01 275.490 0.9599 
1 1 1 -16 18  6  o 4  7.03593e+00 1.83610e+00 8.42468e+01 304.850 2.88117e+00  -4.13780e+00 0.00000e+00 0.00000e+00 1.55608e+02 304.850 7.13611e+01 304.850 0.8943 
1 1 1 -16 18  7  o 4  4.75439e+00 1.48835e+00 1.19015e+02 313.621 4.19042e+00  -4.39716e+00 0.00000e+00 0.00000e+00 4.63594e+01 313.621 7.26553e+01 133.621 0.9135 
1 1 1 -16 18  8  o 12 8.05483e+00 1.72950e+00 1.09249e+02 213.471 -7.06266e+00 -4.66961e+00 0.00000e+00 0.00000e+00 1.78414e+02 213.471 6.91656e+01 213.471 0.9389 
1 1 1 -16 18  9  o 19 7.35782e+00 1.87387e+00 1.20193e+02 72.605  2.39533e+00  7.64567e+00  0.00000e+00 0.00000e+00 1.41264e+02 72.605  2.10708e+01 72.605  0.9353 
1 1 1 -16 18  10 o 3  1.10833e+01 1.68800e+00 1.78375e+02 221.288 -1.52423e+01 -1.33853e+01 0.00000e+00 0.00000e+00 2.31676e+02 221.288 5.33016e+01 221.288 0.9750 
1 1 1 -16 18  11 o 19 4.83946e+00 1.52258e+00 9.66085e+01 30.648  4.85795e+00  2.87842e+00  0.00000e+00 0.00000e+00 6.96380e+01 30.648  2.69704e+01 210.647 0.9065 
1 1 1 -16 19  1  o 9  9.01107e+00 1.53882e+00 2.07021e+02 149.029 -1.47916e+01 8.87743e+00  0.00000e+00 0.00000e+00 1.27763e+02 149.029 7.92585e+01 329.029 0.9706 
1 1 1 -16 19  2  o 8  1.25155e+01 1.38457e+00 2.66009e+02 321.142 2.60400e+01  -2.09799e+01 0.00000e+00 0.00000e+00 2.05506e+02 321.142 6.05026e+01 141.142 0.9849 
1 1 1 -16 19  3  o 10 5.55467e+00 1.52917e+00 1.22148e+02 265.531 -5.03337e-01 -6.43946e+00 0.00000e+00 0.00000e+00 7.29467e+01 265.531 4.92014e+01 85.531  0.9189 
1 1 1 -16 19  4  o 17 5.55113e+00 1.54584e+00 1.14484e+02 108.508 -1.87995e+00 5.61603e+00  0.00000e+00 0.00000e+00 7.86622e+01 108.508 3.58222e+01 288.508 0.9111 
1 1 1 -16 19  5  o 5  9.45795e+00 1.82388e+00 1.27180e+02 231.671 -6.00979e+00 -7.60170e+00 0.00000e+00 0.00000e+00 2.14506e+02 231.671 8.73260e+01 231.671 0.9469 
1 1 1 -16 19  6  o 3  5.31518e+00 1.62703e+00 5.52498e+01 176.839 -2.82433e+00 1.55976e-01  0.00000e+00 0.00000e+00 1.06106e+02 176.839 5.08565e+01 176.839 0.7965 
1 1 1 -16 19  7  f 0  1.73758e+01 1.44011e+00 3.06391e+02 330.132 5.10027e+01  -2.92905e+01 0.00000e+00 0.00000e+00 3.49551e+02 330.132 4.31599e+01 330.132 0.9915 
1 1 1 -16 19  8  o 9  5.12586e+00 1.60908e+00 1.05840e+02 346.959 5.28117e+00  -1.22322e+00 0.00000e+00 0.00000e+00 7.00690e+01 346.959 3.57708e+01 166.959 0.9023 
1 1 1 -16 19  9  o 18 4.65556e+00 1.50602e+00 6.03224e+01 300.097 1.62223e+00  -2.79879e+00 0.00000e+00 0.00000e+00 8.57574e+01 300.097 2.54350e+01 300.097 0.8260 
1 1 1 -16 19  10 o 11 4.62931e+00 1.49718e+00 1.50513e+02 91.018  -1.49258e-01 8.40360e+00  0.00000e+00 0.00000e+00 1.43287e+01 91.018  1.36185e+02 271.017 0.9385 
1 1 1 -16 19  11 o 3  5.68490e+00 1.56244e+00 8.59584e+01 6.276   5.87106e+00  6.45723e-01  0.00000e+00 0.00000e+00 1.10266e+02 6.276   2.43078e+01 6.276   0.9109 
1 1 1 -16 20  1  o 16 6.30004e+00 1.53865e+00 1.01950e+02 307.491 3.70602e+00  -4.83139e+00 0.00000e+00 0.00000e+00 1.18391e+02 307.491 1.64407e+01 307.491 0.9137 
1 1 1 -16 20  2  o 5  6.38684e+00 1.59025e+00 1.14486e+02 126.159 -3.97220e+00 5.43550e+00  0.00000e+00 0.00000e+00 1.10850e+02 126.159 3.63680e+00 306.159 0.9224 
1 1 1 -16 20  3  o 3  1.00015e+01 1.53832e+00 2.16899e+02 71.483  6.30355e+00  1.88203e+01  0.00000e+00 0.00000e+00 1.55586e+02 71.483  6.13126e+01 251.483 0.9745 
1 1 1 -16 20  4  o 1  2.20179e+01 1.27003e+00 3.37567e+02 189.183 -8.29051e+01 -1.34031e+01 0.00000e+00 0.00000e+00 4.98180e+02 189.183 1.60613e+02 189.183 0.9940 
1 1 1 -16 20  5  o 18 2.31901e+01 1.33978e+00 4.71065e+02 335.735 1.04864e+02  -4.72701e+01 0.00000e+00 0.00000e+00 4.09795e+02 335.735 6.12697e+01 155.735 0.9956 
1 1 1 -16 20  6  o 3  7.94860e+00 1.69248e+00 1.25907e+02 52.432  5.64891e+00  7.34380e+00  0.00000e+00 0.00000e+00 1.60191e+02 52.432  3.42839e+01 52.432  0.9444 
1 1 1 -16 20  7  o 3  1.17264e+01 1.64486e+00 2.14280e+02 291.651 8.66422e+00  -2.18267e+01 0.00000e+00 0.00000e+00 2.22573e+02 291.651 8.29311e+00 291.651 0.9785 
1 1 1 -16 20  8  o 16 5.32155e+00 1.64477e+00 1.11951e+02 135.747 -4.16948e+00 4.06211e+00  0.00000e+00 0.00000e+00 7.21161e+01 135.747 3.98353e+01 315.747 0.9095 
1 1 1 -16 20  9  o 10 1.03475e+01 1.67478e+00 1.65476e+02 100.016 -3.15230e+00 1.78483e+01  0.00000e+00 0.00000e+00 2.16595e+02 100.016 5.11191e+01 100.016 0.9720 
1 1 1 -16 20  10 o 5  5.76579e+00 1.61397e+00 9.31737e+01 207.603 -5.29915e+00 -2.77066e+00 0.00000e+00 0.00000e+00 1.06343e+02 207.603 1.31691e+01 207.603 0.9120 
1 1 1 -16 20  11 o 3  4.72460e+00 1.51336e+00 2.52563e+01 126.934 -8.97166e-01 1.19346e+00  0.00000e+00 0.00000e+00 8.11580e+01 126.934 5.59017e+01 126.934 0.5944 
1 1 1 -16 21  1  o 10 5.88652e+00 1.38829e+00 1.38399e+02 339.978 7.88198e+00  -2.87228e+00 0.00000e+00 0.00000e+00 7.30186e+01 339.978 6.53800e+01 159.978 0.9384 
1 1 1 -16 21  2  o 8  4.96020e+00 1.45997e+00 1.24675e+02 339.620 5.73580e+00  -2.13086e+00 0.00000e+00 0.00000e+00 4.87531e+01 339.620 7.59217e+01 159.620 0.9142 
1 1 1 -16 21  3  o 5  5.97611e+00 1.52742e+00 1.31522e+02 128.073 -4.45734e+00 5.69018e+00  0.00000e+00 0.00000e+00 8.04182e+01 128.073 5.11035e+01 308.073 0.9280 
1 1 1 -16 21  4  o 18 5.04292e+00 1.58852e+00 7.42708e+01 242.270 -1.64507e+00 -3.12946e+00 0.00000e+00 0.00000e+00 8.80417e+01 242.270 1.37709e+01 242.270 0.8429 
1 1 1 -16 21  5  o 19 5.52064e+00 1.52893e+00 9.30343e+01 253.019 -1.55206e+00 -5.08247e+00 0.00000e+00 0.00000e+00 9.65492e+01 253.019 3.51487e+00 253.019 0.9002 
1 1 1 -16 21  6  o 15 5.63419e+00 1.54112e+00 6.73206e+01 132.655 -2.59175e+00 2.81303e+00  0.00000e+00 0.00000e+00 1.16577e+02 132.655 4.92565e+01 132.655 0.8564 
1 1 1 -16 21  7  o 6  1.78347e+01 1.80906e+00 2.96413e+02 280.231 7.96657e+00  -4.41399e+01 0.00000e+00 0.00000e+00 3.74965e+02 280.231 7.85524e+01 280.231 0.9888 
1 1 1 -16 21  8  o 5  9.61129e+00 1.75900e+00 1.12221e+02 167.351 -1.00303e+01 2.25101e+00  0.00000e+00 0.00000e+00 2.35029e+02 167.351 1.22808e+02 167.351 0.9500 
1 1 1 -16 21  9  f 0  3.56753e+00 1.24784e+00 6.47542e+01 249.782 -1.12736e+00 -3.06117e+00 0.00000e+00 0.00000e+00 4.74018e+01 249.782 1.73524e+01 69.782  0.8276 
1 1 1 -16 21  10 o 7  5.66657e+00 1.67071e+00 1.25176e+02 20.851  6.74088e+00  2.56750e+00  0.00000e+00 0.00000e+00 7.42922e+01 20.851  5.08838e+01 200.851 0.9278 
1 1 1 -16 21  11 o 7  4.07281e+00 1.33073e+00 8.26488e+01 5.978   4.75249e+00  4.97684e-01  0.00000e+00 0.00000e+00 5.43819e+01 5.978   2.82669e+01 185.978 0.8880 
1 1 1 -16 22  1  o 14 8.82276e+00 1.59245e+00 1.34166e+02 118.456 -5.01536e+00 9.25426e+00  0.00000e+00 0.00000e+00 1.87041e+02 118.456 5.28745e+01 118.456 0.9512 
1 1 1 -16 22  2  o 4  9.93848e+00 1.48832e+00 1.71021e+02 304.223 8.98580e+00  -1.32108e+01 0.00000e+00 0.00000e+00 1.96977e+02 304.223 2.59567e+01 304.223 0.9682 
1 1 1 -16 22  3  o 13 1.79223e+01 1.07205e+00 2.99683e+02 69.670  2.23345e+01  6.02827e+01  0.00000e+00 0.00000e+00 3.79854e+02 69.670  8.01714e+01 69.670  0.9922 
1 1 1 -16 22  4  o 17 1.15359e+01 1.42843e+00 1.84274e+02 298.877 1.04395e+01  -1.89289e+01 0.00000e+00 0.00000e+00 2.45870e+02 298.877 6.15954e+01 298.877 0.9766 
1 1 1 -16 22  5  o 10 1.54039e+01 1.55342e+00 2.14426e+02 263.361 -3.89160e+00 -3.34355e+01 0.00000e+00 0.00000e+00 3.64377e+02 263.361 1.49951e+02 263.361 0.9850 
1 1 1 -16 22  6  o 18 5.56247e+00 1.64506e+00 8.82892e+01 24.658  4.22932e+00  1.94151e+00  0.00000e+00 0.00000e+00 9.92435e+01 24.658  1.09543e+01 24.658  0.8847 
1 1 1 -16 22  7  o 11 5.83470e+00 1.69286e+00 1.01746e+02 258.201 -1.18261e+00 -5.66145e+00 0.00000e+00 0.00000e+00 1.00131e+02 258.201 1.61494e+00 78.201  0.9089 
1 1 1 -16 22  8  o 8  4.98759e+00 1.55399e+00 1.09548e+02 146.111 -4.92679e+00 3.30933e+00  0.00000e+00 0.00000e+00 6.32993e+01 146.111 4.62488e+01 326.111 0.9113 
1 1 1 -16 22  9  o 11 4.36236e+00 1.43716e+00 5.20825e+01 189.918 -2.67016e+00 -4.66881e-01 0.00000e+00 0.00000e+00 7.81687e+01 189.918 2.60862e+01 189.918 0.7861 
1 1 1 -16 22  10 o 14 3.93175e+00 1.31712e+00 7.33282e+00 48.631  2.43151e-01  2.76097e-01  0.00000e+00 0.00000e+00 1.96506e+01 48.631  1.23178e+01 48.631  0.1809 
1 1 1 -16 22  11 o 16 6.06218e+00 1.73845e+00 8.44855e+01 123.874 -3.03031e+00 4.51402e+00  0.00000e+00 0.00000e+00 1.22828e+02 123.874 3.83424e+01 123.874 0.9026 
1 1 1 -16 23  1  f 0  4.88200e+00 1.41968e+00 8.66938e+01 208.869 -3.61296e+00 -1.99188e+00 0.00000e+00 0.00000e+00 7.55142e+01 208.869 1.11797e+01 28.869  0.8682 
1 1 1 -16 23  2  o 3  7.49270e+00 1.53556e+00 1.03717e+02 266.373 -4.50181e-01 -7.10207e+00 0.00000e+00 0.00000e+00 1.61848e+02 266.373 5.81311e+01 266.373 0.9268 
1 1 1 -16 23  3  o 4  7.59335e+00 1.61256e+00 1.75183e+02 148.768 -1.02147e+01 6.19400e+00  0.00000e+00 0.00000e+00 1.02547e+02 148.768 7.26360e+01 328.768 0.9572 
1 1 1 -16 23  4  o 18 1.08576e+01 1.49371e+00 2.36194e+02 302.280 1.34217e+01  -2.12474e+01 0.00000e+00 0.00000e+00 1.70002e+02 302.280 6.61929e+01 122.280 0.9799 
1 1 1 -16 23  5  o 6  1.75474e+01 1.48922e+00 2.85955e+02 214.025 -4.33367e+01 -2.92586e+01 0.00000e+00 0.00000e+00 3.76936e+02 214.025 9.09805e+01 214.025 0.9904 
1 1 1 -16 23  6  o 13 3.81422e+00 1.28360e+00 8.11779e+00 5.949   3.62343e-01  3.77576e-02  0.00000e+00 0.00000e+00 1.79276e+01 5.949   9.80981e+00 5.949   0.1792 
1 1 1 -16 23  7  f 0  5.60099e+00 1.65300e+00 2.08768e+02 185.766 -1.16152e+01 -1.17286e+00 0.00000e+00 0.00000e+00 4.90396e+00 5.766   2.13672e+02 5.766   0.9562 
1 1 1 -16 23  8  o 8  4.61056e+00 1.47149e+00 7.40791e+01 105.693 -1.05565e+00 3.75744e+00  0.00000e+00 0.00000e+00 7.66362e+01 105.693 2.55716e+00 105.693 0.8597 
1 1 1 -16 23  9  o 2  5.75818e+00 1.71056e+00 1.23575e+02 183.534 -7.08671e+00 -4.37655e-01 0.00000e+00 0.00000e+00 7.90784e+01 183.534 4.44967e+01 3.534   0.9266 
1 1 1 -16 23  10 f 0  6.11839e+00 1.63797e+00 3.54480e+01 141.998 -1.83675e+00 1.43514e+00  0.00000e+00 0.00000e+00 1.37529e+02 141.998 1.02081e+02 141.998 0.7453 
1 1 1 -16 23  11 o 19 3.93032e+00 1.32713e+00 8.90799e+01 291.168 1.82743e+00  -4.71915e+00 0.00000e+00 0.00000e+00 4.41521e+01 291.168 4.49278e+01 111.168 0.8948 
1 1 1 -16 24  1  o 17 7.79591e+00 1.52127e+00 2.39557e+02 154.971 -1.60026e+01 7.47205e+00  0.00000e+00 0.00000e+00 5.02028e+01 154.971 1.89354e+02 334.971 0.9713 
1 1 1 -16 24  2  o 2  5.54356e+00 1.49877e+00 1.13736e+02 267.007 -3.15057e-01 -6.02517e+00 0.00000e+00 0.00000e+00 7.97790e+01 267.007 3.39571e+01 87.007  0.9129 
1 1 1 -16 24  3  o 9  5.67369e+00 1.49032e+00 1.14904e+02 346.908 6.34140e+00  -1.47479e+00 0.00000e+00 0.00000e+00 8.44595e+01 346.908 3.04444e+01 166.908 0.9196 
1 1 1 -16 24  4  o 8  7.02230e+00 1.60736e+00 7.93017e+01 143.989 -4.09699e+00 2.97785e+00  0.00000e+00 0.00000e+00 1.60599e+02 143.989 8.12977e+01 143.989 0.8949 
1 1 1 -16 24  5  o 14 1.06058e+01 1.74138e+00 1.84051e+02 308.643 1.09270e+01  -1.36669e+01 0.00000e+00 0.00000e+00 2.08735e+02 308.643 2.46838e+01 308.643 0.9710 
1 1 1 -16 24  6  o 12 8.50182e+00 1.81136e+00 1.19716e+02 144.876 -7.17422e+00 5.04668e+00  0.00000e+00 0.00000e+00 1.85169e+02 144.876 6.54535e+01 144.876 0.9411 
1 1 1 -16 24  7  o 11 1.87048e+01 1.46993e+00 2.85752e+02 122.253 -3.03040e+01 4.80239e+01  0.00000e+00 0.00000e+00 4.19934e+02 122.253 1.34182e+02 122.253 0.9912 
1 1 1 -16 24  8  o 4  7.89289e+00 1.68462e+00 1.26438e+02 357.983 9.93683e+00  -3.49940e-01 0.00000e+00 0.00000e+00 1.58151e+02 357.983 3.17125e+01 357.983 0.9483 
1 1 1 -16 24  9  o 13 5.74561e+00 1.71150e+00 4.08607e+01 274.150 1.71597e-01  -2.36473e+00 0.00000e+00 0.00000e+00 1.22838e+02 274.150 8.19768e+01 274.150 0.7502 
1 1 1 -16 24  10 o 7  5.89989e+00 1.64555e+00 1.06863e+02 151.956 -5.94593e+00 3.16735e+00  0.00000e+00 0.00000e+00 9.95778e+01 151.956 7.28550e+00 331.956 0.9225 
1 1 1 -16 24  11 o 16 4.78121e+00 1.52375e+00 5.61080e+01 353.467 3.33752e+00  -3.82194e-01 0.00000e+00 0.00000e+00 9.48425e+01 353.467 3.87344e+01 353.467 0.8334 
1 1 1 -16 25  1  o 10 4.66917e+00 1.38335e+00 1.29286e+01 222.962 -4.50002e-01 -4.19077e-01 0.00000e+00 0.00000e+00 3.95616e+01 222.962 2.66331e+01 222.962 0.2938 
1 1 1 -16 25  2  o 5  8.17215e+00 1.42271e+00 1.19747e+02 288.230 3.05089e+00  -9.26295e+00 0.00000e+00 0.00000e+00 1.76250e+02 288.230 5.65034e+01 288.230 0.9473 
1 1 1 -16 25  3  o 17 6.39067e+00 1.40382e+00 1.46901e+02 172.649 -9.60078e+00 1.23857e+00  0.00000e+00 0.00000e+00 8.42869e+01 172.649 6.26141e+01 352.649 0.9468 
1 1 1 -16 25  4  f 0  7.85607e+00 1.57340e+00 7.97357e+01 124.818 -3.31301e+00 4.76351e+00  0.00000e+00 0.00000e+00 1.92922e+02 124.818 1.13186e+02 124.818 0.9092 
1 1 1 -16 25  5  o 7  6.57270e+00 1.74455e+00 1.15908e+02 302.918 3.71807e+00  -5.74328e+00 0.00000e+00 0.00000e+00 1.15645e+02 302.918 2.62779e-01 122.918 0.9237 
1 1 1 -16 25  6  o 16 7.76871e+00 1.89620e+00 1.91137e+02 76.835  2.76930e+00  1.18393e+01  0.00000e+00 0.00000e+00 9.24146e+01 76.835  9.87229e+01 256.835 0.9580 
1 1 1 -16 25  7  o 5  5.80420e+00 1.58259e+00 1.12975e+02 110.744 -2.30519e+00 6.08627e+00  0.00000e+00 0.00000e+00 9.01799e+01 110.744 2.27947e+01 290.744 0.9196 
1 1 1 -16 25  8  o 9  2.00675e+01 1.33516e+00 3.33097e+02 304.535 4.79677e+01  -6.97032e+01 0.00000e+00 0.00000e+00 4.25341e+02 304.535 9.22435e+01 304.535 0.9941 
1 1 1 -16 25  9  o 11 4.16955e+00 1.43959e+00 9.00093e+01 145.418 -3.55212e+00 2.44881e+00  0.00000e+00 0.00000e+00 4.84769e+01 145.418 4.15324e+01 325.418 0.8746 
1 1 1 -16 25  10 o 4  5.73290e+00 1.51753e+00 6.52190e+01 356.400 4.39734e+00  -2.76639e-01 0.00000e+00 0.00000e+00 1.25588e+02 356.400 6.03687e+01 356.400 0.8775 
1 1 1 -16 25  11 o 17 4.69040e+00 1.48953e+00 8.00113e+01 138.599 -3.73124e+00 3.28967e+00  0.00000e+00 0.00000e+00 7.86124e+01 138.599 1.39893e+00 318.599 0.8928 
1 1 1 -16 26  1  o 18 4.25272e+00 1.29578e+00 7.83692e+01 146.643 -3.10252e+00 2.04243e+00  0.00000e+00 0.00000e+00 6.01981e+01 146.643 1.81710e+01 326.642 0.8516 
1 1 1 -16 26  2  o 5  7.20961e+00 1.47056e+00 1.43617e+02 298.700 5.02155e+00  -9.17207e+00 0.00000e+00 0.00000e+00 1.18507e+02 298.700 2.51098e+01 118.700 0.9509 
1 1 1 -16 26  3  o 6  8.11831e+00 1.57945e+00 1.44961e+02 51.293  6.87407e+00  8.57808e+00  0.00000e+00 0.00000e+00 1.50728e+02 51.293  5.76642e+00 51.293  0.9534 
1 1 1 -16 26  4  o 13 5.38052e+00 1.50179e+00 8.99149e+01 23.885  4.65192e+00  2.06000e+00  0.00000e+00 0.00000e+00 9.39779e+01 23.885  4.06306e+00 23.885  0.8954 
1 1 1 -16 26  5  o 17 4.10740e+00 1.36556e+00 6.50160e+01 181.835 -3.00066e+00 -9.61132e-02 0.00000e+00 0.00000e+00 6.18856e+01 181.835 3.13044e+00 1.835   0.8101 
1 1 1 -16 26  6  o 11 5.00985e+00 1.53925e+00 8.13074e+01 76.282  1.00519e+00  4.11772e+00  0.00000e+00 0.00000e+00 8.51508e+01 76.282  3.84340e+00 76.282  0.8721 
1 1 1 -16 26  7  o 4  4.17807e+00 1.38370e+00 5.36895e+01 263.888 -2.86406e-01 -2.67493e+00 0.00000e+00 0.00000e+00 7.10080e+01 263.888 1.73185e+01 263.888 0.7842 
1 1 1 -16 26  8  o 8  6.06329e+00 1.58813e+00 8.93533e+01 177.498 -5.61693e+00 2.45429e-01  0.00000e+00 0.00000e+00 1.19501e+02 177.498 3.01476e+01 177.498 0.9061 
1 1 1 -16 26  9  o 19 4.86319e+00 1.51723e+00 1.12728e+02 333.018 5.34297e+00  -2.72030e+00 0.00000e+00 0.00000e+00 5.57433e+01 333.018 5.69851e+01 153.018 0.9123 
1 1 1 -16 26  10 o 13 5.35079e+00 1.52356e+00 5.41366e+01 216.093 -2.74473e+00 -2.00101e+00 0.00000e+00 0.00000e+00 1.15420e+02 216.093 6.12836e+01 216.093 0.8355 
1 1 1 -16 26  11 o 13 4.89818e+00 1.52071e+00 7.80576e+01 129.563 -3.15109e+00 3.81406e+00  0.00000e+00 0.00000e+00 8.74635e+01 129.563 9.40584e+00 129.563 0.8921 
1 1 1 -16 27  1  o 7  4.47828e+00 1.36822e+00 1.17110e+02 327.103 4.71035e+00  -3.04690e+00 0.00000e+00 0.00000e+00 3.80942e+01 327.103 7.90162e+01 147.103 0.9058 
1 1 1 -16 27  2  o 10 6.46405e+00 1.48958e+00 8.23525e+01 239.272 -2.67375e+00 -4.49813e+00 0.00000e+00 0.00000e+00 1.39699e+02 239.272 5.73464e+01 239.272 0.8985 
1 1 1 -16 27  3  o 12 6.44465e+00 1.28735e+00 9.26277e+01 62.878  2.95006e+00  5.75946e+00  0.00000e+00 0.00000e+00 1.33650e+02 62.878  4.10225e+01 62.878  0.9191 
1 1 1 -16 27  4  o 16 7.63988e+00 1.56956e+00 9.62214e+01 299.117 3.55476e+00  -6.38224e+00 0.00000e+00 0.00000e+00 1.74616e+02 299.117 7.83950e+01 299.117 0.9288 
1 1 1 -16 27  5  o 7  7.58911e+00 1.71918e+00 1.36032e+02 217.585 -7.42111e+00 -5.71184e+00 0.00000e+00 0.00000e+00 1.37448e+02 217.585 1.41626e+00 217.585 0.9450 
1 1 1 -16 27  6  o 3  1.31765e+01 1.67225e+00 1.92282e+02 313.273 1.66497e+01  -1.76850e+01 0.00000e+00 0.00000e+00 2.99244e+02 313.273 1.06962e+02 313.273 0.9792 
1 1 1 -16 27  7  o 6  7.20360e+00 1.76758e+00 1.37851e+02 186.486 -9.26696e+00 -1.05350e+00 0.00000e+00 0.00000e+00 1.21148e+02 186.486 1.67033e+01 6.486   0.9448 
1 1 1 -16 27  8  o 14 3.56129e+00 1.22136e+00 5.49201e+01 7.864   2.52068e+00  3.48175e-01  0.00000e+00 0.00000e+00 4.92902e+01 7.864   5.62987e+00 187.864 0.7698 
1 1 1 -16 27  9  o 13 8.60148e+00 1.76489e+00 1.68370e+02 95.834  -1.44914e+00 1.41824e+01  0.00000e+00 0.00000e+00 1.46557e+02 95.834  2.18129e+01 275.834 0.9643 
1 1 1 -16 27  10 o 8  7.00369e+00 1.75323e+00 1.49034e+02 224.941 -7.48567e+00 -7.47025e+00 0.00000e+00 0.00000e+00 1.03683e+02 224.941 4.53504e+01 44.941  0.9515 
1 1 1 -16 27  11 o 16 9.43800e+00 1.74699e+00 1.92335e+02 11.151  1.89950e+01  3.74410e+00  0.00000e+00 0.00000e+00 1.55770e+02 11.151  3.65649e+01 191.151 0.9738 
1 1 1 -16 28  1  o 16 5.39337e+00 1.39270e+00 9.26810e+01 64.655  2.21925e+00  4.68533e+00  0.00000e+00 0.00000e+00 9.25014e+01 64.655  1.79583e-01 244.655 0.8975 
1 1 1 -16 28  2  f 0  5.67222e+00 1.51676e+00 1.68738e+02 248.469 -3.39818e+00 -8.61327e+00 0.00000e+00 0.00000e+00 3.60367e+01 248.469 1.32701e+02 68.469  0.9444 
1 1 1 -16 28  3  o 16 6.29028e+00 1.51126e+00 6.92881e+01 186.939 -4.14818e+00 -5.04828e-01 0.00000e+00 0.00000e+00 1.39768e+02 186.939 7.04801e+01 186.939 0.8701 
1 1 1 -16 28  4  o 1  5.08171e+00 1.44579e+00 6.46067e+01 292.336 1.33346e+00  -3.24541e+00 0.00000e+00 0.00000e+00 9.86095e+01 292.336 3.40028e+01 292.336 0.8416 
1 1 1 -16 28  5  o 9  3.71170e+00 1.25574e+00 7.15881e+01 287.476 9.54546e-01  -3.03193e+00 0.00000e+00 0.00000e+00 4.48008e+01 287.476 2.67873e+01 107.476 0.8224 
1 1 1 -16 28  6  o 16 8.24878e+00 1.82485e+00 1.65130e+02 284.182 2.80531e+00  -1.11014e+01 0.00000e+00 0.00000e+00 1.35039e+02 284.182 3.00907e+01 104.182 0.9553 
1 1 1 -16 28  7  o 1  5.05379e+00 1.49546e+00 1.21628e+02 177.848 -6.57716e+00 2.47112e-01  0.00000e+00 0.00000e+00 5.54049e+01 177.848 6.62233e+01 357.848 0.9205 
1 1 1 -16 28  8  o 1  8.36880e+00 1.63291e+00 1.12832e+02 130.759 -6.53641e+00 7.58348e+00  0.00000e+00 0.00000e+00 1.88946e+02 130.759 7.61141e+01 130.759 0.9487 
1 1 1 -16 28  9  o 14 6.11938e+00 1.58520e+00 5.19631e+01 294.660 1.47034e+00  -3.20260e+00 0.00000e+00 0.00000e+00 1.43744e+02 294.660 9.17808e+01 294.660 0.8423 
1 1 1 -16 28  10 o 7  7.16472e+00 1.73027e+00 1.33542e+02 102.677 -2.17882e+00 9.68641e+00  0.00000e+00 0.00000e+00 1.24080e+02 102.677 9.46159e+00 282.677 0.9482 
1 1 1 -16 28  11 f 0  6.12666e+00 1.60618e+00 9.36349e+01 228.573 -4.45482e+00 -5.04829e+00 0.00000e+00 0.00000e+00 1.20393e+02 228.573 2.67579e+01 228.573 0.9224 
1 1 1 -16 29  1  o 14 3.51192e+00 1.15103e+00 7.37370e+00 305.531 1.75296e-01  -2.45474e-01 0.00000e+00 0.00000e+00 1.26611e+01 305.531 5.28739e+00 305.531 0.1491 
1 1 1 -16 29  2  o 5  1.97219e+01 1.03532e+00 2.86877e+02 233.028 -4.19691e+01 -5.57513e+01 0.00000e+00 0.00000e+00 4.61585e+02 233.028 1.74707e+02 233.028 0.9928 
1 1 1 -16 29  3  o 18 2.21405e+01 1.02773e+00 3.79536e+02 23.830  1.06471e+02  4.70266e+01  0.00000e+00 0.00000e+00 4.62485e+02 23.830  8.29485e+01 23.830  0.9957 
1 1 1 -16 29  4  o 17 6.09349e+00 1.50455e+00 5.95753e+01 125.257 -2.17208e+00 3.07266e+00  0.00000e+00 0.00000e+00 1.38956e+02 125.257 7.93811e+01 125.257 0.8537 
1 1 1 -16 29  5  o 12 9.06646e+00 1.78790e+00 2.43393e+02 228.683 -1.27176e+01 -1.44676e+01 0.00000e+00 0.00000e+00 9.31919e+01 228.683 1.50201e+02 48.683  0.9737 
1 1 1 -16 29  6  o 18 6.03233e+00 1.72241e+00 5.11063e+01 233.095 -1.77003e+00 -2.35706e+00 0.00000e+00 0.00000e+00 1.34099e+02 233.095 8.29927e+01 233.095 0.8060 
1 1 1 -16 29  7  o 8  4.15863e+00 1.32171e+00 8.61199e+01 142.097 -3.56390e+00 2.77471e+00  0.00000e+00 0.00000e+00 5.32586e+01 142.097 3.28613e+01 322.097 0.8808 
1 1 1 -16 29  8  o 4  5.72001e+00 1.62253e+00 1.32993e+02 337.802 7.72497e+00  -3.15222e+00 0.00000e+00 0.00000e+00 7.09373e+01 337.802 6.20559e+01 157.802 0.9380 
1 1 1 -16 29  9  o 10 4.53028e+00 1.44137e+00 1.28968e+02 48.715  4.65602e+00  5.30271e+00  0.00000e+00 0.00000e+00 3.03211e+01 48.715  9.86466e+01 228.715 0.9262 
1 1 1 -16 29  10 o 12 3.71105e+00 1.26618e+00 8.75091e+01 126.754 -2.77278e+00 3.71264e+00  0.00000e+00 0.00000e+00 3.69014e+01 126.754 5.06077e+01 306.754 0.8841 
1 1 1 -16 29  11 o 16 8.33788e+00 1.73416e+00 1.19127e+02 219.247 -8.23810e+00 -6.73004e+00 0.00000e+00 0.00000e+00 1.81391e+02 219.247 6.22647e+01 219.247 0.9518 
1 1 1 -16 30  1  o 8  3.80223e+00 1.22916e+00 3.86152e+01 214.059 -1.35917e+00 -9.18814e-01 0.00000e+00 0.00000e+00 5.28678e+01 214.059 1.42526e+01 214.059 0.6290 
1 1 1 -16 30  2  o 18 4.16151e+00 1.31858e+00 8.75316e+01 295.568 1.84542e+00  -3.85713e+00 0.00000e+00 0.00000e+00 5.13871e+01 295.568 3.61445e+01 115.568 0.8734 
1 1 1 -16 30  3  o 5  3.99285e+00 1.26581e+00 2.89228e+01 280.869 2.58621e-01  -1.34696e+00 0.00000e+00 0.00000e+00 5.68929e+01 280.869 2.79701e+01 280.869 0.5627 
1 1 1 -16 30  4  o 16 8.39448e+00 1.48051e+00 1.46849e+02 322.305 1.02019e+01  -7.88338e+00 0.00000e+00 0.00000e+00 1.60794e+02 322.305 1.39453e+01 322.305 0.9604 
1 1 1 -16 30  5  o 6  1.48009e+01 1.56127e+00 2.70558e+02 210.965 -3.43203e+01 -2.05931e+01 0.00000e+00 0.00000e+00 2.86622e+02 210.965 1.60645e+01 210.965 0.9874 
1 1 1 -16 30  6  o 8  7.96689e+00 1.86169e+00 1.61898e+02 292.051 4.24158e+00  -1.04713e+01 0.00000e+00 0.00000e+00 1.27779e+02 292.051 3.41193e+01 112.051 0.9547 
1 1 1 -16 30  7  o 15 9.89477e+00 1.56476e+00 2.29720e+02 118.183 -1.15790e+01 2.16106e+01  0.00000e+00 0.00000e+00 1.38989e+02 118.183 9.07310e+01 298.183 0.9794 
1 1 1 -16 30  8  o 6  7.63758e+00 1.62734e+00 1.62572e+02 134.467 -9.50239e+00 9.68071e+00  0.00000e+00 0.00000e+00 1.16783e+02 134.467 4.57891e+01 314.467 0.9624 
1 1 1 -16 30  9  o 13 4.43627e+00 1.45543e+00 6.81612e+01 355.224 3.74001e+00  -3.12503e-01 0.00000e+00 0.00000e+00 7.55403e+01 355.224 7.37915e+00 355.224 0.8533 
1 1 1 -16 30  10 o 2  4.98249e+00 1.53690e+00 9.83997e+01 126.913 -3.52204e+00 4.68870e+00  0.00000e+00 0.00000e+00 7.35445e+01 126.913 2.48552e+01 306.913 0.9102 
1 1 1 -16 30  11 o 6  4.52478e+00 1.44336e+00 3.92557e+01 254.597 -6.52812e-01 -2.36958e+00 0.00000e+00 0.00000e+00 9.10160e+01 254.597 5.17603e+01 254.597 0.7603 
1 1 1 -16 31  1  o 12 5.30532e+00 1.50080e+00 1.26103e+02 32.528  5.93552e+00  3.78539e+00  0.00000e+00 0.00000e+00 6.17916e+01 32.528  6.43119e+01 212.528 0.9260 
1 1 1 -16 31  2  o 14 8.09042e+00 1.52722e+00 1.54556e+02 325.182 1.06281e+01  -7.39160e+00 0.00000e+00 0.00000e+00 1.42462e+02 325.182 1.20944e+01 145.182 0.9606 
1 1 1 -16 31  3  o 17 5.62902e+00 1.47549e+00 1.15008e+02 70.664  2.25037e+00  6.41331e+00  0.00000e+00 0.00000e+00 8.34462e+01 70.664  3.15623e+01 250.664 0.9232 
1 1 1 -16 31  4  o 7  4.43798e+00 1.30660e+00 9.01609e+01 267.689 -1.86612e-01 -4.62493e+00 0.00000e+00 0.00000e+00 5.95319e+01 267.689 3.06290e+01 87.689  0.8840 
1 1 1 -16 31  5  o 17 6.93343e+00 1.78348e+00 1.55318e+02 94.825  -8.11887e-01 9.61759e+00  0.00000e+00 0.00000e+00 9.49004e+01 94.825  6.04179e+01 274.825 0.9467 
1 1 1 -16 31  6  o 4  8.90429e+00 1.92670e+00 2.27488e+02 147.078 -1.37417e+01 8.89744e+00  0.00000e+00 0.00000e+00 1.01095e+02 147.078 1.26394e+02 327.078 0.9690 
1 1 1 -16 31  7  o 10 4.28784e+00 1.36146e+00 5.70946e+01 113.680 -1.20468e+00 2.74696e+00  0.00000e+00 0.00000e+00 7.50299e+01 113.680 1.79353e+01 113.680 0.8099 
1 1 1 -16 31  8  o 1  5.58206e+00 1.61176e+00 5.94992e+01 305.809 2.06857e+00  -2.86722e+00 0.00000e+00 0.00000e+00 1.19313e+02 305.809 5.98142e+01 305.809 0.8429 
1 1 1 -16 31  9  o 9  4.62084e+00 1.48650e+00 4.08558e+01 118.150 -1.08122e+00 2.02068e+00  0.00000e+00 0.00000e+00 8.89941e+01 118.150 4.81384e+01 118.150 0.7403 
1 1 1 -16 31  10 o 18 6.05666e+00 1.59306e+00 1.42629e+02 23.481  9.36830e+00  4.06969e+00  0.00000e+00 0.00000e+00 7.54404e+01 23.481  6.71884e+01 203.481 0.9497 
1 1 1 -16 31  11 o 19 3.83499e+00 1.28963e+00 7.89445e+01 347.442 4.56323e+00  -1.01645e+00 0.00000e+00 0.00000e+00 4.95977e+01 347.442 2.93468e+01 167.442 0.8853 
1 1 1 -16 32  1  o 3  1.09129e+01 1.38489e+00 2.32208e+02 35.220  2.29468e+01  1.61993e+01  0.00000e+00 0.00000e+00 1.77652e+02 35.220  5.45558e+01 215.220 0.9820 
1 1 1 -16 32  2  o 15 1.05658e+01 1.36448e+00 9.08196e+01 202.158 -9.96465e+00 -4.05803e+00 0.00000e+00 0.00000e+00 2.93716e+02 202.158 2.02897e+02 202.158 0.9523 
1 1 1 -16 32  3  o 7  1.02210e+01 1.36603e+00 2.40710e+02 241.527 -1.31902e+01 -2.43210e+01 0.00000e+00 0.00000e+00 1.42466e+02 241.527 9.82436e+01 61.527  0.9818 
1 1 1 -16 32  4  o 7  3.69068e+00 1.20320e+00 8.53690e+01 93.038  -2.05770e-01 3.87700e+00  0.00000e+00 0.00000e+00 3.55653e+01 93.038  4.98038e+01 273.038 0.8588 
1 1 1 -16 32  5  o 1  1.55407e+01 1.44015e+00 2.84626e+02 226.214 -3.22309e+01 -3.36262e+01 0.00000e+00 0.00000e+00 3.01357e+02 226.214 1.67313e+01 226.214 0.9892 
1 1 1 -16 32  6  o 6  7.51008e+00 1.83974e+00 1.79664e+02 166.283 -1.17694e+01 2.87274e+00  0.00000e+00 0.00000e+00 9.42536e+01 166.283 8.54101e+01 346.283 0.9578 
1 1 1 -16 32  7  o 18 1.15748e+01 1.46852e+00 2.24518e+02 21.213  2.81388e+01  1.09216e+01  0.00000e+00 0.00000e+00 2.08442e+02 21.213  1.60764e+01 201.213 0.9833 
1 1 1 -16 32  8  o 6  4.67096e+00 1.47067e+00 8.03329e+01 144.912 -3.63631e+00 2.55447e+00  0.00000e+00 0.00000e+00 7.56212e+01 144.912 4.71177e+00 324.912 0.8787 
1 1 1 -16 32  9  o 10 1.08770e+01 1.60205e+00 1.80278e+02 337.833 1.92865e+01  -7.85779e+00 0.00000e+00 0.00000e+00 2.22517e+02 337.833 4.22392e+01 337.833 0.9757 
1 1 1 -16 32  10 o 1  3.47854e+00 1.18919e+00 5.73812e+01 104.251 -7.71774e-01 3.03873e+00  0.00000e+00 0.00000e+00 5.06830e+01 104.251 6.69819e+00 284.251 0.8195 
1 1 1 -16 32  11 o 2  5.02857e+00 1.50480e+00 8.73587e+01 94.380  -4.42231e-01 5.77387e+00  0.00000e+00 0.00000e+00 8.56920e+01 94.380  1.66675e+00 274.380 0.9090 
1 1 1 -16 33  1  o 11 4.14272e+00 1.31940e+00 5.65405e+01 74.755  7.12578e-01  2.61467e+00  0.00000e+00 0.00000e+00 6.79844e+01 74.755  1.14438e+01 74.755  0.7860 
1 1 1 -16 33  2  o 5  1.00917e+01 1.38172e+00 1.82416e+02 181.352 -2.05169e+01 -4.84183e-01 0.00000e+00 0.00000e+00 1.93699e+02 181.352 1.12836e+01 181.352 0.9753 
1 1 1 -16 33  3  o 12 9.03217e+00 1.47291e+00 1.47525e+02 327.176 1.17587e+01  -7.58482e+00 0.00000e+00 0.00000e+00 1.84783e+02 327.176 3.72587e+01 327.176 0.9636 
1 1 1 -16 33  4  o 14 1.04214e+01 1.32324e+00 1.71654e+02 115.375 -8.82172e+00 1.85997e+01  0.00000e+00 0.00000e+00 2.16135e+02 115.375 4.44810e+01 115.375 0.9754 
1 1 1 -16 33  5  o 3  6.48173e+00 1.71833e+00 1.28732e+02 232.967 -4.49446e+00 -5.95728e+00 0.00000e+00 0.00000e+00 1.01112e+02 232.967 2.76198e+01 52.967  0.9304 
1 1 1 -16 33  6  o 19 5.14583e+00 1.58722e+00 6.59116e+01 67.028  1.34091e+00  3.16332e+00  0.00000e+00 0.00000e+00 9.82214e+01 67.028  3.23097e+01 67.028  0.8377 
1 1 1 -16 33  7  o 3  4.53863e+00 1.47684e+00 7.12952e+01 319.386 2.73274e+00  -2.34339e+00 0.00000e+00 0.00000e+00 7.47834e+01 319.386 3.48824e+00 319.386 0.8462 
1 1 1 -16 33  8  o 18 9.47524e+00 1.68163e+00 1.46383e+02 233.285 -8.53472e+00 -1.14439e+01 0.00000e+00 0.00000e+00 2.00786e+02 233.285 5.44024e+01 233.285 0.9643 
1 1 1 -16 33  9  o 1  7.28534e+00 1.80973e+00 1.34253e+02 34.547  7.72192e+00  5.31649e+00  0.00000e+00 0.00000e+00 1.27045e+02 34.547  7.20822e+00 214.547 0.9451 
1 1 1 -16 33  10 o 19 7.22734e+00 1.77814e+00 1.93783e+02 208.444 -1.27128e+01 -6.88639e+00 0.00000e+00 0.00000e+00 7.05168e+01 208.444 1.23267e+02 28.444  0.9648 
1 1 1 -16 33  11 o 15 4.23683e+00 1.39662e+00 7.24516e+01 218.980 -3.40891e+00 -2.75851e+00 0.00000e+00 0.00000e+00 6.81872e+01 218.980 4.26447e+00 38.980  0.8769 
1 1 1 -16 34  1  o 2  5.14255e+00 1.41176e+00 7.71735e+01 334.169 3.91013e+00  -1.89280e+00 0.00000e+00 0.00000e+00 9.49957e+01 334.169 1.78222e+01 334.169 0.8756 
1 1 1 -16 34  2  o 10 4.60676e+00 1.33199e+00 1.01068e+02 198.872 -5.02708e+00 -1.71846e+00 0.00000e+00 0.00000e+00 5.73798e+01 198.872 4.36878e+01 18.873  0.9002 
1 1 1 -16 34  3  f 0  4.58401e+00 1.36027e+00 1.40569e+01 194.540 -7.02475e-01 -1.82198e-01 0.00000e+00 0.00000e+00 4.56036e+01 194.540 3.15467e+01 194.540 0.3409 
1 1 1 -16 34  4  o 15 1.12517e+01 1.33072e+00 1.77337e+02 354.485 2.34598e+01  -2.26521e+00 0.00000e+00 0.00000e+00 2.42663e+02 354.485 6.53259e+01 354.485 0.9786 
1 1 1 -16 34  5  o 11 7.21181e+00 1.70269e+00 1.00200e+02 146.022 -5.79807e+00 3.90767e+00  0.00000e+00 0.00000e+00 1.54157e+02 146.022 5.39572e+01 146.022 0.9254 
1 1 1 -16 34  6  o 3  1.10215e+01 1.86536e+00 1.89851e+02 30.180  1.54472e+01  8.98314e+00  0.00000e+00 0.00000e+00 2.17861e+02 30.180  2.80095e+01 30.180  0.9716 
1 1 1 -16 34  7  o 18 6.53223e+00 1.73468e+00 8.99595e+01 227.041 -3.78705e+00 -4.06702e+00 0.00000e+00 0.00000e+00 1.34855e+02 227.041 4.48951e+01 227.041 0.9049 
1 1 1 -16 34  8  o 5  6.13163e+00 1.69147e+00 1.82883e+02 70.216  3.71844e+00  1.03374e+01  0.00000e+00 0.00000e+00 3.92002e+01 70.216  1.43683e+02 250.216 0.9533 
1 1 1 -16 34  9  o 14 5.55334e+00 1.59196e+00 1.05319e+02 301.313 3.40582e+00  -5.59863e+00 0.00000e+00 0.00000e+00 8.85959e+01 301.313 1.67236e+01 121.313 0.9202 
1 1 1 -16 34  10 o 6  1.16702e+01 1.75560e+00 2.55354e+02 69.663  1.09888e+01  2.96473e+01  0.00000e+00 0.00000e+00 1.79909e+02 69.663  7.54445e+01 249.663 0.9841 
1 1 1 -16 34  11 o 4  4.57718e+00 1.42043e+00 4.75488e+01 240.301 -1.49212e+00 -2.61605e+00 0.00000e+00 0.00000e+00 9.29363e+01 240.301 4.53875e+01 240.301 0.8108 
1 1 1 -16 35  1  o 11 5.32112e+00 1.48063e+00 1.44860e+02 10.633  7.91828e+00  1.48664e+00  0.00000e+00 0.00000e+00 4.55070e+01 10.633  9.93528e+01 190.633 0.9357 
1 1 1 -16 35  2  o 7  6.62646e+00 1.51714e+00 6.07937e+01 73.655  1.16433e+00  3.97000e+00  0.00000e+00 0.00000e+00 1.59108e+02 73.655  9.83142e+01 73.655  0.8686 
1 1 1 -16 35  3  f 0  1.46740e+01 1.13610e+00 2.09009e+02 183.316 -3.92197e+01 -2.27251e+00 0.00000e+00 0.00000e+00 3.43996e+02 183.316 1.34987e+02 183.316 0.9872 
1 1 1 -16 35  4  o 4  4.98919e+00 1.40342e+00 7.53734e+01 10.839  4.17120e+00  7.98642e-01  0.00000e+00 0.00000e+00 9.06422e+01 10.839  1.52688e+01 10.839  0.8724 
1 1 1 -16 35  5  o 7  5.44546e+00 1.58178e+00 1.19509e+02 113.549 -2.58302e+00 5.92654e+00  0.00000e+00 0.00000e+00 7.12001e+01 113.549 4.83090e+01 293.549 0.9190 
1 1 1 -16 35  6  o 18 4.96735e+00 1.54893e+00 9.85918e+01 28.447  4.69309e+00  2.54257e+00  0.00000e+00 0.00000e+00 7.17300e+01 28.447  2.68618e+01 208.447 0.9007 
1 1 1 -16 35  7  o 2  4.77929e+00 1.50691e+00 8.48173e+01 299.962 2.33112e+00  -4.04375e+00 0.00000e+00 0.00000e+00 7.60487e+01 299.962 8.76859e+00 119.962 0.8851 
1 1 1 -16 35  8  o 2  5.18939e+00 1.55475e+00 6.21979e+01 174.931 -3.63774e+00 3.22653e-01  0.00000e+00 0.00000e+00 1.05105e+02 174.931 4.29074e+01 174.931 0.8487 
1 1 1 -16 35  9  o 2  6.01729e+00 1.62532e+00 3.65739e+01 185.207 -2.42296e+00 -2.20799e-01 0.00000e+00 0.00000e+00 1.36381e+02 185.207 9.98073e+01 185.207 0.7575 
1 1 1 -16 35  10 f 0  9.22551e+00 1.80642e+00 1.45358e+02 154.781 -1.27377e+01 5.99905e+00  0.00000e+00 0.00000e+00 1.91614e+02 154.781 4.62560e+01 154.781 0.9638 
1 1 1 -16 35  11 o 3  5.67189e+00 1.62149e+00 6.41956e+01 273.149 2.39943e-01  -4.36161e+00 0.00000e+00 0.00000e+00 1.23930e+02 273.149 5.97343e+01 273.149 0.8763 
1 1 1 -16 36  1  o 14 8.01316e+00 1.48477e+00 7.75344e+01 349.331 6.38801e+00  -1.20350e+00 0.00000e+00 0.00000e+00 2.04146e+02 349.331 1.26612e+02 349.331 0.9195 
1 1 1 -16 36  2  o 17 6.93393e+00 1.42734e+00 1.18191e+02 121.676 -4.65586e+00 7.54568e+00  0.00000e+00 0.00000e+00 1.31281e+02 121.676 1.30904e+01 121.676 0.9418 
1 1 1 -16 36  3  o 8  1.34423e+01 1.22214e+00 2.48562e+02 237.745 -2.17236e+01 -3.44234e+01 0.00000e+00 0.00000e+00 2.58207e+02 237.745 9.64496e+00 237.745 0.9876 
1 1 1 -16 36  4  o 4  4.20655e+00 1.30623e+00 4.56572e+01 328.764 1.86545e+00  -1.13135e+00 0.00000e+00 0.00000e+00 7.07313e+01 328.764 2.50741e+01 328.764 0.7255 
1 1 1 -16 36  5  o 15 5.09523e+00 1.44128e+00 6.45935e+01 338.253 3.53534e+00  -1.41025e+00 0.00000e+00 0.00000e+00 1.01525e+02 338.253 3.69319e+01 338.253 0.8556 
1 1 1 -16 36  6  o 2  5.72156e+00 1.65580e+00 6.58188e+01 142.957 -3.05152e+00 2.30306e+00  0.00000e+00 0.00000e+00 1.20694e+02 142.957 5.48757e+01 142.957 0.8564 
1 1 1 -16 36  7  o 4  4.99591e+00 1.57041e+00 9.27840e+01 94.462  -4.09494e-01 5.24754e+00  0.00000e+00 0.00000e+00 7.80353e+01 94.462  1.47487e+01 274.462 0.8992 
1 1 1 -16 36  8  o 6  4.15773e+00 1.34732e+00 9.99907e+01 9.520   5.27044e+00  8.83843e-01  0.00000e+00 0.00000e+00 4.22718e+01 9.520   5.77189e+01 189.520 0.9008 
1 1 1 -16 36  9  o 17 4.63235e+00 1.47703e+00 8.13280e+01 99.594  -7.67295e-01 4.53925e+00  0.00000e+00 0.00000e+00 7.39152e+01 99.594  7.41278e+00 279.594 0.8833 
1 1 1 -16 36  10 o 3  8.48737e+00 1.69601e+00 1.65029e+02 328.468 1.32049e+01  -8.10217e+00 0.00000e+00 0.00000e+00 1.46032e+02 328.468 1.89967e+01 148.468 0.9672 
1 1 1 -16 36  11 o 12 3.89055e+00 1.25505e+00 3.57192e+01 41.402  1.71551e+00  1.51252e+00  0.00000e+00 0.00000e+00 7.31951e+01 41.402  3.74759e+01 41.402  0.7397 
1 1 1 -16 37  1  f 0  8.21311e+00 1.50834e+00 1.10635e+02 317.102 6.86907e+00  -6.38272e+00 0.00000e+00 0.00000e+00 1.86076e+02 317.102 7.54408e+01 317.102 0.9451 
1 1 1 -16 37  2  o 19 9.73093e+00 1.36906e+00 1.85679e+02 158.431 -1.88149e+01 7.43739e+00  0.00000e+00 0.00000e+00 1.76718e+02 158.431 8.96106e+00 338.431 0.9750 
1 1 1 -16 37  3  o 2  6.29538e+00 1.48834e+00 3.46150e+01 98.473  -3.44466e-01 2.31230e+00  0.00000e+00 0.00000e+00 1.44668e+02 98.473  1.10053e+02 98.473  0.7461 
1 1 1 -16 37  4  f 0  1.38719e+01 1.17029e+00 2.81278e+02 46.993  3.58743e+01  3.84607e+01  0.00000e+00 0.00000e+00 2.42671e+02 46.993  3.86070e+01 226.993 0.9904 
1 1 1 -16 37  5  o 13 5.49539e+00 1.47913e+00 1.04845e+02 7.001   6.18884e+00  7.60024e-01  0.00000e+00 0.00000e+00 8.69134e+01 7.001   1.79315e+01 187.001 0.9159 
1 1 1 -16 37  6  o 12 8.59332e+00 1.72132e+00 1.25259e+02 258.206 -2.16863e+00 -1.03866e+01 0.00000e+00 0.00000e+00 1.86007e+02 258.206 6.07489e+01 258.206 0.9516 
1 1 1 -16 37  7  o 6  5.02388e+00 1.50812e+00 1.08410e+02 45.382  4.35704e+00  4.41551e+00  0.00000e+00 0.00000e+00 6.64530e+01 45.382  4.19568e+01 225.382 0.9154 
1 1 1 -16 37  8  f 0  4.70774e+00 1.47305e+00 9.50979e+01 216.598 -4.40749e+00 -3.27311e+00 0.00000e+00 0.00000e+00 6.64743e+01 216.598 2.86236e+01 36.598  0.9036 
1 1 1 -16 37  9  o 1  4.32480e+00 1.42609e+00 1.15759e+02 85.102  5.46348e-01  6.37549e+00  0.00000e+00 0.00000e+00 3.48790e+01 85.102  8.08802e+01 265.102 0.9181 
1 1 1 -16 37  10 o 10 5.15463e+00 1.49045e+00 5.95935e+01 317.324 2.88037e+00  -2.65565e+00 0.00000e+00 0.00000e+00 1.08429e+02 317.324 4.88354e+01 317.324 0.8603 
1 1 1 -16 37  11 f 0  4.98829e+00 1.49776e+00 5.21147e+01 70.083  1.20665e+00  3.33019e+00  0.00000e+00 0.00000e+00 1.07065e+02 70.083  5.49502e+01 70.083  0.8433 
1 1 1 -16 38  1  o 12 6.04929e+00 1.52607e+00 1.28721e+02 317.225 5.99618e+00  -5.54760e+00 0.00000e+00 0.00000e+00 8.78438e+01 317.225 4.08775e+01 137.225 0.9366 
1 1 1 -16 38  2  o 14 6.34380e+00 1.46162e+00 5.99599e+01 269.732 -1.93693e-02 -4.14873e+00 0.00000e+00 0.00000e+00 1.50597e+02 269.732 9.06375e+01 269.732 0.8690 
1 1 1 -16 38  3  o 14 4.34209e+00 1.31209e+00 6.64076e+01 216.244 -2.63359e+00 -1.93062e+00 0.00000e+00 0.00000e+00 7.07745e+01 216.244 4.36685e+00 216.244 0.8278 
1 1 1 -16 38  4  o 2  4.71093e+00 1.38728e+00 3.77891e+01 289.797 6.72497e-01  -1.86826e+00 0.00000e+00 0.00000e+00 8.71268e+01 289.797 4.93377e+01 289.797 0.6954 
1 1 1 -16 38  5  o 5  1.03725e+01 1.36149e+00 2.03884e+02 30.822  2.23411e+01  1.33298e+01  0.00000e+00 0.00000e+00 1.83597e+02 30.822  2.02868e+01 210.822 0.9806 
1 1 1 -16 38  6  o 7  5.55520e+00 1.65314e+00 1.29863e+02 212.449 -6.06329e+00 -3.85517e+00 0.00000e+00 0.00000e+00 6.62410e+01 212.449 6.36218e+01 32.449  0.9275 
1 1 1 -16 38  7  o 18 6.17138e+00 1.73431e+00 1.15247e+02 343.841 6.79617e+00  -1.96925e+00 0.00000e+00 0.00000e+00 1.02106e+02 343.841 1.31406e+01 163.841 0.9264 
1 1 1 -16 38  8  o 13 6.57253e+00 1.65191e+00 5.56897e+01 352.573 3.73564e+00  -4.86972e-01 0.00000e+00 0.00000e+00 1.57457e+02 352.573 1.01767e+02 352.573 0.8539 
1 1 1 -16 38  9  o 4  5.74437e+00 1.62795e+00 1.09539e+02 238.340 -3.70722e+00 -6.01191e+00 0.00000e+00 0.00000e+00 9.22867e+01 238.340 1.72520e+01 58.340  0.9262 
1 1 1 -16 38  10 o 14 8.57124e+00 1.73232e+00 1.29487e+02 75.242  3.03114e+00  1.15069e+01  0.00000e+00 0.00000e+00 1.81286e+02 75.242  5.17983e+01 75.242  0.9570 
1 1 1 -16 38  11 o 8  3.78535e+00 1.26392e+00 3.87973e+01 239.508 -1.27647e+00 -2.16768e+00 0.00000e+00 0.00000e+00 7.10135e+01 239.508 3.22162e+01 239.508 0.7667 
1 1 1 -16 39  1  o 8  1.05279e+01 1.36946e+00 1.60142e+02 262.907 -2.28378e+00 -1.83542e+01 0.00000e+00 0.00000e+00 2.31183e+02 262.907 7.10416e+01 262.907 0.9726 
1 1 1 -16 39  2  o 11 1.06783e+01 1.31107e+00 1.66688e+02 32.808  1.69581e+01  1.09323e+01  0.00000e+00 0.00000e+00 2.30880e+02 32.808  6.41926e+01 32.808  0.9749 
1 1 1 -16 39  3  o 17 1.01909e+01 1.34477e+00 1.02331e+02 131.924 -8.44105e+00 9.39964e+00  0.00000e+00 0.00000e+00 2.70825e+02 131.924 1.68494e+02 131.924 0.9596 
1 1 1 -16 39  4  o 7  1.33733e+01 1.15854e+00 2.40277e+02 306.214 2.61985e+01  -3.57771e+01 0.00000e+00 0.00000e+00 2.63823e+02 306.214 2.35461e+01 306.214 0.9887 
1 1 1 -16 39  5  o 14 6.46911e+00 1.54231e+00 2.97086e+01 133.013 -1.43466e+00 1.53777e+00  0.00000e+00 0.00000e+00 1.46235e+02 133.013 1.16526e+02 133.013 0.7140 
1 1 1 -16 39  6  o 4  5.10331e+00 1.55678e+00 9.97471e+01 97.412  -7.32167e-01 5.62819e+00  0.00000e+00 0.00000e+00 7.63968e+01 97.412  2.33503e+01 277.412 0.9070 
1 1 1 -16 39  7  o 5  6.82296e+00 1.76844e+00 7.05994e+01 242.686 -2.06442e+00 -3.99738e+00 0.00000e+00 0.00000e+00 1.57728e+02 242.686 8.71284e+01 242.686 0.8803 
1 1 1 -16 39  8  o 9  4.57778e+00 1.36380e+00 5.10784e+01 155.206 -2.74199e+00 1.26662e+00  0.00000e+00 0.00000e+00 8.99832e+01 155.206 3.89048e+01 155.206 0.8115 
1 1 1 -16 39  9  o 17 5.05533e+00 1.43574e+00 1.25413e+02 301.233 4.34980e+00  -7.17303e+00 0.00000e+00 0.00000e+00 5.45098e+01 301.233 7.09027e+01 121.233 0.9384 
1 1 1 -16 39  10 o 12 4.84137e+00 1.48819e+00 1.11857e+02 11.268  7.10169e+00  1.41494e+00  0.00000e+00 0.00000e+00 5.83644e+01 11.268  5.34929e+01 191.268 0.9281 
1 1 1 -16 39  11 o 13 4.39324e+00 1.38874e+00 2.25567e+01 220.056 -1.17210e+00 -9.85473e-01 0.00000e+00 0.00000e+00 7.77996e+01 220.056 5.52429e+01 220.056 0.6038 
1 1 1 -16 40  1  o 2  5.42232e+00 1.47207e+00 1.09810e+02 210.894 -5.71937e+00 -3.42218e+00 0.00000e+00 0.00000e+00 8.11517e+01 210.894 2.86586e+01 30.894  0.9216 
1 1 1 -16 40  2  o 18 1.03614e+01 1.36535e+00 1.55898e+02 359.667 1.93241e+01  -1.12412e-01 0.00000e+00 0.00000e+00 2.29385e+02 359.667 7.34870e+01 359.667 0.9738 
1 1 1 -16 40  3  o 6  3.87137e+00 1.22448e+00 9.31972e+01 126.958 -2.66031e+00 3.53574e+00  0.00000e+00 0.00000e+00 3.65074e+01 126.958 5.66898e+01 306.958 0.8781 
1 1 1 -16 40  4  o 10 4.40921e+00 1.32825e+00 1.07427e+02 233.577 -3.33426e+00 -4.51875e+00 0.00000e+00 0.00000e+00 4.48541e+01 233.577 6.25731e+01 53.577  0.9059 
1 1 1 -16 40  5  o 19 6.34827e+00 1.50253e+00 1.16448e+02 171.250 -8.17949e+00 1.25900e+00  0.00000e+00 0.00000e+00 1.10227e+02 171.250 6.22072e+00 351.250 0.9375 
1 1 1 -16 40  6  o 14 5.12526e+00 1.58095e+00 7.67895e+01 236.068 -2.47782e+00 -3.68292e+00 0.00000e+00 0.00000e+00 9.45354e+01 236.068 1.77459e+01 236.068 0.8785 
1 1 1 -16 40  7  o 9  3.84498e+00 1.30481e+00 5.68660e+01 162.294 -2.78623e+00 8.89507e-01  0.00000e+00 0.00000e+00 6.06779e+01 162.294 3.81192e+00 162.294 0.8043 
1 1 1 -16 40  8  o 6  6.08195e+00 1.49105e+00 8.78087e+01 333.681 5.66983e+00  -2.80450e+00 0.00000e+00 0.00000e+00 1.23981e+02 333.681 3.61725e+01 333.681 0.9171 
1 1 1 -16 40  9  o 11 3.83768e+00 1.28735e+00 4.19027e+01 243.250 -1.05937e+00 -2.10172e+00 0.00000e+00 0.00000e+00 6.69765e+01 243.250 2.50738e+01 243.250 0.7481 
1 1 1 -16 40  10 o 1  4.83506e+00 1.45963e+00 9.56458e+01 150.021 -5.43862e+00 3.13727e+00  0.00000e+00 0.00000e+00 7.22021e+01 150.021 2.34437e+01 330.021 0.9165 
1 1 1 -16 40  11 o 10 6.19266e+00 1.62697e+00 1.06625e+02 75.092  2.20000e+00  8.26328e+00  0.00000e+00 0.00000e+00 1.13484e+02 75.092  6.85936e+00 75.092  0.9396 
1 1 1 -16 41  1  o 8  7.16274e+00 1.57356e+00 1.48588e+02 205.293 -9.61191e+00 -4.54218e+00 0.00000e+00 0.00000e+00 1.11891e+02 205.293 3.66968e+01 25.293  0.9517 
1 1 1 -16 41  2  o 2  6.50049e+00 1.50714e+00 1.66292e+02 294.756 4.70286e+00  -1.01987e+01 0.00000e+00 0.00000e+00 7.05863e+01 294.756 9.57059e+01 114.755 0.9544 
1 1 1 -16 41  3  o 7  5.84946e+00 1.44192e+00 1.22227e+02 161.582 -7.84049e+00 2.61087e+00  0.00000e+00 0.00000e+00 8.69639e+01 161.582 3.52633e+01 341.582 0.9374 
1 1 1 -16 41  4  o 19 5.75708e+00 1.50747e+00 8.53642e+01 280.773 1.02881e+00  -5.40684e+00 0.00000e+00 0.00000e+00 1.12996e+02 280.773 2.76316e+01 280.773 0.9039 
1 1 1 -16 41  5  o 11 6.92255e+00 1.62406e+00 1.47542e+02 102.377 -2.29740e+00 1.04690e+01  0.00000e+00 0.00000e+00 1.03476e+02 102.377 4.40668e+01 282.377 0.9521 
1 1 1 -16 41  6  o 17 6.34849e+00 1.69343e+00 9.28121e+01 11.734  5.82462e+00  1.20985e+00  0.00000e+00 0.00000e+00 1.27362e+02 11.734  3.45496e+01 11.734  0.9116 
1 1 1 -16 41  7  o 9  8.71322e+00 1.86572e+00 1.46001e+02 145.299 -9.55866e+00 6.61889e+00  0.00000e+00 0.00000e+00 1.70580e+02 145.299 2.45788e+01 145.299 0.9560 
1 1 1 -16 41  8  o 3  6.26578e+00 1.59779e+00 8.73087e+01 279.550 1.01195e+00  -6.01509e+00 0.00000e+00 0.00000e+00 1.30083e+02 279.550 4.27747e+01 279.550 0.9139 
1 1 1 -16 41  9  o 13 9.92114e+00 1.62347e+00 1.50425e+02 203.369 -1.59694e+01 -6.90043e+00 0.00000e+00 0.00000e+00 2.14811e+02 203.369 6.43853e+01 203.369 0.9708 
1 1 1 -16 41  10 o 8  8.83066e+00 1.65300e+00 1.35377e+02 23.350  1.29424e+01  5.58739e+00  0.00000e+00 0.00000e+00 1.86986e+02 23.350  5.16095e+01 23.350  0.9639 
1 1 1 -16 41  11 o 6  4.81527e+00 1.46064e+00 5.14173e+01 244.073 -1.64124e+00 -3.37592e+00 0.00000e+00 0.00000e+00 1.04009e+02 244.073 5.25915e+01 244.073 0.8533 
1 1 1 -16 42  1  o 11 5.89168e+00 1.42182e+00 1.03173e+02 339.530 6.67081e+00  -2.49018e+00 0.00000e+00 0.00000e+00 1.05457e+02 339.530 2.28327e+00 339.530 0.9269 
1 1 1 -16 42  2  o 6  3.79864e+00 1.21865e+00 7.65431e+01 313.323 2.65400e+00  -2.81411e+00 0.00000e+00 0.00000e+00 4.79231e+01 313.323 2.86200e+01 133.323 0.8583 
1 1 1 -16 42  3  o 15 1.01132e+01 1.37402e+00 2.01935e+02 330.022 2.04007e+01  -1.17679e+01 0.00000e+00 0.00000e+00 1.75572e+02 330.022 2.63637e+01 150.022 0.9785 
1 1 1 -16 42  4  o 2  5.17518e+00 1.45033e+00 9.76708e+01 213.093 -4.90636e+00 -3.19760e+00 0.00000e+00 0.00000e+00 8.18382e+01 213.093 1.58326e+01 33.093  0.9101 
1 1 1 -16 42  5  o 9  8.28180e+00 1.48748e+00 1.36491e+02 81.242  1.90046e+00  1.23356e+01  0.00000e+00 0.00000e+00 1.65963e+02 81.242  2.94726e+01 81.242  0.9591 
1 1 1 -16 42  6  o 11 9.51841e+00 1.84164e+00 1.58828e+02 187.619 -1.39006e+01 -1.85933e+00 0.00000e+00 0.00000e+00 1.90111e+02 187.619 3.12834e+01 187.619 0.9637 
1 1 1 -16 42  7  f 0  9.19942e+00 1.87396e+00 1.01086e+02 277.645 1.15577e+00  -8.61104e+00 0.00000e+00 0.00000e+00 2.27731e+02 277.645 1.26645e+02 277.645 0.9406 
1 1 1 -16 42  8  o 8  4.93998e+00 1.54464e+00 1.16232e+02 73.477  1.90521e+00  6.42242e+00  0.00000e+00 0.00000e+00 5.66659e+01 73.477  5.95665e+01 253.477 0.9220 
1 1 1 -16 42  9  o 1  6.72188e+00 1.74556e+00 1.16114e+02 234.010 -5.03099e+00 -6.92712e+00 0.00000e+00 0.00000e+00 1.23370e+02 234.010 7.25617e+00 234.010 0.9396 
1 1 1 -16 42  10 o 4  8.16053e+00 1.66992e+00 1.49116e+02 83.040  1.69712e+00  1.39028e+01  0.00000e+00 0.00000e+00 1.48676e+02 83.040  4.39294e-01 263.040 0.9636 
1 1 1 -16 43  1  o 8  8.21660e+00 1.50123e+00 2.09463e+02 89.212  2.52652e-01  1.83785e+01  0.00000e+00 0.00000e+00 9.57585e+01 89.212  1.13704e+02 269.212 0.9724 
1 1 1 -16 43  2  o 17 1.16938e+01 1.23524e+00 2.59399e+02 240.143 -1.89272e+01 -3.29722e+01 0.00000e+00 0.00000e+00 1.81077e+02 240.143 7.83217e+01 60.143  0.9868 
1 1 1 -16 43  3  o 19 5.86320e+00 1.55129e+00 9.03007e+01 109.838 -1.95581e+00 5.42132e+00  0.00000e+00 0.00000e+00 1.12878e+02 109.838 2.25769e+01 109.838 0.9085 
1 1 1 -16 43  4  o 15 6.43358e+00 1.55104e+00 8.39365e+01 129.311 -3.76678e+00 4.60022e+00  0.00000e+00 0.00000e+00 1.39549e+02 129.311 5.56122e+01 129.311 0.9115 
1 1 1 -16 43  5  o 2  3.83040e+00 1.23204e+00 8.69692e+01 203.695 -4.20637e+00 -1.84603e+00 0.00000e+00 0.00000e+00 4.18115e+01 203.695 4.51577e+01 23.695  0.8830 
1 1 1 -16 43  6  o 17 7.55143e+00 1.79491e+00 9.98837e+01 36.267  5.58726e+00  4.09937e+00  0.00000e+00 0.00000e+00 1.65736e+02 36.267  6.58521e+01 36.267  0.9247 
1 1 1 -16 43  7  o 7  7.08030e+00 1.84894e+00 1.02857e+02 272.199 2.53387e-01  -6.59968e+00 0.00000e+00 0.00000e+00 1.44880e+02 272.199 4.20233e+01 272.199 0.9208 
1 1 1 -16 43  8  o 14 4.27051e+00 1.36224e+00 3.09033e+01 128.585 -1.09928e+00 1.37779e+00  0.00000e+00 0.00000e+00 7.52131e+01 128.585 4.43098e+01 128.585 0.6547 
1 1 1 -16 43  9  o 9  7.85720e+00 1.59667e+00 8.66491e+01 215.061 -6.61508e+00 -4.64252e+00 0.00000e+00 0.00000e+00 1.92142e+02 215.061 1.05493e+02 215.061 0.9359 
1 1 1 -16 43  10 o 9  3.64316e+00 1.24628e+00 1.00231e+02 308.197 3.58250e+00  -4.55304e+00 0.00000e+00 0.00000e+00 2.51687e+01 308.197 7.50620e+01 128.197 0.9090 
1 1 1 -16 44  1  o 18 4.91579e+00 1.38065e+00 5.88993e+01 58.415  1.84308e+00  2.99766e+00  0.00000e+00 0.00000e+00 9.92160e+01 58.415  4.03167e+01 58.415  0.8421 
1 1 1 -16 44  2  o 13 4.04306e+00 1.25282e+00 6.80467e+01 182.680 -3.62116e+00 -1.69474e-01 0.00000e+00 0.00000e+00 6.27188e+01 182.680 5.32793e+00 2.680   0.8474 
1 1 1 -16 44  3  o 18 6.39160e+00 1.51302e+00 9.20963e+01 203.490 -6.00654e+00 -2.61051e+00 0.00000e+00 0.00000e+00 1.32196e+02 203.490 4.01001e+01 203.490 0.9201 
1 1 1 -16 44  4  o 5  9.20497e+00 1.36804e+00 1.54638e+02 201.941 -1.57193e+01 -6.33226e+00 0.00000e+00 0.00000e+00 1.85608e+02 201.941 3.09697e+01 201.941 0.9700 
1 1 1 -16 44  5  f 0  6.72514e+00 1.52871e+00 1.29566e+02 38.335  7.98149e+00  6.31138e+00  0.00000e+00 0.00000e+00 1.13535e+02 38.335  1.60308e+01 218.335 0.9495 
1 1 1 -16 44  6  o 19 4.34837e+00 1.34026e+00 7.74261e+01 191.899 -4.30498e+00 -9.07110e-01 0.00000e+00 0.00000e+00 6.76630e+01 191.899 9.76302e+00 11.899  0.8773 
1 1 1 -16 44  7  o 19 5.32968e+00 1.63009e+00 1.30656e+02 49.686  4.86688e+00  5.73593e+00  0.00000e+00 0.00000e+00 5.78525e+01 49.686  7.28032e+01 229.686 0.9309 
1 1 1 -16 44  8  o 3  4.41263e+00 1.45855e+00 6.41032e+01 198.258 -3.39167e+00 -1.11892e+00 0.00000e+00 0.00000e+00 7.73632e+01 198.258 1.32601e+01 198.258 0.8448 
1 1 1 -16 44  9  o 10 3.91427e+00 1.30318e+00 9.55556e+01 304.096 3.05923e+00  -4.51909e+00 0.00000e+00 0.00000e+00 3.84317e+01 304.096 5.71239e+01 124.096 0.9030 
1 1 1 -16 44  10 o 17 9.14393e+00 1.59991e+00 1.47827e+02 83.349  1.97053e+00  1.68997e+01  0.00000e+00 0.00000e+00 1.88037e+02 83.349  4.02097e+01 83.349  0.9702 
1 1 1 -16 45  1  o 4  5.04817e+00 1.36382e+00 7.48159e+01 36.385  3.72418e+00  2.74419e+00  0.00000e+00 0.00000e+00 9.56033e+01 36.385  2.07873e+01 36.385  0.8839 
1 1 1 -16 45  2  o 11 4.49607e+00 1.26387e+00 3.23755e+01 118.668 -9.10742e-01 1.66569e+00  0.00000e+00 0.00000e+00 8.43663e+01 118.668 5.19908e+01 118.668 0.6804 
1 1 1 -16 45  3  o 13 4.94299e+00 1.30025e+00 5.36370e+01 248.722 -1.24599e+00 -3.19937e+00 0.00000e+00 0.00000e+00 1.04235e+02 248.722 5.05977e+01 248.722 0.8375 
1 1 1 -16 45  4  o 16 5.44282e+00 1.45271e+00 6.24953e+01 54.410  2.36398e+00  3.30323e+00  0.00000e+00 0.00000e+00 1.17063e+02 54.410  5.45678e+01 54.410  0.8659 
1 1 1 -16 45  5  o 19 5.76313e+00 1.44718e+00 9.91681e+01 124.045 -3.79037e+00 5.61002e+00  0.00000e+00 0.00000e+00 1.03289e+02 124.045 4.12126e+00 124.045 0.9229 
1 1 1 -16 45  6  o 10 5.35265e+00 1.47173e+00 1.15105e+02 14.785  7.05581e+00  1.86226e+00  0.00000e+00 0.00000e+00 7.39353e+01 14.785  4.11701e+01 194.785 0.9287 
1 1 1 -16 45  7  o 2  7.13516e+00 1.79191e+00 1.31283e+02 251.853 -2.85751e+00 -8.71812e+00 0.00000e+00 0.00000e+00 1.24543e+02 251.853 6.73943e+00 71.853  0.9438 
1 1 1 -16 45  8  o 10 5.88623e+00 1.74271e+00 8.04986e+01 115.319 -2.14556e+00 4.53509e+00  0.00000e+00 0.00000e+00 1.19138e+02 115.319 3.86397e+01 115.319 0.8938 
1 1 1 -16 45  9  o 18 4.40436e+00 1.41863e+00 1.01432e+02 59.081  3.23631e+00  5.40340e+00  0.00000e+00 0.00000e+00 5.16091e+01 59.081  4.98229e+01 239.081 0.9168 
1 1 1 -16 45  10 f 0  4.17957e+00 1.36321e+00 9.60679e+01 214.382 -5.00725e+00 -3.42623e+00 0.00000e+00 0.00000e+00 4.84512e+01 214.382 4.76167e+01 34.382  0.9134 
1 1 1 -16 46  1  o 6  3.84763e+00 1.22931e+00 3.91183e+01 248.529 -7.47010e-01 -1.89922e+00 0.00000e+00 0.00000e+00 6.43749e+01 248.529 2.52566e+01 248.529 0.7044 
1 1 1 -16 46  2  o 2  3.94591e+00 1.21529e+00 8.65657e+01 306.194 2.75803e+00  -3.76915e+00 0.00000e+00 0.00000e+00 4.67108e+01 306.194 3.98550e+01 126.194 0.8851 
1 1 1 -16 46  3  o 14 4.72536e+00 1.38344e+00 7.25265e+01 252.781 -1.19581e+00 -3.85846e+00 0.00000e+00 0.00000e+00 8.33261e+01 252.781 1.07997e+01 252.781 0.8650 
1 1 1 -16 46  4  o 1  9.82303e+00 1.35634e+00 1.62806e+02 191.509 -2.05852e+01 -4.19154e+00 0.00000e+00 0.00000e+00 2.02392e+02 191.509 3.95860e+01 191.509 0.9759 
1 1 1 -16 46  5  o 15 1.00505e+01 1.40612e+00 1.95488e+02 326.853 2.03125e+01  -1.32651e+01 0.00000e+00 0.00000e+00 1.79073e+02 326.853 1.64150e+01 146.853 0.9792 
1 1 1 -16 46  6  o 19 4.33869e+00 1.32190e+00 1.20305e+02 359.198 7.09921e+00  -9.93699e-02 0.00000e+00 0.00000e+00 3.25633e+01 359.198 8.77417e+01 179.198 0.9266 
1 1 1 -16 46  7  o 19 6.33151e+00 1.75969e+00 1.01296e+02 109.101 -2.11719e+00 6.11382e+00  0.00000e+00 0.00000e+00 1.19742e+02 109.101 1.84454e+01 109.101 0.9191 
1 1 1 -16 46  8  o 16 7.22285e+00 1.92479e+00 9.61575e+01 6.330   6.50986e+00  7.22172e-01  0.00000e+00 0.00000e+00 1.56005e+02 6.330   5.98472e+01 6.330   0.9201 
1 1 1 -16 46  9  o 1  5.38810e+00 1.55053e+00 1.04481e+02 275.091 6.33748e-01  -7.11354e+00 0.00000e+00 0.00000e+00 8.48264e+01 275.091 1.96548e+01 95.091  0.9271 
1 1 1 -16 46  10 o 11 7.90615e+00 1.61030e+00 1.20376e+02 209.040 -1.07652e+01 -5.97720e+00 0.00000e+00 0.00000e+00 1.66461e+02 209.040 4.60854e+01 209.040 0.9585 
1 1 1 -16 47  1  o 7  5.37687e+00 1.43536e+00 1.02815e+02 337.585 5.83496e+00  -2.40678e+00 0.00000e+00 0.00000e+00 8.54352e+01 337.585 1.73797e+01 157.585 0.9169 
1 1 1 -16 47  2  f 0  4.99258e+00 1.41525e+00 6.17559e+01 109.555 -1.19251e+00 3.35731e+00  0.00000e+00 0.00000e+00 9.90762e+01 109.555 3.73203e+01 109.555 0.8443 
1 1 1 -16 47  3  o 14 6.60844e+00 1.44680e+00 1.25615e+02 6.207   9.88836e+00  1.07537e+00  0.00000e+00 0.00000e+00 1.13302e+02 6.207   1.23134e+01 186.207 0.9483 
1 1 1 -16 47  4  o 3  4.06581e+00 1.27103e+00 5.48421e+01 130.602 -1.92838e+00 2.24972e+00  0.00000e+00 0.00000e+00 7.01723e+01 130.602 1.53301e+01 130.602 0.8072 
1 1 1 -16 47  5  o 13 6.38005e+00 1.49742e+00 1.59951e+02 312.890 8.17122e+00  -8.79627e+00 0.00000e+00 0.00000e+00 7.25058e+01 312.890 8.74449e+01 132.890 0.9574 
1 1 1 -16 47  6  o 18 4.90235e+00 1.41758e+00 6.42894e+01 85.438  3.00134e-01  3.76158e+00  0.00000e+00 0.00000e+00 9.49192e+01 85.438  3.06298e+01 85.438  0.8542 
1 1 1 -16 47  7  o 12 3.90917e+00 1.30765e+00 7.76256e+01 223.274 -3.06689e+00 -2.88750e+00 0.00000e+00 0.00000e+00 5.17207e+01 223.274 2.59049e+01 43.274  0.8712 
1 1 1 -16 47  8  o 1  4.17100e+00 1.38859e+00 5.85263e+01 287.462 1.04751e+00  -3.32994e+00 0.00000e+00 0.00000e+00 7.44905e+01 287.462 1.59642e+01 287.462 0.8406 
1 1 1 -16 47  9  o 10 5.45709e+00 1.56711e+00 9.27154e+01 153.828 -5.70695e+00 2.80474e+00  0.00000e+00 0.00000e+00 9.70307e+01 153.828 4.31529e+00 153.828 0.9176 
1 1 1 -16 47  10 o 11 4.14485e+00 1.35435e+00 7.85057e+01 319.165 4.08654e+00  -3.53171e+00 0.00000e+00 0.00000e+00 6.29777e+01 319.165 1.55280e+01 139.166 0.9019 
1 1 1 -16 48  1  o 4  4.64050e+00 1.32859e+00 9.63961e+01 310.977 3.80151e+00  -4.37667e+00 0.00000e+00 0.00000e+00 6.46591e+01 310.977 3.17370e+01 130.977 0.9091 
1 1 1 -16 48  2  o 12 6.34646e+00 1.56342e+00 1.35476e+02 93.529  -5.87016e-01 9.51820e+00  0.00000e+00 0.00000e+00 9.35664e+01 93.529  4.19099e+01 273.529 0.9460 
1 1 1 -16 48  3  o 12 7.11731e+00 1.49582e+00 7.95700e+01 269.880 -1.41204e-02 -6.76267e+00 0.00000e+00 0.00000e+00 1.70783e+02 269.880 9.12132e+01 269.880 0.9228 
1 1 1 -16 48  4  o 12 5.11899e+00 1.44734e+00 4.57140e+01 243.264 -1.26556e+00 -2.51231e+00 0.00000e+00 0.00000e+00 1.09311e+02 243.264 6.35973e+01 243.264 0.7952 
1 1 1 -16 48  5  o 13 7.56263e+00 1.49142e+00 1.58447e+02 203.186 -1.28772e+01 -5.51534e+00 0.00000e+00 0.00000e+00 1.18849e+02 203.186 3.95984e+01 23.186  0.9636 
1 1 1 -16 48  6  o 1  3.02316e+00 1.04500e+00 9.44054e+01 254.529 -1.21109e+00 -4.37555e+00 0.00000e+00 0.00000e+00 6.89733e+00 254.529 8.75081e+01 74.529  0.8815 
1 1 1 -16 48  7  o 15 7.85644e+00 1.79297e+00 1.88976e+02 43.023  1.08760e+01  1.01501e+01  0.00000e+00 0.00000e+00 9.91565e+01 43.023  8.98197e+01 223.023 0.9658 
1 1 1 -16 48  8  o 8  4.91641e+00 1.58075e+00 1.56545e+02 189.370 -9.11908e+00 -1.50470e+00 0.00000e+00 0.00000e+00 1.95475e+01 189.370 1.36997e+02 9.370   0.9442 
1 1 1 -16 48  9  o 1  3.79858e+00 1.25009e+00 4.89397e+01 40.932  2.20563e+00  1.91277e+00  0.00000e+00 0.00000e+00 6.67516e+01 40.932  1.78120e+01 40.932  0.8039 
1 1 1 -16 48  10 o 17 3.72053e+00 1.25483e+00 7.13412e+01 27.527  4.26325e+00  2.22183e+00  0.00000e+00 0.00000e+00 5.37822e+01 27.527  1.75590e+01 207.527 0.8887 
1 1 1 -16 49  1  o 5  6.62491e+00 1.42846e+00 6.97470e+01 131.971 -3.86410e+00 4.29595e+00  0.00000e+00 0.00000e+00 1.60068e+02 131.971 9.03214e+01 131.971 0.9088 
1 1 1 -16 49  2  o 11 1.42249e+01 1.17170e+00 2.03120e+02 43.030  3.14007e+01  2.93126e+01  0.00000e+00 0.00000e+00 3.33123e+02 43.030  1.30004e+02 43.030  0.9883 
1 1 1 -16 49  3  o 10 7.95749e+00 1.46413e+00 1.37390e+02 202.520 -1.18313e+01 -4.90561e+00 0.00000e+00 0.00000e+00 1.53807e+02 202.520 1.64165e+01 202.520 0.9601 
1 1 1 -16 49  4  o 18 4.26145e+00 1.35092e+00 4.86218e+01 350.344 2.47989e+00  -4.21929e-01 0.00000e+00 0.00000e+00 7.57943e+01 350.344 2.71725e+01 350.344 0.7667 
1 1 1 -16 49  5  o 17 9.50992e+00 1.44379e+00 1.51938e+02 181.339 -1.80716e+01 -4.22299e-01 0.00000e+00 0.00000e+00 1.99721e+02 181.339 4.77824e+01 181.339 0.9719 
1 1 1 -16 49  6  o 7  1.22848e+01 1.74198e+00 2.14920e+02 359.271 2.67192e+01  -3.39809e-01 0.00000e+00 0.00000e+00 2.43186e+02 359.271 2.82655e+01 359.271 0.9811 
1 1 1 -16 49  7  o 7  3.91002e+00 1.31281e+00 7.29640e+01 91.639  -1.17993e-01 4.12273e+00  0.00000e+00 0.00000e+00 5.59199e+01 91.639  1.70441e+01 271.639 0.8681 
1 1 1 -16 49  8  o 19 4.81333e+00 1.54058e+00 5.35108e+01 119.204 -1.54513e+00 2.76423e+00  0.00000e+00 0.00000e+00 9.64765e+01 119.204 4.29657e+01 119.204 0.8216 
1 1 1 -16 49  9  o 3  5.03866e+00 1.50629e+00 4.27466e+01 336.966 2.68301e+00  -1.14077e+00 0.00000e+00 0.00000e+00 1.10632e+02 336.966 6.78854e+01 336.966 0.8035 
1 1 1 -16 49  10 o 17 3.03988e+00 1.06608e+00 3.26537e+01 148.767 -1.67537e+00 1.01594e+00  0.00000e+00 0.00000e+00 4.68223e+01 148.767 1.41686e+01 148.767 0.6910 
1 1 1 -16 50  1  o 3  4.39809e+00 1.25061e+00 5.51484e+01 351.881 3.23283e+00  -4.61191e-01 0.00000e+00 0.00000e+00 8.38161e+01 351.881 2.86677e+01 351.881 0.8279 
1 1 1 -16 50  2  o 7  4.11937e+00 1.27207e+00 6.43985e+01 340.826 3.38440e+00  -1.17687e+00 0.00000e+00 0.00000e+00 6.84101e+01 340.826 4.01157e+00 340.826 0.8453 
1 1 1 -16 50  3  o 14 5.62593e+00 1.45732e+00 9.96093e+01 238.288 -3.34901e+00 -5.41990e+00 0.00000e+00 0.00000e+00 9.71556e+01 238.288 2.45369e+00 58.288  0.9178 
1 1 1 -16 50  4  o 4  7.25578e+00 1.40482e+00 1.05513e+02 52.967  5.76451e+00  7.64064e+00  0.00000e+00 0.00000e+00 1.55899e+02 52.967  5.03863e+01 52.967  0.9462 
1 1 1 -16 50  5  o 2  4.25725e+00 1.29177e+00 9.52463e+01 124.458 -2.97749e+00 4.33907e+00  0.00000e+00 0.00000e+00 5.03672e+01 124.458 4.48791e+01 304.458 0.8991 
1 1 1 -16 50  6  o 1  1.45428e+01 1.17517e+00 1.83603e+02 59.365  2.04282e+01  3.44937e+01  0.00000e+00 0.00000e+00 3.62135e+02 59.365  1.78533e+02 59.365  0.9874 
1 1 1 -16 50  7  o 14 7.65643e+00 1.87993e+00 1.22501e+02 209.519 -7.84953e+00 -4.44442e+00 0.00000e+00 0.00000e+00 1.51548e+02 209.519 2.90472e+01 209.519 0.9428 
1 1 1 -16 50  8  o 2  5.68625e+00 1.67955e+00 9.05237e+01 243.483 -2.66403e+00 -5.33921e+00 0.00000e+00 0.00000e+00 1.06101e+02 243.483 1.55768e+01 243.483 0.9118 
1 1 1 -16 50  9  o 4  5.48793e+00 1.57766e+00 9.76215e+01 44.935  4.85843e+00  4.84749e+00  0.00000e+00 0.00000e+00 9.44454e+01 44.935  3.17611e+00 224.935 0.9240 
1 1 1 -16 51  1  o 7  1.00574e+01 1.43036e+00 1.80506e+02 340.120 1.97503e+01  -7.14155e+00 0.00000e+00 0.00000e+00 1.94051e+02 340.120 1.35451e+01 340.120 0.9759 
1 1 1 -16 51  2  o 3  4.90325e+00 1.38671e+00 5.85530e+01 81.582  4.99494e-01  3.37511e+00  0.00000e+00 0.00000e+00 9.78294e+01 81.582  3.92763e+01 81.582  0.8364 
1 1 1 -16 51  3  o 18 4.93129e+00 1.36619e+00 6.00063e+01 348.281 3.72061e+00  -7.71767e-01 0.00000e+00 0.00000e+00 1.00714e+02 348.281 4.07075e+01 348.281 0.8554 
1 1 1 -16 51  4  o 12 6.95925e+00 1.52770e+00 1.06391e+02 134.876 -6.17053e+00 6.19735e+00  0.00000e+00 0.00000e+00 1.42909e+02 134.876 3.65186e+01 134.876 0.9410 
1 1 1 -16 51  5  o 16 3.58764e+00 1.17565e+00 6.18395e+01 202.998 -2.98595e+00 -1.26735e+00 0.00000e+00 0.00000e+00 5.09438e+01 202.998 1.08957e+01 22.998  0.8265 
1 1 1 -16 51  6  o 12 9.16293e+00 1.40671e+00 1.62283e+02 255.573 -4.79808e+00 -1.86504e+01 0.00000e+00 0.00000e+00 1.76728e+02 255.573 1.44452e+01 255.573 0.9737 
1 1 1 -16 51  7  f 0  1.38812e+01 1.58457e+00 1.47757e+02 256.110 -6.08041e+00 -2.45888e+01 0.00000e+00 0.00000e+00 3.68647e+02 256.110 2.20890e+02 256.110 0.9801 
1 1 1 -16 51  8  o 2  6.10533e+00 1.70664e+00 7.64404e+01 47.931  3.53369e+00  3.91512e+00  0.00000e+00 0.00000e+00 1.31759e+02 47.931  5.53187e+01 47.931  0.8994 
1 1 1 -16 51  9  o 6  4.62806e+00 1.45264e+00 8.43861e+01 48.952  3.76517e+00  4.32398e+00  0.00000e+00 0.00000e+00 7.47666e+01 48.952  9.61951e+00 228.952 0.9080 
1 1 1 -16 52  1  o 16 1.04120e+01 1.35174e+00 1.02720e+02 215.432 -1.13027e+01 -8.04182e+00 0.00000e+00 0.00000e+00 2.79964e+02 215.432 1.77243e+02 215.432 0.9633 
1 1 1 -16 52  2  o 9  6.86000e+00 1.38884e+00 1.30507e+02 329.269 9.73148e+00  -5.78514e+00 0.00000e+00 0.00000e+00 1.19219e+02 329.269 1.12879e+01 149.269 0.9548 
1 1 1 -16 52  3  o 12 7.71285e+00 1.44081e+00 1.84306e+02 115.044 -7.27196e+00 1.55632e+01  0.00000e+00 0.00000e+00 1.00852e+02 115.044 8.34536e+01 295.045 0.9704 
1 1 1 -16 52  4  o 12 7.61240e+00 1.50685e+00 1.30976e+02 3.424   1.12480e+01  6.72992e-01  0.00000e+00 0.00000e+00 1.45619e+02 3.424   1.46431e+01 3.424   0.9545 
1 1 1 -16 52  5  o 2  6.52128e+00 1.42117e+00 7.72082e+01 267.256 -3.02945e-01 -6.32165e+00 0.00000e+00 0.00000e+00 1.50258e+02 267.256 7.30502e+01 267.256 0.9172 
1 1 1 -16 52  6  o 4  7.97163e+00 1.50819e+00 1.53187e+02 148.265 -1.30487e+01 8.07003e+00  0.00000e+00 0.00000e+00 1.39636e+02 148.265 1.35508e+01 328.265 0.9668 
1 1 1 -16 52  7  o 16 7.69615e+00 1.64343e+00 1.81819e+02 5.985   1.59766e+01  1.67494e+00  0.00000e+00 0.00000e+00 1.01033e+02 5.985   8.07861e+01 185.985 0.9684 
1 1 1 -16 52  8  o 19 6.81673e+00 1.83796e+00 1.24051e+02 203.871 -7.89073e+00 -3.49200e+00 0.00000e+00 0.00000e+00 1.18910e+02 203.871 5.14100e+00 23.872  0.9401 
1 1 1 -16 52  9  o 18 5.39012e+00 1.62257e+00 8.78725e+01 243.296 -2.76616e+00 -5.49901e+00 0.00000e+00 0.00000e+00 9.88285e+01 243.296 1.09561e+01 243.296 0.9147 
1 1 1 -16 53  1  o 9  5.13647e+00 1.43950e+00 1.29201e+02 259.693 -1.43648e+00 -7.89859e+00 0.00000e+00 0.00000e+00 5.41140e+01 259.693 7.50874e+01 79.693  0.9355 
1 1 1 -16 53  2  o 6  6.02909e+00 1.39626e+00 6.44262e+01 280.915 9.15249e-01  -4.74624e+00 0.00000e+00 0.00000e+00 1.39993e+02 280.915 7.55670e+01 280.915 0.8894 
1 1 1 -16 53  3  o 17 6.35227e+00 1.50458e+00 7.41794e+01 69.167  2.00946e+00  5.28089e+00  0.00000e+00 0.00000e+00 1.45183e+02 69.167  7.10037e+01 69.167  0.9066 
1 1 1 -16 53  4  o 17 4.06623e+00 1.26522e+00 4.98699e+01 334.814 2.52988e+00  -1.18972e+00 0.00000e+00 0.00000e+00 7.29573e+01 334.814 2.30874e+01 334.814 0.7937 
1 1 1 -16 53  5  o 13 5.00740e+00 1.40041e+00 3.98275e+01 47.188  1.76528e+00  1.90551e+00  0.00000e+00 0.00000e+00 1.07774e+02 47.188  6.79470e+01 47.188  0.7752 
1 1 1 -16 53  6  o 6  7.77395e+00 1.52638e+00 1.44866e+02 228.005 -9.29311e+00 -1.03229e+01 0.00000e+00 0.00000e+00 1.39608e+02 228.005 5.25856e+00 48.005  0.9633 
1 1 1 -16 53  7  o 4  3.94633e+00 1.27452e+00 5.41369e+01 62.525  1.46830e+00  2.82355e+00  0.00000e+00 0.00000e+00 6.90544e+01 62.525  1.49174e+01 62.525  0.8226 
1 1 1 -16 53  8  o 9  4.22557e+00 1.39555e+00 6.27249e+01 72.229  1.14844e+00  3.58318e+00  0.00000e+00 0.00000e+00 7.40215e+01 72.229  1.12966e+01 72.229  0.8537 
1 1 1 -16 53  9  o 14 3.51102e+00 1.21452e+00 6.99992e+01 298.003 2.15656e+00  -4.05543e+00 0.00000e+00 0.00000e+00 4.73819e+01 298.003 2.26173e+01 118.003 0.8830 
1 1 1 -16 54  1  o 10 7.00732e+00 1.51490e+00 1.00897e+02 233.527 -5.00423e+00 -6.76940e+00 0.00000e+00 0.00000e+00 1.49981e+02 233.527 4.90842e+01 233.527 0.9386 
1 1 1 -16 54  2  o 3  7.09629e+00 1.52822e+00 1.12621e+02 50.196  5.70551e+00  6.84690e+00  0.00000e+00 0.00000e+00 1.42210e+02 50.196  2.95898e+01 50.196  0.9421 
1 1 1 -16 54  3  f 0  7.93907e+00 1.51413e+00 2.02235e+02 326.533 1.56402e+01  -1.03389e+01 0.00000e+00 0.00000e+00 9.19601e+01 326.533 1.10275e+02 146.533 0.9730 
1 1 1 -16 54  4  o 18 1.04925e+01 1.31334e+00 1.57934e+02 52.666  1.35921e+01  1.78203e+01  0.00000e+00 0.00000e+00 2.32337e+02 52.666  7.44029e+01 52.666  0.9774 
1 1 1 -16 54  5  o 8  3.38933e+00 1.12752e+00 3.32149e+01 95.187  -1.61877e-01 1.78324e+00  0.00000e+00 0.00000e+00 5.18584e+01 95.187  1.86436e+01 95.187  0.6602 
1 1 1 -16 54  6  o 5  4.50845e+00 1.29994e+00 9.02240e+01 75.719  1.47847e+00  5.80820e+00  0.00000e+00 0.00000e+00 6.59900e+01 75.719  2.42340e+01 255.719 0.9123 
1 1 1 -16 54  7  o 1  7.78336e+00 1.61268e+00 1.32171e+02 212.837 -1.05268e+01 -6.79359e+00 0.00000e+00 0.00000e+00 1.51105e+02 212.837 1.89343e+01 212.837 0.9592 
1 1 1 -16 54  8  o 3  4.55079e+00 1.44026e+00 1.14216e+02 126.401 -4.39112e+00 5.95576e+00  0.00000e+00 0.00000e+00 4.61430e+01 126.401 6.80727e+01 306.401 0.9297 
1 1 1 -16 54  9  o 7  5.41930e+00 1.60993e+00 1.17028e+02 298.905 3.92085e+00  -7.10108e+00 0.00000e+00 0.00000e+00 7.50298e+01 298.905 4.19986e+01 118.905 0.9362 
1 1 1 -16 55  1  o 11 5.41683e+00 1.46888e+00 8.02918e+01 65.312  2.18711e+00  4.75776e+00  0.00000e+00 0.00000e+00 1.05353e+02 65.312  2.50609e+01 65.312  0.8986 
1 1 1 -16 55  2  o 4  8.75802e+00 1.44499e+00 1.20132e+02 192.829 -1.25458e+01 -2.85713e+00 0.00000e+00 0.00000e+00 2.00404e+02 192.829 8.02725e+01 192.829 0.9603 
1 1 1 -16 55  3  o 6  8.39075e+00 1.45427e+00 1.81870e+02 338.187 1.74269e+01  -6.97492e+00 0.00000e+00 0.00000e+00 1.29028e+02 338.187 5.28416e+01 158.187 0.9730 
1 1 1 -16 55  4  f 0  4.42168e+00 1.33264e+00 5.77495e+01 251.079 -1.13035e+00 -3.29748e+00 0.00000e+00 0.00000e+00 8.36310e+01 251.079 2.58815e+01 251.079 0.8404 
1 1 1 -16 55  5  o 15 3.95269e+00 1.25255e+00 7.36159e+01 145.366 -3.61484e+00 2.49685e+00  0.00000e+00 0.00000e+00 5.81744e+01 145.366 1.54414e+01 325.366 0.8771 
1 1 1 -16 55  6  o 12 6.62054e+00 1.37522e+00 1.59737e+02 181.841 -1.52498e+01 -4.90049e-01 0.00000e+00 0.00000e+00 8.33008e+01 181.841 7.64364e+01 1.841   0.9667 
1 1 1 -16 55  7  o 18 5.68434e+00 1.52335e+00 6.07313e+01 355.415 4.47228e+00  -3.58671e-01 0.00000e+00 0.00000e+00 1.29022e+02 355.415 6.82907e+01 355.415 0.8799 
1 1 1 -16 55  8  o 19 5.89319e+00 1.60839e+00 6.02830e+01 55.665  2.50515e+00  3.66762e+00  0.00000e+00 0.00000e+00 1.35924e+02 55.665  7.56410e+01 55.665  0.8786 
1 1 1 -16 56  1  f 0  5.03260e+00 1.38133e+00 6.48388e+01 306.220 2.49270e+00  -3.40337e+00 0.00000e+00 0.00000e+00 1.02399e+02 306.220 3.75604e+01 306.220 0.8714 
1 1 1 -16 56  2  o 4  5.66907e+00 1.43124e+00 7.90935e+01 138.631 -4.20293e+00 3.70132e+00  0.00000e+00 0.00000e+00 1.16552e+02 138.631 3.74582e+01 138.631 0.9057 
1 1 1 -16 56  3  o 2  5.40386e+00 1.39450e+00 1.11891e+02 288.868 2.52982e+00  -7.40243e+00 0.00000e+00 0.00000e+00 8.02223e+01 288.868 3.16684e+01 108.868 0.9337 
1 1 1 -16 56  4  o 17 7.14672e+00 1.55041e+00 1.00622e+02 90.797  -1.18521e-01 8.51857e+00  0.00000e+00 0.00000e+00 1.54764e+02 90.797  5.41422e+01 90.797  0.9393 
1 1 1 -16 56  5  o 15 3.49265e+00 1.15640e+00 4.10162e+01 197.002 -2.24221e+00 -6.85584e-01 0.00000e+00 0.00000e+00 5.81449e+01 197.002 1.71287e+01 197.002 0.7470 
1 1 1 -16 56  6  o 11 4.26544e+00 1.32210e+00 6.84418e+01 79.884  7.38249e-01  4.13800e+00  0.00000e+00 0.00000e+00 7.26109e+01 79.884  4.16910e+00 79.884  0.8709 
1 1 1 -16 56  7  o 15 4.04994e+00 1.26362e+00 6.49399e+01 304.679 2.32862e+00  -3.36557e+00 0.00000e+00 0.00000e+00 6.82450e+01 304.679 3.30510e+00 304.679 0.8670 
1 1 1 -16 56  8  o 14 3.63978e+00 1.23231e+00 3.01962e+01 100.332 -3.53143e-01 1.93712e+00  0.00000e+00 0.00000e+00 6.53221e+01 100.332 3.51260e+01 100.332 0.6926 
1 1 1 -16 57  1  o 10 6.29651e+00 1.39377e+00 2.82014e+01 128.057 -1.41700e+00 1.80998e+00  0.00000e+00 0.00000e+00 1.49742e+02 128.057 1.21540e+02 128.057 0.7412 
1 1 1 -16 57  2  o 5  6.07479e+00 1.50615e+00 1.17108e+02 43.901  6.13902e+00  5.90796e+00  0.00000e+00 0.00000e+00 1.00301e+02 43.901  1.68068e+01 223.901 0.9393 
1 1 1 -16 57  3  o 11 5.56585e+00 1.44878e+00 1.14611e+02 212.222 -6.86903e+00 -4.32942e+00 0.00000e+00 0.00000e+00 8.37650e+01 212.222 3.08458e+01 32.222  0.9362 
1 1 1 -16 57  4  o 16 4.90430e+00 1.42590e+00 8.13132e+01 138.993 -4.00873e+00 3.48560e+00  0.00000e+00 0.00000e+00 8.66040e+01 138.993 5.29081e+00 138.993 0.9002 
1 1 1 -16 57  5  o 9  6.78841e+00 1.42107e+00 1.36709e+02 343.636 1.24216e+01  -3.64729e+00 0.00000e+00 0.00000e+00 1.11089e+02 343.636 2.56205e+01 163.636 0.9606 
1 1 1 -16 57  6  o 4  3.59312e+00 1.16692e+00 5.46655e+01 108.343 -1.05501e+00 3.18204e+00  0.00000e+00 0.00000e+00 5.89654e+01 108.343 4.29996e+00 108.343 0.8330 
1 1 1 -16 57  7  o 8  3.33074e+00 1.10913e+00 4.70990e+01 0.069   2.75770e+00  3.30281e-03  0.00000e+00 0.00000e+00 5.27356e+01 0.069   5.63656e+00 0.069   0.7903 
1 1 1 -16 57  8  o 3  4.69477e+00 1.46240e+00 2.46062e+01 15.034  1.68907e+00  4.53672e-01  0.00000e+00 0.00000e+00 9.13405e+01 15.034  6.67343e+01 15.034  0.6519 
1 1 1 -16 58  1  o 4  7.36715e+00 1.35073e+00 1.46081e+02 75.667  3.63298e+00  1.42181e+01  0.00000e+00 0.00000e+00 1.25023e+02 75.667  2.10573e+01 255.667 0.9653 
1 1 1 -16 58  2  o 8  7.05239e+00 1.51722e+00 1.58294e+02 255.380 -3.41685e+00 -1.30991e+01 0.00000e+00 0.00000e+00 1.00236e+02 255.380 5.80579e+01 75.380  0.9623 
1 1 1 -16 58  3  o 7  5.10314e+00 1.43094e+00 4.67074e+01 217.244 -2.51983e+00 -1.91571e+00 0.00000e+00 0.00000e+00 1.12864e+02 217.244 6.61562e+01 217.244 0.8215 
1 1 1 -16 58  4  o 2  3.15322e+00 1.06015e+00 2.74493e+01 79.338  2.80706e-01  1.49096e+00  0.00000e+00 0.00000e+00 4.45437e+01 79.338  1.70944e+01 79.338  0.6003 
1 1 1 -16 58  5  o 4  4.92793e+00 1.40439e+00 1.74522e+02 348.728 1.15016e+01  -2.29242e+00 0.00000e+00 0.00000e+00 4.54867e+00 348.728 1.69973e+02 168.728 0.9564 
1 1 1 -16 58  6  o 12 4.44185e+00 1.34610e+00 5.23214e+01 109.329 -1.13728e+00 3.24220e+00  0.00000e+00 0.00000e+00 8.89166e+01 109.329 3.65952e+01 109.329 0.8377 
1 1 1 -16 58  7  o 17 5.19906e+00 1.35110e+00 7.74168e+01 0.407   6.14612e+00  4.36609e-02  0.00000e+00 0.00000e+00 1.02885e+02 0.407   2.54680e+01 0.407   0.9146 
1 1 1 -16 58  8  o 5  7.79391e+00 1.52315e+00 1.60321e+02 149.105 -1.54541e+01 9.24708e+00  0.00000e+00 0.00000e+00 1.26573e+02 149.105 3.37480e+01 329.105 0.9718 
1 1 1 -16 59  1  o 14 9.74078e+00 1.36527e+00 1.33332e+02 219.072 -1.40412e+01 -1.13997e+01 0.00000e+00 0.00000e+00 2.27530e+02 219.072 9.41981e+01 219.072 0.9719 
1 1 1 -16 59  2  o 10 6.03829e+00 1.32741e+00 9.90856e+01 99.783  -1.45441e+00 8.43521e+00  0.00000e+00 0.00000e+00 1.17015e+02 99.783  1.79290e+01 99.783  0.9396 
1 1 1 -16 59  3  f 0  4.50497e+00 1.35193e+00 7.88276e+01 79.405  9.12299e-01  4.87706e+00  0.00000e+00 0.00000e+00 7.41863e+01 79.405  4.64129e+00 259.405 0.8925 
1 1 1 -16 59  4  o 15 4.28970e+00 1.27611e+00 4.81458e+01 98.274  -4.62430e-01 3.17981e+00  0.00000e+00 0.00000e+00 8.63569e+01 98.274  3.82111e+01 98.274  0.8246 
1 1 1 -16 59  5  o 12 5.73907e+00 1.31520e+00 7.44494e+01 124.386 -3.68242e+00 5.38085e+00  0.00000e+00 0.00000e+00 1.26080e+02 124.386 5.16301e+01 124.386 0.9198 
1 1 1 -16 59  6  o 16 6.98505e+00 1.57922e+00 1.15685e+02 90.707  -1.22727e-01 9.93984e+00  0.00000e+00 0.00000e+00 1.35704e+02 90.707  2.00188e+01 90.707  0.9483 
1 1 1 -16 59  7  o 3  3.71182e+00 1.19952e+00 3.38007e+01 126.908 -1.35980e+00 1.81059e+00  0.00000e+00 0.00000e+00 6.98780e+01 126.908 3.60773e+01 126.908 0.7367 
1 1 1 -16 59  8  o 12 4.29572e+00 1.31713e+00 6.66454e+01 283.799 1.16176e+00  -4.73025e+00 0.00000e+00 0.00000e+00 7.81912e+01 283.799 1.15458e+01 283.799 0.8903 
1 1 1 -16 60  1  o 2  4.36909e+00 1.31889e+00 5.36970e+01 337.354 3.09776e+00  -1.29240e+00 0.00000e+00 0.00000e+00 8.50410e+01 337.354 3.13440e+01 337.354 0.8332 
1 1 1 -16 60  2  o 5  6.30014e+00 1.51405e+00 1.17084e+02 124.352 -5.25068e+00 7.68209e+00  0.00000e+00 0.00000e+00 1.09550e+02 124.352 7.53438e+00 304.352 0.9446 
1 1 1 -16 60  3  o 6  5.24852e+00 1.32072e+00 1.31379e+02 203.618 -9.50927e+00 -4.15816e+00 0.00000e+00 0.00000e+00 5.84532e+01 203.618 7.29255e+01 23.619  0.9505 
1 1 1 -16 60  4  o 19 3.43946e+00 1.12821e+00 1.34322e+01 346.164 7.46858e-01  -1.83944e-01 0.00000e+00 0.00000e+00 3.34713e+01 346.164 2.00391e+01 346.164 0.3587 
1 1 1 -16 60  5  o 17 1.06167e+01 1.37793e+00 1.85296e+02 247.756 -1.07550e+01 -2.62966e+01 0.00000e+00 0.00000e+00 2.10801e+02 247.756 2.55049e+01 247.756 0.9822 
1 1 1 -16 60  6  o 9  7.55852e+00 1.53014e+00 1.10287e+02 270.364 6.78409e-02  -1.06905e+01 0.00000e+00 0.00000e+00 1.62767e+02 270.364 5.24793e+01 270.364 0.9520 
1 1 1 -16 60  7  o 13 3.41705e+00 1.14393e+00 3.09300e+01 111.510 -7.46797e-01 1.89484e+00  0.00000e+00 0.00000e+00 6.02206e+01 111.510 2.92906e+01 111.510 0.7037 
1 1 1 -16 61  1  o 16 4.18434e+00 1.28970e+00 3.02537e+01 343.802 1.87300e+00  -5.44076e-01 0.00000e+00 0.00000e+00 7.96718e+01 343.802 4.94181e+01 343.802 0.6895 
1 1 1 -16 61  2  o 11 3.72891e+00 1.20987e+00 5.77437e+01 134.548 -2.47068e+00 2.50997e+00  0.00000e+00 0.00000e+00 6.18366e+01 134.548 4.09288e+00 134.548 0.8422 
1 1 1 -16 61  3  f 0  4.02136e+00 1.25485e+00 6.14550e+01 64.854  1.59699e+00  3.40204e+00  0.00000e+00 0.00000e+00 6.91288e+01 64.854  7.67375e+00 64.854  0.8535 
1 1 1 -16 61  4  o 16 3.71926e+00 1.19691e+00 9.16896e+01 298.936 2.75417e+00  -4.98179e+00 0.00000e+00 0.00000e+00 3.65813e+01 298.936 5.51083e+01 118.936 0.9073 
1 1 1 -16 61  5  o 13 6.10847e+00 1.55442e+00 1.14115e+02 207.204 -7.86115e+00 -4.04070e+00 0.00000e+00 0.00000e+00 1.04321e+02 207.204 9.79416e+00 27.204  0.9416 
1 1 1 -16 61  6  o 1  1.04758e+01 1.36855e+00 1.63579e+02 71.110  8.35467e+00  2.44160e+01  0.00000e+00 0.00000e+00 2.26093e+02 71.110  6.25139e+01 71.110  0.9804 
1 1 1 -16 61  7  o 6  6.12889e+00 1.40556e+00 1.20261e+02 343.316 1.12381e+01  -3.36821e+00 0.00000e+00 0.00000e+00 1.01894e+02 343.316 1.83664e+01 163.316 0.9564 
1 1 1 -16 62  1  o 12 7.17677e+00 1.45634e+00 1.19964e+02 246.354 -4.53363e+00 -1.03544e+01 0.00000e+00 0.00000e+00 1.41058e+02 246.354 2.10945e+01 246.354 0.9547 
1 1 1 -16 62  2  o 4  4.07961e+00 1.28922e+00 1.00870e+02 315.416 4.34444e+00  -4.28183e+00 0.00000e+00 0.00000e+00 4.10612e+01 315.416 5.98086e+01 135.416 0.9139 
1 1 1 -16 62  3  o 7  9.20214e+00 1.35963e+00 1.72442e+02 259.035 -4.45267e+00 -2.29818e+01 0.00000e+00 0.00000e+00 1.70032e+02 259.035 2.40922e+00 79.035  0.9784 
1 1 1 -16 62  4  o 19 1.04334e+01 1.35239e+00 1.47522e+02 184.928 -2.25679e+01 -1.94593e+00 0.00000e+00 0.00000e+00 2.40154e+02 184.928 9.26320e+01 184.928 0.9777 
1 1 1 -16 62  5  o 8  4.07019e+00 1.25882e+00 1.92609e+01 129.087 -7.77576e-01 9.57240e-01  0.00000e+00 0.00000e+00 6.15620e+01 129.087 4.23011e+01 129.087 0.5230 
1 1 1 -16 62  6  o 1  5.54327e+00 1.44199e+00 4.68260e+01 25.680  3.46189e+00  1.66457e+00  0.00000e+00 0.00000e+00 1.33407e+02 25.680  8.65814e+01 25.680  0.8571 
1 1 1 -16 62  7  o 17 4.04198e+00 1.27950e+00 4.20031e+01 352.624 2.79806e+00  -3.62230e-01 0.00000e+00 0.00000e+00 7.98966e+01 352.624 3.78935e+01 352.624 0.7959 
1 1 1 -16 63  1  o 12 6.09248e+00 1.48301e+00 6.45821e+01 283.988 1.27697e+00  -5.12606e+00 0.00000e+00 0.00000e+00 1.44171e+02 283.988 7.95890e+01 283.988 0.8996 
1 1 1 -16 63  2  o 3  6.90117e+00 1.53866e+00 9.63577e+01 97.679  -1.14360e+00 8.48153e+00  0.00000e+00 0.00000e+00 1.50456e+02 97.679  5.40979e+01 97.679  0.9396 
1 1 1 -16 63  3  o 5  4.64114e+00 1.36858e+00 7.45509e+01 214.120 -4.16581e+00 -2.82261e+00 0.00000e+00 0.00000e+00 8.32709e+01 214.120 8.72008e+00 214.120 0.8941 
1 1 1 -16 63  4  o 9  3.53592e+00 1.15667e+00 4.95027e+01 55.599  1.66672e+00  2.43409e+00  0.00000e+00 0.00000e+00 5.88229e+01 55.599  9.32012e+00 55.599  0.8062 
1 1 1 -16 63  5  o 2  4.12650e+00 1.28477e+00 2.56975e+01 320.242 1.30969e+00  -1.08957e+00 0.00000e+00 0.00000e+00 7.49714e+01 320.242 4.92739e+01 320.242 0.6426 
1 1 1 -16 63  6  o 6  3.82663e+00 1.21872e+00 4.71338e+01 217.868 -2.65367e+00 -2.06343e+00 0.00000e+00 0.00000e+00 7.38384e+01 217.868 2.67047e+01 217.868 0.8335 
1 1 1 -16 63  7  o 17 3.39215e+00 1.11378e+00 2.24649e+01 109.737 -5.16120e-01 1.43850e+00  0.00000e+00 0.00000e+00 5.50389e+01 109.737 3.25739e+01 109.737 0.6030 
1 1 1 -16 64  1  o 7  3.41150e+00 1.12848e+00 5.10375e+01 80.348  5.08935e-01  2.99242e+00  0.00000e+00 0.00000e+00 5.45329e+01 80.348  3.49536e+00 80.348  0.8126 
1 1 1 -16 64  2  o 19 9.42398e+00 1.40495e+00 1.91815e+02 177.234 -2.55305e+01 1.23342e+00  0.00000e+00 0.00000e+00 1.59732e+02 177.234 3.20832e+01 357.234 0.9802 
1 1 1 -16 64  3  o 4  4.17294e+00 1.27813e+00 5.21722e+01 226.432 -2.31130e+00 -2.42982e+00 0.00000e+00 0.00000e+00 8.00165e+01 226.432 2.78443e+01 226.432 0.8331 
1 1 1 -16 64  4  o 18 7.01104e+00 1.54516e+00 1.29140e+02 48.842  7.55547e+00  8.64322e+00  0.00000e+00 0.00000e+00 1.25348e+02 48.842  3.79188e+00 228.842 0.9554 
1 1 1 -16 64  5  o 1  7.83629e+00 1.45799e+00 9.91121e+01 251.568 -3.58812e+00 -1.07665e+01 0.00000e+00 0.00000e+00 1.84911e+02 251.568 8.57989e+01 251.568 0.9549 
1 1 1 -16 64  6  o 1  3.77601e+00 1.19519e+00 7.79356e+01 232.738 -3.39476e+00 -4.46240e+00 0.00000e+00 0.00000e+00 5.17616e+01 232.738 2.61740e+01 52.738  0.9058 
1 1 1 -16 65  1  o 6  8.88510e+00 1.36787e+00 1.44492e+02 158.961 -1.72517e+01 6.63570e+00  0.00000e+00 0.00000e+00 1.84541e+02 158.961 4.00496e+01 158.961 0.9726 
1 1 1 -16 65  2  o 9  6.09681e+00 1.42902e+00 9.18656e+01 358.416 7.69692e+00  -2.12803e-01 0.00000e+00 0.00000e+00 1.24476e+02 358.416 3.26103e+01 358.416 0.9326 
1 1 1 -16 65  3  o 1  5.91438e+00 1.47899e+00 9.93779e+01 49.173  5.12071e+00  5.92678e+00  0.00000e+00 0.00000e+00 1.10590e+02 49.173  1.12125e+01 49.173  0.9338 
1 1 1 -16 65  4  o 6  3.84609e+00 1.23609e+00 6.17043e+01 252.170 -1.21377e+00 -3.77361e+00 0.00000e+00 0.00000e+00 6.42494e+01 252.170 2.54506e+00 252.170 0.8621 
1 1 1 -16 65  5  o 12 3.37766e+00 1.11820e+00 7.59669e+01 148.305 -4.29857e+00 2.65437e+00  0.00000e+00 0.00000e+00 3.87046e+01 148.305 3.72623e+01 328.305 0.8946 
1 1 1 -16 65  6  o 4  6.57732e+00 1.45689e+00 1.34857e+02 137.828 -9.94072e+00 9.00480e+00  0.00000e+00 0.00000e+00 1.05030e+02 137.828 2.98269e+01 317.828 0.9620 
1 1 1 -16 66  1  o 7  6.80704e+00 1.53166e+00 1.45109e+02 288.747 4.06507e+00  -1.19772e+01 0.00000e+00 0.00000e+00 1.03570e+02 288.747 4.15390e+01 108.747 0.9596 
1 1 1 -16 66  2  o 6  3.12359e+00 1.06268e+00 3.41075e+01 144.844 -1.66688e+00 1.17394e+00  0.00000e+00 0.00000e+00 4.95520e+01 144.844 1.54445e+01 144.844 0.7040 
1 1 1 -16 66  3  o 2  4.14241e+00 1.27497e+00 6.75841e+01 138.621 -3.40470e+00 2.99940e+00  0.00000e+00 0.00000e+00 7.12042e+01 138.621 3.62006e+00 138.621 0.8814 
1 1 1 -16 66  4  o 3  4.65785e+00 1.33952e+00 4.26110e+01 355.922 3.18333e+00  -2.26930e-01 0.00000e+00 0.00000e+00 1.03013e+02 355.922 6.04017e+01 355.922 0.8232 
1 1 1 -16 66  5  o 16 3.07910e+00 1.02420e+00 1.59071e+01 73.311  3.10691e-01  1.03633e+00  0.00000e+00 0.00000e+00 3.95490e+01 73.311  2.36419e+01 73.311  0.4747 
1 1 1 -16 66  6  o 6  3.52535e+00 1.13769e+00 7.50626e+01 206.579 -4.64695e+00 -2.32490e+00 0.00000e+00 0.00000e+00 4.49066e+01 206.579 3.01560e+01 26.579  0.8977 
1 1 1 -16 67  1  o 14 5.15986e+00 1.41052e+00 7.62473e+01 312.679 3.88494e+00  -4.21309e+00 0.00000e+00 0.00000e+00 1.02077e+02 312.679 2.58292e+01 312.679 0.9080 
1 1 1 -16 67  2  o 14 3.51914e+00 1.15405e+00 4.98240e+01 321.888 2.45632e+00  -1.92683e+00 0.00000e+00 0.00000e+00 5.97471e+01 321.888 9.92303e+00 321.888 0.8186 
1 1 1 -16 67  3  o 12 4.38148e+00 1.30368e+00 5.96491e+01 340.928 4.09100e+00  -1.41438e+00 0.00000e+00 0.00000e+00 8.60642e+01 340.928 2.64152e+01 340.928 0.8751 
1 1 1 -16 67  4  o 19 4.34590e+00 1.29648e+00 7.20392e+01 304.995 3.12836e+00  -4.46857e+00 0.00000e+00 0.00000e+00 7.69699e+01 304.995 4.93072e+00 304.995 0.9030 
1 1 1 -16 67  5  o 3  4.21273e+00 1.24708e+00 5.10806e+01 56.696  2.01463e+00  3.06652e+00  0.00000e+00 0.00000e+00 8.46811e+01 56.696  3.36006e+01 56.696  0.8495 
1 1 1 -16 67  6  o 5  3.36615e+00 1.10713e+00 7.33077e+01 18.593  4.67257e+00  1.57182e+00  0.00000e+00 0.00000e+00 4.04566e+01 18.593  3.28511e+01 198.593 0.8917 
1 1 1 -16 68  1  o 6  4.98198e+00 1.41847e+00 8.38765e+01 64.265  2.73466e+00  5.67339e+00  0.00000e+00 0.00000e+00 8.99347e+01 64.265  6.05818e+00 64.265  0.9168 
1 1 1 -16 68  2  o 6  2.99157e+00 1.02108e+00 6.64539e+01 111.979 -1.59053e+00 3.94091e+00  0.00000e+00 0.00000e+00 3.28025e+01 111.979 3.36514e+01 291.979 0.8725 
1 1 1 -16 68  3  o 13 4.28143e+00 1.29461e+00 5.26624e+01 273.966 2.72204e-01  -3.92599e+00 0.00000e+00 0.00000e+00 8.74073e+01 273.966 3.47448e+01 273.966 0.8610 
1 1 1 -16 68  4  o 6  3.87944e+00 1.21912e+00 1.56322e+01 321.649 8.30684e-01  -6.57234e-01 0.00000e+00 0.00000e+00 5.31472e+01 321.649 3.75150e+01 321.649 0.4670 
1 1 1 -16 68  5  o 6  3.28206e+00 1.08718e+00 2.88386e+01 35.511  1.57933e+00  1.12699e+00  0.00000e+00 0.00000e+00 5.67730e+01 35.511  2.79344e+01 35.511  0.6877 
1 1 1 -16 68  6  o 6  3.53500e+00 1.14647e+00 7.62577e+01 75.222  1.35201e+00  5.12498e+00  0.00000e+00 0.00000e+00 4.42868e+01 75.222  3.19709e+01 255.222 0.8999 
1 1 1 -16 69  1  o 5  6.96090e+00 1.53779e+00 1.11357e+02 238.327 -5.77923e+00 -9.36724e+00 0.00000e+00 0.00000e+00 1.41163e+02 238.327 2.98061e+01 238.327 0.9534 
1 1 1 -16 69  2  o 12 7.51276e+00 1.48739e+00 6.62844e+01 358.435 7.37098e+00  -2.01373e-01 0.00000e+00 0.00000e+00 1.99214e+02 358.435 1.32930e+02 358.435 0.9295 
1 1 1 -16 69  3  o 2  4.74931e+00 1.34933e+00 5.05186e+01 193.117 -3.89732e+00 -9.08171e-01 0.00000e+00 0.00000e+00 1.05298e+02 193.117 5.47792e+01 193.117 0.8636 
1 1 1 -16 69  4  o 5  8.29998e+00 1.39436e+00 1.12989e+02 292.325 5.67268e+00  -1.38140e+01 0.00000e+00 0.00000e+00 1.91322e+02 292.325 7.83329e+01 292.325 0.9659 
1 1 1 -16 69  5  o 1  4.01972e+00 1.23286e+00 7.22287e+01 112.082 -1.96219e+00 4.83673e+00  0.00000e+00 0.00000e+00 6.46986e+01 112.082 7.53006e+00 292.082 0.8982 
1 1 1 -16 69  6  o 2  4.61276e+00 1.34140e+00 7.50998e+01 54.956  3.64677e+00  5.19968e+00  0.00000e+00 0.00000e+00 8.52390e+01 54.956  1.01392e+01 54.956  0.9175 
1 1 1 -16 70  1  o 13 4.39390e+00 1.33722e+00 3.97877e+01 350.058 2.73307e+00  -4.79049e-01 0.00000e+00 0.00000e+00 9.25702e+01 350.058 5.27826e+01 350.058 0.7918 
1 1 1 -16 70  2  o 2  7.91763e+00 1.46011e+00 1.55072e+02 248.511 -6.46556e+00 -1.64234e+01 0.00000e+00 0.00000e+00 1.37251e+02 248.511 1.78204e+01 68.511  0.9712 
1 1 1 -16 70  3  o 10 3.69122e+00 1.16704e+00 4.97143e+01 36.469  2.85233e+00  2.10825e+00  0.00000e+00 0.00000e+00 6.85506e+01 36.469  1.88362e+01 36.469  0.8435 
1 1 1 -16 70  4  o 9  3.22256e+00 1.06275e+00 3.95346e+01 99.791  -4.63909e-01 2.68827e+00  0.00000e+00 0.00000e+00 5.67972e+01 99.791  1.72627e+01 99.791  0.7877 
1 1 1 -16 70  5  o 4  7.57601e+00 1.46310e+00 1.05560e+02 137.743 -8.89806e+00 8.08444e+00  0.00000e+00 0.00000e+00 1.69471e+02 137.743 6.39111e+01 137.743 0.9575 
1 1 1 -16 71  1  o 5  5.33561e+00 1.39746e+00 1.00390e+02 213.863 -7.06015e+00 -4.73770e+00 0.00000e+00 0.00000e+00 9.02096e+01 213.863 1.01800e+01 33.863  0.9392 
1 1 1 -16 71  2  o 15 5.28106e+00 1.38439e+00 9.24623e+01 294.898 3.27895e+00  -7.06448e+00 0.00000e+00 0.00000e+00 9.48832e+01 294.898 2.42095e+00 294.898 0.9334 
1 1 1 -16 71  3  o 5  5.15965e+00 1.38563e+00 1.08051e+02 67.018  3.52803e+00  8.31871e+00  0.00000e+00 0.00000e+00 7.67082e+01 67.018  3.13429e+01 247.018 0.9429 
1 1 1 -16 71  4  o 19 4.73454e+00 1.32255e+00 6.58723e+01 147.653 -4.38837e+00 2.77928e+00  0.00000e+00 0.00000e+00 9.53951e+01 147.653 2.95228e+01 147.653 0.8977 
1 1 1 -16 71  5  o 12 3.11088e+00 1.04068e+00 5.01123e+01 328.188 3.23301e+00  -2.00547e+00 0.00000e+00 0.00000e+00 5.07828e+01 328.188 6.70496e-01 328.188 0.8556 
1 1 1 -16 72  1  o 2  3.71961e+00 1.19580e+00 5.16151e+01 131.725 -2.43728e+00 2.73314e+00  0.00000e+00 0.00000e+00 6.84912e+01 131.725 1.68760e+01 131.725 0.8491 
1 1 1 -16 72  2  f 0  3.51218e+00 1.12872e+00 2.86726e+01 126.708 -1.21634e+00 1.63135e+00  0.00000e+00 0.00000e+00 6.52048e+01 126.708 3.65322e+01 126.708 0.7034 
1 1 1 -16 72  3  o 9  3.81641e+00 1.13250e+00 5.66678e+01 26.485  3.78231e+00  1.88454e+00  0.00000e+00 0.00000e+00 6.96406e+01 26.485  1.29728e+01 26.485  0.8717 
1 1 1 -16 72  4  f 0  5.83614e+00 1.42521e+00 6.37203e+01 300.164 2.95164e+00  -5.07883e+00 0.00000e+00 0.00000e+00 1.37832e+02 300.164 7.41120e+01 300.164 0.9104 
1 1 1 -16 72  5  o 14 7.64742e+00 1.40400e+00 9.84595e+01 136.688 -9.05559e+00 8.53716e+00  0.00000e+00 0.00000e+00 1.79485e+02 136.688 8.10255e+01 136.688 0.9589 
1 1 1 -16 73  1  o 13 4.30489e+00 1.30225e+00 7.68156e+01 243.570 -2.53530e+00 -5.10055e+00 0.00000e+00 0.00000e+00 7.16903e+01 243.570 5.12523e+00 63.570  0.9074 
1 1 1 -16 73  2  o 11 4.17640e+00 1.27344e+00 9.19307e+01 100.662 -1.25352e+00 6.65852e+00  0.00000e+00 0.00000e+00 5.45081e+01 100.662 3.74226e+01 280.662 0.9229 
1 1 1 -16 73  3  o 7  3.79689e+00 1.15192e+00 6.15128e+01 76.207  1.11495e+00  4.54175e+00  0.00000e+00 0.00000e+00 6.60885e+01 76.207  4.57574e+00 76.207  0.8853 
1 1 1 -16 73  4  f 0  3.92089e+00 1.21545e+00 5.68750e+01 287.189 1.33239e+00  -4.30702e+00 0.00000e+00 0.00000e+00 7.40782e+01 287.189 1.72032e+01 287.189 0.8806 
1 1 1 -16 73  5  o 17 3.87116e+00 1.21330e+00 8.08706e+00 175.005 -6.20239e-01 5.42076e-02  0.00000e+00 0.00000e+00 3.54997e+01 175.005 2.74126e+01 175.005 0.2971 
1 1 1 -16 74  1  o 2  2.62798e+00 9.15172e-01 5.50717e+01 246.808 -1.40134e+00 -3.27079e+00 0.00000e+00 0.00000e+00 2.92480e+01 246.808 2.58237e+01 66.808  0.8441 
1 1 1 -16 74  2  o 16 9.39504e+00 1.38688e+00 1.69019e+02 166.504 -2.71247e+01 6.51004e+00  0.00000e+00 0.00000e+00 1.81382e+02 166.504 1.23625e+01 166.504 0.9819 
1 1 1 -16 74  3  f 0  3.17264e+00 1.04737e+00 7.31978e+01 350.945 5.42850e+00  -8.65136e-01 0.00000e+00 0.00000e+00 3.56258e+01 350.945 3.75720e+01 170.945 0.9038 
1 1 1 -16 74  4  o 17 3.21517e+00 1.05844e+00 5.55874e+01 47.736  2.75868e+00  3.03562e+00  0.00000e+00 0.00000e+00 5.01585e+01 47.736  5.42890e+00 227.736 0.8673 
1 1 1 -16 74  5  o 5  4.34645e+00 1.24789e+00 6.16250e+01 263.959 -5.64512e-01 -5.33417e+00 0.00000e+00 0.00000e+00 8.67731e+01 263.959 2.51481e+01 263.959 0.9012 
1 1 1 -16 75  1  o 3  4.36027e+00 1.32241e+00 8.62595e+01 59.966  3.44418e+00  5.95743e+00  0.00000e+00 0.00000e+00 6.68838e+01 59.966  1.93758e+01 239.966 0.9242 
1 1 1 -16 75  2  o 5  4.36654e+00 1.24965e+00 5.35858e+01 16.744  4.24833e+00  1.27814e+00  0.00000e+00 0.00000e+00 9.20784e+01 16.744  3.84926e+01 16.744  0.8784 
1 1 1 -16 75  3  o 2  3.25024e+00 1.06882e+00 3.35214e+01 1.808   2.47567e+00  7.81506e-02  0.00000e+00 0.00000e+00 6.05145e+01 1.808   2.69931e+01 1.808   0.7625 
1 1 1 -16 75  4  o 10 5.49129e+00 1.38915e+00 1.02820e+02 322.116 7.94430e+00  -6.18098e+00 0.00000e+00 0.00000e+00 9.47421e+01 322.116 8.07745e+00 142.116 0.9489 
1 1 1 -16 75  5  o 7  3.31750e+00 1.08707e+00 4.06796e+01 230.953 -1.94538e+00 -2.39836e+00 0.00000e+00 0.00000e+00 6.18966e+01 230.953 2.12171e+01 230.953 0.8163 
1 1 1 -16 76  1  o 2  3.82354e+00 1.22592e+00 7.05839e+01 71.301  1.70119e+00  5.02618e+00  0.00000e+00 0.00000e+00 6.01717e+01 71.301  1.04122e+01 251.301 0.9000 
1 1 1 -16 76  2  o 1  5.98587e+00 1.41674e+00 1.15880e+02 173.994 -1.14125e+01 1.20069e+00  0.00000e+00 0.00000e+00 1.01251e+02 173.994 1.46293e+01 353.994 0.9554 
1 1 1 -16 76  3  o 17 3.97225e+00 1.21721e+00 7.53371e+01 19.556  5.92386e+00  2.10423e+00  0.00000e+00 0.00000e+00 6.27913e+01 19.556  1.25458e+01 199.556 0.9166 
1 1 1 -16 76  4  o 14 3.14467e+00 1.05166e+00 5.66658e+01 207.262 -4.02042e+00 -2.07176e+00 0.00000e+00 0.00000e+00 4.83482e+01 207.262 8.31762e+00 27.262  0.8810 
1 1 1 -16 76  5  o 16 3.99126e+00 1.18346e+00 2.74686e+01 144.352 -1.93331e+00 1.38656e+00  0.00000e+00 0.00000e+00 8.60726e+01 144.352 5.86041e+01 144.352 0.7512 
1 1 1 -16 77  1  o 2  4.52134e+00 1.33989e+00 5.95365e+01 307.672 3.02059e+00  -3.91212e+00 0.00000e+00 0.00000e+00 9.36759e+01 307.672 3.41394e+01 307.672 0.8920 
1 1 1 -16 77  2  o 14 3.04128e+00 1.02971e+00 3.58195e+01 97.747  -3.62386e-01 2.66396e+00  0.00000e+00 0.00000e+00 5.46948e+01 97.747  1.88752e+01 97.747  0.7840 
1 1 1 -16 77  3  o 1  4.06901e+00 1.23978e+00 6.86383e+01 280.152 1.03475e+00  -5.77840e+00 0.00000e+00 0.00000e+00 7.18534e+01 280.152 3.21507e+00 280.152 0.9103 
1 1 1 -16 77  4  o 12 2.90067e+00 9.81409e-01 1.32068e+01 83.698  1.15400e-01  1.04501e+00  0.00000e+00 0.00000e+00 3.78314e+01 83.698  2.46246e+01 83.698  0.4643 
1 1 1 -16 78  1  o 7  5.25865e+00 1.33474e+00 7.33842e+01 281.539 1.40152e+00  -6.86486e+00 0.00000e+00 0.00000e+00 1.11480e+02 281.539 3.80957e+01 281.539 0.9256 
1 1 1 -16 78  2  o 3  3.76195e+00 1.18747e+00 7.50630e+01 91.741  -1.78635e-01 5.87544e+00  0.00000e+00 0.00000e+00 5.49210e+01 91.741  2.01420e+01 271.741 0.9104 
1 1 1 -16 78  3  o 1  3.84505e+00 1.20808e+00 5.81139e+01 128.946 -3.06347e+00 3.79035e+00  0.00000e+00 0.00000e+00 7.17107e+01 128.946 1.35969e+01 128.946 0.8904 
1 1 1 -16 78  4  o 4  3.17248e+00 1.06115e+00 5.32904e+01 101.183 -8.09116e-01 4.09260e+00  0.00000e+00 0.00000e+00 5.12637e+01 101.183 2.02673e+00 281.183 0.8698 
1 1 1 -16 79  1  o 10 3.51899e+00 1.14906e+00 6.53504e+01 140.197 -3.96419e+00 3.30321e+00  0.00000e+00 0.00000e+00 5.45039e+01 140.197 1.08465e+01 320.197 0.8970 
1 1 1 -16 79  2  o 19 3.09597e+00 1.04401e+00 5.01561e+01 342.665 3.68652e+00  -1.15067e+00 0.00000e+00 0.00000e+00 5.06349e+01 342.665 4.78768e-01 342.665 0.8580 
1 1 1 -16 79  3  o 2  5.67058e+00 1.39309e+00 1.02189e+02 210.044 -8.96174e+00 -5.18315e+00 0.00000e+00 0.00000e+00 1.02139e+02 210.044 4.98329e-02 30.044  0.9504 
1 1 1 -16 79  4  o 14 3.13692e+00 1.04310e+00 7.34727e+01 339.995 5.58584e+00  -2.03365e+00 0.00000e+00 0.00000e+00 3.48388e+01 339.995 3.86338e+01 159.995 0.9115 
1 1 1 -16 80  1  o 14 4.69136e+00 1.30937e+00 1.01589e+02 264.998 -8.03223e-01 -9.17728e+00 0.00000e+00 0.00000e+00 6.65477e+01 264.998 3.50409e+01 84.998  0.9441 
1 1 1 -16 80  2  o 2  2.87116e+00 9.83916e-01 5.25900e+01 81.942  6.04116e-01  4.26698e+00  0.00000e+00 0.00000e+00 4.26541e+01 81.942  9.93585e+00 261.942 0.8745 
1 1 1 -16 80  3  f 0  4.20394e+00 1.25023e+00 7.81535e+01 61.057  3.32771e+00  6.01740e+00  0.00000e+00 0.00000e+00 6.91065e+01 61.057  9.04694e+00 241.057 0.9241 
1 1 1 -16 81  2  o 10 2.89560e+00 9.82632e-01 5.58653e+01 170.602 -4.66046e+00 7.71397e-01  0.00000e+00 0.00000e+00 4.14980e+01 170.602 1.43673e+01 350.602 0.8866 
1 1 1 -16 81  3  o 1  2.91352e+00 9.85357e-01 5.69067e+01 113.088 -1.73941e+00 4.08040e+00  0.00000e+00 0.00000e+00 4.00812e+01 113.088 1.68255e+01 293.088 0.8784 
1 1 1 -15 0   1  o 19 1.29404e+01 2.07320e+00 2.05527e+02 0.000   9.82874e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.88901e+02 0.000   8.33736e+01 0.000   1.0000 
1 1 1 -15 0   2  o 18 6.25314e+00 3.49179e+00 2.37445e+02 180.000 -3.52189e+00 -0.00000e+00 0.00000e+00 0.00000e+00 8.92699e-01 180.000 2.36552e+02 0.000   0.9983 
1 1 1 -15 0   3  f 0  6.34319e+00 3.37043e+00 1.15003e+02 0.000   1.87581e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.15902e+02 0.000   8.98855e-01 0.000   0.9541 
1 1 1 -15 0   4  o 11 1.74348e+01 2.55936e+00 2.85944e+02 0.000   1.72308e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.78693e+02 0.000   9.27494e+01 0.000   1.0000 
1 1 1 -15 0   5  o 4  1.39260e+01 2.41663e+00 3.45763e+02 180.000 -1.69270e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.84646e+02 180.000 1.61116e+02 0.000   1.0000 
1 1 1 -15 0   6  o 3  4.26574e+00 2.73178e+00 2.32203e+02 0.000   3.48894e+00  0.00000e+00  0.00000e+00 0.00000e+00 7.01857e+01 180.000 3.02389e+02 180.000 0.9981 
1 1 1 -15 0   7  o 4  5.96521e+00 3.24206e+00 1.03339e+02 180.000 -1.86503e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.12796e+02 180.000 9.45722e+00 180.000 0.9531 
1 1 1 -15 0   8  o 4  3.47804e+00 2.35082e+00 4.50034e+01 180.000 -6.68751e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.21483e+01 180.000 1.28552e+01 0.000   0.5842 
1 1 1 -15 0   9  o 5  3.05351e+00 2.05222e+00 5.88939e-01 0.000   9.57356e-03  0.00000e+00  0.00000e+00 0.00000e+00 5.19856e-01 0.000   6.90832e-02 180.000 0.0096 
1 1 1 -15 0   10 o 4  3.67178e+00 2.32203e+00 6.47093e+01 180.000 -1.11096e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.71899e+01 180.000 1.75194e+01 0.000   0.8044 
1 1 1 -15 0   11 o 5  4.65783e+00 2.68109e+00 1.91379e+01 180.000 -3.93176e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.67951e+01 180.000 2.76572e+01 180.000 0.3741 
1 1 1 -15 0   12 f 0  5.81006e+00 2.86733e+00 2.25304e+02 180.000 -5.39844e+00 -0.00000e+00 0.00000e+00 0.00000e+00 5.75497e+00 0.000   2.31059e+02 0.000   1.0000 
1 1 1 -15 0   13 o 13 4.07657e+00 2.51819e+00 5.94561e+01 180.000 -1.25092e+00 0.00000e+00  0.00000e+00 0.00000e+00 7.10838e+01 180.000 1.16278e+01 180.000 0.8485 
1 1 1 -15 1   1  o 2  1.02497e+01 1.86021e+00 1.63777e+02 188.011 -1.03664e+01 -1.45885e+00 0.00000e+00 0.00000e+00 2.08639e+02 188.011 4.48619e+01 188.011 0.9510 
1 1 1 -15 1   2  o 17 1.43217e+01 2.04035e+00 3.29753e+02 312.912 1.84919e+01  -1.98914e+01 0.00000e+00 0.00000e+00 2.06907e+02 312.912 1.22846e+02 132.912 0.9814 
1 1 1 -15 1   3  o 2  1.03382e+01 2.19263e+00 2.84853e+02 107.193 -4.89541e+00 1.58218e+01  0.00000e+00 0.00000e+00 9.74743e+01 107.193 1.87379e+02 287.193 0.9693 
1 1 1 -15 1   4  o 3  7.23224e+00 2.07596e+00 2.75334e+02 226.530 -8.33380e+00 -8.79126e+00 0.00000e+00 0.00000e+00 1.12687e+01 46.530  2.86602e+02 46.530  0.9578 
1 1 1 -15 1   5  o 4  9.54854e+00 1.75648e+00 2.03229e+02 289.950 4.55442e+00  -1.25470e+01 0.00000e+00 0.00000e+00 1.46553e+02 289.950 5.66755e+01 109.950 0.9618 
1 1 1 -15 1   6  o 8  4.69968e+00 1.50903e+00 4.18837e+01 119.385 -8.45115e-01 1.50073e+00  0.00000e+00 0.00000e+00 7.37289e+01 119.385 3.18452e+01 119.385 0.6465 
1 1 1 -15 1   7  o 3  1.24262e+01 1.89868e+00 2.21968e+02 82.782  2.58847e+00  2.04370e+01  0.00000e+00 0.00000e+00 2.38788e+02 82.782  1.68201e+01 82.782  0.9754 
1 1 1 -15 1   8  o 19 1.07083e+01 1.76694e+00 2.32464e+02 275.262 1.84326e+00  -2.00156e+01 0.00000e+00 0.00000e+00 1.63918e+02 275.262 6.85460e+01 95.262  0.9748 
1 1 1 -15 1   9  o 1  9.44007e+00 1.55360e+00 1.52164e+02 142.312 -1.13944e+01 8.80288e+00  0.00000e+00 0.00000e+00 1.93238e+02 142.312 4.10738e+01 142.312 0.9646 
1 1 1 -15 1   10 o 12 6.15272e+00 1.62531e+00 8.84627e+01 137.119 -3.76589e+00 3.49717e+00  0.00000e+00 0.00000e+00 1.20516e+02 137.119 3.20535e+01 137.119 0.8965 
1 1 1 -15 1   11 o 12 4.76140e+00 1.44742e+00 6.87769e+01 213.682 -3.20592e+00 -2.13664e+00 0.00000e+00 0.00000e+00 8.57344e+01 213.682 1.69575e+01 213.682 0.8576 
1 1 1 -15 1   12 o 11 6.08421e+00 1.71534e+00 1.18284e+02 85.805  5.30831e-01  7.23769e+00  0.00000e+00 0.00000e+00 9.51485e+01 85.805  2.31350e+01 265.805 0.9283 
1 1 1 -15 1   13 o 6  4.86155e+00 1.54817e+00 1.06967e+02 285.254 1.66287e+00  -6.09758e+00 0.00000e+00 0.00000e+00 6.12807e+01 285.254 4.56861e+01 105.254 0.9171 
1 1 1 -15 2   1  o 8  1.34765e+01 1.60330e+00 2.98562e+02 0.502   2.80644e+01  2.45728e-01  0.00000e+00 0.00000e+00 2.07088e+02 0.502   9.14745e+01 180.502 0.9820 
1 1 1 -15 2   2  o 3  1.87626e+01 1.77325e+00 3.12308e+02 73.868  1.12807e+01  3.90021e+01  0.00000e+00 0.00000e+00 3.95194e+02 73.868  8.28855e+01 73.868  0.9876 
1 1 1 -15 2   3  o 13 1.24967e+01 2.13664e+00 2.58221e+02 272.189 7.11825e-01  -1.86182e+01 0.00000e+00 0.00000e+00 2.05582e+02 272.189 5.26393e+01 92.190  0.9728 
1 1 1 -15 2   4  o 19 1.91894e+01 1.35260e+00 2.66622e+02 101.912 -9.01666e+00 4.27437e+01  0.00000e+00 0.00000e+00 4.56478e+02 101.912 1.89856e+02 101.912 0.9885 
1 1 1 -15 2   5  o 14 8.59282e+00 1.98767e+00 1.98339e+02 34.462  8.68075e+00  5.95764e+00  0.00000e+00 0.00000e+00 1.12988e+02 34.462  8.53507e+01 214.462 0.9513 
1 1 1 -15 2   6  o 15 1.42979e+01 1.78117e+00 2.49337e+02 210.467 -2.33975e+01 -1.37640e+01 0.00000e+00 0.00000e+00 2.84607e+02 210.467 3.52704e+01 210.467 0.9814 
1 1 1 -15 2   7  o 17 1.13836e+01 1.97200e+00 2.12347e+02 90.266  -8.04582e-02 1.73537e+01  0.00000e+00 0.00000e+00 2.07725e+02 90.266  4.62203e+00 270.266 0.9707 
1 1 1 -15 2   8  o 19 4.26323e+00 1.40647e+00 5.02490e+01 117.995 -9.84568e-01 1.85212e+00  0.00000e+00 0.00000e+00 6.52038e+01 117.995 1.49548e+01 117.995 0.7132 
1 1 1 -15 2   9  o 13 5.23755e+00 1.47360e+00 1.20248e+02 358.824 6.61611e+00  -1.35782e-01 0.00000e+00 0.00000e+00 6.27205e+01 358.824 5.75276e+01 178.824 0.9210 
1 1 1 -15 2   10 o 18 4.83064e+00 1.46235e+00 4.46347e+01 87.292  1.05702e-01  2.23462e+00  0.00000e+00 0.00000e+00 8.95340e+01 87.292  4.48993e+01 87.292  0.7331 
1 1 1 -15 2   11 o 6  4.49986e+00 1.41634e+00 6.10825e+01 355.237 3.28753e+00  -2.73911e-01 0.00000e+00 0.00000e+00 8.02176e+01 355.237 1.91351e+01 355.237 0.8299 
1 1 1 -15 2   12 o 12 5.61774e+00 1.62914e+00 1.34814e+02 127.588 -4.92906e+00 6.40338e+00  0.00000e+00 0.00000e+00 6.38694e+01 127.588 7.09448e+01 307.587 0.9359 
1 1 1 -15 2   13 o 8  4.64551e+00 1.43689e+00 4.80433e+01 140.857 -2.27713e+00 1.85341e+00  0.00000e+00 0.00000e+00 9.31064e+01 140.857 4.50632e+01 140.857 0.8051 
1 1 1 -15 3   1  f 0  7.91517e+00 1.86463e+00 1.81321e+02 283.333 2.05966e+00  -8.69040e+00 0.00000e+00 0.00000e+00 1.03628e+02 283.333 7.76934e+01 103.333 0.9422 
1 1 1 -15 3   2  o 1  9.45349e+00 2.00565e+00 1.54450e+02 315.383 6.45105e+00  -6.36549e+00 0.00000e+00 0.00000e+00 1.85956e+02 315.383 3.15068e+01 315.383 0.9431 
1 1 1 -15 3   3  o 9  8.38393e+00 2.07965e+00 2.21596e+02 97.030  -1.34841e+00 1.09347e+01  0.00000e+00 0.00000e+00 8.33868e+01 97.030  1.38210e+02 277.030 0.9535 
1 1 1 -15 3   4  o 17 2.02447e+01 1.32827e+00 3.00535e+02 196.212 -4.90809e+01 -1.42709e+01 0.00000e+00 0.00000e+00 4.63623e+02 196.212 1.63088e+02 196.212 0.9902 
1 1 1 -15 3   5  o 14 8.74765e+00 1.83259e+00 1.08466e+02 276.605 7.24693e-01  -6.25806e+00 0.00000e+00 0.00000e+00 1.96982e+02 276.605 8.85165e+01 276.605 0.9168 
1 1 1 -15 3   6  o 3  7.09530e+00 1.83843e+00 1.52091e+02 47.435  5.39585e+00  5.87518e+00  0.00000e+00 0.00000e+00 1.00358e+02 47.435  5.17332e+01 227.435 0.9350 
1 1 1 -15 3   7  o 2  7.69874e+00 1.82175e+00 1.50888e+02 345.131 8.53093e+00  -2.26497e+00 0.00000e+00 0.00000e+00 1.24654e+02 345.131 2.62336e+01 165.131 0.9415 
1 1 1 -15 3   8  o 16 4.51027e+00 1.41683e+00 1.16625e+02 201.376 -4.76966e+00 -1.86694e+00 0.00000e+00 0.00000e+00 3.68556e+01 201.376 7.97691e+01 21.376  0.8961 
1 1 1 -15 3   9  o 19 8.03381e+00 1.72375e+00 1.38879e+02 73.457  2.87896e+00  9.69251e+00  0.00000e+00 0.00000e+00 1.50360e+02 73.457  1.14810e+01 73.457  0.9492 
1 1 1 -15 3   10 o 17 6.96221e+00 1.62249e+00 1.45202e+02 206.729 -8.53837e+00 -4.29978e+00 0.00000e+00 0.00000e+00 1.04362e+02 206.729 4.08399e+01 26.729  0.9462 
1 1 1 -15 3   11 o 9  4.90643e+00 1.47499e+00 1.89710e+01 118.690 -5.16398e-01 9.43594e-01  0.00000e+00 0.00000e+00 6.87594e+01 118.690 4.97884e+01 118.690 0.4726 
1 1 1 -15 3   12 o 8  1.21134e+01 1.63966e+00 1.70779e+02 192.115 -2.14311e+01 -4.60011e+00 0.00000e+00 0.00000e+00 2.76406e+02 192.115 1.05628e+02 192.115 0.9769 
1 1 1 -15 3   13 o 17 5.10106e+00 1.56685e+00 1.00969e+02 4.376   6.15856e+00  4.71334e-01  0.00000e+00 0.00000e+00 7.51717e+01 4.376   2.57970e+01 184.376 0.9150 
1 1 1 -15 4   1  o 6  4.71209e+00 1.50421e+00 9.95285e+01 307.640 2.08264e+00  -2.70042e+00 0.00000e+00 0.00000e+00 5.10305e+01 307.640 4.84981e+01 127.640 0.8363 
1 1 1 -15 4   2  o 11 6.77138e+00 1.99309e+00 1.33902e+02 121.692 -2.97398e+00 4.81675e+00  0.00000e+00 0.00000e+00 1.00524e+02 121.692 3.33785e+01 301.692 0.9067 
1 1 1 -15 4   3  o 15 8.77051e+00 2.08948e+00 1.40713e+02 53.373  4.34566e+00  5.84574e+00  0.00000e+00 0.00000e+00 1.69997e+02 53.373  2.92837e+01 53.373  0.9286 
1 1 1 -15 4   4  o 9  5.00976e+00 1.55350e+00 1.18971e+02 356.625 4.52720e+00  -2.66950e-01 0.00000e+00 0.00000e+00 4.93447e+01 356.625 6.96265e+01 176.625 0.8814 
1 1 1 -15 4   5  o 16 1.11451e+01 1.65098e+00 1.00007e+02 172.672 -7.97699e+00 1.02585e+00  0.00000e+00 0.00000e+00 2.97138e+02 172.672 1.97131e+02 172.672 0.9356 
1 1 1 -15 4   6  o 14 1.08242e+01 1.93237e+00 2.31991e+02 16.858  1.73504e+01  5.25758e+00  0.00000e+00 0.00000e+00 1.68358e+02 16.858  6.36330e+01 196.858 0.9720 
1 1 1 -15 4   7  o 13 4.36082e+00 1.43506e+00 7.86680e+01 342.292 3.03474e+00  -9.68977e-01 0.00000e+00 0.00000e+00 5.77306e+01 342.292 2.09374e+01 162.292 0.8228 
1 1 1 -15 4   8  o 15 1.20780e+01 1.60087e+00 2.13724e+02 111.288 -8.27497e+00 2.12374e+01  0.00000e+00 0.00000e+00 2.34734e+02 111.288 2.10105e+01 111.288 0.9778 
1 1 1 -15 4   9  f 0  5.72163e+00 1.69702e+00 1.48083e+02 320.652 6.03198e+00  -4.94560e+00 0.00000e+00 0.00000e+00 5.45075e+01 320.652 9.35759e+01 140.652 0.9335 
1 1 1 -15 4   10 o 4  3.68582e+00 1.24483e+00 6.57732e+01 210.057 -2.46145e+00 -1.42441e+00 0.00000e+00 0.00000e+00 4.56221e+01 210.057 2.01511e+01 30.057  0.7977 
1 1 1 -15 4   11 o 4  7.70656e+00 1.46527e+00 1.16367e+02 238.755 -5.21138e+00 -8.58969e+00 0.00000e+00 0.00000e+00 1.60317e+02 238.755 4.39507e+01 238.755 0.9488 
1 1 1 -15 4   12 o 8  6.86378e+00 1.75472e+00 1.11763e+02 44.880  5.34137e+00  5.31896e+00  0.00000e+00 0.00000e+00 1.29735e+02 44.880  1.79725e+01 44.880  0.9311 
1 1 1 -15 4   13 o 14 5.72326e+00 1.60475e+00 8.01152e+01 16.973  5.11940e+00  1.56248e+00  0.00000e+00 0.00000e+00 1.14473e+02 16.973  3.43574e+01 16.973  0.9010 
1 1 1 -15 5   1  o 11 7.89891e+00 1.82191e+00 1.52594e+02 105.618 -2.05719e+00 7.35897e+00  0.00000e+00 0.00000e+00 1.28694e+02 105.618 2.39006e+01 285.618 0.9321 
1 1 1 -15 5   2  o 1  1.47085e+01 1.83588e+00 2.57538e+02 168.007 -2.49171e+01 5.29318e+00  0.00000e+00 0.00000e+00 2.92900e+02 168.007 3.53619e+01 168.007 0.9802 
1 1 1 -15 5   3  o 18 1.01707e+01 2.03823e+00 2.11136e+02 21.382  1.20880e+01  4.73287e+00  0.00000e+00 0.00000e+00 1.61631e+02 21.382  4.95050e+01 201.382 0.9607 
1 1 1 -15 5   4  o 10 7.84544e+00 1.71159e+00 1.72198e+02 219.828 -7.34315e+00 -6.12423e+00 0.00000e+00 0.00000e+00 1.10771e+02 219.828 6.14263e+01 39.828  0.9462 
1 1 1 -15 5   5  o 10 1.38827e+01 1.54322e+00 2.62192e+02 80.775  4.41846e+00  2.72061e+01  0.00000e+00 0.00000e+00 2.56869e+02 80.775  5.32322e+00 260.775 0.9817 
1 1 1 -15 5   6  o 17 8.04234e+00 1.95269e+00 2.09005e+02 232.258 -7.34761e+00 -9.49247e+00 0.00000e+00 0.00000e+00 8.39735e+01 232.258 1.25032e+02 52.258  0.9574 
1 1 1 -15 5   7  f 0  5.13449e+00 1.60189e+00 1.27526e+02 332.996 4.97201e+00  -2.53381e+00 0.00000e+00 0.00000e+00 4.91674e+01 332.996 7.83582e+01 152.996 0.9053 
1 1 1 -15 5   8  o 2  8.94089e+00 1.71074e+00 1.54573e+02 109.207 -3.86925e+00 1.11065e+01  0.00000e+00 0.00000e+00 1.70162e+02 109.207 1.55895e+01 109.207 0.9565 
1 1 1 -15 5   9  o 1  6.58710e+00 1.60207e+00 1.07578e+02 214.682 -5.67441e+00 -3.92652e+00 0.00000e+00 0.00000e+00 1.23381e+02 214.682 1.58031e+01 214.682 0.9244 
1 1 1 -15 5   10 o 10 5.73517e+00 1.55304e+00 1.03165e+02 319.123 4.75836e+00  -4.11844e+00 0.00000e+00 0.00000e+00 9.60077e+01 319.123 7.15730e+00 139.123 0.9167 
1 1 1 -15 5   11 o 7  6.23393e+00 1.67141e+00 8.02483e+01 300.076 2.46982e+00  -4.26480e+00 0.00000e+00 0.00000e+00 1.30081e+02 300.076 4.98328e+01 300.076 0.8917 
1 1 1 -15 5   12 o 3  1.24234e+01 1.59629e+00 1.55448e+02 107.231 -6.23527e+00 2.01045e+01  0.00000e+00 0.00000e+00 3.02717e+02 107.231 1.47269e+02 107.231 0.9759 
1 1 1 -15 5   13 o 14 5.00638e+00 1.56154e+00 5.39052e+01 284.726 8.25604e-01  -3.14109e+00 0.00000e+00 0.00000e+00 1.02288e+02 284.726 4.83826e+01 284.726 0.8268 
1 1 1 -15 6   1  o 8  1.51260e+01 1.51588e+00 2.51868e+02 232.136 -1.82479e+01 -2.34706e+01 0.00000e+00 0.00000e+00 3.16234e+02 232.136 6.43652e+01 232.136 0.9830 
1 1 1 -15 6   2  o 16 1.09180e+01 2.04808e+00 2.76507e+02 54.204  1.07359e+01  1.48878e+01  0.00000e+00 0.00000e+00 1.28819e+02 54.204  1.47689e+02 234.204 0.9724 
1 1 1 -15 6   3  f 0  6.25844e+00 1.85238e+00 2.09752e+02 258.392 -1.74162e+00 -8.47861e+00 0.00000e+00 0.00000e+00 1.47634e+01 258.392 1.94989e+02 78.392  0.9403 
1 1 1 -15 6   4  o 9  7.42146e+00 2.18388e+00 1.71569e+02 85.583  5.55983e-01  7.19741e+00  0.00000e+00 0.00000e+00 9.09354e+01 85.583  8.06335e+01 265.583 0.9279 
1 1 1 -15 6   5  o 1  3.95951e+00 1.81311e+00 7.80123e+01 47.890  1.38689e+00  1.53435e+00  0.00000e+00 0.00000e+00 2.88563e+01 47.890  4.91560e+01 227.890 0.7087 
1 1 1 -15 6   6  o 14 3.83980e+00 1.30610e+00 4.45099e+01 295.646 7.40003e-01  -1.54133e+00 0.00000e+00 0.00000e+00 4.95635e+01 295.646 5.05364e+00 295.646 0.6439 
1 1 1 -15 6   7  f 0  1.42590e+01 1.72063e+00 2.32960e+02 38.731  2.07544e+01  1.66457e+01  0.00000e+00 0.00000e+00 2.98768e+02 38.731  6.58084e+01 38.731  0.9810 
1 1 1 -15 6   8  o 11 7.10328e+00 1.75081e+00 6.42663e+01 143.835 -3.06712e+00 2.24189e+00  0.00000e+00 0.00000e+00 1.66435e+02 143.835 1.02169e+02 143.835 0.8553 
1 1 1 -15 6   9  o 4  6.42430e+00 1.72609e+00 7.31450e+01 127.643 -2.59641e+00 3.36628e+00  0.00000e+00 0.00000e+00 1.39462e+02 127.643 6.63174e+01 127.643 0.8725 
1 1 1 -15 6   10 o 5  6.93950e+00 1.82532e+00 1.69532e+02 26.436  9.45169e+00  4.69925e+00  0.00000e+00 0.00000e+00 8.05835e+01 26.436  8.89482e+01 206.436 0.9514 
1 1 1 -15 6   11 o 15 1.16896e+01 1.51216e+00 2.23190e+02 141.955 -2.23492e+01 1.74896e+01  0.00000e+00 0.00000e+00 2.11243e+02 141.955 1.19469e+01 321.954 0.9822 
1 1 1 -15 6   12 o 16 4.46741e+00 1.43983e+00 1.11459e+02 325.350 5.13948e+00  -3.55215e+00 0.00000e+00 0.00000e+00 4.31795e+01 325.350 6.82797e+01 145.350 0.9160 
1 1 1 -15 6   13 o 1  6.08009e+00 1.59088e+00 9.11982e+01 83.935  6.90413e-01  6.49822e+00  0.00000e+00 0.00000e+00 1.19870e+02 83.935  2.86718e+01 83.935  0.9199 
1 1 1 -15 7   1  o 9  7.63695e+00 1.84555e+00 1.27749e+02 190.101 -6.43085e+00 -1.14567e+00 0.00000e+00 0.00000e+00 1.40655e+02 190.101 1.29056e+01 190.101 0.9199 
1 1 1 -15 7   2  o 13 5.71739e+00 1.72636e+00 8.94778e+01 207.158 -3.22060e+00 -1.65219e+00 0.00000e+00 0.00000e+00 9.54341e+01 207.158 5.95626e+00 207.158 0.8471 
1 1 1 -15 7   3  o 11 9.79169e+00 2.11753e+00 2.00307e+02 283.504 2.66617e+00  -1.11022e+01 0.00000e+00 0.00000e+00 1.56492e+02 283.504 4.38153e+01 103.504 0.9552 
1 1 1 -15 7   4  o 4  1.38933e+01 1.65954e+00 2.54352e+02 251.649 -8.06145e+00 -2.43031e+01 0.00000e+00 0.00000e+00 2.64795e+02 251.649 1.04426e+01 251.649 0.9803 
1 1 1 -15 7   5  o 9  6.04298e+00 2.21262e+00 9.65879e+01 78.815  6.56703e-01  3.32103e+00  0.00000e+00 0.00000e+00 9.55591e+01 78.815  1.02883e+00 258.815 0.8349 
1 1 1 -15 7   6  o 11 5.33706e+00 1.57892e+00 1.00475e+02 184.210 -4.65199e+00 -3.42401e-01 0.00000e+00 0.00000e+00 7.92391e+01 184.210 2.12354e+01 4.210   0.8850 
1 1 1 -15 7   7  o 10 6.36153e+00 1.78154e+00 1.32436e+02 319.853 4.99471e+00  -4.21294e+00 0.00000e+00 0.00000e+00 9.00131e+01 319.853 4.24231e+01 139.853 0.9199 
1 1 1 -15 7   8  o 5  7.04498e+00 1.70578e+00 1.75997e+02 210.341 -9.12817e+00 -5.34279e+00 0.00000e+00 0.00000e+00 7.85291e+01 210.341 9.74681e+01 30.341  0.9515 
1 1 1 -15 7   9  o 15 7.11508e+00 1.75875e+00 6.99076e+01 22.201  4.08597e+00  1.66757e+00  0.00000e+00 0.00000e+00 1.66957e+02 22.201  9.70494e+01 22.201  0.8777 
1 1 1 -15 7   10 o 8  5.54814e+00 1.50112e+00 7.69509e+01 123.607 -2.59549e+00 3.90550e+00  0.00000e+00 0.00000e+00 1.09195e+02 123.607 3.22443e+01 123.607 0.8856 
1 1 1 -15 7   11 f 0  4.25729e+00 1.38012e+00 9.83901e+01 51.027  3.10935e+00  3.84339e+00  0.00000e+00 0.00000e+00 4.53027e+01 51.027  5.30875e+01 231.027 0.8921 
1 1 1 -15 7   12 f 0  5.10641e+00 1.55752e+00 1.37148e+02 295.700 3.51591e+00  -7.30551e+00 0.00000e+00 0.00000e+00 4.34827e+01 295.700 9.36650e+01 115.700 0.9361 
1 1 1 -15 7   13 o 11 5.53053e+00 1.66184e+00 1.36801e+02 110.414 -2.95768e+00 7.94701e+00  0.00000e+00 0.00000e+00 5.91723e+01 110.414 7.76283e+01 290.414 0.9390 
1 1 1 -15 8   1  o 14 6.29463e+00 1.63044e+00 7.21668e+01 324.707 2.74406e+00  -1.94236e+00 0.00000e+00 0.00000e+00 1.28290e+02 324.707 5.61228e+01 324.707 0.8336 
1 1 1 -15 8   2  o 6  1.80953e+01 1.62680e+00 2.81634e+02 234.603 -2.18652e+01 -3.07704e+01 0.00000e+00 0.00000e+00 3.99997e+02 234.603 1.18363e+02 234.603 0.9867 
1 1 1 -15 8   3  o 18 1.82217e+01 1.65935e+00 3.03338e+02 119.569 -1.96488e+01 3.46321e+01  0.00000e+00 0.00000e+00 3.83019e+02 119.569 7.96806e+01 119.569 0.9874 
1 1 1 -15 8   4  o 14 6.33532e+00 2.20315e+00 3.60841e+01 299.651 6.35113e-01  -1.11567e+00 0.00000e+00 0.00000e+00 9.38290e+01 299.651 5.77449e+01 299.651 0.5380 
1 1 1 -15 8   5  o 19 6.71295e+00 2.15844e+00 1.16298e+02 146.515 -3.87713e+00 2.56471e+00  0.00000e+00 0.00000e+00 1.09843e+02 146.515 6.45491e+00 326.515 0.8845 
1 1 1 -15 8   6  o 16 4.59479e+00 1.39964e+00 7.50150e+01 246.834 -1.29350e+00 -3.02288e+00 0.00000e+00 0.00000e+00 6.99524e+01 246.834 5.06262e+00 66.834  0.8292 
1 1 1 -15 8   7  o 8  5.97330e+00 1.67186e+00 1.39759e+02 320.321 5.27644e+00  -4.37738e+00 0.00000e+00 0.00000e+00 7.00077e+01 320.321 6.97512e+01 140.321 0.9239 
1 1 1 -15 8   8  o 14 7.51396e+00 1.79177e+00 1.53969e+02 29.720  8.17093e+00  4.66437e+00  0.00000e+00 0.00000e+00 1.15720e+02 29.720  3.82492e+01 209.720 0.9453 
1 1 1 -15 8   9  o 4  5.37254e+00 1.64861e+00 1.55857e+02 108.180 -2.48521e+00 7.56755e+00  0.00000e+00 0.00000e+00 3.46527e+01 108.180 1.21205e+02 288.180 0.9349 
1 1 1 -15 8   10 o 8  6.08825e+00 1.79740e+00 5.12151e+01 202.529 -2.62847e+00 -1.09032e+00 0.00000e+00 0.00000e+00 1.32810e+02 202.529 8.15944e+01 202.529 0.7979 
1 1 1 -15 8   11 o 9  6.59001e+00 1.81794e+00 1.73356e+02 336.816 9.44030e+00  -4.04292e+00 0.00000e+00 0.00000e+00 6.35100e+01 336.816 1.09846e+02 156.816 0.9500 
1 1 1 -15 8   12 o 15 6.39239e+00 1.74739e+00 1.18007e+02 177.502 -7.67023e+00 3.34657e-01  0.00000e+00 0.00000e+00 1.07207e+02 177.502 1.08000e+01 357.502 0.9324 
1 1 1 -15 8   13 o 1  4.07935e+00 1.35293e+00 6.80910e+01 14.552  3.81470e+00  9.90254e-01  0.00000e+00 0.00000e+00 6.44781e+01 14.552  3.61292e+00 194.552 0.8612 
1 1 1 -15 9   1  o 8  9.23760e+00 1.81370e+00 1.05148e+02 302.082 3.50405e+00  -5.58981e+00 0.00000e+00 0.00000e+00 2.19792e+02 302.082 1.14644e+02 302.082 0.9207 
1 1 1 -15 9   2  o 4  1.35893e+01 1.54048e+00 2.65298e+02 231.410 -1.73190e+01 -2.17028e+01 0.00000e+00 0.00000e+00 2.44074e+02 231.410 2.12236e+01 51.410  0.9818 
1 1 1 -15 9   3  o 16 6.29111e+00 1.84689e+00 1.15693e+02 354.697 4.92806e+00  -4.57435e-01 0.00000e+00 0.00000e+00 9.84285e+01 354.697 1.72649e+01 174.697 0.8922 
1 1 1 -15 9   4  o 19 1.27966e+01 1.69288e+00 1.69644e+02 180.403 -1.54805e+01 -1.08788e-01 0.00000e+00 0.00000e+00 3.02099e+02 180.403 1.32455e+02 180.403 0.9671 
1 1 1 -15 9   5  o 2  7.61437e+00 2.12691e+00 1.04789e+02 336.332 4.41799e+00  -1.93640e+00 0.00000e+00 0.00000e+00 1.53042e+02 336.332 4.82528e+01 336.332 0.8891 
1 1 1 -15 9   6  o 3  1.00013e+01 1.59456e+00 2.17059e+02 115.949 -8.19126e+00 1.68329e+01  0.00000e+00 0.00000e+00 1.53160e+02 115.949 6.38998e+01 295.948 0.9729 
1 1 1 -15 9   7  o 8  1.10227e+01 1.64932e+00 2.39163e+02 326.943 1.83544e+01  -1.19454e+01 0.00000e+00 0.00000e+00 1.70127e+02 326.943 6.90367e+01 146.943 0.9769 
1 1 1 -15 9   8  o 2  1.35739e+01 1.57278e+00 1.82374e+02 142.815 -1.80924e+01 1.37256e+01  0.00000e+00 0.00000e+00 3.21537e+02 142.815 1.39163e+02 142.815 0.9777 
1 1 1 -15 9   9  o 2  8.63747e+00 1.87317e+00 2.22236e+02 283.034 3.60313e+00  -1.55649e+01 0.00000e+00 0.00000e+00 9.49302e+01 283.034 1.27306e+02 103.034 0.9682 
1 1 1 -15 9   10 o 12 7.57940e+00 1.96604e+00 1.66536e+02 69.103  3.70194e+00  9.69618e+00  0.00000e+00 0.00000e+00 1.06381e+02 69.103  6.01542e+01 249.103 0.9505 
1 1 1 -15 9   11 o 7  3.84293e+00 1.32200e+00 1.97767e+01 254.173 -2.53353e-01 -8.93749e-01 0.00000e+00 0.00000e+00 4.13845e+01 254.173 2.16078e+01 254.173 0.4207 
1 1 1 -15 9   12 o 5  5.16861e+00 1.52657e+00 1.00712e+02 172.455 -6.09862e+00 8.07786e-01  0.00000e+00 0.00000e+00 7.79171e+01 172.455 2.27951e+01 352.455 0.9147 
1 1 1 -15 9   13 o 5  6.09373e+00 1.72785e+00 1.44210e+02 292.094 3.58142e+00  -8.82260e+00 0.00000e+00 0.00000e+00 7.32959e+01 292.094 7.09138e+01 112.094 0.9459 
1 1 1 -15 10  1  o 10 5.94423e+00 1.71471e+00 1.11750e+02 171.978 -4.67774e+00 6.59260e-01  0.00000e+00 0.00000e+00 8.95759e+01 171.978 2.21743e+01 351.978 0.8866 
1 1 1 -15 10  2  o 19 8.54920e+00 1.81744e+00 6.14830e+01 47.096  2.39974e+00  2.58210e+00  0.00000e+00 0.00000e+00 2.13457e+02 47.096  1.51974e+02 47.096  0.8424 
1 1 1 -15 10  3  o 7  6.69198e+00 1.89410e+00 1.17801e+02 204.894 -4.75213e+00 -2.20526e+00 0.00000e+00 0.00000e+00 1.11606e+02 204.894 6.19535e+00 24.894  0.8986 
1 1 1 -15 10  4  o 10 9.33612e+00 2.07097e+00 1.52978e+02 28.351  7.74701e+00  4.18017e+00  0.00000e+00 0.00000e+00 1.82011e+02 28.351  2.90337e+01 28.351  0.9414 
1 1 1 -15 10  5  o 11 1.03375e+01 1.92438e+00 1.83431e+02 62.688  5.80660e+00  1.12443e+01  0.00000e+00 0.00000e+00 1.94358e+02 62.688  1.09274e+01 62.688  0.9596 
1 1 1 -15 10  6  o 4  1.18158e+01 1.89133e+00 2.34573e+02 86.601  1.21044e+00  2.03811e+01  0.00000e+00 0.00000e+00 2.03830e+02 86.601  3.07431e+01 266.601 0.9752 
1 1 1 -15 10  7  o 14 1.05030e+01 1.73764e+00 2.04900e+02 267.306 -8.36284e-01 -1.77722e+01 0.00000e+00 0.00000e+00 1.82918e+02 267.306 2.19815e+01 87.306  0.9715 
1 1 1 -15 10  8  o 11 7.65097e+00 1.78431e+00 1.09865e+02 292.044 2.57488e+00  -6.35896e+00 0.00000e+00 0.00000e+00 1.58535e+02 292.044 4.86703e+01 292.044 0.9239 
1 1 1 -15 10  9  o 4  7.87902e+00 1.89809e+00 1.32512e+02 104.876 -2.19785e+00 8.27382e+00  0.00000e+00 0.00000e+00 1.48268e+02 104.876 1.57560e+01 104.876 0.9396 
1 1 1 -15 10  10 o 2  4.97299e+00 1.59821e+00 5.96275e+01 15.868  2.94630e+00  8.37486e-01  0.00000e+00 0.00000e+00 9.38155e+01 15.868  3.41879e+01 15.868  0.8145 
1 1 1 -15 10  11 o 3  7.88542e+00 1.84168e+00 2.12311e+02 213.448 -1.29384e+01 -8.54679e+00 0.00000e+00 0.00000e+00 7.62368e+01 213.448 1.36074e+02 33.448  0.9672 
1 1 1 -15 10  12 o 2  4.98094e+00 1.62083e+00 7.92190e+01 181.903 -4.37006e+00 -1.45197e-01 0.00000e+00 0.00000e+00 8.57309e+01 181.903 6.51188e+00 181.903 0.8765 
1 1 1 -15 10  13 o 16 5.40724e+00 1.53584e+00 8.40041e+01 73.940  1.56114e+00  5.42307e+00  0.00000e+00 0.00000e+00 1.00934e+02 73.940  1.69301e+01 73.940  0.9064 
1 1 1 -15 11  1  o 5  5.90725e+00 1.66182e+00 1.49131e+02 122.232 -3.38680e+00 5.37151e+00  0.00000e+00 0.00000e+00 5.79135e+01 122.232 9.12173e+01 302.232 0.9175 
1 1 1 -15 11  2  o 9  6.61265e+00 1.80441e+00 1.27314e+02 182.632 -5.67181e+00 -2.60771e-01 0.00000e+00 0.00000e+00 1.01659e+02 182.632 2.56544e+01 2.632   0.9070 
1 1 1 -15 11  3  o 12 4.57302e+00 1.49505e+00 8.40807e+01 195.877 -2.96506e+00 -8.43326e-01 0.00000e+00 0.00000e+00 5.82503e+01 195.877 2.58304e+01 15.877  0.8159 
1 1 1 -15 11  4  o 6  9.01572e+00 2.15200e+00 1.69583e+02 246.271 -3.64440e+00 -8.29078e+00 0.00000e+00 0.00000e+00 1.54485e+02 246.271 1.50979e+01 66.271  0.9431 
1 1 1 -15 11  5  o 16 9.04076e+00 2.02601e+00 8.30931e+01 52.018  2.93460e+00  3.75859e+00  0.00000e+00 0.00000e+00 2.22537e+02 52.018  1.39444e+02 52.018  0.8877 
1 1 1 -15 11  6  o 19 1.15345e+01 1.81109e+00 1.57186e+02 37.033  1.11222e+01  8.39127e+00  0.00000e+00 0.00000e+00 2.65598e+02 37.033  1.08412e+02 37.033  0.9634 
1 1 1 -15 11  7  o 8  1.09835e+01 1.47605e+00 2.09010e+02 284.460 5.45842e+00  -2.11663e+01 0.00000e+00 0.00000e+00 1.98783e+02 284.460 1.02270e+01 104.460 0.9769 
1 1 1 -15 11  8  o 1  4.55806e+00 1.44501e+00 1.24665e+02 93.358  -3.40731e-01 5.80697e+00  0.00000e+00 0.00000e+00 3.27158e+01 93.358  9.19491e+01 273.358 0.9094 
1 1 1 -15 11  9  o 18 5.07167e+00 1.57960e+00 8.73445e+01 237.396 -2.36360e+00 -3.69523e+00 0.00000e+00 0.00000e+00 8.13188e+01 237.396 6.02567e+00 57.396  0.8769 
1 1 1 -15 11  10 o 11 5.46433e+00 1.65775e+00 8.45268e+01 39.683  3.37514e+00  2.80039e+00  0.00000e+00 0.00000e+00 9.69739e+01 39.683  1.24471e+01 39.683  0.8769 
1 1 1 -15 11  11 o 10 6.93696e+00 1.80514e+00 1.48159e+02 106.953 -2.84137e+00 9.32091e+00  0.00000e+00 0.00000e+00 1.00428e+02 106.953 4.77313e+01 286.953 0.9472 
1 1 1 -15 11  12 o 12 4.93672e+00 1.62262e+00 1.01838e+02 267.962 -1.87551e-01 -5.27161e+00 0.00000e+00 0.00000e+00 6.59203e+01 267.962 3.59176e+01 87.962  0.8994 
1 1 1 -15 11  13 o 15 4.74148e+00 1.45307e+00 1.14575e+02 112.001 -2.68326e+00 6.64089e+00  0.00000e+00 0.00000e+00 5.13221e+01 112.001 6.32529e+01 292.001 0.9273 
1 1 1 -15 12  1  f 0  8.52016e+00 1.79383e+00 2.12543e+02 87.120  6.16812e-01  1.22606e+01  0.00000e+00 0.00000e+00 9.93796e+01 87.120  1.13163e+02 267.120 0.9584 
1 1 1 -15 12  2  o 14 6.40856e+00 1.70814e+00 1.33208e+02 88.489  1.58633e-01  6.01426e+00  0.00000e+00 0.00000e+00 9.00537e+01 88.489  4.31538e+01 268.489 0.9126 
1 1 1 -15 12  3  o 1  5.88555e+00 1.75198e+00 1.18750e+02 162.513 -4.73784e+00 1.49264e+00  0.00000e+00 0.00000e+00 8.16471e+01 162.513 3.71033e+01 342.513 0.8926 
1 1 1 -15 12  4  o 5  3.71575e+00 1.74446e+00 5.22287e+01 303.911 7.81085e-01  -1.16188e+00 0.00000e+00 0.00000e+00 2.85560e+01 303.911 2.36726e+01 123.911 0.5704 
1 1 1 -15 12  5  o 2  7.56293e+00 2.12224e+00 1.41031e+02 103.504 -1.54789e+00 6.44561e+00  0.00000e+00 0.00000e+00 1.24256e+02 103.504 1.67748e+01 283.504 0.9211 
1 1 1 -15 12  6  f 0  1.51178e+01 1.52680e+00 2.26621e+02 301.890 1.61437e+01  -2.59460e+01 0.00000e+00 0.00000e+00 3.39039e+02 301.890 1.12419e+02 301.890 0.9835 
1 1 1 -15 12  7  o 1  1.27847e+01 1.60706e+00 2.57709e+02 170.018 -2.87813e+01 5.06581e+00  0.00000e+00 0.00000e+00 2.19806e+02 170.018 3.79034e+01 350.018 0.9827 
1 1 1 -15 12  8  o 17 6.92564e+00 1.72127e+00 1.25301e+02 270.849 1.12505e-01  -7.59011e+00 0.00000e+00 0.00000e+00 1.19651e+02 270.849 5.65040e+00 90.849  0.9316 
1 1 1 -15 12  9  o 16 6.45853e+00 1.77780e+00 9.69508e+01 37.672  4.34523e+00  3.35500e+00  0.00000e+00 0.00000e+00 1.24373e+02 37.672  2.74223e+01 37.672  0.9036 
1 1 1 -15 12  10 f 0  7.71393e+00 1.96652e+00 1.23145e+02 235.325 -4.27044e+00 -6.17314e+00 0.00000e+00 0.00000e+00 1.48823e+02 235.325 2.56775e+01 235.325 0.9308 
1 1 1 -15 12  11 o 13 7.09247e+00 1.93721e+00 8.05669e+01 80.047  8.59863e-01  4.90025e+00  0.00000e+00 0.00000e+00 1.58988e+02 80.047  7.84206e+01 80.047  0.8928 
1 1 1 -15 12  12 o 12 7.45748e+00 1.85013e+00 1.50485e+02 185.819 -1.01247e+01 -1.03178e+00 0.00000e+00 0.00000e+00 1.17050e+02 185.819 3.34348e+01 5.819   0.9495 
1 1 1 -15 12  13 o 7  4.94466e+00 1.63749e+00 8.92421e+01 107.592 -1.53957e+00 4.85573e+00  0.00000e+00 0.00000e+00 7.78280e+01 107.592 1.14141e+01 287.592 0.8955 
1 1 1 -15 13  1  o 13 5.57702e+00 1.61359e+00 1.22536e+02 61.629  2.39017e+00  4.42591e+00  0.00000e+00 0.00000e+00 6.79359e+01 61.629  5.46000e+01 241.629 0.8941 
1 1 1 -15 13  2  o 16 1.68377e+01 1.52446e+00 2.97205e+02 78.432  7.68193e+00  3.75289e+01  0.00000e+00 0.00000e+00 3.37087e+02 78.432  3.98822e+01 78.432  0.9869 
1 1 1 -15 13  3  o 3  5.46983e+00 1.72365e+00 1.14750e+02 282.453 9.52956e-01  -4.31536e+00 0.00000e+00 0.00000e+00 6.84167e+01 282.453 4.63334e+01 102.453 0.8779 
1 1 1 -15 13  4  o 13 1.39146e+01 1.64002e+00 2.02612e+02 64.104  9.33151e+00  1.92209e+01  0.00000e+00 0.00000e+00 3.15143e+02 64.104  1.12531e+02 64.104  0.9763 
1 1 1 -15 13  5  o 6  1.54162e+01 1.55880e+00 2.22791e+02 234.002 -1.66178e+01 -2.28743e+01 0.00000e+00 0.00000e+00 3.53765e+02 234.002 1.30974e+02 234.002 0.9822 
1 1 1 -15 13  6  o 12 3.87672e+00 1.77715e+00 3.26005e+01 88.010  3.43138e-02  9.87667e-01  0.00000e+00 0.00000e+00 3.26186e+01 88.010  1.81389e-02 88.010  0.4422 
1 1 1 -15 13  7  o 12 1.81740e+01 1.33409e+00 2.72284e+02 221.897 -3.77649e+01 -3.38809e+01 0.00000e+00 0.00000e+00 4.11580e+02 221.897 1.39296e+02 221.897 0.9901 
1 1 1 -15 13  8  o 12 1.76530e+01 1.15730e+00 2.51960e+02 5.575   5.29933e+01  5.17272e+00  0.00000e+00 0.00000e+00 4.11909e+02 5.575   1.59949e+02 5.575   0.9906 
1 1 1 -15 13  9  o 7  4.46330e+00 1.44202e+00 9.42058e+01 244.867 -1.90806e+00 -4.06718e+00 0.00000e+00 0.00000e+00 5.47594e+01 244.867 3.94464e+01 64.867  0.8801 
1 1 1 -15 13  10 o 16 4.24248e+00 1.43283e+00 2.01405e+01 87.754  3.62986e-02  9.25668e-01  0.00000e+00 0.00000e+00 4.73018e+01 87.754  2.71613e+01 87.754  0.4197 
1 1 1 -15 13  11 o 8  4.48379e+00 1.44968e+00 1.06470e+02 46.319  3.94114e+00  4.12686e+00  0.00000e+00 0.00000e+00 4.74690e+01 46.319  5.90006e+01 226.319 0.9075 
1 1 1 -15 13  12 o 13 5.61244e+00 1.71500e+00 7.77622e+01 269.394 -4.56156e-02 -4.31193e+00 0.00000e+00 0.00000e+00 1.07676e+02 269.394 2.99134e+01 269.394 0.8745 
1 1 1 -15 13  13 f 0  6.79856e+00 1.99246e+00 1.19474e+02 68.194  2.78245e+00  6.95462e+00  0.00000e+00 0.00000e+00 1.19236e+02 68.194  2.38025e-01 248.194 0.9306 
1 1 1 -15 14  1  o 19 4.97423e+00 1.52005e+00 4.17930e+01 175.899 -1.59083e+00 1.14058e-01  0.00000e+00 0.00000e+00 7.57693e+01 175.899 3.39763e+01 175.899 0.6187 
1 1 1 -15 14  2  o 16 7.29211e+00 1.81132e+00 1.12428e+02 320.735 4.38899e+00  -3.58789e+00 0.00000e+00 0.00000e+00 1.40002e+02 320.735 2.75741e+01 320.735 0.9069 
1 1 1 -15 14  3  o 9  1.49252e+01 1.50400e+00 1.38844e+02 73.150  4.67157e+00  1.54248e+01  0.00000e+00 0.00000e+00 4.12484e+02 73.150  2.73640e+02 73.150  0.9685 
1 1 1 -15 14  4  o 4  5.56363e+00 2.17893e+00 1.08231e+02 243.105 -1.53926e+00 -3.03474e+00 0.00000e+00 0.00000e+00 6.90011e+01 243.105 3.92301e+01 63.105  0.8359 
1 1 1 -15 14  5  o 14 1.37152e+01 1.68523e+00 2.14369e+02 218.269 -1.78447e+01 -1.40772e+01 0.00000e+00 0.00000e+00 2.96253e+02 218.269 8.18835e+01 218.269 0.9777 
1 1 1 -15 14  6  o 2  9.34999e+00 2.03924e+00 1.95056e+02 63.308  5.40964e+00  1.07595e+01  0.00000e+00 0.00000e+00 1.45531e+02 63.308  4.95250e+01 243.308 0.9575 
1 1 1 -15 14  7  o 4  4.53412e+00 1.42745e+00 1.06971e+02 345.086 4.59686e+00  -1.22429e+00 0.00000e+00 0.00000e+00 4.59445e+01 345.086 6.10264e+01 165.086 0.8874 
1 1 1 -15 14  8  o 13 7.88745e+00 1.59507e+00 9.65887e+01 255.627 -1.75076e+00 -6.83213e+00 0.00000e+00 0.00000e+00 1.80722e+02 255.627 8.41334e+01 255.627 0.9261 
1 1 1 -15 14  9  o 17 5.54988e+00 1.65791e+00 6.40090e+01 357.622 3.33842e+00  -1.38655e-01 0.00000e+00 0.00000e+00 1.11166e+02 357.622 4.71572e+01 357.622 0.8324 
1 1 1 -15 14  10 o 12 6.54511e+00 1.76364e+00 5.03602e+01 339.930 2.91924e+00  -1.06654e+00 0.00000e+00 0.00000e+00 1.52338e+02 339.930 1.01978e+02 339.930 0.8177 
1 1 1 -15 14  11 o 17 5.21026e+00 1.63782e+00 7.17041e+01 62.602  1.86686e+00  3.60187e+00  0.00000e+00 0.00000e+00 9.89178e+01 62.602  2.72137e+01 62.602  0.8657 
1 1 1 -15 14  12 o 4  9.22531e+00 2.05528e+00 1.81568e+02 41.814  9.94834e+00  8.89935e+00  0.00000e+00 0.00000e+00 1.53635e+02 41.814  2.79332e+01 221.814 0.9618 
1 1 1 -15 15  1  o 3  4.35599e+00 1.38553e+00 1.70695e+02 37.785  4.95434e+00  3.84086e+00  0.00000e+00 0.00000e+00 1.82321e+01 217.785 1.88928e+02 217.785 0.9163 
1 1 1 -15 15  2  o 10 7.61249e+00 1.73432e+00 8.32236e+01 236.012 -2.53912e+00 -3.76614e+00 0.00000e+00 0.00000e+00 1.72927e+02 236.012 8.97033e+01 236.012 0.8816 
1 1 1 -15 15  3  o 18 1.02470e+01 1.74793e+00 1.23352e+02 312.119 5.89564e+00  -6.52043e+00 0.00000e+00 0.00000e+00 2.44526e+02 312.119 1.21174e+02 312.119 0.9413 
1 1 1 -15 15  4  o 7  1.13066e+01 1.76384e+00 2.24656e+02 105.230 -4.57430e+00 1.68016e+01  0.00000e+00 0.00000e+00 1.93673e+02 105.230 3.09829e+01 285.230 0.9708 
1 1 1 -15 15  5  o 3  9.78015e+00 1.95519e+00 1.07725e+02 65.846  3.00235e+00  6.69484e+00  0.00000e+00 0.00000e+00 2.38268e+02 65.846  1.30544e+02 65.846  0.9291 
1 1 1 -15 15  6  o 15 1.66810e+01 1.49174e+00 3.03973e+02 160.052 -4.15451e+01 1.50787e+01  0.00000e+00 0.00000e+00 3.23355e+02 160.052 1.93821e+01 160.052 0.9886 
1 1 1 -15 15  7  o 11 7.51813e+00 1.73987e+00 1.41737e+02 333.020 7.86126e+00  -4.00210e+00 0.00000e+00 0.00000e+00 1.27250e+02 333.020 1.44870e+01 153.020 0.9415 
1 1 1 -15 15  8  o 19 4.84007e+00 1.48916e+00 8.23838e+01 115.260 -1.67050e+00 3.54039e+00  0.00000e+00 0.00000e+00 7.56600e+01 115.260 6.72380e+00 295.260 0.8602 
1 1 1 -15 15  9  o 7  8.07416e+00 1.75435e+00 8.12263e+01 232.972 -3.52136e+00 -4.66823e+00 0.00000e+00 0.00000e+00 1.97360e+02 232.972 1.16134e+02 232.972 0.9099 
1 1 1 -15 15  10 o 19 6.54080e+00 1.78968e+00 1.48191e+02 353.302 8.92654e+00  -1.04829e+00 0.00000e+00 0.00000e+00 8.53196e+01 353.302 6.28716e+01 173.302 0.9426 
1 1 1 -15 15  11 o 18 4.51907e+00 1.46778e+00 4.19194e+01 61.830  1.08889e+00  2.03334e+00  0.00000e+00 0.00000e+00 8.49565e+01 61.830  4.30370e+01 61.830  0.7422 
1 1 1 -15 15  12 o 11 7.97452e+00 2.10420e+00 1.87915e+02 316.007 8.55725e+00  -8.26157e+00 0.00000e+00 0.00000e+00 1.00387e+02 316.007 8.75281e+01 136.007 0.9570 
1 1 1 -15 16  1  o 1  1.34658e+01 1.60310e+00 2.37953e+02 283.177 5.57142e+00  -2.37966e+01 0.00000e+00 0.00000e+00 2.65732e+02 283.177 2.77784e+01 283.177 0.9793 
1 1 1 -15 16  2  o 11 5.19623e+00 1.58272e+00 6.64404e+01 209.482 -2.31251e+00 -1.30741e+00 0.00000e+00 0.00000e+00 8.84552e+01 209.482 2.20148e+01 209.482 0.7810 
1 1 1 -15 16  3  o 19 1.55207e+01 1.41547e+00 2.80143e+02 216.670 -2.93895e+01 -2.18822e+01 0.00000e+00 0.00000e+00 3.03670e+02 216.670 2.35268e+01 216.670 0.9863 
1 1 1 -15 16  4  o 5  1.65571e+01 1.48759e+00 2.06329e+02 136.169 -1.91244e+01 1.83592e+01  0.00000e+00 0.00000e+00 4.12611e+02 136.169 2.06282e+02 136.169 0.9810 
1 1 1 -15 16  5  o 2  9.88927e+00 1.93432e+00 1.51705e+02 274.774 8.78660e-01  -1.05211e+01 0.00000e+00 0.00000e+00 2.06521e+02 274.774 5.48157e+01 274.774 0.9514 
1 1 1 -15 16  6  o 5  8.44109e+00 2.17577e+00 2.17965e+02 9.379   1.11707e+01  1.84505e+00  0.00000e+00 0.00000e+00 8.85968e+01 9.379   1.29369e+02 189.379 0.9548 
1 1 1 -15 16  7  o 18 6.99159e+00 1.65590e+00 6.85747e+01 44.327  2.97154e+00  2.90252e+00  0.00000e+00 0.00000e+00 1.62355e+02 44.327  9.37803e+01 44.327  0.8692 
1 1 1 -15 16  8  o 16 5.33316e+00 1.49176e+00 9.32412e+01 155.178 -4.42275e+00 2.04561e+00  0.00000e+00 0.00000e+00 8.70081e+01 155.178 6.23314e+00 335.178 0.8903 
1 1 1 -15 16  9  o 14 1.31006e+01 1.52035e+00 2.55037e+02 324.672 2.79072e+01  -1.97801e+01 0.00000e+00 0.00000e+00 2.34388e+02 324.672 2.06495e+01 144.672 0.9853 
1 1 1 -15 16  10 o 11 1.27537e+01 1.85616e+00 2.63558e+02 149.631 -2.57848e+01 1.51091e+01  0.00000e+00 0.00000e+00 2.11305e+02 149.631 5.22529e+01 329.631 0.9831 
1 1 1 -15 16  11 o 14 6.31075e+00 1.81779e+00 7.58939e+01 297.342 2.11704e+00  -4.09426e+00 0.00000e+00 0.00000e+00 1.34993e+02 297.342 5.90990e+01 297.342 0.8835 
1 1 1 -15 16  12 o 7  5.28582e+00 1.64939e+00 7.00878e+01 294.790 1.65636e+00  -3.58626e+00 0.00000e+00 0.00000e+00 1.01951e+02 294.790 3.18631e+01 294.790 0.8616 
1 1 1 -15 17  1  o 14 1.16810e+01 1.63427e+00 1.72754e+02 128.389 -9.19718e+00 1.16084e+01  0.00000e+00 0.00000e+00 2.58041e+02 128.389 8.52870e+01 128.389 0.9656 
1 1 1 -15 17  2  o 5  1.41093e+01 1.51112e+00 2.64998e+02 358.512 2.89822e+01  -7.52792e-01 0.00000e+00 0.00000e+00 2.64131e+02 358.512 8.67803e-01 178.512 0.9826 
1 1 1 -15 17  3  o 17 7.56278e+00 1.75081e+00 1.16623e+02 189.001 -6.26720e+00 -9.92725e-01 0.00000e+00 0.00000e+00 1.47981e+02 189.001 3.13584e+01 189.001 0.9174 
1 1 1 -15 17  4  o 11 1.23525e+01 1.70967e+00 2.90186e+02 17.695  2.53168e+01  8.07736e+00  0.00000e+00 0.00000e+00 1.71577e+02 17.695  1.18610e+02 197.695 0.9810 
1 1 1 -15 17  5  o 8  4.51566e+00 1.86791e+00 1.18807e+02 352.288 3.87068e+00  -5.24131e-01 0.00000e+00 0.00000e+00 2.90144e+01 352.288 8.97925e+01 172.288 0.8598 
1 1 1 -15 17  6  o 6  5.50993e+00 1.99088e+00 9.65432e+01 13.115  3.68454e+00  8.58454e-01  0.00000e+00 0.00000e+00 8.25724e+01 13.115  1.39708e+01 193.115 0.8546 
1 1 1 -15 17  7  o 13 8.32079e+00 1.71267e+00 1.65383e+02 299.646 5.84868e+00  -1.02764e+01 0.00000e+00 0.00000e+00 1.37117e+02 299.646 2.82663e+01 119.646 0.9567 
1 1 1 -15 17  8  o 17 1.10604e+01 1.54112e+00 2.10317e+02 152.376 -1.94334e+01 1.01701e+01  0.00000e+00 0.00000e+00 1.99834e+02 152.376 1.04832e+01 332.376 0.9769 
1 1 1 -15 17  9  o 15 4.78140e+00 1.49704e+00 1.34623e+02 46.870  4.56522e+00  4.87336e+00  0.00000e+00 0.00000e+00 3.24814e+01 46.870  1.02141e+02 226.870 0.9217 
1 1 1 -15 17  10 o 12 4.08889e+00 1.34694e+00 5.63340e+01 347.899 2.63771e+00  -5.65505e-01 0.00000e+00 0.00000e+00 6.52059e+01 347.899 8.87196e+00 347.899 0.7849 
1 1 1 -15 17  11 o 7  5.19273e+00 1.59011e+00 7.75332e+01 289.583 1.45747e+00  -4.09699e+00 0.00000e+00 0.00000e+00 9.44625e+01 289.583 1.69293e+01 289.583 0.8757 
1 1 1 -15 17  12 o 4  5.64240e+00 1.72429e+00 8.24191e+01 202.671 -4.40189e+00 -1.83876e+00 0.00000e+00 0.00000e+00 1.06799e+02 202.671 2.43799e+01 202.671 0.8878 
1 1 1 -15 18  1  o 14 7.07575e+00 1.69138e+00 1.36427e+02 320.423 5.31549e+00  -4.39370e+00 0.00000e+00 0.00000e+00 1.13362e+02 320.423 2.30642e+01 140.423 0.9244 
1 1 1 -15 18  2  o 18 6.96185e+00 1.76800e+00 8.38831e+01 166.125 -3.90627e+00 9.64905e-01  0.00000e+00 0.00000e+00 1.45791e+02 166.125 6.19079e+01 166.125 0.8644 
1 1 1 -15 18  3  o 9  1.51048e+01 1.35009e+00 2.36234e+02 291.836 1.15012e+01  -2.87029e+01 0.00000e+00 0.00000e+00 3.30404e+02 291.836 9.41702e+01 291.836 0.9837 
1 1 1 -15 18  4  f 0  8.26820e+00 1.76302e+00 8.70226e+01 107.127 -1.52979e+00 4.96440e+00  0.00000e+00 0.00000e+00 1.95806e+02 107.127 1.08783e+02 107.127 0.8977 
1 1 1 -15 18  5  o 17 1.12767e+01 1.62124e+00 1.32136e+02 45.635  8.86635e+00  9.06496e+00  0.00000e+00 0.00000e+00 2.79884e+02 45.635  1.47748e+02 45.635  0.9597 
1 1 1 -15 18  6  o 4  3.45807e+00 1.60134e+00 1.13449e+02 15.410  3.31591e+00  9.13989e-01  0.00000e+00 0.00000e+00 3.24371e+00 195.410 1.16693e+02 195.410 0.8379 
1 1 1 -15 18  7  o 3  1.14811e+01 1.48969e+00 2.40512e+02 208.514 -2.35889e+01 -1.28151e+01 0.00000e+00 0.00000e+00 1.87530e+02 208.514 5.29811e+01 28.514  0.9812 
1 1 1 -15 18  8  o 6  4.76721e+00 1.47918e+00 5.50794e+01 160.273 -2.41006e+00 8.64207e-01  0.00000e+00 0.00000e+00 8.45038e+01 160.273 2.94244e+01 160.273 0.7714 
1 1 1 -15 18  9  o 8  1.01376e+01 1.60280e+00 2.46016e+02 14.929  2.35059e+01  6.26733e+00  0.00000e+00 0.00000e+00 1.30358e+02 14.929  1.15658e+02 194.929 0.9792 
1 1 1 -15 18  10 o 13 9.62090e+00 1.91050e+00 1.71545e+02 196.015 -1.31978e+01 -3.78809e+00 0.00000e+00 0.00000e+00 1.79261e+02 196.015 7.71691e+00 196.015 0.9629 
1 1 1 -15 18  11 o 11 8.23683e+00 1.76801e+00 1.72661e+02 52.227  8.38221e+00  1.08166e+01  0.00000e+00 0.00000e+00 1.27264e+02 52.227  4.53968e+01 232.226 0.9627 
1 1 1 -15 18  12 o 11 5.98199e+00 1.83905e+00 6.13072e+01 34.786  2.86159e+00  1.98785e+00  0.00000e+00 0.00000e+00 1.28558e+02 34.786  6.72508e+01 34.786  0.8403 
1 1 1 -15 19  1  o 6  1.43439e+01 1.17807e+00 2.58048e+02 293.781 1.33322e+01  -3.02546e+01 0.00000e+00 0.00000e+00 2.81384e+02 293.781 2.33361e+01 293.781 0.9848 
1 1 1 -15 19  2  o 16 8.05318e+00 1.75289e+00 1.24697e+02 70.695  2.38722e+00  6.81484e+00  0.00000e+00 0.00000e+00 1.60481e+02 70.695  3.57843e+01 70.695  0.9279 
1 1 1 -15 19  3  o 10 1.54368e+01 1.45436e+00 2.67172e+02 318.032 2.41842e+01  -2.17509e+01 0.00000e+00 0.00000e+00 3.12368e+02 318.032 4.51962e+01 318.032 0.9845 
1 1 1 -15 19  4  o 10 1.03267e+01 1.57040e+00 2.23282e+02 214.212 -1.56190e+01 -1.06195e+01 0.00000e+00 0.00000e+00 1.59629e+02 214.212 6.36530e+01 34.212  0.9732 
1 1 1 -15 19  5  f 0  1.52711e+01 1.45010e+00 2.58210e+02 350.388 3.61398e+01  -6.12044e+00 0.00000e+00 0.00000e+00 3.15158e+02 350.388 5.69487e+01 350.388 0.9863 
1 1 1 -15 19  6  o 1  1.49995e+01 1.51995e+00 2.21599e+02 270.426 2.20023e-01  -2.95610e+01 0.00000e+00 0.00000e+00 3.39147e+02 270.426 1.17549e+02 270.426 0.9829 
1 1 1 -15 19  7  o 14 1.11990e+01 1.54162e+00 3.04694e+02 124.012 -1.74187e+01 2.58121e+01  0.00000e+00 0.00000e+00 1.13923e+02 124.012 1.90770e+02 304.012 0.9838 
1 1 1 -15 19  8  o 2  4.57481e+00 1.40560e+00 9.10266e+01 71.752  1.45191e+00  4.40348e+00  0.00000e+00 0.00000e+00 6.25044e+01 71.752  2.85221e+01 251.752 0.8842 
1 1 1 -15 19  9  o 15 3.58867e+00 1.25518e+00 7.11305e+01 241.174 -1.46935e+00 -2.66993e+00 0.00000e+00 0.00000e+00 3.95410e+01 241.174 3.15896e+01 61.174  0.8134 
1 1 1 -15 19  10 o 6  1.32279e+01 1.54567e+00 2.52076e+02 8.400   3.42259e+01  5.05384e+00  0.00000e+00 0.00000e+00 2.41534e+02 8.400   1.05416e+01 188.400 0.9854 
1 1 1 -15 19  11 o 8  6.60677e+00 1.78668e+00 5.24544e+01 27.812  2.95005e+00  1.55618e+00  0.00000e+00 0.00000e+00 1.55440e+02 27.812  1.02986e+02 27.812  0.8320 
1 1 1 -15 19  12 o 9  7.41463e+00 1.86568e+00 1.91857e+02 112.656 -5.11287e+00 1.22494e+01  0.00000e+00 0.00000e+00 7.74331e+01 112.656 1.14424e+02 292.656 0.9616 
1 1 1 -15 20  1  o 7  7.76673e+00 1.55947e+00 9.39153e+01 272.380 2.38788e-01  -5.74533e+00 0.00000e+00 0.00000e+00 1.75475e+02 272.380 8.15595e+01 272.380 0.9083 
1 1 1 -15 20  2  o 16 5.64660e+00 1.62367e+00 1.03652e+02 182.975 -4.46701e+00 -2.32192e-01 0.00000e+00 0.00000e+00 8.58669e+01 182.975 1.77856e+01 2.976   0.8795 
1 1 1 -15 20  3  o 7  5.24693e+00 1.58708e+00 1.09126e+02 146.085 -3.52948e+00 2.37306e+00  0.00000e+00 0.00000e+00 6.54571e+01 146.085 4.36689e+01 326.085 0.8726 
1 1 1 -15 20  4  o 3  5.93745e+00 1.62444e+00 7.77889e+01 248.576 -1.34458e+00 -3.42673e+00 0.00000e+00 0.00000e+00 1.14505e+02 248.576 3.67156e+01 248.576 0.8500 
1 1 1 -15 20  5  o 8  1.40051e+01 1.50982e+00 3.21709e+02 87.547  1.73605e+00  4.05243e+01  0.00000e+00 0.00000e+00 2.04809e+02 87.547  1.16900e+02 267.547 0.9876 
1 1 1 -15 20  6  o 16 2.56000e+01 1.34312e+00 4.01479e+02 198.286 -9.48464e+01 -3.13420e+01 0.00000e+00 0.00000e+00 5.67231e+02 198.286 1.65752e+02 198.286 0.9950 
1 1 1 -15 20  7  o 11 8.34442e+00 1.63553e+00 1.60531e+02 102.458 -2.50572e+00 1.13418e+01  0.00000e+00 0.00000e+00 1.42529e+02 102.458 1.80023e+01 282.458 0.9559 
1 1 1 -15 20  8  o 19 7.33104e+00 1.67193e+00 1.05851e+02 92.498  -3.20835e-01 7.35552e+00  0.00000e+00 0.00000e+00 1.52730e+02 92.498  4.68786e+01 92.498  0.9294 
1 1 1 -15 20  9  o 18 5.36348e+00 1.56908e+00 1.30616e+02 338.332 6.65202e+00  -2.64279e+00 0.00000e+00 0.00000e+00 5.79220e+01 338.332 7.26941e+01 158.332 0.9273 
1 1 1 -15 20  10 o 15 6.83818e+00 1.70618e+00 1.13075e+02 152.065 -6.73567e+00 3.57167e+00  0.00000e+00 0.00000e+00 1.28221e+02 152.065 1.51466e+01 152.065 0.9319 
1 1 1 -15 20  11 o 12 5.48903e+00 1.63128e+00 7.80284e+01 140.165 -3.50216e+00 2.92148e+00  0.00000e+00 0.00000e+00 1.05079e+02 140.165 2.70505e+01 140.165 0.8821 
1 1 1 -15 20  12 o 4  5.58762e+00 1.66473e+00 1.16505e+02 312.800 4.76135e+00  -5.14170e+00 0.00000e+00 0.00000e+00 7.88337e+01 312.800 3.76715e+01 132.800 0.9256 
1 1 1 -15 21  1  o 4  7.12812e+00 1.54294e+00 1.10208e+02 263.239 -7.34128e-01 -6.19249e+00 0.00000e+00 0.00000e+00 1.39081e+02 263.239 2.88729e+01 263.239 0.9159 
1 1 1 -15 21  2  o 3  8.45087e+00 1.73083e+00 1.89495e+02 222.265 -8.25700e+00 -7.50420e+00 0.00000e+00 0.00000e+00 1.18167e+02 222.265 7.13283e+01 42.265  0.9541 
1 1 1 -15 21  3  o 3  8.65296e+00 1.68611e+00 1.54548e+02 325.505 8.26603e+00  -5.68004e+00 0.00000e+00 0.00000e+00 1.58478e+02 325.505 3.93026e+00 325.505 0.9488 
1 1 1 -15 21  4  o 16 2.10395e+01 1.16399e+00 3.33939e+02 240.620 -3.56912e+01 -6.33939e+01 0.00000e+00 0.00000e+00 4.62100e+02 240.620 1.28160e+02 240.620 0.9931 
1 1 1 -15 21  5  o 16 5.06097e+00 1.52857e+00 1.05684e+02 253.025 -1.39147e+00 -4.55839e+00 0.00000e+00 0.00000e+00 6.53189e+01 253.025 4.03650e+01 73.025  0.8877 
1 1 1 -15 21  6  o 19 6.97753e+00 2.07013e+00 1.80385e+02 342.069 8.25771e+00  -2.67213e+00 0.00000e+00 0.00000e+00 6.91736e+01 342.069 1.11212e+02 162.069 0.9405 
1 1 1 -15 21  7  o 3  2.11560e+01 1.18524e+00 3.45454e+02 57.646  4.41399e+01  6.96776e+01  0.00000e+00 0.00000e+00 4.53393e+02 57.646  1.07939e+02 57.646  0.9939 
1 1 1 -15 21  8  o 15 8.07693e+00 1.76255e+00 1.41825e+02 234.608 -5.95875e+00 -8.38719e+00 0.00000e+00 0.00000e+00 1.49399e+02 234.608 7.57436e+00 234.608 0.9501 
1 1 1 -15 21  9  o 6  6.99169e+00 1.75381e+00 9.23782e+01 55.966  3.29937e+00  4.88521e+00  0.00000e+00 0.00000e+00 1.48993e+02 55.966  5.66148e+01 55.966  0.9107 
1 1 1 -15 21  10 o 2  4.09162e+00 1.36305e+00 5.12940e+01 267.986 -9.04705e-02 -2.57258e+00 0.00000e+00 0.00000e+00 6.84334e+01 267.986 1.71394e+01 267.986 0.7728 
1 1 1 -15 21  11 o 2  4.83005e+00 1.55600e+00 1.01062e+02 157.926 -4.83191e+00 1.95947e+00  0.00000e+00 0.00000e+00 6.29820e+01 157.926 3.80803e+01 337.926 0.8981 
1 1 1 -15 21  12 o 1  6.01122e+00 1.71509e+00 1.38680e+02 326.403 7.22009e+00  -4.79647e+00 0.00000e+00 0.00000e+00 7.48155e+01 326.403 6.38641e+01 146.403 0.9404 
1 1 1 -15 22  1  o 19 1.32707e+01 1.24838e+00 1.93357e+02 185.206 -2.20078e+01 -2.00523e+00 0.00000e+00 0.00000e+00 3.01754e+02 185.206 1.08397e+02 185.206 0.9771 
1 1 1 -15 22  2  o 7  1.26107e+01 1.61343e+00 2.16315e+02 106.639 -5.73594e+00 1.91925e+01  0.00000e+00 0.00000e+00 2.52692e+02 106.639 3.63771e+01 106.639 0.9747 
1 1 1 -15 22  3  o 9  7.24954e+00 1.74725e+00 1.62103e+02 341.851 8.12438e+00  -2.66318e+00 0.00000e+00 0.00000e+00 9.75951e+01 341.851 6.45084e+01 161.851 0.9396 
1 1 1 -15 22  4  o 13 1.34994e+01 1.39364e+00 2.33060e+02 71.018  9.48961e+00  2.75878e+01  0.00000e+00 0.00000e+00 2.72320e+02 71.018  3.92600e+01 71.018  0.9827 
1 1 1 -15 22  5  o 10 6.35211e+00 1.59925e+00 1.93965e+02 62.755  4.66205e+00  9.05389e+00  0.00000e+00 0.00000e+00 3.56162e+01 62.755  1.58348e+02 242.755 0.9496 
1 1 1 -15 22  6  o 7  5.60339e+00 1.51304e+00 9.31338e+01 136.441 -3.52961e+00 3.35636e+00  0.00000e+00 0.00000e+00 9.65691e+01 136.441 3.43533e+00 136.441 0.8903 
1 1 1 -15 22  7  o 8  1.07590e+01 1.53088e+00 2.43754e+02 70.990  8.01986e+00  2.32782e+01  0.00000e+00 0.00000e+00 1.56579e+02 70.990  8.71755e+01 250.990 0.9795 
1 1 1 -15 22  8  o 10 8.41623e+00 1.64733e+00 1.91571e+02 23.018  1.40707e+01  5.97797e+00  0.00000e+00 0.00000e+00 1.17182e+02 23.018  7.43887e+01 203.018 0.9667 
1 1 1 -15 22  9  o 8  1.13824e+01 1.49923e+00 1.07050e+02 261.145 -1.90708e+00 -1.22414e+01 0.00000e+00 0.00000e+00 3.06612e+02 261.145 1.99562e+02 261.145 0.9588 
1 1 1 -15 22  10 o 4  4.97623e+00 1.52815e+00 9.01624e+01 179.260 -4.94282e+00 6.38735e-02  0.00000e+00 0.00000e+00 7.79034e+01 179.260 1.22590e+01 359.260 0.8920 
1 1 1 -15 22  11 o 5  7.14779e+00 1.82641e+00 1.32805e+02 9.069   8.44589e+00  1.34818e+00  0.00000e+00 0.00000e+00 1.21148e+02 9.069   1.16570e+01 189.069 0.9396 
1 1 1 -15 22  12 o 6  4.71418e+00 1.54756e+00 6.83568e+01 165.248 -3.66556e+00 9.65205e-01  0.00000e+00 0.00000e+00 8.38484e+01 165.248 1.54915e+01 165.248 0.8550 
1 1 1 -15 23  1  o 18 1.71206e+01 1.06461e+00 3.46317e+02 256.813 -1.25066e+01 -5.33765e+01 0.00000e+00 0.00000e+00 3.01365e+02 256.813 4.49517e+01 76.813  0.9908 
1 1 1 -15 23  2  o 1  8.47370e+00 1.74750e+00 1.11018e+02 59.996  3.42552e+00  5.93216e+00  0.00000e+00 0.00000e+00 1.87656e+02 59.996  7.66382e+01 59.996  0.9238 
1 1 1 -15 23  3  o 15 7.83197e+00 1.74364e+00 1.86709e+02 167.020 -1.07107e+01 2.46878e+00  0.00000e+00 0.00000e+00 9.79593e+01 167.020 8.87493e+01 347.020 0.9534 
1 1 1 -15 23  4  o 9  9.21753e+00 1.55256e+00 1.27322e+02 190.751 -1.01745e+01 -1.93192e+00 0.00000e+00 0.00000e+00 2.06399e+02 190.751 7.90765e+01 190.751 0.9504 
1 1 1 -15 23  5  f 0  1.49016e+01 1.38656e+00 3.46614e+02 37.798  3.74466e+01  2.90445e+01  0.00000e+00 0.00000e+00 2.14527e+02 37.798  1.32087e+02 217.798 0.9894 
1 1 1 -15 23  6  o 13 4.80056e+00 1.44470e+00 1.32248e+02 199.226 -5.82742e+00 -2.03229e+00 0.00000e+00 0.00000e+00 3.47650e+01 199.226 9.74826e+01 19.226  0.9149 
1 1 1 -15 23  7  o 1  5.80702e+00 1.42371e+00 4.24522e+01 48.622  1.68845e+00  1.91665e+00  0.00000e+00 0.00000e+00 1.27571e+02 48.622  8.51189e+01 48.622  0.7708 
1 1 1 -15 23  8  o 3  7.08469e+00 1.64185e+00 9.83227e+01 17.405  6.34911e+00  1.99035e+00  0.00000e+00 0.00000e+00 1.49396e+02 17.405  5.10731e+01 17.405  0.9215 
1 1 1 -15 23  9  o 1  6.83352e+00 1.74628e+00 1.11567e+02 287.599 2.02880e+00  -6.39600e+00 0.00000e+00 0.00000e+00 1.27281e+02 287.599 1.57138e+01 287.599 0.9221 
1 1 1 -15 23  10 o 12 5.05254e+00 1.52018e+00 4.66164e+01 271.213 5.51824e-02  -2.60566e+00 0.00000e+00 0.00000e+00 1.01833e+02 271.213 5.52161e+01 271.213 0.7761 
1 1 1 -15 23  11 o 15 8.83441e+00 1.85024e+00 1.04205e+02 193.735 -8.33187e+00 -2.03656e+00 0.00000e+00 0.00000e+00 2.09712e+02 193.735 1.05507e+02 193.735 0.9398 
1 1 1 -15 23  12 o 17 5.88545e+00 1.69747e+00 1.26715e+02 310.453 5.13328e+00  -6.02030e+00 0.00000e+00 0.00000e+00 8.09693e+01 310.453 4.57460e+01 130.453 0.9345 
1 1 1 -15 24  1  o 15 3.78981e+00 1.22827e+00 1.18250e+02 247.178 -1.61141e+00 -3.82933e+00 0.00000e+00 0.00000e+00 7.51339e+00 247.178 1.10737e+02 67.178  0.8692 
1 1 1 -15 24  2  o 17 5.60336e+00 1.57714e+00 6.26371e+01 171.169 -2.73843e+00 4.25447e-01  0.00000e+00 0.00000e+00 1.06575e+02 171.169 4.39383e+01 171.169 0.7915 
1 1 1 -15 24  3  o 13 3.77793e+00 1.26739e+00 9.56725e+01 307.381 2.07356e+00  -2.71398e+00 0.00000e+00 0.00000e+00 2.48125e+01 307.381 7.08601e+01 127.381 0.8366 
1 1 1 -15 24  4  o 10 3.81511e+00 1.24634e+00 8.52914e+01 102.506 -7.25788e-01 3.27206e+00  0.00000e+00 0.00000e+00 3.57561e+01 102.506 4.95353e+01 282.506 0.8330 
1 1 1 -15 24  5  o 7  6.62627e+00 1.63502e+00 7.99749e+01 84.361  4.48615e-01  4.54372e+00  0.00000e+00 0.00000e+00 1.42508e+02 84.361  6.25328e+01 84.361  0.8822 
1 1 1 -15 24  6  o 7  9.03598e+00 1.77580e+00 2.10992e+02 251.309 -4.95903e+00 -1.46586e+01 0.00000e+00 0.00000e+00 1.21281e+02 251.309 8.97111e+01 71.309  0.9671 
1 1 1 -15 24  7  o 3  4.36292e+00 1.34037e+00 4.03548e+01 31.887  1.62144e+00  1.00874e+00  0.00000e+00 0.00000e+00 7.27260e+01 31.887  3.23712e+01 31.887  0.6824 
1 1 1 -15 24  8  o 15 4.46292e+00 1.40466e+00 8.00760e+01 327.880 3.32416e+00  -2.08687e+00 0.00000e+00 0.00000e+00 6.56526e+01 327.880 1.44234e+01 147.880 0.8606 
1 1 1 -15 24  9  o 3  6.11013e+00 1.70396e+00 1.33145e+02 279.419 1.28826e+00  -7.76550e+00 0.00000e+00 0.00000e+00 8.31816e+01 279.419 4.99631e+01 99.419  0.9341 
1 1 1 -15 24  10 o 15 7.30684e+00 1.45766e+00 9.05202e+01 9.149   7.63474e+00  1.22963e+00  0.00000e+00 0.00000e+00 1.67528e+02 9.149   7.70081e+01 9.149   0.9329 
1 1 1 -15 24  11 o 1  5.13174e+00 1.55899e+00 8.11833e+01 151.754 -4.14118e+00 2.22476e+00  0.00000e+00 0.00000e+00 9.07138e+01 151.754 9.53050e+00 151.754 0.8860 
1 1 1 -15 24  12 o 3  6.47990e+00 1.65463e+00 1.43633e+02 9.502   1.01246e+01  1.69465e+00  0.00000e+00 0.00000e+00 8.88033e+01 9.502   5.48294e+01 189.502 0.9500 
1 1 1 -15 25  1  o 5  1.68573e+01 1.08727e+00 3.38165e+02 209.595 -5.08483e+01 -2.88800e+01 0.00000e+00 0.00000e+00 2.99839e+02 209.595 3.83255e+01 29.595  0.9914 
1 1 1 -15 25  2  o 10 9.57724e+00 1.66333e+00 1.62519e+02 155.354 -1.10681e+01 5.07810e+00  0.00000e+00 0.00000e+00 1.87502e+02 155.354 2.49833e+01 155.354 0.9580 
1 1 1 -15 25  3  f 0  1.08050e+01 1.52460e+00 2.28178e+02 5.126   2.13387e+01  1.91421e+00  0.00000e+00 0.00000e+00 1.73975e+02 5.126   5.42032e+01 185.126 0.9764 
1 1 1 -15 25  4  o 1  5.53231e+00 1.46361e+00 1.16427e+02 15.462  5.72390e+00  1.58333e+00  0.00000e+00 0.00000e+00 7.56216e+01 15.462  4.08051e+01 195.462 0.9114 
1 1 1 -15 25  5  o 19 1.16620e+01 1.42924e+00 2.16871e+02 58.484  1.26926e+01  2.06999e+01  0.00000e+00 0.00000e+00 2.17691e+02 58.484  8.20706e-01 58.484  0.9792 
1 1 1 -15 25  6  o 11 8.09549e+00 1.48838e+00 1.09785e+02 22.258  8.00789e+00  3.27736e+00  0.00000e+00 0.00000e+00 1.79627e+02 22.258  6.98413e+01 22.258  0.9403 
1 1 1 -15 25  7  o 8  5.06362e+00 1.41091e+00 8.25213e+01 195.324 -4.13225e+00 -1.13235e+00 0.00000e+00 0.00000e+00 8.54992e+01 195.324 2.97794e+00 195.324 0.8736 
1 1 1 -15 25  8  f 0  1.35225e+01 1.23942e+00 2.16264e+02 75.409  8.84846e+00  3.39925e+01  0.00000e+00 0.00000e+00 2.89436e+02 75.409  7.31719e+01 75.409  0.9857 
1 1 1 -15 25  9  o 1  4.88896e+00 1.46844e+00 1.04504e+02 237.897 -3.04220e+00 -4.84912e+00 0.00000e+00 0.00000e+00 6.37057e+01 237.897 4.07985e+01 57.897  0.9079 
1 1 1 -15 25  10 o 10 6.25564e+00 1.63584e+00 1.35322e+02 167.749 -8.33230e+00 1.80929e+00  0.00000e+00 0.00000e+00 8.71229e+01 167.749 4.81988e+01 347.749 0.9394 
1 1 1 -15 25  11 o 19 5.12184e+00 1.54546e+00 6.54034e+01 120.132 -1.89688e+00 3.26807e+00  0.00000e+00 0.00000e+00 1.00048e+02 120.132 3.46448e+01 120.132 0.8544 
1 1 1 -15 25  12 o 17 4.70871e+00 1.46946e+00 7.98242e+01 334.768 4.39517e+00  -2.07123e+00 0.00000e+00 0.00000e+00 7.84058e+01 334.768 1.41837e+00 154.768 0.8900 
1 1 1 -15 26  1  o 6  2.18140e+01 9.93693e-01 3.91490e+02 253.226 -2.62481e+01 -8.70782e+01 0.00000e+00 0.00000e+00 4.36618e+02 253.226 4.51279e+01 253.226 0.9945 
1 1 1 -15 26  2  o 13 1.89470e+01 1.28138e+00 3.69745e+02 81.511  9.71091e+00  6.50608e+01  0.00000e+00 0.00000e+00 3.47495e+02 81.511  2.22500e+01 261.511 0.9924 
1 1 1 -15 26  3  o 16 1.46572e+01 1.61989e+00 2.46178e+02 329.805 2.65730e+01  -1.54631e+01 0.00000e+00 0.00000e+00 3.03350e+02 329.805 5.71723e+01 329.805 0.9836 
1 1 1 -15 26  4  o 1  8.91543e+00 1.49317e+00 1.68007e+02 98.108  -1.91705e+00 1.34567e+01  0.00000e+00 0.00000e+00 1.58807e+02 98.108  9.19937e+00 278.108 0.9625 
1 1 1 -15 26  5  f 0  6.69399e+00 1.58479e+00 4.57767e+01 251.578 -8.32493e-01 -2.49937e+00 0.00000e+00 0.00000e+00 1.52616e+02 251.578 1.06839e+02 251.578 0.7789 
1 1 1 -15 26  6  o 4  4.22704e+00 1.31870e+00 7.17853e+01 247.939 -1.21590e+00 -3.00034e+00 0.00000e+00 0.00000e+00 6.09688e+01 247.939 1.08165e+01 67.939  0.8261 
1 1 1 -15 26  7  o 14 6.27105e+00 1.53031e+00 2.03815e+02 174.533 -1.22028e+01 1.16787e+00  0.00000e+00 0.00000e+00 2.44196e+01 174.533 1.79396e+02 354.533 0.9583 
1 1 1 -15 26  8  o 3  5.75441e+00 1.53577e+00 1.17449e+02 55.585  3.86123e+00  5.63601e+00  0.00000e+00 0.00000e+00 8.41854e+01 55.585  3.32635e+01 235.585 0.9236 
1 1 1 -15 26  9  o 11 6.31919e+00 1.53815e+00 7.01243e+01 171.994 -4.47282e+00 6.29111e-01  0.00000e+00 0.00000e+00 1.40807e+02 171.994 7.06826e+01 171.994 0.8808 
1 1 1 -15 26  10 o 18 5.53994e+00 1.52336e+00 6.25148e+01 26.906  3.33374e+00  1.69177e+00  0.00000e+00 0.00000e+00 1.16279e+02 26.906  5.37642e+01 26.906  0.8527 
1 1 1 -15 26  11 o 11 3.40417e+00 1.17980e+00 7.28232e+01 326.155 2.94649e+00  -1.97588e+00 0.00000e+00 0.00000e+00 3.57340e+01 326.155 3.70892e+01 146.155 0.8436 
1 1 1 -15 26  12 o 6  5.27592e+00 1.57051e+00 9.33729e+01 268.046 -2.01853e-01 -5.91622e+00 0.00000e+00 0.00000e+00 8.81064e+01 268.046 5.26648e+00 88.046  0.9111 
1 1 1 -15 27  1  o 16 6.76938e+00 1.57036e+00 1.37893e+02 278.772 1.20925e+00  -7.83705e+00 0.00000e+00 0.00000e+00 1.03605e+02 278.772 3.42878e+01 98.772  0.9346 
1 1 1 -15 27  2  o 8  7.73941e+00 1.74719e+00 9.68519e+01 97.059  -7.14206e-01 5.76799e+00  0.00000e+00 0.00000e+00 1.71590e+02 97.059  7.47380e+01 97.059  0.9093 
1 1 1 -15 27  3  o 7  1.50412e+01 1.40252e+00 2.50308e+02 10.246  3.53042e+01  6.38151e+00  0.00000e+00 0.00000e+00 3.14930e+02 10.246  6.46217e+01 10.246  0.9860 
1 1 1 -15 27  4  o 15 1.43584e+01 1.19384e+00 2.88345e+02 174.887 -4.14603e+01 3.70982e+00  0.00000e+00 0.00000e+00 2.51859e+02 174.887 3.64863e+01 354.887 0.9879 
1 1 1 -15 27  5  o 15 1.05859e+01 1.42757e+00 2.98033e+02 324.129 2.49962e+01  -1.80751e+01 0.00000e+00 0.00000e+00 9.81747e+01 324.129 1.99858e+02 144.129 0.9837 
1 1 1 -15 27  6  o 9  5.24430e+00 1.45037e+00 6.47321e+01 46.254  2.24793e+00  2.34852e+00  0.00000e+00 0.00000e+00 1.00126e+02 46.254  3.53942e+01 46.254  0.8270 
1 1 1 -15 27  7  o 10 7.31788e+00 1.51916e+00 1.57567e+02 338.880 1.02619e+01  -3.96392e+00 0.00000e+00 0.00000e+00 1.07387e+02 338.880 5.01799e+01 158.880 0.9534 
1 1 1 -15 27  8  o 12 4.56087e+00 1.37886e+00 6.85672e+01 52.036  2.14013e+00  2.74283e+00  0.00000e+00 0.00000e+00 7.67685e+01 52.036  8.20130e+00 52.036  0.8400 
1 1 1 -15 27  9  o 13 9.60856e+00 1.49333e+00 2.64091e+02 114.234 -1.08924e+01 2.41978e+01  0.00000e+00 0.00000e+00 9.30782e+01 114.234 1.71012e+02 294.234 0.9810 
1 1 1 -15 27  10 o 10 6.24406e+00 1.64175e+00 1.36998e+02 96.229  -9.78773e-01 8.96698e+00  0.00000e+00 0.00000e+00 8.58148e+01 96.229  5.11836e+01 276.229 0.9428 
1 1 1 -15 27  11 o 8  4.34519e+00 1.39001e+00 9.45801e+01 308.840 3.34420e+00  -4.15344e+00 0.00000e+00 0.00000e+00 5.33389e+01 308.840 4.12412e+01 128.840 0.9006 
1 1 1 -15 27  12 o 9  3.96373e+00 1.28113e+00 1.20919e+02 303.083 3.84614e+00  -5.90388e+00 0.00000e+00 0.00000e+00 1.76511e+01 303.083 1.03268e+02 123.083 0.9260 
1 1 1 -15 28  1  o 11 5.49854e+00 1.39025e+00 1.21481e+02 276.783 7.33025e-01  -6.16240e+00 0.00000e+00 0.00000e+00 7.06362e+01 276.783 5.08449e+01 96.784  0.9154 
1 1 1 -15 28  2  o 17 1.21606e+01 1.53609e+00 2.80357e+02 26.018  2.72734e+01  1.33125e+01  0.00000e+00 0.00000e+00 1.75746e+02 26.018  1.04611e+02 206.018 0.9834 
1 1 1 -15 28  3  o 8  4.66118e+00 1.40512e+00 6.24371e+01 85.189  2.31898e-01  2.75546e+00  0.00000e+00 0.00000e+00 7.80813e+01 85.189  1.56442e+01 85.189  0.7910 
1 1 1 -15 28  4  o 18 1.54336e+01 1.35745e+00 2.58609e+02 249.899 -1.36869e+01 -3.73992e+01 0.00000e+00 0.00000e+00 3.21683e+02 249.899 6.30737e+01 249.899 0.9874 
1 1 1 -15 28  5  o 4  4.40257e+00 1.34637e+00 5.94242e+01 192.838 -2.60019e+00 -5.92568e-01 0.00000e+00 0.00000e+00 7.15623e+01 192.838 1.21381e+01 192.838 0.7820 
1 1 1 -15 28  6  o 9  1.69404e+01 1.19843e+00 3.42585e+02 114.356 -2.68378e+01 5.92857e+01  0.00000e+00 0.00000e+00 2.96371e+02 114.356 4.62135e+01 294.356 0.9923 
1 1 1 -15 28  7  o 1  8.60248e+00 1.46951e+00 7.79930e+01 325.705 5.94063e+00  -4.05170e+00 0.00000e+00 0.00000e+00 2.25020e+02 325.705 1.47027e+02 325.705 0.9276 
1 1 1 -15 28  8  o 9  3.50470e+00 1.17212e+00 7.00741e+01 77.064  6.88715e-01  2.99855e+00  0.00000e+00 0.00000e+00 3.83400e+01 77.064  3.17340e+01 257.065 0.8155 
1 1 1 -15 28  9  o 11 1.14755e+01 1.36644e+00 2.14667e+02 115.762 -1.29667e+01 2.68681e+01  0.00000e+00 0.00000e+00 2.12789e+02 115.762 1.87788e+00 295.762 0.9831 
1 1 1 -15 28  10 o 7  9.37362e+00 1.49533e+00 1.85790e+02 352.440 2.00230e+01  -2.65744e+00 0.00000e+00 0.00000e+00 1.60060e+02 352.440 2.57300e+01 172.440 0.9749 
1 1 1 -15 28  11 o 2  8.99460e+00 1.65495e+00 1.50227e+02 174.830 -1.38292e+01 1.25133e+00  0.00000e+00 0.00000e+00 1.77271e+02 174.830 2.70439e+01 174.830 0.9633 
1 1 1 -15 28  12 o 1  9.27495e+00 1.62864e+00 1.43586e+02 181.264 -1.52728e+01 -3.37081e-01 0.00000e+00 0.00000e+00 1.94871e+02 181.264 5.12845e+01 181.264 0.9667 
1 1 1 -15 29  1  o 1  6.59135e+00 1.47297e+00 1.40303e+02 52.875  5.13250e+00  6.78024e+00  0.00000e+00 0.00000e+00 9.59597e+01 52.875  4.43435e+01 232.875 0.9392 
1 1 1 -15 29  2  o 1  6.50221e+00 1.69559e+00 5.49932e+01 235.034 -1.67595e+00 -2.39653e+00 0.00000e+00 0.00000e+00 1.44440e+02 235.034 8.94464e+01 235.034 0.8042 
1 1 1 -15 29  3  o 17 8.53095e+00 1.63572e+00 4.30259e+01 24.302  2.81843e+00  1.27269e+00  0.00000e+00 0.00000e+00 2.22451e+02 24.302  1.79425e+02 24.302  0.8166 
1 1 1 -15 29  4  o 4  5.29515e+00 1.56386e+00 6.11399e+01 256.677 -6.67248e-01 -2.81760e+00 0.00000e+00 0.00000e+00 1.00554e+02 256.677 3.94145e+01 256.677 0.8020 
1 1 1 -15 29  5  o 14 9.61357e+00 1.37976e+00 1.97012e+02 137.958 -1.41500e+01 1.27597e+01  0.00000e+00 0.00000e+00 1.58995e+02 137.958 3.80166e+01 317.957 0.9734 
1 1 1 -15 29  6  o 5  9.04484e+00 1.53710e+00 1.70007e+02 288.727 4.61870e+00  -1.36241e+01 0.00000e+00 0.00000e+00 1.61598e+02 288.727 8.40901e+00 108.727 0.9646 
1 1 1 -15 29  7  o 11 4.74238e+00 1.37379e+00 9.04895e+01 32.668  4.09644e+00  2.62668e+00  0.00000e+00 0.00000e+00 6.98047e+01 32.668  2.06848e+01 212.668 0.8902 
1 1 1 -15 29  8  o 9  5.19496e+00 1.46985e+00 5.75043e+01 157.584 -2.91133e+00 1.20095e+00  0.00000e+00 0.00000e+00 1.04159e+02 157.584 4.66545e+01 157.584 0.8204 
1 1 1 -15 29  9  o 6  1.19913e+01 1.33427e+00 1.54738e+02 54.192  1.28082e+01  1.77539e+01  0.00000e+00 0.00000e+00 2.89077e+02 54.192  1.34340e+02 54.192  0.9769 
1 1 1 -15 29  10 o 16 7.51248e+00 1.56889e+00 1.60543e+02 354.641 1.36525e+01  -1.28054e+00 0.00000e+00 0.00000e+00 1.13175e+02 354.641 4.73674e+01 174.642 0.9628 
1 1 1 -15 29  11 o 12 1.07276e+01 1.56637e+00 1.79105e+02 191.883 -2.04344e+01 -4.30007e+00 0.00000e+00 0.00000e+00 2.16516e+02 191.883 3.74105e+01 191.883 0.9758 
1 1 1 -15 29  12 o 10 7.16677e+00 1.62776e+00 1.06473e+02 205.469 -8.01092e+00 -3.81568e+00 0.00000e+00 0.00000e+00 1.48309e+02 205.469 4.18355e+01 205.469 0.9418 
1 1 1 -15 30  1  o 13 1.11739e+01 1.30439e+00 1.39339e+02 314.007 1.08178e+01  -1.11993e+01 0.00000e+00 0.00000e+00 2.73139e+02 314.007 1.33800e+02 314.007 0.9673 
1 1 1 -15 30  2  o 4  1.18284e+01 1.55062e+00 1.87057e+02 159.091 -1.82166e+01 6.95934e+00  0.00000e+00 0.00000e+00 2.52290e+02 159.091 6.52328e+01 159.091 0.9740 
1 1 1 -15 30  3  o 1  5.04892e+00 1.47634e+00 8.81387e+01 291.397 1.42617e+00  -3.63975e+00 0.00000e+00 0.00000e+00 7.73059e+01 291.397 1.08328e+01 111.397 0.8599 
1 1 1 -15 30  4  o 3  6.45971e+00 1.63475e+00 1.31804e+02 215.285 -5.82183e+00 -4.11976e+00 0.00000e+00 0.00000e+00 9.61851e+01 215.285 3.56192e+01 35.285  0.9270 
1 1 1 -15 30  5  o 15 5.10171e+00 1.48178e+00 9.10317e+01 252.919 -1.33316e+00 -4.33852e+00 0.00000e+00 0.00000e+00 8.00358e+01 252.919 1.09959e+01 72.919  0.8815 
1 1 1 -15 30  6  o 12 1.27285e+01 1.26984e+00 1.64550e+02 14.809  2.28396e+01  6.03830e+00  0.00000e+00 0.00000e+00 3.08846e+02 14.809  1.44296e+02 14.809  0.9786 
1 1 1 -15 30  7  o 19 6.87091e+00 1.46120e+00 1.63034e+02 293.277 4.68516e+00  -1.08909e+01 0.00000e+00 0.00000e+00 8.65773e+01 293.277 7.64569e+01 113.277 0.9569 
1 1 1 -15 30  8  o 3  5.49700e+00 1.52182e+00 1.49439e+02 87.615  3.59252e-01  8.62703e+00  0.00000e+00 0.00000e+00 4.65715e+01 87.615  1.02867e+02 267.615 0.9402 
1 1 1 -15 30  9  o 3  4.44371e+00 1.34716e+00 1.00870e+02 144.583 -4.53136e+00 3.22223e+00  0.00000e+00 0.00000e+00 5.14721e+01 144.583 4.93977e+01 324.583 0.9049 
1 1 1 -15 30  10 o 1  5.55048e+00 1.53996e+00 8.76147e+01 67.231  2.09983e+00  5.00286e+00  0.00000e+00 0.00000e+00 1.01912e+02 67.231  1.42978e+01 67.231  0.9024 
1 1 1 -15 30  11 o 2  6.19033e+00 1.50341e+00 5.60995e+01 133.674 -2.81928e+00 2.95287e+00  0.00000e+00 0.00000e+00 1.46643e+02 133.674 9.05439e+01 133.674 0.8666 
1 1 1 -15 30  12 o 13 4.85184e+00 1.46911e+00 7.43671e+01 149.523 -4.18705e+00 2.46408e+00  0.00000e+00 0.00000e+00 8.86092e+01 149.523 1.42421e+01 149.523 0.8900 
1 1 1 -15 31  1  o 2  7.82232e+00 1.32792e+00 1.72228e+02 262.758 -1.67711e+00 -1.31979e+01 0.00000e+00 0.00000e+00 1.14807e+02 262.758 5.74208e+01 82.758  0.9617 
1 1 1 -15 31  2  o 15 6.21047e+00 1.43363e+00 1.21776e+02 38.068  5.34558e+00  4.18671e+00  0.00000e+00 0.00000e+00 9.68271e+01 38.068  2.49493e+01 218.068 0.9231 
1 1 1 -15 31  3  o 5  5.00433e+00 1.48419e+00 1.09896e+02 119.014 -2.49055e+00 4.49041e+00  0.00000e+00 0.00000e+00 6.10300e+01 119.014 4.88660e+01 299.014 0.8964 
1 1 1 -15 31  4  o 19 1.01889e+01 1.62327e+00 2.16964e+02 150.838 -1.69851e+01 9.47800e+00  0.00000e+00 0.00000e+00 1.60830e+02 150.838 5.61334e+01 330.838 0.9739 
1 1 1 -15 31  5  o 1  4.41596e+00 1.36078e+00 7.74833e+00 271.499 9.34053e-03  -3.56809e-01 0.00000e+00 0.00000e+00 2.17615e+01 271.499 1.40132e+01 271.499 0.1757 
1 1 1 -15 31  6  o 19 5.06424e+00 1.46667e+00 7.58737e+01 82.184  5.19664e-01  3.78599e+00  0.00000e+00 0.00000e+00 8.89198e+01 82.184  1.30461e+01 82.184  0.8563 
1 1 1 -15 31  7  o 18 5.72389e+00 1.49826e+00 1.25751e+02 89.471  6.90853e-02  7.48472e+00  0.00000e+00 0.00000e+00 7.64646e+01 89.471  4.92866e+01 269.471 0.9306 
1 1 1 -15 31  8  o 13 1.16328e+01 1.30284e+00 1.49361e+02 286.389 5.57618e+00  -1.89599e+01 0.00000e+00 0.00000e+00 2.80485e+02 286.389 1.31124e+02 286.389 0.9744 
1 1 1 -15 31  9  o 9  6.35584e+00 1.56635e+00 1.32383e+02 232.640 -5.50277e+00 -7.20787e+00 0.00000e+00 0.00000e+00 9.46910e+01 232.640 3.76921e+01 52.640  0.9431 
1 1 1 -15 31  10 o 6  9.74936e+00 1.49925e+00 1.24486e+02 115.584 -6.09106e+00 1.27224e+01  0.00000e+00 0.00000e+00 2.31065e+02 115.584 1.06579e+02 115.584 0.9639 
1 1 1 -15 31  11 o 17 4.67459e+00 1.38389e+00 4.65189e+01 154.199 -2.52590e+00 1.22110e+00  0.00000e+00 0.00000e+00 9.38307e+01 154.199 4.73118e+01 154.199 0.7945 
1 1 1 -15 31  12 o 17 4.51058e+00 1.40198e+00 7.61993e+01 357.915 4.69725e+00  -1.70995e-01 0.00000e+00 0.00000e+00 7.46112e+01 357.915 1.58804e+00 177.915 0.8859 
1 1 1 -15 32  1  o 6  8.43973e+00 1.51332e+00 1.50610e+02 281.303 2.14934e+00  -1.07537e+01 0.00000e+00 0.00000e+00 1.56350e+02 281.303 5.73999e+00 281.303 0.9533 
1 1 1 -15 32  2  o 15 5.67173e+00 1.45390e+00 1.26860e+02 50.201  4.37230e+00  5.24799e+00  0.00000e+00 0.00000e+00 7.28670e+01 50.201  5.39934e+01 230.201 0.9236 
1 1 1 -15 32  3  o 6  3.77763e+00 1.22167e+00 7.34987e+01 320.895 2.22516e+00  -1.80868e+00 0.00000e+00 0.00000e+00 4.15961e+01 320.895 3.19026e+01 140.895 0.7997 
1 1 1 -15 32  4  o 8  1.38399e+01 1.42113e+00 2.23344e+02 142.577 -2.41748e+01 1.84982e+01  0.00000e+00 0.00000e+00 2.94782e+02 142.577 7.14383e+01 142.577 0.9834 
1 1 1 -15 32  5  o 13 9.92010e+00 1.35941e+00 1.79637e+02 265.589 -1.37630e+00 -1.78437e+01 0.00000e+00 0.00000e+00 1.86970e+02 265.589 7.33288e+00 265.589 0.9716 
1 1 1 -15 32  6  o 7  4.68483e+00 1.39649e+00 1.48498e+02 76.911  1.62730e+00  6.99886e+00  0.00000e+00 0.00000e+00 1.66213e+01 76.911  1.31877e+02 256.911 0.9275 
1 1 1 -15 32  7  o 11 1.29156e+01 1.22991e+00 1.68137e+02 129.995 -1.68598e+01 2.00962e+01  0.00000e+00 0.00000e+00 3.12708e+02 129.995 1.44571e+02 129.995 0.9808 
1 1 1 -15 32  8  o 19 6.28309e+00 1.49454e+00 1.27713e+02 330.894 7.14053e+00  -3.97531e+00 0.00000e+00 0.00000e+00 9.54510e+01 330.894 3.22622e+01 150.894 0.9367 
1 1 1 -15 32  9  o 2  3.79161e+00 1.23203e+00 5.67625e+01 34.855  2.34579e+00  1.63370e+00  0.00000e+00 0.00000e+00 5.79825e+01 34.855  1.21995e+00 34.855  0.7990 
1 1 1 -15 32  10 o 14 6.79204e+00 1.51392e+00 6.69086e+01 303.007 2.84673e+00  -4.38239e+00 0.00000e+00 0.00000e+00 1.63938e+02 303.007 9.70292e+01 303.007 0.8984 
1 1 1 -15 32  11 o 3  5.36828e+00 1.49877e+00 6.89391e+01 333.369 3.94505e+00  -1.97822e+00 0.00000e+00 0.00000e+00 1.09102e+02 333.369 4.01628e+01 333.369 0.8777 
1 1 1 -15 32  12 o 13 6.85000e+00 1.53938e+00 1.14791e+02 349.974 9.57971e+00  -1.69356e+00 0.00000e+00 0.00000e+00 1.30033e+02 349.974 1.52428e+01 349.974 0.9471 
1 1 1 -15 33  1  o 18 7.04509e+00 1.47133e+00 1.65261e+02 190.080 -1.07777e+01 -1.91586e+00 0.00000e+00 0.00000e+00 9.09285e+01 190.080 7.43329e+01 10.080  0.9532 
1 1 1 -15 33  2  o 1  1.07537e+01 1.30324e+00 1.34937e+02 148.783 -1.27227e+01 7.71024e+00  0.00000e+00 0.00000e+00 2.61012e+02 148.783 1.26075e+02 148.783 0.9658 
1 1 1 -15 33  3  o 11 5.58333e+00 1.55370e+00 1.01100e+02 129.716 -3.14978e+00 3.79173e+00  0.00000e+00 0.00000e+00 8.85684e+01 129.716 1.25317e+01 309.716 0.8917 
1 1 1 -15 33  4  o 12 8.23591e+00 1.73536e+00 1.51810e+02 337.434 9.58072e+00  -3.98146e+00 0.00000e+00 0.00000e+00 1.46171e+02 337.434 5.63824e+00 157.434 0.9505 
1 1 1 -15 33  5  o 15 7.81278e+00 1.49781e+00 1.19668e+02 159.367 -8.36903e+00 3.15128e+00  0.00000e+00 0.00000e+00 1.60318e+02 159.367 4.06492e+01 159.367 0.9423 
1 1 1 -15 33  6  o 13 5.40678e+00 1.47198e+00 1.25208e+02 279.517 1.09583e+00  -6.53640e+00 0.00000e+00 0.00000e+00 6.40194e+01 279.517 6.11889e+01 99.517  0.9211 
1 1 1 -15 33  7  o 11 4.30720e+00 1.25159e+00 3.76545e+01 243.274 -8.69437e-01 -1.72670e+00 0.00000e+00 0.00000e+00 7.45808e+01 243.274 3.69263e+01 243.274 0.6865 
1 1 1 -15 33  8  o 5  1.03937e+01 1.31625e+00 1.30824e+02 221.414 -1.25580e+01 -1.10768e+01 0.00000e+00 0.00000e+00 2.51316e+02 221.414 1.20491e+02 221.414 0.9697 
1 1 1 -15 33  9  o 9  4.70823e+00 1.40878e+00 7.49477e+01 112.008 -1.59609e+00 3.94896e+00  0.00000e+00 0.00000e+00 8.06910e+01 112.008 5.74334e+00 112.008 0.8728 
1 1 1 -15 33  10 o 6  7.86936e+00 1.64085e+00 1.32078e+02 60.039  5.25205e+00  9.11099e+00  0.00000e+00 0.00000e+00 1.51087e+02 60.039  1.90086e+01 60.039  0.9512 
1 1 1 -15 33  11 o 15 4.56450e+00 1.38589e+00 3.80372e+01 279.591 3.76337e-01  -2.22707e+00 0.00000e+00 0.00000e+00 8.88893e+01 279.591 5.08520e+01 279.591 0.7360 
1 1 1 -15 33  12 o 1  5.47620e+00 1.49258e+00 1.56460e+02 266.174 -7.27883e-01 -1.08832e+01 0.00000e+00 0.00000e+00 4.04605e+01 266.174 1.15999e+02 86.174  0.9530 
1 1 1 -15 34  1  o 1  9.86679e+00 1.36760e+00 2.09610e+02 193.960 -1.92985e+01 -4.79740e+00 0.00000e+00 0.00000e+00 1.57193e+02 193.960 5.24169e+01 13.960  0.9745 
1 1 1 -15 34  2  o 13 1.42453e+01 1.15834e+00 2.35725e+02 321.980 2.81397e+01  -2.20012e+01 0.00000e+00 0.00000e+00 2.99664e+02 321.980 6.39388e+01 321.980 0.9859 
1 1 1 -15 34  3  f 0  6.64621e+00 1.50738e+00 1.22190e+02 214.229 -6.28634e+00 -4.27689e+00 0.00000e+00 0.00000e+00 1.13688e+02 214.229 8.50208e+00 34.229  0.9317 
1 1 1 -15 34  4  o 12 4.71572e+00 1.46812e+00 1.44030e+02 351.897 6.61880e+00  -9.42384e-01 0.00000e+00 0.00000e+00 2.14269e+01 351.897 1.22603e+02 171.897 0.9218 
1 1 1 -15 34  5  o 1  6.78014e+00 1.49738e+00 1.47960e+02 75.918  2.42686e+00  9.67433e+00  0.00000e+00 0.00000e+00 9.65837e+01 75.918  5.13761e+01 255.918 0.9485 
1 1 1 -15 34  6  o 8  9.55869e+00 1.37514e+00 1.60837e+02 70.689  5.76286e+00  1.64462e+01  0.00000e+00 0.00000e+00 1.91736e+02 70.689  3.08988e+01 70.689  0.9709 
1 1 1 -15 34  7  o 9  7.32875e+00 1.58804e+00 1.06625e+02 206.840 -6.85694e+00 -3.46969e+00 0.00000e+00 0.00000e+00 1.52742e+02 206.840 4.61164e+01 206.840 0.9325 
1 1 1 -15 34  8  f 0  1.04460e+01 1.32879e+00 1.75833e+02 318.993 1.59806e+01  -1.38949e+01 0.00000e+00 0.00000e+00 2.10744e+02 318.993 3.49111e+01 318.993 0.9761 
1 1 1 -15 34  9  o 17 1.55675e+01 1.16127e+00 2.13976e+02 264.622 -4.21153e+00 -4.47330e+01 0.00000e+00 0.00000e+00 3.68979e+02 264.622 1.55003e+02 264.622 0.9888 
1 1 1 -15 34  10 o 5  4.33491e+00 1.36578e+00 1.84597e+01 246.812 -4.04427e-01 -9.44140e-01 0.00000e+00 0.00000e+00 5.62976e+01 246.812 3.78379e+01 246.812 0.4559 
1 1 1 -15 34  11 o 3  6.21568e+00 1.53331e+00 5.77450e+01 134.100 -2.96658e+00 3.06125e+00  0.00000e+00 0.00000e+00 1.47235e+02 134.100 8.94896e+01 134.100 0.8729 
1 1 1 -15 34  12 o 12 5.26691e+00 1.53203e+00 1.30096e+02 245.969 -3.61455e+00 -8.10669e+00 0.00000e+00 0.00000e+00 5.70679e+01 245.969 7.30285e+01 65.969  0.9419 
1 1 1 -15 35  1  o 16 4.94548e+00 1.31849e+00 1.01583e+02 123.208 -2.85121e+00 4.35571e+00  0.00000e+00 0.00000e+00 6.78061e+01 123.208 3.37769e+01 303.208 0.8979 
1 1 1 -15 35  2  f 0  6.27592e+00 1.43779e+00 2.86518e+01 55.687  9.85603e-01  1.44416e+00  0.00000e+00 0.00000e+00 1.27279e+02 55.687  9.86268e+01 55.687  0.6518 
1 1 1 -15 35  3  o 6  1.08129e+01 1.53480e+00 2.43965e+02 345.470 2.36469e+01  -6.12877e+00 0.00000e+00 0.00000e+00 1.59364e+02 345.470 8.46013e+01 165.470 0.9793 
1 1 1 -15 35  4  o 9  4.48199e+00 1.41671e+00 7.47178e+01 68.533  1.19514e+00  3.03918e+00  0.00000e+00 0.00000e+00 6.64925e+01 68.533  8.22525e+00 248.533 0.8279 
1 1 1 -15 35  5  o 15 5.97062e+00 1.44766e+00 5.87913e+01 260.199 -6.10435e-01 -3.53368e+00 0.00000e+00 0.00000e+00 1.33153e+02 260.199 7.43619e+01 260.199 0.8455 
1 1 1 -15 35  6  o 15 9.28928e+00 1.40141e+00 1.04995e+02 183.420 -1.06753e+01 -6.37949e-01 0.00000e+00 0.00000e+00 2.30961e+02 183.420 1.25966e+02 183.420 0.9520 
1 1 1 -15 35  7  o 9  7.40615e+00 1.51900e+00 1.19301e+02 27.127  8.05824e+00  4.12848e+00  0.00000e+00 0.00000e+00 1.45755e+02 27.127  2.64541e+01 27.127  0.9430 
1 1 1 -15 35  8  o 6  5.18788e+00 1.24737e+00 6.24470e+01 294.799 1.77341e+00  -3.83812e+00 0.00000e+00 0.00000e+00 1.09001e+02 294.799 4.65544e+01 294.799 0.8718 
1 1 1 -15 35  9  o 9  1.03005e+01 1.43067e+00 2.28998e+02 110.277 -9.34537e+00 2.52948e+01  0.00000e+00 0.00000e+00 1.53752e+02 110.277 7.52456e+01 290.277 0.9813 
1 1 1 -15 35  10 o 1  5.87147e+00 1.36603e+00 9.04068e+01 282.993 1.51509e+00  -6.56614e+00 0.00000e+00 0.00000e+00 1.14453e+02 282.993 2.40465e+01 282.993 0.9225 
1 1 1 -15 35  11 o 3  5.49906e+00 1.46876e+00 1.07933e+02 349.865 7.33198e+00  -1.31065e+00 0.00000e+00 0.00000e+00 8.52998e+01 349.865 2.26334e+01 169.865 0.9302 
1 1 1 -15 35  12 o 1  6.00518e+00 1.61395e+00 1.46065e+02 266.468 -6.54844e-01 -1.06103e+01 0.00000e+00 0.00000e+00 6.95513e+01 266.468 7.65138e+01 86.468  0.9517 
1 1 1 -15 36  1  o 11 1.28992e+01 1.14723e+00 2.18206e+02 176.113 -3.17002e+01 2.15374e+00  0.00000e+00 0.00000e+00 2.65965e+02 176.113 4.77584e+01 176.113 0.9841 
1 1 1 -15 36  2  o 18 9.30202e+00 1.30212e+00 1.63992e+02 295.566 6.90291e+00  -1.44291e+01 0.00000e+00 0.00000e+00 1.79274e+02 295.566 1.52823e+01 295.566 0.9682 
1 1 1 -15 36  3  o 1  5.04653e+00 1.49962e+00 1.39420e+02 342.311 6.48655e+00  -2.06880e+00 0.00000e+00 0.00000e+00 3.80397e+01 342.311 1.01381e+02 162.311 0.9233 
1 1 1 -15 36  4  o 17 1.12875e+01 1.44134e+00 2.08433e+02 18.071  2.20668e+01  7.20025e+00  0.00000e+00 0.00000e+00 2.11739e+02 18.071  3.30552e+00 18.071  0.9782 
1 1 1 -15 36  5  o 17 5.91354e+00 1.47731e+00 1.19279e+02 102.401 -1.49675e+00 6.80705e+00  0.00000e+00 0.00000e+00 8.87350e+01 102.401 3.05443e+01 282.401 0.9252 
1 1 1 -15 36  6  o 10 4.56105e+00 1.37460e+00 7.78671e+01 277.190 4.97232e-01  -3.94175e+00 0.00000e+00 0.00000e+00 7.15560e+01 277.190 6.31114e+00 97.190  0.8625 
1 1 1 -15 36  7  o 12 4.69241e+00 1.37953e+00 5.43902e+01 41.521  2.18931e+00  1.93838e+00  0.00000e+00 0.00000e+00 8.88082e+01 41.521  3.44180e+01 41.521  0.8042 
1 1 1 -15 36  8  o 3  5.34049e+00 1.44567e+00 1.36798e+02 192.664 -7.86823e+00 -1.76796e+00 0.00000e+00 0.00000e+00 5.26377e+01 192.664 8.41599e+01 12.664  0.9358 
1 1 1 -15 36  9  o 4  4.07290e+00 1.28885e+00 1.64896e+01 23.778  8.16194e-01  3.59603e-01  0.00000e+00 0.00000e+00 4.62416e+01 23.778  2.97519e+01 23.778  0.4068 
1 1 1 -15 36  10 o 8  7.30474e+00 1.67252e+00 1.45438e+02 322.473 9.02193e+00  -6.92946e+00 0.00000e+00 0.00000e+00 1.18381e+02 322.473 2.70568e+01 142.473 0.9550 
1 1 1 -15 36  11 o 3  4.63915e+00 1.41495e+00 6.07159e+01 309.951 2.43104e+00  -2.90228e+00 0.00000e+00 0.00000e+00 8.90610e+01 309.951 2.83451e+01 309.951 0.8548 
1 1 1 -15 36  12 o 14 4.49477e+00 1.32674e+00 8.79272e+01 219.150 -4.59797e+00 -3.74329e+00 0.00000e+00 0.00000e+00 6.65764e+01 219.150 2.13508e+01 39.150  0.9112 
1 1 1 -15 37  1  o 3  5.05982e+00 1.36210e+00 3.85194e+01 354.339 1.96994e+00  -1.95256e-01 0.00000e+00 0.00000e+00 9.54731e+01 354.339 5.69537e+01 354.339 0.6944 
1 1 1 -15 37  2  o 2  1.08627e+01 1.20770e+00 1.88317e+02 181.737 -2.31708e+01 -7.02730e-01 0.00000e+00 0.00000e+00 2.16628e+02 181.737 2.83110e+01 181.737 0.9782 
1 1 1 -15 37  3  o 9  1.24256e+01 1.47541e+00 2.46002e+02 230.974 -1.82029e+01 -2.24579e+01 0.00000e+00 0.00000e+00 2.18921e+02 230.974 2.70808e+01 50.974  0.9825 
1 1 1 -15 37  4  o 13 4.18443e+00 1.35488e+00 6.03665e+01 145.627 -2.24597e+00 1.53627e+00  0.00000e+00 0.00000e+00 6.49454e+01 145.627 4.57891e+00 145.627 0.7871 
1 1 1 -15 37  5  o 11 6.85018e+00 1.45421e+00 1.28915e+02 105.158 -2.28314e+00 8.42757e+00  0.00000e+00 0.00000e+00 1.16103e+02 105.158 1.28125e+01 285.158 0.9409 
1 1 1 -15 37  6  o 19 1.15446e+01 1.29126e+00 2.20240e+02 5.007   2.95530e+01  2.58922e+00  0.00000e+00 0.00000e+00 2.10775e+02 5.007   9.46531e+00 185.007 0.9830 
1 1 1 -15 37  7  o 9  5.60802e+00 1.51076e+00 7.55466e+01 1.879   4.27716e+00  1.40342e-01  0.00000e+00 0.00000e+00 1.10312e+02 1.879   3.47658e+01 1.879   0.8735 
1 1 1 -15 37  8  o 16 1.31617e+01 1.19066e+00 2.24176e+02 96.013  -3.96448e+00 3.76383e+01  0.00000e+00 0.00000e+00 2.68046e+02 96.013  4.38698e+01 96.013  0.9867 
1 1 1 -15 37  9  o 6  4.80981e+00 1.41427e+00 1.20070e+02 302.677 3.93605e+00  -6.13645e+00 0.00000e+00 0.00000e+00 4.90333e+01 302.677 7.10366e+01 122.677 0.9286 
1 1 1 -15 37  10 o 5  5.22460e+00 1.44914e+00 3.42292e+01 23.147  2.04805e+00  8.75546e-01  0.00000e+00 0.00000e+00 1.10349e+02 23.147  7.61194e+01 23.147  0.7318 
1 1 1 -15 37  11 o 16 5.81755e+00 1.40103e+00 9.71481e+01 261.137 -1.18076e+00 -7.57197e+00 0.00000e+00 0.00000e+00 1.07686e+02 261.137 1.05377e+01 261.137 0.9323 
1 1 1 -15 37  12 o 6  6.58235e+00 1.58971e+00 1.07611e+02 155.169 -7.94996e+00 3.67862e+00  0.00000e+00 0.00000e+00 1.26031e+02 155.169 1.84197e+01 155.169 0.9411 
1 1 1 -15 38  1  o 6  1.29616e+01 1.11259e+00 2.05082e+02 277.429 4.08816e+00  -3.13510e+01 0.00000e+00 0.00000e+00 2.81293e+02 277.429 7.62115e+01 277.429 0.9841 
1 1 1 -15 38  2  o 18 1.15600e+01 1.12878e+00 2.12804e+02 279.495 4.58584e+00  -2.74193e+01 0.00000e+00 0.00000e+00 2.19703e+02 279.495 6.89849e+00 279.495 0.9818 
1 1 1 -15 38  3  o 15 6.78096e+00 1.57531e+00 1.40120e+02 78.176  1.78571e+00  8.53022e+00  0.00000e+00 0.00000e+00 1.02780e+02 78.176  3.73393e+01 258.176 0.9407 
1 1 1 -15 38  4  o 12 7.33967e+00 1.74183e+00 1.78885e+02 347.139 1.10611e+01  -2.52547e+00 0.00000e+00 0.00000e+00 8.77543e+01 347.139 9.11305e+01 167.139 0.9549 
1 1 1 -15 38  5  o 3  4.74526e+00 1.44707e+00 9.44670e+01 339.286 4.55387e+00  -1.72205e+00 0.00000e+00 0.00000e+00 6.61144e+01 339.286 2.83526e+01 159.286 0.8902 
1 1 1 -15 38  6  o 15 4.64861e+00 1.42456e+00 7.74456e+01 59.499  1.97158e+00  3.34693e+00  0.00000e+00 0.00000e+00 7.41887e+01 59.499  3.25688e+00 239.499 0.8589 
1 1 1 -15 38  7  o 18 6.31661e+00 1.53036e+00 8.42241e+01 133.180 -3.92776e+00 4.18563e+00  0.00000e+00 0.00000e+00 1.33401e+02 133.180 4.91768e+01 133.180 0.9081 
1 1 1 -15 38  8  o 9  4.05457e+00 1.22799e+00 4.89715e+01 72.746  7.86516e-01  2.53233e+00  0.00000e+00 0.00000e+00 7.09666e+01 72.746  2.19951e+01 72.746  0.7805 
1 1 1 -15 38  9  o 5  5.48593e+00 1.49486e+00 6.55757e+01 7.041   4.10150e+00  5.06587e-01  0.00000e+00 0.00000e+00 1.14776e+02 7.041   4.92007e+01 7.041   0.8684 
1 1 1 -15 38  10 o 7  5.25057e+00 1.44089e+00 7.03401e+01 293.692 1.74835e+00  -3.98435e+00 0.00000e+00 0.00000e+00 1.03529e+02 293.692 3.31885e+01 293.692 0.8758 
1 1 1 -15 38  11 o 17 8.54209e+00 1.59251e+00 1.07059e+02 136.276 -7.77710e+00 7.43820e+00  0.00000e+00 0.00000e+00 2.00149e+02 136.276 9.30898e+01 136.276 0.9523 
1 1 1 -15 38  12 o 15 4.78697e+00 1.45827e+00 6.41087e+01 357.258 4.12474e+00  -1.97517e-01 0.00000e+00 0.00000e+00 9.26569e+01 357.258 2.85482e+01 357.258 0.8683 
1 1 1 -15 39  1  o 16 3.50051e+00 1.12631e+00 6.25110e+01 331.770 2.17962e+00  -1.17016e+00 0.00000e+00 0.00000e+00 3.92088e+01 331.770 2.33022e+01 151.770 0.7621 
1 1 1 -15 39  2  o 3  8.00728e+00 1.36041e+00 1.78764e+02 79.288  2.67048e+00  1.41172e+01  0.00000e+00 0.00000e+00 1.15511e+02 79.288  6.32528e+01 259.288 0.9645 
1 1 1 -15 39  3  o 5  1.46591e+01 1.07017e+00 2.06103e+02 257.503 -8.20613e+00 -3.70255e+01 0.00000e+00 0.00000e+00 3.44604e+02 257.503 1.38501e+02 257.503 0.9867 
1 1 1 -15 39  4  o 7  8.53504e+00 1.66755e+00 2.33939e+02 56.904  9.68434e+00  1.48579e+01  0.00000e+00 0.00000e+00 8.14593e+01 56.904  1.52479e+02 236.904 0.9714 
1 1 1 -15 39  5  o 6  8.31399e+00 1.61539e+00 1.60137e+02 335.837 1.17394e+01  -5.26670e+00 0.00000e+00 0.00000e+00 1.43325e+02 335.837 1.68123e+01 155.837 0.9603 
1 1 1 -15 39  6  o 9  5.97938e+00 1.55904e+00 1.37378e+02 308.517 5.11661e+00  -6.42849e+00 0.00000e+00 0.00000e+00 7.53728e+01 308.517 6.20048e+01 128.517 0.9370 
1 1 1 -15 39  7  o 6  4.30465e+00 1.32910e+00 5.52144e+01 126.962 -1.74567e+00 2.31976e+00  0.00000e+00 0.00000e+00 7.58412e+01 126.962 2.06268e+01 126.962 0.8026 
1 1 1 -15 39  8  o 7  9.61253e+00 1.39309e+00 1.23803e+02 130.609 -9.29610e+00 1.08423e+01  0.00000e+00 0.00000e+00 2.27464e+02 130.609 1.03661e+02 130.609 0.9643 
1 1 1 -15 39  9  f 0  9.42173e+00 1.46541e+00 1.66879e+02 317.668 1.38088e+01  -1.25790e+01 0.00000e+00 0.00000e+00 1.80068e+02 317.668 1.31890e+01 317.668 0.9729 
1 1 1 -15 39  10 o 7  1.14428e+01 1.41249e+00 2.41572e+02 350.747 3.40694e+01  -5.55049e+00 0.00000e+00 0.00000e+00 1.84732e+02 350.747 5.68396e+01 170.747 0.9854 
1 1 1 -15 39  11 o 12 5.33765e+00 1.47974e+00 3.24133e+01 99.877  -3.83745e-01 2.20393e+00  0.00000e+00 0.00000e+00 1.15344e+02 99.877  8.29309e+01 99.877  0.7331 
1 1 1 -15 39  12 o 10 4.02230e+00 1.27258e+00 3.81773e+01 204.099 -2.18073e+00 -9.75420e-01 0.00000e+00 0.00000e+00 7.59425e+01 204.099 3.77652e+01 204.099 0.7524 
1 1 1 -15 40  1  o 1  6.06597e+00 1.37679e+00 1.24463e+02 209.730 -6.69714e+00 -3.82460e+00 0.00000e+00 0.00000e+00 9.12376e+01 209.730 3.32251e+01 29.730  0.9327 
1 1 1 -15 40  2  o 11 1.47863e+01 1.01264e+00 2.87491e+02 225.455 -3.66369e+01 -3.72241e+01 0.00000e+00 0.00000e+00 2.70414e+02 225.455 1.70773e+01 45.455  0.9904 
1 1 1 -15 40  3  o 1  7.87622e+00 1.38911e+00 1.32806e+02 53.126  6.62785e+00  8.83575e+00  0.00000e+00 0.00000e+00 1.53120e+02 53.126  2.03141e+01 53.126  0.9536 
1 1 1 -15 40  4  f 0  5.14624e+00 1.44060e+00 7.59276e+01 71.966  1.20489e+00  3.70080e+00  0.00000e+00 0.00000e+00 9.22696e+01 71.966  1.63420e+01 71.966  0.8592 
1 1 1 -15 40  5  o 4  4.06530e+00 1.31281e+00 8.24018e+01 226.283 -2.68389e+00 -2.80682e+00 0.00000e+00 0.00000e+00 5.02954e+01 226.283 3.21064e+01 46.283  0.8589 
1 1 1 -15 40  6  o 7  7.30460e+00 1.52028e+00 1.55582e+02 290.449 4.06363e+00  -1.08980e+01 0.00000e+00 0.00000e+00 1.09558e+02 290.449 4.60244e+01 110.449 0.9560 
1 1 1 -15 40  7  o 6  7.34697e+00 1.44132e+00 1.02878e+02 283.622 1.92042e+00  -7.92454e+00 0.00000e+00 0.00000e+00 1.58103e+02 283.622 5.52251e+01 283.622 0.9365 
1 1 1 -15 40  8  o 4  8.12670e+00 1.44967e+00 1.09575e+02 45.918  7.27957e+00  7.51653e+00  0.00000e+00 0.00000e+00 1.83243e+02 45.918  7.36684e+01 45.918  0.9509 
1 1 1 -15 40  9  o 13 5.20891e+00 1.46121e+00 8.00480e+01 253.290 -1.35862e+00 -4.52563e+00 0.00000e+00 0.00000e+00 9.47396e+01 253.290 1.46916e+01 253.290 0.8866 
1 1 1 -15 40  10 o 9  9.43117e+00 1.44475e+00 1.29288e+02 111.748 -5.59027e+00 1.40138e+01  0.00000e+00 0.00000e+00 2.15212e+02 111.748 8.59242e+01 111.748 0.9663 
1 1 1 -15 40  11 o 1  3.59057e+00 1.19931e+00 2.76330e+01 242.198 -7.62113e-01 -1.44534e+00 0.00000e+00 0.00000e+00 5.74402e+01 242.198 2.98071e+01 242.198 0.6275 
1 1 1 -15 40  12 o 13 3.79539e+00 1.22843e+00 7.28193e+01 243.572 -2.06574e+00 -4.15627e+00 0.00000e+00 0.00000e+00 5.37393e+01 243.572 1.90800e+01 63.572  0.8843 
1 1 1 -15 41  1  o 2  3.87956e+00 1.19379e+00 5.10725e+01 221.366 -1.74936e+00 -1.54041e+00 0.00000e+00 0.00000e+00 5.91466e+01 221.366 8.07415e+00 221.366 0.7453 
1 1 1 -15 41  2  o 12 1.25054e+01 1.05832e+00 2.45082e+02 177.552 -3.86366e+01 1.65181e+00  0.00000e+00 0.00000e+00 2.25092e+02 177.552 1.99907e+01 357.552 0.9870 
1 1 1 -15 41  3  o 14 6.76342e+00 1.38915e+00 4.55902e+01 245.042 -1.34987e+00 -2.90030e+00 0.00000e+00 0.00000e+00 1.66466e+02 245.042 1.20876e+02 245.042 0.8237 
1 1 1 -15 41  4  o 14 6.06810e+00 1.56491e+00 1.22580e+02 95.629  -7.38211e-01 7.48997e+00  0.00000e+00 0.00000e+00 9.22812e+01 95.629  3.02991e+01 275.629 0.9310 
1 1 1 -15 41  5  f 0  7.31654e+00 1.65836e+00 8.00243e+01 178.320 -5.50535e+00 1.61445e-01  0.00000e+00 0.00000e+00 1.71304e+02 178.320 9.12792e+01 178.320 0.9040 
1 1 1 -15 41  6  o 12 7.31086e+00 1.48048e+00 1.24733e+02 300.584 4.99935e+00  -8.45890e+00 0.00000e+00 0.00000e+00 1.38292e+02 300.584 1.35583e+01 300.584 0.9477 
1 1 1 -15 41  7  o 13 7.57381e+00 1.53920e+00 1.18398e+02 15.768  9.37026e+00  2.64592e+00  0.00000e+00 0.00000e+00 1.53672e+02 15.768  3.52745e+01 15.768  0.9472 
1 1 1 -15 41  8  o 15 6.20797e+00 1.47474e+00 4.79964e+01 193.119 -3.22912e+00 -7.52552e-01 0.00000e+00 0.00000e+00 1.47419e+02 193.119 9.94222e+01 193.119 0.8309 
1 1 1 -15 41  9  o 6  9.35280e+00 1.46146e+00 1.82893e+02 327.820 1.74416e+01  -1.09752e+01 0.00000e+00 0.00000e+00 1.62352e+02 327.820 2.05403e+01 147.820 0.9754 
1 1 1 -15 41  10 o 10 3.17528e+00 1.08425e+00 3.46747e+01 340.553 1.65390e+00  -5.83951e-01 0.00000e+00 0.00000e+00 4.36922e+01 340.553 9.01753e+00 340.553 0.6529 
1 1 1 -15 41  11 o 16 6.84100e+00 1.57973e+00 1.05476e+02 254.590 -2.30462e+00 -8.36101e+00 0.00000e+00 0.00000e+00 1.37402e+02 254.590 3.19260e+01 254.590 0.9404 
1 1 1 -15 42  1  o 17 3.92890e+00 1.22038e+00 7.05651e+01 94.762  -2.61808e-01 3.14285e+00  0.00000e+00 0.00000e+00 5.23429e+01 94.762  1.82222e+01 274.762 0.8207 
1 1 1 -15 42  2  o 19 6.48411e+00 1.40641e+00 1.12046e+02 143.689 -6.01821e+00 4.42264e+00  0.00000e+00 0.00000e+00 1.17744e+02 143.689 5.69807e+00 143.689 0.9304 
1 1 1 -15 42  3  o 2  1.01590e+01 1.18130e+00 1.37782e+02 69.535  5.59590e+00  1.49946e+01  0.00000e+00 0.00000e+00 2.36593e+02 69.535  9.88111e+01 69.535  0.9682 
1 1 1 -15 42  4  o 10 1.19493e+01 1.52612e+00 1.80044e+02 297.662 1.01743e+01  -1.94106e+01 0.00000e+00 0.00000e+00 2.63885e+02 297.662 8.38415e+01 297.662 0.9769 
1 1 1 -15 42  5  o 3  5.55451e+00 1.56889e+00 9.13436e+01 273.913 3.44545e-01  -5.03684e+00 0.00000e+00 0.00000e+00 9.74384e+01 273.913 6.09474e+00 273.913 0.8945 
1 1 1 -15 42  6  o 15 5.22211e+00 1.39537e+00 8.66840e+01 261.668 -7.07571e-01 -4.83133e+00 0.00000e+00 0.00000e+00 8.98597e+01 261.668 3.17573e+00 261.668 0.8906 
1 1 1 -15 42  7  o 10 5.81542e+00 1.53887e+00 8.48828e+01 324.063 4.16558e+00  -3.01947e+00 0.00000e+00 0.00000e+00 1.12855e+02 324.063 2.79719e+01 324.063 0.8966 
1 1 1 -15 42  8  o 12 7.61086e+00 1.47174e+00 1.42460e+02 272.637 5.87950e-01  -1.27649e+01 0.00000e+00 0.00000e+00 1.34330e+02 272.637 8.12976e+00 92.637  0.9600 
1 1 1 -15 42  9  o 6  9.09894e+00 1.40715e+00 1.63509e+02 83.745  2.00306e+00  1.82742e+01  0.00000e+00 0.00000e+00 1.71289e+02 83.745  7.77995e+00 83.745  0.9724 
1 1 1 -15 42  10 o 16 5.07634e+00 1.44137e+00 6.02639e+01 11.026  3.79888e+00  7.40223e-01  0.00000e+00 0.00000e+00 1.04415e+02 11.026  4.41515e+01 11.026  0.8583 
1 1 1 -15 42  11 f 0  6.16004e+00 1.56160e+00 1.45771e+02 239.563 -5.51077e+00 -9.37889e+00 0.00000e+00 0.00000e+00 7.57941e+01 239.563 6.99765e+01 59.563  0.9529 
1 1 1 -15 43  1  o 15 1.89381e+01 9.52065e-01 2.62965e+02 238.518 -3.33261e+01 -5.44218e+01 0.00000e+00 0.00000e+00 4.53112e+02 238.518 1.90147e+02 238.518 0.9921 
1 1 1 -15 43  2  o 10 1.07250e+01 1.23447e+00 2.38492e+02 107.654 -8.63171e+00 2.71212e+01  0.00000e+00 0.00000e+00 1.62726e+02 107.654 7.57655e+01 287.654 0.9823 
1 1 1 -15 43  3  o 7  7.29591e+00 1.31560e+00 1.48386e+02 193.806 -1.23434e+01 -3.03311e+00 0.00000e+00 0.00000e+00 1.18110e+02 193.806 3.02753e+01 13.806  0.9598 
1 1 1 -15 43  4  f 0  3.89341e+00 1.26526e+00 1.53328e+02 6.108   7.06964e+00  7.56488e-01  0.00000e+00 0.00000e+00 1.61279e+01 186.108 1.69456e+02 186.108 0.9267 
1 1 1 -15 43  5  o 6  4.27531e+00 1.33054e+00 8.63487e+01 61.341  2.02664e+00  3.70803e+00  0.00000e+00 0.00000e+00 5.52326e+01 61.341  3.11161e+01 241.341 0.8717 
1 1 1 -15 43  6  o 6  4.81866e+00 1.40280e+00 6.33224e+01 185.186 -3.54765e+00 -3.21966e-01 0.00000e+00 0.00000e+00 9.10941e+01 185.186 2.77717e+01 185.186 0.8443 
1 1 1 -15 43  7  o 8  8.26333e+00 1.51332e+00 1.87589e+02 293.808 6.97637e+00  -1.58115e+01 0.00000e+00 0.00000e+00 1.16532e+02 293.808 7.10580e+01 113.808 0.9706 
1 1 1 -15 43  8  o 15 3.81122e+00 1.22288e+00 1.22661e+02 161.008 -6.34541e+00 2.18389e+00  0.00000e+00 0.00000e+00 1.04597e+01 161.008 1.12202e+02 341.008 0.9222 
1 1 1 -15 43  9  o 12 3.90269e+00 1.25726e+00 3.48577e+01 306.013 1.13620e+00  -1.56313e+00 0.00000e+00 0.00000e+00 6.64888e+01 306.013 3.16311e+01 306.013 0.6864 
1 1 1 -15 43  10 o 5  5.88788e+00 1.41147e+00 8.06427e+01 4.502   6.17949e+00  4.86590e-01  0.00000e+00 0.00000e+00 1.23023e+02 4.502   4.23801e+01 4.502   0.9153 
1 1 1 -15 43  11 o 9  3.85476e+00 1.24194e+00 2.72712e+01 175.837 -1.68982e+00 1.22987e-01  0.00000e+00 0.00000e+00 6.59331e+01 175.837 3.86620e+01 175.837 0.6406 
1 1 1 -15 44  1  o 2  6.49055e+00 1.39964e+00 1.31087e+02 213.244 -7.95370e+00 -5.21341e+00 0.00000e+00 0.00000e+00 1.02857e+02 213.244 2.82294e+01 33.244  0.9459 
1 1 1 -15 44  2  o 13 1.39990e+01 1.03944e+00 2.88228e+02 77.838  1.16806e+01  5.42007e+01  0.00000e+00 0.00000e+00 2.40029e+02 77.838  4.81989e+01 257.838 0.9909 
1 1 1 -15 44  3  o 3  1.28793e+01 1.05764e+00 2.10548e+02 269.815 -1.16751e-01 -3.60827e+01 0.00000e+00 0.00000e+00 2.72689e+02 269.815 6.21417e+01 269.815 0.9860 
1 1 1 -15 44  4  o 6  6.26019e+00 1.54214e+00 1.07834e+02 334.009 6.11187e+00  -2.97975e+00 0.00000e+00 0.00000e+00 1.11906e+02 334.009 4.07210e+00 334.009 0.9232 
1 1 1 -15 44  5  o 10 4.84556e+00 1.43698e+00 4.64815e+01 114.124 -1.01882e+00 2.27506e+00  0.00000e+00 0.00000e+00 9.41844e+01 114.124 4.77029e+01 114.124 0.7642 
1 1 1 -15 44  6  o 2  8.62127e+00 1.35919e+00 1.99612e+02 215.228 -1.59189e+01 -1.12413e+01 0.00000e+00 0.00000e+00 1.19066e+02 215.228 8.05454e+01 35.228  0.9740 
1 1 1 -15 44  7  o 17 4.68318e+00 1.40534e+00 4.39565e+01 25.300  2.21616e+00  1.04760e+00  0.00000e+00 0.00000e+00 9.09121e+01 25.300  4.69555e+01 25.300  0.7596 
1 1 1 -15 44  8  f 0  7.20059e+00 1.54828e+00 1.68121e+02 84.149  1.36894e+00  1.33585e+01  0.00000e+00 0.00000e+00 9.42268e+01 84.149  7.38939e+01 264.149 0.9620 
1 1 1 -15 44  9  o 15 1.21853e+01 1.26076e+00 2.15438e+02 159.787 -3.25859e+01 1.19979e+01  0.00000e+00 0.00000e+00 2.38848e+02 159.787 2.34102e+01 159.787 0.9855 
1 1 1 -15 44  10 o 8  7.35180e+00 1.54844e+00 1.39356e+02 280.699 2.32171e+00  -1.22887e+01 0.00000e+00 0.00000e+00 1.27086e+02 280.699 1.22704e+01 100.699 0.9591 
1 1 1 -15 44  11 o 15 4.02775e+00 1.29589e+00 2.27635e+01 139.852 -1.07648e+00 9.08009e-01  0.00000e+00 0.00000e+00 6.42767e+01 139.852 4.15132e+01 139.852 0.5726 
1 1 1 -15 45  1  o 7  6.99844e+00 1.39047e+00 1.64760e+02 105.309 -3.36044e+00 1.22765e+01  0.00000e+00 0.00000e+00 9.11953e+01 105.309 7.35651e+01 285.309 0.9599 
1 1 1 -15 45  2  o 3  4.33107e+00 1.20786e+00 3.22883e+01 72.986  5.01419e-01  1.63863e+00  0.00000e+00 0.00000e+00 7.40248e+01 72.986  4.17366e+01 72.986  0.6447 
1 1 1 -15 45  3  o 1  7.35812e+00 1.46366e+00 2.02409e+02 59.760  7.95582e+00  1.36478e+01  0.00000e+00 0.00000e+00 6.85328e+01 59.760  1.33876e+02 239.760 0.9678 
1 1 1 -15 45  4  o 4  4.14492e+00 1.29709e+00 9.24989e+01 158.174 -4.15065e+00 1.66229e+00  0.00000e+00 0.00000e+00 4.60816e+01 158.174 4.64173e+01 338.174 0.8795 
1 1 1 -15 45  5  o 18 5.96090e+00 1.57569e+00 9.32258e+01 14.027  5.24279e+00  1.30981e+00  0.00000e+00 0.00000e+00 1.10989e+02 14.027  1.77632e+01 14.027  0.9020 
1 1 1 -15 45  6  o 9  5.28698e+00 1.40828e+00 4.04559e+01 282.959 5.65802e-01  -2.45887e+00 0.00000e+00 0.00000e+00 1.13519e+02 282.959 7.30635e+01 282.959 0.7675 
1 1 1 -15 45  7  o 12 9.73053e+00 1.45493e+00 2.10031e+02 152.914 -2.13051e+01 1.08956e+01  0.00000e+00 0.00000e+00 1.51047e+02 152.914 5.89846e+01 332.914 0.9789 
1 1 1 -15 45  8  o 1  6.99994e+00 1.55674e+00 1.16691e+02 27.130  8.12796e+00  4.16468e+00  0.00000e+00 0.00000e+00 1.33421e+02 27.130  1.67309e+01 27.130  0.9436 
1 1 1 -15 45  9  o 5  1.00380e+01 1.39308e+00 1.34086e+02 235.828 -9.56955e+00 -1.40960e+01 0.00000e+00 0.00000e+00 2.34290e+02 235.828 1.00204e+02 235.828 0.9702 
1 1 1 -15 45  10 o 9  9.35852e+00 1.49638e+00 1.11785e+02 318.904 9.93539e+00  -8.66603e+00 0.00000e+00 0.00000e+00 2.28102e+02 318.904 1.16317e+02 318.904 0.9613 
1 1 1 -15 45  11 o 15 3.25760e+00 1.10241e+00 4.89011e+01 120.915 -1.45870e+00 2.43584e+00  0.00000e+00 0.00000e+00 4.91113e+01 120.915 2.10201e-01 120.915 0.7974 
1 1 1 -15 46  1  o 3  8.96314e+00 1.34601e+00 1.20605e+02 74.168  3.35443e+00  1.18291e+01  0.00000e+00 0.00000e+00 2.06672e+02 74.168  8.60672e+01 74.168  0.9584 
1 1 1 -15 46  2  o 16 7.56968e+00 1.34789e+00 1.19999e+02 190.288 -1.01480e+01 -1.84205e+00 0.00000e+00 0.00000e+00 1.53836e+02 190.288 3.38366e+01 190.288 0.9502 
1 1 1 -15 46  3  o 13 5.48760e+00 1.34453e+00 1.13469e+02 223.189 -5.15786e+00 -4.84170e+00 0.00000e+00 0.00000e+00 7.99154e+01 223.189 3.35538e+01 43.189  0.9264 
1 1 1 -15 46  4  o 17 7.40480e+00 1.38580e+00 1.14610e+02 174.900 -9.36120e+00 8.35440e-01  0.00000e+00 0.00000e+00 1.51429e+02 174.900 3.68194e+01 174.900 0.9452 
1 1 1 -15 46  5  o 19 8.90634e+00 1.67349e+00 1.76401e+02 42.502  1.14181e+01  1.04637e+01  0.00000e+00 0.00000e+00 1.50730e+02 42.502  2.56705e+01 222.502 0.9672 
1 1 1 -15 46  6  o 9  4.10847e+00 1.29390e+00 9.21774e+01 84.910  4.05869e-01  4.55645e+00  0.00000e+00 0.00000e+00 4.53856e+01 84.910  4.67918e+01 264.910 0.8825 
1 1 1 -15 46  7  o 19 7.79988e+00 1.56190e+00 1.57104e+02 80.575  2.11402e+00  1.27357e+01  0.00000e+00 0.00000e+00 1.26849e+02 80.575  3.02545e+01 260.575 0.9605 
1 1 1 -15 46  8  f 0  4.99443e+00 1.48077e+00 5.25103e+01 243.191 -1.32301e+00 -2.61806e+00 0.00000e+00 0.00000e+00 9.97080e+01 243.191 4.71976e+01 243.191 0.8049 
1 1 1 -15 46  9  o 12 3.31865e+00 1.11457e+00 7.00719e+01 14.767  3.46981e+00  9.14617e-01  0.00000e+00 0.00000e+00 3.60614e+01 14.767  3.40105e+01 194.767 0.8456 
1 1 1 -15 46  10 o 16 4.77150e+00 1.35990e+00 1.08516e+02 221.481 -5.47082e+00 -4.83698e+00 0.00000e+00 0.00000e+00 5.88923e+01 221.481 4.96240e+01 41.481  0.9288 
1 1 1 -15 46  11 o 13 5.77021e+00 1.38084e+00 7.90260e+01 75.110  1.66954e+00  6.27923e+00  0.00000e+00 0.00000e+00 1.21143e+02 75.110  4.21173e+01 75.110  0.9195 
1 1 1 -15 47  1  o 7  8.35798e+00 1.33040e+00 8.12061e+01 16.005  7.44148e+00  2.13452e+00  0.00000e+00 0.00000e+00 2.15832e+02 16.005  1.34626e+02 16.005  0.9330 
1 1 1 -15 47  2  o 13 1.02585e+01 1.23716e+00 1.57149e+02 273.893 1.32295e+00  -1.94411e+01 0.00000e+00 0.00000e+00 2.23194e+02 273.893 6.60448e+01 273.893 0.9740 
1 1 1 -15 47  3  o 12 5.79303e+00 1.30706e+00 1.24889e+02 194.726 -8.12407e+00 -2.13529e+00 0.00000e+00 0.00000e+00 8.18967e+01 194.726 4.29920e+01 14.726  0.9384 
1 1 1 -15 47  4  o 19 4.19409e+00 1.21795e+00 2.79787e+01 334.068 1.25959e+00  -6.12491e-01 0.00000e+00 0.00000e+00 6.29731e+01 334.068 3.49945e+01 334.068 0.5706 
1 1 1 -15 47  5  o 12 1.12323e+01 1.47808e+00 1.85991e+02 18.901  2.08745e+01  7.14735e+00  0.00000e+00 0.00000e+00 2.30747e+02 18.901  4.47557e+01 18.901  0.9771 
1 1 1 -15 47  6  o 4  5.61377e+00 1.53802e+00 1.76641e+01 136.000 -7.82663e-01 7.55812e-01  0.00000e+00 0.00000e+00 8.38613e+01 136.000 6.61971e+01 136.000 0.4767 
1 1 1 -15 47  7  o 6  4.51274e+00 1.39955e+00 5.37864e+01 254.942 -8.04467e-01 -2.99028e+00 0.00000e+00 0.00000e+00 8.59230e+01 254.942 3.21367e+01 254.942 0.8169 
1 1 1 -15 47  8  o 10 5.19648e+00 1.49483e+00 1.32982e+02 77.233  1.79771e+00  7.93361e+00  0.00000e+00 0.00000e+00 5.12279e+01 77.233  8.17541e+01 257.233 0.9364 
1 1 1 -15 47  9  o 11 8.07701e+00 1.49394e+00 1.33301e+02 288.702 4.17343e+00  -1.23282e+01 0.00000e+00 0.00000e+00 1.60161e+02 288.702 2.68604e+01 288.702 0.9608 
1 1 1 -15 47  10 o 12 5.40999e+00 1.41961e+00 6.43242e+01 30.929  4.16761e+00  2.49713e+00  0.00000e+00 0.00000e+00 1.17539e+02 30.929  5.32150e+01 30.929  0.8900 
1 1 1 -15 47  11 o 3  4.08340e+00 1.29344e+00 4.08228e+01 282.150 5.37117e-01  -2.49475e+00 0.00000e+00 0.00000e+00 7.78718e+01 282.150 3.70490e+01 282.150 0.7705 
1 1 1 -15 48  1  o 14 6.01194e+00 1.37922e+00 1.03937e+02 45.683  4.85614e+00  4.97336e+00  0.00000e+00 0.00000e+00 1.07864e+02 45.683  3.92709e+00 45.683  0.9250 
1 1 1 -15 48  2  o 1  9.10627e+00 1.29597e+00 1.54389e+02 132.670 -1.11357e+01 1.20802e+01  0.00000e+00 0.00000e+00 1.81486e+02 132.670 2.70975e+01 132.670 0.9691 
1 1 1 -15 48  3  o 4  3.85684e+00 1.19949e+00 9.27878e+01 189.682 -4.49838e+00 -7.67461e-01 0.00000e+00 0.00000e+00 3.66115e+01 189.682 5.61763e+01 9.682   0.8822 
1 1 1 -15 48  4  o 15 4.59715e+00 1.27479e+00 2.76542e+01 12.615  1.56898e+00  3.51148e-01  0.00000e+00 0.00000e+00 8.09496e+01 12.615  5.32954e+01 12.615  0.6217 
1 1 1 -15 48  5  f 0  7.62133e+00 1.74108e+00 1.65586e+02 95.943  -1.24857e+00 1.19934e+01  0.00000e+00 0.00000e+00 1.11507e+02 95.943  5.40788e+01 275.943 0.9576 
1 1 1 -15 48  6  o 16 5.89388e+00 1.64162e+00 5.18644e+01 47.734  2.13520e+00  2.34932e+00  0.00000e+00 0.00000e+00 1.31932e+02 47.734  8.00673e+01 47.734  0.8221 
1 1 1 -15 48  7  o 7  1.40660e+01 1.41145e+00 2.40646e+02 192.161 -4.01460e+01 -8.65101e+00 0.00000e+00 0.00000e+00 2.85839e+02 192.161 4.51930e+01 192.161 0.9877 
1 1 1 -15 48  8  o 16 1.04799e+01 1.37005e+00 2.04307e+02 26.801  2.51533e+01  1.27061e+01  0.00000e+00 0.00000e+00 1.85292e+02 26.801  1.90156e+01 206.801 0.9821 
1 1 1 -15 48  9  o 10 4.58724e+00 1.37529e+00 6.49536e+01 132.288 -2.65443e+00 2.91839e+00  0.00000e+00 0.00000e+00 8.44509e+01 132.288 1.94973e+01 132.288 0.8614 
1 1 1 -15 48  10 o 17 8.45993e+00 1.52374e+00 1.43340e+02 218.685 -1.18398e+01 -9.48038e+00 0.00000e+00 0.00000e+00 1.65442e+02 218.685 2.21012e+01 218.685 0.9665 
1 1 1 -15 48  11 o 8  7.28474e+00 1.58316e+00 1.45760e+02 53.380  8.08816e+00  1.08829e+01  0.00000e+00 0.00000e+00 1.18681e+02 53.380  2.70794e+01 233.380 0.9624 
1 1 1 -15 49  1  o 10 3.43653e+00 1.10304e+00 7.98394e+01 96.267  -3.89577e-01 3.54751e+00  0.00000e+00 0.00000e+00 3.06971e+01 96.267  4.91423e+01 276.267 0.8446 
1 1 1 -15 49  2  o 3  1.12424e+01 1.16517e+00 2.30000e+02 111.489 -1.23228e+01 3.13006e+01  0.00000e+00 0.00000e+00 1.91434e+02 111.489 3.85663e+01 291.489 0.9850 
1 1 1 -15 49  3  o 1  7.07588e+00 1.39014e+00 9.60652e+01 116.970 -3.33776e+00 6.55924e+00  0.00000e+00 0.00000e+00 1.53998e+02 116.970 5.79324e+01 116.970 0.9293 
1 1 1 -15 49  4  o 3  1.31523e+01 1.10022e+00 2.53421e+02 205.226 -3.96117e+01 -1.86619e+01 0.00000e+00 0.00000e+00 2.40574e+02 205.226 1.28466e+01 25.226  0.9885 
1 1 1 -15 49  5  o 11 1.61218e+01 1.28454e+00 2.73969e+02 6.487   5.33107e+01  6.06154e+00  0.00000e+00 0.00000e+00 3.32325e+02 6.487   5.83555e+01 6.487   0.9906 
1 1 1 -15 49  6  o 18 8.47460e+00 1.58227e+00 6.26350e+01 311.850 3.68784e+00  -4.11738e+00 0.00000e+00 0.00000e+00 2.28031e+02 311.850 1.65396e+02 311.850 0.9043 
1 1 1 -15 49  7  o 16 8.10686e+00 1.52113e+00 1.36925e+02 240.119 -6.33335e+00 -1.10224e+01 0.00000e+00 0.00000e+00 1.57895e+02 240.119 2.09699e+01 240.119 0.9598 
1 1 1 -15 49  8  o 19 5.92961e+00 1.40590e+00 2.20743e+02 11.621  1.54649e+01  3.18048e+00  0.00000e+00 0.00000e+00 3.54258e+00 191.621 2.24285e+02 191.621 0.9678 
1 1 1 -15 49  9  o 5  5.98704e+00 1.51805e+00 3.29290e+01 192.845 -2.32927e+00 -5.31141e-01 0.00000e+00 0.00000e+00 1.37368e+02 192.845 1.04439e+02 192.845 0.7524 
1 1 1 -15 49  10 o 8  4.48076e+00 1.34893e+00 9.71588e+01 244.506 -2.78727e+00 -5.84516e+00 0.00000e+00 0.00000e+00 5.83641e+01 244.506 3.87947e+01 64.506  0.9192 
1 1 1 -15 49  11 o 13 4.36128e+00 1.35388e+00 7.36698e+01 126.756 -3.06022e+00 4.09721e+00  0.00000e+00 0.00000e+00 7.37000e+01 126.756 3.02004e-02 126.756 0.8960 
1 1 1 -15 50  1  o 14 6.87890e+00 1.36406e+00 1.55356e+02 24.436  1.06997e+01  4.86168e+00  0.00000e+00 0.00000e+00 9.51696e+01 24.436  6.01861e+01 204.436 0.9565 
1 1 1 -15 50  2  o 14 9.07439e+00 1.28162e+00 8.88852e+01 138.968 -7.00619e+00 6.09723e+00  0.00000e+00 0.00000e+00 2.37247e+02 138.968 1.48362e+02 138.968 0.9445 
1 1 1 -15 50  3  o 3  8.70384e+00 1.32337e+00 1.56435e+02 346.971 1.62743e+01  -3.76583e+00 0.00000e+00 0.00000e+00 1.64438e+02 346.971 8.00211e+00 346.971 0.9696 
1 1 1 -15 50  4  o 8  5.77859e+00 1.23490e+00 1.29926e+02 168.552 -9.67990e+00 1.96022e+00  0.00000e+00 0.00000e+00 7.81774e+01 168.552 5.17489e+01 348.552 0.9479 
1 1 1 -15 50  5  o 19 5.99633e+00 1.57297e+00 1.14760e+02 22.411  6.81510e+00  2.81057e+00  0.00000e+00 0.00000e+00 9.67908e+01 22.411  1.79696e+01 202.411 0.9295 
1 1 1 -15 50  6  o 2  5.95051e+00 1.57903e+00 9.82113e+01 95.340  -5.97529e-01 6.39252e+00  0.00000e+00 0.00000e+00 1.09036e+02 95.340  1.08251e+01 95.340  0.9184 
1 1 1 -15 50  7  o 3  5.41740e+00 1.47403e+00 6.69904e+01 42.895  2.98805e+00  2.77617e+00  0.00000e+00 0.00000e+00 1.10839e+02 42.895  4.38484e+01 42.895  0.8665 
1 1 1 -15 50  8  o 1  5.82447e+00 1.42976e+00 9.72565e+01 14.346  6.77880e+00  1.73371e+00  0.00000e+00 0.00000e+00 1.06740e+02 14.346  9.48396e+00 14.346  0.9255 
1 1 1 -15 50  9  o 8  4.94028e+00 1.42257e+00 5.94843e+01 131.490 -2.59963e+00 2.93935e+00  0.00000e+00 0.00000e+00 1.01219e+02 131.490 4.17345e+01 131.490 0.8605 
1 1 1 -15 50  10 o 9  4.74253e+00 1.40423e+00 1.02063e+02 39.713  5.27495e+00  4.38142e+00  0.00000e+00 0.00000e+00 6.33714e+01 39.713  3.86912e+01 219.713 0.9239 
1 1 1 -15 50  11 o 13 4.57927e+00 1.34840e+00 3.28930e+01 316.103 1.76555e+00  -1.69885e+00 0.00000e+00 0.00000e+00 9.82518e+01 316.103 6.53588e+01 316.103 0.7595 
1 1 1 -15 51  1  o 11 7.15450e+00 1.35886e+00 1.47711e+02 342.950 1.21324e+01  -3.72075e+00 0.00000e+00 0.00000e+00 1.13712e+02 342.950 3.39993e+01 162.950 0.9598 
1 1 1 -15 51  2  o 2  3.99858e+00 1.19973e+00 6.61633e+01 50.177  2.24176e+00  2.68846e+00  0.00000e+00 0.00000e+00 6.17956e+01 50.177  4.36768e+00 230.177 0.8411 
1 1 1 -15 51  3  o 6  7.07551e+00 1.27979e+00 1.52207e+02 42.825  9.36931e+00  8.68374e+00  0.00000e+00 0.00000e+00 1.06028e+02 42.825  4.61786e+01 222.825 0.9600 
1 1 1 -15 51  4  o 4  8.17559e+00 1.31992e+00 1.70827e+02 232.437 -1.01324e+01 -1.31746e+01 0.00000e+00 0.00000e+00 1.30235e+02 232.437 4.05922e+01 52.437  0.9694 
1 1 1 -15 51  5  o 9  4.38906e+00 1.37250e+00 9.33658e+01 241.131 -2.44517e+00 -4.43505e+00 0.00000e+00 0.00000e+00 5.56942e+01 241.131 3.76716e+01 61.131  0.8949 
1 1 1 -15 51  6  o 12 5.85657e+00 1.50306e+00 8.70628e+01 329.295 5.21145e+00  -3.09489e+00 0.00000e+00 0.00000e+00 1.15745e+02 329.295 2.86823e+01 329.295 0.9133 
1 1 1 -15 51  7  o 9  4.66221e+00 1.39870e+00 1.18836e+02 74.586  1.84872e+00  6.70519e+00  0.00000e+00 0.00000e+00 4.45225e+01 74.586  7.43134e+01 254.586 0.9250 
1 1 1 -15 51  8  o 15 9.16984e+00 1.40442e+00 1.64605e+02 268.611 -4.65413e-01 -1.91913e+01 0.00000e+00 0.00000e+00 1.73204e+02 268.611 8.59909e+00 268.611 0.9736 
1 1 1 -15 51  9  o 17 4.64470e+00 1.37700e+00 9.17256e+01 319.703 4.53011e+00  -3.84146e+00 0.00000e+00 0.00000e+00 6.82726e+01 319.703 2.34530e+01 139.703 0.9114 
1 1 1 -15 51  10 o 14 5.14163e+00 1.40561e+00 1.03461e+02 173.591 -7.50627e+00 8.43176e-01  0.00000e+00 0.00000e+00 7.72939e+01 173.591 2.61669e+01 353.591 0.9312 
1 1 1 -15 51  11 o 1  4.58940e+00 1.39523e+00 3.85977e+01 135.975 -2.04220e+00 1.97388e+00  0.00000e+00 0.00000e+00 9.93905e+01 135.975 6.07928e+01 135.975 0.7974 
1 1 1 -15 52  1  o 3  7.64924e+00 1.35082e+00 8.50901e+01 312.353 4.99442e+00  -5.47850e+00 0.00000e+00 0.00000e+00 1.85672e+02 312.353 1.00582e+02 312.353 0.9299 
1 1 1 -15 52  2  o 10 6.17556e+00 1.38977e+00 7.15651e+01 340.668 4.63931e+00  -1.62762e+00 0.00000e+00 0.00000e+00 1.37844e+02 340.668 6.62791e+01 340.668 0.8914 
1 1 1 -15 52  3  o 2  7.65948e+00 1.34793e+00 1.06858e+02 19.776  9.02305e+00  3.24423e+00  0.00000e+00 0.00000e+00 1.68661e+02 19.776  6.18025e+01 19.776  0.9463 
1 1 1 -15 52  4  o 1  5.64267e+00 1.39704e+00 9.09580e+01 195.418 -5.94180e+00 -1.63865e+00 0.00000e+00 0.00000e+00 1.05099e+02 195.418 1.41406e+01 195.418 0.9148 
1 1 1 -15 52  5  o 2  1.14719e+01 1.16489e+00 2.14264e+02 185.824 -3.29082e+01 -3.35674e+00 0.00000e+00 0.00000e+00 2.14426e+02 185.824 1.61478e-01 185.824 0.9848 
1 1 1 -15 52  6  o 8  5.32060e+00 1.56494e+00 1.07766e+02 324.336 5.11089e+00  -3.66765e+00 0.00000e+00 0.00000e+00 7.71317e+01 324.336 3.06345e+01 144.336 0.9167 
1 1 1 -15 52  7  o 12 5.83251e+00 1.60641e+00 5.15079e+01 286.228 9.08991e-01  -3.12298e+00 0.00000e+00 0.00000e+00 1.31185e+02 286.228 7.96768e+01 286.228 0.8271 
1 1 1 -15 52  8  f 0  4.66883e+00 1.38679e+00 1.13791e+02 52.476  4.20705e+00  5.47792e+00  0.00000e+00 0.00000e+00 4.95053e+01 52.476  6.42852e+01 232.476 0.9245 
1 1 1 -15 52  9  o 2  4.94046e+00 1.41656e+00 7.87940e+01 82.910  6.72827e-01  5.40925e+00  0.00000e+00 0.00000e+00 8.97768e+01 82.910  1.09828e+01 82.910  0.9029 
1 1 1 -15 52  10 o 14 4.91047e+00 1.33378e+00 1.12396e+02 328.191 6.92227e+00  -4.29354e+00 0.00000e+00 0.00000e+00 6.11726e+01 328.191 5.12231e+01 148.191 0.9364 
1 1 1 -15 52  11 o 3  3.77932e+00 1.23181e+00 8.20548e+01 79.163  1.07652e+00  5.62352e+00  0.00000e+00 0.00000e+00 4.72947e+01 79.163  3.47601e+01 259.163 0.9079 
1 1 1 -15 53  1  o 3  4.39518e+00 1.30503e+00 3.80886e+01 22.264  1.95082e+00  7.98661e-01  0.00000e+00 0.00000e+00 8.14756e+01 22.264  4.33869e+01 22.264  0.7147 
1 1 1 -15 53  2  o 8  1.09829e+01 1.20957e+00 1.47975e+02 310.253 1.33539e+01  -1.57727e+01 0.00000e+00 0.00000e+00 2.59519e+02 310.253 1.11545e+02 310.253 0.9755 
1 1 1 -15 53  3  o 6  6.87616e+00 1.35891e+00 7.50910e+01 267.630 -2.62978e-01 -6.35297e+00 0.00000e+00 0.00000e+00 1.64707e+02 267.630 8.96160e+01 267.630 0.9176 
1 1 1 -15 53  4  o 11 6.79169e+00 1.18506e+00 1.82410e+02 188.540 -1.70646e+01 -2.56252e+00 0.00000e+00 0.00000e+00 6.79146e+01 188.540 1.14495e+02 8.540   0.9706 
1 1 1 -15 53  5  o 17 5.66163e+00 1.37667e+00 1.38881e+02 208.601 -8.66006e+00 -4.72186e+00 0.00000e+00 0.00000e+00 6.47306e+01 208.601 7.41501e+01 28.601  0.9479 
1 1 1 -15 53  6  o 8  3.79619e+00 1.26932e+00 7.16396e+01 219.084 -2.69731e+00 -2.19077e+00 0.00000e+00 0.00000e+00 4.92026e+01 219.084 2.24370e+01 39.084  0.8398 
1 1 1 -15 53  7  o 13 4.45856e+00 1.42382e+00 3.66106e+01 104.678 -4.93222e-01 1.88305e+00  0.00000e+00 0.00000e+00 7.96838e+01 104.678 4.30732e+01 104.678 0.6888 
1 1 1 -15 53  8  o 10 6.53149e+00 1.53013e+00 9.29850e+01 201.146 -6.73692e+00 -2.60576e+00 0.00000e+00 0.00000e+00 1.36282e+02 201.146 4.32973e+01 201.146 0.9279 
1 1 1 -15 53  9  o 16 5.12765e+00 1.48418e+00 6.06364e+01 234.587 -2.31982e+00 -3.26272e+00 0.00000e+00 0.00000e+00 1.06695e+02 234.587 4.60582e+01 234.587 0.8637 
1 1 1 -15 53  10 o 7  5.26858e+00 1.43853e+00 6.82573e+01 10.365  4.85918e+00  8.88786e-01  0.00000e+00 0.00000e+00 1.09099e+02 10.365  4.08420e+01 10.365  0.8920 
1 1 1 -15 53  11 o 7  4.32342e+00 1.31249e+00 4.00773e+01 309.824 1.89692e+00  -2.27477e+00 0.00000e+00 0.00000e+00 9.14555e+01 309.824 5.13782e+01 309.824 0.8071 
1 1 1 -15 54  1  o 17 1.14035e+01 1.21574e+00 1.50264e+02 41.522  1.72996e+01  1.53174e+01  0.00000e+00 0.00000e+00 2.74206e+02 41.522  1.23942e+02 41.522  0.9781 
1 1 1 -15 54  2  o 1  9.27559e+00 1.28955e+00 1.47834e+02 335.676 1.60768e+01  -7.26691e+00 0.00000e+00 0.00000e+00 1.94760e+02 335.676 4.69259e+01 335.676 0.9712 
1 1 1 -15 54  3  o 17 7.55469e+00 1.38596e+00 1.37888e+02 94.441  -9.73115e-01 1.25292e+01  0.00000e+00 0.00000e+00 1.37522e+02 94.441  3.65549e-01 274.441 0.9593 
1 1 1 -15 54  4  o 3  7.19535e+00 1.36321e+00 1.03971e+02 303.985 4.99022e+00  -7.40234e+00 0.00000e+00 0.00000e+00 1.53441e+02 303.985 4.94691e+01 303.985 0.9422 
1 1 1 -15 54  5  o 17 7.86822e+00 1.37402e+00 1.55558e+02 164.188 -1.52711e+01 4.32477e+00  0.00000e+00 0.00000e+00 1.33367e+02 164.188 2.21907e+01 344.188 0.9680 
1 1 1 -15 54  6  o 9  3.84533e+00 1.27312e+00 4.95190e+01 279.246 4.17677e-01  -2.56574e+00 0.00000e+00 0.00000e+00 6.34867e+01 279.246 1.39677e+01 279.246 0.7754 
1 1 1 -15 54  7  o 6  7.93428e+00 1.52727e+00 1.43978e+02 323.228 1.05881e+01  -7.91282e+00 0.00000e+00 0.00000e+00 1.44834e+02 323.228 8.56282e-01 323.228 0.9614 
1 1 1 -15 54  8  o 18 4.58092e+00 1.35403e+00 9.96298e+01 16.096  6.15690e+00  1.77658e+00  0.00000e+00 0.00000e+00 5.94684e+01 16.096  4.01614e+01 196.096 0.9183 
1 1 1 -15 54  9  o 4  6.16438e+00 1.52768e+00 7.14692e+01 24.429  4.97705e+00  2.26069e+00  0.00000e+00 0.00000e+00 1.38870e+02 24.429  6.74010e+01 24.429  0.9032 
1 1 1 -15 54  10 f 0  6.15201e+00 1.45033e+00 1.99461e+01 333.683 1.55514e+00  -7.69166e-01 0.00000e+00 0.00000e+00 1.30735e+02 333.683 1.10789e+02 333.683 0.6491 
1 1 1 -15 54  11 o 13 6.81392e+00 1.56153e+00 1.20238e+02 199.666 -1.06475e+01 -3.80532e+00 0.00000e+00 0.00000e+00 1.24930e+02 199.666 4.69153e+00 199.666 0.9547 
1 1 1 -15 55  1  o 15 6.38407e+00 1.37260e+00 1.42161e+02 49.671  7.14893e+00  8.42119e+00  0.00000e+00 0.00000e+00 8.94809e+01 49.671  5.26805e+01 229.671 0.9536 
1 1 1 -15 55  2  o 5  9.15762e+00 1.30902e+00 1.86165e+02 285.861 5.90044e+00  -2.07668e+01 0.00000e+00 0.00000e+00 1.53876e+02 285.861 3.22891e+01 105.861 0.9766 
1 1 1 -15 55  3  o 13 4.13761e+00 1.19556e+00 9.05703e+01 136.273 -3.74416e+00 3.58137e+00  0.00000e+00 0.00000e+00 5.05106e+01 136.273 4.00597e+01 316.273 0.8974 
1 1 1 -15 55  4  o 12 3.88055e+00 1.18343e+00 9.96507e+01 59.438  2.79630e+00  4.73552e+00  0.00000e+00 0.00000e+00 3.34976e+01 59.438  6.61531e+01 239.438 0.9038 
1 1 1 -15 55  5  o 19 3.74974e+00 1.16943e+00 8.58287e+01 209.424 -4.04123e+00 -2.27936e+00 0.00000e+00 0.00000e+00 3.99433e+01 209.424 4.58854e+01 29.424  0.8843 
1 1 1 -15 55  6  o 12 4.83595e+00 1.45295e+00 5.87115e+01 213.340 -2.84275e+00 -1.87021e+00 0.00000e+00 0.00000e+00 9.44647e+01 213.340 3.57533e+01 213.340 0.8359 
1 1 1 -15 55  7  o 10 5.93422e+00 1.62873e+00 7.41612e+01 122.196 -2.56206e+00 4.06906e+00  0.00000e+00 0.00000e+00 1.25494e+02 122.196 5.13327e+01 122.196 0.8887 
1 1 1 -15 55  8  o 18 5.82457e+00 1.49713e+00 7.04030e+01 223.656 -3.73726e+00 -3.56591e+00 0.00000e+00 0.00000e+00 1.27192e+02 223.656 5.67892e+01 223.656 0.8971 
1 1 1 -15 55  9  o 12 6.09004e+00 1.46907e+00 1.05660e+02 302.112 4.61644e+00  -7.35576e+00 0.00000e+00 0.00000e+00 1.10704e+02 302.112 5.04387e+00 302.112 0.9405 
1 1 1 -15 55  10 o 2  5.95211e+00 1.56031e+00 1.75662e+02 266.493 -8.61970e-01 -1.40648e+01 0.00000e+00 0.00000e+00 4.07847e+01 266.493 1.34877e+02 86.493  0.9638 
1 1 1 -15 55  11 o 8  1.10519e+01 1.40645e+00 1.85365e+02 125.475 -1.89496e+01 2.65904e+01  0.00000e+00 0.00000e+00 2.24667e+02 125.475 3.93011e+01 125.475 0.9846 
1 1 1 -15 56  1  o 15 5.68946e+00 1.33264e+00 1.49974e+01 126.309 -6.40498e-01 8.71656e-01  0.00000e+00 0.00000e+00 8.77260e+01 126.309 7.27287e+01 126.309 0.4746 
1 1 1 -15 56  2  o 18 3.54093e+00 1.12257e+00 8.16734e+01 219.802 -3.07026e+00 -2.55822e+00 0.00000e+00 0.00000e+00 3.45532e+01 219.802 4.71203e+01 39.802  0.8634 
1 1 1 -15 56  3  f 0  6.97043e+00 1.42600e+00 1.45446e+02 32.424  1.04029e+01  6.60806e+00  0.00000e+00 0.00000e+00 1.08370e+02 32.424  3.70761e+01 212.424 0.9585 
1 1 1 -15 56  4  o 8  3.41377e+00 1.09572e+00 2.97038e+01 112.933 -6.16707e-01 1.45761e+00  0.00000e+00 0.00000e+00 5.01068e+01 112.933 2.04029e+01 112.933 0.6159 
1 1 1 -15 56  5  o 2  5.25103e+00 1.38957e+00 6.46534e+01 25.908  3.61837e+00  1.75758e+00  0.00000e+00 0.00000e+00 1.07482e+02 25.908  4.28289e+01 25.908  0.8644 
1 1 1 -15 56  6  f 0  6.72455e+00 1.68981e+00 1.09061e+02 239.975 -3.87919e+00 -6.71225e+00 0.00000e+00 0.00000e+00 1.28673e+02 239.975 1.96112e+01 239.975 0.9331 
1 1 1 -15 56  7  o 16 4.53352e+00 1.42101e+00 8.46402e+01 181.875 -4.86894e+00 -1.59376e-01 0.00000e+00 0.00000e+00 6.81356e+01 181.875 1.65046e+01 1.875   0.8903 
1 1 1 -15 56  8  o 18 5.03594e+00 1.42767e+00 6.03013e+01 337.191 3.75806e+00  -1.58043e+00 0.00000e+00 0.00000e+00 1.04674e+02 337.191 4.43725e+01 337.191 0.8664 
1 1 1 -15 56  9  o 16 4.98672e+00 1.37725e+00 6.13279e+01 286.677 1.27318e+00  -4.24985e+00 0.00000e+00 0.00000e+00 1.04115e+02 286.677 4.27871e+01 286.677 0.8784 
1 1 1 -15 56  10 o 18 6.77151e+00 1.56703e+00 9.66915e+01 149.123 -7.64197e+00 4.56946e+00  0.00000e+00 0.00000e+00 1.43949e+02 149.123 4.72576e+01 149.123 0.9420 
1 1 1 -15 56  11 o 7  4.16442e+00 1.25505e+00 9.07737e+01 37.251  5.30591e+00  4.03486e+00  0.00000e+00 0.00000e+00 5.38254e+01 37.251  3.69483e+01 217.251 0.9216 
1 1 1 -15 57  1  o 17 5.20236e+00 1.37710e+00 8.45504e+01 94.066  -3.91654e-01 5.50946e+00  0.00000e+00 0.00000e+00 9.43908e+01 94.066  9.84046e+00 94.066  0.9043 
1 1 1 -15 57  2  f 0  4.71851e+00 1.31721e+00 7.68698e+01 12.942  4.61386e+00  1.06028e+00  0.00000e+00 0.00000e+00 8.21904e+01 12.942  5.32063e+00 12.942  0.8868 
1 1 1 -15 57  3  o 6  3.95354e+00 1.17562e+00 4.62322e+01 87.130  1.35652e-01  2.70614e+00  0.00000e+00 0.00000e+00 7.17972e+01 87.130  2.55650e+01 87.130  0.7860 
1 1 1 -15 57  4  f 0  5.31029e+00 1.33606e+00 6.53962e+01 67.825  1.69604e+00  4.16114e+00  0.00000e+00 0.00000e+00 1.11983e+02 67.825  4.65870e+01 67.825  0.8801 
1 1 1 -15 57  5  o 10 5.66640e+00 1.44322e+00 1.05403e+02 179.870 -7.27700e+00 1.64739e-02  0.00000e+00 0.00000e+00 9.40958e+01 179.870 1.13073e+01 359.870 0.9285 
1 1 1 -15 57  6  o 9  3.83589e+00 1.24777e+00 5.81611e+01 238.530 -1.62407e+00 -2.65340e+00 0.00000e+00 0.00000e+00 6.06863e+01 238.530 2.52524e+00 238.530 0.8179 
1 1 1 -15 57  7  o 8  4.36838e+00 1.37540e+00 9.66724e+01 22.523  5.22414e+00  2.16641e+00  0.00000e+00 0.00000e+00 5.32159e+01 22.523  4.34565e+01 202.523 0.9067 
1 1 1 -15 57  8  o 4  1.06685e+01 1.42146e+00 1.84897e+02 193.768 -2.58274e+01 -6.32831e+00 0.00000e+00 0.00000e+00 2.10763e+02 193.768 2.58656e+01 193.768 0.9810 
1 1 1 -15 57  9  o 6  3.85078e+00 1.25219e+00 6.60525e+01 214.796 -3.27480e+00 -2.27570e+00 0.00000e+00 0.00000e+00 5.94475e+01 214.796 6.60495e+00 34.796  0.8631 
1 1 1 -15 57  10 o 11 6.34226e+00 1.49072e+00 6.91520e+01 139.280 -4.93116e+00 4.24445e+00  0.00000e+00 0.00000e+00 1.50822e+02 139.280 8.16699e+01 139.280 0.9196 
1 1 1 -15 57  11 o 4  2.75017e+00 9.52271e-01 6.79102e+01 8.350   4.39985e+00  6.45802e-01  0.00000e+00 0.00000e+00 2.31287e+01 8.350   4.47815e+01 188.350 0.8788 
1 1 1 -15 58  1  o 3  5.85446e+00 1.38695e+00 1.02432e+02 140.383 -5.94302e+00 4.91942e+00  0.00000e+00 0.00000e+00 1.05250e+02 140.383 2.81814e+00 140.383 0.9327 
1 1 1 -15 58  2  o 13 4.03333e+00 1.21757e+00 8.88808e+01 124.137 -2.89958e+00 4.27670e+00  0.00000e+00 0.00000e+00 4.86376e+01 124.137 4.02433e+01 304.137 0.8971 
1 1 1 -15 58  3  o 16 4.72994e+00 1.30236e+00 7.23541e+01 186.841 -4.42121e+00 -5.30405e-01 0.00000e+00 0.00000e+00 8.55269e+01 186.841 1.31728e+01 186.841 0.8789 
1 1 1 -15 58  4  o 11 7.45624e+00 1.34559e+00 1.24500e+02 302.879 6.13648e+00  -9.49317e+00 0.00000e+00 0.00000e+00 1.45613e+02 302.879 2.11135e+01 302.879 0.9547 
1 1 1 -15 58  5  o 2  5.23396e+00 1.40896e+00 3.11770e+01 331.651 1.84008e+00  -9.92822e-01 0.00000e+00 0.00000e+00 1.10135e+02 331.651 7.89578e+01 331.651 0.7121 
1 1 1 -15 58  6  o 14 9.12937e+00 1.29393e+00 1.65870e+02 357.800 2.07323e+01  -7.96419e-01 0.00000e+00 0.00000e+00 1.71483e+02 357.800 5.61367e+00 357.800 0.9756 
1 1 1 -15 58  7  o 12 4.23712e+00 1.35033e+00 1.22632e+02 192.703 -7.13147e+00 -1.60748e+00 0.00000e+00 0.00000e+00 2.62878e+01 192.703 9.63441e+01 12.703  0.9288 
1 1 1 -15 58  8  o 13 4.25165e+00 1.32293e+00 3.98503e+01 276.280 2.66528e-01  -2.42200e+00 0.00000e+00 0.00000e+00 8.19530e+01 276.280 4.21027e+01 276.280 0.7579 
1 1 1 -15 58  9  o 9  8.13038e+00 1.47409e+00 1.45673e+02 119.321 -8.05120e+00 1.43349e+01  0.00000e+00 0.00000e+00 1.51813e+02 119.321 6.14029e+00 119.321 0.9691 
1 1 1 -15 58  10 o 2  6.53103e+00 1.50179e+00 1.13667e+02 181.934 -1.03332e+01 -3.48844e-01 0.00000e+00 0.00000e+00 1.20397e+02 181.934 6.73001e+00 181.934 0.9503 
1 1 1 -15 59  1  o 18 6.46500e+00 1.41816e+00 3.60345e+01 216.779 -2.25290e+00 -1.68410e+00 0.00000e+00 0.00000e+00 1.59439e+02 216.779 1.23405e+02 216.779 0.7951 
1 1 1 -15 59  2  o 15 7.37782e+00 1.47182e+00 1.17695e+02 107.148 -3.03013e+00 9.82022e+00  0.00000e+00 0.00000e+00 1.48649e+02 107.148 3.09544e+01 107.148 0.9500 
1 1 1 -15 59  3  o 9  3.78276e+00 1.19351e+00 4.18303e+01 233.795 -1.25101e+00 -1.70895e+00 0.00000e+00 0.00000e+00 6.10433e+01 233.795 1.92129e+01 233.795 0.7162 
1 1 1 -15 59  4  o 18 5.27193e+00 1.33806e+00 6.11896e+01 291.165 1.50685e+00  -3.89190e+00 0.00000e+00 0.00000e+00 1.12799e+02 291.165 5.16093e+01 291.165 0.8699 
1 1 1 -15 59  5  o 1  1.05696e+01 1.26373e+00 2.01050e+02 106.901 -8.15428e+00 2.68370e+01  0.00000e+00 0.00000e+00 1.92397e+02 106.901 8.65286e+00 286.901 0.9820 
1 1 1 -15 59  6  o 15 7.53586e+00 1.31864e+00 1.37069e+02 337.185 1.29622e+01  -5.45292e+00 0.00000e+00 0.00000e+00 1.37977e+02 337.185 9.08211e-01 337.185 0.9638 
1 1 1 -15 59  7  o 18 5.89626e+00 1.60393e+00 8.38517e+01 186.222 -5.81516e+00 -6.33942e-01 0.00000e+00 0.00000e+00 1.19134e+02 186.222 3.52826e+01 186.222 0.9100 
1 1 1 -15 59  8  o 10 5.12692e+00 1.44047e+00 5.19832e+01 107.705 -1.12376e+00 3.52011e+00  0.00000e+00 0.00000e+00 1.12845e+02 107.705 6.08617e+01 107.705 0.8507 
1 1 1 -15 59  9  o 2  5.14434e+00 1.35280e+00 2.00810e+01 320.700 1.21857e+00  -9.97396e-01 0.00000e+00 0.00000e+00 9.91706e+01 320.700 7.90896e+01 320.700 0.6141 
1 1 1 -15 59  10 f 0  5.10761e+00 1.41241e+00 1.15668e+02 315.808 6.65031e+00  -6.46540e+00 0.00000e+00 0.00000e+00 6.62179e+01 315.808 4.94505e+01 135.808 0.9444 
1 1 1 -15 60  1  o 12 9.35545e+00 1.26786e+00 1.36116e+02 88.938  3.01884e-01  1.62898e+01  0.00000e+00 0.00000e+00 2.08482e+02 88.938  7.23655e+01 88.938  0.9688 
1 1 1 -15 60  2  o 18 6.64699e+00 1.40240e+00 1.26738e+02 287.941 3.05124e+00  -9.42358e+00 0.00000e+00 0.00000e+00 1.12695e+02 287.941 1.40423e+01 107.941 0.9481 
1 1 1 -15 60  3  o 1  3.79208e+00 1.18093e+00 8.51151e+01 161.843 -4.44669e+00 1.45832e+00  0.00000e+00 0.00000e+00 4.23493e+01 161.843 4.27658e+01 341.843 0.8854 
1 1 1 -15 60  4  o 19 4.07301e+00 1.24518e+00 7.93695e+01 184.045 -4.61867e+00 -3.26576e-01 0.00000e+00 0.00000e+00 5.72173e+01 184.045 2.21521e+01 4.045   0.8840 
1 1 1 -15 60  5  o 4  6.83997e+00 1.47001e+00 1.72632e+02 339.166 1.34363e+01  -5.11316e+00 0.00000e+00 0.00000e+00 7.74194e+01 339.166 9.52124e+01 159.166 0.9646 
1 1 1 -15 60  6  o 7  3.95200e+00 1.22853e+00 3.40037e+01 343.654 1.91225e+00  -5.60861e-01 0.00000e+00 0.00000e+00 7.02344e+01 343.654 3.62307e+01 343.654 0.6966 
1 1 1 -15 60  7  o 11 4.71785e+00 1.42192e+00 8.00518e+01 317.834 3.90302e+00  -3.53481e+00 0.00000e+00 0.00000e+00 8.04203e+01 317.834 3.68498e-01 317.834 0.8992 
1 1 1 -15 60  8  o 12 4.04853e+00 1.32288e+00 7.59044e+01 351.967 4.59994e+00  -6.49158e-01 0.00000e+00 0.00000e+00 5.93996e+01 351.967 1.65049e+01 171.967 0.8845 
1 1 1 -15 60  9  o 14 3.00412e+00 1.01955e+00 4.09512e+01 298.142 1.21106e+00  -2.26409e+00 0.00000e+00 0.00000e+00 4.66019e+01 298.142 5.65063e+00 298.142 0.7722 
1 1 1 -15 60  10 o 18 3.65933e+00 1.18860e+00 7.36514e+01 79.385  9.53596e-01  5.08788e+00  0.00000e+00 0.00000e+00 5.01376e+01 79.385  2.35138e+01 259.385 0.8973 
1 1 1 -15 61  1  o 6  7.00461e+00 1.38569e+00 1.11300e+02 103.516 -2.30824e+00 9.60280e+00  0.00000e+00 0.00000e+00 1.41106e+02 103.516 2.98060e+01 103.516 0.9479 
1 1 1 -15 61  2  o 5  4.86051e+00 1.25452e+00 9.50921e+01 169.151 -6.26944e+00 1.20147e+00  0.00000e+00 0.00000e+00 7.43920e+01 169.151 2.07002e+01 349.151 0.9179 
1 1 1 -15 61  3  o 16 1.05263e+01 1.24688e+00 1.45643e+02 250.906 -7.17951e+00 -2.07408e+01 0.00000e+00 0.00000e+00 2.44705e+02 250.906 9.90619e+01 250.906 0.9769 
1 1 1 -15 61  4  o 14 4.94667e+00 1.37981e+00 9.35662e+01 77.519  1.22571e+00  5.53756e+00  0.00000e+00 0.00000e+00 7.65869e+01 77.519  1.69793e+01 257.519 0.9069 
1 1 1 -15 61  5  o 8  3.45750e+00 1.12410e+00 2.22849e+01 50.597  7.59721e-01  9.24790e-01  0.00000e+00 0.00000e+00 4.47704e+01 50.597  2.24855e+01 50.597  0.5118 
1 1 1 -15 61  6  o 5  1.08691e+01 1.17108e+00 1.48193e+02 7.481   2.55384e+01  3.35349e+00  0.00000e+00 0.00000e+00 2.55225e+02 7.481   1.07031e+02 7.481   0.9804 
1 1 1 -15 61  7  o 18 3.92083e+00 1.28513e+00 3.03617e+01 3.063   1.76678e+00  9.45311e-02  0.00000e+00 0.00000e+00 6.69165e+01 3.063   3.65548e+01 3.063   0.6560 
1 1 1 -15 61  8  o 4  5.73561e+00 1.57634e+00 6.22704e+01 197.507 -4.20008e+00 -1.32486e+00 0.00000e+00 0.00000e+00 1.27865e+02 197.507 6.55945e+01 197.507 0.8774 
1 1 1 -15 61  9  o 1  3.94585e+00 1.23193e+00 4.45572e+01 55.988  1.81222e+00  2.68547e+00  0.00000e+00 0.00000e+00 7.84787e+01 55.988  3.39215e+01 55.988  0.8263 
1 1 1 -15 61  10 o 18 5.30292e+00 1.47657e+00 1.45345e+02 233.446 -6.74065e+00 -9.09168e+00 0.00000e+00 0.00000e+00 4.54929e+01 233.446 9.98518e+01 53.446  0.9547 
1 1 1 -15 62  1  o 3  5.72393e+00 1.40783e+00 8.79904e+01 236.438 -3.57170e+00 -5.38356e+00 0.00000e+00 0.00000e+00 1.11931e+02 236.438 2.39410e+01 236.438 0.9190 
1 1 1 -15 62  2  o 2  4.16733e+00 1.24079e+00 4.28348e+01 180.535 -2.56497e+00 -2.39507e-02 0.00000e+00 0.00000e+00 7.93391e+01 180.535 3.65043e+01 180.535 0.7719 
1 1 1 -15 62  3  o 4  4.97161e+00 1.35456e+00 3.65401e+01 354.608 2.25408e+00  -2.12771e-01 0.00000e+00 0.00000e+00 1.02464e+02 354.608 6.59240e+01 354.608 0.7367 
1 1 1 -15 62  4  o 8  4.08531e+00 1.22729e+00 4.62126e+01 200.525 -2.53465e+00 -9.48924e-01 0.00000e+00 0.00000e+00 7.55074e+01 200.525 2.92948e+01 200.525 0.7857 
1 1 1 -15 62  5  o 3  8.53110e+00 1.30250e+00 1.11829e+02 354.592 1.32162e+01  -1.25106e+00 0.00000e+00 0.00000e+00 1.98970e+02 354.592 8.71406e+01 354.592 0.9616 
1 1 1 -15 62  6  o 7  8.35640e+00 1.36897e+00 1.00992e+02 290.728 4.18766e+00  -1.10662e+01 0.00000e+00 0.00000e+00 2.01637e+02 290.728 1.00645e+02 290.728 0.9568 
1 1 1 -15 62  7  o 7  5.52608e+00 1.48955e+00 1.32768e+02 160.534 -9.24809e+00 3.26868e+00  0.00000e+00 0.00000e+00 6.52383e+01 160.534 6.75297e+01 340.534 0.9476 
1 1 1 -15 62  8  o 11 5.77736e+00 1.56933e+00 1.43898e+02 282.699 2.35744e+00  -1.04616e+01 0.00000e+00 0.00000e+00 6.38965e+01 282.699 8.00018e+01 102.699 0.9522 
1 1 1 -15 62  9  o 12 4.03436e+00 1.26865e+00 1.07392e+02 354.924 7.71956e+00  -6.85645e-01 0.00000e+00 0.00000e+00 3.46395e+01 354.924 7.27527e+01 174.924 0.9331 
1 1 1 -15 62  10 o 11 3.75397e+00 1.21990e+00 1.38926e+01 273.303 5.67557e-02  -9.83420e-01 0.00000e+00 0.00000e+00 4.85076e+01 273.303 3.46150e+01 273.303 0.4411 
1 1 1 -15 63  1  o 8  8.28025e+00 1.35379e+00 1.63562e+02 335.889 1.54159e+01  -6.89953e+00 0.00000e+00 0.00000e+00 1.41631e+02 335.889 2.19311e+01 155.889 0.9699 
1 1 1 -15 63  2  o 15 1.44509e+01 1.03882e+00 2.01990e+02 110.019 -1.51552e+01 4.15954e+01  0.00000e+00 0.00000e+00 3.40538e+02 110.019 1.38548e+02 110.019 0.9886 
1 1 1 -15 63  3  o 10 3.72402e+00 1.17172e+00 6.41036e+01 151.592 -3.07473e+00 1.66309e+00  0.00000e+00 0.00000e+00 5.47204e+01 151.592 9.38314e+00 331.592 0.8409 
1 1 1 -15 63  4  f 0  7.93886e+00 1.35633e+00 1.17695e+02 128.654 -7.74723e+00 9.68590e+00  0.00000e+00 0.00000e+00 1.70901e+02 128.654 5.32056e+01 128.654 0.9588 
1 1 1 -15 63  5  o 3  3.69557e+00 1.16338e+00 4.35919e+01 262.500 -3.38381e-01 -2.57011e+00 0.00000e+00 0.00000e+00 6.48564e+01 262.500 2.12645e+01 262.500 0.7747 
1 1 1 -15 63  6  o 13 8.34216e+00 1.40018e+00 1.50194e+02 349.521 1.74537e+01  -3.22830e+00 0.00000e+00 0.00000e+00 1.56492e+02 349.521 6.29715e+00 349.521 0.9714 
1 1 1 -15 63  7  o 15 5.76636e+00 1.41066e+00 6.47367e+01 285.318 1.38926e+00  -5.07186e+00 0.00000e+00 0.00000e+00 1.31268e+02 285.318 6.65310e+01 285.318 0.8991 
1 1 1 -15 63  8  o 18 6.37816e+00 1.63328e+00 9.05499e+01 14.470  6.86711e+00  1.77217e+00  0.00000e+00 0.00000e+00 1.32643e+02 14.470  4.20927e+01 14.470  0.9265 
1 1 1 -15 63  9  f 0  4.37607e+00 1.32314e+00 4.46960e+01 206.869 -2.95455e+00 -1.49690e+00 0.00000e+00 0.00000e+00 9.24337e+01 206.869 4.77377e+01 206.869 0.8307 
1 1 1 -15 63  10 o 16 4.67716e+00 1.33668e+00 1.02487e+02 107.780 -2.69872e+00 8.41549e+00  0.00000e+00 0.00000e+00 6.34570e+01 107.780 3.90299e+01 287.780 0.9416 
1 1 1 -15 64  1  o 19 4.04032e+00 1.22684e+00 2.42452e+01 183.277 -1.40366e+00 -8.03802e-02 0.00000e+00 0.00000e+00 6.35630e+01 183.277 3.93178e+01 183.277 0.5720 
1 1 1 -15 64  2  o 7  3.91169e+00 1.19787e+00 7.10050e+01 31.819  3.45087e+00  2.14123e+00  0.00000e+00 0.00000e+00 5.75864e+01 31.819  1.34186e+01 211.819 0.8658 
1 1 1 -15 64  3  o 3  4.94153e+00 1.32890e+00 8.01715e+01 202.847 -4.94112e+00 -2.08187e+00 0.00000e+00 0.00000e+00 8.87718e+01 202.847 8.60032e+00 202.847 0.9011 
1 1 1 -15 64  4  o 14 3.94330e+00 1.18845e+00 1.16913e+02 314.481 4.92591e+00  -5.01591e+00 0.00000e+00 0.00000e+00 2.14872e+01 314.481 9.54259e+01 134.481 0.9259 
1 1 1 -15 64  5  o 14 4.73638e+00 1.27730e+00 6.27526e+01 238.698 -2.27479e+00 -3.74114e+00 0.00000e+00 0.00000e+00 9.45072e+01 238.698 3.17546e+01 238.698 0.8766 
1 1 1 -15 64  6  o 19 4.05287e+00 1.22946e+00 8.89920e+01 220.891 -4.19559e+00 -3.63323e+00 0.00000e+00 0.00000e+00 4.97565e+01 220.891 3.92355e+01 40.891  0.9047 
1 1 1 -15 64  7  o 14 3.57459e+00 1.14161e+00 3.08765e+01 9.831   1.85175e+00  3.20899e-01  0.00000e+00 0.00000e+00 6.05925e+01 9.831   2.97159e+01 9.831   0.6769 
1 1 1 -15 64  8  o 13 5.78366e+00 1.60137e+00 9.29545e+01 138.691 -5.34453e+00 4.69680e+00  0.00000e+00 0.00000e+00 1.09453e+02 138.691 1.64988e+01 138.691 0.9268 
1 1 1 -15 64  9  o 18 3.33965e+00 1.12360e+00 4.42990e+01 320.437 2.26560e+00  -1.87181e+00 0.00000e+00 0.00000e+00 5.71489e+01 320.437 1.28499e+01 320.437 0.8054 
1 1 1 -15 64  10 o 14 4.22074e+00 1.26298e+00 1.26929e+02 3.100   1.00315e+01  5.43283e-01  0.00000e+00 0.00000e+00 2.39475e+01 3.100   1.02981e+02 183.100 0.9488 
1 1 1 -15 65  1  o 19 4.57553e+00 1.32715e+00 9.76518e+01 178.841 -6.05298e+00 1.22419e-01  0.00000e+00 0.00000e+00 6.10722e+01 178.841 3.65796e+01 358.841 0.9132 
1 1 1 -15 65  2  o 10 5.24153e+00 1.39218e+00 9.58888e+01 114.743 -2.72463e+00 5.91220e+00  0.00000e+00 0.00000e+00 8.70896e+01 114.743 8.79922e+00 294.743 0.9196 
1 1 1 -15 65  3  o 16 3.99377e+00 1.21817e+00 5.78269e+01 26.384  3.05005e+00  1.51301e+00  0.00000e+00 0.00000e+00 6.88152e+01 26.384  1.09883e+01 26.384  0.8360 
1 1 1 -15 65  4  o 19 7.63901e+00 1.33574e+00 9.45039e+01 312.968 6.99473e+00  -7.50937e+00 0.00000e+00 0.00000e+00 1.80533e+02 312.968 8.60289e+01 312.968 0.9500 
1 1 1 -15 65  5  o 4  1.24776e+01 1.07742e+00 1.99004e+02 166.300 -4.35312e+01 1.06116e+01  0.00000e+00 0.00000e+00 2.68192e+02 166.300 6.91882e+01 166.300 0.9888 
1 1 1 -15 65  6  o 1  5.16045e+00 1.37667e+00 9.09207e+01 16.062  6.56114e+00  1.88908e+00  0.00000e+00 0.00000e+00 8.93857e+01 16.062  1.53508e+00 196.062 0.9236 
1 1 1 -15 65  7  o 14 8.91961e+00 1.34544e+00 1.39594e+02 301.110 9.47427e+00  -1.56992e+01 0.00000e+00 0.00000e+00 1.88191e+02 301.110 4.85965e+01 301.110 0.9723 
1 1 1 -15 65  8  o 17 4.32380e+00 1.38423e+00 2.07313e+01 75.142  3.71832e-01  1.40155e+00  0.00000e+00 0.00000e+00 7.45258e+01 75.142  5.37945e+01 75.142  0.5835 
1 1 1 -15 65  9  o 14 4.04429e+00 1.24813e+00 4.72239e+01 42.138  2.51388e+00  2.27448e+00  0.00000e+00 0.00000e+00 8.01510e+01 42.138  3.29271e+01 42.138  0.8352 
1 1 1 -15 66  1  o 13 5.06344e+00 1.34860e+00 1.48770e+02 186.281 -1.02224e+01 -1.12508e+00 0.00000e+00 0.00000e+00 3.39384e+01 186.281 1.14831e+02 6.281   0.9501 
1 1 1 -15 66  2  o 8  1.35069e+01 1.06363e+00 2.10795e+02 249.739 -1.63667e+01 -4.43376e+01 0.00000e+00 0.00000e+00 2.96392e+02 249.739 8.55969e+01 249.739 0.9894 
1 1 1 -15 66  3  o 14 8.30099e+00 1.35738e+00 8.77282e+01 20.854  9.52868e+00  3.62986e+00  0.00000e+00 0.00000e+00 2.11229e+02 20.854  1.23501e+02 20.854  0.9496 
1 1 1 -15 66  4  o 9  4.23395e+00 1.18809e+00 7.60476e+01 327.515 4.34059e+00  -2.76366e+00 0.00000e+00 0.00000e+00 6.78141e+01 327.515 8.23354e+00 147.515 0.8967 
1 1 1 -15 66  5  o 3  9.33843e+00 1.24297e+00 1.34651e+02 109.339 -6.38024e+00 1.81789e+01  0.00000e+00 0.00000e+00 2.09609e+02 109.339 7.49588e+01 109.339 0.9737 
1 1 1 -15 66  6  o 6  3.46004e+00 1.12082e+00 3.93923e+01 209.483 -2.08848e+00 -1.18080e+00 0.00000e+00 0.00000e+00 5.92327e+01 209.483 1.98404e+01 209.483 0.7536 
1 1 1 -15 66  7  o 2  4.30222e+00 1.25961e+00 1.04215e+02 225.440 -5.15764e+00 -5.23740e+00 0.00000e+00 0.00000e+00 4.68532e+01 225.440 5.73618e+01 45.440  0.9293 
1 1 1 -15 66  8  o 8  3.95452e+00 1.28581e+00 1.07401e+02 66.870  2.76081e+00  6.46333e+00  0.00000e+00 0.00000e+00 3.08027e+01 66.870  7.65982e+01 246.870 0.9258 
1 1 1 -15 66  9  o 4  3.70923e+00 1.24319e+00 9.37634e+01 289.503 2.10275e+00  -5.93689e+00 0.00000e+00 0.00000e+00 3.44510e+01 289.503 5.93124e+01 109.503 0.9168 
1 1 1 -15 67  1  o 5  4.59840e+00 1.32225e+00 6.42484e+01 70.287  1.43094e+00  3.99361e+00  0.00000e+00 0.00000e+00 8.80582e+01 70.287  2.38098e+01 70.287  0.8722 
1 1 1 -15 67  2  o 16 6.66771e+00 1.42200e+00 1.12117e+02 339.967 9.34117e+00  -3.40589e+00 0.00000e+00 0.00000e+00 1.27820e+02 339.967 1.57027e+01 339.967 0.9483 
1 1 1 -15 67  3  o 17 4.79078e+00 1.32975e+00 7.64033e+01 179.805 -5.28163e+00 1.79302e-02  0.00000e+00 0.00000e+00 8.70038e+01 179.805 1.06005e+01 179.805 0.8995 
1 1 1 -15 67  4  o 15 5.01864e+00 1.34686e+00 1.72169e+02 140.296 -9.79906e+00 8.13639e+00  0.00000e+00 0.00000e+00 1.03501e+01 140.296 1.61819e+02 320.296 0.9599 
1 1 1 -15 67  5  o 15 4.40503e+00 1.25936e+00 6.81003e+01 346.436 4.64001e+00  -1.11944e+00 0.00000e+00 0.00000e+00 7.99457e+01 346.436 1.18454e+01 346.436 0.8878 
1 1 1 -15 67  6  o 13 3.44587e+00 1.12556e+00 3.62983e+01 264.087 -2.21788e-01 -2.14160e+00 0.00000e+00 0.00000e+00 5.77093e+01 264.087 2.14109e+01 264.087 0.7214 
1 1 1 -15 67  7  o 6  3.66299e+00 1.14752e+00 5.04989e+01 299.998 1.74011e+00  -3.01419e+00 0.00000e+00 0.00000e+00 6.57589e+01 299.998 1.52600e+01 299.998 0.8401 
1 1 1 -15 67  8  o 10 3.80573e+00 1.21621e+00 3.48501e+01 90.402  -1.72395e-02 2.45730e+00  0.00000e+00 0.00000e+00 7.43486e+01 90.402  3.94985e+01 90.402  0.7603 
1 1 1 -15 67  9  o 3  3.64732e+00 1.21382e+00 2.78406e+01 251.369 -6.71235e-01 -1.99097e+00 0.00000e+00 0.00000e+00 7.02900e+01 251.369 4.24494e+01 251.369 0.7137 
1 1 1 -15 68  1  o 7  3.43387e+00 1.13556e+00 1.12301e+02 228.340 -4.25605e+00 -4.78363e+00 0.00000e+00 0.00000e+00 7.40655e+00 228.340 1.04894e+02 48.340  0.9182 
1 1 1 -15 68  2  o 18 4.61615e+00 1.29292e+00 7.65563e+01 250.819 -1.71965e+00 -4.94354e+00 0.00000e+00 0.00000e+00 8.08118e+01 250.819 4.25545e+00 250.819 0.8985 
1 1 1 -15 68  3  o 15 8.06306e+00 1.31935e+00 1.72171e+02 202.330 -1.93319e+01 -7.94056e+00 0.00000e+00 0.00000e+00 1.26105e+02 202.330 4.60653e+01 22.330  0.9758 
1 1 1 -15 68  4  o 10 5.36664e+00 1.33995e+00 6.69635e+01 23.283  4.68986e+00  2.01808e+00  0.00000e+00 0.00000e+00 1.15139e+02 23.283  4.81753e+01 23.283  0.8958 
1 1 1 -15 68  5  o 10 4.23223e+00 1.20212e+00 6.50154e+01 15.256  4.39799e+00  1.19956e+00  0.00000e+00 0.00000e+00 7.62657e+01 15.256  1.12503e+01 15.256  0.8820 
1 1 1 -15 68  6  o 12 8.08466e+00 1.39501e+00 1.17771e+02 224.709 -9.98135e+00 -9.88049e+00 0.00000e+00 0.00000e+00 1.76829e+02 224.709 5.90579e+01 224.709 0.9637 
1 1 1 -15 68  7  o 4  5.62046e+00 1.37897e+00 5.15194e+01 142.040 -3.70989e+00 2.89428e+00  0.00000e+00 0.00000e+00 1.36597e+02 142.040 8.50779e+01 142.040 0.8861 
1 1 1 -15 68  8  o 9  3.77981e+00 1.16626e+00 4.42976e+01 22.235  3.03374e+00  1.24023e+00  0.00000e+00 0.00000e+00 7.38783e+01 22.235  2.95807e+01 22.235  0.8286 
1 1 1 -15 68  9  o 9  5.39709e+00 1.56725e+00 1.10108e+02 244.719 -3.64887e+00 -7.72584e+00 0.00000e+00 0.00000e+00 8.10102e+01 244.719 2.90981e+01 64.719  0.9395 
1 1 1 -15 69  1  o 7  2.87618e+00 9.88365e-01 6.24504e+01 45.650  2.41717e+00  2.47267e+00  0.00000e+00 0.00000e+00 2.91361e+01 45.650  3.33142e+01 225.650 0.8389 
1 1 1 -15 69  2  o 1  6.05725e+00 1.27752e+00 1.05819e+02 181.780 -9.58716e+00 -2.97943e-01 0.00000e+00 0.00000e+00 1.11621e+02 181.780 5.80271e+00 181.780 0.9463 
1 1 1 -15 69  3  o 12 5.65861e+00 1.32826e+00 1.04181e+02 46.181  5.85031e+00  6.09663e+00  0.00000e+00 0.00000e+00 9.71806e+01 46.181  7.00054e+00 226.181 0.9388 
1 1 1 -15 69  4  o 19 5.44812e+00 1.34371e+00 1.56109e+02 64.022  5.52403e+00  1.13369e+01  0.00000e+00 0.00000e+00 4.18710e+01 64.022  1.14238e+02 244.022 0.9595 
1 1 1 -15 69  5  o 10 9.05966e+00 1.29740e+00 1.29753e+02 280.096 3.12463e+00  -1.75479e+01 0.00000e+00 0.00000e+00 2.03304e+02 280.096 7.35514e+01 280.096 0.9715 
1 1 1 -15 69  6  o 14 3.38676e+00 1.10261e+00 4.57567e+01 49.658  1.96052e+00  2.30834e+00  0.00000e+00 0.00000e+00 5.82164e+01 49.658  1.24597e+01 49.658  0.8121 
1 1 1 -15 69  7  o 3  3.29094e+00 1.07474e+00 5.06664e+01 213.286 -2.73212e+00 -1.79373e+00 0.00000e+00 0.00000e+00 5.22458e+01 213.286 1.57934e+00 213.286 0.8280 
1 1 1 -15 69  8  o 18 4.94666e+00 1.29483e+00 1.23712e+02 45.494  7.44383e+00  7.57325e+00  0.00000e+00 0.00000e+00 5.38906e+01 45.494  6.98213e+01 225.494 0.9517 
1 1 1 -15 70  1  o 4  6.02665e+00 1.45129e+00 1.31929e+02 104.838 -2.66941e+00 1.00762e+01  0.00000e+00 0.00000e+00 8.55307e+01 104.838 4.63984e+01 284.838 0.9508 
1 1 1 -15 70  2  o 11 4.69580e+00 1.27274e+00 9.69845e+01 245.341 -2.83217e+00 -6.16925e+00 0.00000e+00 0.00000e+00 6.74095e+01 245.341 2.95750e+01 65.341  0.9231 
1 1 1 -15 70  3  o 10 4.86021e+00 1.33500e+00 7.50489e+01 126.921 -3.28998e+00 4.37853e+00  0.00000e+00 0.00000e+00 9.13423e+01 126.921 1.62934e+01 126.921 0.9034 
1 1 1 -15 70  4  o 2  4.37245e+00 1.25060e+00 3.14483e+01 119.268 -1.07255e+00 1.91373e+00  0.00000e+00 0.00000e+00 8.89463e+01 119.268 5.74980e+01 119.268 0.7272 
1 1 1 -15 70  5  o 6  5.39251e+00 1.35541e+00 8.80865e+01 317.905 5.36253e+00  -4.84449e+00 0.00000e+00 0.00000e+00 1.01234e+02 317.905 1.31473e+01 317.905 0.9280 
1 1 1 -15 70  6  o 4  5.61886e+00 1.40842e+00 1.02725e+02 146.224 -7.42117e+00 4.96347e+00  0.00000e+00 0.00000e+00 9.73787e+01 146.224 5.34659e+00 326.224 0.9422 
1 1 1 -15 70  7  o 6  3.30779e+00 1.07483e+00 1.58067e+01 219.760 -8.39828e-01 -6.98730e-01 0.00000e+00 0.00000e+00 4.39208e+01 219.760 2.81141e+01 219.760 0.4782 
1 1 1 -15 70  8  o 10 4.25701e+00 1.22906e+00 3.76339e+01 261.008 -4.68834e-01 -2.96263e+00 0.00000e+00 0.00000e+00 9.24200e+01 261.008 5.47861e+01 261.008 0.8099 
1 1 1 -15 71  1  o 12 8.46660e+00 1.48544e+00 1.49919e+02 150.092 -1.46601e+01 8.43266e+00  0.00000e+00 0.00000e+00 1.61697e+02 150.092 1.17773e+01 150.092 0.9700 
1 1 1 -15 71  2  o 10 3.59348e+00 1.14514e+00 3.88874e+01 12.533  2.34767e+00  5.21881e-01  0.00000e+00 0.00000e+00 6.38862e+01 12.533  2.49988e+01 12.533  0.7543 
1 1 1 -15 71  3  o 13 5.83575e+00 1.33751e+00 1.04806e+02 331.682 8.04587e+00  -4.33556e+00 0.00000e+00 0.00000e+00 1.03837e+02 331.682 9.68674e-01 151.682 0.9436 
1 1 1 -15 71  4  o 9  3.59027e+00 1.13898e+00 3.22926e+01 219.699 -1.53406e+00 -1.27357e+00 0.00000e+00 0.00000e+00 6.24128e+01 219.699 3.01202e+01 219.699 0.6968 
1 1 1 -15 71  5  o 2  4.64981e+00 1.26899e+00 6.04132e+01 288.837 1.54711e+00  -4.53497e+00 0.00000e+00 0.00000e+00 9.58244e+01 288.837 3.54112e+01 288.837 0.8883 
1 1 1 -15 71  6  o 10 5.79635e+00 1.32749e+00 1.21742e+02 255.201 -3.06694e+00 -1.16089e+01 0.00000e+00 0.00000e+00 8.79710e+01 255.201 3.37712e+01 75.201  0.9574 
1 1 1 -15 71  7  o 10 5.03429e+00 1.33728e+00 7.20638e+01 307.303 3.71539e+00  -4.87655e+00 0.00000e+00 0.00000e+00 1.01711e+02 307.303 2.96473e+01 307.303 0.9143 
1 1 1 -15 71  8  o 2  7.37604e+00 1.35607e+00 1.14326e+02 75.638  3.71905e+00  1.45248e+01  0.00000e+00 0.00000e+00 1.54395e+02 75.638  4.00689e+01 75.638  0.9661 
1 1 1 -15 72  1  o 19 4.46762e+00 1.32799e+00 5.47744e+01 254.529 -9.82091e-01 -3.54837e+00 0.00000e+00 0.00000e+00 8.93026e+01 254.529 3.45283e+01 254.529 0.8501 
1 1 1 -15 72  2  o 6  4.06578e+00 1.23071e+00 7.68899e+01 6.763   4.95164e+00  5.87162e-01  0.00000e+00 0.00000e+00 6.07648e+01 6.763   1.61251e+01 186.762 0.8931 
1 1 1 -15 72  3  f 0  8.32919e+00 1.33133e+00 1.54219e+02 150.124 -1.65929e+01 9.53217e+00  0.00000e+00 0.00000e+00 1.52951e+02 150.124 1.26827e+00 330.124 0.9735 
1 1 1 -15 72  4  o 9  3.20676e+00 1.07186e+00 1.68381e+01 309.196 6.47697e-01  -7.94262e-01 0.00000e+00 0.00000e+00 3.84059e+01 309.196 2.15678e+01 309.196 0.4551 
1 1 1 -15 72  5  o 7  3.30060e+00 1.05225e+00 4.92424e+01 213.034 -2.83368e+00 -1.84258e+00 0.00000e+00 0.00000e+00 5.49321e+01 213.034 5.68971e+00 213.034 0.8346 
1 1 1 -15 72  6  o 7  2.86200e+00 9.61772e-01 7.02412e+01 0.684   4.62601e+00  5.52205e-02  0.00000e+00 0.00000e+00 2.53410e+01 0.684   4.49002e+01 180.684 0.8839 
1 1 1 -15 72  7  o 17 4.35831e+00 1.23266e+00 8.56972e+01 58.292  3.59022e+00  5.81120e+00  0.00000e+00 0.00000e+00 6.62359e+01 58.292  1.94613e+01 238.292 0.9236 
1 1 1 -15 72  8  o 6  5.28197e+00 1.42439e+00 1.00489e+02 137.411 -6.43749e+00 5.91735e+00  0.00000e+00 0.00000e+00 8.69048e+01 137.411 1.35843e+01 317.411 0.9410 
1 1 1 -15 73  1  o 14 4.11321e+00 1.20320e+00 2.24596e+01 272.839 7.50181e-02  -1.51261e+00 0.00000e+00 0.00000e+00 7.11000e+01 272.839 4.86405e+01 272.839 0.5997 
1 1 1 -15 73  2  o 1  4.48481e+00 1.24900e+00 5.94135e+01 129.859 -2.70330e+00 3.23783e+00  0.00000e+00 0.00000e+00 8.87171e+01 129.859 2.93036e+01 129.859 0.8714 
1 1 1 -15 73  3  o 7  6.16089e+00 1.31502e+00 9.67003e+01 138.143 -6.97052e+00 6.24475e+00  0.00000e+00 0.00000e+00 1.23798e+02 138.143 2.70980e+01 138.143 0.9450 
1 1 1 -15 73  4  o 16 9.41108e+00 1.25791e+00 1.76657e+02 315.501 2.03898e+01  -2.00359e+01 0.00000e+00 0.00000e+00 1.73207e+02 315.501 3.44937e+00 135.502 0.9824 
1 1 1 -15 73  5  o 12 3.37808e+00 1.08236e+00 9.21831e+01 120.446 -3.31431e+00 5.63871e+00  0.00000e+00 0.00000e+00 2.53276e+01 120.446 6.68554e+01 300.446 0.9200 
1 1 1 -15 73  6  o 1  4.29438e+00 1.23422e+00 5.61621e+01 113.209 -1.71980e+00 4.01080e+00  0.00000e+00 0.00000e+00 8.59734e+01 113.209 2.98112e+01 113.209 0.8762 
1 1 1 -15 73  7  o 12 3.97956e+00 1.22427e+00 9.22137e+01 247.308 -2.66063e+00 -6.36285e+00 0.00000e+00 0.00000e+00 4.66037e+01 247.308 4.56100e+01 67.308  0.9244 
1 1 1 -15 74  1  o 12 4.71308e+00 1.25838e+00 7.75081e+01 20.540  5.61474e+00  2.10377e+00  0.00000e+00 0.00000e+00 8.55467e+01 20.540  8.03856e+00 20.540  0.9123 
1 1 1 -15 74  2  f 0  6.25008e+00 1.40728e+00 6.58666e+01 101.239 -1.17167e+00 5.89636e+00  0.00000e+00 0.00000e+00 1.50270e+02 101.239 8.44031e+01 101.239 0.9125 
1 1 1 -15 74  3  o 9  2.79762e+00 9.45766e-01 4.00521e+01 66.650  9.84109e-01  2.27964e+00  0.00000e+00 0.00000e+00 4.07924e+01 66.650  7.40271e-01 66.650  0.7631 
1 1 1 -15 74  4  o 17 2.86580e+00 9.82530e-01 2.00449e+01 170.769 -1.29313e+00 2.10155e-01  0.00000e+00 0.00000e+00 3.91110e+01 170.769 1.90661e+01 170.769 0.5456 
1 1 1 -15 74  5  o 15 5.28980e+00 1.31948e+00 5.66053e+01 183.604 -5.07537e+00 -3.19634e-01 0.00000e+00 0.00000e+00 1.22433e+02 183.604 6.58272e+01 183.604 0.8953 
1 1 1 -15 74  6  o 4  4.11791e+00 1.21960e+00 5.71142e+01 7.190   4.24010e+00  5.34889e-01  0.00000e+00 0.00000e+00 7.87002e+01 7.190   2.15860e+01 7.190   0.8733 
1 1 1 -15 74  7  f 0  3.84534e+00 1.17830e+00 5.12287e+01 88.989  7.27840e-02  4.12328e+00  0.00000e+00 0.00000e+00 7.47210e+01 88.989  2.34923e+01 88.989  0.8681 
1 1 1 -15 75  1  o 16 3.58054e+00 1.12991e+00 4.09661e+01 128.167 -1.76937e+00 2.25115e+00  0.00000e+00 0.00000e+00 6.75484e+01 128.167 2.65822e+01 128.167 0.7993 
1 1 1 -15 75  2  o 5  4.84862e+00 1.30507e+00 8.67868e+01 285.217 1.86141e+00  -6.84293e+00 0.00000e+00 0.00000e+00 8.34231e+01 285.217 3.36375e+00 105.217 0.9265 
1 1 1 -15 75  3  o 13 4.76504e+00 1.29958e+00 1.10769e+02 335.050 8.31794e+00  -3.86985e+00 0.00000e+00 0.00000e+00 5.94966e+01 335.050 5.12721e+01 155.050 0.9438 
1 1 1 -15 75  4  o 19 1.05811e+01 1.26864e+00 1.75029e+02 184.751 -3.09591e+01 -2.57309e+00 0.00000e+00 0.00000e+00 2.18740e+02 184.751 4.37108e+01 184.751 0.9838 
1 1 1 -15 75  5  o 12 3.70513e+00 1.14913e+00 2.93190e+01 17.362  2.01525e+00  6.30058e-01  0.00000e+00 0.00000e+00 7.08421e+01 17.362  4.15231e+01 17.362  0.7153 
1 1 1 -15 75  6  o 10 4.10902e+00 1.19300e+00 5.94654e+01 8.865   4.66638e+00  7.27811e-01  0.00000e+00 0.00000e+00 7.80842e+01 8.865   1.86188e+01 8.865   0.8865 
1 1 1 -15 75  7  o 1  5.30102e+00 1.31474e+00 7.03469e+01 189.084 -6.68715e+00 -1.06919e+00 0.00000e+00 0.00000e+00 1.14199e+02 189.084 4.38517e+01 189.084 0.9229 
1 1 1 -15 76  1  o 18 5.17019e+00 1.18613e+00 7.51730e+01 171.263 -7.35611e+00 1.13049e+00  0.00000e+00 0.00000e+00 1.07125e+02 171.263 3.19515e+01 171.263 0.9302 
1 1 1 -15 76  2  o 4  4.11551e+00 1.22560e+00 5.77824e+01 261.475 -6.54696e-01 -4.36748e+00 0.00000e+00 0.00000e+00 7.90661e+01 261.475 2.12837e+01 261.475 0.8778 
1 1 1 -15 76  3  o 14 5.89315e+00 1.26440e+00 1.07381e+02 85.316  8.69898e-01  1.06165e+01  0.00000e+00 0.00000e+00 1.04940e+02 85.316  2.44018e+00 265.316 0.9518 
1 1 1 -15 76  4  o 18 4.97224e+00 1.32587e+00 2.08459e+01 43.138  1.26799e+00  1.18816e+00  0.00000e+00 0.00000e+00 1.01321e+02 43.138  8.04749e+01 43.138  0.6496 
1 1 1 -15 76  5  o 3  3.74932e+00 1.14337e+00 4.84625e+01 69.344  1.24106e+00  3.29200e+00  0.00000e+00 0.00000e+00 7.08357e+01 69.344  2.23732e+01 69.344  0.8420 
1 1 1 -15 76  6  o 13 4.19743e+00 1.20706e+00 3.82540e+01 350.585 3.23066e+00  -5.35693e-01 0.00000e+00 0.00000e+00 9.30164e+01 350.585 5.47624e+01 350.585 0.8284 
1 1 1 -15 76  7  o 11 2.90738e+00 9.80038e-01 3.58596e+01 122.926 -1.46758e+00 2.26632e+00  0.00000e+00 0.00000e+00 5.02263e+01 122.926 1.43667e+01 122.926 0.7851 
1 1 1 -15 77  1  o 9  4.36175e+00 1.21776e+00 3.71156e+01 19.237  2.66991e+00  9.31690e-01  0.00000e+00 0.00000e+00 9.45332e+01 19.237  5.74176e+01 19.237  0.7964 
1 1 1 -15 77  2  o 16 3.92005e+00 1.18501e+00 6.04609e+01 3.321   4.50664e+00  2.61504e-01  0.00000e+00 0.00000e+00 7.02956e+01 3.321   9.83475e+00 3.321   0.8807 
1 1 1 -15 77  3  o 16 3.62899e+00 1.12566e+00 9.10265e+01 250.061 -2.23681e+00 -6.16592e+00 0.00000e+00 0.00000e+00 3.53556e+01 250.061 5.56708e+01 70.061  0.9203 
1 1 1 -15 77  4  o 11 1.14266e+01 1.11838e+00 1.71429e+02 33.167  3.34179e+01  2.18409e+01  0.00000e+00 0.00000e+00 2.55193e+02 33.167  8.37639e+01 33.167  0.9874 
1 1 1 -15 77  5  o 11 4.61330e+00 1.31279e+00 1.38918e+02 172.977 -1.10758e+01 1.36453e+00  0.00000e+00 0.00000e+00 2.73674e+01 172.977 1.11550e+02 352.977 0.9541 
1 1 1 -15 77  6  o 17 3.49706e+00 1.11125e+00 7.99199e+01 223.588 -4.34483e+00 -4.13575e+00 0.00000e+00 0.00000e+00 4.05013e+01 223.588 3.94186e+01 43.588  0.9123 
1 1 1 -15 78  1  o 5  4.61669e+00 1.29056e+00 8.75751e+01 137.141 -5.11495e+00 4.74630e+00  0.00000e+00 0.00000e+00 7.42836e+01 137.141 1.32915e+01 317.141 0.9253 
1 1 1 -15 78  2  o 8  4.92218e+00 1.30494e+00 6.54493e+01 283.985 1.32687e+00  -5.32774e+00 0.00000e+00 0.00000e+00 1.02966e+02 283.985 3.75164e+01 283.985 0.9036 
1 1 1 -15 78  3  o 6  4.23651e+00 1.19836e+00 5.54442e+01 120.176 -2.24596e+00 3.86266e+00  0.00000e+00 0.00000e+00 8.55133e+01 120.176 3.00691e+01 120.176 0.8794 
1 1 1 -15 78  4  o 19 3.79809e+00 1.14766e+00 5.57084e+01 254.073 -1.14059e+00 -3.99682e+00 0.00000e+00 0.00000e+00 6.91067e+01 254.073 1.33983e+01 254.073 0.8693 
1 1 1 -15 78  5  f 0  4.66874e+00 1.28007e+00 7.04105e+01 222.394 -4.62581e+00 -4.22304e+00 0.00000e+00 0.00000e+00 9.11684e+01 222.394 2.07580e+01 222.394 0.9163 
1 1 1 -15 78  6  o 1  2.46550e+00 8.57480e-01 2.70571e+01 80.969  3.12871e-01  1.96842e+00  0.00000e+00 0.00000e+00 3.77568e+01 80.969  1.06997e+01 80.969  0.6966 
1 1 1 -15 79  1  o 11 6.21214e+00 1.38022e+00 1.19772e+02 24.583  1.07517e+01  4.91867e+00  0.00000e+00 0.00000e+00 1.05376e+02 24.583  1.43958e+01 204.583 0.9567 
1 1 1 -15 79  2  o 11 4.98844e+00 1.33133e+00 6.70047e+01 262.610 -7.11235e-01 -5.48401e+00 0.00000e+00 0.00000e+00 1.03780e+02 262.610 3.67752e+01 262.610 0.9044 
1 1 1 -15 79  3  o 14 3.93800e+00 1.17149e+00 5.95989e+01 8.648   4.46633e+00  6.79282e-01  0.00000e+00 0.00000e+00 7.16160e+01 8.648   1.20171e+01 8.648   0.8808 
1 1 1 -15 79  4  f 0  5.91635e+00 1.32478e+00 1.35982e+02 292.329 5.69381e+00  -1.38629e+01 0.00000e+00 0.00000e+00 8.00402e+01 292.329 5.59423e+01 112.329 0.9660 
1 1 1 -15 79  5  o 6  3.64739e+00 1.12041e+00 8.01994e+01 78.570  1.25656e+00  6.21507e+00  0.00000e+00 0.00000e+00 4.61537e+01 78.570  3.40456e+01 258.570 0.9173 
1 1 1 -15 79  6  o 15 5.12206e+00 1.31635e+00 7.52929e+01 110.719 -2.66438e+00 7.04417e+00  0.00000e+00 0.00000e+00 1.04621e+02 110.719 2.93285e+01 110.719 0.9310 
1 1 1 -15 80  1  o 9  3.44260e+00 1.10505e+00 4.32831e+01 109.957 -1.06152e+00 2.92332e+00  0.00000e+00 0.00000e+00 6.33467e+01 109.957 2.00636e+01 109.957 0.8178 
1 1 1 -15 80  2  o 10 3.89924e+00 1.18926e+00 4.35116e+01 82.344  4.38078e-01  3.25904e+00  0.00000e+00 0.00000e+00 7.88647e+01 82.344  3.53531e+01 82.344  0.8292 
1 1 1 -15 80  3  o 9  5.92485e+00 1.31862e+00 8.43909e+01 179.575 -9.36591e+00 6.95428e-02  0.00000e+00 0.00000e+00 1.27359e+02 179.575 4.29681e+01 179.575 0.9450 
1 1 1 -15 80  4  o 16 3.21879e+00 1.03506e+00 4.86383e+01 193.144 -3.50647e+00 -8.18822e-01 0.00000e+00 0.00000e+00 5.42868e+01 193.144 5.64855e+00 193.144 0.8462 
1 1 1 -15 80  5  o 17 5.22633e+00 1.35002e+00 6.83558e+01 52.272  3.98330e+00  5.14850e+00  0.00000e+00 0.00000e+00 1.13102e+02 52.272  4.47458e+01 52.272  0.9196 
1 1 1 -15 80  6  o 8  4.75792e+00 1.31465e+00 5.74671e+01 179.258 -5.37475e+00 6.95901e-02  0.00000e+00 0.00000e+00 1.04306e+02 179.258 4.68387e+01 179.258 0.9014 
1 1 1 -15 81  1  o 10 7.07836e+00 1.34691e+00 1.06026e+02 100.915 -2.54611e+00 1.32027e+01  0.00000e+00 0.00000e+00 1.51834e+02 100.915 4.58077e+01 100.915 0.9621 
1 1 1 -15 81  2  f 0  5.00764e+00 1.31650e+00 7.83222e+01 292.712 2.78903e+00  -6.66348e+00 0.00000e+00 0.00000e+00 9.75112e+01 292.712 1.91890e+01 292.712 0.9279 
1 1 1 -15 81  3  o 14 3.33320e+00 1.07518e+00 6.84889e+01 266.608 -2.99600e-01 -5.05507e+00 0.00000e+00 0.00000e+00 4.42890e+01 266.608 2.41999e+01 86.608  0.8948 
1 1 1 -15 81  4  o 6  4.52427e+00 1.20794e+00 5.56486e+01 128.543 -3.32923e+00 4.17899e+00  0.00000e+00 0.00000e+00 9.83171e+01 128.543 4.26685e+01 128.543 0.9008 
1 1 1 -15 81  5  o 18 2.63802e+00 9.01897e-01 4.98850e+01 267.558 -1.52696e-01 -3.58051e+00 0.00000e+00 0.00000e+00 3.42930e+01 267.558 1.55920e+01 87.558  0.8454 
1 1 1 -15 81  6  o 13 3.78382e+00 1.17303e+00 5.59442e+01 58.501  2.44517e+00  3.99029e+00  0.00000e+00 0.00000e+00 7.03936e+01 58.501  1.44493e+01 58.501  0.8854 
1 1 1 -15 82  1  o 18 8.02049e+00 1.28986e+00 9.08930e+01 229.857 -8.72665e+00 -1.03475e+01 0.00000e+00 0.00000e+00 2.01301e+02 229.857 1.10408e+02 229.857 0.9623 
1 1 1 -15 82  2  o 15 4.56849e+00 1.26471e+00 1.09835e+02 7.595   9.44607e+00  1.25951e+00  0.00000e+00 0.00000e+00 5.36584e+01 7.595   5.61770e+01 187.595 0.9460 
1 1 1 -15 82  3  o 11 3.01892e+00 1.00676e+00 2.96908e+01 253.681 -6.50661e-01 -2.22231e+00 0.00000e+00 0.00000e+00 5.51431e+01 253.681 2.54523e+01 253.681 0.7434 
1 1 1 -15 82  4  f 0  3.47913e+00 1.07768e+00 5.39306e+00 92.285  -1.85060e-02 4.63826e-01  0.00000e+00 0.00000e+00 2.43141e+01 92.285  1.89211e+01 92.285  0.2261 
1 1 1 -15 82  5  o 8  3.34324e+00 1.07180e+00 5.31206e+01 84.668  4.12953e-01  4.42462e+00  0.00000e+00 0.00000e+00 5.77377e+01 84.668  4.61713e+00 84.668  0.8787 
1 1 1 -15 82  6  o 9  2.56123e+00 8.74840e-01 6.57600e+01 37.788  4.07239e+00  3.15748e+00  0.00000e+00 0.00000e+00 2.08414e+01 37.788  4.49186e+01 217.788 0.8968 
1 1 1 -15 83  1  o 19 6.12667e+00 1.40150e+00 1.20483e+02 65.340  5.34786e+00  1.16485e+01  0.00000e+00 0.00000e+00 1.02166e+02 65.340  1.83171e+01 245.340 0.9602 
1 1 1 -15 83  2  o 4  3.08506e+00 1.02232e+00 2.23755e+01 39.618  1.32214e+00  1.09447e+00  0.00000e+00 0.00000e+00 5.29152e+01 39.618  3.05397e+01 39.618  0.6453 
1 1 1 -15 83  3  o 13 3.25926e+00 1.06324e+00 5.59515e+01 168.240 -4.48080e+00 9.32801e-01  0.00000e+00 0.00000e+00 5.27604e+01 168.240 3.19103e+00 348.240 0.8825 
1 1 1 -15 83  4  o 4  3.62718e+00 1.11556e+00 5.78904e+01 75.195  1.28546e+00  4.86360e+00  0.00000e+00 0.00000e+00 6.45752e+01 75.195  6.68479e+00 75.195  0.8941 
1 1 1 -15 83  5  o 11 4.88208e+00 1.26942e+00 9.19188e+01 130.916 -5.91277e+00 6.82196e+00  0.00000e+00 0.00000e+00 8.17572e+01 130.916 1.01616e+01 310.916 0.9429 
1 1 1 -15 84  1  o 13 6.62284e+00 1.35345e+00 1.34200e+02 93.244  -9.46330e-01 1.66969e+01  0.00000e+00 0.00000e+00 1.08797e+02 93.244  2.54029e+01 273.244 0.9696 
1 1 1 -15 84  2  o 17 4.57753e+00 1.29854e+00 6.46692e+01 299.862 2.76895e+00  -4.82266e+00 0.00000e+00 0.00000e+00 9.19719e+01 299.862 2.73027e+01 299.862 0.9050 
1 1 1 -15 84  3  o 17 6.53228e+00 1.39549e+00 8.51947e+01 222.729 -7.42869e+00 -6.86191e+00 0.00000e+00 0.00000e+00 1.49087e+02 222.729 6.38925e+01 222.729 0.9492 
1 1 1 -15 84  4  o 4  5.11515e+00 1.30425e+00 7.71660e+01 354.956 7.65388e+00  -6.75607e-01 0.00000e+00 0.00000e+00 1.02908e+02 354.956 2.57417e+01 354.956 0.9325 
1 1 1 -15 84  5  o 2  5.13486e+00 1.32413e+00 7.86701e+01 270.166 2.27556e-02  -7.86674e+00 0.00000e+00 0.00000e+00 1.02256e+02 270.166 2.35860e+01 270.166 0.9341 
1 1 1 -15 85  1  o 9  2.48073e+00 8.56129e-01 5.29986e+01 294.607 1.70494e+00  -3.72274e+00 0.00000e+00 0.00000e+00 2.83745e+01 294.607 2.46241e+01 114.607 0.8671 
1 1 1 -15 85  2  o 2  3.20597e+00 1.06383e+00 6.76096e+01 353.341 5.25163e+00  -6.13132e-01 0.00000e+00 0.00000e+00 4.14287e+01 353.341 2.61809e+01 173.341 0.8996 
1 1 1 -15 85  3  o 19 3.39169e+00 1.07529e+00 6.08175e+01 28.464  4.41247e+00  2.39215e+00  0.00000e+00 0.00000e+00 5.37044e+01 28.464  7.11307e+00 208.464 0.8938 
1 1 1 -15 85  4  o 1  5.07053e+00 1.32926e+00 9.92243e+01 249.779 -3.37137e+00 -9.15261e+00 0.00000e+00 0.00000e+00 8.20714e+01 249.779 1.71528e+01 69.779  0.9473 
1 1 1 -15 85  5  o 8  3.12195e+00 1.01787e+00 6.65239e+01 25.098  4.86528e+00  2.27882e+00  0.00000e+00 0.00000e+00 3.95985e+01 25.098  2.69254e+01 205.098 0.9014 
1 1 1 -15 86  1  o 7  3.25655e+00 1.04707e+00 3.57908e+01 338.420 2.89427e+00  -1.14473e+00 0.00000e+00 0.00000e+00 6.49584e+01 338.420 2.91675e+01 338.420 0.8180 
1 1 1 -15 86  2  o 18 4.80624e+00 1.34109e+00 8.30396e+01 40.125  6.01527e+00  5.06986e+00  0.00000e+00 0.00000e+00 8.66448e+01 40.125  3.60524e+00 40.125  0.9341 
1 1 1 -15 86  3  o 9  2.98418e+00 9.89956e-01 5.65056e+01 196.188 -4.40755e+00 -1.27955e+00 0.00000e+00 0.00000e+00 4.30020e+01 196.188 1.35036e+01 16.188  0.8829 
1 1 1 -15 86  4  o 9  2.82871e+00 9.50937e-01 5.70512e+01 202.586 -4.12369e+00 -1.71538e+00 0.00000e+00 0.00000e+00 3.68137e+01 202.586 2.02375e+01 22.586  0.8793 
1 1 1 -15 86  5  o 17 2.90437e+00 9.70034e-01 4.65244e+01 226.704 -2.80597e+00 -2.97807e+00 0.00000e+00 0.00000e+00 4.84116e+01 226.704 1.88722e+00 226.704 0.8670 
1 1 1 -15 87  1  o 14 7.62435e+00 1.41288e+00 8.53468e+01 157.331 -1.11770e+01 4.66844e+00  0.00000e+00 0.00000e+00 1.90786e+02 157.331 1.05439e+02 157.331 0.9578 
1 1 1 -15 87  2  o 10 2.53419e+00 8.76728e-01 4.57333e+01 298.371 1.80393e+00  -3.34037e+00 0.00000e+00 0.00000e+00 3.61611e+01 298.371 9.57223e+00 118.371 0.8552 
1 1 1 -15 87  3  o 8  4.45631e+00 1.22599e+00 1.35034e+02 197.959 -1.20642e+01 -3.91026e+00 0.00000e+00 0.00000e+00 2.64528e+01 197.959 1.08582e+02 17.959  0.9597 
1 1 1 -15 87  4  o 8  4.14966e+00 1.20043e+00 5.14801e+01 48.208  3.35484e+00  3.75329e+00  0.00000e+00 0.00000e+00 8.85079e+01 48.208  3.70278e+01 48.208  0.8942 
1 1 1 -15 88  1  o 12 2.93062e+00 9.73725e-01 7.02340e+01 305.317 3.40731e+00  -4.80935e+00 0.00000e+00 0.00000e+00 3.06603e+01 305.317 3.95737e+01 125.317 0.9107 
1 1 1 -15 88  2  o 8  3.41382e+00 1.09518e+00 2.34438e+01 357.815 2.01522e+00  -7.69022e-02 0.00000e+00 0.00000e+00 6.68973e+01 357.815 4.34535e+01 357.815 0.7005 
1 1 1 -15 88  3  o 8  3.79995e+00 1.12973e+00 8.72469e+01 22.835  7.76648e+00  3.27036e+00  0.00000e+00 0.00000e+00 4.73977e+01 22.835  3.98492e+01 202.835 0.9386 
1 1 1 -15 88  4  o 19 2.79264e+00 9.37214e-01 1.93261e+01 173.508 -1.77761e+00 2.02287e-01  0.00000e+00 0.00000e+00 5.01857e+01 173.508 3.08596e+01 173.508 0.6599 
1 1 1 -15 89  2  o 12 2.70331e+00 9.09229e-01 6.39488e+01 152.622 -5.05513e+00 2.61786e+00  0.00000e+00 0.00000e+00 2.86877e+01 152.622 3.52611e+01 332.622 0.9073 
1 1 1 -15 89  3  o 17 2.58320e+00 8.84403e-01 4.42247e+01 90.082  -5.73541e-03 4.02795e+00  0.00000e+00 0.00000e+00 4.00648e+01 90.082  4.15986e+00 270.082 0.8646 
1 1 1 -15 89  4  o 14 3.55692e+00 1.10800e+00 1.60795e+01 41.607  1.11142e+00  9.87020e-01  0.00000e+00 0.00000e+00 6.34268e+01 41.607  4.73473e+01 41.607  0.5928 
1 1 1 -15 90  2  o 8  3.51353e+00 1.09544e+00 3.51927e+01 241.916 -1.57178e+00 -2.94564e+00 0.00000e+00 0.00000e+00 7.52170e+01 241.916 4.00244e+01 241.916 0.8322 
1 1 1 -15 90  3  o 5  2.75304e+00 9.32566e-01 3.86835e+01 293.359 1.33026e+00  -3.08008e+00 0.00000e+00 0.00000e+00 4.78608e+01 293.359 9.17727e+00 293.359 0.8332 
1 1 1 -14 0   1  o 7  1.75846e+01 2.12482e+00 2.36852e+02 180.000 -1.21920e+01 -0.00000e+00 0.00000e+00 0.00000e+00 4.33543e+02 180.000 1.96691e+02 180.000 1.0000 
1 1 1 -14 0   2  o 17 1.08242e+01 2.76599e+00 2.14045e+02 0.000   5.98816e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.98343e+02 0.000   1.57020e+01 180.000 1.0000 
1 1 1 -14 0   3  o 17 2.45346e+01 1.84421e+00 4.83451e+02 180.000 -4.13450e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.50625e+02 180.000 3.28260e+01 0.000   1.0000 
1 1 1 -14 0   4  o 9  9.28832e+00 3.12918e+00 1.43180e+02 0.000   3.30734e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.09222e+02 0.000   6.60416e+01 0.000   0.9973 
1 1 1 -14 0   5  o 7  4.48663e+00 2.47230e+00 1.27035e+02 0.000   1.78730e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.42036e+01 0.000   9.28319e+01 180.000 0.9455 
1 1 1 -14 0   6  o 7  6.96296e+00 2.80622e+00 7.08684e+01 180.000 -1.45547e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.66260e+02 180.000 9.53917e+01 180.000 0.8968 
1 1 1 -14 0   7  o 8  4.88649e+00 2.61792e+00 9.05294e+01 0.000   1.49934e+00  0.00000e+00  0.00000e+00 0.00000e+00 7.72550e+01 0.000   1.32744e+01 180.000 0.9050 
1 1 1 -14 0   8  o 6  3.80651e+00 2.32579e+00 1.82001e+02 0.000   2.73253e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.89474e+01 180.000 2.20948e+02 180.000 0.9916 
1 1 1 -14 0   9  o 10 4.47850e+00 2.42979e+00 6.99580e+01 180.000 -1.28923e+00 -0.00000e+00 0.00000e+00 0.00000e+00 7.56769e+01 180.000 5.71891e+00 180.000 0.8589 
1 1 1 -14 0   10 o 8  3.01063e+00 1.97484e+00 8.16824e+00 0.000   1.29217e-01  0.00000e+00  0.00000e+00 0.00000e+00 6.46192e+00 0.000   1.70632e+00 180.000 0.1285 
1 1 1 -14 0   11 o 15 1.03424e+01 2.33903e+00 2.32005e+02 180.000 -1.13474e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.58635e+02 180.000 7.33704e+01 0.000   1.0000 
1 1 1 -14 0   12 o 12 2.53945e+00 1.78637e+00 1.84227e+00 0.000   3.05524e-02  0.00000e+00  0.00000e+00 0.00000e+00 1.08361e+00 0.000   7.58658e-01 180.000 0.0305 
1 1 1 -14 0   13 o 8  3.33326e+00 2.19102e+00 2.09947e+02 180.000 -3.74715e+00 0.00000e+00  0.00000e+00 0.00000e+00 8.45130e+01 0.000   2.94460e+02 0.000   0.9989 
1 1 1 -14 0   14 o 6  6.01378e+00 2.91964e+00 4.70580e+01 0.000   1.21008e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.42240e+02 0.000   9.51817e+01 0.000   0.8367 
1 1 1 -14 0   15 o 1  1.20844e+01 2.10039e+00 1.81955e+02 0.000   1.46018e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.72008e+02 0.000   9.00527e+01 0.000   1.0000 
1 1 1 -14 1   1  o 17 1.56688e+01 1.64184e+00 3.20841e+02 261.293 -4.24764e+00 -2.77355e+01 0.00000e+00 0.00000e+00 2.65772e+02 261.293 5.50694e+01 81.293  0.9820 
1 1 1 -14 1   2  o 7  9.55482e+00 1.79847e+00 1.59383e+02 152.691 -7.42655e+00 3.83461e+00  0.00000e+00 0.00000e+00 1.82120e+02 152.691 2.27372e+01 152.691 0.9381 
1 1 1 -14 1   3  o 18 1.40721e+01 1.57776e+00 2.61651e+02 44.494  1.65746e+01  1.62841e+01  0.00000e+00 0.00000e+00 2.62440e+02 44.494  7.88771e-01 44.494  0.9782 
1 1 1 -14 1   4  o 11 7.66550e+00 1.70894e+00 4.20183e+01 5.314   1.96171e+00  1.82475e-01  0.00000e+00 0.00000e+00 1.60015e+02 5.314   1.17996e+02 5.314   0.6928 
1 1 1 -14 1   5  o 5  1.90917e+01 1.00391e+00 3.09262e+02 63.409  2.19282e+01  4.38071e+01  0.00000e+00 0.00000e+00 4.08972e+02 63.409  9.97104e+01 63.409  0.9897 
1 1 1 -14 1   6  o 12 1.63274e+01 1.07544e+00 2.44112e+02 196.821 -3.26875e+01 -9.88219e+00 0.00000e+00 0.00000e+00 3.66791e+02 196.821 1.22678e+02 196.821 0.9852 
1 1 1 -14 1   7  o 2  1.50731e+01 1.09055e+00 2.63518e+02 59.438  1.92200e+01  3.25486e+01  0.00000e+00 0.00000e+00 3.00730e+02 59.438  3.72129e+01 59.438  0.9867 
1 1 1 -14 1   8  o 12 1.16141e+01 1.30515e+00 2.14734e+02 227.351 -1.56746e+01 -1.70168e+01 0.00000e+00 0.00000e+00 2.15829e+02 227.351 1.09588e+00 227.351 0.9781 
1 1 1 -14 1   9  o 15 3.97594e+00 1.27715e+00 3.77452e+01 275.976 1.61892e-01  -1.54658e+00 0.00000e+00 0.00000e+00 5.39931e+01 275.976 1.62479e+01 275.976 0.6094 
1 1 1 -14 1   10 o 13 5.40206e+00 1.48293e+00 8.74669e+01 142.254 -3.74122e+00 2.89629e+00  0.00000e+00 0.00000e+00 9.36849e+01 142.254 6.21800e+00 142.254 0.8868 
1 1 1 -14 1   11 o 3  5.82338e+00 1.57089e+00 1.77410e+02 113.711 -4.12666e+00 9.39606e+00  0.00000e+00 0.00000e+00 3.15351e+01 113.711 1.45875e+02 293.711 0.9500 
1 1 1 -14 1   12 o 3  1.05107e+01 1.55700e+00 2.03941e+02 290.675 8.20902e+00  -2.17533e+01 0.00000e+00 0.00000e+00 1.83931e+02 290.675 2.00103e+01 110.675 0.9783 
1 1 1 -14 1   13 o 5  5.01044e+00 1.52460e+00 4.52014e+01 108.687 -7.89175e-01 2.33320e+00  0.00000e+00 0.00000e+00 9.84274e+01 108.687 5.32259e+01 108.687 0.7609 
1 1 1 -14 1   14 o 9  7.91753e+00 1.73061e+00 1.49936e+02 260.147 -2.18201e+00 -1.25632e+01 0.00000e+00 0.00000e+00 1.35997e+02 260.147 1.39387e+01 80.147  0.9600 
1 1 1 -14 1   15 o 4  5.43414e+00 1.55655e+00 1.56778e+02 159.370 -1.00455e+01 3.78196e+00  0.00000e+00 0.00000e+00 3.76058e+01 159.370 1.19172e+02 339.370 0.9522 
1 1 1 -14 2   1  f 0  5.39268e+00 1.50277e+00 1.43668e+02 97.816  -6.16655e-01 4.49262e+00  0.00000e+00 0.00000e+00 3.75275e+01 97.816  1.06140e+02 277.815 0.8813 
1 1 1 -14 2   2  o 7  4.96751e+00 1.52852e+00 7.96552e+01 15.382  2.31068e+00  6.35695e-01  0.00000e+00 0.00000e+00 6.29035e+01 15.382  1.67517e+01 195.382 0.7533 
1 1 1 -14 2   3  o 9  1.53966e+01 1.42366e+00 2.78761e+02 112.636 -1.10361e+01 2.64661e+01  0.00000e+00 0.00000e+00 2.97096e+02 112.636 1.83355e+01 112.636 0.9824 
1 1 1 -14 2   4  o 16 1.44901e+01 1.34674e+00 2.08028e+02 332.048 1.86926e+01  -9.91903e+00 0.00000e+00 0.00000e+00 3.30018e+02 332.048 1.21990e+02 332.048 0.9761 
1 1 1 -14 2   5  o 1  1.96719e+01 9.93053e-01 3.33300e+02 259.673 -9.78463e+00 -5.36970e+01 0.00000e+00 0.00000e+00 4.07547e+02 259.673 7.42474e+01 259.673 0.9908 
1 1 1 -14 2   6  o 5  1.98801e+01 1.00567e+00 3.58083e+02 62.253  2.90808e+01  5.52806e+01  0.00000e+00 0.00000e+00 3.90814e+02 62.253  3.27310e+01 62.253  0.9920 
1 1 1 -14 2   7  o 7  7.76044e+00 1.55196e+00 2.08011e+02 261.423 -1.87767e+00 -1.24492e+01 0.00000e+00 0.00000e+00 7.44689e+01 261.423 1.33542e+02 81.423  0.9594 
1 1 1 -14 2   8  o 18 1.55555e+01 1.10530e+00 1.92695e+02 163.578 -2.91379e+01 8.58808e+00  0.00000e+00 0.00000e+00 3.87080e+02 163.578 1.94385e+02 163.578 0.9834 
1 1 1 -14 2   9  o 19 4.24549e+00 1.32734e+00 5.97354e+01 87.976  9.05026e-02  2.56038e+00  0.00000e+00 0.00000e+00 6.42814e+01 87.976  4.54599e+00 87.976  0.7716 
1 1 1 -14 2   10 o 15 7.43670e+00 1.56257e+00 8.11814e+01 251.550 -1.82914e+00 -5.48253e+00 0.00000e+00 0.00000e+00 1.74396e+02 251.550 9.32149e+01 251.550 0.9088 
1 1 1 -14 2   11 o 12 4.00887e+00 1.28651e+00 6.68744e+01 96.742  -3.68851e-01 3.12006e+00  0.00000e+00 0.00000e+00 5.72796e+01 96.742  9.59482e+00 276.742 0.8199 
1 1 1 -14 2   12 o 9  4.24395e+00 1.36344e+00 7.00375e+01 208.604 -3.20055e+00 -1.74527e+00 0.00000e+00 0.00000e+00 6.57787e+01 208.604 4.25885e+00 28.604  0.8484 
1 1 1 -14 2   13 o 19 6.37301e+00 1.64481e+00 1.27398e+02 98.892  -1.33914e+00 8.55896e+00  0.00000e+00 0.00000e+00 9.83764e+01 98.892  2.90214e+01 278.892 0.9404 
1 1 1 -14 2   14 o 11 6.37382e+00 1.66126e+00 4.16039e+01 123.342 -1.64361e+00 2.49815e+00  0.00000e+00 0.00000e+00 1.52447e+02 123.342 1.10843e+02 123.342 0.8093 
1 1 1 -14 2   15 o 3  3.61008e+00 1.21923e+00 1.71923e+01 13.736  9.75770e-01  2.38514e-01  0.00000e+00 0.00000e+00 4.35612e+01 13.736  2.63689e+01 13.736  0.4480 
1 1 1 -14 3   1  o 12 7.43264e+00 1.71789e+00 1.19748e+02 336.964 4.44942e+00  -1.89193e+00 0.00000e+00 0.00000e+00 1.32274e+02 336.964 1.25254e+01 336.964 0.8894 
1 1 1 -14 3   2  o 7  1.26136e+01 1.67303e+00 1.93167e+02 102.166 -2.95189e+00 1.36928e+01  0.00000e+00 0.00000e+00 2.69908e+02 102.166 7.67411e+01 102.166 0.9636 
1 1 1 -14 3   3  o 5  1.68318e+01 1.38568e+00 2.69919e+02 6.107   3.05906e+01  3.27318e+00  0.00000e+00 0.00000e+00 3.60389e+02 6.107   9.04697e+01 6.107   0.9836 
1 1 1 -14 3   4  o 14 9.43045e+00 1.56421e+00 1.61373e+02 267.122 -4.94566e-01 -9.83689e+00 0.00000e+00 0.00000e+00 1.78646e+02 267.122 1.72729e+01 267.122 0.9478 
1 1 1 -14 3   5  o 7  9.70592e+00 1.39075e+00 1.52452e+02 343.248 1.02549e+01  -3.08677e+00 0.00000e+00 0.00000e+00 1.98797e+02 343.248 4.63443e+01 343.248 0.9521 
1 1 1 -14 3   6  o 9  1.26185e+01 1.28166e+00 1.28897e+02 175.531 -1.28729e+01 1.00615e+00  0.00000e+00 0.00000e+00 3.31352e+02 175.531 2.02454e+02 175.531 0.9605 
1 1 1 -14 3   7  o 1  4.04052e+00 1.30906e+00 6.37291e+01 270.331 1.29504e-02  -2.23817e+00 0.00000e+00 0.00000e+00 4.86748e+01 270.331 1.50544e+01 90.331  0.7333 
1 1 1 -14 3   8  o 4  9.04130e+00 1.45739e+00 2.08955e+02 93.311  -9.42304e-01 1.62892e+01  0.00000e+00 0.00000e+00 1.23040e+02 93.311  8.59151e+01 273.311 0.9689 
1 1 1 -14 3   9  o 11 3.78472e+00 1.24366e+00 6.54511e+01 93.792  -1.72590e-01 2.60384e+00  0.00000e+00 0.00000e+00 4.57975e+01 93.792  1.96536e+01 273.792 0.7764 
1 1 1 -14 3   10 o 7  7.51322e+00 1.50976e+00 1.01637e+02 262.328 -1.00536e+00 -7.46368e+00 0.00000e+00 0.00000e+00 1.62885e+02 262.328 6.12488e+01 262.328 0.9310 
1 1 1 -14 3   11 o 17 3.35594e+00 1.13150e+00 5.41793e+01 126.313 -1.37585e+00 1.87213e+00  0.00000e+00 0.00000e+00 4.01686e+01 126.313 1.40107e+01 306.313 0.7443 
1 1 1 -14 3   12 o 12 5.73859e+00 1.51781e+00 6.98431e+01 234.199 -2.60709e+00 -3.61468e+00 0.00000e+00 0.00000e+00 1.20448e+02 234.199 5.06047e+01 234.199 0.8790 
1 1 1 -14 3   13 o 9  5.25966e+00 1.54928e+00 5.34207e+01 326.837 2.67345e+00  -1.74699e+00 0.00000e+00 0.00000e+00 1.09720e+02 326.837 5.62989e+01 326.837 0.8233 
1 1 1 -14 3   14 o 7  1.06682e+01 1.71045e+00 2.06543e+02 197.998 -2.28275e+01 -7.41617e+00 0.00000e+00 0.00000e+00 1.86345e+02 197.998 2.01979e+01 17.998  0.9789 
1 1 1 -14 3   15 o 2  8.36218e+00 1.67356e+00 1.41877e+02 31.875  1.16500e+01  7.24433e+00  0.00000e+00 0.00000e+00 1.60578e+02 31.875  1.87012e+01 31.875  0.9628 
1 1 1 -14 4   1  o 13 5.97726e+00 1.63859e+00 3.85874e+01 297.310 5.91006e-01  -1.14454e+00 0.00000e+00 0.00000e+00 8.42883e+01 297.310 4.57009e+01 297.310 0.5392 
1 1 1 -14 4   2  o 5  2.01812e+01 1.35576e+00 4.58238e+02 304.505 3.36518e+01  -4.89545e+01 0.00000e+00 0.00000e+00 3.04132e+02 304.505 1.54106e+02 124.505 0.9915 
1 1 1 -14 4   3  o 5  8.73704e+00 1.71061e+00 1.12513e+02 78.863  1.13796e+00  5.78023e+00  0.00000e+00 0.00000e+00 1.90388e+02 78.863  7.78749e+01 78.863  0.9106 
1 1 1 -14 4   4  o 12 1.93677e+01 1.20056e+00 4.03521e+02 287.663 1.75109e+01  -5.49906e+01 0.00000e+00 0.00000e+00 3.26840e+02 287.663 7.66811e+01 107.663 0.9913 
1 1 1 -14 4   5  o 5  6.89827e+00 1.57623e+00 5.71798e+01 251.799 -8.28751e-01 -2.52057e+00 0.00000e+00 0.00000e+00 1.47518e+02 251.799 9.03379e+01 251.799 0.7807 
1 1 1 -14 4   6  o 13 4.93811e+00 1.40161e+00 6.57072e+01 329.979 2.12681e+00  -1.22894e+00 0.00000e+00 0.00000e+00 7.68429e+01 329.979 1.11357e+01 329.979 0.7602 
1 1 1 -14 4   7  o 14 1.68813e+01 1.04554e+00 3.20851e+02 156.869 -4.82212e+01 2.05989e+01  0.00000e+00 0.00000e+00 3.13466e+02 156.869 7.38482e+00 336.869 0.9904 
1 1 1 -14 4   8  o 11 3.76876e+00 1.22218e+00 1.19096e+02 357.247 4.31660e+00  -2.07529e-01 0.00000e+00 0.00000e+00 5.86241e+00 357.247 1.13234e+02 177.247 0.8748 
1 1 1 -14 4   9  o 4  6.29186e+00 1.28286e+00 7.37879e+01 240.901 -2.25854e+00 -4.05794e+00 0.00000e+00 0.00000e+00 1.36883e+02 240.901 6.30949e+01 240.901 0.8844 
1 1 1 -14 4   10 o 5  9.54087e+00 1.42375e+00 1.55510e+02 8.972   1.51658e+01  2.39457e+00  0.00000e+00 0.00000e+00 1.93329e+02 8.972   3.78193e+01 8.972   0.9669 
1 1 1 -14 4   11 o 5  8.34734e+00 1.53353e+00 1.74608e+02 84.397  1.44473e+00  1.47257e+01  0.00000e+00 0.00000e+00 1.29823e+02 84.397  4.47854e+01 264.397 0.9656 
1 1 1 -14 4   12 o 19 4.55238e+00 1.34611e+00 4.88187e+01 273.725 1.79008e-01  -2.74930e+00 0.00000e+00 0.00000e+00 8.68643e+01 273.725 3.80457e+01 273.725 0.7901 
1 1 1 -14 4   13 o 5  9.88309e+00 1.66682e+00 1.83561e+02 196.815 -1.82588e+01 -5.51776e+00 0.00000e+00 0.00000e+00 1.78861e+02 196.815 4.69938e+00 16.815  0.9734 
1 1 1 -14 4   14 o 13 4.79985e+00 1.48099e+00 1.21586e+02 61.928  3.51923e+00  6.59864e+00  0.00000e+00 0.00000e+00 4.64373e+01 61.928  7.51483e+01 241.928 0.9305 
1 1 1 -14 4   15 o 7  3.52072e+00 1.19144e+00 8.84386e+01 12.108  5.02826e+00  1.07872e+00  0.00000e+00 0.00000e+00 3.01415e+01 12.108  5.82971e+01 192.108 0.8966 
1 1 1 -14 5   1  o 9  2.32681e+01 1.44534e+00 3.55935e+02 343.279 4.94844e+01  -1.48659e+01 0.00000e+00 0.00000e+00 5.22481e+02 343.279 1.66546e+02 343.279 0.9903 
1 1 1 -14 5   2  o 14 9.50941e+00 1.83955e+00 1.35873e+02 101.816 -1.42891e+00 6.83018e+00  0.00000e+00 0.00000e+00 1.99346e+02 101.816 6.34728e+01 101.816 0.9253 
1 1 1 -14 5   3  o 8  4.37884e+00 1.39865e+00 1.60553e+02 72.850  1.39643e+00  4.52516e+00  0.00000e+00 0.00000e+00 1.27073e+01 252.850 1.73260e+02 252.850 0.8869 
1 1 1 -14 5   4  o 17 8.19009e+00 1.67603e+00 2.61130e+02 225.340 -9.30948e+00 -9.42068e+00 0.00000e+00 0.00000e+00 3.84243e+01 225.340 2.22706e+02 45.340  0.9615 
1 1 1 -14 5   5  o 2  1.25801e+01 1.30890e+00 2.51837e+02 49.502  1.53640e+01  1.79902e+01  0.00000e+00 0.00000e+00 2.16101e+02 49.502  3.57362e+01 229.502 0.9786 
1 1 1 -14 5   6  o 14 1.52184e+01 1.12687e+00 2.91824e+02 217.632 -2.95738e+01 -2.28014e+01 0.00000e+00 0.00000e+00 2.78302e+02 217.632 1.35219e+01 37.632  0.9865 
1 1 1 -14 5   7  o 11 2.68177e+01 9.76970e-01 4.03083e+02 6.701   1.06628e+02  1.25286e+01  0.00000e+00 0.00000e+00 6.09585e+02 6.701   2.06502e+02 6.701   0.9953 
1 1 1 -14 5   8  o 4  2.18704e+01 1.01293e+00 3.89335e+02 163.134 -8.57552e+01 2.59982e+01  0.00000e+00 0.00000e+00 4.34904e+02 163.134 4.55698e+01 163.134 0.9944 
1 1 1 -14 5   9  o 2  6.17023e+00 1.56038e+00 9.57087e+01 88.616  1.24094e-01  5.13712e+00  0.00000e+00 0.00000e+00 1.13710e+02 88.616  1.80009e+01 88.616  0.8965 
1 1 1 -14 5   10 o 9  5.17302e+00 1.43757e+00 6.36856e+01 312.936 2.30418e+00  -2.47649e+00 0.00000e+00 0.00000e+00 9.96030e+01 312.936 3.59173e+01 312.936 0.8347 
1 1 1 -14 5   11 o 19 9.69267e+00 1.49585e+00 1.80296e+02 170.863 -1.79050e+01 2.87974e+00  0.00000e+00 0.00000e+00 1.75551e+02 170.863 4.74470e+00 350.863 0.9720 
1 1 1 -14 5   12 o 14 6.14331e+00 1.50518e+00 3.52900e+01 243.777 -1.07355e+00 -2.17959e+00 0.00000e+00 0.00000e+00 1.40162e+02 243.777 1.04872e+02 243.777 0.7571 
1 1 1 -14 5   13 o 10 6.29167e+00 1.63566e+00 1.41911e+02 98.360  -1.39313e+00 9.47987e+00  0.00000e+00 0.00000e+00 8.23748e+01 98.360  5.95362e+01 278.360 0.9463 
1 1 1 -14 5   14 o 16 4.76669e+00 1.42630e+00 2.60265e+01 235.433 -9.37793e-01 -1.36110e+00 0.00000e+00 0.00000e+00 8.72531e+01 235.433 6.12266e+01 235.433 0.6317 
1 1 1 -14 5   15 o 13 4.13366e+00 1.32130e+00 4.50017e+01 338.125 2.58861e+00  -1.03929e+00 0.00000e+00 0.00000e+00 7.81555e+01 338.125 3.31538e+01 338.125 0.7931 
1 1 1 -14 6   1  o 13 4.84644e+00 2.06799e+00 1.12983e+02 215.634 -2.20276e+00 -1.57899e+00 0.00000e+00 0.00000e+00 3.22453e+01 215.634 8.07382e+01 35.634  0.7861 
1 1 1 -14 6   2  o 12 1.81761e+01 1.44960e+00 3.13240e+02 253.541 -1.00332e+01 -3.39599e+01 0.00000e+00 0.00000e+00 3.69369e+02 253.541 5.61291e+01 253.541 0.9858 
1 1 1 -14 6   3  o 11 7.02457e+00 1.72007e+00 1.48587e+02 104.174 -1.52495e+00 6.03819e+00  0.00000e+00 0.00000e+00 9.63094e+01 104.174 5.22780e+01 284.174 0.9158 
1 1 1 -14 6   4  o 3  8.52180e+00 1.72351e+00 1.46986e+02 268.314 -2.23844e-01 -7.60663e+00 0.00000e+00 0.00000e+00 1.55067e+02 268.314 8.08041e+00 268.314 0.9318 
1 1 1 -14 6   5  o 13 1.10444e+01 1.53301e+00 2.00273e+02 7.913   1.50000e+01  2.08478e+00  0.00000e+00 0.00000e+00 2.05400e+02 7.913   5.12723e+00 7.913   0.9664 
1 1 1 -14 6   6  o 10 5.81942e+00 1.46208e+00 5.65379e+01 323.094 1.94259e+00  -1.45887e+00 0.00000e+00 0.00000e+00 1.10770e+02 323.094 5.42324e+01 323.094 0.7571 
1 1 1 -14 6   7  o 8  1.20474e+01 1.28622e+00 3.29223e+02 131.550 -2.30787e+01 2.60395e+01  0.00000e+00 0.00000e+00 1.21210e+02 131.550 2.08013e+02 311.550 0.9855 
1 1 1 -14 6   8  o 10 1.05575e+01 1.40898e+00 1.44725e+02 14.740  1.30503e+01  3.43337e+00  0.00000e+00 0.00000e+00 2.40268e+02 14.740  9.55432e+01 14.740  0.9622 
1 1 1 -14 6   9  o 2  1.02901e+01 1.34982e+00 1.50193e+02 273.869 1.00902e+00  -1.49205e+01 0.00000e+00 0.00000e+00 2.26108e+02 273.869 7.59156e+01 273.869 0.9660 
1 1 1 -14 6   10 o 19 3.72158e+00 1.20321e+00 5.96014e+01 89.328  3.03404e-02  2.58785e+00  0.00000e+00 0.00000e+00 4.93576e+01 89.328  1.02438e+01 269.328 0.7742 
1 1 1 -14 6   11 o 10 8.58280e+00 1.51916e+00 1.74236e+02 324.437 1.24504e+01  -8.90143e+00 0.00000e+00 0.00000e+00 1.39152e+02 324.437 3.50845e+01 144.437 0.9668 
1 1 1 -14 6   12 o 19 4.16557e+00 1.33536e+00 5.17840e+01 359.288 2.69125e+00  -3.34521e-02 0.00000e+00 0.00000e+00 7.14547e+01 359.288 1.96707e+01 359.288 0.7843 
1 1 1 -14 6   13 o 4  7.47250e+00 1.74349e+00 2.00503e+02 107.073 -4.39598e+00 1.43135e+01  0.00000e+00 0.00000e+00 7.14255e+01 107.073 1.29078e+02 287.073 0.9660 
1 1 1 -14 6   14 o 12 4.46575e+00 1.39879e+00 3.00185e+01 233.436 -1.08493e+00 -1.46277e+00 0.00000e+00 0.00000e+00 8.18860e+01 233.436 5.18675e+01 233.436 0.6661 
1 1 1 -14 6   15 o 7  6.16087e+00 1.48782e+00 6.03669e+01 189.993 -4.85199e+00 -8.54892e-01 0.00000e+00 0.00000e+00 1.45988e+02 189.993 8.56206e+01 189.993 0.8917 
1 1 1 -14 7   1  o 18 2.19638e+01 1.35700e+00 3.84619e+02 0.126   5.42623e+01  1.19564e-01  0.00000e+00 0.00000e+00 4.44923e+02 0.126   6.03044e+01 0.126   0.9907 
1 1 1 -14 7   2  o 11 1.16668e+01 1.65369e+00 2.44592e+02 228.149 -1.10111e+01 -1.22932e+01 0.00000e+00 0.00000e+00 1.86189e+02 228.149 5.84023e+01 48.149  0.9692 
1 1 1 -14 7   3  f 0  7.35957e+00 1.71586e+00 1.05716e+02 23.602  4.25897e+00  1.86090e+00  0.00000e+00 0.00000e+00 1.42102e+02 23.602  3.63867e+01 23.602  0.8845 
1 1 1 -14 7   4  o 12 1.17186e+01 1.47358e+00 1.66749e+02 94.638  -1.05718e+00 1.30312e+01  0.00000e+00 0.00000e+00 2.61620e+02 94.638  9.48711e+01 94.638  0.9610 
1 1 1 -14 7   5  o 11 1.60732e+01 1.21684e+00 3.36560e+02 300.956 2.14740e+01  -3.58016e+01 0.00000e+00 0.00000e+00 2.66984e+02 300.956 6.95760e+01 120.956 0.9879 
1 1 1 -14 7   6  o 14 5.85881e+00 1.55739e+00 6.86322e+01 80.163  4.87458e-01  2.81131e+00  0.00000e+00 0.00000e+00 1.09023e+02 80.163  4.03904e+01 80.163  0.7985 
1 1 1 -14 7   7  o 10 6.96898e+00 1.52277e+00 1.20778e+02 78.160  1.36379e+00  6.50569e+00  0.00000e+00 0.00000e+00 1.22815e+02 78.160  2.03703e+00 78.160  0.9214 
1 1 1 -14 7   8  o 11 6.38791e+00 1.52661e+00 1.02714e+02 95.365  -5.12055e-01 5.45264e+00  0.00000e+00 0.00000e+00 1.15984e+02 95.365  1.32700e+01 95.365  0.9034 
1 1 1 -14 7   9  o 15 7.00696e+00 1.53473e+00 1.83649e+02 200.141 -1.06472e+01 -3.90494e+00 0.00000e+00 0.00000e+00 6.96352e+01 200.141 1.14013e+02 20.141  0.9548 
1 1 1 -14 7   10 o 10 4.58601e+00 1.39876e+00 6.88550e+01 59.584  1.67671e+00  2.85610e+00  0.00000e+00 0.00000e+00 7.51900e+01 59.584  6.33495e+00 59.584  0.8306 
1 1 1 -14 7   11 o 9  8.56873e+00 1.55929e+00 1.32944e+02 234.885 -6.55857e+00 -9.32684e+00 0.00000e+00 0.00000e+00 1.76148e+02 234.885 4.32041e+01 234.885 0.9551 
1 1 1 -14 7   12 o 8  1.07922e+01 1.50042e+00 2.15245e+02 146.450 -2.17551e+01 1.44265e+01  0.00000e+00 0.00000e+00 1.83968e+02 146.450 3.12774e+01 326.450 0.9807 
1 1 1 -14 7   13 o 6  3.51238e+00 1.19984e+00 1.40012e+01 297.814 3.28084e-01  -6.21894e-01 0.00000e+00 0.00000e+00 2.98590e+01 297.814 1.58578e+01 297.814 0.3315 
1 1 1 -14 7   14 o 9  8.74613e+00 1.67547e+00 7.93902e+01 152.136 -6.84931e+00 3.62098e+00  0.00000e+00 0.00000e+00 2.27590e+02 152.136 1.48200e+02 152.136 0.9330 
1 1 1 -14 7   15 o 1  4.54685e+00 1.42923e+00 8.32705e+01 282.160 1.14689e+00  -5.32264e+00 0.00000e+00 0.00000e+00 7.09189e+01 282.160 1.23516e+01 102.160 0.9028 
1 1 1 -14 8   1  o 4  7.30503e+00 2.16431e+00 1.28839e+02 195.960 -4.31029e+00 -1.23267e+00 0.00000e+00 0.00000e+00 1.16171e+02 195.960 1.26678e+01 15.960  0.8798 
1 1 1 -14 8   2  f 0  5.88714e+00 1.56633e+00 9.98922e+01 299.961 1.75213e+00  -3.03952e+00 0.00000e+00 0.00000e+00 8.88441e+01 299.961 1.10481e+01 119.961 0.8415 
1 1 1 -14 8   3  o 15 4.86069e+00 1.52677e+00 7.16517e+01 19.097  2.02610e+00  7.01487e-01  0.00000e+00 0.00000e+00 6.15899e+01 19.097  1.00618e+01 199.097 0.7201 
1 1 1 -14 8   4  o 13 5.10254e+00 1.49828e+00 7.49063e+01 307.538 1.54296e+00  -2.00805e+00 0.00000e+00 0.00000e+00 7.42504e+01 307.538 6.55893e-01 127.538 0.7685 
1 1 1 -14 8   5  o 5  1.78986e+01 1.18728e+00 2.64123e+02 326.347 3.06763e+01  -2.04223e+01 0.00000e+00 0.00000e+00 4.06851e+02 326.347 1.42728e+02 326.347 0.9863 
1 1 1 -14 8   6  o 13 1.77025e+01 1.04868e+00 2.42638e+02 183.019 -3.70428e+01 -1.95338e+00 0.00000e+00 0.00000e+00 4.20452e+02 183.019 1.77815e+02 183.019 0.9864 
1 1 1 -14 8   7  o 3  1.03887e+01 1.36229e+00 1.62416e+02 3.195   1.39177e+01  7.77024e-01  0.00000e+00 0.00000e+00 2.17281e+02 3.195   5.48650e+01 3.195   0.9634 
1 1 1 -14 8   8  o 1  9.88291e+00 1.45849e+00 1.59809e+02 196.891 -1.35620e+01 -4.11825e+00 0.00000e+00 0.00000e+00 2.01264e+02 196.891 4.14548e+01 196.891 0.9641 
1 1 1 -14 8   9  o 14 4.90258e+00 1.47023e+00 7.54851e+01 28.950  2.94841e+00  1.63098e+00  0.00000e+00 0.00000e+00 7.92971e+01 28.950  3.81196e+00 28.950  0.8340 
1 1 1 -14 8   10 o 13 6.77691e+00 1.55830e+00 1.08344e+02 190.681 -6.81539e+00 -1.28543e+00 0.00000e+00 0.00000e+00 1.28643e+02 190.681 2.02995e+01 190.681 0.9248 
1 1 1 -14 8   11 o 11 1.61230e+01 1.22170e+00 3.22433e+02 230.664 -4.00822e+01 -4.89090e+01 0.00000e+00 0.00000e+00 2.81657e+02 230.664 4.07758e+01 50.664  0.9921 
1 1 1 -14 8   12 o 9  1.48776e+01 1.32734e+00 2.39886e+02 58.551  2.33001e+01  3.80991e+01  0.00000e+00 0.00000e+00 3.14971e+02 58.551  7.50849e+01 58.551  0.9887 
1 1 1 -14 8   13 o 11 5.65323e+00 1.58105e+00 1.40409e+02 319.077 6.66927e+00  -5.78185e+00 0.00000e+00 0.00000e+00 6.00926e+01 319.077 8.03169e+01 139.077 0.9415 
1 1 1 -14 8   14 o 15 3.62528e+00 1.21855e+00 9.54396e+01 105.717 -1.44007e+00 5.11724e+00  0.00000e+00 0.00000e+00 2.73278e+01 105.717 6.81117e+01 285.717 0.9002 
1 1 1 -14 8   15 o 1  6.20996e+00 1.68065e+00 9.43642e+01 277.884 9.54153e-01  -6.89068e+00 0.00000e+00 0.00000e+00 1.21414e+02 277.884 2.70503e+01 277.884 0.9250 
1 1 1 -14 9   1  o 10 2.93013e+01 1.34113e+00 4.46257e+02 185.264 -8.39953e+01 -7.73839e+00 0.00000e+00 0.00000e+00 6.64063e+02 185.264 2.17807e+02 185.264 0.9941 
1 1 1 -14 9   2  o 7  7.79615e+00 1.74409e+00 1.70300e+02 348.710 7.71079e+00  -1.53933e+00 0.00000e+00 0.00000e+00 1.07109e+02 348.710 6.31902e+01 168.710 0.9341 
1 1 1 -14 9   3  o 5  1.26207e+01 1.57981e+00 2.28850e+02 321.581 1.36596e+01  -1.08338e+01 0.00000e+00 0.00000e+00 2.37600e+02 321.581 8.74976e+00 321.581 0.9709 
1 1 1 -14 9   4  o 15 6.35832e+00 1.61613e+00 1.25244e+02 250.132 -1.73216e+00 -4.79330e+00 0.00000e+00 0.00000e+00 9.13581e+01 250.132 3.38860e+01 70.132  0.8956 
1 1 1 -14 9   5  o 15 6.58975e+00 1.65383e+00 1.33934e+02 270.284 2.85434e-02  -5.74866e+00 0.00000e+00 0.00000e+00 9.35424e+01 270.284 4.03913e+01 90.284  0.9083 
1 1 1 -14 9   6  f 0  6.55166e+00 1.60094e+00 1.01652e+02 311.544 3.08112e+00  -3.47711e+00 0.00000e+00 0.00000e+00 1.18384e+02 311.544 1.67327e+01 311.544 0.8845 
1 1 1 -14 9   7  o 4  7.19796e+00 1.56608e+00 1.67317e+02 238.011 -4.81839e+00 -7.71437e+00 0.00000e+00 0.00000e+00 9.02608e+01 238.011 7.70564e+01 58.011  0.9433 
1 1 1 -14 9   8  o 1  1.06309e+01 1.32569e+00 2.01416e+02 13.923  1.98967e+01  4.93242e+00  0.00000e+00 0.00000e+00 1.91506e+02 13.923  9.90994e+00 193.923 0.9753 
1 1 1 -14 9   9  f 0  8.37905e+00 1.56213e+00 1.34492e+02 339.412 9.16212e+00  -3.44158e+00 0.00000e+00 0.00000e+00 1.66032e+02 339.412 3.15405e+01 339.412 0.9474 
1 1 1 -14 9   10 o 19 5.45494e+00 1.52193e+00 1.24304e+02 123.065 -3.56509e+00 5.47606e+00  0.00000e+00 0.00000e+00 6.54446e+01 123.065 5.88593e+01 303.065 0.9199 
1 1 1 -14 9   11 o 14 6.58541e+00 1.64617e+00 9.84982e+01 220.821 -4.66463e+00 -4.02941e+00 0.00000e+00 0.00000e+00 1.29029e+02 220.821 3.05309e+01 220.821 0.9148 
1 1 1 -14 9   12 o 17 9.93920e+00 1.50028e+00 1.59786e+02 91.044  -3.24521e-01 1.78089e+01  0.00000e+00 0.00000e+00 2.04428e+02 91.044  4.46421e+01 91.044  0.9715 
1 1 1 -14 9   13 o 11 4.64278e+00 1.44842e+00 5.33255e+01 116.342 -1.33348e+00 2.69309e+00  0.00000e+00 0.00000e+00 8.83973e+01 116.342 3.50718e+01 116.342 0.8104 
1 1 1 -14 9   14 o 15 3.27080e+00 1.12926e+00 5.04864e+01 225.164 -1.90356e+00 -1.91451e+00 0.00000e+00 0.00000e+00 4.61076e+01 225.164 4.37880e+00 45.164  0.7851 
1 1 1 -14 9   15 o 7  5.22108e+00 1.54337e+00 8.92157e+01 316.106 4.41994e+00  -4.25252e+00 0.00000e+00 0.00000e+00 9.01079e+01 316.106 8.92277e-01 316.106 0.9144 
1 1 1 -14 10  1  o 1  9.38766e+00 1.95364e+00 1.56898e+02 175.406 -7.58463e+00 6.09488e-01  0.00000e+00 0.00000e+00 1.76530e+02 175.406 1.96317e+01 175.406 0.9318 
1 1 1 -14 10  2  o 17 4.76607e+00 1.46310e+00 1.08504e+02 80.949  5.35928e-01  3.36437e+00  0.00000e+00 0.00000e+00 4.32937e+01 80.949  6.52102e+01 260.949 0.8361 
1 1 1 -14 10  3  o 14 1.72423e+01 1.40484e+00 3.08992e+02 69.722  1.18492e+01  3.20707e+01  0.00000e+00 0.00000e+00 3.37693e+02 69.722  2.87013e+01 69.722  0.9853 
1 1 1 -14 10  4  o 9  1.48250e+01 1.36430e+00 2.25917e+02 243.410 -1.05528e+01 -2.10830e+01 0.00000e+00 0.00000e+00 3.25888e+02 243.410 9.99707e+01 243.410 0.9786 
1 1 1 -14 10  5  o 9  6.25152e+00 1.66721e+00 8.72439e+01 115.719 -1.53256e+00 3.18171e+00  0.00000e+00 0.00000e+00 1.12981e+02 115.719 2.57371e+01 115.719 0.8427 
1 1 1 -14 10  6  o 18 1.37125e+01 1.38576e+00 1.31177e+02 313.470 9.43084e+00  -9.94852e+00 0.00000e+00 0.00000e+00 3.70131e+02 313.470 2.38955e+02 313.470 0.9628 
1 1 1 -14 10  7  o 10 2.09712e+01 9.90328e-01 3.34180e+02 117.617 -3.10736e+01 5.93961e+01  0.00000e+00 0.00000e+00 4.55392e+02 117.617 1.21212e+02 117.617 0.9925 
1 1 1 -14 10  8  o 6  1.53019e+01 1.05625e+00 2.65477e+02 11.854  4.30598e+01  9.03810e+00  0.00000e+00 0.00000e+00 3.07769e+02 11.854  4.22915e+01 11.854  0.9886 
1 1 1 -14 10  9  o 10 1.89901e+01 1.05081e+00 3.64429e+02 181.831 -8.16393e+01 -2.61010e+00 0.00000e+00 0.00000e+00 3.50016e+02 181.831 1.44129e+01 1.831   0.9939 
1 1 1 -14 10  10 o 15 8.46988e+00 1.56727e+00 1.03281e+02 16.227  7.89071e+00  2.29648e+00  0.00000e+00 0.00000e+00 1.96807e+02 16.227  9.35264e+01 16.227  0.9370 
1 1 1 -14 10  11 o 2  4.17752e+00 1.34318e+00 7.92144e+01 108.673 -1.20169e+00 3.55577e+00  0.00000e+00 0.00000e+00 5.54110e+01 108.673 2.38033e+01 288.673 0.8533 
1 1 1 -14 10  12 o 9  6.53275e+00 1.59362e+00 1.79742e+02 232.908 -7.48284e+00 -9.89714e+00 0.00000e+00 0.00000e+00 5.65105e+01 232.908 1.23232e+02 52.909  0.9588 
1 1 1 -14 10  13 o 18 6.04386e+00 1.51789e+00 7.93111e+01 42.911  4.03301e+00  3.74921e+00  0.00000e+00 0.00000e+00 1.26479e+02 42.911  4.71676e+01 42.911  0.9039 
1 1 1 -14 10  14 o 11 5.30173e+00 1.54087e+00 4.40321e+01 320.420 2.19797e+00  -1.81705e+00 0.00000e+00 0.00000e+00 1.15191e+02 320.420 7.11589e+01 320.420 0.7984 
1 1 1 -14 10  15 o 12 5.73805e+00 1.60757e+00 9.27175e+01 1.176   6.66854e+00  1.36941e-01  0.00000e+00 0.00000e+00 1.05923e+02 1.176   1.32052e+01 1.176   0.9217 
1 1 1 -14 11  1  o 4  1.00137e+01 1.89503e+00 2.79659e+02 112.655 -6.01509e+00 1.44115e+01  0.00000e+00 0.00000e+00 8.96100e+01 112.655 1.90049e+02 292.655 0.9674 
1 1 1 -14 11  2  o 4  7.83318e+00 1.71215e+00 2.05794e+02 138.269 -7.20457e+00 6.42611e+00  0.00000e+00 0.00000e+00 7.66892e+01 138.269 1.29104e+02 318.269 0.9467 
1 1 1 -14 11  3  o 16 1.27158e+01 1.63224e+00 1.71356e+02 255.264 -3.27780e+00 -1.24624e+01 0.00000e+00 0.00000e+00 2.93500e+02 255.264 1.22144e+02 255.264 0.9604 
1 1 1 -14 11  4  o 8  1.35851e+01 1.38810e+00 2.74777e+02 180.236 -2.60320e+01 -1.07245e-01 0.00000e+00 0.00000e+00 2.31921e+02 180.236 4.28558e+01 0.236   0.9806 
1 1 1 -14 11  5  o 6  8.30253e+00 1.71796e+00 1.48532e+02 355.027 7.79366e+00  -6.78176e-01 0.00000e+00 0.00000e+00 1.46080e+02 355.027 2.45255e+00 175.027 0.9337 
1 1 1 -14 11  6  o 7  4.86478e+00 1.44965e+00 9.05194e+01 246.921 -1.28119e+00 -3.00681e+00 0.00000e+00 0.00000e+00 6.24285e+01 246.921 2.80909e+01 66.921  0.8280 
1 1 1 -14 11  7  o 7  1.07971e+01 1.38581e+00 2.03850e+02 267.521 -7.77690e-01 -1.79608e+01 0.00000e+00 0.00000e+00 1.94161e+02 267.521 9.68967e+00 87.521  0.9718 
1 1 1 -14 11  8  o 14 7.32045e+00 1.53608e+00 1.15775e+02 353.113 7.25757e+00  -8.76562e-01 0.00000e+00 0.00000e+00 1.41891e+02 353.113 2.61160e+01 353.113 0.9288 
1 1 1 -14 11  9  o 6  4.77362e+00 1.41707e+00 1.23618e+02 39.031  4.49960e+00  3.64772e+00  0.00000e+00 0.00000e+00 4.06375e+01 39.031  8.29807e+01 219.031 0.9090 
1 1 1 -14 11  10 o 7  5.25930e+00 1.50442e+00 1.49497e+02 84.539  7.27727e-01  7.61180e+00  0.00000e+00 0.00000e+00 3.58575e+01 84.539  1.13640e+02 264.539 0.9321 
1 1 1 -14 11  11 o 9  1.04721e+01 1.49827e+00 2.18982e+02 342.497 2.26564e+01  -7.14482e+00 0.00000e+00 0.00000e+00 1.68077e+02 342.497 5.09049e+01 162.497 0.9787 
1 1 1 -14 11  12 o 5  3.73296e+00 1.21533e+00 7.76910e+01 127.429 -2.36189e+00 3.08599e+00  0.00000e+00 0.00000e+00 4.32516e+01 127.429 3.44394e+01 307.429 0.8590 
1 1 1 -14 11  13 o 12 8.58939e+00 1.65042e+00 2.18448e+02 17.625  1.88269e+01  5.98126e+00  0.00000e+00 0.00000e+00 9.67878e+01 17.625  1.21660e+02 197.625 0.9744 
1 1 1 -14 11  14 o 14 3.56436e+00 1.20094e+00 2.02137e+01 149.834 -9.67904e-01 5.62559e-01  0.00000e+00 0.00000e+00 4.50973e+01 149.834 2.48837e+01 149.834 0.4871 
1 1 1 -14 11  15 o 1  7.18398e+00 1.68017e+00 1.03059e+02 254.970 -2.27844e+00 -8.48545e+00 0.00000e+00 0.00000e+00 1.50916e+02 254.970 4.78564e+01 254.970 0.9412 
1 1 1 -14 12  1  o 6  6.30298e+00 2.08495e+00 5.34185e+01 156.385 -1.59134e+00 6.95727e-01  0.00000e+00 0.00000e+00 1.02612e+02 156.385 4.91935e+01 156.385 0.6495 
1 1 1 -14 12  2  o 7  1.55641e+01 1.44869e+00 2.93258e+02 295.468 1.29765e+01  -2.72446e+01 0.00000e+00 0.00000e+00 2.89695e+02 295.468 3.56265e+00 115.468 0.9833 
1 1 1 -14 12  3  o 19 2.15770e+01 1.40354e+00 3.64025e+02 159.029 -4.70136e+01 1.80191e+01  0.00000e+00 0.00000e+00 4.49088e+02 159.029 8.50626e+01 159.029 0.9900 
1 1 1 -14 12  4  o 3  6.43611e+00 1.60748e+00 1.30227e+02 49.838  3.46534e+00  4.10614e+00  0.00000e+00 0.00000e+00 9.04242e+01 49.838  3.98025e+01 229.838 0.9014 
1 1 1 -14 12  5  o 6  1.42678e+01 1.29859e+00 2.89485e+02 203.638 -2.83072e+01 -1.23898e+01 0.00000e+00 0.00000e+00 2.43882e+02 203.638 4.56033e+01 23.639  0.9837 
1 1 1 -14 12  6  o 11 8.67845e+00 1.66258e+00 2.22391e+02 63.666  5.80860e+00  1.17353e+01  0.00000e+00 0.00000e+00 9.42733e+01 63.666  1.28118e+02 243.666 0.9610 
1 1 1 -14 12  7  o 10 1.67975e+01 1.30565e+00 2.84053e+02 2.670   4.20964e+01  1.96295e+00  0.00000e+00 0.00000e+00 3.45505e+02 2.670   6.14521e+01 2.670   0.9881 
1 1 1 -14 12  8  o 10 5.48297e+00 1.47360e+00 1.10397e+02 74.558  1.43373e+00  5.19020e+00  0.00000e+00 0.00000e+00 7.69259e+01 74.558  3.34710e+01 254.558 0.9016 
1 1 1 -14 12  9  f 0  3.96678e+00 1.25807e+00 4.75444e+01 279.822 3.42735e-01  -1.97969e+00 0.00000e+00 0.00000e+00 5.74519e+01 279.822 9.90750e+00 279.822 0.6993 
1 1 1 -14 12  10 o 11 1.14040e+01 1.32454e+00 1.75082e+02 18.127  2.03518e+01  6.66251e+00  0.00000e+00 0.00000e+00 2.45900e+02 18.127  7.08186e+01 18.127  0.9764 
1 1 1 -14 12  11 o 12 5.55167e+00 1.45685e+00 7.69702e+01 48.872  3.07231e+00  3.51834e+00  0.00000e+00 0.00000e+00 1.08601e+02 48.872  3.16305e+01 48.872  0.8851 
1 1 1 -14 12  12 o 17 3.87903e+00 1.27730e+00 5.48327e+01 35.024  2.28588e+00  1.60200e+00  0.00000e+00 0.00000e+00 6.12257e+01 35.024  6.39294e+00 35.024  0.7933 
1 1 1 -14 12  13 o 6  3.30339e+00 1.14773e+00 3.33647e+01 192.629 -1.56957e+00 -3.51677e-01 0.00000e+00 0.00000e+00 4.40056e+01 192.629 1.06409e+01 192.629 0.6218 
1 1 1 -14 12  14 o 1  4.48527e+00 1.40831e+00 1.35045e+02 221.230 -6.20920e+00 -5.44143e+00 0.00000e+00 0.00000e+00 2.30861e+01 221.230 1.11959e+02 41.230  0.9373 
1 1 1 -14 12  15 o 16 5.71997e+00 1.65116e+00 1.77477e+02 40.529  9.36541e+00  8.00713e+00  0.00000e+00 0.00000e+00 2.84460e+01 40.529  1.49031e+02 220.529 0.9585 
1 1 1 -14 13  1  o 14 1.81780e+01 1.30444e+00 2.96607e+02 245.894 -1.53363e+01 -3.42753e+01 0.00000e+00 0.00000e+00 3.86963e+02 245.894 9.03553e+01 245.894 0.9866 
1 1 1 -14 13  2  o 10 1.15569e+01 1.62320e+00 1.99509e+02 127.795 -8.39989e+00 1.08309e+01  0.00000e+00 0.00000e+00 2.24320e+02 127.795 2.48111e+01 127.795 0.9628 
1 1 1 -14 13  3  o 7  3.03422e+01 1.40018e+00 4.72022e+02 143.010 -7.87758e+01 5.93398e+01  0.00000e+00 0.00000e+00 6.77022e+02 143.010 2.05000e+02 143.010 0.9949 
1 1 1 -14 13  4  o 9  5.24530e+00 1.51750e+00 8.89318e+01 266.329 -2.06232e-01 -3.21402e+00 0.00000e+00 0.00000e+00 7.56646e+01 266.329 1.32671e+01 86.329  0.8251 
1 1 1 -14 13  5  o 19 1.13714e+01 1.52152e+00 2.78995e+02 267.982 -7.66691e-01 -2.17628e+01 0.00000e+00 0.00000e+00 1.43094e+02 267.982 1.35901e+02 87.982  0.9768 
1 1 1 -14 13  6  o 11 1.22133e+01 1.44340e+00 2.38157e+02 34.022  1.93838e+01  1.30855e+01  0.00000e+00 0.00000e+00 2.15523e+02 34.022  2.26331e+01 214.022 0.9784 
1 1 1 -14 13  7  f 0  6.14240e+00 1.62563e+00 1.11414e+02 253.050 -1.52208e+00 -4.99421e+00 0.00000e+00 0.00000e+00 9.78697e+01 253.050 1.35441e+01 73.050  0.8983 
1 1 1 -14 13  8  f 0  5.93636e+00 1.48781e+00 1.13745e+02 14.751  5.95124e+00  1.56690e+00  0.00000e+00 0.00000e+00 9.20053e+01 14.751  2.17397e+01 194.751 0.9147 
1 1 1 -14 13  9  o 12 5.44347e+00 1.45761e+00 9.33205e+01 178.582 -4.87478e+00 1.20633e-01  0.00000e+00 0.00000e+00 9.01446e+01 178.582 3.17591e+00 358.582 0.8904 
1 1 1 -14 13  10 o 13 6.62780e+00 1.49043e+00 1.70351e+02 329.899 9.46276e+00  -5.48562e+00 0.00000e+00 0.00000e+00 6.84854e+01 329.899 1.01866e+02 149.899 0.9531 
1 1 1 -14 13  11 o 18 1.01412e+01 1.51490e+00 2.10646e+02 304.602 1.27998e+01  -1.85528e+01 0.00000e+00 0.00000e+00 1.63712e+02 304.602 4.69341e+01 124.602 0.9776 
1 1 1 -14 13  12 o 5  5.08175e+00 1.49069e+00 1.03760e+02 210.573 -5.19625e+00 -3.06982e+00 0.00000e+00 0.00000e+00 7.12026e+01 210.573 3.25571e+01 30.574  0.9129 
1 1 1 -14 13  13 o 10 3.81961e+00 1.26312e+00 8.57207e+01 357.722 4.43350e+00  -1.76366e-01 0.00000e+00 0.00000e+00 4.06554e+01 357.722 4.50653e+01 177.722 0.8785 
1 1 1 -14 13  14 o 18 4.28081e+00 1.37535e+00 4.78246e+01 286.572 8.14737e-01  -2.73790e+00 0.00000e+00 0.00000e+00 8.07889e+01 286.572 3.29643e+01 286.572 0.7988 
1 1 1 -14 13  15 o 6  7.76016e+00 1.78403e+00 1.57205e+02 327.301 1.12830e+01  -7.24321e+00 0.00000e+00 0.00000e+00 1.23158e+02 327.301 3.40463e+01 147.301 0.9620 
1 1 1 -14 14  1  o 13 1.01671e+01 1.79039e+00 1.43005e+02 106.822 -2.35049e+00 7.77423e+00  0.00000e+00 0.00000e+00 2.19796e+02 106.822 7.67912e+01 106.822 0.9362 
1 1 1 -14 14  2  o 16 1.50163e+01 1.54984e+00 2.64388e+02 163.901 -2.32680e+01 6.71544e+00  0.00000e+00 0.00000e+00 2.95631e+02 163.901 3.12433e+01 163.901 0.9791 
1 1 1 -14 14  3  o 2  6.52977e+00 1.73264e+00 1.26725e+02 213.746 -4.16581e+00 -2.78309e+00 0.00000e+00 0.00000e+00 9.53678e+01 213.746 3.13569e+01 33.746  0.8936 
1 1 1 -14 14  4  o 16 1.36284e+01 1.33502e+00 2.45164e+02 344.774 2.38687e+01  -6.49672e+00 0.00000e+00 0.00000e+00 2.62565e+02 344.774 1.74016e+01 344.774 0.9796 
1 1 1 -14 14  5  o 6  1.80728e+01 1.17939e+00 3.07654e+02 342.009 4.32682e+01  -1.40508e+01 0.00000e+00 0.00000e+00 3.71523e+02 342.009 6.38685e+01 342.009 0.9889 
1 1 1 -14 14  6  o 19 1.05033e+01 1.60804e+00 1.31246e+02 127.984 -6.33169e+00 8.10883e+00  0.00000e+00 0.00000e+00 2.47614e+02 127.984 1.16367e+02 127.984 0.9501 
1 1 1 -14 14  7  o 7  9.68785e+00 1.68346e+00 1.43567e+02 357.394 1.03091e+01  -4.69149e-01 0.00000e+00 0.00000e+00 2.05602e+02 357.394 6.20351e+01 357.394 0.9502 
1 1 1 -14 14  8  o 7  9.36118e+00 1.71881e+00 2.10080e+02 230.097 -1.01897e+01 -1.21856e+01 0.00000e+00 0.00000e+00 1.33267e+02 230.097 7.68128e+01 50.097  0.9680 
1 1 1 -14 14  9  o 8  1.25195e+01 1.24766e+00 2.28348e+02 333.521 2.75301e+01  -1.37137e+01 0.00000e+00 0.00000e+00 2.37743e+02 333.521 9.39521e+00 333.521 0.9836 
1 1 1 -14 14  10 o 17 4.32988e+00 1.34875e+00 4.75293e+01 148.427 -1.83287e+00 1.12640e+00  0.00000e+00 0.00000e+00 7.05160e+01 148.427 2.29867e+01 148.427 0.7211 
1 1 1 -14 14  11 o 18 6.99340e+00 1.51933e+00 1.14564e+02 85.991  5.89165e-01  8.40711e+00  0.00000e+00 0.00000e+00 1.33311e+02 85.991  1.87471e+01 85.991  0.9387 
1 1 1 -14 14  12 o 17 8.06020e+00 1.52213e+00 1.39880e+02 277.078 1.55781e+00  -1.25456e+01 0.00000e+00 0.00000e+00 1.51812e+02 277.078 1.19318e+01 277.078 0.9596 
1 1 1 -14 14  13 o 1  3.83945e+00 1.25040e+00 6.91121e+01 122.331 -2.02358e+00 3.19719e+00  0.00000e+00 0.00000e+00 5.44755e+01 122.331 1.46365e+01 302.331 0.8547 
1 1 1 -14 14  14 o 1  3.20952e+00 1.11189e+00 4.99066e+01 234.101 -1.58172e+00 -2.18515e+00 0.00000e+00 0.00000e+00 4.48375e+01 234.101 5.06914e+00 54.101  0.7849 
1 1 1 -14 14  15 o 2  6.57248e+00 1.73663e+00 1.47131e+02 10.431  1.08217e+01  1.99223e+00  0.00000e+00 0.00000e+00 8.82068e+01 10.431  5.89242e+01 190.431 0.9534 
1 1 1 -14 15  1  o 17 1.77835e+01 1.33371e+00 2.54888e+02 115.735 -1.29494e+01 2.68652e+01  0.00000e+00 0.00000e+00 4.11421e+02 115.735 1.56533e+02 115.735 0.9831 
1 1 1 -14 15  2  o 11 2.69098e+01 1.27090e+00 5.54184e+02 354.956 9.96251e+01  -8.79228e+00 0.00000e+00 0.00000e+00 4.65601e+02 354.956 8.85828e+01 174.956 0.9950 
1 1 1 -14 15  3  o 19 9.34731e+00 2.02605e+00 2.44227e+02 29.916  1.06214e+01  6.11164e+00  0.00000e+00 0.00000e+00 9.66920e+01 29.916  1.47535e+02 209.916 0.9583 
1 1 1 -14 15  4  o 12 1.58458e+01 1.21771e+00 2.31253e+02 21.866  2.62582e+01  1.05376e+01  0.00000e+00 0.00000e+00 3.60621e+02 21.866  1.29368e+02 21.866  0.9822 
1 1 1 -14 15  5  o 9  1.39182e+01 1.34608e+00 1.99278e+02 184.909 -2.12036e+01 -1.82126e+00 0.00000e+00 0.00000e+00 3.17013e+02 184.909 1.17735e+02 184.909 0.9762 
1 1 1 -14 15  6  o 5  1.32217e+01 1.37683e+00 2.45440e+02 249.555 -9.36955e+00 -2.51331e+01 0.00000e+00 0.00000e+00 2.47065e+02 249.555 1.62494e+00 249.555 0.9812 
1 1 1 -14 15  7  o 3  8.31606e+00 1.70925e+00 1.41817e+02 333.563 7.42373e+00  -3.69117e+00 0.00000e+00 0.00000e+00 1.53911e+02 333.563 1.20936e+01 333.563 0.9376 
1 1 1 -14 15  8  o 6  1.07374e+01 1.68636e+00 1.33697e+02 223.046 -8.61576e+00 -8.04722e+00 0.00000e+00 0.00000e+00 2.55476e+02 223.046 1.21778e+02 223.046 0.9566 
1 1 1 -14 15  9  o 4  3.52945e+00 1.17965e+00 7.04467e+01 14.739  2.67576e+00  7.03939e-01  0.00000e+00 0.00000e+00 3.52374e+01 14.739  3.52093e+01 194.739 0.7911 
1 1 1 -14 15  10 o 3  1.15567e+01 1.36247e+00 1.67208e+02 144.749 -1.63687e+01 1.15684e+01  0.00000e+00 0.00000e+00 2.58649e+02 144.749 9.14411e+01 144.749 0.9747 
1 1 1 -14 15  11 o 1  5.56008e+00 1.53283e+00 9.91091e+01 12.223  5.36812e+00  1.16289e+00  0.00000e+00 0.00000e+00 9.06127e+01 12.223  8.49644e+00 192.223 0.9037 
1 1 1 -14 15  12 o 14 1.01763e+01 1.50306e+00 1.39151e+02 132.488 -1.08526e+01 1.18486e+01  0.00000e+00 0.00000e+00 2.32469e+02 132.488 9.33180e+01 132.488 0.9684 
1 1 1 -14 15  13 o 18 4.41490e+00 1.38002e+00 5.61824e+01 277.970 4.49101e-01  -3.20750e+00 0.00000e+00 0.00000e+00 8.11903e+01 277.970 2.50079e+01 277.970 0.8262 
1 1 1 -14 15  14 o 6  6.77541e+00 1.56896e+00 9.35762e+01 9.434   7.82582e+00  1.30026e+00  0.00000e+00 0.00000e+00 1.44592e+02 9.434   5.10160e+01 9.434   0.9347 
1 1 1 -14 15  15 f 0  4.63992e+00 1.43795e+00 4.89652e+01 254.781 -8.87442e-01 -3.26194e+00 0.00000e+00 0.00000e+00 9.64656e+01 254.781 4.75003e+01 254.781 0.8346 
1 1 1 -14 16  1  o 10 1.74455e+01 1.34337e+00 2.83325e+02 34.700  2.66202e+01  1.84327e+01  0.00000e+00 0.00000e+00 3.71188e+02 34.700  8.78625e+01 34.700  0.9844 
1 1 1 -14 16  2  o 19 3.86430e+00 1.77810e+00 1.20852e+02 213.448 -2.31938e+00 -1.53214e+00 0.00000e+00 0.00000e+00 4.24733e+00 33.448  1.25099e+02 33.448  0.7923 
1 1 1 -14 16  3  o 13 6.11958e+00 2.11471e+00 1.67206e+02 152.131 -4.71918e+00 2.49545e+00  0.00000e+00 0.00000e+00 4.25637e+01 152.131 1.24642e+02 332.131 0.9007 
1 1 1 -14 16  4  o 7  7.53212e+00 1.68037e+00 8.79008e+01 227.233 -2.90012e+00 -3.13547e+00 0.00000e+00 0.00000e+00 1.62214e+02 227.233 7.43130e+01 227.233 0.8732 
1 1 1 -14 16  5  o 2  1.22003e+01 1.43708e+00 2.32349e+02 204.166 -1.91219e+01 -8.58014e+00 0.00000e+00 0.00000e+00 2.20025e+02 204.166 1.23246e+01 24.166  0.9758 
1 1 1 -14 16  6  o 16 1.10016e+01 1.56567e+00 2.06359e+02 111.995 -6.38845e+00 1.58159e+01  0.00000e+00 0.00000e+00 1.98857e+02 111.995 7.50210e+00 291.995 0.9702 
1 1 1 -14 16  7  o 15 8.82618e+00 1.70362e+00 2.29546e+02 239.623 -7.21548e+00 -1.23098e+01 0.00000e+00 0.00000e+00 9.32456e+01 239.623 1.36300e+02 59.623  0.9643 
1 1 1 -14 16  8  o 5  7.54658e+00 1.76337e+00 1.46085e+02 118.803 -4.18492e+00 7.61130e+00  0.00000e+00 0.00000e+00 1.22836e+02 118.803 2.32493e+01 298.803 0.9405 
1 1 1 -14 16  9  o 4  6.65266e+00 1.66885e+00 9.56249e+01 60.069  2.72987e+00  4.74137e+00  0.00000e+00 0.00000e+00 1.31800e+02 60.069  3.61754e+01 60.069  0.9033 
1 1 1 -14 16  10 o 8  7.07705e+00 1.72884e+00 1.29935e+02 202.945 -7.76588e+00 -3.28763e+00 0.00000e+00 0.00000e+00 1.21197e+02 202.945 8.73782e+00 22.945  0.9387 
1 1 1 -14 16  11 o 11 9.04467e+00 1.65698e+00 2.25506e+02 36.755  1.51518e+01  1.13165e+01  0.00000e+00 0.00000e+00 1.06843e+02 36.755  1.18663e+02 216.755 0.9732 
1 1 1 -14 16  12 o 13 1.66738e+01 1.23682e+00 3.04698e+02 185.127 -6.51277e+01 -5.84297e+00 0.00000e+00 0.00000e+00 3.19240e+02 185.127 1.45415e+01 185.127 0.9923 
1 1 1 -14 16  13 o 1  1.01105e+01 1.62040e+00 2.21106e+02 22.518  2.17040e+01  8.99818e+00  0.00000e+00 0.00000e+00 1.51460e+02 22.518  6.96458e+01 202.518 0.9785 
1 1 1 -14 16  14 o 9  4.24126e+00 1.36994e+00 8.93268e+01 237.623 -2.94199e+00 -4.63991e+00 0.00000e+00 0.00000e+00 5.48166e+01 237.623 3.45102e+01 57.623  0.9037 
1 1 1 -14 16  15 o 8  3.94743e+00 1.32388e+00 9.81593e+01 255.559 -1.57581e+00 -6.11934e+00 0.00000e+00 0.00000e+00 3.77814e+01 255.559 6.03780e+01 75.559  0.9170 
1 1 1 -14 17  1  o 14 1.82603e+01 1.38513e+00 3.42553e+02 5.498   4.31528e+01  4.15386e+00  0.00000e+00 0.00000e+00 3.45256e+02 5.498   2.70278e+00 5.498   0.9884 
1 1 1 -14 17  2  o 12 6.70075e+00 2.09811e+00 5.64054e+01 275.887 2.02154e-01  -1.96042e+00 0.00000e+00 0.00000e+00 1.20422e+02 275.887 6.40170e+01 275.887 0.6929 
1 1 1 -14 17  3  o 15 3.24842e+01 1.39058e+00 5.51191e+02 323.620 1.00442e+02  -7.39978e+01 0.00000e+00 0.00000e+00 6.80085e+02 323.620 1.28893e+02 323.620 0.9960 
1 1 1 -14 17  4  o 14 7.28414e+00 1.54589e+00 1.24060e+02 118.441 -2.93015e+00 5.40993e+00  0.00000e+00 0.00000e+00 1.29297e+02 118.441 5.23692e+00 118.441 0.9147 
1 1 1 -14 17  5  o 1  8.45322e+00 1.64025e+00 2.29633e+02 255.349 -3.36700e+00 -1.28790e+01 0.00000e+00 0.00000e+00 7.92389e+01 255.349 1.50394e+02 75.349  0.9617 
1 1 1 -14 17  6  o 6  1.30922e+01 1.39937e+00 2.60988e+02 175.704 -2.75140e+01 2.06665e+00  0.00000e+00 0.00000e+00 2.26914e+02 175.704 3.40734e+01 355.704 0.9817 
1 1 1 -14 17  7  o 18 1.70023e+01 1.28554e+00 3.11511e+02 199.283 -4.22214e+01 -1.47719e+01 0.00000e+00 0.00000e+00 3.26045e+02 199.283 1.45338e+01 199.283 0.9888 
1 1 1 -14 17  8  o 5  6.37774e+00 1.56287e+00 5.45667e+01 320.518 2.34923e+00  -1.93531e+00 0.00000e+00 0.00000e+00 1.41915e+02 320.518 8.73485e+01 320.518 0.8132 
1 1 1 -14 17  9  o 19 1.02050e+01 1.68594e+00 1.79183e+02 121.236 -8.26851e+00 1.36337e+01  0.00000e+00 0.00000e+00 1.94708e+02 121.236 1.55250e+01 121.236 0.9681 
1 1 1 -14 17  10 o 6  7.60685e+00 1.79319e+00 2.33464e+02 325.573 1.29231e+01  -8.85763e+00 0.00000e+00 0.00000e+00 4.47525e+01 325.573 1.88711e+02 145.573 0.9675 
1 1 1 -14 17  11 o 16 6.34682e+00 1.64049e+00 1.19986e+02 125.582 -4.14592e+00 5.79481e+00  0.00000e+00 0.00000e+00 1.02128e+02 125.582 1.78587e+01 305.582 0.9269 
1 1 1 -14 17  12 o 10 8.74476e+00 1.69639e+00 1.75672e+02 169.709 -1.46509e+01 2.66022e+00  0.00000e+00 0.00000e+00 1.42804e+02 169.709 3.28680e+01 349.709 0.9658 
1 1 1 -14 17  13 o 15 6.39457e+00 1.64482e+00 1.91036e+02 8.647   1.24891e+01  1.89929e+00  0.00000e+00 0.00000e+00 4.00336e+01 8.647   1.51003e+02 188.647 0.9596 
1 1 1 -14 17  14 o 19 5.87316e+00 1.52228e+00 1.33067e+02 187.325 -1.00300e+01 -1.28933e+00 0.00000e+00 0.00000e+00 7.65751e+01 187.325 5.64917e+01 7.325   0.9492 
1 1 1 -14 17  15 o 2  4.53285e+00 1.41815e+00 5.68877e+01 98.693  -5.88698e-01 3.85033e+00  0.00000e+00 0.00000e+00 8.93878e+01 98.693  3.25001e+01 98.693  0.8594 
1 1 1 -14 18  1  o 16 9.79314e+00 1.97368e+00 8.67487e+01 25.200  4.22086e+00  1.98620e+00  0.00000e+00 0.00000e+00 2.43517e+02 25.200  1.56768e+02 25.200  0.8850 
1 1 1 -14 18  2  o 2  4.60132e+00 1.88226e+00 1.02470e+02 311.286 1.77182e+00  -2.01784e+00 0.00000e+00 0.00000e+00 3.48633e+01 311.286 6.76065e+01 131.286 0.7837 
1 1 1 -14 18  3  o 19 1.18625e+01 1.62103e+00 1.74877e+02 287.103 4.04131e+00  -1.31339e+01 0.00000e+00 0.00000e+00 2.59802e+02 287.103 8.49247e+01 287.103 0.9629 
1 1 1 -14 18  4  o 12 4.86617e+00 1.37934e+00 6.18673e+01 275.115 1.94879e-01  -2.17703e+00 0.00000e+00 0.00000e+00 7.24763e+01 275.115 1.06091e+01 275.115 0.7260 
1 1 1 -14 18  5  o 17 9.25266e+00 1.60956e+00 1.42063e+02 3.477   9.11068e+00  5.53518e-01  0.00000e+00 0.00000e+00 1.89621e+02 3.477   4.75577e+01 3.477   0.9435 
1 1 1 -14 18  6  o 6  8.59698e+00 1.67177e+00 1.08084e+02 244.432 -2.96056e+00 -6.18813e+00 0.00000e+00 0.00000e+00 1.93427e+02 244.432 8.53424e+01 244.432 0.9239 
1 1 1 -14 18  7  o 14 5.50343e+00 1.52343e+00 1.91953e+02 9.630   8.42969e+00  1.43034e+00  0.00000e+00 0.00000e+00 4.13837e+00 9.630   1.87814e+02 189.630 0.9396 
1 1 1 -14 18  8  o 5  5.02901e+00 1.53042e+00 9.27877e+01 20.691  3.73125e+00  1.40922e+00  0.00000e+00 0.00000e+00 7.16448e+01 20.691  2.11429e+01 200.691 0.8631 
1 1 1 -14 18  9  o 11 7.94470e+00 1.74059e+00 1.10414e+02 162.073 -7.05702e+00 2.28306e+00  0.00000e+00 0.00000e+00 1.69166e+02 162.073 5.87518e+01 162.073 0.9299 
1 1 1 -14 18  10 o 18 6.13134e+00 1.69857e+00 1.79760e+02 170.209 -9.99435e+00 1.72464e+00  0.00000e+00 0.00000e+00 4.02611e+01 170.209 1.39499e+02 350.209 0.9493 
1 1 1 -14 18  11 o 14 5.30040e+00 1.59940e+00 1.30372e+02 276.564 8.15979e-01  -7.09095e+00 0.00000e+00 0.00000e+00 5.51394e+01 276.564 7.52323e+01 96.564  0.9270 
1 1 1 -14 18  12 o 17 6.60169e+00 1.68457e+00 9.48842e+01 59.723  3.24010e+00  5.54990e+00  0.00000e+00 0.00000e+00 1.33757e+02 59.723  3.88727e+01 59.723  0.9185 
1 1 1 -14 18  13 o 1  3.96538e+00 1.31137e+00 8.19514e+01 311.871 2.77372e+00  -3.09449e+00 0.00000e+00 0.00000e+00 4.78461e+01 311.871 3.41053e+01 131.871 0.8693 
1 1 1 -14 18  14 o 13 4.59581e+00 1.44432e+00 1.40329e+02 222.873 -6.26812e+00 -5.81914e+00 0.00000e+00 0.00000e+00 2.20495e+01 222.873 1.18280e+02 42.873  0.9396 
1 1 1 -14 19  1  o 9  2.19128e+01 1.14719e+00 4.33618e+02 91.378  -1.71615e+00 7.13432e+01  0.00000e+00 0.00000e+00 3.95503e+02 91.378  3.81156e+01 271.378 0.9930 
1 1 1 -14 19  2  o 3  1.50154e+01 1.44200e+00 2.39421e+02 318.339 1.83780e+01  -1.63519e+01 0.00000e+00 0.00000e+00 3.20624e+02 318.339 8.12034e+01 318.339 0.9795 
1 1 1 -14 19  3  f 0  1.50330e+01 1.45150e+00 2.16812e+02 281.595 4.63878e+00  -2.26076e+01 0.00000e+00 0.00000e+00 3.42701e+02 281.595 1.25889e+02 281.595 0.9781 
1 1 1 -14 19  4  o 13 1.41663e+01 1.28053e+00 3.19402e+02 49.039  2.23484e+01  2.57446e+01  0.00000e+00 0.00000e+00 2.11287e+02 49.039  1.08115e+02 229.039 0.9852 
1 1 1 -14 19  5  o 9  7.54012e+00 1.59404e+00 1.06529e+02 350.280 5.54094e+00  -9.49118e-01 0.00000e+00 0.00000e+00 1.53018e+02 350.280 4.64887e+01 350.280 0.9060 
1 1 1 -14 19  6  o 17 6.16894e+00 1.60019e+00 1.35078e+02 129.417 -4.03593e+00 4.91040e+00  0.00000e+00 0.00000e+00 7.97742e+01 129.417 5.53039e+01 309.417 0.9176 
1 1 1 -14 19  7  o 13 1.42370e+01 1.31069e+00 2.70433e+02 85.562  2.65482e+00  3.42063e+01  0.00000e+00 0.00000e+00 2.61518e+02 85.562  8.91529e+00 265.562 0.9853 
1 1 1 -14 19  8  o 4  1.00966e+01 1.63856e+00 1.47815e+02 211.080 -1.03448e+01 -6.23537e+00 0.00000e+00 0.00000e+00 2.18474e+02 211.080 7.06587e+01 211.080 0.9577 
1 1 1 -14 19  9  o 1  1.39075e+01 1.47795e+00 3.31299e+02 5.825   4.32375e+01  4.41116e+00  0.00000e+00 0.00000e+00 1.88883e+02 5.825   1.42417e+02 185.825 0.9884 
1 1 1 -14 19  10 o 18 7.83087e+00 1.77172e+00 1.14558e+02 260.698 -1.27735e+00 -7.79885e+00 0.00000e+00 0.00000e+00 1.62016e+02 260.698 4.74583e+01 260.698 0.9344 
1 1 1 -14 19  11 o 18 6.60243e+00 1.77606e+00 8.15993e+01 135.092 -3.52928e+00 3.51796e+00  0.00000e+00 0.00000e+00 1.40984e+02 135.092 5.93845e+01 135.092 0.8930 
1 1 1 -14 19  12 o 5  4.10861e+00 1.38104e+00 1.25573e+02 338.067 5.98370e+00  -2.40947e+00 0.00000e+00 0.00000e+00 1.67664e+01 338.067 1.08806e+02 158.067 0.9188 
1 1 1 -14 19  13 o 12 6.34429e+00 1.87831e+00 1.31132e+02 150.061 -6.61986e+00 3.81257e+00  0.00000e+00 0.00000e+00 9.15236e+01 150.061 3.96084e+01 330.061 0.9320 
1 1 1 -14 19  14 o 15 4.82966e+00 1.52690e+00 1.35732e+02 114.249 -3.36275e+00 7.46526e+00  0.00000e+00 0.00000e+00 3.43915e+01 114.249 1.01341e+02 294.249 0.9368 
1 1 1 -14 20  1  o 1  1.20091e+01 1.37452e+00 2.23366e+02 102.759 -4.15724e+00 1.83588e+01  0.00000e+00 0.00000e+00 2.21891e+02 102.759 1.47474e+00 282.759 0.9731 
1 1 1 -14 20  2  o 18 1.36964e+01 1.43501e+00 2.73899e+02 240.976 -1.24723e+01 -2.24786e+01 0.00000e+00 0.00000e+00 2.37387e+02 240.976 3.65115e+01 60.976  0.9804 
1 1 1 -14 20  3  o 8  3.29907e+00 1.51741e+00 1.80290e+01 307.538 2.49695e-01  -3.24965e-01 0.00000e+00 0.00000e+00 7.16834e+00 307.538 1.08606e+01 127.538 0.2007 
1 1 1 -14 20  4  o 5  2.06148e+01 1.09111e+00 2.73331e+02 51.464  2.82410e+01  3.54579e+01  0.00000e+00 0.00000e+00 5.01777e+02 51.464  2.28446e+02 51.464  0.9889 
1 1 1 -14 20  5  o 13 1.56797e+01 1.07346e+00 2.47032e+02 207.451 -2.94677e+01 -1.53079e+01 0.00000e+00 0.00000e+00 3.39591e+02 207.451 9.25591e+01 207.451 0.9848 
1 1 1 -14 20  6  o 9  1.06024e+01 1.43664e+00 2.42234e+02 135.151 -1.49529e+01 1.48741e+01  0.00000e+00 0.00000e+00 1.50524e+02 135.151 9.17101e+01 315.151 0.9760 
1 1 1 -14 20  7  o 16 9.41515e+00 1.62249e+00 1.80315e+02 315.029 9.58168e+00  -9.57189e+00 0.00000e+00 0.00000e+00 1.63252e+02 315.029 1.70630e+01 135.029 0.9623 
1 1 1 -14 20  8  o 16 1.64542e+01 1.26125e+00 2.66373e+02 252.693 -1.26696e+01 -4.06598e+01 0.00000e+00 0.00000e+00 3.49548e+02 252.693 8.31751e+01 252.693 0.9882 
1 1 1 -14 20  9  o 13 5.54311e+00 1.60046e+00 1.47282e+02 229.364 -4.69578e+00 -5.47165e+00 0.00000e+00 0.00000e+00 4.73224e+01 229.364 9.99592e+01 49.364  0.9278 
1 1 1 -14 20  10 o 18 6.22590e+00 1.62590e+00 7.80871e+01 141.921 -3.68988e+00 2.89109e+00  0.00000e+00 0.00000e+00 1.30304e+02 141.921 5.22169e+01 141.921 0.8856 
1 1 1 -14 20  11 o 13 6.35913e+00 1.74613e+00 6.53414e+01 11.494  3.66827e+00  7.45949e-01  0.00000e+00 0.00000e+00 1.39397e+02 11.494  7.40560e+01 11.494  0.8529 
1 1 1 -14 20  12 o 11 6.19565e+00 1.79833e+00 1.27140e+02 275.643 7.56115e-01  -7.65164e+00 0.00000e+00 0.00000e+00 9.06834e+01 275.643 3.64563e+01 95.643  0.9325 
1 1 1 -14 20  13 o 5  6.76788e+00 1.86911e+00 1.26792e+02 166.004 -7.68754e+00 1.91613e+00  0.00000e+00 0.00000e+00 1.11363e+02 166.004 1.54294e+01 346.004 0.9346 
1 1 1 -14 20  14 o 18 4.23020e+00 1.43371e+00 7.39818e+01 55.844  2.33510e+00  3.44172e+00  0.00000e+00 0.00000e+00 6.42965e+01 55.844  9.68529e+00 235.844 0.8694 
1 1 1 -14 21  1  o 19 6.00382e+00 1.60286e+00 6.04200e+01 67.581  8.88894e-01  2.15462e+00  0.00000e+00 0.00000e+00 1.10061e+02 67.581  4.96410e+01 67.581  0.7453 
1 1 1 -14 21  2  o 2  6.24864e+00 1.92558e+00 9.55115e+01 24.514  3.16462e+00  1.44312e+00  0.00000e+00 0.00000e+00 1.04333e+02 24.514  8.82167e+00 24.514  0.8400 
1 1 1 -14 21  3  o 10 7.73244e+00 1.90685e+00 1.17180e+02 200.584 -4.97418e+00 -1.86810e+00 0.00000e+00 0.00000e+00 1.47661e+02 200.584 3.04810e+01 200.584 0.9002 
1 1 1 -14 21  4  o 6  4.53450e+00 1.38624e+00 5.60561e+01 300.459 9.73580e-01  -1.65549e+00 0.00000e+00 0.00000e+00 6.19133e+01 300.459 5.85722e+00 300.459 0.6843 
1 1 1 -14 21  5  o 6  6.36557e+00 1.51121e+00 7.93396e+01 240.780 -1.92457e+00 -3.44076e+00 0.00000e+00 0.00000e+00 1.28925e+02 240.780 4.95852e+01 240.780 0.8613 
1 1 1 -14 21  6  o 7  1.00476e+01 1.31072e+00 2.07859e+02 289.921 6.00628e+00  -1.65731e+01 0.00000e+00 0.00000e+00 1.62501e+02 289.921 4.53580e+01 109.921 0.9712 
1 1 1 -14 21  7  o 6  7.00045e+00 1.56059e+00 8.63827e+01 354.411 4.94444e+00  -4.83844e-01 0.00000e+00 0.00000e+00 1.50553e+02 354.411 6.41702e+01 354.411 0.8926 
1 1 1 -14 21  8  o 4  1.41530e+01 1.41317e+00 2.63618e+02 266.270 -2.34864e+00 -3.60235e+01 0.00000e+00 0.00000e+00 2.64989e+02 266.270 1.37125e+00 266.270 0.9861 
1 1 1 -14 21  9  o 12 5.22738e+00 1.55613e+00 1.13654e+02 282.120 1.15525e+00  -5.37955e+00 0.00000e+00 0.00000e+00 6.51174e+01 282.120 4.85369e+01 102.120 0.9039 
1 1 1 -14 21  10 f 0  5.80333e+00 1.59342e+00 4.28274e+00 132.094 -1.63667e-01 1.81171e-01  0.00000e+00 0.00000e+00 2.22944e+01 132.094 1.80116e+01 132.094 0.1212 
1 1 1 -14 21  11 o 18 5.74381e+00 1.63757e+00 1.19060e+02 67.609  2.50142e+00  6.07165e+00  0.00000e+00 0.00000e+00 8.04881e+01 67.609  3.85718e+01 247.609 0.9204 
1 1 1 -14 21  12 o 17 5.90931e+00 1.69575e+00 1.32268e+02 217.247 -6.49929e+00 -4.94159e+00 0.00000e+00 0.00000e+00 7.63878e+01 217.247 5.58806e+01 37.247  0.9366 
1 1 1 -14 21  13 o 12 4.43811e+00 1.48732e+00 1.17946e+02 78.969  1.20503e+00  6.18120e+00  0.00000e+00 0.00000e+00 3.52389e+01 78.969  8.27067e+01 258.969 0.9167 
1 1 1 -14 21  14 o 8  6.12692e+00 1.74216e+00 8.13075e+01 13.487  5.16914e+00  1.23976e+00  0.00000e+00 0.00000e+00 1.26067e+02 13.487  4.47599e+01 13.487  0.9002 
1 1 1 -14 22  1  o 10 1.24190e+01 1.29936e+00 2.06535e+02 233.582 -1.14367e+01 -1.55021e+01 0.00000e+00 0.00000e+00 2.54164e+02 233.582 4.76285e+01 233.582 0.9737 
1 1 1 -14 22  2  o 5  4.80042e+00 1.81967e+00 8.34712e+01 279.567 4.05474e-01  -2.40575e+00 0.00000e+00 0.00000e+00 5.51184e+01 279.567 2.83529e+01 99.567  0.7583 
1 1 1 -14 22  3  f 0  8.45143e+00 1.77646e+00 1.32931e+02 272.882 3.49741e-01  -6.94591e+00 0.00000e+00 0.00000e+00 1.64508e+02 272.882 3.15771e+01 272.882 0.9250 
1 1 1 -14 22  4  o 2  1.82578e+01 1.10188e+00 3.09714e+02 9.504   4.68426e+01  7.84210e+00  0.00000e+00 0.00000e+00 3.77045e+02 9.504   6.73315e+01 9.504   0.9894 
1 1 1 -14 22  5  f 0  6.28079e+00 1.51732e+00 1.59531e+02 166.505 -7.57688e+00 1.81829e+00  0.00000e+00 0.00000e+00 6.31641e+01 166.505 9.63666e+01 346.505 0.9334 
1 1 1 -14 22  6  o 16 3.99046e+00 1.23752e+00 5.09516e+01 96.647  -2.04553e-01 1.75522e+00  0.00000e+00 0.00000e+00 4.83293e+01 96.647  2.62231e+00 276.647 0.6556 
1 1 1 -14 22  7  o 9  3.59788e+00 1.20165e+00 6.56163e+01 274.274 1.78656e-01  -2.39068e+00 0.00000e+00 0.00000e+00 3.71497e+01 274.274 2.84666e+01 94.274  0.7534 
1 1 1 -14 22  8  o 6  4.47919e+00 1.39125e+00 1.15223e+02 167.517 -4.92726e+00 1.09082e+00  0.00000e+00 0.00000e+00 3.65224e+01 167.517 7.87007e+01 347.517 0.8945 
1 1 1 -14 22  9  o 13 7.42012e+00 1.76017e+00 1.22939e+02 185.596 -7.51200e+00 -7.36097e-01 0.00000e+00 0.00000e+00 1.38479e+02 185.596 1.55407e+01 185.596 0.9312 
1 1 1 -14 22  10 o 1  1.08735e+01 1.76166e+00 2.30512e+02 17.862  2.11208e+01  6.80647e+00  0.00000e+00 0.00000e+00 1.71044e+02 17.862  5.94686e+01 197.862 0.9772 
1 1 1 -14 22  11 o 19 1.04852e+01 1.86893e+00 1.88760e+02 218.867 -1.36077e+01 -1.09670e+01 0.00000e+00 0.00000e+00 1.95516e+02 218.867 6.75621e+00 218.867 0.9710 
1 1 1 -14 22  12 o 1  5.58024e+00 1.66451e+00 1.14916e+02 160.899 -6.23919e+00 2.16061e+00  0.00000e+00 0.00000e+00 7.87890e+01 160.899 3.61268e+01 340.899 0.9208 
1 1 1 -14 22  13 o 13 7.70481e+00 1.93474e+00 3.68536e+01 277.283 3.21400e-01  -2.51472e+00 0.00000e+00 0.00000e+00 1.86144e+02 277.283 1.49290e+02 277.283 0.7688 
1 1 1 -14 23  1  o 11 4.52745e+00 1.47083e+00 2.40766e+01 331.475 6.72531e-01  -3.65535e-01 0.00000e+00 0.00000e+00 3.75299e+01 331.475 1.34533e+01 331.475 0.3572 
1 1 1 -14 23  2  o 15 1.45792e+01 1.82581e+00 3.15574e+02 310.840 1.82653e+01  -2.11309e+01 0.00000e+00 0.00000e+00 2.29448e+02 310.840 8.61260e+01 130.840 0.9819 
1 1 1 -14 23  3  o 1  1.05505e+01 1.53050e+00 1.82706e+02 128.437 -8.20365e+00 1.03367e+01  0.00000e+00 0.00000e+00 2.03159e+02 128.437 2.04535e+01 128.437 0.9613 
1 1 1 -14 23  4  o 10 5.80092e+00 1.49976e+00 1.65197e+02 196.837 -6.67301e+00 -2.01945e+00 0.00000e+00 0.00000e+00 3.88313e+01 196.837 1.26366e+02 16.837  0.9252 
1 1 1 -14 23  5  o 10 1.01922e+01 1.37910e+00 1.57146e+02 124.948 -7.48371e+00 1.07085e+01  0.00000e+00 0.00000e+00 2.14857e+02 124.948 5.77109e+01 124.948 0.9609 
1 1 1 -14 23  6  o 11 5.10946e+00 1.46731e+00 3.11518e+01 274.162 9.48596e-02  -1.30342e+00 0.00000e+00 0.00000e+00 7.44523e+01 274.162 4.33006e+01 274.162 0.5446 
1 1 1 -14 23  7  o 5  8.40096e+00 1.42998e+00 1.62278e+02 231.978 -7.63761e+00 -9.76812e+00 0.00000e+00 0.00000e+00 1.43093e+02 231.978 1.91843e+01 51.978  0.9588 
1 1 1 -14 23  8  o 7  8.10073e+00 1.63754e+00 1.92937e+02 190.175 -1.28583e+01 -2.30781e+00 0.00000e+00 0.00000e+00 1.01877e+02 190.175 9.10604e+01 10.175  0.9609 
1 1 1 -14 23  9  o 9  7.05359e+00 1.65972e+00 8.25942e+01 255.785 -1.29641e+00 -5.11766e+00 0.00000e+00 0.00000e+00 1.57435e+02 255.785 7.48410e+01 255.785 0.8995 
1 1 1 -14 23  10 o 19 6.23570e+00 1.60473e+00 1.45382e+02 42.787  6.45744e+00  5.97686e+00  0.00000e+00 0.00000e+00 7.64345e+01 42.787  6.89474e+01 222.787 0.9413 
1 1 1 -14 23  11 o 14 6.35074e+00 1.71815e+00 9.53823e+01 253.267 -1.69163e+00 -5.62678e+00 0.00000e+00 0.00000e+00 1.22835e+02 253.267 2.74526e+01 253.267 0.9104 
1 1 1 -14 23  12 o 6  1.50144e+01 1.47332e+00 2.53250e+02 347.116 4.31660e+01  -9.87390e+00 0.00000e+00 0.00000e+00 3.06299e+02 347.116 5.30492e+01 347.116 0.9886 
1 1 1 -14 23  13 o 5  5.37604e+00 1.64310e+00 8.95351e+01 203.440 -4.82700e+00 -2.09284e+00 0.00000e+00 0.00000e+00 9.24301e+01 203.440 2.89492e+00 203.440 0.8991 
1 1 1 -14 24  1  o 3  7.45898e+00 1.71891e+00 4.30802e+01 19.818  1.91907e+00  6.91600e-01  0.00000e+00 0.00000e+00 1.57018e+02 19.818  1.13938e+02 19.818  0.7042 
1 1 1 -14 24  2  o 16 8.95782e+00 1.58467e+00 8.63564e+01 221.453 -3.88524e+00 -3.43175e+00 0.00000e+00 0.00000e+00 2.19697e+02 221.453 1.33341e+02 221.453 0.8975 
1 1 1 -14 24  3  o 18 1.29181e+01 1.36556e+00 1.88097e+02 341.938 1.76154e+01  -5.74481e+00 0.00000e+00 0.00000e+00 2.89879e+02 341.938 1.01781e+02 341.938 0.9726 
1 1 1 -14 24  4  o 17 1.69014e+01 1.04577e+00 2.57224e+02 241.869 -1.77310e+01 -3.31645e+01 0.00000e+00 0.00000e+00 3.76634e+02 241.869 1.19410e+02 241.869 0.9866 
1 1 1 -14 24  5  o 18 4.97971e+00 1.35554e+00 5.15388e+01 158.696 -1.96767e+00 7.67321e-01  0.00000e+00 0.00000e+00 8.37529e+01 158.696 3.22141e+01 158.696 0.7153 
1 1 1 -14 24  6  o 19 8.45833e+00 1.41842e+00 9.38935e+01 348.203 6.22043e+00  -1.29912e+00 0.00000e+00 0.00000e+00 2.00600e+02 348.203 1.06707e+02 348.203 0.9175 
1 1 1 -14 24  7  o 18 9.91067e+00 1.36015e+00 1.56910e+02 120.272 -7.62538e+00 1.30641e+01  0.00000e+00 0.00000e+00 2.06160e+02 120.272 4.92503e+01 120.272 0.9664 
1 1 1 -14 24  8  o 10 4.99808e+00 1.39386e+00 1.73250e+02 233.796 -5.08498e+00 -6.94666e+00 0.00000e+00 0.00000e+00 4.67195e+00 233.796 1.68578e+02 53.796  0.9400 
1 1 1 -14 24  9  o 15 5.03967e+00 1.42546e+00 1.16513e+02 12.533  5.92491e+00  1.31711e+00  0.00000e+00 0.00000e+00 5.76320e+01 12.533  5.88808e+01 192.533 0.9134 
1 1 1 -14 24  10 o 8  5.10989e+00 1.50650e+00 9.01224e+01 189.782 -4.68438e+00 -8.07654e-01 0.00000e+00 0.00000e+00 8.12085e+01 189.782 8.91387e+00 9.782   0.8873 
1 1 1 -14 24  11 o 9  9.34518e+00 1.71555e+00 1.84305e+02 311.266 1.06408e+01  -1.21266e+01 0.00000e+00 0.00000e+00 1.57280e+02 311.266 2.70256e+01 131.266 0.9685 
1 1 1 -14 24  12 o 14 5.93033e+00 1.68554e+00 6.21494e+01 67.135  1.47283e+00  3.49265e+00  0.00000e+00 0.00000e+00 1.28961e+02 67.135  6.68117e+01 67.135  0.8550 
1 1 1 -14 24  13 o 13 5.61585e+00 1.64369e+00 6.81526e+01 275.457 3.97395e-01  -4.15947e+00 0.00000e+00 0.00000e+00 1.15774e+02 275.457 4.76214e+01 275.457 0.8700 
1 1 1 -14 25  1  o 6  1.12230e+01 1.49915e+00 2.25288e+02 30.453  1.51266e+01  8.89358e+00  0.00000e+00 0.00000e+00 1.89845e+02 30.453  3.54435e+01 210.453 0.9711 
1 1 1 -14 25  2  o 5  1.12017e+01 1.41920e+00 2.00790e+02 113.479 -6.41055e+00 1.47579e+01  0.00000e+00 0.00000e+00 2.12149e+02 113.479 1.13596e+01 113.479 0.9684 
1 1 1 -14 25  3  f 0  1.80474e+01 1.74354e+00 2.75896e+02 258.839 -6.27179e+00 -3.17885e+01 0.00000e+00 0.00000e+00 3.99932e+02 258.839 1.24036e+02 258.839 0.9844 
1 1 1 -14 25  4  o 9  2.04068e+01 1.01609e+00 4.12163e+02 113.578 -2.94263e+01 6.74246e+01  0.00000e+00 0.00000e+00 3.58198e+02 113.578 5.39649e+01 293.578 0.9932 
1 1 1 -14 25  5  o 15 6.37360e+00 1.40160e+00 1.28146e+02 53.968  4.01357e+00  5.51772e+00  0.00000e+00 0.00000e+00 9.53910e+01 53.968  3.27554e+01 233.968 0.9235 
1 1 1 -14 25  6  o 10 1.21455e+01 1.22276e+00 1.96736e+02 192.104 -2.02560e+01 -4.34388e+00 0.00000e+00 0.00000e+00 2.52842e+02 192.104 5.61057e+01 192.104 0.9756 
1 1 1 -14 25  7  o 1  6.23849e+00 1.46376e+00 1.06468e+02 88.301  1.81610e-01  6.12215e+00  0.00000e+00 0.00000e+00 1.09738e+02 88.301  3.27028e+00 88.301  0.9143 
1 1 1 -14 25  8  o 8  8.18088e+00 1.41554e+00 1.55919e+02 103.072 -2.83305e+00 1.22014e+01  0.00000e+00 0.00000e+00 1.41241e+02 103.072 1.46784e+01 283.072 0.9592 
1 1 1 -14 25  9  o 18 9.46452e+00 1.36215e+00 1.67189e+02 288.764 5.35498e+00  -1.57626e+01 0.00000e+00 0.00000e+00 1.79903e+02 288.764 1.27139e+01 288.764 0.9695 
1 1 1 -14 25  10 o 19 7.22772e+00 1.52586e+00 8.86215e+01 325.550 5.38618e+00  -3.69495e+00 0.00000e+00 0.00000e+00 1.62596e+02 325.550 7.39748e+01 325.550 0.9199 
1 1 1 -14 25  11 o 18 7.39169e+00 1.69602e+00 1.49076e+02 302.771 5.64957e+00  -8.77623e+00 0.00000e+00 0.00000e+00 1.16155e+02 302.771 3.29217e+01 122.771 0.9508 
1 1 1 -14 25  12 o 8  6.71997e+00 1.80293e+00 1.82760e+02 202.507 -1.08041e+01 -4.47666e+00 0.00000e+00 0.00000e+00 5.94369e+01 202.507 1.23323e+02 22.507  0.9562 
1 1 1 -14 25  13 o 12 4.71400e+00 1.53005e+00 1.00858e+02 349.155 5.56032e+00  -1.06526e+00 0.00000e+00 0.00000e+00 6.00346e+01 349.155 4.08236e+01 169.154 0.9068 
1 1 1 -14 26  1  o 3  6.33661e+00 1.47470e+00 1.71425e+02 297.875 3.55498e+00  -6.72138e+00 0.00000e+00 0.00000e+00 5.34460e+01 297.875 1.17979e+02 117.875 0.9317 
1 1 1 -14 26  2  f 0  2.19136e+01 1.05600e+00 4.88536e+02 347.247 8.93575e+01  -2.02244e+01 0.00000e+00 0.00000e+00 3.41013e+02 347.247 1.47523e+02 167.247 0.9945 
1 1 1 -14 26  3  o 15 8.11894e+00 1.63946e+00 1.63849e+02 230.522 -5.80367e+00 -7.04594e+00 0.00000e+00 0.00000e+00 1.27526e+02 230.522 3.63226e+01 50.522  0.9435 
1 1 1 -14 26  4  o 4  6.28690e+00 1.45009e+00 1.08103e+02 292.981 2.12827e+00  -5.01850e+00 0.00000e+00 0.00000e+00 1.07639e+02 292.981 4.63659e-01 112.981 0.9029 
1 1 1 -14 26  5  o 6  1.29511e+01 1.15233e+00 1.68505e+02 226.777 -1.38713e+01 -1.47594e+01 0.00000e+00 0.00000e+00 3.11015e+02 226.777 1.42510e+02 226.777 0.9750 
1 1 1 -14 26  6  o 17 4.72088e+00 1.38918e+00 9.94564e+01 14.616  3.91255e+00  1.02028e+00  0.00000e+00 0.00000e+00 5.55079e+01 14.616  4.39485e+01 194.616 0.8652 
1 1 1 -14 26  7  o 11 7.07654e+00 1.37814e+00 1.90391e+02 42.694  9.52253e+00  8.78537e+00  0.00000e+00 0.00000e+00 6.72713e+01 42.694  1.23120e+02 222.694 0.9606 
1 1 1 -14 26  8  o 14 5.37884e+00 1.46174e+00 1.28072e+02 111.480 -2.42738e+00 6.16858e+00  0.00000e+00 0.00000e+00 5.95391e+01 111.480 6.85332e+01 291.480 0.9211 
1 1 1 -14 26  9  o 5  4.50726e+00 1.33842e+00 1.12554e+02 240.020 -2.69934e+00 -4.67922e+00 0.00000e+00 0.00000e+00 4.12134e+01 240.020 7.13408e+01 60.020  0.9019 
1 1 1 -14 26  10 o 2  4.15126e+00 1.31057e+00 8.12227e+01 348.985 3.82769e+00  -7.45087e-01 0.00000e+00 0.00000e+00 5.35886e+01 348.985 2.76341e+01 168.985 0.8595 
1 1 1 -14 26  11 o 1  3.96678e+00 1.24111e+00 1.58827e+02 202.018 -7.73361e+00 -3.12748e+00 0.00000e+00 0.00000e+00 1.84185e+01 22.018  1.77245e+02 22.018  0.9380 
1 1 1 -14 26  12 o 16 4.15029e+00 1.29604e+00 4.85071e+01 165.625 -2.44692e+00 6.27120e-01  0.00000e+00 0.00000e+00 7.15885e+01 165.625 2.30814e+01 165.625 0.7678 
1 1 1 -14 26  13 o 2  3.99108e+00 1.31592e+00 7.02727e+01 247.650 -1.46933e+00 -3.57374e+00 0.00000e+00 0.00000e+00 5.86251e+01 247.650 1.16476e+01 67.650  0.8581 
1 1 1 -14 27  1  o 15 5.07427e+00 1.53225e+00 1.64321e+02 301.194 3.07701e+00  -5.08198e+00 0.00000e+00 0.00000e+00 1.18212e+01 301.194 1.52499e+02 121.194 0.9114 
1 1 1 -14 27  2  o 1  7.13673e+00 1.42542e+00 1.84667e+02 16.848  9.37866e+00  2.84019e+00  0.00000e+00 0.00000e+00 7.27078e+01 16.848  1.11959e+02 196.848 0.9475 
1 1 1 -14 27  3  o 3  1.82273e+01 1.41822e+00 3.50361e+02 178.580 -4.80032e+01 1.19014e+00  0.00000e+00 0.00000e+00 3.35633e+02 178.580 1.47271e+01 358.580 0.9895 
1 1 1 -14 27  4  o 14 1.80640e+01 1.11288e+00 3.55018e+02 18.694  5.60285e+01  1.89585e+01  0.00000e+00 0.00000e+00 3.25660e+02 18.694  2.93586e+01 198.694 0.9915 
1 1 1 -14 27  5  o 8  1.17194e+01 1.21364e+00 2.09761e+02 188.088 -2.13871e+01 -3.03924e+00 0.00000e+00 0.00000e+00 2.24824e+02 188.088 1.50630e+01 188.088 0.9766 
1 1 1 -14 27  6  o 12 4.74295e+00 1.35679e+00 7.37917e+01 111.348 -1.11202e+00 2.84509e+00  0.00000e+00 0.00000e+00 7.26688e+01 111.348 1.12287e+00 291.348 0.8139 
1 1 1 -14 27  7  o 12 1.17009e+01 1.22004e+00 2.77451e+02 338.787 3.14323e+01  -1.22001e+01 0.00000e+00 0.00000e+00 1.59406e+02 338.787 1.18044e+02 158.787 0.9851 
1 1 1 -14 27  8  o 13 8.01337e+00 1.36043e+00 2.01976e+02 93.539  -1.01362e+00 1.63873e+01  0.00000e+00 0.00000e+00 9.20435e+01 93.539  1.09932e+02 273.539 0.9691 
1 1 1 -14 27  9  o 10 9.79096e+00 1.39667e+00 1.98147e+02 224.083 -1.42023e+01 -1.37549e+01 0.00000e+00 0.00000e+00 1.62675e+02 224.083 3.54724e+01 44.083  0.9744 
1 1 1 -14 27  10 o 13 6.00605e+00 1.48008e+00 1.56168e+02 122.483 -5.27419e+00 8.28413e+00  0.00000e+00 0.00000e+00 5.88500e+01 122.483 9.73176e+01 302.483 0.9476 
1 1 1 -14 27  11 o 6  5.49329e+00 1.50898e+00 5.67035e+01 63.937  1.52697e+00  3.12207e+00  0.00000e+00 0.00000e+00 1.17372e+02 63.937  6.06684e+01 63.937  0.8398 
1 1 1 -14 27  12 o 18 4.23592e+00 1.34609e+00 6.17165e+01 127.885 -1.95092e+00 2.50746e+00  0.00000e+00 0.00000e+00 6.95434e+01 127.885 7.82683e+00 127.885 0.8223 
1 1 1 -14 27  13 o 10 4.20152e+00 1.31828e+00 1.02648e+02 206.256 -5.38530e+00 -2.65641e+00 0.00000e+00 0.00000e+00 4.16314e+01 206.256 6.10161e+01 26.256  0.9124 
1 1 1 -14 28  1  o 16 4.54165e+00 1.42600e+00 2.49440e+01 230.219 -5.38668e-01 -6.46975e-01 0.00000e+00 0.00000e+00 4.20899e+01 230.219 1.71460e+01 230.219 0.3876 
1 1 1 -14 28  2  o 7  1.33617e+01 1.30062e+00 2.47165e+02 144.352 -2.11690e+01 1.51826e+01  0.00000e+00 0.00000e+00 2.51496e+02 144.352 4.33116e+00 144.352 0.9806 
1 1 1 -14 28  3  o 10 1.28112e+01 1.20766e+00 2.48840e+02 294.692 1.08814e+01  -2.36671e+01 0.00000e+00 0.00000e+00 2.28937e+02 294.692 1.99028e+01 114.692 0.9806 
1 1 1 -14 28  4  o 4  4.35951e+00 1.39773e+00 7.05640e+01 92.050  -8.89775e-02 2.48629e+00  0.00000e+00 0.00000e+00 5.59511e+01 92.050  1.46129e+01 272.049 0.7637 
1 1 1 -14 28  5  o 13 7.87308e+00 1.46596e+00 1.48562e+02 84.989  8.40161e-01  9.58107e+00  0.00000e+00 0.00000e+00 1.34378e+02 84.989  1.41846e+01 264.989 0.9465 
1 1 1 -14 28  6  o 8  1.02930e+01 1.34443e+00 1.95934e+02 347.672 1.79481e+01  -3.92233e+00 0.00000e+00 0.00000e+00 1.83754e+02 347.672 1.21801e+01 167.672 0.9724 
1 1 1 -14 28  7  o 7  1.33630e+01 1.17633e+00 2.99993e+02 120.025 -2.02802e+01 3.50911e+01  0.00000e+00 0.00000e+00 2.00163e+02 120.025 9.98307e+01 300.025 0.9876 
1 1 1 -14 28  8  o 6  1.03762e+01 1.24938e+00 1.51478e+02 24.957  1.57565e+01  7.33302e+00  0.00000e+00 0.00000e+00 2.29892e+02 24.957  7.84137e+01 24.957  0.9708 
1 1 1 -14 28  9  o 19 3.89263e+00 1.25003e+00 1.01931e+02 172.679 -4.79580e+00 6.16169e-01  0.00000e+00 0.00000e+00 2.90045e+01 172.679 7.29267e+01 352.679 0.8894 
1 1 1 -14 28  10 o 6  4.73648e+00 1.45837e+00 7.71162e+01 145.784 -3.29700e+00 2.24200e+00  0.00000e+00 0.00000e+00 7.72996e+01 145.784 1.83391e-01 145.784 0.8630 
1 1 1 -14 28  11 o 1  7.98209e+00 1.53922e+00 1.10602e+02 168.695 -9.46690e+00 1.89246e+00  0.00000e+00 0.00000e+00 1.74512e+02 168.695 6.39095e+01 168.695 0.9467 
1 1 1 -14 28  12 o 16 5.05455e+00 1.39918e+00 1.14197e+02 313.445 4.98013e+00  -5.25807e+00 0.00000e+00 0.00000e+00 6.25844e+01 313.445 5.16123e+01 133.445 0.9281 
1 1 1 -14 28  13 o 10 5.09286e+00 1.49534e+00 7.35670e+01 123.345 -2.61325e+00 3.97147e+00  0.00000e+00 0.00000e+00 9.64996e+01 123.345 2.29326e+01 123.345 0.8874 
1 1 1 -14 29  1  o 14 9.83558e+00 1.54518e+00 1.86855e+02 198.244 -1.24635e+01 -4.10839e+00 0.00000e+00 0.00000e+00 1.73119e+02 198.244 1.37361e+01 18.244  0.9611 
1 1 1 -14 29  2  o 1  1.69459e+01 1.19161e+00 2.45028e+02 154.723 -3.09103e+01 1.45964e+01  0.00000e+00 0.00000e+00 3.90348e+02 154.723 1.45320e+02 154.723 0.9853 
1 1 1 -14 29  3  o 10 1.13527e+01 1.24309e+00 2.27611e+02 308.817 1.42000e+01  -1.76505e+01 0.00000e+00 0.00000e+00 1.94469e+02 308.817 3.31423e+01 128.817 0.9777 
1 1 1 -14 29  4  o 1  5.47068e+00 1.40831e+00 1.05321e+02 11.353  4.70676e+00  9.45038e-01  0.00000e+00 0.00000e+00 7.93868e+01 11.353  2.59341e+01 191.353 0.8885 
1 1 1 -14 29  5  o 2  1.36934e+01 1.28104e+00 2.32682e+02 338.478 2.64363e+01  -1.04252e+01 0.00000e+00 0.00000e+00 2.77975e+02 338.478 4.52932e+01 338.478 0.9822 
1 1 1 -14 29  6  o 11 1.57114e+01 1.06573e+00 2.39834e+02 183.840 -4.05924e+01 -2.72491e+00 0.00000e+00 0.00000e+00 3.48764e+02 183.840 1.08929e+02 183.840 0.9876 
1 1 1 -14 29  7  o 10 7.72830e+00 1.42691e+00 9.21391e+01 263.650 -7.56922e-01 -6.80161e+00 0.00000e+00 0.00000e+00 1.78397e+02 263.650 8.62582e+01 263.650 0.9237 
1 1 1 -14 29  8  o 2  9.00538e+00 1.38027e+00 2.14531e+02 14.800  1.85444e+01  4.89981e+00  0.00000e+00 0.00000e+00 1.17377e+02 14.800  9.71546e+01 194.800 0.9736 
1 1 1 -14 29  9  o 18 4.21248e+00 1.31496e+00 1.30093e+02 192.858 -6.26643e+00 -1.43035e+00 0.00000e+00 0.00000e+00 1.62279e+01 192.858 1.13865e+02 12.858  0.9185 
1 1 1 -14 29  10 o 2  5.07081e+00 1.46364e+00 6.44332e+01 36.380  2.72805e+00  2.00983e+00  0.00000e+00 0.00000e+00 9.55129e+01 36.380  3.10797e+01 36.380  0.8351 
1 1 1 -14 29  11 o 8  4.74163e+00 1.41726e+00 9.98623e+01 249.091 -2.02763e+00 -5.30746e+00 0.00000e+00 0.00000e+00 6.24093e+01 249.091 3.74530e+01 69.091  0.9071 
1 1 1 -14 29  12 o 13 3.75839e+00 1.26093e+00 7.94925e+01 63.378  1.81873e+00  3.62850e+00  0.00000e+00 0.00000e+00 4.31094e+01 63.378  3.63831e+01 243.378 0.8657 
1 1 1 -14 29  13 o 7  4.98734e+00 1.45566e+00 1.19006e+02 320.926 6.00946e+00  -4.87923e+00 0.00000e+00 0.00000e+00 5.60863e+01 320.926 6.29197e+01 140.926 0.9330 
1 1 1 -14 30  1  o 17 5.97901e+00 1.55891e+00 1.00733e+02 159.504 -4.00816e+00 1.49830e+00  0.00000e+00 0.00000e+00 9.81201e+01 159.504 2.61332e+00 339.504 0.8735 
1 1 1 -14 30  2  o 7  2.96711e+01 1.10788e+00 5.45164e+02 109.900 -4.66537e+01 1.28877e+02  0.00000e+00 0.00000e+00 5.79757e+02 109.900 3.45929e+01 109.900 0.9963 
1 1 1 -14 30  3  o 3  1.12557e+01 1.32276e+00 1.79965e+02 236.666 -9.42197e+00 -1.43253e+01 0.00000e+00 0.00000e+00 2.35356e+02 236.666 5.53907e+01 236.666 0.9704 
1 1 1 -14 30  4  o 9  4.83477e+00 1.41143e+00 5.47084e+01 241.406 -1.05201e+00 -1.93000e+00 0.00000e+00 0.00000e+00 7.89806e+01 241.406 2.42722e+01 241.406 0.7278 
1 1 1 -14 30  5  o 19 1.42179e+01 1.07426e+00 2.69002e+02 26.633  3.14253e+01  1.57594e+01  0.00000e+00 0.00000e+00 2.63024e+02 26.633  5.97817e+00 206.633 0.9857 
1 1 1 -14 30  6  o 1  1.42756e+01 1.16120e+00 2.33230e+02 264.284 -3.42705e+00 -3.42391e+01 0.00000e+00 0.00000e+00 3.00303e+02 264.284 6.70732e+01 264.284 0.9854 
1 1 1 -14 30  7  o 9  1.13526e+01 1.23275e+00 2.85907e+02 32.759  2.89211e+01  1.86094e+01  0.00000e+00 0.00000e+00 1.37972e+02 32.759  1.47935e+02 212.759 0.9854 
1 1 1 -14 30  8  o 7  3.80507e+00 1.23733e+00 1.27792e+02 273.947 3.57034e-01  -5.17395e+00 0.00000e+00 0.00000e+00 1.48574e+00 273.947 1.26306e+02 93.948  0.8975 
1 1 1 -14 30  9  o 11 4.71043e+00 1.38115e+00 4.96409e+01 323.801 2.09118e+00  -1.53046e+00 0.00000e+00 0.00000e+00 8.83246e+01 323.801 3.86837e+01 323.801 0.7746 
1 1 1 -14 30  10 o 13 8.19406e+00 1.42675e+00 1.84847e+02 170.963 -1.58281e+01 2.51748e+00  0.00000e+00 0.00000e+00 1.14824e+02 170.963 7.00228e+01 350.963 0.9683 
1 1 1 -14 30  11 o 8  6.47706e+00 1.52049e+00 7.83962e+01 81.637  7.99251e-01  5.43688e+00  0.00000e+00 0.00000e+00 1.42423e+02 81.637  6.40267e+01 81.637  0.9037 
1 1 1 -14 30  12 o 9  4.76981e+00 1.42332e+00 6.92978e+01 51.826  2.49453e+00  3.17297e+00  0.00000e+00 0.00000e+00 8.61327e+01 51.826  1.68349e+01 51.826  0.8649 
1 1 1 -14 30  13 o 18 4.33356e+00 1.37493e+00 1.23739e+02 204.773 -6.69117e+00 -3.08799e+00 0.00000e+00 0.00000e+00 2.78124e+01 204.773 9.59262e+01 24.773  0.9294 
1 1 1 -14 31  1  o 17 2.38578e+01 1.15366e+00 3.50867e+02 155.041 -6.90641e+01 3.21455e+01  0.00000e+00 0.00000e+00 5.51510e+02 155.041 2.00642e+02 155.041 0.9934 
1 1 1 -14 31  2  o 7  1.35474e+01 1.18853e+00 2.68959e+02 290.365 1.13641e+01  -3.06137e+01 0.00000e+00 0.00000e+00 2.38550e+02 290.365 3.04089e+01 110.365 0.9846 
1 1 1 -14 31  3  o 15 1.02569e+01 1.27039e+00 1.62616e+02 131.904 -9.50396e+00 1.05908e+01  0.00000e+00 0.00000e+00 2.13406e+02 131.904 5.07904e+01 131.904 0.9642 
1 1 1 -14 31  4  o 2  9.07129e+00 1.31579e+00 1.66877e+02 260.986 -1.99805e+00 -1.25958e+01 0.00000e+00 0.00000e+00 1.63960e+02 260.986 2.91732e+00 80.986  0.9600 
1 1 1 -14 31  5  o 9  5.74249e+00 1.28259e+00 7.47270e+01 322.355 3.06976e+00  -2.36784e+00 0.00000e+00 0.00000e+00 1.12439e+02 322.355 3.77119e+01 322.355 0.8586 
1 1 1 -14 31  6  o 11 3.91838e+00 1.15861e+00 6.95554e+01 177.491 -2.92065e+00 1.27998e-01  0.00000e+00 0.00000e+00 4.99500e+01 177.491 1.96053e+01 357.491 0.8042 
1 1 1 -14 31  7  o 6  4.24550e+00 1.26361e+00 7.22201e+01 301.943 1.63668e+00  -2.62505e+00 0.00000e+00 0.00000e+00 5.91487e+01 301.943 1.30715e+01 121.943 0.8167 
1 1 1 -14 31  8  o 12 1.08803e+01 1.27045e+00 2.11060e+02 3.764   2.47016e+01  1.62515e+00  0.00000e+00 0.00000e+00 1.92364e+02 3.764   1.86957e+01 183.764 0.9796 
1 1 1 -14 31  9  o 4  6.76595e+00 1.55885e+00 1.46611e+02 321.247 7.75885e+00  -6.22774e+00 0.00000e+00 0.00000e+00 9.59905e+01 321.247 5.06200e+01 141.247 0.9483 
1 1 1 -14 31  10 o 18 5.67436e+00 1.50388e+00 1.61620e+02 180.059 -1.00498e+01 -1.03627e-02 0.00000e+00 0.00000e+00 4.17223e+01 180.059 1.19897e+02 0.059   0.9489 
1 1 1 -14 31  11 o 18 4.61171e+00 1.39345e+00 6.92526e+01 203.909 -3.41401e+00 -1.51353e+00 0.00000e+00 0.00000e+00 7.90425e+01 203.909 9.78987e+00 203.909 0.8525 
1 1 1 -14 31  12 o 7  5.15011e+00 1.49003e+00 3.85086e+01 343.065 2.29868e+00  -6.99933e-01 0.00000e+00 0.00000e+00 1.07785e+02 343.065 6.92766e+01 343.065 0.7540 
1 1 1 -14 31  13 f 0  3.42670e+00 1.16791e+00 2.93100e+01 104.739 -4.13880e-01 1.57321e+00  0.00000e+00 0.00000e+00 5.13883e+01 104.739 2.20783e+01 104.739 0.6259 
1 1 1 -14 32  1  o 2  8.37934e+00 1.65185e+00 1.78341e+02 54.297  6.38009e+00  8.87781e+00  0.00000e+00 0.00000e+00 1.25706e+02 54.297  5.26355e+01 234.297 0.9531 
1 1 1 -14 32  2  o 19 2.28990e+01 1.13533e+00 4.07932e+02 39.057  6.54108e+01  5.30755e+01  0.00000e+00 0.00000e+00 4.58088e+02 39.057  5.01563e+01 39.057  0.9940 
1 1 1 -14 32  3  o 17 8.97293e+00 1.37055e+00 1.12530e+02 182.335 -8.54586e+00 -3.48531e-01 0.00000e+00 0.00000e+00 2.07996e+02 182.335 9.54660e+01 182.335 0.9396 
1 1 1 -14 32  4  o 7  6.04802e+00 1.47353e+00 1.21485e+02 256.087 -1.44740e+00 -5.84316e+00 0.00000e+00 0.00000e+00 8.82059e+01 256.087 3.32792e+01 76.087  0.9127 
1 1 1 -14 32  5  o 16 5.44205e+00 1.37154e+00 1.43506e+02 359.009 6.77019e+00  -1.17072e-01 0.00000e+00 0.00000e+00 4.71282e+01 359.009 9.63776e+01 179.009 0.9229 
1 1 1 -14 32  6  o 14 1.10398e+01 1.12227e+00 1.10094e+02 283.185 3.01859e+00  -1.28851e+01 0.00000e+00 0.00000e+00 2.92422e+02 283.185 1.82328e+02 283.185 0.9614 
1 1 1 -14 32  7  o 17 7.02444e+00 1.39907e+00 1.50420e+02 324.101 8.48175e+00  -6.13952e+00 0.00000e+00 0.00000e+00 1.02663e+02 324.101 4.77574e+01 144.101 0.9510 
1 1 1 -14 32  8  o 16 4.06604e+00 1.25563e+00 9.87917e+01 225.921 -3.17257e+00 -3.27628e+00 0.00000e+00 0.00000e+00 3.69524e+01 225.921 6.18393e+01 45.921  0.8821 
1 1 1 -14 32  9  o 15 5.34687e+00 1.42598e+00 8.42654e+01 302.517 2.62392e+00  -4.11606e+00 0.00000e+00 0.00000e+00 9.57575e+01 302.517 1.14921e+01 302.517 0.8906 
1 1 1 -14 32  10 o 14 4.40828e+00 1.32370e+00 7.15505e+01 103.913 -8.76287e-01 3.53738e+00  0.00000e+00 0.00000e+00 6.96671e+01 103.913 1.88340e+00 283.913 0.8483 
1 1 1 -14 32  11 o 3  7.15197e+00 1.53984e+00 7.89176e+01 304.123 3.56879e+00  -5.26661e+00 0.00000e+00 0.00000e+00 1.68621e+02 304.123 8.97039e+01 304.123 0.9176 
1 1 1 -14 32  12 o 10 4.66572e+00 1.43612e+00 9.32330e+01 327.994 4.36038e+00  -2.72525e+00 0.00000e+00 0.00000e+00 6.43471e+01 327.994 2.88859e+01 147.994 0.8966 
1 1 1 -14 32  13 o 1  4.65198e+00 1.42030e+00 1.17002e+02 106.880 -2.20830e+00 7.27736e+00  0.00000e+00 0.00000e+00 4.60567e+01 106.880 7.09455e+01 286.880 0.9317 
1 1 1 -14 33  1  o 12 7.78899e+00 1.68575e+00 1.33705e+02 11.426  7.26497e+00  1.46826e+00  0.00000e+00 0.00000e+00 1.42004e+02 11.426  8.29865e+00 11.426  0.9299 
1 1 1 -14 33  2  o 13 9.23968e+00 1.57193e+00 2.11297e+02 174.969 -1.45591e+01 1.28180e+00  0.00000e+00 0.00000e+00 1.27954e+02 174.969 8.33433e+01 354.969 0.9652 
1 1 1 -14 33  3  o 19 1.40383e+01 1.19869e+00 2.48730e+02 253.970 -8.53445e+00 -2.97041e+01 0.00000e+00 0.00000e+00 2.76230e+02 253.970 2.75002e+01 253.970 0.9837 
1 1 1 -14 33  4  f 0  5.90091e+00 1.44908e+00 1.43084e+02 193.102 -6.49560e+00 -1.51182e+00 0.00000e+00 0.00000e+00 6.35002e+01 193.102 7.95842e+01 13.102  0.9216 
1 1 1 -14 33  5  o 10 1.71914e+01 9.09862e-01 2.76947e+02 37.879  4.12014e+01  3.20500e+01  0.00000e+00 0.00000e+00 3.69245e+02 37.879  9.22980e+01 37.879  0.9904 
1 1 1 -14 33  6  o 1  5.75178e+00 1.37822e+00 1.03772e+02 136.444 -3.98399e+00 3.78811e+00  0.00000e+00 0.00000e+00 9.33435e+01 136.444 1.04285e+01 316.444 0.9038 
1 1 1 -14 33  7  f 0  1.75996e+01 9.26195e-01 3.44650e+02 288.291 2.38912e+01  -7.22761e+01 0.00000e+00 0.00000e+00 3.17681e+02 288.291 2.69684e+01 108.292 0.9934 
1 1 1 -14 33  8  o 19 4.84930e+00 1.36421e+00 8.48324e+01 177.062 -4.31877e+00 2.21674e-01  0.00000e+00 0.00000e+00 7.57336e+01 177.062 9.09876e+00 357.062 0.8749 
1 1 1 -14 33  9  o 13 5.72586e+00 1.40339e+00 1.44403e+02 14.472  8.73972e+00  2.25565e+00  0.00000e+00 0.00000e+00 5.96843e+01 14.472  8.47192e+01 194.472 0.9429 
1 1 1 -14 33  10 o 14 3.86334e+00 1.24806e+00 1.10424e+02 210.349 -4.79885e+00 -2.80974e+00 0.00000e+00 0.00000e+00 2.15896e+01 210.349 8.88342e+01 30.349  0.9049 
1 1 1 -14 33  11 o 17 4.46396e+00 1.33681e+00 3.65318e+01 197.794 -2.06510e+00 -6.62782e-01 0.00000e+00 0.00000e+00 8.52976e+01 197.794 4.87659e+01 197.794 0.7236 
1 1 1 -14 33  12 o 9  4.89169e+00 1.44090e+00 1.23110e+02 148.353 -6.28554e+00 3.87394e+00  0.00000e+00 0.00000e+00 4.81692e+01 148.353 7.49403e+01 328.353 0.9296 
1 1 1 -14 33  13 o 15 6.46925e+00 1.44162e+00 1.09517e+02 70.187  3.29891e+00  9.15665e+00  0.00000e+00 0.00000e+00 1.20972e+02 70.187  1.14542e+01 70.187  0.9471 
1 1 1 -14 34  1  f 0  8.38314e+00 1.42921e+00 1.46505e+02 98.559  -1.50895e+00 1.00266e+01  0.00000e+00 0.00000e+00 1.56419e+02 98.559  9.91447e+00 98.559  0.9493 
1 1 1 -14 34  2  o 17 1.87690e+01 1.16182e+00 2.92625e+02 202.336 -4.70124e+01 -1.93158e+01 0.00000e+00 0.00000e+00 4.14266e+02 202.336 1.21641e+02 202.336 0.9901 
1 1 1 -14 34  3  o 19 9.46597e+00 1.31507e+00 1.69100e+02 75.483  3.37952e+00  1.30514e+01  0.00000e+00 0.00000e+00 1.77102e+02 75.483  8.00195e+00 75.483  0.9622 
1 1 1 -14 34  4  o 11 6.94733e+00 1.36814e+00 9.10027e+01 181.163 -5.15999e+00 -1.04739e-01 0.00000e+00 0.00000e+00 1.45688e+02 181.163 5.46855e+01 181.163 0.8970 
1 1 1 -14 34  5  o 18 3.58514e+00 1.09202e+00 7.87158e+01 212.576 -2.53742e+00 -1.62128e+00 0.00000e+00 0.00000e+00 3.15993e+01 212.576 4.71165e+01 32.576  0.8108 
1 1 1 -14 34  6  o 7  9.86646e+00 1.24300e+00 1.65451e+02 348.042 1.56585e+01  -3.31638e+00 0.00000e+00 0.00000e+00 1.96763e+02 348.042 3.13111e+01 348.042 0.9682 
1 1 1 -14 34  7  o 13 5.72574e+00 1.29003e+00 8.90092e+01 180.296 -5.52011e+00 -2.84780e-02 0.00000e+00 0.00000e+00 1.07099e+02 180.296 1.80903e+01 180.296 0.9042 
1 1 1 -14 34  8  o 8  5.51670e+00 1.33979e+00 9.44596e+01 247.451 -2.12644e+00 -5.12137e+00 0.00000e+00 0.00000e+00 9.43936e+01 247.451 6.59993e-02 67.451  0.9047 
1 1 1 -14 34  9  o 15 1.16512e+01 1.18247e+00 2.20351e+02 303.472 1.75970e+01  -2.66142e+01 0.00000e+00 0.00000e+00 2.13105e+02 303.472 7.24624e+00 123.472 0.9842 
1 1 1 -14 34  10 o 8  7.99202e+00 1.42702e+00 1.51111e+02 225.114 -9.92808e+00 -9.96780e+00 0.00000e+00 0.00000e+00 1.39709e+02 225.114 1.14017e+01 45.114  0.9638 
1 1 1 -14 34  11 o 15 7.35757e+00 1.50660e+00 1.79014e+02 170.490 -1.48144e+01 2.48184e+00  0.00000e+00 0.00000e+00 8.90457e+01 170.490 8.99687e+01 350.490 0.9661 
1 1 1 -14 34  12 o 12 1.23096e+01 1.33532e+00 1.96107e+02 95.492  -3.03408e+00 3.15587e+01  0.00000e+00 0.00000e+00 2.60142e+02 95.492  6.40357e+01 95.492  0.9841 
1 1 1 -14 34  13 o 15 3.42184e+00 1.15399e+00 6.50250e+01 284.437 9.05447e-01  -3.51716e+00 0.00000e+00 0.00000e+00 4.40803e+01 284.437 2.09447e+01 104.437 0.8477 
1 1 1 -14 35  1  o 8  2.26822e+01 1.15630e+00 4.11824e+02 258.768 -1.63871e+01 -8.25230e+01 0.00000e+00 0.00000e+00 4.46316e+02 258.768 3.44926e+01 258.768 0.9940 
1 1 1 -14 35  2  o 12 1.55354e+01 1.27349e+00 3.17787e+02 66.730  1.67316e+01  3.89058e+01  0.00000e+00 0.00000e+00 2.66086e+02 66.730  5.17013e+01 246.730 0.9881 
1 1 1 -14 35  3  o 7  1.44665e+01 1.14691e+00 2.86746e+02 357.927 3.91543e+01  -1.41725e+00 0.00000e+00 0.00000e+00 2.56031e+02 357.927 3.07143e+01 177.927 0.9872 
1 1 1 -14 35  4  o 8  5.67225e+00 1.47652e+00 9.00641e+01 194.435 -4.09115e+00 -1.05311e+00 0.00000e+00 0.00000e+00 9.77049e+01 194.435 7.64080e+00 194.435 0.8716 
1 1 1 -14 35  5  o 19 4.01136e+00 1.16983e+00 5.15348e+01 161.167 -2.08910e+00 7.12536e-01  0.00000e+00 0.00000e+00 5.94369e+01 161.167 7.90213e+00 161.167 0.7290 
1 1 1 -14 35  6  o 1  7.21861e+00 1.35070e+00 1.71199e+02 351.602 1.22150e+01  -1.80338e+00 0.00000e+00 0.00000e+00 9.11478e+01 351.602 8.00510e+01 171.602 0.9586 
1 1 1 -14 35  7  o 3  1.83098e+01 9.40586e-01 2.94869e+02 206.290 -6.23345e+01 -3.07942e+01 0.00000e+00 0.00000e+00 3.93627e+02 206.290 9.87579e+01 206.290 0.9928 
1 1 1 -14 35  8  o 8  6.58766e+00 1.41047e+00 9.79300e+01 337.575 6.03134e+00  -2.48906e+00 0.00000e+00 0.00000e+00 1.31340e+02 337.575 3.34104e+01 337.575 0.9198 
1 1 1 -14 35  9  o 6  3.79386e+00 1.20646e+00 8.73640e+01 218.710 -3.17264e+00 -2.54266e+00 0.00000e+00 0.00000e+00 3.68155e+01 218.710 5.05485e+01 38.710  0.8660 
1 1 1 -14 35  10 o 13 4.03911e+00 1.25622e+00 6.35832e+01 12.765  3.08998e+00  7.00070e-01  0.00000e+00 0.00000e+00 6.17157e+01 12.765  1.86750e+00 192.765 0.8217 
1 1 1 -14 35  11 o 16 7.98305e+00 1.54275e+00 1.28786e+02 137.001 -8.36854e+00 7.80343e+00  0.00000e+00 0.00000e+00 1.58763e+02 137.001 2.99769e+01 137.001 0.9553 
1 1 1 -14 35  12 o 7  5.00397e+00 1.42052e+00 7.19204e+01 51.271  2.83079e+00  3.52977e+00  0.00000e+00 0.00000e+00 9.41120e+01 51.271  2.21916e+01 51.271  0.8811 
1 1 1 -14 35  13 o 8  3.96630e+00 1.27827e+00 7.83155e+01 193.706 -4.48014e+00 -1.09268e+00 0.00000e+00 0.00000e+00 5.34799e+01 193.706 2.48355e+01 13.706  0.8835 
1 1 1 -14 36  1  o 7  1.18967e+01 1.47469e+00 2.09399e+02 331.512 1.79469e+01  -9.73943e+00 0.00000e+00 0.00000e+00 2.32118e+02 331.512 2.27181e+01 331.512 0.9752 
1 1 1 -14 36  2  o 11 5.82416e+00 1.51942e+00 1.18506e+02 42.881  4.05706e+00  3.76758e+00  0.00000e+00 0.00000e+00 8.18416e+01 42.881  3.66647e+01 222.881 0.9045 
1 1 1 -14 36  3  o 19 1.27482e+01 1.20403e+00 2.12207e+02 75.786  5.80764e+00  2.29276e+01  0.00000e+00 0.00000e+00 2.61921e+02 75.786  4.97145e+01 75.786  0.9786 
1 1 1 -14 36  4  o 2  6.63633e+00 1.36654e+00 1.27829e+02 134.200 -5.33424e+00 5.48525e+00  0.00000e+00 0.00000e+00 1.07085e+02 134.200 2.07432e+01 314.200 0.9322 
1 1 1 -14 36  5  o 15 4.73472e+00 1.28824e+00 6.13302e+01 294.741 1.22282e+00  -2.65361e+00 0.00000e+00 0.00000e+00 8.31131e+01 294.741 2.17829e+01 294.741 0.8040 
1 1 1 -14 36  6  o 4  7.38547e+00 1.29373e+00 1.00741e+02 185.506 -7.36735e+00 -7.10234e-01 0.00000e+00 0.00000e+00 1.59566e+02 185.506 5.88247e+01 185.506 0.9298 
1 1 1 -14 36  7  o 9  1.22768e+01 1.00800e+00 1.69710e+02 71.067  8.05211e+00  2.34743e+01  0.00000e+00 0.00000e+00 2.85773e+02 71.067  1.16064e+02 71.067  0.9796 
1 1 1 -14 36  8  o 4  8.20183e+00 1.24065e+00 1.43893e+02 294.138 5.91159e+00  -1.31922e+01 0.00000e+00 0.00000e+00 1.55478e+02 294.138 1.15851e+01 294.138 0.9648 
1 1 1 -14 36  9  o 14 4.53305e+00 1.30114e+00 4.20822e+01 87.283  1.08460e-01  2.28564e+00  0.00000e+00 0.00000e+00 8.46669e+01 87.283  4.25847e+01 87.283  0.7399 
1 1 1 -14 36  10 o 15 6.84671e+00 1.31970e+00 1.63530e+02 50.719  8.93511e+00  1.09240e+01  0.00000e+00 0.00000e+00 8.55962e+01 50.719  7.79335e+01 230.719 0.9639 
1 1 1 -14 36  11 o 7  5.70800e+00 1.43146e+00 1.20686e+02 103.854 -2.00236e+00 8.11939e+00  0.00000e+00 0.00000e+00 8.12163e+01 103.854 3.94701e+01 283.853 0.9382 
1 1 1 -14 36  12 o 15 6.00925e+00 1.46236e+00 1.17266e+02 52.357  5.31464e+00  6.89058e+00  0.00000e+00 0.00000e+00 9.55894e+01 52.357  2.16769e+01 232.357 0.9407 
1 1 1 -14 36  13 o 11 6.80704e+00 1.51627e+00 1.04903e+02 67.909  3.52182e+00  8.67698e+00  0.00000e+00 0.00000e+00 1.37002e+02 67.909  3.20992e+01 67.909  0.9450 
1 1 1 -14 37  1  o 8  5.82029e+00 1.53370e+00 6.10696e+01 122.924 -1.53849e+00 2.37599e+00  0.00000e+00 0.00000e+00 1.15367e+02 122.924 5.42975e+01 122.924 0.7966 
1 1 1 -14 37  2  o 19 2.07144e+01 1.14001e+00 4.45238e+02 315.791 5.93397e+01  -5.77240e+01 0.00000e+00 0.00000e+00 3.37710e+02 315.791 1.07528e+02 135.791 0.9939 
1 1 1 -14 37  3  o 16 1.44344e+01 1.23040e+00 2.55252e+02 97.310  -4.33257e+00 3.37736e+01  0.00000e+00 0.00000e+00 2.85146e+02 97.310  2.98938e+01 97.310  0.9852 
1 1 1 -14 37  4  o 2  1.39993e+01 1.09044e+00 1.72464e+02 263.835 -2.76964e+00 -2.56429e+01 0.00000e+00 0.00000e+00 3.48690e+02 263.835 1.76226e+02 263.835 0.9804 
1 1 1 -14 37  5  o 12 5.73320e+00 1.33785e+00 1.25749e+02 70.489  2.36144e+00  6.66459e+00  0.00000e+00 0.00000e+00 7.57342e+01 70.489  5.00150e+01 250.489 0.9263 
1 1 1 -14 37  6  o 4  3.85756e+00 1.13606e+00 9.72645e+01 48.276  2.82955e+00  3.17317e+00  0.00000e+00 0.00000e+00 3.03186e+01 48.276  6.69458e+01 228.276 0.8725 
1 1 1 -14 37  7  o 17 1.28556e+01 1.02927e+00 2.77262e+02 47.603  2.92246e+01  3.20083e+01  0.00000e+00 0.00000e+00 2.03910e+02 47.603  7.33517e+01 227.603 0.9884 
1 1 1 -14 37  8  o 18 3.63189e+00 1.12875e+00 6.92577e+01 72.707  9.55768e-01  3.06995e+00  0.00000e+00 0.00000e+00 4.40536e+01 72.707  2.52040e+01 252.707 0.8247 
1 1 1 -14 37  9  o 1  6.37219e+00 1.44847e+00 1.04940e+02 267.960 -2.49144e-01 -6.99315e+00 0.00000e+00 0.00000e+00 1.17918e+02 267.960 1.29783e+01 267.960 0.9255 
1 1 1 -14 37  10 o 18 4.89933e+00 1.37195e+00 1.82588e+02 10.052  1.07124e+01  1.89891e+00  0.00000e+00 0.00000e+00 6.37589e+00 190.052 1.88964e+02 190.052 0.9529 
1 1 1 -14 37  11 o 8  9.19427e+00 1.40238e+00 2.08514e+02 169.545 -2.21418e+01 4.08556e+00  0.00000e+00 0.00000e+00 1.30323e+02 169.545 7.81908e+01 349.545 0.9775 
1 1 1 -14 37  12 o 17 6.96933e+00 1.51904e+00 1.13820e+02 343.051 9.10185e+00  -2.77392e+00 0.00000e+00 0.00000e+00 1.34393e+02 343.051 2.05738e+01 343.051 0.9459 
1 1 1 -14 37  13 f 0  6.03749e+00 1.46886e+00 1.01133e+02 180.620 -8.24483e+00 -8.92650e-02 0.00000e+00 0.00000e+00 1.11642e+02 180.620 1.05084e+01 180.620 0.9372 
1 1 1 -14 38  1  o 13 8.38125e+00 1.59874e+00 9.99201e+01 14.489  5.98772e+00  1.54734e+00  0.00000e+00 0.00000e+00 1.91911e+02 14.489  9.19913e+01 14.489  0.9151 
1 1 1 -14 38  2  o 6  1.50592e+01 1.23085e+00 2.51234e+02 3.581   3.49184e+01  2.18516e+00  0.00000e+00 0.00000e+00 3.13130e+02 3.581   6.18963e+01 3.581   0.9856 
1 1 1 -14 38  3  o 4  3.73164e+00 1.19047e+00 6.49258e+01 335.895 2.16257e+00  -9.67593e-01 0.00000e+00 0.00000e+00 4.14137e+01 335.895 2.35121e+01 155.895 0.7500 
1 1 1 -14 38  4  o 19 5.35834e+00 1.38306e+00 1.05746e+02 316.145 3.93037e+00  -3.77628e+00 0.00000e+00 0.00000e+00 7.79354e+01 316.145 2.78106e+01 136.145 0.9029 
1 1 1 -14 38  5  o 9  7.94251e+00 1.33286e+00 8.60472e+01 172.587 -6.37203e+00 8.29106e-01  0.00000e+00 0.00000e+00 1.90698e+02 172.587 1.04651e+02 172.587 0.9185 
1 1 1 -14 38  6  o 17 7.84665e+00 1.31216e+00 1.17988e+02 30.989  8.26406e+00  4.96334e+00  0.00000e+00 0.00000e+00 1.63532e+02 30.989  4.55436e+01 30.989  0.9466 
1 1 1 -14 38  7  o 2  5.16496e+00 1.33957e+00 9.05891e+01 111.286 -1.84234e+00 4.72865e+00  0.00000e+00 0.00000e+00 8.44625e+01 111.286 6.12657e+00 291.286 0.8951 
1 1 1 -14 38  8  o 13 4.18123e+00 1.25204e+00 7.21741e+01 196.369 -3.47186e+00 -1.01978e+00 0.00000e+00 0.00000e+00 6.17959e+01 196.369 1.03782e+01 16.369  0.8471 
1 1 1 -14 38  9  f 0  6.74077e+00 1.46669e+00 1.99108e+02 229.988 -8.92512e+00 -1.06319e+01 0.00000e+00 0.00000e+00 4.62379e+01 229.988 1.52870e+02 49.988  0.9633 
1 1 1 -14 38  10 o 2  6.05204e+00 1.41316e+00 1.45968e+02 37.031  8.48475e+00  6.40092e+00  0.00000e+00 0.00000e+00 7.14192e+01 37.031  7.45486e+01 217.031 0.9517 
1 1 1 -14 38  11 o 8  3.87613e+00 1.21359e+00 1.22109e+02 167.763 -6.55658e+00 1.42206e+00  0.00000e+00 0.00000e+00 1.26283e+01 167.763 1.09481e+02 347.763 0.9221 
1 1 1 -14 38  12 o 19 3.79750e+00 1.22577e+00 7.71568e+01 309.286 2.75395e+00  -3.36638e+00 0.00000e+00 0.00000e+00 4.80458e+01 309.286 2.91110e+01 129.286 0.8757 
1 1 1 -14 38  13 o 11 3.66416e+00 1.21331e+00 6.58142e+01 80.672  6.41896e-01  3.90767e+00  0.00000e+00 0.00000e+00 5.29362e+01 80.672  1.28780e+01 260.672 0.8620 
1 1 1 -14 39  1  o 14 7.72364e+00 1.57749e+00 1.01349e+02 33.490  5.15091e+00  3.40803e+00  0.00000e+00 0.00000e+00 1.67522e+02 33.490  6.61725e+01 33.490  0.9150 
1 1 1 -14 39  2  o 13 9.66628e+00 1.44867e+00 9.90509e+01 278.418 1.21740e+00  -8.22622e+00 0.00000e+00 0.00000e+00 2.45596e+02 278.418 1.46545e+02 278.418 0.9378 
1 1 1 -14 39  3  o 5  7.02359e+00 1.34361e+00 1.68864e+02 261.372 -1.69007e+00 -1.11388e+01 0.00000e+00 0.00000e+00 8.58464e+01 261.372 8.30178e+01 81.372  0.9545 
1 1 1 -14 39  4  o 5  8.92066e+00 1.34165e+00 1.44930e+02 72.495  3.81141e+00  1.20843e+01  0.00000e+00 0.00000e+00 1.80074e+02 72.495  3.51440e+01 72.495  0.9597 
1 1 1 -14 39  5  o 7  9.94508e+00 1.28322e+00 1.26189e+02 10.930  1.27402e+01  2.46040e+00  0.00000e+00 0.00000e+00 2.36197e+02 10.930  1.10008e+02 10.930  0.9607 
1 1 1 -14 39  6  o 3  3.56315e+00 1.11602e+00 5.59992e+01 1.227   2.36375e+00  5.06317e-02  0.00000e+00 0.00000e+00 4.51932e+01 1.227   1.08060e+01 181.227 0.7494 
1 1 1 -14 39  7  o 10 3.30091e+00 1.06229e+00 5.62228e+01 17.317  2.17999e+00  6.79696e-01  0.00000e+00 0.00000e+00 3.61639e+01 17.317  2.00589e+01 197.317 0.7392 
1 1 1 -14 39  8  o 8  1.05387e+01 1.23955e+00 1.88768e+02 234.295 -1.39298e+01 -1.93820e+01 0.00000e+00 0.00000e+00 2.01382e+02 234.295 1.26136e+01 234.295 0.9788 
1 1 1 -14 39  9  o 5  9.29147e+00 1.27003e+00 2.07273e+02 292.051 9.14965e+00  -2.25885e+01 0.00000e+00 0.00000e+00 1.36487e+02 292.051 7.07860e+01 112.051 0.9793 
1 1 1 -14 39  10 o 8  4.33120e+00 1.30053e+00 1.08488e+02 197.277 -5.55865e+00 -1.72885e+00 0.00000e+00 0.00000e+00 4.01668e+01 197.277 6.83214e+01 17.277  0.9095 
1 1 1 -14 39  11 o 18 6.71287e+00 1.27944e+00 1.34576e+02 352.431 1.20196e+01  -1.59703e+00 0.00000e+00 0.00000e+00 1.07777e+02 352.431 2.67992e+01 172.431 0.9578 
1 1 1 -14 39  12 f 0  4.58040e+00 1.30430e+00 9.27061e+01 203.621 -5.65901e+00 -2.47479e+00 0.00000e+00 0.00000e+00 6.50669e+01 203.621 2.76391e+01 23.621  0.9150 
1 1 1 -14 40  1  o 8  9.48703e+00 1.39075e+00 8.72248e+01 54.982  4.23575e+00  6.04529e+00  0.00000e+00 0.00000e+00 2.48246e+02 54.982  1.61021e+02 54.982  0.9296 
1 1 1 -14 40  2  f 0  8.49081e+00 1.59862e+00 1.67273e+02 242.685 -5.45474e+00 -1.05617e+01 0.00000e+00 0.00000e+00 1.41619e+02 242.685 2.56542e+01 62.685  0.9570 
1 1 1 -14 40  3  o 10 3.65292e+00 1.17886e+00 5.42524e+01 276.557 2.40765e-01  -2.09461e+00 0.00000e+00 0.00000e+00 4.49386e+01 276.557 9.31381e+00 96.557  0.7148 
1 1 1 -14 40  4  f 0  5.32664e+00 1.39168e+00 6.85794e+01 51.970  2.06010e+00  2.63400e+00  0.00000e+00 0.00000e+00 9.97494e+01 51.970  3.11699e+01 51.970  0.8325 
1 1 1 -14 40  5  o 11 7.50122e+00 1.35441e+00 1.23122e+02 259.798 -1.57923e+00 -8.77495e+00 0.00000e+00 0.00000e+00 1.44912e+02 259.798 2.17900e+01 259.798 0.9421 
1 1 1 -14 40  6  o 9  5.92297e+00 1.28267e+00 3.16278e+01 317.501 1.44234e+00  -1.32162e+00 0.00000e+00 0.00000e+00 1.23338e+02 317.501 9.17103e+01 317.501 0.6905 
1 1 1 -14 40  7  o 2  3.61891e+00 1.13463e+00 8.03555e+01 334.640 3.07279e+00  -1.45640e+00 0.00000e+00 0.00000e+00 3.41386e+01 334.640 4.62168e+01 154.641 0.8357 
1 1 1 -14 40  8  o 16 4.37051e+00 1.26499e+00 1.35427e+02 212.452 -5.93031e+00 -3.77106e+00 0.00000e+00 0.00000e+00 1.75982e+01 212.452 1.17829e+02 32.452  0.9258 
1 1 1 -14 40  9  o 15 9.53280e+00 1.27033e+00 1.46772e+02 63.437  7.44961e+00  1.49003e+01  0.00000e+00 0.00000e+00 2.02364e+02 63.437  5.55922e+01 63.437  0.9695 
1 1 1 -14 40  10 o 1  7.39955e+00 1.33159e+00 9.56952e+01 265.592 -7.03167e-01 -9.12201e+00 0.00000e+00 0.00000e+00 1.67784e+02 265.592 7.20886e+01 265.592 0.9437 
1 1 1 -14 40  11 o 5  4.03265e+00 1.25404e+00 1.17085e+02 96.266  -7.33090e-01 6.67649e+00  0.00000e+00 0.00000e+00 2.30769e+01 96.266  9.40082e+01 276.266 0.9222 
1 1 1 -14 40  12 o 4  1.19553e+01 1.31994e+00 2.04669e+02 14.220  3.39157e+01  8.59487e+00  0.00000e+00 0.00000e+00 2.38854e+02 14.220  3.41847e+01 14.220  0.9856 
1 1 1 -14 41  1  f 0  7.62232e+00 1.30427e+00 7.30212e+01 172.866 -5.34635e+00 6.69160e-01  0.00000e+00 0.00000e+00 1.88394e+02 172.866 1.15373e+02 172.866 0.9017 
1 1 1 -14 41  2  o 15 8.49988e+00 1.60192e+00 2.08570e+02 294.383 6.10788e+00  -1.34755e+01 0.00000e+00 0.00000e+00 1.03404e+02 294.383 1.05166e+02 114.383 0.9656 
1 1 1 -14 41  3  o 19 7.50694e+00 1.55386e+00 9.16537e+01 90.862  -9.10633e-02 6.05158e+00  0.00000e+00 0.00000e+00 1.68730e+02 90.862  7.70759e+01 90.862  0.9132 
1 1 1 -14 41  4  o 17 1.11867e+01 1.26360e+00 2.38743e+02 275.824 2.83377e+00  -2.77843e+01 0.00000e+00 0.00000e+00 1.78171e+02 275.824 6.05730e+01 95.824  0.9819 
1 1 1 -14 41  5  o 7  7.66296e+00 1.28257e+00 1.63962e+02 5.215   1.31710e+01  1.20223e+00  0.00000e+00 0.00000e+00 1.15427e+02 5.215   4.85351e+01 185.215 0.9614 
1 1 1 -14 41  6  o 11 8.50854e+00 1.20540e+00 1.08003e+02 192.287 -1.00211e+01 -2.18261e+00 0.00000e+00 0.00000e+00 1.98229e+02 192.287 9.02254e+01 192.287 0.9499 
1 1 1 -14 41  7  o 15 1.08997e+01 1.09318e+00 2.28238e+02 168.717 -3.24901e+01 6.48204e+00  0.00000e+00 0.00000e+00 1.78064e+02 168.717 5.01738e+01 348.717 0.9848 
1 1 1 -14 41  8  f 0  4.17537e+00 1.25540e+00 3.81721e+01 70.575  6.32963e-01  1.79490e+00  0.00000e+00 0.00000e+00 6.93835e+01 70.575  3.12114e+01 70.575  0.6812 
1 1 1 -14 41  9  o 5  4.08284e+00 1.22328e+00 6.62996e+01 146.495 -2.98484e+00 1.97602e+00  0.00000e+00 0.00000e+00 6.40399e+01 146.495 2.25969e+00 326.495 0.8452 
1 1 1 -14 41  10 o 7  4.06089e+00 1.23596e+00 7.16381e+01 44.087  2.97329e+00  2.87999e+00  0.00000e+00 0.00000e+00 6.14559e+01 44.087  1.01822e+01 224.087 0.8687 
1 1 1 -14 41  11 o 4  6.57678e+00 1.42429e+00 1.46291e+02 213.404 -9.56878e+00 -6.31034e+00 0.00000e+00 0.00000e+00 9.04759e+01 213.404 5.58155e+01 33.404  0.9553 
1 1 1 -14 41  12 o 18 3.68319e+00 1.20687e+00 2.30263e+01 271.411 3.29121e-02  -1.33592e+00 0.00000e+00 0.00000e+00 5.36301e+01 271.411 3.06038e+01 271.411 0.5530 
1 1 1 -14 42  1  o 8  4.84957e+00 1.22756e+00 4.96555e+01 294.805 1.04975e+00  -2.27137e+00 0.00000e+00 0.00000e+00 9.14840e+01 294.805 4.18284e+01 294.805 0.7652 
1 1 1 -14 42  2  o 13 7.40294e+00 1.49397e+00 1.72128e+02 35.429  9.43009e+00  6.70888e+00  0.00000e+00 0.00000e+00 9.67908e+01 35.429  7.53369e+01 215.429 0.9558 
1 1 1 -14 42  3  o 2  1.39778e+01 1.23351e+00 2.85435e+02 70.820  1.29341e+01  3.71833e+01  0.00000e+00 0.00000e+00 2.38651e+02 70.820  4.67832e+01 250.820 0.9872 
1 1 1 -14 42  4  o 8  5.45410e+00 1.45164e+00 1.14862e+02 316.619 4.31681e+00  -4.07954e+00 0.00000e+00 0.00000e+00 7.37850e+01 316.619 4.10772e+01 136.619 0.9114 
1 1 1 -14 42  5  o 16 3.89978e+00 1.17228e+00 3.30349e+01 46.090  9.98525e-01  1.03726e+00  0.00000e+00 0.00000e+00 5.28631e+01 46.090  1.98282e+01 46.090  0.5809 
1 1 1 -14 42  6  o 14 5.83068e+00 1.24625e+00 1.48462e+02 198.881 -9.35274e+00 -3.19871e+00 0.00000e+00 0.00000e+00 6.09383e+01 198.881 8.75238e+01 18.881  0.9480 
1 1 1 -14 42  7  o 9  7.97645e+00 1.30978e+00 1.16482e+02 358.412 1.07312e+01  -2.97558e-01 0.00000e+00 0.00000e+00 1.70985e+02 358.412 5.45035e+01 358.412 0.9522 
1 1 1 -14 42  8  o 12 1.02862e+01 1.27019e+00 2.18871e+02 93.572  -1.71405e+00 2.74554e+01  0.00000e+00 0.00000e+00 1.62905e+02 93.572  5.59652e+01 273.572 0.9817 
1 1 1 -14 42  9  o 17 7.61866e+00 1.40489e+00 1.60813e+02 225.957 -9.62225e+00 -9.94917e+00 0.00000e+00 0.00000e+00 1.16333e+02 225.957 4.44801e+01 45.957  0.9632 
1 1 1 -14 42  10 o 13 3.59843e+00 1.16474e+00 5.14522e+01 291.801 9.75841e-01  -2.43966e+00 0.00000e+00 0.00000e+00 5.41877e+01 291.801 2.73547e+00 291.801 0.7782 
1 1 1 -14 42  11 f 0  5.24742e+00 1.42388e+00 1.12766e+02 64.732  3.13170e+00  6.63484e+00  0.00000e+00 0.00000e+00 7.09382e+01 64.732  4.18280e+01 244.732 0.9291 
1 1 1 -14 42  12 o 3  3.78765e+00 1.23240e+00 7.80288e+01 314.089 3.30587e+00  -3.41275e+00 0.00000e+00 0.00000e+00 4.84408e+01 314.089 2.95880e+01 134.089 0.8873 
1 1 1 -14 43  1  o 2  6.84625e+00 1.28733e+00 7.52319e+01 181.638 -5.18412e+00 -1.48282e-01 0.00000e+00 0.00000e+00 1.58436e+02 181.638 8.32046e+01 181.638 0.8975 
1 1 1 -14 43  2  o 8  6.76389e+00 1.60051e+00 1.32400e+02 144.638 -6.26517e+00 4.44613e+00  0.00000e+00 0.00000e+00 1.07280e+02 144.638 2.51209e+01 324.638 0.9324 
1 1 1 -14 43  3  o 3  4.10451e+00 1.28774e+00 8.59203e+01 112.939 -1.42004e+00 3.35534e+00  0.00000e+00 0.00000e+00 4.62980e+01 112.939 3.96223e+01 292.939 0.8483 
1 1 1 -14 43  4  o 4  5.77619e+00 1.25134e+00 6.63687e+01 321.063 3.19362e+00  -2.58031e+00 0.00000e+00 0.00000e+00 1.23765e+02 321.063 5.73962e+01 321.063 0.8675 
1 1 1 -14 43  5  o 11 9.12840e+00 1.30167e+00 1.51699e+02 263.411 -1.70965e+00 -1.48013e+01 0.00000e+00 0.00000e+00 1.82571e+02 263.411 3.08728e+01 263.411 0.9658 
1 1 1 -14 43  6  o 1  5.55460e+00 1.35021e+00 4.94899e+01 217.680 -2.30525e+00 -1.78039e+00 0.00000e+00 0.00000e+00 1.19535e+02 217.680 7.00446e+01 217.680 0.8033 
1 1 1 -14 43  7  o 9  1.23991e+01 1.07283e+00 2.37974e+02 70.772  1.28728e+01  3.69074e+01  0.00000e+00 0.00000e+00 2.25210e+02 70.772  1.27648e+01 250.772 0.9871 
1 1 1 -14 43  8  o 18 4.99355e+00 1.34289e+00 1.30835e+02 356.604 7.24753e+00  -4.30122e-01 0.00000e+00 0.00000e+00 4.44153e+01 356.604 8.64194e+01 176.604 0.9283 
1 1 1 -14 43  9  o 4  7.39661e+00 1.32790e+00 1.96901e+02 180.905 -1.82588e+01 -2.88363e-01 0.00000e+00 0.00000e+00 7.46644e+01 180.905 1.22236e+02 0.905   0.9722 
1 1 1 -14 43  10 o 5  6.46447e+00 1.33401e+00 1.04165e+02 33.804  7.24585e+00  4.85133e+00  0.00000e+00 0.00000e+00 1.25238e+02 33.804  2.10731e+01 33.804  0.9408 
1 1 1 -14 43  11 o 11 4.09434e+00 1.23543e+00 8.94213e+01 119.621 -2.57732e+00 4.53300e+00  0.00000e+00 0.00000e+00 4.91195e+01 119.621 4.03018e+01 299.621 0.8981 
1 1 1 -14 43  12 o 13 4.79422e+00 1.38882e+00 7.43088e+01 310.018 3.16208e+00  -3.76605e+00 0.00000e+00 0.00000e+00 8.65009e+01 310.018 1.21921e+01 310.018 0.8914 
1 1 1 -14 44  1  o 10 1.45273e+01 9.98032e-01 2.08077e+02 164.333 -3.18488e+01 8.93238e+00  0.00000e+00 0.00000e+00 3.35879e+02 164.333 1.27802e+02 164.333 0.9848 
1 1 1 -14 44  2  o 16 9.73755e+00 1.52483e+00 1.87514e+02 236.496 -8.63402e+00 -1.30425e+01 0.00000e+00 0.00000e+00 1.70463e+02 236.496 1.70508e+01 56.496  0.9675 
1 1 1 -14 44  3  o 14 6.75205e+00 1.54310e+00 9.92114e+01 326.200 4.89032e+00  -3.27382e+00 0.00000e+00 0.00000e+00 1.34232e+02 326.200 3.50206e+01 326.200 0.9105 
1 1 1 -14 44  4  o 19 1.38851e+01 1.09423e+00 2.35750e+02 4.031   3.79547e+01  2.67490e+00  0.00000e+00 0.00000e+00 2.84099e+02 4.031   4.83491e+01 4.031   0.9868 
1 1 1 -14 44  5  o 11 1.62620e+01 1.11426e+00 2.90867e+02 247.830 -2.02404e+01 -4.96710e+01 0.00000e+00 0.00000e+00 3.19843e+02 247.830 2.89765e+01 247.830 0.9906 
1 1 1 -14 44  6  o 3  3.06806e+00 1.01505e+00 3.52765e+01 104.708 -3.40897e-01 1.29865e+00  0.00000e+00 0.00000e+00 2.91890e+01 104.708 6.08754e+00 284.708 0.5548 
1 1 1 -14 44  7  o 3  7.79151e+00 1.36516e+00 1.13093e+02 140.137 -7.55486e+00 6.30864e+00  0.00000e+00 0.00000e+00 1.66325e+02 140.137 5.32323e+01 140.137 0.9478 
1 1 1 -14 44  8  f 0  4.39655e+00 1.21779e+00 6.59139e+01 218.734 -2.95582e+00 -2.37096e+00 0.00000e+00 0.00000e+00 7.61625e+01 218.734 1.02486e+01 218.734 0.8549 
1 1 1 -14 44  9  o 7  4.42026e+00 1.16964e+00 5.71221e+01 192.189 -3.40176e+00 -7.34814e-01 0.00000e+00 0.00000e+00 8.30896e+01 192.189 2.59675e+01 192.189 0.8401 
1 1 1 -14 44  10 o 1  3.69273e+00 1.15039e+00 2.80208e+01 24.107  1.29484e+00  5.79393e-01  0.00000e+00 0.00000e+00 5.21108e+01 24.107  2.40900e+01 24.107  0.5753 
1 1 1 -14 44  11 o 19 4.71621e+00 1.30716e+00 5.45462e+01 286.782 1.01972e+00  -3.38134e+00 0.00000e+00 0.00000e+00 9.51783e+01 286.782 4.06322e+01 286.782 0.8427 
1 1 1 -14 44  12 o 3  6.78497e+00 1.41884e+00 4.74505e+01 22.722  3.98815e+00  1.67006e+00  0.00000e+00 0.00000e+00 1.75888e+02 22.722  1.28438e+02 22.722  0.8749 
1 1 1 -14 45  1  o 13 1.17167e+01 1.10120e+00 2.08926e+02 182.868 -2.76673e+01 -1.38593e+00 0.00000e+00 0.00000e+00 2.28409e+02 182.868 1.94824e+01 182.868 0.9818 
1 1 1 -14 45  2  o 13 4.09776e+00 1.25127e+00 6.64909e+01 184.548 -2.76282e+00 -2.19754e-01 0.00000e+00 0.00000e+00 5.67465e+01 184.548 9.74437e+00 4.548   0.7916 
1 1 1 -14 45  3  o 6  4.11617e+00 1.27673e+00 1.12415e+02 234.206 -2.86079e+00 -3.96748e+00 0.00000e+00 0.00000e+00 2.67951e+01 234.206 8.56200e+01 54.206  0.8908 
1 1 1 -14 45  4  o 4  5.75960e+00 1.32924e+00 7.56835e+01 87.536  1.98837e-01  4.62144e+00  0.00000e+00 0.00000e+00 1.17451e+02 87.536  4.17676e+01 87.536  0.8839 
1 1 1 -14 45  5  f 0  9.78315e+00 1.22363e+00 1.74700e+02 253.741 -5.28577e+00 -1.81246e+01 0.00000e+00 0.00000e+00 1.86170e+02 253.741 1.14706e+01 253.741 0.9731 
1 1 1 -14 45  6  o 8  9.91472e+00 1.25751e+00 1.54162e+02 115.068 -7.86082e+00 1.68058e+01  0.00000e+00 0.00000e+00 2.11053e+02 115.068 5.68908e+01 115.068 0.9727 
1 1 1 -14 45  7  o 4  7.76066e+00 1.32286e+00 1.14500e+02 334.865 9.24030e+00  -4.33533e+00 0.00000e+00 0.00000e+00 1.64342e+02 334.865 4.98414e+01 334.865 0.9497 
1 1 1 -14 45  8  o 14 6.10865e+00 1.18532e+00 6.65224e+01 340.822 4.80124e+00  -1.66990e+00 0.00000e+00 0.00000e+00 1.40180e+02 340.822 7.36578e+01 340.822 0.8953 
1 1 1 -14 45  9  o 12 5.55324e+00 1.38070e+00 9.01534e+01 110.183 -2.12078e+00 5.76927e+00  0.00000e+00 0.00000e+00 1.01598e+02 110.183 1.14449e+01 110.183 0.9146 
1 1 1 -14 45  10 o 8  3.18007e+00 1.07727e+00 5.84749e+01 273.864 1.93906e-01  -2.87110e+00 0.00000e+00 0.00000e+00 3.75272e+01 273.864 2.09477e+01 93.864  0.8005 
1 1 1 -14 45  11 o 18 4.32290e+00 1.29294e+00 6.58877e+01 243.403 -1.78659e+00 -3.56820e+00 0.00000e+00 0.00000e+00 7.46569e+01 243.403 8.76921e+00 243.403 0.8632 
1 1 1 -14 45  12 o 4  3.56343e+00 1.14508e+00 3.11586e+01 134.701 -1.35417e+00 1.36839e+00  0.00000e+00 0.00000e+00 6.06787e+01 134.701 2.95201e+01 134.701 0.6851 
1 1 1 -14 46  1  f 0  8.47140e+00 1.27183e+00 2.39303e+02 96.812  -2.41950e+00 2.02532e+01  0.00000e+00 0.00000e+00 7.47292e+01 96.812  1.64574e+02 276.812 0.9752 
1 1 1 -14 46  2  o 13 4.77596e+00 1.39221e+00 9.56992e+01 210.197 -3.93369e+00 -2.28918e+00 0.00000e+00 0.00000e+00 6.42914e+01 210.197 3.14078e+01 30.197  0.8818 
1 1 1 -14 46  3  o 7  4.77569e+00 1.34183e+00 6.49519e+01 25.445  2.87333e+00  1.36710e+00  0.00000e+00 0.00000e+00 8.41766e+01 25.445  1.92246e+01 25.445  0.8226 
1 1 1 -14 46  4  o 12 4.10240e+00 1.23365e+00 1.03917e+02 291.875 1.70071e+00  -4.23600e+00 0.00000e+00 0.00000e+00 3.33636e+01 291.875 7.05536e+01 111.875 0.8822 
1 1 1 -14 46  5  o 9  1.06988e+01 1.13452e+00 1.72005e+02 158.448 -2.07204e+01 8.18383e+00  0.00000e+00 0.00000e+00 2.24273e+02 158.448 5.22679e+01 158.448 0.9773 
1 1 1 -14 46  6  o 13 6.12311e+00 1.39224e+00 9.48151e+01 259.734 -1.14006e+00 -6.29450e+00 0.00000e+00 0.00000e+00 1.18057e+02 259.734 2.32418e+01 259.734 0.9181 
1 1 1 -14 46  7  o 7  6.14587e+00 1.34568e+00 1.27596e+02 29.522  7.73540e+00  4.38032e+00  0.00000e+00 0.00000e+00 9.14040e+01 29.522  3.61920e+01 209.521 0.9420 
1 1 1 -14 46  8  o 14 6.41646e+00 1.36082e+00 1.06765e+02 142.980 -6.64848e+00 5.01358e+00  0.00000e+00 0.00000e+00 1.20656e+02 142.980 1.38914e+01 142.980 0.9379 
1 1 1 -14 46  9  o 3  1.33493e+01 1.02196e+00 2.23466e+02 262.554 -5.63625e+00 -4.31258e+01 0.00000e+00 0.00000e+00 2.74641e+02 262.554 5.11752e+01 262.554 0.9884 
1 1 1 -14 46  10 o 6  9.50986e+00 1.30124e+00 1.67308e+02 52.232  1.28987e+01  1.66480e+01  0.00000e+00 0.00000e+00 1.82659e+02 52.232  1.53513e+01 52.232  0.9760 
1 1 1 -14 46  11 o 11 6.97009e+00 1.43802e+00 1.73762e+02 75.395  3.91462e+00  1.50228e+01  0.00000e+00 0.00000e+00 8.01404e+01 75.395  9.36216e+01 255.395 0.9672 
1 1 1 -14 46  12 o 17 4.09183e+00 1.28791e+00 8.42722e+01 220.168 -4.07330e+00 -3.43833e+00 0.00000e+00 0.00000e+00 5.43260e+01 220.168 2.99462e+01 40.168  0.9005 
1 1 1 -14 47  1  o 19 1.58388e+01 9.40003e-01 2.56972e+02 21.544  4.70397e+01  1.85716e+01  0.00000e+00 0.00000e+00 3.39058e+02 21.544  8.20860e+01 21.544  0.9901 
1 1 1 -14 47  2  o 8  1.17437e+01 1.02331e+00 1.52861e+02 61.973  1.01442e+01  1.90565e+01  0.00000e+00 0.00000e+00 2.82752e+02 61.973  1.29891e+02 61.973  0.9766 
1 1 1 -14 47  3  o 8  6.65053e+00 1.40180e+00 8.41851e+01 13.118  5.56323e+00  1.29641e+00  0.00000e+00 0.00000e+00 1.44933e+02 13.118  6.07474e+01 13.118  0.9076 
1 1 1 -14 47  4  o 11 3.59146e+00 1.16421e+00 7.98406e+01 312.484 2.20712e+00  -2.41002e+00 0.00000e+00 0.00000e+00 3.29439e+01 312.484 4.68967e+01 132.484 0.8280 
1 1 1 -14 47  5  o 11 1.32781e+01 1.06401e+00 2.22368e+02 40.980  2.73925e+01  2.37948e+01  0.00000e+00 0.00000e+00 2.73827e+02 40.980  5.14590e+01 40.980  0.9861 
1 1 1 -14 47  6  o 8  7.08052e+00 1.34811e+00 1.38912e+02 277.268 1.41241e+00  -1.10741e+01 0.00000e+00 0.00000e+00 1.16861e+02 277.268 2.20504e+01 97.268  0.9541 
1 1 1 -14 47  7  o 11 4.42449e+00 1.25616e+00 6.51976e+01 278.082 4.99456e-01  -3.51711e+00 0.00000e+00 0.00000e+00 7.60157e+01 278.082 1.08181e+01 278.082 0.8438 
1 1 1 -14 47  8  o 15 7.77600e+00 1.29428e+00 1.59150e+02 19.693  1.40683e+01  5.03532e+00  0.00000e+00 0.00000e+00 1.24666e+02 19.693  3.44833e+01 199.693 0.9659 
1 1 1 -14 47  9  o 12 4.99073e+00 1.30624e+00 1.61920e+02 173.873 -1.05406e+01 1.13147e+00  0.00000e+00 0.00000e+00 1.73377e+01 173.873 1.44583e+02 353.873 0.9516 
1 1 1 -14 47  10 o 13 5.21036e+00 1.35198e+00 8.39417e+01 161.055 -5.50758e+00 1.89046e+00  0.00000e+00 0.00000e+00 9.47248e+01 161.055 1.07831e+01 161.055 0.9095 
1 1 1 -14 47  11 o 19 5.89710e+00 1.48374e+00 1.36947e+02 130.339 -6.68561e+00 7.87252e+00  0.00000e+00 0.00000e+00 7.40772e+01 130.339 6.28694e+01 310.339 0.9503 
1 1 1 -14 47  12 o 2  9.92747e+00 1.39511e+00 1.70231e+02 341.328 2.29195e+01  -7.74515e+00 0.00000e+00 0.00000e+00 1.95331e+02 341.328 2.50996e+01 341.328 0.9791 
1 1 1 -14 48  1  o 9  7.50818e+00 1.19522e+00 1.30373e+02 248.684 -3.93367e+00 -1.00808e+01 0.00000e+00 0.00000e+00 1.41444e+02 248.684 1.10707e+01 248.684 0.9526 
1 1 1 -14 48  2  o 11 6.92276e+00 1.29645e+00 1.82927e+02 165.042 -1.32125e+01 3.52984e+00  0.00000e+00 0.00000e+00 7.01891e+01 165.042 1.12737e+02 345.042 0.9627 
1 1 1 -14 48  3  o 1  6.12165e+00 1.44105e+00 7.89773e+01 161.023 -4.39802e+00 1.51236e+00  0.00000e+00 0.00000e+00 1.26539e+02 161.023 4.75617e+01 161.023 0.8846 
1 1 1 -14 48  4  o 3  5.19418e+00 1.41351e+00 8.24126e+01 142.131 -3.51938e+00 2.73675e+00  0.00000e+00 0.00000e+00 9.07457e+01 142.131 8.33306e+00 142.131 0.8791 
1 1 1 -14 48  5  o 8  1.04841e+01 1.18249e+00 1.79539e+02 52.301  1.45896e+01  1.88773e+01  0.00000e+00 0.00000e+00 2.09292e+02 52.301  2.97534e+01 52.301  0.9788 
1 1 1 -14 48  6  f 0  3.83064e+00 1.20087e+00 5.75217e+01 161.572 -2.56308e+00 8.54018e-01  0.00000e+00 0.00000e+00 5.63511e+01 161.572 1.17061e+00 341.572 0.7853 
1 1 1 -14 48  7  o 10 6.05322e+00 1.40983e+00 9.18191e+01 237.449 -3.19746e+00 -5.00914e+00 0.00000e+00 0.00000e+00 1.16843e+02 237.449 2.50237e+01 237.449 0.9115 
1 1 1 -14 48  8  o 1  6.95697e+00 1.26491e+00 1.25845e+02 282.825 2.53592e+00  -1.11393e+01 0.00000e+00 0.00000e+00 1.25216e+02 282.825 6.29394e-01 102.825 0.9552 
1 1 1 -14 48  9  o 3  4.40665e+00 1.28823e+00 8.95905e+01 155.703 -4.72400e+00 2.13268e+00  0.00000e+00 0.00000e+00 5.96649e+01 155.703 2.99256e+01 335.703 0.8975 
1 1 1 -14 48  10 o 1  9.03148e+00 1.32632e+00 2.29063e+02 3.323   2.61806e+01  1.52013e+00  0.00000e+00 0.00000e+00 1.04841e+02 3.323   1.24222e+02 183.323 0.9807 
1 1 1 -14 48  11 f 0  5.66536e+00 1.31590e+00 1.13159e+02 80.776  1.47278e+00  9.06867e+00  0.00000e+00 0.00000e+00 8.81842e+01 80.776  2.49750e+01 260.775 0.9439 
1 1 1 -14 48  12 o 17 4.44095e+00 1.26431e+00 3.24942e+01 213.941 -1.86035e+00 -1.25206e+00 0.00000e+00 0.00000e+00 9.00535e+01 213.941 5.75594e+01 213.941 0.7338 
1 1 1 -14 49  1  o 16 1.57204e+01 9.29294e-01 2.58795e+02 9.614   4.96368e+01  8.40824e+00  0.00000e+00 0.00000e+00 3.32596e+02 9.614   7.38016e+01 9.614   0.9900 
1 1 1 -14 49  2  o 9  6.01201e+00 1.28601e+00 1.22421e+02 285.464 2.04605e+00  -7.39583e+00 0.00000e+00 0.00000e+00 9.04359e+01 285.464 3.19851e+01 105.464 0.9324 
1 1 1 -14 49  3  o 8  6.48701e+00 1.46720e+00 8.17607e+01 26.185  4.62495e+00  2.27429e+00  0.00000e+00 0.00000e+00 1.39004e+02 26.185  5.72432e+01 26.185  0.8968 
1 1 1 -14 49  4  o 13 3.89996e+00 1.22682e+00 9.51601e+01 31.340  3.58648e+00  2.18407e+00  0.00000e+00 0.00000e+00 3.36044e+01 31.340  6.15557e+01 211.340 0.8708 
1 1 1 -14 49  5  o 12 5.69736e+00 1.39204e+00 1.07331e+02 247.107 -2.62172e+00 -6.20861e+00 0.00000e+00 0.00000e+00 9.17876e+01 247.107 1.55431e+01 67.107  0.9225 
1 1 1 -14 49  6  o 13 5.85125e+00 1.40677e+00 9.68983e+01 323.133 4.96150e+00  -3.72076e+00 0.00000e+00 0.00000e+00 1.05838e+02 323.133 8.93969e+00 323.133 0.9154 
1 1 1 -14 49  7  o 3  8.14999e+00 1.23991e+00 1.27533e+02 321.412 1.04749e+01  -8.35832e+00 0.00000e+00 0.00000e+00 1.68925e+02 321.412 4.13921e+01 321.412 0.9619 
1 1 1 -14 49  8  o 12 5.30971e+00 1.34767e+00 1.42262e+02 247.294 -3.60019e+00 -8.60415e+00 0.00000e+00 0.00000e+00 4.72394e+01 247.294 9.50228e+01 67.294  0.9448 
1 1 1 -14 49  9  o 12 1.20479e+01 1.11439e+00 2.37536e+02 97.048  -5.23409e+00 4.23362e+01  0.00000e+00 0.00000e+00 2.11734e+02 97.048  2.58019e+01 277.048 0.9882 
1 1 1 -14 49  10 o 8  6.28618e+00 1.41416e+00 1.41082e+02 79.702  1.97734e+00  1.08830e+01  0.00000e+00 0.00000e+00 8.48787e+01 79.702  5.62034e+01 259.702 0.9537 
1 1 1 -14 49  11 o 16 4.97028e+00 1.34560e+00 4.61667e+01 189.994 -3.21961e+00 -5.67362e-01 0.00000e+00 0.00000e+00 1.08778e+02 189.994 6.26112e+01 189.994 0.8281 
1 1 1 -14 49  12 o 4  5.25022e+00 1.43379e+00 1.00131e+02 304.409 4.09770e+00  -5.98245e+00 0.00000e+00 0.00000e+00 8.31049e+01 304.409 1.70266e+01 124.409 0.9282 
1 1 1 -14 50  1  o 15 5.65826e+00 1.31070e+00 6.84057e+01 209.440 -3.56442e+00 -2.01174e+00 0.00000e+00 0.00000e+00 1.17980e+02 209.440 4.95746e+01 209.440 0.8670 
1 1 1 -14 50  2  o 3  3.62306e+00 1.13096e+00 5.62658e+01 183.647 -2.35696e+00 -1.50225e-01 0.00000e+00 0.00000e+00 4.67802e+01 183.647 9.48563e+00 3.647   0.7491 
1 1 1 -14 50  3  o 13 7.68038e+00 1.50926e+00 9.78888e+01 117.758 -3.45448e+00 6.56371e+00  0.00000e+00 0.00000e+00 1.73093e+02 117.758 7.52043e+01 117.758 0.9299 
1 1 1 -14 50  4  o 18 8.35104e+00 1.51916e+00 1.05437e+02 306.660 5.01353e+00  -6.73589e+00 0.00000e+00 0.00000e+00 1.91670e+02 306.660 8.62329e+01 306.660 0.9384 
1 1 1 -14 50  5  o 14 7.11644e+00 1.48772e+00 9.32129e+01 321.889 5.45968e+00  -4.28260e+00 0.00000e+00 0.00000e+00 1.56099e+02 321.889 6.28858e+01 321.889 0.9248 
1 1 1 -14 50  6  o 15 7.51619e+00 1.28857e+00 1.38065e+02 91.448  -3.06994e-01 1.21439e+01  0.00000e+00 0.00000e+00 1.34420e+02 91.448  3.64514e+00 271.448 0.9579 
1 1 1 -14 50  7  o 5  5.85981e+00 1.28538e+00 5.06479e+01 294.080 1.42953e+00  -3.19870e+00 0.00000e+00 0.00000e+00 1.35747e+02 294.080 8.50987e+01 294.080 0.8413 
1 1 1 -14 50  8  o 19 4.78657e+00 1.30511e+00 1.63485e+02 173.471 -1.00179e+01 1.14659e+00  0.00000e+00 0.00000e+00 8.09503e+00 173.471 1.55390e+02 353.471 0.9490 
1 1 1 -14 50  9  o 12 1.23758e+01 1.07594e+00 2.30041e+02 45.318  2.86606e+01  2.89805e+01  0.00000e+00 0.00000e+00 2.31135e+02 45.318  1.09417e+00 45.318  0.9877 
1 1 1 -14 50  10 o 4  8.22741e+00 1.38842e+00 1.59247e+02 278.598 2.51641e+00  -1.66427e+01 0.00000e+00 0.00000e+00 1.41462e+02 278.598 1.77851e+01 98.598  0.9698 
1 1 1 -14 50  11 o 19 6.06179e+00 1.43359e+00 1.34871e+02 66.158  4.56601e+00  1.03319e+01  0.00000e+00 0.00000e+00 8.29573e+01 66.158  5.19137e+01 246.158 0.9547 
1 1 1 -14 50  12 o 14 3.48089e+00 1.14253e+00 2.18431e+01 229.417 -8.87178e-01 -1.03571e+00 0.00000e+00 0.00000e+00 5.15168e+01 229.417 2.96736e+01 229.417 0.5606 
1 1 1 -14 51  1  o 18 4.62628e+00 1.26151e+00 1.05116e+02 201.123 -5.13930e+00 -1.98544e+00 0.00000e+00 0.00000e+00 5.37562e+01 201.123 5.13599e+01 21.123  0.9040 
1 1 1 -14 51  2  o 11 3.87068e+00 1.16849e+00 7.38680e+01 245.958 -1.38613e+00 -3.10714e+00 0.00000e+00 0.00000e+00 4.89530e+01 245.958 2.49151e+01 65.958  0.8358 
1 1 1 -14 51  3  o 8  3.92808e+00 1.23110e+00 8.66217e+01 3.909   3.83068e+00  2.61770e-01  0.00000e+00 0.00000e+00 4.10943e+01 3.909   4.55274e+01 183.909 0.8571 
1 1 1 -14 51  4  o 16 4.85872e+00 1.39043e+00 1.23695e+02 2.226   6.74118e+00  2.62022e-01  0.00000e+00 0.00000e+00 4.62244e+01 2.226   7.74710e+01 182.226 0.9226 
1 1 1 -14 51  5  o 10 9.58267e+00 1.22932e+00 1.44790e+02 233.874 -9.87105e+00 -1.35238e+01 0.00000e+00 0.00000e+00 2.07141e+02 233.874 6.23507e+01 233.874 0.9697 
1 1 1 -14 51  6  o 3  4.83361e+00 1.31253e+00 1.05288e+02 307.973 3.72827e+00  -4.77654e+00 0.00000e+00 0.00000e+00 6.17562e+01 307.973 4.35319e+01 127.973 0.9133 
1 1 1 -14 51  7  o 1  7.18427e+00 1.32332e+00 1.45580e+02 293.518 4.95564e+00  -1.13875e+01 0.00000e+00 0.00000e+00 1.14842e+02 293.518 3.07384e+01 113.518 0.9589 
1 1 1 -14 51  8  o 14 3.06709e+00 1.01259e+00 3.30018e+01 57.493  7.97263e-01  1.25110e+00  0.00000e+00 0.00000e+00 3.55744e+01 57.493  2.57259e+00 57.493  0.5920 
1 1 1 -14 51  9  o 18 3.58891e+00 1.12995e+00 6.15427e+01 55.115  1.88950e+00  2.71010e+00  0.00000e+00 0.00000e+00 5.08532e+01 55.115  1.06895e+01 235.115 0.8302 
1 1 1 -14 51  10 o 15 6.31624e+00 1.41067e+00 9.23844e+01 274.727 6.21826e-01  -7.52029e+00 0.00000e+00 0.00000e+00 1.29239e+02 274.727 3.68548e+01 274.727 0.9312 
1 1 1 -14 51  11 o 6  4.68276e+00 1.34018e+00 4.80686e+01 92.120  -1.18317e-01 3.19637e+00  0.00000e+00 0.00000e+00 9.70940e+01 92.120  4.90254e+01 92.120  0.8237 
1 1 1 -14 51  12 o 19 4.81281e+00 1.38630e+00 4.16338e+01 152.727 -2.76268e+00 1.42427e+00  0.00000e+00 0.00000e+00 1.06290e+02 152.727 6.46559e+01 152.727 0.8177 
1 1 1 -14 52  1  o 9  6.75676e+00 1.17940e+00 1.53393e+02 302.305 6.42779e+00  -1.01656e+01 0.00000e+00 0.00000e+00 9.23362e+01 302.305 6.10572e+01 122.305 0.9575 
1 1 1 -14 52  2  o 10 8.69754e+00 1.18027e+00 1.34304e+02 65.977  5.44083e+00  1.22074e+01  0.00000e+00 0.00000e+00 1.83236e+02 65.977  4.89318e+01 65.977  0.9618 
1 1 1 -14 52  3  o 9  6.38383e+00 1.32348e+00 6.74325e+01 250.264 -1.69860e+00 -4.73453e+00 0.00000e+00 0.00000e+00 1.49062e+02 250.264 8.16296e+01 250.264 0.8941 
1 1 1 -14 52  4  o 16 1.07246e+01 1.37808e+00 1.56307e+02 194.802 -1.80869e+01 -4.77938e+00 0.00000e+00 0.00000e+00 2.39151e+02 194.802 8.28444e+01 194.802 0.9729 
1 1 1 -14 52  5  o 5  4.24985e+00 1.29168e+00 7.80654e+01 250.820 -1.27393e+00 -3.66242e+00 0.00000e+00 0.00000e+00 6.01252e+01 250.820 1.79401e+01 70.820  0.8586 
1 1 1 -14 52  6  o 8  6.53712e+00 1.17187e+00 1.42032e+02 5.271   1.24291e+01  1.14666e+00  0.00000e+00 0.00000e+00 9.51783e+01 5.271   4.68538e+01 185.271 0.9591 
1 1 1 -14 52  7  o 15 5.54040e+00 1.21225e+00 5.99439e+01 23.328  4.11309e+00  1.77378e+00  0.00000e+00 0.00000e+00 1.24289e+02 23.328  6.43448e+01 23.328  0.8797 
1 1 1 -14 52  8  o 3  4.65339e+00 1.27363e+00 9.74301e+01 314.872 4.43913e+00  -4.45897e+00 0.00000e+00 0.00000e+00 6.36417e+01 314.872 3.37883e+01 134.872 0.9167 
1 1 1 -14 52  9  o 8  5.65444e+00 1.39674e+00 1.20236e+02 193.440 -8.21820e+00 -1.96386e+00 0.00000e+00 0.00000e+00 7.99973e+01 193.440 4.02386e+01 13.440  0.9388 
1 1 1 -14 52  10 o 19 1.07658e+01 1.16008e+00 1.11193e+02 319.155 1.40640e+01  -1.21587e+01 0.00000e+00 0.00000e+00 2.83360e+02 319.155 1.72167e+02 319.155 0.9727 
1 1 1 -14 52  11 o 12 6.20427e+00 1.44695e+00 1.27482e+02 209.985 -9.46176e+00 -5.45955e+00 0.00000e+00 0.00000e+00 9.50332e+01 209.985 3.24492e+01 29.985  0.9531 
1 1 1 -14 52  12 o 14 4.07979e+00 1.24879e+00 4.60243e+01 45.698  2.31767e+00  2.37486e+00  0.00000e+00 0.00000e+00 8.13981e+01 45.698  3.53738e+01 45.698  0.8310 
1 1 1 -14 53  1  o 6  3.52542e+00 1.09557e+00 1.46241e+02 347.148 5.99635e+00  -1.36809e+00 0.00000e+00 0.00000e+00 2.37832e+01 167.148 1.70024e+02 167.148 0.9146 
1 1 1 -14 53  2  o 6  2.70077e+00 8.91537e-01 9.53657e+01 116.909 -1.72889e+00 3.40654e+00  0.00000e+00 0.00000e+00 7.60073e+00 296.909 1.02966e+02 296.909 0.8562 
1 1 1 -14 53  3  o 12 5.44134e+00 1.27681e+00 9.65262e+01 196.577 -5.92845e+00 -1.76475e+00 0.00000e+00 0.00000e+00 9.23284e+01 196.577 4.19776e+00 16.577  0.9151 
1 1 1 -14 53  4  o 16 6.74279e+00 1.46992e+00 1.14067e+02 217.897 -6.37943e+00 -4.96572e+00 0.00000e+00 0.00000e+00 1.25087e+02 217.897 1.10197e+01 217.897 0.9359 
1 1 1 -14 53  5  o 18 6.45053e+00 1.45006e+00 1.14548e+02 344.062 7.57209e+00  -2.16242e+00 0.00000e+00 0.00000e+00 1.13615e+02 344.062 9.32844e-01 164.062 0.9342 
1 1 1 -14 53  6  o 18 3.78175e+00 1.16348e+00 1.78254e+01 68.727  3.09680e-01  7.95391e-01  0.00000e+00 0.00000e+00 3.82703e+01 68.727  2.04449e+01 68.727  0.3921 
1 1 1 -14 53  7  o 10 6.54546e+00 1.27529e+00 1.79969e+02 149.805 -1.31569e+01 7.65598e+00  0.00000e+00 0.00000e+00 5.91394e+01 149.805 1.20829e+02 329.805 0.9666 
1 1 1 -14 53  8  o 3  3.71130e+00 1.14712e+00 7.15898e+01 323.609 3.06806e+00  -2.26121e+00 0.00000e+00 0.00000e+00 4.83326e+01 323.609 2.32572e+01 143.609 0.8559 
1 1 1 -14 53  9  o 19 8.15434e+00 1.31560e+00 1.33864e+02 209.664 -1.21157e+01 -6.90063e+00 0.00000e+00 0.00000e+00 1.62428e+02 209.664 2.85641e+01 209.664 0.9634 
1 1 1 -14 53  10 o 1  2.80931e+00 9.69493e-01 6.79245e+01 80.082  6.03880e-01  3.45372e+00  0.00000e+00 0.00000e+00 2.11228e+01 80.082  4.68017e+01 260.082 0.8414 
1 1 1 -14 53  11 o 10 6.92558e+00 1.39609e+00 1.19452e+02 339.442 1.10375e+01  -4.13947e+00 0.00000e+00 0.00000e+00 1.29817e+02 339.442 1.03658e+01 339.442 0.9566 
1 1 1 -14 53  12 o 1  3.07361e+00 1.04175e+00 5.54349e+01 67.209  1.43032e+00  3.40412e+00  0.00000e+00 0.00000e+00 4.28043e+01 67.209  1.26306e+01 247.209 0.8506 
1 1 1 -14 54  1  o 7  9.05069e+00 1.14827e+00 1.91825e+02 169.104 -2.15975e+01 4.15751e+00  0.00000e+00 0.00000e+00 1.43940e+02 169.104 4.78849e+01 349.104 0.9770 
1 1 1 -14 54  2  o 14 9.10757e+00 1.10040e+00 1.28544e+02 119.960 -7.59742e+00 1.31803e+01  0.00000e+00 0.00000e+00 2.05502e+02 119.960 7.69575e+01 119.960 0.9666 
1 1 1 -14 54  3  o 17 5.62725e+00 1.25536e+00 3.15882e+01 311.858 1.41972e+00  -1.58462e+00 0.00000e+00 0.00000e+00 1.21547e+02 311.858 8.99592e+01 311.858 0.7177 
1 1 1 -14 54  4  o 4  1.11342e+01 1.40135e+00 1.34702e+02 201.332 -1.53315e+01 -5.98745e+00 0.00000e+00 0.00000e+00 2.74154e+02 201.332 1.39453e+02 201.332 0.9691 
1 1 1 -14 54  5  o 1  6.71358e+00 1.54457e+00 9.06175e+01 67.748  2.28088e+00  5.57478e+00  0.00000e+00 0.00000e+00 1.41365e+02 67.748  5.07476e+01 67.748  0.9127 
1 1 1 -14 54  6  o 8  6.16090e+00 1.35886e+00 1.20846e+02 339.309 8.47295e+00  -3.20019e+00 0.00000e+00 0.00000e+00 9.89188e+01 339.309 2.19273e+01 159.309 0.9431 
1 1 1 -14 54  7  o 11 8.56416e+00 1.34014e+00 1.57321e+02 65.210  7.11893e+00  1.54141e+01  0.00000e+00 0.00000e+00 1.56623e+02 65.210  6.98006e-01 245.210 0.9701 
1 1 1 -14 54  8  f 0  4.16049e+00 1.24152e+00 5.58092e+01 217.367 -2.53554e+00 -1.93626e+00 0.00000e+00 0.00000e+00 7.34680e+01 217.367 1.76588e+01 217.367 0.8231 
1 1 1 -14 54  9  o 15 1.02603e+01 1.19355e+00 1.54565e+02 272.411 9.62808e-01  -2.28670e+01 0.00000e+00 0.00000e+00 2.23790e+02 272.411 6.92250e+01 272.411 0.9779 
1 1 1 -14 54  10 o 19 8.39330e+00 1.38033e+00 1.43625e+02 111.431 -6.02915e+00 1.53597e+01  0.00000e+00 0.00000e+00 1.62778e+02 111.431 1.91525e+01 111.431 0.9692 
1 1 1 -14 54  11 o 2  3.00417e+00 1.02314e+00 4.04096e+01 91.552  -6.20400e-02 2.29035e+00  0.00000e+00 0.00000e+00 4.32506e+01 91.552  2.84103e+00 91.552  0.7402 
1 1 1 -14 54  12 o 9  5.46655e+00 1.43253e+00 1.25705e+02 155.010 -9.70171e+00 4.52182e+00  0.00000e+00 0.00000e+00 6.98433e+01 155.010 5.58619e+01 335.010 0.9521 
1 1 1 -14 55  1  o 3  3.20382e+00 1.03892e+00 9.71251e+01 259.186 -7.88351e-01 -4.12705e+00 0.00000e+00 0.00000e+00 8.80280e+00 259.186 8.83223e+01 79.186  0.8709 
1 1 1 -14 55  2  o 15 4.07389e+00 1.12666e+00 9.40164e+01 247.215 -1.90813e+00 -4.54259e+00 0.00000e+00 0.00000e+00 4.38069e+01 247.215 5.02095e+01 67.215  0.8917 
1 1 1 -14 55  3  o 19 8.41783e+00 1.19303e+00 1.18198e+02 10.175  1.21220e+01  2.17568e+00  0.00000e+00 0.00000e+00 1.87712e+02 10.175  6.95142e+01 10.175  0.9585 
1 1 1 -14 55  4  o 9  6.02997e+00 1.53933e+00 1.02653e+02 155.097 -5.67911e+00 2.63648e+00  0.00000e+00 0.00000e+00 1.06655e+02 155.097 4.00171e+00 155.097 0.9162 
1 1 1 -14 55  5  o 13 5.26629e+00 1.41221e+00 1.22371e+02 260.869 -1.18683e+00 -7.38380e+00 0.00000e+00 0.00000e+00 6.31219e+01 260.869 5.92495e+01 80.869  0.9305 
1 1 1 -14 55  6  o 10 4.99336e+00 1.20440e+00 8.37203e+01 44.787  3.77320e+00  3.74522e+00  0.00000e+00 0.00000e+00 8.62831e+01 44.787  2.56280e+00 44.787  0.9002 
1 1 1 -14 55  7  o 11 6.16155e+00 1.42252e+00 1.48414e+02 225.963 -7.74242e+00 -8.00728e+00 0.00000e+00 0.00000e+00 7.36749e+01 225.963 7.47391e+01 45.963  0.9540 
1 1 1 -14 55  8  o 19 6.18105e+00 1.40332e+00 9.09317e+01 157.283 -6.08216e+00 2.54637e+00  0.00000e+00 0.00000e+00 1.23863e+02 157.283 3.29315e+01 157.283 0.9207 
1 1 1 -14 55  9  o 13 8.58455e+00 1.32901e+00 1.33792e+02 82.206  2.08321e+00  1.52190e+01  0.00000e+00 0.00000e+00 1.79152e+02 82.206  4.53606e+01 82.206  0.9669 
1 1 1 -14 55  10 o 2  3.66901e+00 1.16628e+00 5.77254e+01 304.153 2.00856e+00  -2.96075e+00 0.00000e+00 0.00000e+00 5.90408e+01 304.153 1.31539e+00 304.153 0.8451 
1 1 1 -14 55  11 o 19 3.97030e+00 1.23624e+00 1.19112e+02 283.133 1.71863e+00  -7.36631e+00 0.00000e+00 0.00000e+00 1.99749e+01 283.133 9.91368e+01 103.133 0.9313 
1 1 1 -14 55  12 o 16 2.92759e+00 1.00425e+00 3.99685e+01 123.071 -1.41669e+00 2.17563e+00  0.00000e+00 0.00000e+00 4.52740e+01 123.071 5.30550e+00 123.071 0.7751 
1 1 1 -14 56  1  o 10 7.57652e+00 1.20979e+00 1.12193e+02 142.657 -8.24817e+00 6.29310e+00  0.00000e+00 0.00000e+00 1.61182e+02 142.657 4.89883e+01 142.657 0.9505 
1 1 1 -14 56  2  o 19 3.00336e+00 9.76701e-01 6.51024e+01 144.259 -2.20753e+00 1.58865e+00  0.00000e+00 0.00000e+00 2.45552e+01 144.259 4.05472e+01 324.259 0.7869 
1 1 1 -14 56  3  o 5  6.40604e+00 1.28878e+00 1.33261e+02 124.914 -5.72626e+00 8.20400e+00  0.00000e+00 0.00000e+00 9.71055e+01 124.914 3.61555e+01 304.914 0.9486 
1 1 1 -14 56  4  o 3  5.49000e+00 1.51275e+00 4.87211e+01 218.059 -2.12418e+00 -1.66313e+00 0.00000e+00 0.00000e+00 1.14504e+02 218.059 6.57825e+01 218.059 0.7849 
1 1 1 -14 56  5  o 17 5.85707e+00 1.54839e+00 1.07073e+02 240.591 -3.11731e+00 -5.53030e+00 0.00000e+00 0.00000e+00 9.63019e+01 240.591 1.07710e+01 60.591  0.9175 
1 1 1 -14 56  6  o 6  3.24334e+00 1.06634e+00 2.96066e+01 228.173 -9.40465e-01 -1.05085e+00 0.00000e+00 0.00000e+00 4.06844e+01 228.173 1.10779e+01 228.173 0.5731 
1 1 1 -14 56  7  o 10 4.28608e+00 1.24084e+00 6.67389e+01 25.141  3.67235e+00  1.72344e+00  0.00000e+00 0.00000e+00 7.34245e+01 25.141  6.68560e+00 25.141  0.8657 
1 1 1 -14 56  8  o 16 4.97478e+00 1.33180e+00 6.23856e+01 137.448 -2.96693e+00 2.72368e+00  0.00000e+00 0.00000e+00 9.99284e+01 137.448 3.75427e+01 137.448 0.8646 
1 1 1 -14 56  9  o 1  4.09549e+00 1.25069e+00 7.84898e+01 45.511  3.20920e+00  3.26694e+00  0.00000e+00 0.00000e+00 5.77770e+01 45.511  2.07128e+01 225.511 0.8826 
1 1 1 -14 56  10 o 5  6.62512e+00 1.39320e+00 1.71811e+02 46.749  1.07292e+01  1.14051e+01  0.00000e+00 0.00000e+00 6.95498e+01 46.749  1.02261e+02 226.749 0.9675 
1 1 1 -14 56  11 o 2  4.91252e+00 1.36103e+00 5.09918e+01 297.994 1.78143e+00  -3.35117e+00 0.00000e+00 0.00000e+00 1.07002e+02 297.994 5.60103e+01 297.994 0.8552 
1 1 1 -14 56  12 o 17 4.93404e+00 1.38670e+00 1.21781e+02 191.363 -9.39204e+00 -1.88746e+00 0.00000e+00 0.00000e+00 5.35897e+01 191.363 6.81912e+01 11.363  0.9463 
1 1 1 -14 57  1  f 0  7.40286e+00 1.20197e+00 1.35659e+02 263.724 -1.35273e+00 -1.22996e+01 0.00000e+00 0.00000e+00 1.33709e+02 263.724 1.95008e+00 83.724  0.9587 
1 1 1 -14 57  2  o 8  7.31350e+00 1.27440e+00 1.23176e+02 176.384 -1.06213e+01 6.71239e-01  0.00000e+00 0.00000e+00 1.40850e+02 176.384 1.76748e+01 176.384 0.9518 
1 1 1 -14 57  3  o 11 8.98962e+00 1.14747e+00 1.20107e+02 165.100 -1.36876e+01 3.64191e+00  0.00000e+00 0.00000e+00 2.08364e+02 165.100 8.82573e+01 165.100 0.9640 
1 1 1 -14 57  4  o 2  3.15651e+00 1.04290e+00 1.29770e+01 286.212 1.65753e-01  -5.70073e-01 0.00000e+00 0.00000e+00 2.10325e+01 286.212 8.05549e+00 286.212 0.2845 
1 1 1 -14 57  5  o 19 5.67160e+00 1.50899e+00 6.24004e+01 242.656 -1.72642e+00 -3.33854e+00 0.00000e+00 0.00000e+00 1.20788e+02 242.656 5.83880e+01 242.656 0.8535 
1 1 1 -14 57  6  f 0  3.76344e+00 1.15145e+00 4.53734e+01 131.301 -1.60003e+00 1.82118e+00  0.00000e+00 0.00000e+00 6.22646e+01 131.301 1.68912e+01 131.301 0.7565 
1 1 1 -14 57  7  o 7  3.68274e+00 1.13133e+00 4.24111e+01 84.813  2.04479e-01  2.25251e+00  0.00000e+00 0.00000e+00 6.00227e+01 84.813  1.76116e+01 84.813  0.7364 
1 1 1 -14 57  8  o 18 3.26463e+00 1.06003e+00 7.82486e+01 42.466  3.04701e+00  2.78876e+00  0.00000e+00 0.00000e+00 2.87178e+01 42.466  4.95308e+01 222.466 0.8684 
1 1 1 -14 57  9  f 0  5.88437e+00 1.30556e+00 8.71542e+01 358.151 7.20429e+00  -2.32547e-01 0.00000e+00 0.00000e+00 1.18619e+02 358.151 3.14651e+01 358.151 0.9278 
1 1 1 -14 57  10 o 3  4.44935e+00 1.29515e+00 1.15432e+02 229.465 -4.89467e+00 -5.72388e+00 0.00000e+00 0.00000e+00 4.05239e+01 229.465 7.49085e+01 49.465  0.9310 
1 1 1 -14 57  11 o 9  3.19824e+00 1.06683e+00 5.59560e+01 274.821 2.85870e-01  -3.38973e+00 0.00000e+00 0.00000e+00 4.45601e+01 274.821 1.13959e+01 94.821  0.8358 
1 1 1 -14 57  12 o 10 3.53513e+00 1.14989e+00 3.67706e+01 53.309  1.54102e+00  2.06809e+00  0.00000e+00 0.00000e+00 6.58993e+01 53.309  2.91286e+01 53.309  0.7733 
1 1 1 -14 58  1  o 4  9.07440e+00 1.18816e+00 1.51746e+02 266.605 -1.04568e+00 -1.76273e+01 0.00000e+00 0.00000e+00 1.82717e+02 266.605 3.09702e+01 266.605 0.9713 
1 1 1 -14 58  2  o 12 9.55647e+00 1.08481e+00 1.83579e+02 172.636 -2.36436e+01 3.05548e+00  0.00000e+00 0.00000e+00 1.71154e+02 172.636 1.24249e+01 352.636 0.9788 
1 1 1 -14 58  3  o 7  4.81502e+00 1.28358e+00 1.32720e+02 82.389  1.06424e+00  7.96428e+00  0.00000e+00 0.00000e+00 3.79885e+01 82.389  9.47315e+01 262.389 0.9355 
1 1 1 -14 58  4  o 4  3.31607e+00 1.05967e+00 6.31324e+01 98.004  -3.90475e-01 2.77688e+00  0.00000e+00 0.00000e+00 3.66202e+01 98.004  2.65122e+01 278.004 0.7944 
1 1 1 -14 58  5  o 1  5.32079e+00 1.43731e+00 1.31718e+02 271.860 2.66288e-01  -8.19903e+00 0.00000e+00 0.00000e+00 5.68940e+01 271.860 7.48235e+01 91.860  0.9369 
1 1 1 -14 58  6  o 9  5.68121e+00 1.46887e+00 8.90986e+01 201.125 -5.26994e+00 -2.03612e+00 0.00000e+00 0.00000e+00 1.05588e+02 201.125 1.64896e+01 201.125 0.9065 
1 1 1 -14 58  7  o 3  3.88300e+00 1.17722e+00 3.97900e+01 84.373  2.04480e-01  2.07554e+00  0.00000e+00 0.00000e+00 6.45216e+01 84.373  2.47316e+01 84.373  0.7113 
1 1 1 -14 58  8  o 12 4.39082e+00 1.27188e+00 8.31446e+01 124.609 -2.71840e+00 3.93928e+00  0.00000e+00 0.00000e+00 6.39812e+01 124.609 1.91634e+01 304.608 0.8882 
1 1 1 -14 58  9  o 2  8.40811e+00 1.25548e+00 1.03406e+02 67.578  4.99257e+00  1.20997e+01  0.00000e+00 0.00000e+00 2.01102e+02 67.578  9.76961e+01 67.578  0.9610 
1 1 1 -14 58  10 o 10 4.16103e+00 1.25773e+00 1.36347e+02 349.461 8.82339e+00  -1.64151e+00 0.00000e+00 0.00000e+00 1.12815e+01 349.461 1.25065e+02 169.461 0.9425 
1 1 1 -14 58  11 o 10 3.26226e+00 1.07940e+00 1.88280e+01 250.566 -4.15672e-01 -1.17815e+00 0.00000e+00 0.00000e+00 4.59066e+01 250.566 2.70786e+01 250.566 0.5278 
1 1 1 -14 58  12 o 1  3.88702e+00 1.21622e+00 3.49314e+01 126.225 -1.48870e+00 2.03216e+00  0.00000e+00 0.00000e+00 7.70249e+01 126.225 4.20935e+01 126.225 0.7671 
1 1 1 -14 59  1  o 10 1.07300e+01 1.12276e+00 1.22246e+02 285.511 4.40069e+00  -1.58560e+01 0.00000e+00 0.00000e+00 2.72305e+02 285.511 1.50059e+02 285.511 0.9691 
1 1 1 -14 59  2  o 16 1.42069e+01 9.56618e-01 2.99801e+02 139.477 -4.93088e+01 4.21473e+01  0.00000e+00 0.00000e+00 2.34722e+02 139.477 6.50797e+01 319.477 0.9923 
1 1 1 -14 59  3  f 0  7.55319e+00 1.24265e+00 7.70542e+01 288.995 2.29507e+00  -6.66709e+00 0.00000e+00 0.00000e+00 1.87989e+02 288.995 1.10935e+02 288.995 0.9261 
1 1 1 -14 59  4  o 18 5.49997e+00 1.34353e+00 1.20835e+02 244.184 -3.39555e+00 -7.01894e+00 0.00000e+00 0.00000e+00 7.35468e+01 244.184 4.72886e+01 64.184  0.9335 
1 1 1 -14 59  5  o 14 1.00409e+01 1.38455e+00 1.25828e+02 266.416 -9.52567e-01 -1.52074e+01 0.00000e+00 0.00000e+00 2.41326e+02 266.416 1.15499e+02 266.416 0.9666 
1 1 1 -14 59  6  o 2  5.23056e+00 1.44716e+00 1.01261e+02 145.914 -5.41674e+00 3.66553e+00  0.00000e+00 0.00000e+00 8.06159e+01 145.914 2.06455e+01 325.914 0.9200 
1 1 1 -14 59  7  o 1  7.59310e+00 1.28439e+00 6.65523e+01 263.018 -8.31725e-01 -6.79107e+00 0.00000e+00 0.00000e+00 1.98285e+02 263.018 1.31733e+02 263.018 0.9237 
1 1 1 -14 59  8  o 7  6.95854e+00 1.36972e+00 1.40645e+02 39.340  9.85479e+00  8.07753e+00  0.00000e+00 0.00000e+00 1.11313e+02 39.340  2.93329e+01 219.340 0.9599 
1 1 1 -14 59  9  o 14 8.75211e+00 1.23341e+00 1.35357e+02 265.057 -1.57873e+00 -1.82538e+01 0.00000e+00 0.00000e+00 1.85288e+02 265.057 4.99310e+01 265.057 0.9723 
1 1 1 -14 59  10 o 9  5.32488e+00 1.39055e+00 8.69865e+01 315.182 4.71967e+00  -4.68979e+00 0.00000e+00 0.00000e+00 9.76793e+01 315.182 1.06928e+01 315.182 0.9214 
1 1 1 -14 59  11 o 13 3.92787e+00 1.16624e+00 5.01027e+01 172.444 -3.80197e+00 5.04322e-01  0.00000e+00 0.00000e+00 7.64169e+01 172.444 2.63141e+01 172.444 0.8569 
1 1 1 -14 60  1  o 15 1.07185e+01 1.06817e+00 1.37016e+02 47.889  1.31578e+01  1.45567e+01  0.00000e+00 0.00000e+00 2.59102e+02 47.889  1.22085e+02 47.889  0.9742 
1 1 1 -14 60  2  o 11 3.36966e+00 1.08455e+00 7.55090e+01 186.531 -3.34412e+00 -3.82834e-01 0.00000e+00 0.00000e+00 3.10058e+01 186.531 4.45032e+01 6.531   0.8338 
1 1 1 -14 60  3  o 11 4.65511e+00 1.16231e+00 1.06847e+02 255.906 -1.66343e+00 -6.62541e+00 0.00000e+00 0.00000e+00 5.60341e+01 255.906 5.08126e+01 75.906  0.9236 
1 1 1 -14 60  4  o 13 1.08758e+01 1.11605e+00 2.09194e+02 71.028  1.05791e+01  3.07724e+01  0.00000e+00 0.00000e+00 1.96131e+02 71.028  1.30626e+01 251.028 0.9845 
1 1 1 -14 60  5  o 1  4.02369e+00 1.24634e+00 5.40260e+01 224.371 -1.99012e+00 -1.94692e+00 0.00000e+00 0.00000e+00 6.66078e+01 224.371 1.25817e+01 224.371 0.7927 
1 1 1 -14 60  6  o 1  4.79284e+00 1.40950e+00 4.76023e+01 167.830 -2.70658e+00 5.83715e-01  0.00000e+00 0.00000e+00 9.57200e+01 167.830 4.81177e+01 167.830 0.7913 
1 1 1 -14 60  7  o 11 4.09767e+00 1.22944e+00 1.06728e+02 33.030  5.08074e+00  3.30322e+00  0.00000e+00 0.00000e+00 3.45550e+01 33.030  7.21733e+01 213.030 0.9133 
1 1 1 -14 60  8  o 18 3.89230e+00 1.22961e+00 5.70227e+01 16.217  3.08057e+00  8.95958e-01  0.00000e+00 0.00000e+00 6.39760e+01 16.217  6.95326e+00 16.217  0.8243 
1 1 1 -14 60  9  o 8  5.51266e+00 1.34154e+00 7.19130e+01 244.779 -2.50208e+00 -5.31208e+00 0.00000e+00 0.00000e+00 1.17142e+02 244.779 4.52290e+01 244.779 0.9103 
1 1 1 -14 60  10 o 6  5.60047e+00 1.36484e+00 5.28711e+01 99.671  -7.17266e-01 4.20898e+00  0.00000e+00 0.00000e+00 1.31141e+02 99.671  7.82700e+01 99.671  0.8731 
1 1 1 -14 60  11 o 4  8.31116e+00 1.42481e+00 1.30734e+02 12.695  1.66135e+01  3.74248e+00  0.00000e+00 0.00000e+00 1.72324e+02 12.695  4.15898e+01 12.695  0.9702 
1 1 1 -14 61  1  o 19 1.24706e+01 9.95406e-01 1.75220e+02 120.649 -1.68922e+01 2.85069e+01  0.00000e+00 0.00000e+00 2.90596e+02 120.649 1.15375e+02 120.649 0.9848 
1 1 1 -14 61  2  o 4  2.99356e+00 9.93401e-01 3.71737e+01 50.345  1.01914e+00  1.22954e+00  0.00000e+00 0.00000e+00 3.30892e+01 50.345  4.08458e+00 230.345 0.6192 
1 1 1 -14 61  3  o 3  8.64660e+00 1.16908e+00 1.96133e+02 210.210 -2.03121e+01 -1.18269e+01 0.00000e+00 0.00000e+00 1.24338e+02 210.210 7.17949e+01 30.210  0.9785 
1 1 1 -14 61  4  o 16 6.17479e+00 1.13867e+00 1.24374e+02 306.694 6.57287e+00  -8.81999e+00 0.00000e+00 0.00000e+00 9.84425e+01 306.694 2.59311e+01 126.694 0.9534 
1 1 1 -14 61  5  o 7  8.50877e+00 1.33650e+00 1.34768e+02 29.528  1.28429e+01  7.27434e+00  0.00000e+00 0.00000e+00 1.75907e+02 29.528  4.11398e+01 29.528  0.9655 
1 1 1 -14 61  6  o 16 7.80904e+00 1.56855e+00 1.06996e+02 110.017 -3.03035e+00 8.31794e+00  0.00000e+00 0.00000e+00 1.70850e+02 110.017 6.38540e+01 110.017 0.9417 
1 1 1 -14 61  7  o 11 1.02581e+01 1.25757e+00 1.60710e+02 231.677 -1.35419e+01 -1.71327e+01 0.00000e+00 0.00000e+00 2.17524e+02 231.677 5.68132e+01 231.677 0.9768 
1 1 1 -14 61  8  f 0  4.64641e+00 1.29132e+00 7.90029e+01 291.137 1.87911e+00  -4.86052e+00 0.00000e+00 0.00000e+00 7.83426e+01 291.137 6.60347e-01 111.137 0.8981 
1 1 1 -14 61  9  o 15 4.58881e+00 1.24733e+00 6.74276e+01 76.310  1.11812e+00  4.59004e+00  0.00000e+00 0.00000e+00 8.58130e+01 76.310  1.83853e+01 76.310  0.8866 
1 1 1 -14 61  10 o 14 4.04177e+00 1.23426e+00 6.74461e+01 217.665 -3.60889e+00 -2.78571e+00 0.00000e+00 0.00000e+00 6.66829e+01 217.665 7.63196e-01 37.665  0.8820 
1 1 1 -14 61  11 o 12 4.39272e+00 1.25770e+00 4.90988e+01 6.436   3.83653e+00  4.32776e-01  0.00000e+00 0.00000e+00 9.25250e+01 6.436   4.34262e+01 6.436   0.8580 
1 1 1 -14 62  1  f 0  6.15489e+00 1.34893e+00 3.53864e+01 186.488 -2.68143e+00 -3.04961e-01 0.00000e+00 0.00000e+00 1.47842e+02 186.488 1.12456e+02 186.488 0.7850 
1 1 1 -14 62  2  o 11 9.84380e+00 1.11318e+00 2.08372e+02 308.040 1.81203e+01  -2.31593e+01 0.00000e+00 0.00000e+00 1.58296e+02 308.040 5.00757e+01 128.040 0.9828 
1 1 1 -14 62  3  o 15 5.72795e+00 1.29016e+00 8.35207e+01 109.662 -2.06129e+00 5.76895e+00  0.00000e+00 0.00000e+00 1.14810e+02 109.662 3.12895e+01 109.662 0.9143 
1 1 1 -14 62  4  o 1  3.36819e+00 1.04042e+00 8.08360e+01 42.158  2.91691e+00  2.64103e+00  0.00000e+00 0.00000e+00 2.89030e+01 42.158  5.19330e+01 222.158 0.8610 
1 1 1 -14 62  5  o 4  4.59836e+00 1.26665e+00 1.52503e+02 238.559 -4.86989e+00 -7.96527e+00 0.00000e+00 0.00000e+00 1.17690e+01 238.559 1.40734e+02 58.559  0.9448 
1 1 1 -14 62  6  o 13 3.62563e+00 1.20263e+00 6.75631e+01 302.802 1.89495e+00  -2.94012e+00 0.00000e+00 0.00000e+00 4.76219e+01 302.802 1.99412e+01 122.802 0.8410 
1 1 1 -14 62  7  f 0  4.38097e+00 1.26857e+00 7.22759e+01 285.964 1.19600e+00  -4.18078e+00 0.00000e+00 0.00000e+00 7.25109e+01 285.964 2.35065e-01 285.964 0.8757 
1 1 1 -14 62  8  o 10 8.51945e+00 1.40426e+00 1.52914e+02 53.011  1.06087e+01  1.40838e+01  0.00000e+00 0.00000e+00 1.59036e+02 53.011  6.12211e+00 53.011  0.9712 
1 1 1 -14 62  9  o 13 3.55305e+00 1.11029e+00 6.13026e+01 152.580 -3.44077e+00 1.78504e+00  0.00000e+00 0.00000e+00 5.35855e+01 152.580 7.71718e+00 332.580 0.8586 
1 1 1 -14 62  10 o 2  6.22480e+00 1.38026e+00 6.82077e+01 279.273 1.02086e+00  -6.25235e+00 0.00000e+00 0.00000e+00 1.46582e+02 279.273 7.83743e+01 279.273 0.9173 
1 1 1 -14 62  11 f 0  4.73533e+00 1.31991e+00 8.70630e+01 112.243 -2.62855e+00 6.42741e+00  0.00000e+00 0.00000e+00 7.74925e+01 112.243 9.57053e+00 292.243 0.9249 
1 1 1 -14 63  1  o 15 4.50778e+00 1.21266e+00 1.11232e+02 55.433  3.82434e+00  5.55052e+00  0.00000e+00 0.00000e+00 4.64458e+01 55.433  6.47863e+01 235.433 0.9225 
1 1 1 -14 63  2  o 17 4.74455e+00 1.25666e+00 4.98111e+01 257.496 -6.80984e-01 -3.07071e+00 0.00000e+00 0.00000e+00 9.76420e+01 257.496 4.78309e+01 257.496 0.8202 
1 1 1 -14 63  3  o 7  3.89134e+00 1.14918e+00 7.53414e+01 70.246  1.34584e+00  3.74761e+00  0.00000e+00 0.00000e+00 5.17923e+01 70.246  2.35491e+01 250.246 0.8628 
1 1 1 -14 63  4  o 4  4.84786e+00 1.26702e+00 8.36312e+01 224.401 -4.03962e+00 -3.95603e+00 0.00000e+00 0.00000e+00 8.26637e+01 224.401 9.67490e-01 44.401  0.9066 
1 1 1 -14 63  5  o 14 1.27137e+01 1.03839e+00 1.88984e+02 70.215  1.27064e+01  3.53223e+01  0.00000e+00 0.00000e+00 2.85197e+02 70.215  9.62136e+01 70.215  0.9866 
1 1 1 -14 63  6  o 6  4.64633e+00 1.36627e+00 4.23794e+01 281.717 5.27502e-01  -2.54350e+00 0.00000e+00 0.00000e+00 9.36634e+01 281.717 5.12840e+01 281.717 0.7752 
1 1 1 -14 63  7  f 0  4.32923e+00 1.31238e+00 1.05437e+02 164.237 -6.01161e+00 1.69696e+00  0.00000e+00 0.00000e+00 4.42027e+01 164.237 6.12344e+01 344.237 0.9160 
1 1 1 -14 63  8  o 2  4.98215e+00 1.34012e+00 6.85889e+01 170.748 -4.82908e+00 7.86609e-01  0.00000e+00 0.00000e+00 9.87118e+01 170.748 3.01230e+01 170.748 0.8908 
1 1 1 -14 63  9  o 9  9.17400e+00 1.35472e+00 1.43894e+02 16.303  1.86180e+01  5.44538e+00  0.00000e+00 0.00000e+00 1.92520e+02 16.303  4.86265e+01 16.303  0.9739 
1 1 1 -14 63  10 o 19 6.34167e+00 1.42322e+00 6.74934e+01 145.475 -5.39665e+00 3.71254e+00  0.00000e+00 0.00000e+00 1.51976e+02 145.475 8.44826e+01 145.475 0.9201 
1 1 1 -14 63  11 o 3  4.10136e+00 1.26709e+00 1.03287e+02 1.888   7.39850e+00  2.43860e-01  0.00000e+00 0.00000e+00 3.99636e+01 1.888   6.33233e+01 181.888 0.9298 
1 1 1 -14 64  1  f 0  3.29694e+00 1.06319e+00 5.62420e+01 34.269  2.18949e+00  1.49186e+00  0.00000e+00 0.00000e+00 4.12890e+01 34.269  1.49530e+01 214.269 0.7803 
1 1 1 -14 64  2  o 16 5.43563e+00 1.21040e+00 5.53514e+01 76.271  9.34638e-01  3.82557e+00  0.00000e+00 0.00000e+00 1.21977e+02 76.271  6.66252e+01 76.271  0.8611 
1 1 1 -14 64  3  f 0  6.61948e+00 1.30685e+00 4.86029e+01 73.193  1.22108e+00  4.04275e+00  0.00000e+00 0.00000e+00 1.69819e+02 73.193  1.21216e+02 73.193  0.8716 
1 1 1 -14 64  4  o 12 4.15311e+00 1.16003e+00 6.78262e+01 65.608  1.65602e+00  3.65200e+00  0.00000e+00 0.00000e+00 6.79001e+01 65.608  7.39114e-02 65.608  0.8639 
1 1 1 -14 64  5  o 11 3.84121e+00 1.16374e+00 8.63826e+01 235.159 -2.77820e+00 -3.99116e+00 0.00000e+00 0.00000e+00 4.28491e+01 235.159 4.35335e+01 55.159  0.8901 
1 1 1 -14 64  6  o 7  8.29285e+00 1.57035e+00 1.47046e+02 257.507 -2.86038e+00 -1.29095e+01 0.00000e+00 0.00000e+00 1.54034e+02 257.507 6.98815e+00 257.507 0.9614 
1 1 1 -14 64  7  o 16 6.09964e+00 1.38638e+00 9.27319e+01 82.581  9.59295e-01  7.36752e+00  0.00000e+00 0.00000e+00 1.21290e+02 82.581  2.85579e+01 82.581  0.9300 
1 1 1 -14 64  8  o 12 4.30613e+00 1.24339e+00 9.42940e+01 344.225 6.22665e+00  -1.75902e+00 0.00000e+00 0.00000e+00 5.48675e+01 344.225 3.94265e+01 164.225 0.9191 
1 1 1 -14 64  9  o 14 4.61144e+00 1.23965e+00 1.48427e+02 42.410  8.00179e+00  7.30922e+00  0.00000e+00 0.00000e+00 1.69679e+01 42.410  1.31459e+02 222.410 0.9527 
1 1 1 -14 64  10 o 16 3.29535e+00 1.09098e+00 6.14708e+01 204.752 -3.82231e+00 -1.76223e+00 0.00000e+00 0.00000e+00 4.64763e+01 204.752 1.49945e+01 24.752  0.8711 
1 1 1 -14 64  11 o 6  3.42555e+00 1.11076e+00 8.42628e+01 16.237  5.61539e+00  1.63534e+00  0.00000e+00 0.00000e+00 3.28111e+01 16.237  5.14517e+01 196.237 0.9099 
1 1 1 -14 65  1  o 1  7.79678e+00 1.37388e+00 1.10576e+02 64.526  4.66001e+00  9.78150e+00  0.00000e+00 0.00000e+00 1.70965e+02 64.526  6.03891e+01 64.526  0.9527 
1 1 1 -14 65  2  o 8  6.52611e+00 1.31035e+00 1.08895e+02 100.621 -1.77459e+00 9.46365e+00  0.00000e+00 0.00000e+00 1.25095e+02 100.621 1.62008e+01 100.621 0.9466 
1 1 1 -14 65  3  o 2  4.44051e+00 1.23624e+00 6.40709e+01 201.706 -3.58893e+00 -1.42865e+00 0.00000e+00 0.00000e+00 8.01482e+01 201.706 1.60773e+01 201.706 0.8580 
1 1 1 -14 65  4  o 2  6.48632e+00 1.34431e+00 8.42088e+01 239.950 -3.33499e+00 -5.76472e+00 0.00000e+00 0.00000e+00 1.41867e+02 239.950 5.76585e+01 239.950 0.9215 
1 1 1 -14 65  5  o 16 4.35999e+00 1.23327e+00 1.30015e+02 350.578 7.73328e+00  -1.28331e+00 0.00000e+00 0.00000e+00 2.38521e+01 350.578 1.06163e+02 170.578 0.9338 
1 1 1 -14 65  6  f 0  3.67991e+00 1.16932e+00 4.62375e+01 27.738  2.24223e+00  1.17909e+00  0.00000e+00 0.00000e+00 6.05492e+01 27.738  1.43117e+01 27.738  0.7686 
1 1 1 -14 65  7  f 0  2.70239e+00 9.46916e-01 1.55919e+01 340.444 7.41275e-01  -2.63315e-01 0.00000e+00 0.00000e+00 2.16896e+01 340.444 6.09765e+00 340.444 0.3657 
1 1 1 -14 65  8  o 9  3.35379e+00 1.09805e+00 6.05668e+01 3.905   3.42053e+00  2.33492e-01  0.00000e+00 0.00000e+00 4.52459e+01 3.905   1.53209e+01 183.905 0.8373 
1 1 1 -14 65  9  o 18 3.79978e+00 1.20206e+00 6.29985e+01 145.545 -3.23466e+00 2.21938e+00  0.00000e+00 0.00000e+00 6.00749e+01 145.545 2.92364e+00 325.545 0.8605 
1 1 1 -14 65  10 o 3  7.12537e+00 1.32505e+00 1.51077e+02 306.541 1.02805e+01  -1.38727e+01 0.00000e+00 0.00000e+00 1.08944e+02 306.541 4.21328e+01 126.541 0.9706 
1 1 1 -14 65  11 o 11 4.67779e+00 1.19609e+00 5.76930e+01 139.613 -4.32799e+00 3.68166e+00  0.00000e+00 0.00000e+00 1.01654e+02 139.613 4.39613e+01 139.613 0.9071 
1 1 1 -14 66  1  o 6  3.11813e+00 1.02860e+00 4.31944e+01 339.869 1.95382e+00  -7.16196e-01 0.00000e+00 0.00000e+00 4.07791e+01 339.869 2.41524e+00 159.869 0.7106 
1 1 1 -14 66  2  o 7  6.00671e+00 1.29175e+00 1.00578e+02 267.460 -3.50684e-01 -7.90559e+00 0.00000e+00 0.00000e+00 1.12008e+02 267.460 1.14303e+01 267.460 0.9345 
1 1 1 -14 66  3  o 12 1.09968e+01 1.02817e+00 2.14363e+02 299.897 1.84792e+01  -3.21398e+01 0.00000e+00 0.00000e+00 1.96158e+02 299.897 1.82047e+01 119.897 0.9864 
1 1 1 -14 66  4  o 1  6.28245e+00 1.20073e+00 1.12929e+02 145.096 -8.32042e+00 5.80535e+00  0.00000e+00 0.00000e+00 1.12615e+02 145.096 3.14104e-01 325.096 0.9494 
1 1 1 -14 66  5  o 5  6.08606e+00 1.17166e+00 1.11835e+02 318.964 7.17785e+00  -6.24751e+00 0.00000e+00 0.00000e+00 1.05679e+02 318.964 6.15677e+00 138.964 0.9459 
1 1 1 -14 66  6  o 10 4.17839e+00 1.26883e+00 8.83087e+01 162.827 -4.96499e+00 1.53431e+00  0.00000e+00 0.00000e+00 5.32967e+01 162.827 3.50120e+01 342.827 0.8978 
1 1 1 -14 66  7  o 7  4.55001e+00 1.34442e+00 5.65977e+01 129.921 -2.32043e+00 2.77315e+00  0.00000e+00 0.00000e+00 8.87340e+01 129.921 3.21363e+01 129.921 0.8469 
1 1 1 -14 66  8  o 6  3.76782e+00 1.13150e+00 6.35427e+01 85.813  3.06037e-01  4.18039e+00  0.00000e+00 0.00000e+00 6.00276e+01 85.813  3.51511e+00 265.813 0.8705 
1 1 1 -14 66  9  o 12 4.32588e+00 1.29029e+00 8.89721e+01 287.500 1.85275e+00  -5.87618e+00 0.00000e+00 0.00000e+00 5.99576e+01 287.500 2.90145e+01 107.500 0.9148 
1 1 1 -14 66  10 o 6  7.94794e+00 1.37788e+00 9.65993e+01 170.075 -1.22290e+01 2.13983e+00  0.00000e+00 0.00000e+00 1.89875e+02 170.075 9.32759e+01 170.075 0.9588 
1 1 1 -14 66  11 o 15 4.06672e+00 1.21594e+00 5.42911e+01 281.540 8.93095e-01  -4.37425e+00 0.00000e+00 0.00000e+00 7.99644e+01 281.540 2.56733e+01 281.540 0.8793 
1 1 1 -14 67  1  o 1  5.36644e+00 1.35626e+00 9.80737e+01 157.868 -6.22003e+00 2.52978e+00  0.00000e+00 0.00000e+00 8.94422e+01 157.868 8.63153e+00 337.868 0.9222 
1 1 1 -14 67  2  o 3  1.71721e+01 9.09803e-01 2.66295e+02 330.874 6.29405e+01  -3.50689e+01 0.00000e+00 0.00000e+00 3.79400e+02 330.874 1.13105e+02 330.874 0.9930 
1 1 1 -14 67  3  o 3  3.28780e+00 1.05211e+00 3.37412e+01 178.253 -1.74489e+00 5.32063e-02  0.00000e+00 0.00000e+00 4.72794e+01 178.253 1.35382e+01 178.253 0.6513 
1 1 1 -14 67  4  o 19 5.90295e+00 1.29829e+00 9.06536e+01 135.303 -5.25515e+00 5.19986e+00  0.00000e+00 0.00000e+00 1.16834e+02 135.303 2.61800e+01 135.303 0.9297 
1 1 1 -14 67  5  o 18 3.97011e+00 1.17207e+00 3.20426e+01 193.463 -1.80966e+00 -4.33238e-01 0.00000e+00 0.00000e+00 6.89735e+01 193.463 3.69309e+01 193.463 0.6735 
1 1 1 -14 67  6  o 3  3.53552e+00 1.10907e+00 8.36614e+01 282.514 1.03070e+00  -4.64376e+00 0.00000e+00 0.00000e+00 3.47566e+01 282.514 4.89049e+01 102.514 0.8874 
1 1 1 -14 67  7  o 5  5.90926e+00 1.53058e+00 1.05155e+02 308.816 5.00990e+00  -6.22746e+00 0.00000e+00 0.00000e+00 1.03218e+02 308.816 1.93714e+00 128.816 0.9352 
1 1 1 -14 67  8  o 14 3.20166e+00 1.05860e+00 6.25023e+01 76.055  8.88226e-01  3.57718e+00  0.00000e+00 0.00000e+00 4.00384e+01 76.055  2.24639e+01 256.055 0.8503 
1 1 1 -14 67  9  o 15 5.10682e+00 1.37132e+00 5.88973e+01 210.331 -4.07140e+00 -2.38210e+00 0.00000e+00 0.00000e+00 1.11426e+02 210.331 5.25286e+01 210.331 0.8864 
1 1 1 -14 67  10 o 2  4.34187e+00 1.27856e+00 1.01180e+02 305.201 4.50300e+00  -6.38315e+00 0.00000e+00 0.00000e+00 5.11715e+01 305.201 5.00088e+01 125.201 0.9336 
1 1 1 -14 67  11 o 14 2.95831e+00 1.00709e+00 4.42294e+01 52.982  1.89303e+00  2.51054e+00  0.00000e+00 0.00000e+00 4.68453e+01 52.982  2.61591e+00 52.982  0.8201 
1 1 1 -14 68  1  o 2  3.69967e+00 1.12344e+00 3.14842e+01 198.790 -1.65908e+00 -5.64477e-01 0.00000e+00 0.00000e+00 5.99865e+01 198.790 2.85023e+01 198.790 0.6526 
1 1 1 -14 68  2  o 5  2.94819e+00 9.71200e-01 2.06553e+01 20.711  9.41655e-01  3.56034e-01  0.00000e+00 0.00000e+00 2.94327e+01 20.711  8.77741e+00 20.711  0.4488 
1 1 1 -14 68  3  o 3  4.56305e+00 1.24766e+00 3.70253e+01 159.002 -2.16098e+00 8.29426e-01  0.00000e+00 0.00000e+00 9.12773e+01 159.002 5.42520e+01 159.002 0.7432 
1 1 1 -14 68  4  o 19 3.91008e+00 1.15543e+00 1.01564e+02 285.956 1.54031e+00  -5.38729e+00 0.00000e+00 0.00000e+00 3.23072e+01 285.956 6.92572e+01 105.956 0.9057 
1 1 1 -14 68  5  o 8  3.78692e+00 1.13298e+00 7.89593e+01 166.806 -4.49207e+00 1.05310e+00  0.00000e+00 0.00000e+00 4.74212e+01 166.806 3.15381e+01 346.806 0.8836 
1 1 1 -14 68  6  o 12 6.34219e+00 1.32859e+00 1.32017e+02 326.158 9.93469e+00  -6.66110e+00 0.00000e+00 0.00000e+00 9.70781e+01 326.158 3.49385e+01 146.159 0.9572 
1 1 1 -14 68  7  o 8  4.55547e+00 1.37868e+00 1.17361e+02 99.340  -1.20506e+00 7.32666e+00  0.00000e+00 0.00000e+00 4.23563e+01 99.340  7.50044e+01 279.340 0.9300 
1 1 1 -14 68  8  o 17 4.75611e+00 1.41473e+00 6.41758e+01 53.208  2.54008e+00  3.39634e+00  0.00000e+00 0.00000e+00 9.20519e+01 53.208  2.78761e+01 53.208  0.8722 
1 1 1 -14 68  9  o 19 4.21850e+00 1.13192e+00 3.86753e+01 306.644 1.95430e+00  -2.62729e+00 0.00000e+00 0.00000e+00 9.27918e+01 306.644 5.41165e+01 306.644 0.8284 
1 1 1 -14 68  10 o 3  5.50590e+00 1.38390e+00 1.49698e+02 136.256 -9.43709e+00 9.03211e+00  0.00000e+00 0.00000e+00 4.91147e+01 136.256 1.00584e+02 316.256 0.9609 
1 1 1 -14 68  11 o 10 5.93829e+00 1.40945e+00 7.33136e+01 261.443 -1.11933e+00 -7.43872e+00 0.00000e+00 0.00000e+00 1.34171e+02 261.443 6.08573e+01 261.443 0.9309 
1 1 1 -14 69  1  o 18 6.07964e+00 1.39018e+00 8.42673e+01 292.564 2.45420e+00  -5.90631e+00 0.00000e+00 0.00000e+00 1.27146e+02 292.564 4.28787e+01 292.564 0.9181 
1 1 1 -14 69  2  o 4  4.68832e+00 1.21741e+00 6.46209e+01 155.268 -4.01481e+00 1.84933e+00  0.00000e+00 0.00000e+00 9.11767e+01 155.268 2.65558e+01 155.268 0.8779 
1 1 1 -14 69  3  o 10 4.47074e+00 1.19605e+00 6.72442e+01 235.078 -2.36949e+00 -3.39385e+00 0.00000e+00 0.00000e+00 7.96485e+01 235.078 1.24043e+01 235.078 0.8687 
1 1 1 -14 69  4  o 4  1.02910e+01 1.03761e+00 1.80048e+02 251.463 -9.54851e+00 -2.84765e+01 0.00000e+00 0.00000e+00 2.02364e+02 251.463 2.23158e+01 251.463 0.9832 
1 1 1 -14 69  5  o 10 6.05919e+00 1.22010e+00 1.03287e+02 79.542  1.69455e+00  9.18057e+00  0.00000e+00 0.00000e+00 1.12899e+02 79.542  9.61224e+00 79.542  0.9448 
1 1 1 -14 69  6  o 18 4.59613e+00 1.25068e+00 8.97260e+01 261.304 -9.51911e-01 -6.22364e+00 0.00000e+00 0.00000e+00 6.92407e+01 261.304 2.04853e+01 81.304  0.9167 
1 1 1 -14 69  7  o 12 3.90882e+00 1.26789e+00 6.29321e+01 27.072  3.46183e+00  1.76941e+00  0.00000e+00 0.00000e+00 6.36370e+01 27.072  7.04866e-01 27.072  0.8591 
1 1 1 -14 69  8  o 2  4.56688e+00 1.38501e+00 2.94397e+01 0.633   1.99914e+00  2.21043e-02  0.00000e+00 0.00000e+00 9.05299e+01 0.633   6.10902e+01 0.633   0.6977 
1 1 1 -14 69  9  o 19 3.85062e+00 1.18943e+00 7.29086e+01 359.188 5.01936e+00  -7.10946e-02 0.00000e+00 0.00000e+00 5.65506e+01 359.188 1.63580e+01 179.189 0.8938 
1 1 1 -14 69  10 o 11 8.29048e+00 1.47326e+00 1.58717e+02 195.312 -1.92927e+01 -5.28230e+00 0.00000e+00 0.00000e+00 1.44870e+02 195.312 1.38473e+01 15.312  0.9747 
1 1 1 -14 69  11 o 12 4.03974e+00 1.19924e+00 5.88514e+01 340.725 4.92039e+00  -1.72071e+00 0.00000e+00 0.00000e+00 7.72910e+01 340.725 1.84397e+01 340.725 0.8981 
1 1 1 -14 70  1  o 10 8.98825e+00 1.24229e+00 1.45706e+02 223.699 -1.26655e+01 -1.21031e+01 0.00000e+00 0.00000e+00 1.84806e+02 223.699 3.91000e+01 223.699 0.9710 
1 1 1 -14 70  2  o 7  5.43095e+00 1.26743e+00 1.07656e+02 98.646  -1.21008e+00 7.95808e+00  0.00000e+00 0.00000e+00 8.46466e+01 98.646  2.30094e+01 278.646 0.9357 
1 1 1 -14 70  3  o 3  4.60620e+00 1.23128e+00 9.18225e+01 337.977 5.60482e+00  -2.26711e+00 0.00000e+00 0.00000e+00 6.72263e+01 337.977 2.45962e+01 157.977 0.9131 
1 1 1 -14 70  4  o 1  9.24312e+00 1.16275e+00 1.62460e+02 170.611 -2.26975e+01 3.75320e+00  0.00000e+00 0.00000e+00 1.79135e+02 170.611 1.66753e+01 170.611 0.9780 
1 1 1 -14 70  5  o 15 1.45770e+01 9.04890e-01 2.47181e+02 66.647  2.74039e+01  6.34694e+01  0.00000e+00 0.00000e+00 2.99188e+02 66.647  5.20070e+01 66.647  0.9927 
1 1 1 -14 70  6  o 11 4.67370e+00 1.26853e+00 1.17333e+02 193.777 -8.02011e+00 -1.96649e+00 0.00000e+00 0.00000e+00 4.79189e+01 193.777 6.94145e+01 13.777  0.9373 
1 1 1 -14 70  7  o 14 7.81577e+00 1.63478e+00 1.20113e+02 327.910 9.52234e+00  -5.97097e+00 0.00000e+00 0.00000e+00 1.61003e+02 327.910 4.08904e+01 327.910 0.9544 
1 1 1 -14 70  8  o 12 3.36655e+00 1.14075e+00 4.96563e+01 292.888 1.23130e+00  -2.91659e+00 0.00000e+00 0.00000e+00 5.44651e+01 292.888 4.80875e+00 292.888 0.8215 
1 1 1 -14 70  9  o 11 1.03705e+01 1.30404e+00 2.14153e+02 139.284 -2.89602e+01 2.49234e+01  0.00000e+00 0.00000e+00 1.70703e+02 139.284 4.34496e+01 319.284 0.9868 
1 1 1 -14 70  10 o 12 2.96954e+00 1.00988e+00 2.04619e+01 59.756  7.50164e-01  1.28662e+00  0.00000e+00 0.00000e+00 4.57388e+01 59.756  2.52770e+01 59.756  0.5935 
1 1 1 -14 70  11 o 3  3.21076e+00 1.07194e+00 5.49899e+01 120.074 -2.21645e+00 3.82757e+00  0.00000e+00 0.00000e+00 5.07774e+01 120.074 4.21247e+00 300.074 0.8780 
1 1 1 -14 71  1  o 18 1.11273e+01 1.11579e+00 1.95374e+02 162.111 -3.19151e+01 1.03017e+01  0.00000e+00 0.00000e+00 2.19593e+02 162.111 2.42193e+01 162.111 0.9850 
1 1 1 -14 71  2  o 11 4.56952e+00 1.24376e+00 1.19398e+02 47.633  5.20782e+00  5.70996e+00  0.00000e+00 0.00000e+00 4.18886e+01 47.633  7.75094e+01 227.633 0.9329 
1 1 1 -14 71  3  o 19 5.98177e+00 1.14041e+00 1.04753e+02 302.791 5.20806e+00  -8.08414e+00 0.00000e+00 0.00000e+00 1.09311e+02 302.791 4.55826e+00 302.791 0.9465 
1 1 1 -14 71  4  o 11 1.14979e+01 9.86089e-01 2.17688e+02 196.828 -4.17741e+01 -1.26349e+01 0.00000e+00 0.00000e+00 2.11699e+02 196.828 5.98884e+00 16.828  0.9885 
1 1 1 -14 71  5  o 4  8.72254e+00 1.18780e+00 1.43413e+02 30.589  1.72036e+01  1.01698e+01  0.00000e+00 0.00000e+00 1.77502e+02 30.589  3.40887e+01 30.589  0.9747 
1 1 1 -14 71  6  o 10 9.76069e+00 1.17477e+00 1.38851e+02 253.004 -6.32932e+00 -2.07080e+01 0.00000e+00 0.00000e+00 2.20664e+02 253.004 8.18134e+01 253.004 0.9766 
1 1 1 -14 71  7  o 18 4.52830e+00 1.26157e+00 8.96949e+01 350.060 6.22668e+00  -1.09119e+00 0.00000e+00 0.00000e+00 6.67759e+01 350.060 2.29190e+01 170.060 0.9171 
1 1 1 -14 71  8  o 15 4.47200e+00 1.35958e+00 9.61564e+01 27.946  6.12016e+00  3.24671e+00  0.00000e+00 0.00000e+00 5.94964e+01 27.946  3.66600e+01 207.946 0.9247 
1 1 1 -14 71  9  o 16 3.85772e+00 1.21904e+00 1.12382e+02 177.369 -8.10164e+00 3.72315e-01  0.00000e+00 0.00000e+00 2.34023e+01 177.369 8.89802e+01 357.369 0.9362 
1 1 1 -14 71  10 o 14 5.02700e+00 1.38935e+00 9.55843e+01 277.808 1.09440e+00  -7.98093e+00 0.00000e+00 0.00000e+00 8.10697e+01 277.808 1.45145e+01 97.808  0.9357 
1 1 1 -14 71  11 o 10 3.27681e+00 1.07313e+00 4.23711e+01 102.959 -7.52169e-01 3.26878e+00  0.00000e+00 0.00000e+00 6.00304e+01 102.959 1.76593e+01 102.959 0.8331 
1 1 1 -14 72  1  o 6  5.08857e+00 1.27626e+00 7.76395e+01 160.886 -5.23013e+00 1.81254e+00  0.00000e+00 0.00000e+00 9.65831e+01 160.886 1.89436e+01 160.886 0.9045 
1 1 1 -14 72  2  o 7  1.10583e+01 1.03007e+00 1.90789e+02 331.110 3.08951e+01  -1.70477e+01 0.00000e+00 0.00000e+00 2.21565e+02 331.110 3.07764e+01 331.110 0.9857 
1 1 1 -14 72  3  o 1  1.09078e+01 1.06056e+00 2.30582e+02 212.839 -3.51048e+01 -2.26575e+01 0.00000e+00 0.00000e+00 1.76789e+02 212.839 5.37926e+01 32.839  0.9880 
1 1 1 -14 72  4  o 4  7.47367e+00 1.20990e+00 7.96339e+01 300.042 4.60651e+00  -7.96532e+00 0.00000e+00 0.00000e+00 1.86854e+02 300.042 1.07220e+02 300.042 0.9440 
1 1 1 -14 72  5  o 7  6.04595e+00 1.28857e+00 1.42693e+02 55.986  7.16368e+00  1.06149e+01  0.00000e+00 0.00000e+00 7.63879e+01 55.986  6.63056e+01 235.986 0.9601 
1 1 1 -14 72  6  o 18 4.90536e+00 1.25867e+00 7.43465e+01 92.679  -2.69304e-01 5.75589e+00  0.00000e+00 0.00000e+00 9.36951e+01 92.679  1.93486e+01 92.679  0.9085 
1 1 1 -14 72  7  o 12 3.51782e+00 1.11540e+00 4.61701e+01 208.919 -2.60558e+00 -1.43946e+00 0.00000e+00 0.00000e+00 6.09385e+01 208.919 1.47684e+01 208.919 0.8083 
1 1 1 -14 72  8  o 7  4.32274e+00 1.33702e+00 4.59336e+01 298.850 1.61780e+00  -2.93667e+00 0.00000e+00 0.00000e+00 8.95788e+01 298.850 4.36451e+01 298.850 0.8330 
1 1 1 -14 72  9  o 3  4.50377e+00 1.28686e+00 9.26837e+01 52.690  4.42099e+00  5.80127e+00  0.00000e+00 0.00000e+00 6.45441e+01 52.690  2.81396e+01 232.690 0.9287 
1 1 1 -14 72  10 o 11 5.22679e+00 1.38520e+00 6.51392e+01 156.377 -5.59951e+00 2.44904e+00  0.00000e+00 0.00000e+00 1.14252e+02 156.377 4.91132e+01 156.377 0.9141 
1 1 1 -14 72  11 o 7  4.23891e+00 1.27083e+00 9.14254e+01 243.122 -3.71383e+00 -7.32732e+00 0.00000e+00 0.00000e+00 5.75315e+01 243.122 3.38939e+01 63.122  0.9370 
1 1 1 -14 73  1  o 3  1.13547e+01 1.05952e+00 1.61585e+02 83.351  3.53144e+00  3.02964e+01  0.00000e+00 0.00000e+00 2.61045e+02 83.351  9.94598e+01 83.351  0.9835 
1 1 1 -14 73  2  o 18 1.16298e+01 9.79115e-01 1.59384e+02 222.385 -2.50468e+01 -2.28585e+01 0.00000e+00 0.00000e+00 2.73938e+02 222.385 1.14554e+02 222.385 0.9851 
1 1 1 -14 73  3  o 10 5.55856e+00 1.27575e+00 6.61161e+01 72.603  1.62187e+00  5.17647e+00  0.00000e+00 0.00000e+00 1.23459e+02 72.603  5.73426e+01 72.603  0.9024 
1 1 1 -14 73  4  f 0  3.89251e+00 1.14803e+00 1.01682e+02 129.101 -4.27532e+00 5.26065e+00  0.00000e+00 0.00000e+00 3.39962e+01 129.101 6.76860e+01 309.101 0.9230 
1 1 1 -14 73  5  o 10 4.66763e+00 1.24049e+00 1.06461e+02 318.217 5.65032e+00  -5.04890e+00 0.00000e+00 0.00000e+00 5.75938e+01 318.217 4.88673e+01 138.217 0.9315 
1 1 1 -14 73  6  o 13 3.86892e+00 1.16234e+00 8.33997e+01 70.281  1.82561e+00  5.09334e+00  0.00000e+00 0.00000e+00 4.81786e+01 70.281  3.52211e+01 250.281 0.9021 
1 1 1 -14 73  7  o 14 4.21164e+00 1.17397e+00 3.45858e+01 212.948 -2.25261e+00 -1.45998e+00 0.00000e+00 0.00000e+00 8.97192e+01 212.948 5.51334e+01 212.948 0.7836 
1 1 1 -14 73  8  o 18 4.24151e+00 1.30761e+00 6.95117e+01 287.863 1.55227e+00  -4.81654e+00 0.00000e+00 0.00000e+00 7.32803e+01 287.863 3.76861e+00 287.863 0.8948 
1 1 1 -14 73  9  o 8  3.52750e+00 1.17868e+00 8.31228e+01 118.218 -2.71131e+00 5.05285e+00  0.00000e+00 0.00000e+00 3.72606e+01 118.218 4.58622e+01 298.218 0.9080 
1 1 1 -14 73  10 o 4  3.32273e+00 1.07845e+00 7.10419e+01 173.823 -5.80517e+00 6.28277e-01  0.00000e+00 0.00000e+00 4.24431e+01 173.823 2.85988e+01 353.823 0.9098 
1 1 1 -14 73  11 o 3  2.63030e+00 8.97582e-01 4.06541e+01 344.945 3.30600e+00  -8.89254e-01 0.00000e+00 0.00000e+00 4.18957e+01 344.945 1.24163e+00 344.945 0.8370 
1 1 1 -14 74  1  o 11 5.43959e+00 1.24234e+00 1.21081e+02 155.204 -9.03592e+00 4.17442e+00  0.00000e+00 0.00000e+00 7.41161e+01 155.204 4.69649e+01 335.204 0.9484 
1 1 1 -14 74  2  f 0  3.75892e+00 1.11251e+00 3.42618e+01 229.680 -1.37883e+00 -1.62470e+00 0.00000e+00 0.00000e+00 6.78151e+01 229.680 3.35533e+01 229.680 0.7181 
1 1 1 -14 74  3  o 11 3.97115e+00 1.15857e+00 3.85510e+01 73.614  7.03972e-01  2.39411e+00  0.00000e+00 0.00000e+00 7.61683e+01 73.614  3.76172e+01 73.614  0.7645 
1 1 1 -14 74  4  o 13 8.64170e+00 1.15060e+00 1.77549e+02 114.573 -1.04431e+01 2.28378e+01  0.00000e+00 0.00000e+00 1.42176e+02 114.573 3.53733e+01 294.573 0.9799 
1 1 1 -14 74  5  o 11 7.84456e+00 1.23351e+00 1.49933e+02 262.117 -2.59714e+00 -1.87573e+01 0.00000e+00 0.00000e+00 1.38086e+02 262.117 1.18462e+01 82.117  0.9732 
1 1 1 -14 74  6  o 4  7.73984e+00 1.33015e+00 1.29175e+02 61.061  7.20594e+00  1.30324e+01  0.00000e+00 0.00000e+00 1.52582e+02 61.061  2.34074e+01 61.061  0.9658 
1 1 1 -14 74  7  o 2  5.27071e+00 1.31198e+00 9.65125e+01 109.800 -2.96711e+00 8.24143e+00  0.00000e+00 0.00000e+00 9.02610e+01 109.800 6.25151e+00 289.800 0.9411 
1 1 1 -14 74  8  o 5  6.50840e+00 1.56507e+00 1.28612e+02 318.378 8.60850e+00  -7.64891e+00 0.00000e+00 0.00000e+00 1.05331e+02 318.378 2.32810e+01 138.378 0.9555 
1 1 1 -14 74  9  o 15 4.10464e+00 1.31388e+00 6.83464e+01 35.203  4.23758e+00  2.98956e+00  0.00000e+00 0.00000e+00 7.00857e+01 35.203  1.73931e+00 35.203  0.8975 
1 1 1 -14 74  10 o 7  6.07418e+00 1.50349e+00 7.44622e+01 183.209 -7.05874e+00 -3.95709e-01 0.00000e+00 0.00000e+00 1.36721e+02 183.209 6.22588e+01 183.209 0.9263 
1 1 1 -14 75  1  o 12 7.42878e+00 1.29742e+00 1.15810e+02 41.220  9.91175e+00  8.68333e+00  0.00000e+00 0.00000e+00 1.54345e+02 41.220  3.85352e+01 41.220  0.9613 
1 1 1 -14 75  2  o 3  4.77781e+00 1.11940e+00 7.45576e+01 49.224  4.06756e+00  4.71639e+00  0.00000e+00 0.00000e+00 9.08582e+01 49.224  1.63006e+01 49.224  0.9158 
1 1 1 -14 75  3  o 15 4.68330e+00 1.25851e+00 6.47940e+01 242.224 -2.14302e+00 -4.06866e+00 0.00000e+00 0.00000e+00 9.14641e+01 242.224 2.66701e+01 242.224 0.8832 
1 1 1 -14 75  4  o 9  5.12134e+00 1.30209e+00 7.23438e+01 354.806 5.68281e+00  -5.16553e-01 0.00000e+00 0.00000e+00 1.03110e+02 354.806 3.07662e+01 354.806 0.9075 
1 1 1 -14 75  5  o 3  5.27106e+00 1.19530e+00 9.09656e+01 194.503 -7.59652e+00 -1.96504e+00 0.00000e+00 0.00000e+00 9.47101e+01 194.503 3.74454e+00 194.503 0.9339 
1 1 1 -14 75  6  o 19 2.23614e+00 7.85365e-01 3.58087e+01 272.620 8.56324e-02  -1.87115e+00 0.00000e+00 0.00000e+00 2.11385e+01 272.620 1.46702e+01 92.620  0.6758 
1 1 1 -14 75  7  o 6  3.46032e+00 1.09113e+00 5.74362e+01 13.146  4.03132e+00  9.41535e-01  0.00000e+00 0.00000e+00 5.57317e+01 13.146  1.70447e+00 193.146 0.8687 
1 1 1 -14 75  8  o 5  3.45566e+00 1.15399e+00 9.59044e+01 288.293 1.99607e+00  -6.03809e+00 0.00000e+00 0.00000e+00 2.33528e+01 288.293 7.25516e+01 108.293 0.9176 
1 1 1 -14 75  9  o 18 5.10879e+00 1.37701e+00 4.27730e+01 189.510 -3.70489e+00 -6.20650e-01 0.00000e+00 0.00000e+00 1.21032e+02 189.510 7.82592e+01 189.510 0.8535 
1 1 1 -14 75  10 o 6  3.48203e+00 1.11376e+00 5.46614e+01 104.038 -1.07253e+00 4.28947e+00  0.00000e+00 0.00000e+00 6.00606e+01 104.038 5.39921e+00 104.038 0.8780 
1 1 1 -14 76  1  o 1  5.36350e+00 1.30604e+00 1.14223e+02 27.796  7.93337e+00  4.18206e+00  0.00000e+00 0.00000e+00 7.69728e+01 27.796  3.72504e+01 207.796 0.9425 
1 1 1 -14 76  2  o 11 9.66926e+00 1.12780e+00 1.70303e+02 188.221 -2.69488e+01 -3.89359e+00 0.00000e+00 0.00000e+00 1.88404e+02 188.221 1.81010e+01 188.221 0.9815 
1 1 1 -14 76  3  o 5  4.80538e+00 1.26887e+00 8.74113e+01 282.522 1.43864e+00  -6.47739e+00 0.00000e+00 0.00000e+00 7.97950e+01 282.522 7.61633e+00 102.522 0.9212 
1 1 1 -14 76  4  o 9  5.61634e+00 1.29511e+00 5.70404e+01 86.785  2.77320e-01  4.93705e+00  0.00000e+00 0.00000e+00 1.32057e+02 86.785  7.50167e+01 86.785  0.8921 
1 1 1 -14 76  5  o 6  4.46382e+00 1.20820e+00 1.22287e+02 190.522 -9.16312e+00 -1.70197e+00 0.00000e+00 0.00000e+00 3.67405e+01 190.522 8.55462e+01 10.522  0.9447 
1 1 1 -14 76  6  o 18 2.59657e+00 8.94848e-01 6.19066e+01 342.404 3.62145e+00  -1.14848e+00 0.00000e+00 0.00000e+00 2.17699e+01 342.404 4.01368e+01 162.404 0.8553 
1 1 1 -14 76  7  o 8  6.35342e+00 1.33271e+00 1.04816e+02 308.107 6.90264e+00  -8.80087e+00 0.00000e+00 0.00000e+00 1.23373e+02 308.107 1.85576e+01 308.107 0.9542 
1 1 1 -14 76  8  o 2  4.12439e+00 1.12198e+00 4.86621e+01 165.965 -4.00207e+00 1.00041e+00  0.00000e+00 0.00000e+00 8.59772e+01 165.965 3.73151e+01 165.965 0.8682 
1 1 1 -14 76  9  o 3  3.74705e+00 1.24103e+00 7.25781e+01 229.126 -3.59470e+00 -4.15370e+00 0.00000e+00 0.00000e+00 5.46098e+01 229.126 1.79683e+01 49.126  0.9037 
1 1 1 -14 76  10 f 0  3.52229e+00 1.10544e+00 3.64272e+01 35.764  2.61577e+00  1.88407e+00  0.00000e+00 0.00000e+00 7.26293e+01 35.764  3.62021e+01 35.764  0.8253 
1 1 1 -14 77  1  o 4  6.98187e+00 1.26974e+00 1.12218e+02 326.531 1.03141e+01  -6.81867e+00 0.00000e+00 0.00000e+00 1.40891e+02 326.531 2.86734e+01 326.531 0.9587 
1 1 1 -14 77  2  o 16 5.08300e+00 1.22551e+00 6.66125e+01 71.400  1.75035e+00  5.20095e+00  0.00000e+00 0.00000e+00 1.06956e+02 71.400  4.03435e+01 71.400  0.9036 
1 1 1 -14 77  3  o 5  4.09584e+00 1.09268e+00 5.80816e+01 51.571  2.65701e+00  3.34883e+00  0.00000e+00 0.00000e+00 7.69967e+01 51.571  1.89151e+01 51.571  0.8733 
1 1 1 -14 77  4  o 12 6.53061e+00 1.22859e+00 1.63376e+02 182.578 -1.71494e+01 -7.72100e-01 0.00000e+00 0.00000e+00 7.57613e+01 182.578 8.76150e+01 2.578   0.9704 
1 1 1 -14 77  5  o 2  8.78336e+00 1.16183e+00 1.36684e+02 11.863  2.07665e+01  4.36204e+00  0.00000e+00 0.00000e+00 1.86571e+02 11.863  4.98868e+01 11.863  0.9761 
1 1 1 -14 77  6  o 8  6.35789e+00 1.24531e+00 1.11539e+02 186.899 -1.28585e+01 -1.55575e+00 0.00000e+00 0.00000e+00 1.18513e+02 186.899 6.97429e+00 186.899 0.9606 
1 1 1 -14 77  7  o 10 5.09309e+00 1.28454e+00 6.82122e+01 39.056  4.77142e+00  3.87153e+00  0.00000e+00 0.00000e+00 1.07074e+02 39.056  3.88621e+01 39.056  0.9145 
1 1 1 -14 77  8  o 12 4.66345e+00 1.22338e+00 6.80410e+01 200.336 -5.97856e+00 -2.21585e+00 0.00000e+00 0.00000e+00 9.28705e+01 200.336 2.48296e+01 200.336 0.9178 
1 1 1 -14 77  9  o 2  3.83241e+00 1.25606e+00 6.48654e+01 214.728 -4.23442e+00 -2.93515e+00 0.00000e+00 0.00000e+00 6.42004e+01 214.728 6.65012e-01 34.728  0.8968 
1 1 1 -14 77  10 o 9  2.89754e+00 1.01089e+00 7.37033e+01 25.883  5.44487e+00  2.64191e+00  0.00000e+00 0.00000e+00 2.55452e+01 25.883  4.81581e+01 205.883 0.9132 
1 1 1 -14 78  1  o 9  7.64495e+00 1.24811e+00 1.45623e+02 191.181 -1.74617e+01 -3.45154e+00 0.00000e+00 0.00000e+00 1.35171e+02 191.181 1.04521e+01 11.181  0.9715 
1 1 1 -14 78  2  o 19 6.31095e+00 1.19670e+00 7.04790e+01 68.157  2.74826e+00  6.85629e+00  0.00000e+00 0.00000e+00 1.51181e+02 68.157  8.07018e+01 68.157  0.9296 
1 1 1 -14 78  3  o 16 7.20666e+00 1.24803e+00 1.54335e+02 200.739 -1.64975e+01 -6.24664e+00 0.00000e+00 0.00000e+00 1.09927e+02 200.739 4.44082e+01 20.739  0.9712 
1 1 1 -14 78  4  o 18 2.80429e+00 9.38423e-01 1.03860e+01 234.140 -3.58101e-01 -4.95423e-01 0.00000e+00 0.00000e+00 2.05278e+01 234.140 1.01418e+01 234.140 0.2922 
1 1 1 -14 78  5  o 10 6.27744e+00 1.27338e+00 9.18578e+01 314.618 7.00806e+00  -7.10206e+00 0.00000e+00 0.00000e+00 1.32576e+02 314.618 4.07177e+01 314.618 0.9485 
1 1 1 -14 78  6  o 18 2.53196e+00 8.67675e-01 3.41951e+01 243.620 -9.56046e-01 -1.92761e+00 0.00000e+00 0.00000e+00 3.45723e+01 243.620 3.77194e-01 243.620 0.7212 
1 1 1 -14 78  7  o 4  4.08466e+00 1.22656e+00 8.96226e+01 135.543 -4.80415e+00 4.71387e+00  0.00000e+00 0.00000e+00 5.21332e+01 135.543 3.74894e+01 315.543 0.9224 
1 1 1 -14 78  8  o 14 3.13802e+00 1.01273e+00 3.86930e+01 221.062 -2.19000e+00 -1.90788e+00 0.00000e+00 0.00000e+00 5.59778e+01 221.062 1.72848e+01 221.062 0.8027 
1 1 1 -14 78  9  o 5  4.61401e+00 1.42514e+00 3.94644e+01 272.351 1.32223e-01  -3.22007e+00 0.00000e+00 0.00000e+00 1.03487e+02 272.351 6.40226e+01 272.351 0.8252 
1 1 1 -14 78  10 o 11 3.24440e+00 1.09861e+00 5.95644e+01 147.893 -4.11592e+00 2.58257e+00  0.00000e+00 0.00000e+00 4.87245e+01 147.893 1.08399e+01 327.893 0.8900 
1 1 1 -14 79  1  o 13 3.77488e+00 1.14073e+00 8.90294e+01 309.893 3.70114e+00  -4.42758e+00 0.00000e+00 0.00000e+00 4.06223e+01 309.893 4.84072e+01 129.893 0.9086 
1 1 1 -14 79  2  o 16 9.65734e+00 1.22068e+00 1.51701e+02 75.315  6.00429e+00  2.29108e+01  0.00000e+00 0.00000e+00 2.05313e+02 75.315  5.36123e+01 75.315  0.9787 
1 1 1 -14 79  3  o 11 7.79975e+00 1.26122e+00 9.45779e+01 261.405 -1.80373e+00 -1.19332e+01 0.00000e+00 0.00000e+00 1.87367e+02 261.405 9.27890e+01 261.405 0.9576 
1 1 1 -14 79  4  o 6  3.47108e+00 1.08051e+00 4.34265e+01 99.204  -4.79016e-01 2.95633e+00  0.00000e+00 0.00000e+00 6.25686e+01 99.204  1.91421e+01 99.204  0.8096 
1 1 1 -14 79  5  o 4  3.67942e+00 1.07173e+00 4.59562e+01 248.131 -1.33452e+00 -3.32498e+00 0.00000e+00 0.00000e+00 7.12581e+01 248.131 2.53019e+01 248.131 0.8453 
1 1 1 -14 79  6  o 18 4.33794e+00 1.19672e+00 3.82213e+01 35.169  2.53082e+00  1.78326e+00  0.00000e+00 0.00000e+00 9.51958e+01 35.169  5.69744e+01 35.169  0.8168 
1 1 1 -14 79  7  o 14 3.07886e+00 1.00288e+00 2.07494e+01 276.034 1.69994e-01  -1.60826e+00 0.00000e+00 0.00000e+00 5.14965e+01 276.034 3.07471e+01 276.034 0.6238 
1 1 1 -14 79  8  o 2  2.79411e+00 9.39211e-01 2.24999e+01 342.165 1.65021e+00  -5.30949e-01 0.00000e+00 0.00000e+00 4.56206e+01 342.165 2.31207e+01 342.165 0.6488 
1 1 1 -14 79  9  o 7  5.23554e+00 1.48312e+00 1.14459e+02 194.005 -9.58271e+00 -2.39005e+00 0.00000e+00 0.00000e+00 7.18355e+01 194.005 4.26236e+01 14.005  0.9479 
1 1 1 -14 80  1  o 7  3.04442e+00 9.84448e-01 5.42511e+01 97.707  -4.49118e-01 3.31853e+00  0.00000e+00 0.00000e+00 4.15635e+01 97.707  1.26876e+01 277.707 0.8328 
1 1 1 -14 80  2  o 6  1.24296e+01 1.21313e+00 2.26974e+02 197.491 -4.57176e+01 -1.44065e+01 0.00000e+00 0.00000e+00 2.37520e+02 197.491 1.05463e+01 197.491 0.9895 
1 1 1 -14 80  3  o 18 4.22247e+00 1.18919e+00 5.52212e+01 346.360 4.12133e+00  -1.00012e+00 0.00000e+00 0.00000e+00 8.37635e+01 346.360 2.85422e+01 346.360 0.8722 
1 1 1 -14 80  4  o 13 6.29369e+00 1.27518e+00 1.13380e+02 124.941 -7.25372e+00 1.03820e+01  0.00000e+00 0.00000e+00 1.14382e+02 124.941 1.00179e+00 124.941 0.9597 
1 1 1 -14 80  5  o 13 4.16260e+00 1.17000e+00 5.05815e+01 232.346 -2.48008e+00 -3.21419e+00 0.00000e+00 0.00000e+00 8.52067e+01 232.346 3.46251e+01 232.346 0.8658 
1 1 1 -14 80  6  o 12 2.95460e+00 9.46756e-01 2.30232e+01 300.653 7.89525e-01  -1.33220e+00 0.00000e+00 0.00000e+00 4.45911e+01 300.653 2.15678e+01 300.653 0.6079 
1 1 1 -14 80  7  o 1  4.40854e+00 1.22203e+00 6.43209e+01 80.826  9.08810e-01  5.62710e+00  0.00000e+00 0.00000e+00 8.61276e+01 80.826  2.18068e+01 80.826  0.9074 
1 1 1 -14 80  8  o 14 3.27548e+00 1.05984e+00 3.99394e+01 193.277 -3.20609e+00 -7.56521e-01 0.00000e+00 0.00000e+00 6.21474e+01 193.277 2.22079e+01 193.277 0.8296 
1 1 1 -14 80  9  o 14 2.47254e+00 8.61429e-01 3.75796e+01 184.312 -2.87046e+00 -2.16458e-01 0.00000e+00 0.00000e+00 3.67089e+01 184.312 8.70703e-01 4.312   0.8006 
1 1 1 -14 81  1  o 7  4.36138e+00 1.16321e+00 5.29995e+01 211.373 -3.74537e+00 -2.28377e+00 0.00000e+00 0.00000e+00 9.15003e+01 211.373 3.85009e+01 211.373 0.8769 
1 1 1 -14 81  2  o 8  5.42026e+00 1.32266e+00 8.52559e+01 8.627   7.58828e+00  1.15122e+00  0.00000e+00 0.00000e+00 1.05561e+02 8.627   2.03051e+01 8.627   0.9324 
1 1 1 -14 81  3  o 3  3.00739e+00 9.49917e-01 2.26642e+01 256.979 -3.59704e-01 -1.55550e+00 0.00000e+00 0.00000e+00 4.75869e+01 256.979 2.49228e+01 256.979 0.6191 
1 1 1 -14 81  4  o 4  5.07842e+00 1.18469e+00 5.94923e+01 315.135 3.84054e+00  -3.82246e+00 0.00000e+00 0.00000e+00 1.13258e+02 315.135 5.37656e+01 315.135 0.9023 
1 1 1 -14 81  5  o 10 3.23769e+00 1.03613e+00 4.74485e+01 156.721 -3.08921e+00 1.32909e+00  0.00000e+00 0.00000e+00 5.42216e+01 156.721 6.77310e+00 156.721 0.8336 
1 1 1 -14 81  6  o 6  6.74157e+00 1.21487e+00 7.98974e+01 179.534 -1.02099e+01 8.30179e-02  0.00000e+00 0.00000e+00 1.61062e+02 179.534 8.11651e+01 179.534 0.9497 
1 1 1 -14 81  7  o 13 5.52931e+00 1.29398e+00 1.01629e+02 32.699  8.75037e+00  5.61737e+00  0.00000e+00 0.00000e+00 9.60065e+01 32.699  5.62253e+00 212.699 0.9506 
1 1 1 -14 81  8  o 11 3.87889e+00 1.13311e+00 6.42545e+01 167.211 -5.72188e+00 1.29883e+00  0.00000e+00 0.00000e+00 6.83651e+01 167.211 4.11065e+00 167.211 0.9102 
1 1 1 -14 81  9  o 5  5.30088e+00 1.38028e+00 1.21074e+02 38.812  9.10421e+00  7.32311e+00  0.00000e+00 0.00000e+00 6.91061e+01 38.812  5.19683e+01 218.812 0.9562 
1 1 1 -14 82  1  o 7  4.30012e+00 1.19486e+00 1.11596e+01 138.726 -6.87879e-01 6.03774e-01  0.00000e+00 0.00000e+00 5.63417e+01 138.726 4.51821e+01 138.726 0.4156 
1 1 1 -14 82  2  o 17 4.15065e+00 1.24883e+00 5.32162e+01 119.893 -2.00343e+00 3.48508e+00  0.00000e+00 0.00000e+00 8.22034e+01 119.893 2.89872e+01 119.893 0.8643 
1 1 1 -14 82  3  o 13 3.30490e+00 1.04938e+00 1.17746e+01 28.327  6.84299e-01  3.68869e-01  0.00000e+00 0.00000e+00 3.33565e+01 28.327  2.15819e+01 28.327  0.3620 
1 1 1 -14 82  4  o 11 6.09848e+00 1.30847e+00 8.66866e+01 342.176 8.55904e+00  -2.75191e+00 0.00000e+00 0.00000e+00 1.29995e+02 342.176 4.33081e+01 342.176 0.9426 
1 1 1 -14 82  5  o 1  1.22631e+01 9.77992e-01 1.82968e+02 141.275 -3.97154e+01 3.18471e+01  0.00000e+00 0.00000e+00 2.74318e+02 141.275 9.13494e+01 141.275 0.9901 
1 1 1 -14 82  6  o 18 2.79913e+00 9.33672e-01 1.11279e+02 263.370 -9.45472e-01 -8.13440e+00 0.00000e+00 0.00000e+00 1.26120e+01 83.370  1.23891e+02 83.370  0.9368 
1 1 1 -14 82  7  o 14 3.79141e+00 1.10414e+00 7.70644e+01 355.931 6.69692e+00  -4.76446e-01 0.00000e+00 0.00000e+00 5.43698e+01 355.931 2.26946e+01 175.931 0.9222 
1 1 1 -14 82  8  o 3  3.15106e+00 9.99688e-01 7.86873e+01 76.087  1.56260e+00  6.30822e+00  0.00000e+00 0.00000e+00 3.01151e+01 76.087  4.85723e+01 256.087 0.9195 
1 1 1 -14 82  9  o 2  3.36326e+00 1.07976e+00 4.80983e+01 287.576 1.31288e+00  -4.14481e+00 0.00000e+00 0.00000e+00 6.23802e+01 287.576 1.42818e+01 287.576 0.8757 
1 1 1 -14 83  1  o 19 3.04429e+00 1.00171e+00 5.19739e+01 94.748  -2.91434e-01 3.50880e+00  0.00000e+00 0.00000e+00 4.48517e+01 94.748  7.12220e+00 274.748 0.8422 
1 1 1 -14 83  2  f 0  3.30009e+00 1.05082e+00 1.63017e+01 206.921 -1.02331e+00 -5.19638e-01 0.00000e+00 0.00000e+00 4.55088e+01 206.921 2.92071e+01 206.921 0.4963 
1 1 1 -14 83  3  o 5  3.62967e+00 1.07927e+00 2.92563e+01 190.177 -2.15553e+00 -3.86937e-01 0.00000e+00 0.00000e+00 7.02110e+01 190.177 4.09547e+01 190.177 0.7266 
1 1 1 -14 83  4  o 14 4.25230e+00 1.18459e+00 7.08058e+01 209.553 -4.90072e+00 -2.77867e+00 0.00000e+00 0.00000e+00 7.44185e+01 209.553 3.61272e+00 209.553 0.9063 
1 1 1 -14 83  5  o 6  5.16677e+00 1.22681e+00 5.37018e+01 272.854 2.82481e-01  -5.66633e+00 0.00000e+00 0.00000e+00 1.22742e+02 272.854 6.90402e+01 272.854 0.9070 
1 1 1 -14 83  6  o 11 3.17374e+00 1.00170e+00 4.57517e+01 83.959  3.69005e-01  3.48703e+00  0.00000e+00 0.00000e+00 5.47103e+01 83.959  8.95857e+00 83.959  0.8414 
1 1 1 -14 83  7  o 9  7.86089e+00 1.24263e+00 8.42439e+01 343.597 1.25735e+01  -3.70123e+00 0.00000e+00 0.00000e+00 1.99686e+02 343.597 1.15442e+02 343.597 0.9611 
1 1 1 -14 83  8  o 6  4.60085e+00 1.29986e+00 4.51110e+01 188.091 -4.10374e+00 -5.83366e-01 0.00000e+00 0.00000e+00 1.04975e+02 188.091 5.98641e+01 188.091 0.8689 
1 1 1 -14 84  1  o 15 6.23265e+00 1.27916e+00 1.12271e+02 331.285 1.09062e+01  -5.97457e+00 0.00000e+00 0.00000e+00 1.13385e+02 331.285 1.11351e+00 331.285 0.9589 
1 1 1 -14 84  2  o 8  4.77627e+00 1.23355e+00 8.00406e+01 179.953 -7.06135e+00 5.83395e-03  0.00000e+00 0.00000e+00 8.68802e+01 179.953 6.83970e+00 179.953 0.9262 
1 1 1 -14 84  3  o 9  4.25223e+00 1.20799e+00 2.02474e+01 51.280  9.88057e-01  1.23239e+00  0.00000e+00 0.00000e+00 7.83875e+01 51.280  5.81401e+01 51.280  0.6152 
1 1 1 -14 84  4  o 18 6.70495e+00 1.28642e+00 1.40658e+02 196.880 -1.60830e+01 -4.88036e+00 0.00000e+00 0.00000e+00 1.04321e+02 196.880 3.63370e+01 16.880  0.9698 
1 1 1 -14 84  5  o 7  4.44101e+00 1.21684e+00 1.25985e+02 329.779 9.44783e+00  -5.50337e+00 0.00000e+00 0.00000e+00 3.33538e+01 329.779 9.26317e+01 149.779 0.9531 
1 1 1 -14 84  6  o 4  3.58760e+00 1.07175e+00 6.77506e+01 162.241 -5.48767e+00 1.75752e+00  0.00000e+00 0.00000e+00 5.48336e+01 162.241 1.29170e+01 342.241 0.9085 
1 1 1 -14 84  7  o 16 3.61704e+00 1.08100e+00 7.06227e+01 138.180 -4.56536e+00 4.08473e+00  0.00000e+00 0.00000e+00 5.36337e+01 138.180 1.69890e+01 318.180 0.9143 
1 1 1 -14 84  8  o 17 3.42645e+00 1.02623e+00 4.26177e+01 358.925 3.74754e+00  -7.03363e-02 0.00000e+00 0.00000e+00 6.71018e+01 358.925 2.44841e+01 358.925 0.8531 
1 1 1 -14 85  1  o 18 7.28328e+00 1.22569e+00 1.17012e+02 155.996 -1.43255e+01 6.37920e+00  0.00000e+00 0.00000e+00 1.49002e+02 155.996 3.19902e+01 155.996 0.9676 
1 1 1 -14 85  2  o 18 3.66003e+00 1.11092e+00 4.85426e+01 135.980 -2.59056e+00 2.50338e+00  0.00000e+00 0.00000e+00 6.83025e+01 135.980 1.97599e+01 135.980 0.8463 
1 1 1 -14 85  3  o 19 2.42522e+00 8.32589e-01 2.89993e+01 19.127  1.74867e+00  6.06442e-01  0.00000e+00 0.00000e+00 3.24084e+01 19.127  3.40911e+00 19.127  0.6717 
1 1 1 -14 85  4  o 18 4.36246e+00 1.19717e+00 5.30458e+01 353.992 4.73564e+00  -4.98436e-01 0.00000e+00 0.00000e+00 9.27970e+01 353.992 3.97512e+01 353.992 0.8875 
1 1 1 -14 85  5  o 6  3.70144e+00 1.11677e+00 4.79432e+01 15.382  3.97082e+00  1.09242e+00  0.00000e+00 0.00000e+00 7.29633e+01 15.382  2.50201e+01 15.382  0.8679 
1 1 1 -14 85  6  o 9  3.00961e+00 9.71608e-01 3.78182e+01 315.026 2.05221e+00  -2.05031e+00 0.00000e+00 0.00000e+00 5.29845e+01 315.026 1.51663e+01 315.026 0.8024 
1 1 1 -14 85  7  o 16 4.21398e+00 1.25296e+00 7.67964e+01 87.314  3.27160e-01  6.97390e+00  0.00000e+00 0.00000e+00 6.96828e+01 87.314  7.11366e+00 267.314 0.9253 
1 1 1 -14 85  8  o 16 3.08262e+00 1.00563e+00 4.02042e+01 173.798 -3.58996e+00 3.90136e-01  0.00000e+00 0.00000e+00 5.77438e+01 173.798 1.75396e+01 173.798 0.8467 
1 1 1 -14 86  1  o 5  4.14059e+00 1.16631e+00 8.99909e+01 256.077 -1.94119e+00 -7.83042e+00 0.00000e+00 0.00000e+00 5.62400e+01 256.077 3.37509e+01 76.077  0.9358 
1 1 1 -14 86  2  o 1  3.44165e+00 1.07492e+00 7.68942e+01 202.632 -5.76894e+00 -2.40516e+00 0.00000e+00 0.00000e+00 4.20132e+01 202.632 3.48810e+01 22.632  0.9161 
1 1 1 -14 86  3  o 17 6.08724e+00 1.25503e+00 9.93585e+01 17.049  1.12758e+01  3.45798e+00  0.00000e+00 0.00000e+00 1.20102e+02 17.049  2.07439e+01 17.049  0.9566 
1 1 1 -14 86  4  o 9  3.24687e+00 9.95659e-01 3.70278e+01 111.484 -1.06933e+00 2.71693e+00  0.00000e+00 0.00000e+00 6.12633e+01 111.484 2.42355e+01 111.484 0.8039 
1 1 1 -14 86  5  o 4  5.64127e+00 1.27514e+00 1.19833e+02 241.178 -6.63212e+00 -1.20526e+01 0.00000e+00 0.00000e+00 8.45628e+01 241.178 3.52699e+01 61.178  0.9629 
1 1 1 -14 86  6  o 14 2.59635e+00 8.83576e-01 3.61172e+01 77.836  5.74339e-01  2.66458e+00  0.00000e+00 0.00000e+00 4.07437e+01 77.836  4.62655e+00 77.836  0.7875 
1 1 1 -14 86  7  o 4  4.26051e+00 1.11850e+00 3.68465e+01 285.353 1.04931e+00  -3.82160e+00 0.00000e+00 0.00000e+00 1.01096e+02 285.353 6.42498e+01 285.353 0.8621 
1 1 1 -14 86  8  o 13 3.16541e+00 1.02898e+00 4.10494e+01 95.399  -3.64451e-01 3.85644e+00  0.00000e+00 0.00000e+00 6.09043e+01 95.399  1.98548e+01 95.399  0.8585 
1 1 1 -14 87  1  o 5  3.24337e+00 1.02438e+00 2.60487e+01 279.351 3.18935e-01  -1.93674e+00 0.00000e+00 0.00000e+00 5.85814e+01 279.351 3.25327e+01 279.351 0.6916 
1 1 1 -14 87  2  f 0  5.38617e+00 1.28119e+00 7.53101e+01 358.795 7.47769e+00  -1.57267e-01 0.00000e+00 0.00000e+00 1.13669e+02 358.795 3.83591e+01 358.795 0.9305 
1 1 1 -14 87  3  o 4  6.42685e+00 1.28496e+00 1.27397e+02 161.936 -1.45192e+01 4.73562e+00  0.00000e+00 0.00000e+00 1.06690e+02 161.936 2.07073e+01 341.936 0.9667 
1 1 1 -14 87  4  o 2  3.71234e+00 1.11882e+00 6.96104e+01 303.533 3.23521e+00  -4.88181e+00 0.00000e+00 0.00000e+00 5.75872e+01 303.533 1.20232e+01 123.533 0.9101 
1 1 1 -14 87  5  o 17 2.85341e+00 9.41893e-01 4.57291e+01 50.734  2.35985e+00  2.88666e+00  0.00000e+00 0.00000e+00 4.57454e+01 50.734  1.63710e-02 50.734  0.8522 
1 1 1 -14 87  6  o 10 4.50553e+00 1.23416e+00 8.78678e+01 230.188 -5.57376e+00 -6.68706e+00 0.00000e+00 0.00000e+00 7.14222e+01 230.188 1.64456e+01 50.188  0.9407 
1 1 1 -14 87  7  o 2  2.06758e+00 7.32157e-01 2.03695e+01 14.242  1.49998e+00  3.80712e-01  0.00000e+00 0.00000e+00 2.68056e+01 14.242  6.43609e+00 14.242  0.6077 
1 1 1 -14 87  8  o 7  7.31409e+00 1.27135e+00 1.07446e+02 198.737 -1.62726e+01 -5.51959e+00 0.00000e+00 0.00000e+00 1.58794e+02 198.737 5.13478e+01 198.737 0.9705 
1 1 1 -14 88  1  o 10 3.30051e+00 1.03999e+00 6.28236e+01 120.200 -2.60900e+00 4.48267e+00  0.00000e+00 0.00000e+00 4.89194e+01 120.200 1.39042e+01 300.200 0.8975 
1 1 1 -14 88  2  o 12 4.28200e+00 1.21995e+00 9.66522e+01 138.293 -6.48255e+00 5.77721e+00  0.00000e+00 0.00000e+00 5.51639e+01 138.293 4.14883e+01 318.293 0.9405 
1 1 1 -14 88  3  o 14 2.99114e+00 9.82748e-01 3.73741e+01 351.857 2.85581e+00  -4.08653e-01 0.00000e+00 0.00000e+00 5.28900e+01 351.857 1.55159e+01 351.857 0.8011 
1 1 1 -14 88  4  o 8  3.41194e+00 1.05630e+00 4.69391e+01 98.347  -5.47448e-01 3.73109e+00  0.00000e+00 0.00000e+00 6.27502e+01 98.347  1.58112e+01 98.347  0.8541 
1 1 1 -14 88  5  o 3  3.29887e+00 1.03056e+00 3.77571e+01 80.999  4.95745e-01  3.12977e+00  0.00000e+00 0.00000e+00 6.41914e+01 80.999  2.64343e+01 80.999  0.8217 
1 1 1 -14 88  6  o 16 3.41817e+00 1.07848e+00 8.13406e+01 239.553 -3.71138e+00 -6.31404e+00 0.00000e+00 0.00000e+00 3.79753e+01 239.553 4.33653e+01 59.553  0.9290 
1 1 1 -14 88  7  o 16 4.42559e+00 1.25514e+00 8.26704e+01 151.046 -7.20567e+00 3.98666e+00  0.00000e+00 0.00000e+00 7.30203e+01 151.046 9.65013e+00 331.046 0.9372 
1 1 1 -14 89  1  f 0  4.08260e+00 1.15121e+00 8.75322e+01 13.699  7.98089e+00  1.94539e+00  0.00000e+00 0.00000e+00 5.67311e+01 13.699  3.08011e+01 193.699 0.9370 
1 1 1 -14 89  2  o 1  3.19405e+00 1.00212e+00 7.42613e+01 285.265 1.66666e+00  -6.10689e+00 0.00000e+00 0.00000e+00 3.61473e+01 285.265 3.81140e+01 105.265 0.9172 
1 1 1 -14 89  3  o 17 3.75797e+00 1.12106e+00 3.84343e+01 68.372  1.17941e+00  2.97462e+00  0.00000e+00 0.00000e+00 7.81474e+01 68.372  3.97132e+01 68.372  0.8237 
1 1 1 -14 89  4  o 4  3.36726e+00 1.04642e+00 4.86097e+01 168.841 -3.98285e+00 7.85633e-01  0.00000e+00 0.00000e+00 6.10958e+01 168.841 1.24861e+01 168.841 0.8658 
1 1 1 -14 89  5  o 17 5.16080e+00 1.27071e+00 9.99955e+01 269.055 -1.74868e-01 -1.06020e+01 0.00000e+00 0.00000e+00 8.46582e+01 269.055 1.53373e+01 89.055  0.9516 
1 1 1 -14 89  6  o 8  5.34711e+00 1.30670e+00 8.02627e+01 337.625 8.06396e+00  -3.31957e+00 0.00000e+00 0.00000e+00 1.08711e+02 337.625 2.84482e+01 337.625 0.9408 
1 1 1 -14 89  7  o 12 2.37985e+00 8.15315e-01 5.43552e+01 94.827  -4.03899e-01 4.78238e+00  0.00000e+00 0.00000e+00 2.50021e+01 94.827  2.93531e+01 274.827 0.8885 
1 1 1 -14 90  1  o 1  2.78376e+00 9.46485e-01 5.59724e+01 82.651  5.66729e-01  4.39446e+00  0.00000e+00 0.00000e+00 3.62064e+01 82.651  1.97660e+01 262.651 0.8783 
1 1 1 -14 90  2  f 0  8.13800e+00 1.28172e+00 1.32614e+02 307.012 1.31887e+01  -1.74943e+01 0.00000e+00 0.00000e+00 1.66929e+02 307.012 3.43154e+01 307.012 0.9769 
1 1 1 -14 90  3  o 6  5.52504e+00 1.27366e+00 7.47629e+01 204.000 -7.50838e+00 -3.34302e+00 0.00000e+00 0.00000e+00 1.20162e+02 204.000 4.53989e+01 204.000 0.9370 
1 1 1 -14 90  4  o 11 2.95381e+00 9.66613e-01 5.55739e+01 64.279  2.06949e+00  4.29608e+00  0.00000e+00 0.00000e+00 4.30767e+01 64.279  1.24972e+01 244.279 0.8877 
1 1 1 -14 90  5  o 6  2.68222e+00 8.95134e-01 3.48886e+01 346.258 2.65641e+00  -6.49615e-01 0.00000e+00 0.00000e+00 4.45906e+01 346.258 9.70199e+00 346.258 0.7883 
1 1 1 -14 90  6  o 7  3.46653e+00 1.06962e+00 9.76208e+01 155.130 -8.44892e+00 3.91645e+00  0.00000e+00 0.00000e+00 2.53675e+01 155.130 7.22534e+01 335.130 0.9447 
1 1 1 -14 90  7  o 12 3.80336e+00 1.10526e+00 8.42261e+01 310.918 5.83043e+00  -6.72643e+00 0.00000e+00 0.00000e+00 5.02053e+01 310.918 3.40208e+01 130.919 0.9420 
1 1 1 -14 91  1  o 9  6.51865e+00 1.35103e+00 1.02834e+02 301.545 6.52975e+00  -1.06368e+01 0.00000e+00 0.00000e+00 1.32818e+02 301.545 2.99837e+01 301.545 0.9591 
1 1 1 -14 91  2  o 17 4.75262e+00 1.24261e+00 6.53465e+01 50.128  4.11139e+00  4.92210e+00  0.00000e+00 0.00000e+00 9.90593e+01 50.128  3.37128e+01 50.128  0.9183 
1 1 1 -14 91  3  o 19 3.56740e+00 1.08519e+00 3.87352e+01 136.686 -2.48627e+00 2.34407e+00  0.00000e+00 0.00000e+00 7.36132e+01 136.686 3.48780e+01 136.686 0.8367 
1 1 1 -14 91  4  o 7  3.80392e+00 1.12211e+00 7.78956e+01 72.469  2.08571e+00  6.60238e+00  0.00000e+00 0.00000e+00 5.44022e+01 72.469  2.34935e+01 252.469 0.9247 
1 1 1 -14 91  5  o 10 3.88311e+00 1.14738e+00 1.10385e+02 208.965 -9.36103e+00 -5.18140e+00 0.00000e+00 0.00000e+00 2.85495e+01 208.965 8.18353e+01 28.965  0.9521 
1 1 1 -14 91  6  o 13 2.83484e+00 9.40557e-01 4.69706e+01 340.391 3.92208e+00  -1.39732e+00 0.00000e+00 0.00000e+00 4.55820e+01 340.391 1.38861e+00 160.391 0.8695 
1 1 1 -14 91  7  o 14 2.94606e+00 9.56040e-01 7.02781e+01 263.823 -7.47100e-01 -6.90283e+00 0.00000e+00 0.00000e+00 3.19315e+01 263.823 3.83466e+01 83.823  0.9249 
1 1 1 -14 92  1  o 12 3.40356e+00 1.06624e+00 5.52884e+00 39.183  3.67305e-01  2.99388e-01  0.00000e+00 0.00000e+00 2.40378e+01 39.183  1.85089e+01 39.183  0.2305 
1 1 1 -14 92  2  o 14 6.69784e+00 1.30713e+00 1.04417e+02 201.743 -1.34719e+01 -5.37274e+00 0.00000e+00 0.00000e+00 1.38962e+02 201.743 3.45449e+01 201.743 0.9649 
1 1 1 -14 92  3  o 5  3.23213e+00 1.04353e+00 5.62841e+01 27.928  4.05761e+00  2.15093e+00  0.00000e+00 0.00000e+00 5.11161e+01 27.928  5.16797e+00 207.928 0.8830 
1 1 1 -14 92  4  o 9  7.15234e+00 1.33409e+00 1.06725e+02 211.665 -1.33249e+01 -8.21836e+00 0.00000e+00 0.00000e+00 1.53489e+02 211.665 4.67641e+01 211.665 0.9675 
1 1 1 -14 92  5  o 5  4.35052e+00 1.21331e+00 7.99473e+01 55.469  4.77105e+00  6.93379e+00  0.00000e+00 0.00000e+00 7.34666e+01 55.469  6.48076e+00 235.469 0.9386 
1 1 1 -14 92  6  o 1  3.25855e+00 1.05946e+00 7.06671e+01 160.333 -6.35208e+00 2.27023e+00  0.00000e+00 0.00000e+00 4.21809e+01 160.333 2.84862e+01 340.333 0.9226 
1 1 1 -14 93  1  o 6  2.94311e+00 9.90332e-01 5.26073e+01 337.595 3.80524e+00  -1.56878e+00 0.00000e+00 0.00000e+00 4.36186e+01 337.595 8.98870e+00 157.595 0.8678 
1 1 1 -14 93  2  o 9  3.76923e+00 1.12525e+00 7.03376e+01 341.966 6.16143e+00  -2.00595e+00 0.00000e+00 0.00000e+00 6.01101e+01 341.966 1.02275e+01 161.966 0.9192 
1 1 1 -14 93  3  o 6  4.35581e+00 1.18732e+00 1.17056e+02 125.763 -7.12573e+00 9.89356e+00  0.00000e+00 0.00000e+00 3.99508e+01 125.763 7.71050e+01 305.763 0.9581 
1 1 1 -14 93  4  o 17 3.11264e+00 1.03481e+00 8.47782e+01 338.420 7.26587e+00  -2.87387e+00 0.00000e+00 0.00000e+00 2.44699e+01 338.420 6.03083e+01 158.420 0.9336 
1 1 1 -14 93  5  o 14 2.65152e+00 8.94792e-01 7.07862e+01 60.749  3.01157e+00  5.37738e+00  0.00000e+00 0.00000e+00 2.03270e+01 60.749  5.04592e+01 240.749 0.9148 
1 1 1 -14 93  6  o 4  2.96454e+00 9.43081e-01 7.34679e+01 301.299 3.85274e+00  -6.33697e+00 0.00000e+00 0.00000e+00 2.99878e+01 301.299 4.34801e+01 121.299 0.9299 
1 1 1 -14 94  1  o 14 3.46274e+00 1.09499e+00 2.57600e+01 158.151 -2.21629e+00 8.88649e-01  0.00000e+00 0.00000e+00 7.23474e+01 158.151 4.65874e+01 158.151 0.7522 
1 1 1 -14 94  2  o 12 3.75932e+00 1.13302e+00 6.95405e+01 46.302  4.63525e+00  4.85087e+00  0.00000e+00 0.00000e+00 6.09432e+01 46.302  8.59733e+00 226.302 0.9221 
1 1 1 -14 94  3  o 3  4.99467e+00 1.31279e+00 7.85853e+01 315.795 6.10868e+00  -5.94152e+00 0.00000e+00 0.00000e+00 9.78864e+01 315.795 1.93010e+01 315.795 0.9394 
1 1 1 -14 94  4  o 12 3.10971e+00 9.84541e-01 4.24550e+01 87.363  1.80743e-01  3.92510e+00  0.00000e+00 0.00000e+00 5.81447e+01 87.363  1.56898e+01 87.363  0.8607 
1 1 1 -14 94  5  o 10 2.89249e+00 9.42547e-01 1.62708e+01 41.162  1.19923e+00  1.04843e+00  0.00000e+00 0.00000e+00 5.08862e+01 41.162  3.46153e+01 41.162  0.6183 
1 1 1 -14 95  1  o 1  3.46378e+00 1.05737e+00 4.05830e+01 277.402 5.10746e-01  -3.93171e+00 0.00000e+00 0.00000e+00 7.18668e+01 277.402 3.12838e+01 277.402 0.8622 
1 1 1 -14 95  2  o 17 3.87524e+00 1.15907e+00 6.45674e+01 234.951 -3.61861e+00 -5.15856e+00 0.00000e+00 0.00000e+00 6.91264e+01 234.951 4.55901e+00 234.951 0.9168 
1 1 1 -14 95  3  o 16 7.53930e+00 1.37646e+00 1.40956e+02 36.797  1.66804e+01  1.24773e+01  0.00000e+00 0.00000e+00 1.35657e+02 36.797  5.29842e+00 216.797 0.9757 
1 1 1 -14 95  4  o 17 2.81129e+00 9.32943e-01 2.43125e+01 105.449 -6.18656e-01 2.23846e+00  0.00000e+00 0.00000e+00 5.43002e+01 105.449 2.99876e+01 105.449 0.7442 
1 1 1 -14 96  1  o 14 3.42995e+00 1.07904e+00 7.57320e+01 308.490 4.49124e+00  -5.64836e+00 0.00000e+00 0.00000e+00 4.40759e+01 308.490 3.16561e+01 128.490 0.9279 
1 1 1 -14 96  2  o 8  3.19647e+00 1.01887e+00 9.95296e+00 223.952 -7.03428e-01 -6.78167e-01 0.00000e+00 0.00000e+00 4.27438e+01 223.952 3.27908e+01 223.952 0.4382 
1 1 1 -14 96  3  o 8  2.95534e+00 9.92986e-01 4.14391e+01 231.828 -2.41173e+00 -3.06789e+00 0.00000e+00 0.00000e+00 5.40706e+01 231.828 1.26315e+01 231.828 0.8597 
1 1 1 -14 96  4  o 15 3.12393e+00 9.94550e-01 6.61482e+01 335.819 5.78568e+00  -2.59790e+00 0.00000e+00 0.00000e+00 4.15036e+01 335.819 2.46446e+01 155.819 0.9174 
1 1 1 -14 97  1  o 14 2.19252e+00 7.65559e-01 3.50468e+01 86.399  2.02006e-01  3.21015e+00  0.00000e+00 0.00000e+00 3.30124e+01 86.399  2.03443e+00 266.399 0.8248 
1 1 1 -14 97  2  o 4  3.08173e+00 9.87210e-01 4.94101e+01 236.382 -2.72171e+00 -4.09378e+00 0.00000e+00 0.00000e+00 5.39079e+01 236.382 4.49779e+00 236.382 0.8914 
1 1 1 -14 97  3  o 2  3.11729e+00 1.02262e+00 3.25943e+01 41.627  2.25606e+00  2.00490e+00  0.00000e+00 0.00000e+00 6.24593e+01 41.627  2.98650e+01 41.627  0.8113 
1 1 1 -14 98  1  o 1  3.41648e+00 1.07696e+00 8.80430e+01 261.451 -1.29858e+00 -8.63884e+00 0.00000e+00 0.00000e+00 3.29049e+01 261.451 5.51381e+01 81.451  0.9409 
1 1 1 -14 98  2  o 12 2.33570e+00 8.09573e-01 6.19258e+01 196.733 -5.55066e+00 -1.66880e+00 0.00000e+00 0.00000e+00 1.79120e+01 196.733 4.40138e+01 16.733  0.9091 
1 1 1 -13 0   1  o 11 1.52841e+01 1.42426e+00 2.15591e+02 0.000   8.46731e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.65910e+02 0.000   1.50318e+02 0.000   1.0000 
1 1 1 -13 0   2  o 11 7.67033e+00 2.57643e+00 1.57598e+02 180.000 -2.72545e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.31556e+02 180.000 2.60427e+01 0.000   0.9915 
1 1 1 -13 0   3  o 15 3.44399e+01 1.31680e+00 5.97553e+02 0.000   5.63903e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.11061e+02 0.000   1.13508e+02 0.000   1.0000 
1 1 1 -13 0   4  o 5  4.08171e+00 2.39825e+00 1.98429e+02 180.000 -1.93614e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.97690e+01 0.000   2.48198e+02 0.000   0.9592 
1 1 1 -13 0   5  o 19 1.57191e+01 1.48654e+00 1.14567e+02 180.000 -5.66140e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.81780e+02 180.000 3.67213e+02 180.000 1.0000 
1 1 1 -13 0   6  o 11 2.47779e+01 1.29552e+00 5.19530e+02 0.000   4.46351e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.19704e+02 0.000   9.98252e+01 180.000 1.0000 
1 1 1 -13 0   7  o 4  1.52692e+01 1.46819e+00 2.28550e+02 180.000 -1.35302e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.49713e+02 180.000 1.21164e+02 180.000 1.0000 
1 1 1 -13 0   8  o 16 4.54523e+00 2.42761e+00 9.30580e+01 180.000 -1.39081e+00 -0.00000e+00 0.00000e+00 0.00000e+00 5.88464e+01 180.000 3.42116e+01 0.000   0.8833 
1 1 1 -13 0   9  o 6  2.03893e+01 1.30960e+00 3.82181e+02 0.000   3.80560e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.88425e+02 0.000   6.24352e+00 0.000   1.0000 
1 1 1 -13 0   10 o 9  1.06069e+01 1.89823e+00 1.79753e+02 180.000 -9.33714e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.20686e+02 180.000 4.09322e+01 180.000 1.0000 
1 1 1 -13 0   11 o 16 1.70382e+01 1.40552e+00 3.07259e+02 0.000   3.28053e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.35232e+02 0.000   2.79733e+01 0.000   1.0000 
1 1 1 -13 0   12 o 8  3.95206e+00 2.29413e+00 5.36738e+01 0.000   1.02381e+00  0.00000e+00  0.00000e+00 0.00000e+00 6.11471e+01 0.000   7.47339e+00 0.000   0.7714 
1 1 1 -13 0   13 o 5  2.36492e+00 1.64541e+00 7.09063e+00 180.000 -1.09059e-01 -0.00000e+00 0.00000e+00 0.00000e+00 2.57240e+00 180.000 4.51822e+00 0.000   0.1086 
1 1 1 -13 0   14 o 8  2.83192e+00 1.88827e+00 6.49315e+01 180.000 -1.12428e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.11326e+01 180.000 4.37989e+01 0.000   0.8091 
1 1 1 -13 0   15 o 13 3.54065e+00 2.15171e+00 5.23597e+01 180.000 -1.14895e+00 -0.00000e+00 0.00000e+00 0.00000e+00 5.62015e+01 180.000 3.84181e+00 180.000 0.8174 
1 1 1 -13 0   16 o 18 9.79228e+00 2.01004e+00 1.24317e+02 0.000   8.80977e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.42456e+02 0.000   1.18139e+02 0.000   1.0000 
1 1 1 -13 0   17 o 7  7.24394e+00 2.52485e+00 7.41926e+01 0.000   3.17102e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.95764e+02 0.000   1.21571e+02 0.000   0.9965 
1 1 1 -13 1   1  o 6  9.95332e+00 1.35149e+00 1.46058e+02 214.061 -5.73396e+00 -3.87649e+00 0.00000e+00 0.00000e+00 2.04091e+02 214.061 5.80329e+01 214.061 0.9246 
1 1 1 -13 1   2  o 9  1.56586e+01 1.00159e+00 3.04448e+02 356.372 2.67664e+01  -1.69729e+00 0.00000e+00 0.00000e+00 2.79726e+02 356.372 2.47221e+01 176.372 0.9812 
1 1 1 -13 1   3  o 19 1.21400e+01 1.16131e+00 2.51058e+02 11.721  1.55727e+01  3.23091e+00  0.00000e+00 0.00000e+00 1.95480e+02 11.721  5.55780e+01 191.721 0.9680 
1 1 1 -13 1   4  o 1  5.69891e+00 1.38987e+00 6.16371e+01 192.007 -1.79653e+00 -3.82096e-01 0.00000e+00 0.00000e+00 8.31335e+01 192.007 2.14964e+01 192.007 0.6691 
1 1 1 -13 1   5  o 4  2.00674e+01 9.27460e-01 3.36743e+02 226.352 -3.02062e+01 -3.16661e+01 0.00000e+00 0.00000e+00 4.15839e+02 226.352 7.90966e+01 226.352 0.9885 
1 1 1 -13 1   6  f 0  8.68755e+00 1.43411e+00 1.97664e+02 79.009  1.95721e+00  1.00770e+01  0.00000e+00 0.00000e+00 1.15170e+02 79.009  8.24934e+01 259.009 0.9500 
1 1 1 -13 1   7  o 6  2.14025e+01 9.13504e-01 4.24968e+02 128.791 -4.58191e+01 5.70060e+01  0.00000e+00 0.00000e+00 3.80009e+02 128.791 4.49590e+01 308.791 0.9931 
1 1 1 -13 1   8  o 7  1.02871e+01 1.31764e+00 1.93014e+02 348.770 1.50780e+01  -2.99369e+00 0.00000e+00 0.00000e+00 1.83308e+02 348.770 9.70595e+00 168.770 0.9669 
1 1 1 -13 1   9  o 13 4.12265e+00 1.28070e+00 1.48514e+01 93.340  -3.04391e-02 5.21647e-01  0.00000e+00 0.00000e+00 2.45285e+01 93.340  9.67703e+00 93.340  0.2527 
1 1 1 -13 1   10 o 13 1.72140e+01 1.15706e+00 3.26675e+02 146.231 -5.00695e+01 3.34789e+01  0.00000e+00 0.00000e+00 3.17784e+02 146.231 8.89051e+00 326.231 0.9917 
1 1 1 -13 1   11 o 19 6.58513e+00 1.44787e+00 1.52355e+02 298.596 4.76893e+00  -8.74821e+00 0.00000e+00 0.00000e+00 8.31507e+01 298.596 6.92043e+01 118.596 0.9484 
1 1 1 -13 1   12 o 14 5.72660e+00 1.49663e+00 6.97215e+01 208.194 -3.65714e+00 -1.96046e+00 0.00000e+00 0.00000e+00 1.17710e+02 208.194 4.79886e+01 208.194 0.8690 
1 1 1 -13 1   13 o 4  5.06006e+00 1.41649e+00 1.17776e+02 340.856 6.31467e+00  -2.19211e+00 0.00000e+00 0.00000e+00 5.76747e+01 340.856 6.01017e+01 160.856 0.9218 
1 1 1 -13 1   14 o 5  6.03680e+00 1.46653e+00 1.00008e+02 211.150 -5.82567e+00 -3.52127e+00 0.00000e+00 0.00000e+00 1.09365e+02 211.150 9.35775e+00 211.150 0.9233 
1 1 1 -13 1   15 o 6  3.82869e+00 1.22588e+00 8.39195e+01 316.142 3.53998e+00  -3.40162e+00 0.00000e+00 0.00000e+00 4.40767e+01 316.142 3.98427e+01 136.142 0.8912 
1 1 1 -13 1   16 o 1  7.75059e+00 1.54061e+00 9.73814e+01 162.844 -9.52565e+00 2.94064e+00  0.00000e+00 0.00000e+00 1.77951e+02 162.844 8.05692e+01 162.844 0.9484 
1 1 1 -13 1   17 o 3  3.55084e+00 1.12923e+00 3.10552e+01 341.228 2.13133e+00  -7.24399e-01 0.00000e+00 0.00000e+00 6.65462e+01 341.228 3.54910e+01 341.228 0.7350 
1 1 1 -13 2   1  o 12 3.11093e+01 9.17142e-01 5.54241e+02 341.221 8.53238e+01  -2.90111e+01 0.00000e+00 0.00000e+00 6.22759e+02 341.221 6.85174e+01 341.221 0.9944 
1 1 1 -13 2   2  o 19 2.36342e+01 8.80809e-01 4.07751e+02 62.847  2.53561e+01  4.94370e+01  0.00000e+00 0.00000e+00 4.82757e+02 62.847  7.50051e+01 62.847  0.9910 
1 1 1 -13 2   3  o 17 1.98353e+01 9.08589e-01 3.83691e+02 155.782 -3.81940e+01 1.71796e+01  0.00000e+00 0.00000e+00 3.60936e+02 155.782 2.27546e+01 335.782 0.9880 
1 1 1 -13 2   4  o 12 1.41216e+01 1.05257e+00 2.81907e+02 252.884 -6.67096e+00 -2.16630e+01 0.00000e+00 0.00000e+00 2.42309e+02 252.884 3.95979e+01 72.884  0.9777 
1 1 1 -13 2   5  o 8  8.37520e+00 1.41692e+00 7.88013e+01 56.254  2.08070e+00  3.11449e+00  0.00000e+00 0.00000e+00 1.92225e+02 56.254  1.13423e+02 56.254  0.8530 
1 1 1 -13 2   6  o 11 1.20401e+01 1.18472e+00 2.53371e+02 312.647 1.33403e+01  -1.44836e+01 0.00000e+00 0.00000e+00 1.91275e+02 312.647 6.20953e+01 132.647 0.9743 
1 1 1 -13 2   7  o 6  1.28685e+01 1.10573e+00 2.09043e+02 111.527 -7.49373e+00 1.89974e+01  0.00000e+00 0.00000e+00 2.66213e+02 111.527 5.71700e+01 111.527 0.9752 
1 1 1 -13 2   8  o 4  1.68222e+01 9.85559e-01 4.16803e+02 32.281  5.16779e+01  3.26458e+01  0.00000e+00 0.00000e+00 2.14417e+02 32.281  2.02386e+02 212.281 0.9918 
1 1 1 -13 2   9  o 13 1.42526e+01 1.03151e+00 3.16667e+02 71.279  1.36281e+01  4.02141e+01  0.00000e+00 0.00000e+00 2.15617e+02 71.279  1.01050e+02 251.279 0.9882 
1 1 1 -13 2   10 o 13 7.66988e+00 1.43303e+00 1.12976e+02 279.796 1.37955e+00  -7.99052e+00 0.00000e+00 0.00000e+00 1.58090e+02 279.796 4.51139e+01 279.796 0.9361 
1 1 1 -13 2   11 o 5  6.67126e+00 1.41192e+00 1.44080e+02 27.512  8.63205e+00  4.49578e+00  0.00000e+00 0.00000e+00 9.41876e+01 27.512  4.98920e+01 207.512 0.9471 
1 1 1 -13 2   12 o 18 7.02115e+00 1.43252e+00 1.12362e+02 299.150 4.14582e+00  -7.43335e+00 0.00000e+00 0.00000e+00 1.36013e+02 299.150 2.36512e+01 299.150 0.9393 
1 1 1 -13 2   13 o 19 7.66932e+00 1.47739e+00 1.32859e+02 170.385 -1.08636e+01 1.84045e+00  0.00000e+00 0.00000e+00 1.42195e+02 170.385 9.33576e+00 170.385 0.9535 
1 1 1 -13 2   14 o 19 8.34636e+00 1.52014e+00 1.30392e+02 31.521  1.01167e+01  6.20453e+00  0.00000e+00 0.00000e+00 1.69610e+02 31.521  3.92183e+01 31.521  0.9569 
1 1 1 -13 2   15 o 8  5.18913e+00 1.40658e+00 9.26895e+01 100.925 -1.22575e+00 6.35005e+00  0.00000e+00 0.00000e+00 8.62011e+01 100.925 6.48844e+00 280.925 0.9191 
1 1 1 -13 2   16 o 6  1.36129e+01 1.21424e+00 1.94525e+02 176.258 -4.48818e+01 2.93559e+00  0.00000e+00 0.00000e+00 3.09647e+02 176.258 1.15122e+02 176.258 0.9888 
1 1 1 -13 2   17 o 13 8.22449e+00 1.60608e+00 1.64233e+02 319.529 1.40034e+01  -1.19476e+01 0.00000e+00 0.00000e+00 1.34871e+02 319.529 2.93619e+01 139.529 0.9724 
1 1 1 -13 3   1  o 7  1.55194e+01 1.00613e+00 2.54957e+02 301.415 1.05971e+01  -1.73504e+01 0.00000e+00 0.00000e+00 3.20781e+02 301.415 6.58234e+01 301.415 0.9751 
1 1 1 -13 3   2  o 9  4.11795e+00 1.31037e+00 7.99132e+01 40.284  1.31170e+00  1.11178e+00  0.00000e+00 0.00000e+00 2.12175e+01 40.284  5.86957e+01 220.284 0.6459 
1 1 1 -13 3   3  o 2  1.28190e+01 1.08979e+00 2.55015e+02 297.320 7.95310e+00  -1.53955e+01 0.00000e+00 0.00000e+00 2.17793e+02 297.320 3.72219e+01 117.320 0.9707 
1 1 1 -13 3   4  o 17 1.76346e+01 1.11061e+00 3.37562e+02 267.012 -1.74277e+00 -3.33875e+01 0.00000e+00 0.00000e+00 3.21909e+02 267.012 1.56528e+01 87.012  0.9849 
1 1 1 -13 3   5  o 7  2.96442e+01 9.24690e-01 5.40666e+02 93.602  -6.52321e+00 1.03621e+02  0.00000e+00 0.00000e+00 5.78552e+02 93.602  3.78853e+01 93.602  0.9952 
1 1 1 -13 3   6  o 3  6.25280e+00 1.48463e+00 9.01965e+01 11.100  3.25302e+00  6.38191e-01  0.00000e+00 0.00000e+00 1.06722e+02 11.100  1.65259e+01 11.100  0.8308 
1 1 1 -13 3   7  o 6  1.69780e+01 9.91836e-01 3.69416e+02 126.175 -2.90986e+01 3.97943e+01  0.00000e+00 0.00000e+00 2.66996e+02 126.175 1.02420e+02 306.175 0.9898 
1 1 1 -13 3   8  o 1  1.37308e+01 1.08736e+00 1.85866e+02 23.070  1.97780e+01  8.42380e+00  0.00000e+00 0.00000e+00 3.21388e+02 23.070  1.35523e+02 23.070  0.9765 
1 1 1 -13 3   9  o 10 1.32611e+01 1.08132e+00 2.69461e+02 316.430 2.39064e+01  -2.27420e+01 0.00000e+00 0.00000e+00 2.24076e+02 316.430 4.53848e+01 136.430 0.9847 
1 1 1 -13 3   10 o 18 3.87382e+00 1.18942e+00 2.34875e+01 213.301 -8.02076e-01 -5.26877e-01 0.00000e+00 0.00000e+00 3.96773e+01 213.301 1.61898e+01 213.301 0.4319 
1 1 1 -13 3   11 o 10 1.21242e+01 1.18230e+00 2.01882e+02 160.198 -2.63085e+01 9.47286e+00  0.00000e+00 0.00000e+00 2.47051e+02 160.198 4.51690e+01 160.198 0.9820 
1 1 1 -13 3   12 o 11 9.55956e+00 1.36188e+00 1.42473e+02 304.911 8.75994e+00  -1.25520e+01 0.00000e+00 0.00000e+00 2.05594e+02 304.911 6.31210e+01 304.911 0.9668 
1 1 1 -13 3   13 o 4  4.30108e+00 1.29201e+00 1.30747e+02 193.097 -6.61276e+00 -1.53847e+00 0.00000e+00 0.00000e+00 1.85918e+01 193.097 1.12155e+02 13.097  0.9231 
1 1 1 -13 3   14 o 9  7.30887e+00 1.55823e+00 1.75993e+02 215.159 -1.18848e+01 -8.37099e+00 0.00000e+00 0.00000e+00 8.89323e+01 215.159 8.70605e+01 35.159  0.9650 
1 1 1 -13 3   15 o 17 5.21236e+00 1.43846e+00 8.62551e+01 109.263 -1.94960e+00 5.57871e+00  0.00000e+00 0.00000e+00 9.18461e+01 109.263 5.59100e+00 109.263 0.9109 
1 1 1 -13 3   16 o 10 5.17247e+00 1.44511e+00 1.33395e+02 89.269  1.25076e-01  9.80307e+00  0.00000e+00 0.00000e+00 5.01761e+01 89.269  8.32188e+01 269.269 0.9475 
1 1 1 -13 3   17 o 9  4.55148e+00 1.37482e+00 1.29363e+02 293.962 3.95305e+00  -8.89432e+00 0.00000e+00 0.00000e+00 3.18546e+01 293.962 9.75084e+01 113.963 0.9471 
1 1 1 -13 4   1  o 15 2.33510e+01 9.05471e-01 4.28004e+02 297.074 2.38125e+01  -4.65866e+01 0.00000e+00 0.00000e+00 4.51863e+02 297.074 2.38586e+01 297.074 0.9904 
1 1 1 -13 4   2  o 1  7.05543e+00 1.44086e+00 1.41477e+02 173.963 -5.00674e+00 5.29475e-01  0.00000e+00 0.00000e+00 9.83971e+01 173.963 4.30794e+01 353.963 0.8942 
1 1 1 -13 4   3  o 5  8.06231e+00 1.41130e+00 1.60568e+02 284.914 1.63327e+00  -6.13222e+00 0.00000e+00 0.00000e+00 1.20472e+02 284.914 4.00956e+01 104.914 0.9174 
1 1 1 -13 4   4  o 17 1.56551e+01 1.02203e+00 3.57952e+02 81.886  4.53184e+00  3.17885e+01  0.00000e+00 0.00000e+00 2.27115e+02 81.886  1.30837e+02 261.886 0.9843 
1 1 1 -13 4   5  o 5  1.71105e+01 9.76804e-01 2.95457e+02 117.244 -1.53030e+01 2.97206e+01  0.00000e+00 0.00000e+00 3.43896e+02 117.244 4.84389e+01 117.244 0.9849 
1 1 1 -13 4   6  o 5  9.18618e+00 1.38885e+00 2.06443e+02 238.149 -6.06690e+00 -9.76536e+00 0.00000e+00 0.00000e+00 1.26254e+02 238.149 8.01887e+01 58.149  0.9555 
1 1 1 -13 4   7  o 18 1.44113e+01 1.09733e+00 2.34734e+02 32.557  2.16937e+01  1.38510e+01  0.00000e+00 0.00000e+00 3.00319e+02 32.557  6.55843e+01 32.557  0.9804 
1 1 1 -13 4   8  o 3  3.88641e+00 1.23132e+00 3.90078e+01 65.383  5.04960e-01  1.10206e+00  0.00000e+00 0.00000e+00 3.69442e+01 65.383  2.06363e+00 245.383 0.5166 
1 1 1 -13 4   9  o 9  1.36421e+01 1.09750e+00 2.29286e+02 303.298 1.57568e+01  -2.39893e+01 0.00000e+00 0.00000e+00 2.77238e+02 303.298 4.79514e+01 303.298 0.9824 
1 1 1 -13 4   10 o 12 5.83232e+00 1.38851e+00 1.41346e+02 147.891 -6.68119e+00 4.19255e+00  0.00000e+00 0.00000e+00 6.43645e+01 147.891 7.69811e+01 327.891 0.9343 
1 1 1 -13 4   11 o 1  6.98418e+00 1.50685e+00 5.43643e+01 148.275 -3.10537e+00 1.91976e+00  0.00000e+00 0.00000e+00 1.69126e+02 148.275 1.14762e+02 148.275 0.8486 
1 1 1 -13 4   12 o 5  1.07902e+01 1.26736e+00 1.41320e+02 245.863 -7.39580e+00 -1.65048e+01 0.00000e+00 0.00000e+00 2.53659e+02 245.863 1.12340e+02 245.863 0.9719 
1 1 1 -13 4   13 o 2  7.19212e+00 1.63479e+00 1.54769e+02 121.419 -5.70521e+00 9.33973e+00  0.00000e+00 0.00000e+00 1.03079e+02 121.419 5.16906e+01 301.419 0.9532 
1 1 1 -13 4   14 o 5  6.35380e+00 1.53283e+00 1.05548e+02 339.608 7.22360e+00  -2.68530e+00 0.00000e+00 0.00000e+00 1.17046e+02 339.608 1.14984e+01 339.608 0.9327 
1 1 1 -13 4   15 o 14 4.37367e+00 1.32018e+00 9.83571e+01 136.703 -4.47475e+00 4.21641e+00  0.00000e+00 0.00000e+00 5.16881e+01 136.703 4.66690e+01 316.702 0.9146 
1 1 1 -13 4   16 o 19 1.01690e+01 1.35268e+00 1.81541e+02 37.259  2.24174e+01  1.70524e+01  0.00000e+00 0.00000e+00 1.92512e+02 37.259  1.09715e+01 37.259  0.9821 
1 1 1 -13 4   17 o 5  6.13705e+00 1.50122e+00 9.57322e+01 277.936 1.20532e+00  -8.64654e+00 0.00000e+00 0.00000e+00 1.20202e+02 277.936 2.44694e+01 277.936 0.9409 
1 1 1 -13 5   1  o 18 2.68645e+01 9.15579e-01 4.56639e+02 197.129 -6.12321e+01 -1.88717e+01 0.00000e+00 0.00000e+00 5.57411e+02 197.129 1.00773e+02 197.129 0.9922 
1 1 1 -13 5   2  o 2  1.21390e+01 1.19452e+00 1.78469e+02 339.715 1.09258e+01  -4.03832e+00 0.00000e+00 0.00000e+00 2.62794e+02 339.715 8.43251e+01 339.715 0.9561 
1 1 1 -13 5   3  o 11 1.19984e+01 1.16712e+00 2.36622e+02 276.045 1.55634e+00  -1.46957e+01 0.00000e+00 0.00000e+00 2.03561e+02 276.045 3.30608e+01 96.045  0.9655 
1 1 1 -13 5   4  o 14 1.61313e+01 9.94277e-01 3.85512e+02 86.813  1.99233e+00  3.57824e+01  0.00000e+00 0.00000e+00 2.18351e+02 86.813  1.67161e+02 266.813 0.9859 
1 1 1 -13 5   5  o 13 1.22673e+01 1.19878e+00 2.51396e+02 307.824 1.17879e+01  -1.51834e+01 0.00000e+00 0.00000e+00 2.01722e+02 307.824 4.96743e+01 127.825 0.9736 
1 1 1 -13 5   6  o 16 5.17355e+00 1.35294e+00 1.23995e+02 215.429 -3.20390e+00 -2.27937e+00 0.00000e+00 0.00000e+00 4.48206e+01 215.429 7.91744e+01 35.429  0.8609 
1 1 1 -13 5   7  o 3  1.53488e+01 1.03073e+00 2.34541e+02 8.585   2.76385e+01  4.17233e+00  0.00000e+00 0.00000e+00 3.36220e+02 8.585   1.01679e+02 8.585   0.9819 
1 1 1 -13 5   8  o 15 5.66483e+00 1.45647e+00 1.09197e+02 213.381 -3.78308e+00 -2.49270e+00 0.00000e+00 0.00000e+00 7.96620e+01 213.381 2.95353e+01 33.381  0.8812 
1 1 1 -13 5   9  o 13 4.92524e+00 1.37875e+00 1.35124e+01 204.443 -4.95929e-01 -2.25411e-01 0.00000e+00 0.00000e+00 3.53957e+01 204.443 2.18833e+01 204.443 0.2627 
1 1 1 -13 5   10 o 2  1.05595e+01 1.17872e+00 2.31472e+02 244.544 -1.11330e+01 -2.33872e+01 0.00000e+00 0.00000e+00 1.59393e+02 244.544 7.20797e+01 64.544  0.9805 
1 1 1 -13 5   11 o 1  1.19061e+01 1.15588e+00 1.74948e+02 141.839 -1.81788e+01 1.42850e+01  0.00000e+00 0.00000e+00 2.64182e+02 141.839 8.92339e+01 141.839 0.9781 
1 1 1 -13 5   12 o 7  1.48251e+01 1.14505e+00 3.08416e+02 94.608  -4.63844e+00 5.75494e+01  0.00000e+00 0.00000e+00 2.45060e+02 94.608  6.33566e+01 274.608 0.9913 
1 1 1 -13 5   13 o 11 4.42794e+00 1.34189e+00 6.01230e+01 85.709  2.33446e-01  3.11139e+00  0.00000e+00 0.00000e+00 7.61941e+01 85.709  1.60710e+01 85.709  0.8185 
1 1 1 -13 5   14 o 10 5.63593e+00 1.50723e+00 6.22718e+01 234.736 -2.36791e+00 -3.34875e+00 0.00000e+00 0.00000e+00 1.21335e+02 234.736 5.90636e+01 234.736 0.8673 
1 1 1 -13 5   15 o 14 4.70105e+00 1.37267e+00 1.05462e+02 332.893 6.07632e+00  -3.11040e+00 0.00000e+00 0.00000e+00 5.73875e+01 332.893 4.80750e+01 152.893 0.9235 
1 1 1 -13 5   16 o 4  3.82031e+00 1.21637e+00 3.06855e+01 115.739 -8.62934e-01 1.78992e+00  0.00000e+00 0.00000e+00 6.88512e+01 115.739 3.81657e+01 115.739 0.6956 
1 1 1 -13 5   17 o 18 4.28951e+00 1.26645e+00 7.75653e+01 193.291 -6.38737e+00 -1.50882e+00 0.00000e+00 0.00000e+00 7.00641e+01 193.291 7.50122e+00 13.291  0.9203 
1 1 1 -13 6   1  o 7  2.12056e+01 1.01806e+00 4.22126e+02 94.469  -3.57110e+00 4.56892e+01  0.00000e+00 0.00000e+00 3.75773e+02 94.469  4.63528e+01 274.469 0.9890 
1 1 1 -13 6   2  o 15 2.42579e+01 8.98911e-01 3.74951e+02 42.816  3.82765e+01  3.54638e+01  0.00000e+00 0.00000e+00 5.38474e+02 42.816  1.63523e+02 42.816  0.9904 
1 1 1 -13 6   3  o 8  3.96578e+00 1.26741e+00 1.01902e+02 23.277  1.88575e+00  8.11249e-01  0.00000e+00 0.00000e+00 4.51808e+00 23.277  9.73841e+01 203.277 0.7063 
1 1 1 -13 6   4  o 15 2.12454e+01 9.17350e-01 4.17191e+02 50.702  3.28627e+01  4.01539e+01  0.00000e+00 0.00000e+00 3.81623e+02 50.702  3.55680e+01 230.702 0.9903 
1 1 1 -13 6   5  o 19 8.98400e+00 1.41935e+00 1.65433e+02 211.606 -7.38288e+00 -4.54298e+00 0.00000e+00 0.00000e+00 1.55085e+02 211.606 1.03474e+01 31.606  0.9404 
1 1 1 -13 6   6  o 7  4.96020e+00 1.43621e+00 1.07098e+02 114.255 -1.30193e+00 2.88949e+00  0.00000e+00 0.00000e+00 4.74027e+01 114.255 5.96954e+01 294.255 0.8218 
1 1 1 -13 6   7  o 18 1.29248e+01 1.12584e+00 2.24860e+02 8.156   2.16751e+01  3.10662e+00  0.00000e+00 0.00000e+00 2.53284e+02 8.156   2.84240e+01 8.156   0.9769 
1 1 1 -13 6   8  o 3  1.19049e+01 1.19983e+00 1.83077e+02 209.380 -1.53552e+01 -8.64520e+00 0.00000e+00 0.00000e+00 2.54338e+02 209.380 7.12613e+01 209.380 0.9712 
1 1 1 -13 6   9  o 17 4.89810e+00 1.39614e+00 1.31479e+02 273.628 3.31005e-01  -5.22049e+00 0.00000e+00 0.00000e+00 3.48404e+01 273.628 9.66385e+01 93.628  0.8985 
1 1 1 -13 6   10 o 15 8.04718e+00 1.41233e+00 1.47545e+02 130.481 -7.27965e+00 8.52900e+00  0.00000e+00 0.00000e+00 1.42364e+02 130.481 5.18060e+00 310.481 0.9543 
1 1 1 -13 6   11 o 6  8.63676e+00 1.43228e+00 1.90113e+02 123.528 -8.75403e+00 1.32116e+01  0.00000e+00 0.00000e+00 1.25106e+02 123.528 6.50073e+01 303.528 0.9679 
1 1 1 -13 6   12 o 15 5.01349e+00 1.41234e+00 7.08759e+01 22.087  3.57581e+00  1.45107e+00  0.00000e+00 0.00000e+00 9.11010e+01 22.087  2.02251e+01 22.087  0.8579 
1 1 1 -13 6   13 o 5  3.72040e+00 1.21145e+00 8.95894e+01 253.306 -1.21081e+00 -4.03733e+00 0.00000e+00 0.00000e+00 3.23349e+01 253.306 5.72545e+01 73.306  0.8713 
1 1 1 -13 6   14 o 4  6.74923e+00 1.36616e+00 7.77092e+01 266.496 -4.11059e-01 -6.71372e+00 0.00000e+00 0.00000e+00 1.56115e+02 266.496 7.84062e+01 266.496 0.9223 
1 1 1 -13 6   15 o 1  3.76334e+00 1.19664e+00 6.67350e+01 175.535 -3.90236e+00 3.04721e-01  0.00000e+00 0.00000e+00 5.46809e+01 175.535 1.20541e+01 355.535 0.8601 
1 1 1 -13 6   16 o 12 3.45739e+00 1.15189e+00 6.66223e+01 356.594 4.09510e+00  -2.43737e-01 0.00000e+00 0.00000e+00 4.56916e+01 356.594 2.09307e+01 176.594 0.8673 
1 1 1 -13 6   17 o 7  3.46943e+00 1.14971e+00 7.62347e+01 281.978 1.20834e+00  -5.69562e+00 0.00000e+00 0.00000e+00 4.17680e+01 281.978 3.44667e+01 101.978 0.9095 
1 1 1 -13 7   1  o 12 7.74470e+00 1.48453e+00 1.35713e+02 210.944 -4.49414e+00 -2.69443e+00 0.00000e+00 0.00000e+00 1.29067e+02 210.944 6.64654e+00 30.944  0.8987 
1 1 1 -13 7   2  o 8  3.31951e+01 9.35063e-01 5.79064e+02 32.426  9.23604e+01  5.86723e+01  0.00000e+00 0.00000e+00 6.77241e+02 32.426  9.81763e+01 32.426  0.9954 
1 1 1 -13 7   3  o 2  9.39287e+00 1.35094e+00 1.89567e+02 343.519 8.48890e+00  -2.51142e+00 0.00000e+00 0.00000e+00 1.46505e+02 343.519 4.30616e+01 163.519 0.9417 
1 1 1 -13 7   4  f 0  3.02902e+01 9.25742e-01 4.45447e+02 272.607 3.58384e+00  -7.87243e+01 0.00000e+00 0.00000e+00 6.97245e+02 272.607 2.51798e+02 272.607 0.9936 
1 1 1 -13 7   5  o 15 2.22849e+01 9.12351e-01 4.16916e+02 34.983  5.10557e+01  3.57275e+01  0.00000e+00 0.00000e+00 4.21678e+02 34.983  4.76143e+00 34.983  0.9919 
1 1 1 -13 7   6  o 3  1.61810e+01 9.88044e-01 3.47250e+02 266.391 -2.40408e+00 -3.81186e+01 0.00000e+00 0.00000e+00 2.57983e+02 266.391 8.92673e+01 86.391  0.9868 
1 1 1 -13 7   7  f 0  6.19059e+00 1.36697e+00 1.89995e+02 196.147 -7.93278e+00 -2.29666e+00 0.00000e+00 0.00000e+00 2.97452e+01 196.147 1.60250e+02 16.147  0.9373 
1 1 1 -13 7   8  o 14 8.17435e+00 1.47540e+00 1.56298e+02 273.831 6.26493e-01  -9.35560e+00 0.00000e+00 0.00000e+00 1.35962e+02 273.831 2.03354e+01 93.831  0.9451 
1 1 1 -13 7   9  o 14 4.10899e+00 1.29207e+00 7.20269e+01 268.503 -6.55909e-02 -2.51018e+00 0.00000e+00 0.00000e+00 4.69527e+01 268.503 2.50742e+01 88.503  0.7662 
1 1 1 -13 7   10 o 5  8.76920e+00 1.36458e+00 2.25881e+02 167.614 -1.87105e+01 4.10901e+00  0.00000e+00 0.00000e+00 9.63994e+01 167.614 1.29481e+02 347.614 0.9735 
1 1 1 -13 7   11 o 3  9.00889e+00 1.37684e+00 1.88671e+02 242.376 -7.82690e+00 -1.49561e+01 0.00000e+00 0.00000e+00 1.40800e+02 242.376 4.78713e+01 62.376  0.9699 
1 1 1 -13 7   12 o 19 1.08422e+01 1.34888e+00 2.13798e+02 27.810  2.30895e+01  1.21790e+01  0.00000e+00 0.00000e+00 1.86620e+02 27.810  2.71775e+01 207.810 0.9807 
1 1 1 -13 7   13 o 10 8.26113e+00 1.49140e+00 1.32409e+02 323.661 9.96696e+00  -7.33202e+00 0.00000e+00 0.00000e+00 1.65473e+02 323.661 3.30640e+01 323.661 0.9587 
1 1 1 -13 7   14 o 6  5.26048e+00 1.43668e+00 6.59850e+01 272.031 1.50583e-01  -4.24573e+00 0.00000e+00 0.00000e+00 1.06398e+02 272.031 4.04134e+01 272.031 0.8724 
1 1 1 -13 7   15 o 11 4.48318e+00 1.34292e+00 1.20374e+02 45.957  5.27325e+00  5.45243e+00  0.00000e+00 0.00000e+00 3.62686e+01 45.957  8.41058e+01 225.957 0.9315 
1 1 1 -13 7   16 o 16 7.98022e+00 1.49254e+00 1.27834e+02 198.403 -1.32541e+01 -4.40980e+00 0.00000e+00 0.00000e+00 1.60142e+02 198.403 3.23078e+01 198.403 0.9635 
1 1 1 -13 7   17 o 11 3.63419e+00 1.19175e+00 9.04060e+01 67.108  2.70351e+00  6.40247e+00  0.00000e+00 0.00000e+00 3.52994e+01 67.108  5.51066e+01 247.108 0.9250 
1 1 1 -13 8   1  f 0  7.24965e+00 1.52061e+00 8.27654e+01 242.388 -1.37155e+00 -2.62217e+00 0.00000e+00 0.00000e+00 1.39782e+02 242.388 5.70165e+01 242.388 0.8069 
1 1 1 -13 8   2  o 8  2.27929e+01 9.05005e-01 4.69340e+02 310.701 3.99232e+01  -4.64130e+01 0.00000e+00 0.00000e+00 3.90126e+02 310.701 7.92142e+01 130.701 0.9918 
1 1 1 -13 8   3  o 1  1.82295e+01 9.46583e-01 3.49327e+02 83.846  3.71791e+00  3.44792e+01  0.00000e+00 0.00000e+00 3.33218e+02 83.846  1.61086e+01 263.845 0.9855 
1 1 1 -13 8   4  o 15 1.08293e+01 1.23891e+00 2.04373e+02 53.959  7.06943e+00  9.71560e+00  0.00000e+00 0.00000e+00 1.89271e+02 53.959  1.51021e+01 233.959 0.9574 
1 1 1 -13 8   5  o 8  8.90048e+00 1.44904e+00 8.75872e+01 221.065 -3.39323e+00 -2.95650e+00 0.00000e+00 0.00000e+00 2.09656e+02 221.065 1.22069e+02 221.065 0.8803 
1 1 1 -13 8   6  o 12 1.06525e+01 1.28054e+00 2.05946e+02 173.968 -1.43282e+01 1.51396e+00  0.00000e+00 0.00000e+00 1.83541e+02 173.968 2.24052e+01 353.968 0.9646 
1 1 1 -13 8   7  o 4  1.10718e+01 1.19805e+00 1.55026e+02 77.095  2.85468e+00  1.24593e+01  0.00000e+00 0.00000e+00 2.47490e+02 77.095  9.24644e+01 77.095  0.9600 
1 1 1 -13 8   8  o 18 5.59248e+00 1.39151e+00 7.86206e+01 269.619 -2.21697e-02 -3.33730e+00 0.00000e+00 0.00000e+00 9.74320e+01 269.619 1.88114e+01 269.619 0.8321 
1 1 1 -13 8   9  o 9  2.47362e+01 9.14429e-01 4.02735e+02 154.249 -8.78305e+01 4.23667e+01  0.00000e+00 0.00000e+00 5.27272e+02 154.249 1.24536e+02 154.249 0.9949 
1 1 1 -13 8   10 o 15 1.15738e+01 1.18474e+00 2.01205e+02 0.827   2.45697e+01  3.54671e-01  0.00000e+00 0.00000e+00 2.26715e+02 0.827   2.55099e+01 0.827   0.9794 
1 1 1 -13 8   11 o 18 7.83052e+00 1.36061e+00 1.06319e+02 145.999 -6.90991e+00 4.66092e+00  0.00000e+00 0.00000e+00 1.70611e+02 145.999 6.42923e+01 145.999 0.9379 
1 1 1 -13 8   12 o 8  3.23792e+00 1.08068e+00 9.12911e+01 339.754 3.62294e+00  -1.33631e+00 0.00000e+00 0.00000e+00 1.33288e+01 339.754 7.79623e+01 159.754 0.8580 
1 1 1 -13 8   13 o 13 7.15754e+00 1.49570e+00 1.24770e+02 167.889 -9.84812e+00 2.11329e+00  0.00000e+00 0.00000e+00 1.30697e+02 167.889 5.92697e+00 167.889 0.9490 
1 1 1 -13 8   14 o 11 5.99169e+00 1.45285e+00 1.51675e+02 242.623 -5.05919e+00 -9.76960e+00 0.00000e+00 0.00000e+00 6.28890e+01 242.623 8.87855e+01 62.623  0.9534 
1 1 1 -13 8   15 o 1  5.81765e+00 1.50267e+00 1.04771e+02 233.885 -4.50821e+00 -6.17887e+00 0.00000e+00 0.00000e+00 9.86235e+01 233.885 6.14764e+00 53.885  0.9321 
1 1 1 -13 8   16 o 7  5.00494e+00 1.34058e+00 6.31063e+01 82.745  6.13757e-01  4.82119e+00  0.00000e+00 0.00000e+00 1.03726e+02 82.745  4.06201e+01 82.745  0.8900 
1 1 1 -13 8   17 o 4  3.10375e+00 1.05762e+00 1.03705e+01 245.495 -3.20598e-01 -7.03321e-01 0.00000e+00 0.00000e+00 3.14377e+01 245.495 2.10672e+01 245.495 0.3602 
1 1 1 -13 9   1  o 4  1.95305e+01 1.03866e+00 2.11705e+02 316.560 1.67315e+01  -1.58443e+01 0.00000e+00 0.00000e+00 5.14970e+02 316.560 3.03265e+02 316.560 0.9781 
1 1 1 -13 9   2  o 2  9.89857e+00 1.32283e+00 1.33919e+02 292.601 2.64555e+00  -6.35529e+00 0.00000e+00 0.00000e+00 2.13890e+02 292.601 7.99711e+01 292.601 0.9242 
1 1 1 -13 9   3  o 15 1.58420e+01 9.98922e-01 2.93491e+02 68.003  9.47053e+00  2.34444e+01  0.00000e+00 0.00000e+00 2.96366e+02 68.003  2.87520e+00 68.003  0.9800 
1 1 1 -13 9   4  f 0  2.40683e+01 8.98162e-01 5.54604e+02 303.774 4.44737e+01  -6.64992e+01 0.00000e+00 0.00000e+00 3.53413e+02 303.774 2.01192e+02 123.774 0.9937 
1 1 1 -13 9   5  o 15 6.19619e+00 1.55745e+00 5.72453e+01 309.626 1.26035e+00  -1.52210e+00 0.00000e+00 0.00000e+00 1.05837e+02 309.626 4.85918e+01 309.626 0.6938 
1 1 1 -13 9   6  o 8  6.66111e+00 1.34878e+00 1.30098e+02 16.608  5.33201e+00  1.59031e+00  0.00000e+00 0.00000e+00 9.83878e+01 16.608  3.17100e+01 196.608 0.9050 
1 1 1 -13 9   7  o 14 6.99650e+00 1.34606e+00 1.27197e+02 289.856 2.13643e+00  -5.91590e+00 0.00000e+00 0.00000e+00 1.15654e+02 289.856 1.15433e+01 109.856 0.9166 
1 1 1 -13 9   8  o 4  1.08410e+01 1.18316e+00 1.18439e+02 63.937  4.63763e+00  9.48227e+00  0.00000e+00 0.00000e+00 2.71735e+02 63.937  1.53296e+02 63.937  0.9514 
1 1 1 -13 9   9  o 8  6.64687e+00 1.27375e+00 9.70099e+01 333.221 5.14611e+00  -2.59710e+00 0.00000e+00 0.00000e+00 1.31202e+02 333.221 3.41925e+01 333.221 0.9085 
1 1 1 -13 9   10 o 16 5.64104e+00 1.42984e+00 1.17077e+02 260.809 -9.86845e-01 -6.09927e+00 0.00000e+00 0.00000e+00 7.77750e+01 260.809 3.93016e+01 80.809  0.9150 
1 1 1 -13 9   11 o 19 1.18812e+01 1.22524e+00 1.54357e+02 52.358  1.20022e+01  1.55613e+01  0.00000e+00 0.00000e+00 2.82068e+02 52.358  1.27712e+02 52.358  0.9742 
1 1 1 -13 9   12 o 18 9.08702e+00 1.47876e+00 1.89611e+02 218.227 -1.41352e+01 -1.11340e+01 0.00000e+00 0.00000e+00 1.42943e+02 218.227 4.66677e+01 38.227  0.9718 
1 1 1 -13 9   13 o 19 4.50912e+00 1.29792e+00 9.22675e+01 202.091 -4.92377e+00 -1.99846e+00 0.00000e+00 0.00000e+00 6.03932e+01 202.091 3.18743e+01 22.091  0.9002 
1 1 1 -13 9   14 o 11 4.45750e+00 1.21192e+00 2.42868e+01 291.055 5.51128e-01  -1.43164e+00 0.00000e+00 0.00000e+00 7.69090e+01 291.055 5.26221e+01 291.055 0.6044 
1 1 1 -13 9   15 o 5  5.22235e+00 1.44238e+00 1.02553e+02 241.596 -3.38861e+00 -6.26613e+00 0.00000e+00 0.00000e+00 7.89975e+01 241.596 2.35559e+01 61.596  0.9269 
1 1 1 -13 9   16 o 13 6.91894e+00 1.48893e+00 1.23408e+02 89.236  1.62791e-01  1.22039e+01  0.00000e+00 0.00000e+00 1.24861e+02 89.236  1.45264e+00 89.236  0.9581 
1 1 1 -13 9   17 o 6  3.57764e+00 1.11898e+00 4.35011e+01 1.596   3.52372e+00  9.82036e-02  0.00000e+00 0.00000e+00 6.91970e+01 1.596   2.56959e+01 1.596   0.8424 
1 1 1 -13 10  1  o 3  6.25135e+00 1.51510e+00 1.84642e+02 157.401 -5.25659e+00 2.18798e+00  0.00000e+00 0.00000e+00 3.11256e+01 157.401 1.53517e+02 337.401 0.9073 
1 1 1 -13 10  2  f 0  1.37820e+01 1.07819e+00 3.65056e+02 226.796 -1.83212e+01 -1.95074e+01 0.00000e+00 0.00000e+00 1.49017e+02 226.796 2.16039e+02 46.796  0.9811 
1 1 1 -13 10  3  o 8  1.80226e+01 9.80424e-01 3.28603e+02 59.915  1.61948e+01  2.79546e+01  0.00000e+00 0.00000e+00 3.45427e+02 59.915  1.68238e+01 59.915  0.9844 
1 1 1 -13 10  4  o 1  2.47822e+01 8.81703e-01 3.71940e+02 264.394 -5.40965e+00 -5.51178e+01 0.00000e+00 0.00000e+00 5.60352e+02 264.394 1.88412e+02 264.394 0.9909 
1 1 1 -13 10  5  o 7  1.58073e+01 9.85819e-01 2.22265e+02 82.540  3.15987e+00  2.41318e+01  0.00000e+00 0.00000e+00 3.64911e+02 82.540  1.42646e+02 82.540  0.9792 
1 1 1 -13 10  6  o 10 7.93308e+00 1.42726e+00 1.09910e+02 345.599 5.27939e+00  -1.35559e+00 0.00000e+00 0.00000e+00 1.61560e+02 345.599 5.16510e+01 345.599 0.9029 
1 1 1 -13 10  7  o 9  8.20834e+00 1.45258e+00 2.91095e+02 261.707 -2.34090e+00 -1.60609e+01 0.00000e+00 0.00000e+00 9.98877e+00 261.707 2.81107e+02 81.707  0.9687 
1 1 1 -13 10  8  o 19 1.07572e+01 1.21058e+00 2.32390e+02 110.731 -7.19840e+00 1.90189e+01  0.00000e+00 0.00000e+00 1.64406e+02 110.731 6.79842e+01 290.731 0.9751 
1 1 1 -13 10  9  o 17 1.00518e+01 1.28091e+00 9.67225e+01 239.036 -4.45585e+00 -7.42645e+00 0.00000e+00 0.00000e+00 2.60474e+02 239.036 1.63752e+02 239.036 0.9404 
1 1 1 -13 10  10 o 16 1.00571e+01 1.33191e+00 1.22889e+02 183.379 -1.21177e+01 -7.15527e-01 0.00000e+00 0.00000e+00 2.40751e+02 183.379 1.17862e+02 183.379 0.9579 
1 1 1 -13 10  11 o 6  1.39595e+01 1.10360e+00 2.38083e+02 11.824  3.69580e+01  7.73738e+00  0.00000e+00 0.00000e+00 2.81226e+02 11.824  4.31428e+01 11.824  0.9867 
1 1 1 -13 10  12 o 12 1.02228e+01 1.34326e+00 2.06498e+02 231.636 -1.47909e+01 -1.86853e+01 0.00000e+00 0.00000e+00 1.70301e+02 231.636 3.61968e+01 51.636  0.9788 
1 1 1 -13 10  13 o 16 6.19329e+00 1.44379e+00 1.61981e+02 114.230 -4.79632e+00 1.06575e+01  0.00000e+00 0.00000e+00 6.07428e+01 114.230 1.01238e+02 294.230 0.9562 
1 1 1 -13 10  14 o 18 6.72517e+00 1.52109e+00 1.15522e+02 239.300 -4.54725e+00 -7.65858e+00 0.00000e+00 0.00000e+00 1.22431e+02 239.300 6.90930e+00 239.300 0.9421 
1 1 1 -13 10  15 o 16 8.37792e+00 1.45523e+00 1.31836e+02 57.819  7.75014e+00  1.23162e+01  0.00000e+00 0.00000e+00 1.71384e+02 57.819  3.95483e+01 57.819  0.9650 
1 1 1 -13 10  16 o 2  6.81713e+00 1.51390e+00 1.17426e+02 2.514   1.12039e+01  4.91871e-01  0.00000e+00 0.00000e+00 1.26215e+02 2.514   8.78892e+00 2.514   0.9543 
1 1 1 -13 10  17 o 11 6.31783e+00 1.44587e+00 1.07323e+02 222.367 -8.37245e+00 -7.63617e+00 0.00000e+00 0.00000e+00 1.18241e+02 222.367 1.09179e+01 222.367 0.9548 
1 1 1 -13 11  1  o 5  1.41897e+01 1.18286e+00 2.25287e+02 228.504 -1.13972e+01 -1.28843e+01 0.00000e+00 0.00000e+00 2.98554e+02 228.504 7.32678e+01 228.504 0.9705 
1 1 1 -13 11  2  o 19 9.18740e+00 1.42438e+00 1.45161e+02 86.479  4.00222e-01  6.50404e+00  0.00000e+00 0.00000e+00 1.76065e+02 86.479  3.09038e+01 86.479  0.9197 
1 1 1 -13 11  3  o 10 5.52437e+00 1.49117e+00 7.21213e+01 302.343 1.02758e+00  -1.62277e+00 0.00000e+00 0.00000e+00 7.15009e+01 302.343 6.20335e-01 122.343 0.6843 
1 1 1 -13 11  4  o 12 1.05157e+01 1.22412e+00 2.06615e+02 293.024 4.71391e+00  -1.10924e+01 0.00000e+00 0.00000e+00 1.75651e+02 293.024 3.09643e+01 113.024 0.9576 
1 1 1 -13 11  5  o 18 1.00424e+01 1.36450e+00 1.22044e+02 325.350 6.24811e+00  -4.31834e+00 0.00000e+00 0.00000e+00 2.32844e+02 325.350 1.10800e+02 325.350 0.9316 
1 1 1 -13 11  6  o 2  1.17667e+01 1.19732e+00 2.31535e+02 328.828 1.56835e+01  -9.48772e+00 0.00000e+00 0.00000e+00 2.02080e+02 328.828 2.94551e+01 148.828 0.9723 
1 1 1 -13 11  7  o 17 1.00579e+01 1.23721e+00 1.40859e+02 351.290 1.02713e+01  -1.57358e+00 0.00000e+00 0.00000e+00 2.21165e+02 351.290 8.03068e+01 351.290 0.9506 
1 1 1 -13 11  8  o 11 7.94261e+00 1.38352e+00 1.30017e+02 9.275   7.75230e+00  1.26605e+00  0.00000e+00 0.00000e+00 1.50601e+02 9.275   2.05835e+01 9.275   0.9340 
1 1 1 -13 11  9  o 7  5.63643e+00 1.45104e+00 8.32771e+01 354.077 3.85542e+00  -3.99998e-01 0.00000e+00 0.00000e+00 9.95935e+01 354.077 1.63164e+01 354.077 0.8586 
1 1 1 -13 11  10 o 9  7.90705e+00 1.36319e+00 1.83275e+02 272.900 6.79174e-01  -1.34062e+01 0.00000e+00 0.00000e+00 1.03847e+02 272.900 7.94272e+01 92.900  0.9620 
1 1 1 -13 11  11 o 10 3.97895e+00 1.24340e+00 9.42097e+01 158.104 -3.79909e+00 1.52694e+00  0.00000e+00 0.00000e+00 3.58636e+01 158.104 5.83461e+01 338.104 0.8671 
1 1 1 -13 11  12 f 0  8.79000e+00 1.43854e+00 1.92199e+02 32.784  1.52459e+01  9.81944e+00  0.00000e+00 0.00000e+00 1.29540e+02 32.784  6.26591e+01 212.784 0.9720 
1 1 1 -13 11  13 o 15 5.53122e+00 1.43057e+00 8.99253e+01 151.403 -5.12883e+00 2.79603e+00  0.00000e+00 0.00000e+00 9.93339e+01 151.403 9.40854e+00 151.403 0.9098 
1 1 1 -13 11  14 o 12 4.12382e+00 1.26723e+00 5.46380e+01 132.001 -2.03854e+00 2.26398e+00  0.00000e+00 0.00000e+00 7.13355e+01 132.001 1.66975e+01 132.001 0.8134 
1 1 1 -13 11  15 o 15 7.21385e+00 1.52195e+00 1.19930e+02 192.401 -1.06083e+01 -2.33252e+00 0.00000e+00 0.00000e+00 1.37848e+02 192.401 1.79186e+01 192.401 0.9528 
1 1 1 -13 11  16 o 9  1.02680e+01 1.35941e+00 1.42316e+02 72.721  6.88021e+00  2.21180e+01  0.00000e+00 0.00000e+00 2.33818e+02 72.721  9.15022e+01 72.721  0.9782 
1 1 1 -13 11  17 o 12 8.65997e+00 1.46902e+00 1.81573e+02 234.830 -1.45874e+01 -2.07023e+01 0.00000e+00 0.00000e+00 1.35780e+02 234.830 4.57926e+01 54.830  0.9801 
1 1 1 -13 12  1  o 12 1.17618e+01 1.31328e+00 2.49707e+02 200.837 -1.38168e+01 -5.25870e+00 0.00000e+00 0.00000e+00 1.82291e+02 200.837 6.74163e+01 20.837  0.9656 
1 1 1 -13 12  2  o 18 1.05450e+01 1.39968e+00 2.83445e+02 99.566  -2.44025e+00 1.44796e+01  0.00000e+00 0.00000e+00 1.03524e+02 99.566  1.79922e+02 279.566 0.9653 
1 1 1 -13 12  3  o 11 1.76317e+01 9.67066e-01 3.28466e+02 356.357 3.15642e+01  -2.00970e+00 0.00000e+00 0.00000e+00 3.30680e+02 356.357 2.21418e+00 356.357 0.9841 
1 1 1 -13 12  4  o 7  6.11020e+00 1.41151e+00 1.35006e+02 140.897 -3.37262e+00 2.74112e+00  0.00000e+00 0.00000e+00 6.80973e+01 140.897 6.69089e+01 320.897 0.8756 
1 1 1 -13 12  5  o 6  5.25672e+00 1.42655e+00 9.52710e+01 317.827 2.25238e+00  -2.04041e+00 0.00000e+00 0.00000e+00 6.68041e+01 317.827 2.84669e+01 137.827 0.8128 
1 1 1 -13 12  6  o 6  1.27954e+01 1.14713e+00 1.59096e+02 62.669  6.85255e+00  1.32589e+01  0.00000e+00 0.00000e+00 3.09294e+02 62.669  1.50198e+02 62.669  0.9659 
1 1 1 -13 12  7  o 10 8.76084e+00 1.39627e+00 1.28745e+02 232.948 -4.90933e+00 -6.50268e+00 0.00000e+00 0.00000e+00 1.81895e+02 232.948 5.31499e+01 232.948 0.9365 
1 1 1 -13 12  8  o 4  7.60116e+00 1.37170e+00 1.22344e+02 101.664 -1.43909e+00 6.97140e+00  0.00000e+00 0.00000e+00 1.44143e+02 101.664 2.17989e+01 101.664 0.9268 
1 1 1 -13 12  9  o 18 5.59760e+00 1.46675e+00 1.76610e+02 170.297 -7.98568e+00 1.36545e+00  0.00000e+00 0.00000e+00 2.13865e+01 170.297 1.55224e+02 350.297 0.9361 
1 1 1 -13 12  10 o 6  9.97888e+00 1.27177e+00 1.16242e+02 190.349 -1.10296e+01 -2.01413e+00 0.00000e+00 0.00000e+00 2.43204e+02 190.349 1.26961e+02 190.349 0.9543 
1 1 1 -13 12  11 o 10 5.92584e+00 1.43151e+00 1.08851e+02 67.511  2.44091e+00  5.89613e+00  0.00000e+00 0.00000e+00 9.62208e+01 67.511  1.26300e+01 247.511 0.9179 
1 1 1 -13 12  12 o 6  8.28526e+00 1.44145e+00 1.51607e+02 211.002 -1.15331e+01 -6.93026e+00 0.00000e+00 0.00000e+00 1.48549e+02 211.002 3.05865e+00 31.002  0.9621 
1 1 1 -13 12  13 o 11 5.00041e+00 1.39190e+00 5.96295e+01 19.824  3.36882e+00  1.21442e+00  0.00000e+00 0.00000e+00 9.93145e+01 19.824  3.96850e+01 19.824  0.8452 
1 1 1 -13 12  14 o 6  6.36293e+00 1.46926e+00 9.87485e+01 118.151 -3.51369e+00 6.56636e+00  0.00000e+00 0.00000e+00 1.23541e+02 118.151 2.47925e+01 118.151 0.9302 
1 1 1 -13 12  15 o 7  9.62967e+00 1.41153e+00 1.39638e+02 30.918  1.56727e+01  9.38675e+00  0.00000e+00 0.00000e+00 2.11477e+02 30.918  7.18396e+01 30.918  0.9722 
1 1 1 -13 12  16 o 6  3.63481e+00 1.18346e+00 3.90231e+01 237.889 -1.37759e+00 -2.19517e+00 0.00000e+00 0.00000e+00 6.64134e+01 237.889 2.73903e+01 237.889 0.7746 
1 1 1 -13 12  17 o 14 5.28076e+00 1.45276e+00 1.00940e+02 211.820 -7.39882e+00 -4.59105e+00 0.00000e+00 0.00000e+00 8.48007e+01 211.820 1.61393e+01 31.820  0.9407 
1 1 1 -13 13  1  o 18 7.83506e+00 1.55700e+00 1.32813e+02 10.618  4.81982e+00  9.03547e-01  0.00000e+00 0.00000e+00 1.32758e+02 10.618  5.54075e-02 190.618 0.8911 
1 1 1 -13 13  2  o 11 1.01716e+01 1.41501e+00 1.77883e+02 81.172  1.36916e+00  8.81585e+00  0.00000e+00 0.00000e+00 1.86418e+02 81.172  8.53538e+00 81.172  0.9422 
1 1 1 -13 13  3  o 3  2.16484e+01 9.06794e-01 3.94611e+02 213.892 -4.16796e+01 -2.79992e+01 0.00000e+00 0.00000e+00 4.19543e+02 213.892 2.49324e+01 213.892 0.9900 
1 1 1 -13 13  4  o 1  1.11758e+01 1.19593e+00 1.94825e+02 276.734 1.54952e+00  -1.31228e+01 0.00000e+00 0.00000e+00 2.13030e+02 276.734 1.82043e+01 276.734 0.9614 
1 1 1 -13 13  5  o 5  1.44491e+01 1.02397e+00 2.50034e+02 7.474   2.44970e+01  3.21365e+00  0.00000e+00 0.00000e+00 2.86812e+02 7.474   3.67778e+01 7.474   0.9795 
1 1 1 -13 13  6  o 5  1.98967e+01 9.51691e-01 2.79427e+02 292.222 1.63288e+01  -3.99693e+01 0.00000e+00 0.00000e+00 4.65821e+02 292.222 1.86394e+02 292.222 0.9884 
1 1 1 -13 13  7  o 13 4.41875e+00 1.31002e+00 1.72224e+02 232.584 -3.44726e+00 -4.50627e+00 0.00000e+00 0.00000e+00 2.04837e+01 52.584  1.92707e+02 52.584  0.9070 
1 1 1 -13 13  8  f 0  8.34688e+00 1.37878e+00 5.90093e+01 231.216 -2.35337e+00 -2.92864e+00 0.00000e+00 0.00000e+00 2.10455e+02 231.216 1.51445e+02 231.216 0.8535 
1 1 1 -13 13  9  o 4  9.07452e+00 1.32874e+00 1.07557e+02 139.987 -6.19996e+00 5.20486e+00  0.00000e+00 0.00000e+00 2.13396e+02 139.987 1.05839e+02 139.987 0.9360 
1 1 1 -13 13  10 o 8  5.95006e+00 1.41735e+00 3.80887e+01 199.361 -1.92803e+00 -6.77510e-01 0.00000e+00 0.00000e+00 1.20196e+02 199.361 8.21077e+01 199.361 0.7048 
1 1 1 -13 13  11 o 8  4.91421e+00 1.32174e+00 3.06146e+01 93.160  -8.68935e-02 1.57413e+00  0.00000e+00 0.00000e+00 8.32293e+01 93.160  5.26147e+01 93.160  0.6145 
1 1 1 -13 13  12 o 17 1.10583e+01 1.29247e+00 1.64896e+02 20.963  1.98630e+01  7.61010e+00  0.00000e+00 0.00000e+00 2.41584e+02 20.963  7.66882e+01 20.963  0.9762 
1 1 1 -13 13  13 o 4  3.97227e+00 1.22691e+00 8.97018e+01 259.997 -8.23268e-01 -4.66764e+00 0.00000e+00 0.00000e+00 4.27934e+01 259.997 4.69084e+01 79.997  0.8870 
1 1 1 -13 13  14 o 10 9.10073e+00 1.39355e+00 1.21997e+02 21.268  1.28797e+01  5.01339e+00  0.00000e+00 0.00000e+00 2.07172e+02 21.268  8.51759e+01 21.268  0.9631 
1 1 1 -13 13  15 f 0  4.76019e+00 1.39680e+00 4.01877e+01 3.284   2.71609e+00  1.55835e-01  0.00000e+00 0.00000e+00 1.00304e+02 3.284   6.01165e+01 3.284   0.7870 
1 1 1 -13 13  16 o 18 4.98257e+00 1.38591e+00 3.76577e+01 333.331 2.64788e+00  -1.32997e+00 0.00000e+00 0.00000e+00 1.12954e+02 333.331 7.52966e+01 333.331 0.8072 
1 1 1 -13 13  17 o 8  3.45841e+00 1.13631e+00 5.82679e+01 224.065 -3.15347e+00 -3.05219e+00 0.00000e+00 0.00000e+00 5.51303e+01 224.065 3.13759e+00 44.065  0.8770 
1 1 1 -13 14  1  o 15 1.09144e+01 1.34233e+00 1.91444e+02 261.071 -1.61660e+00 -1.02890e+01 0.00000e+00 0.00000e+00 2.03234e+02 261.071 1.17905e+01 261.071 0.9507 
1 1 1 -13 14  2  o 17 2.33532e+01 1.03445e+00 3.29606e+02 249.176 -1.47700e+01 -3.88334e+01 0.00000e+00 0.00000e+00 5.47361e+02 249.176 2.17755e+02 249.176 0.9879 
1 1 1 -13 14  3  o 14 3.12289e+01 9.15502e-01 5.67662e+02 247.141 -4.03553e+01 -9.57260e+01 0.00000e+00 0.00000e+00 6.12902e+02 247.141 4.52398e+01 247.141 0.9952 
1 1 1 -13 14  4  o 14 1.40478e+01 1.04673e+00 2.81272e+02 42.986  1.82242e+01  1.69862e+01  0.00000e+00 0.00000e+00 2.41152e+02 42.986  4.01197e+01 222.986 0.9797 
1 1 1 -13 14  5  o 19 1.38615e+01 1.04175e+00 2.51859e+02 185.135 -2.38144e+01 -2.13994e+00 0.00000e+00 0.00000e+00 2.62773e+02 185.135 1.09136e+01 185.135 0.9789 
1 1 1 -13 14  6  o 5  4.31038e+00 1.31996e+00 1.58526e+02 263.387 -5.43547e-01 -4.68836e+00 0.00000e+00 0.00000e+00 1.37281e+01 83.387  1.72254e+02 83.387  0.8865 
1 1 1 -13 14  7  o 17 1.40870e+01 1.01224e+00 2.63568e+02 249.735 -1.06129e+01 -2.87452e+01 0.00000e+00 0.00000e+00 2.61002e+02 249.735 2.56542e+00 69.735  0.9835 
1 1 1 -13 14  8  o 9  6.92041e+00 1.38857e+00 1.01590e+02 198.637 -5.05794e+00 -1.70586e+00 0.00000e+00 0.00000e+00 1.34166e+02 198.637 3.25768e+01 198.637 0.9007 
1 1 1 -13 14  9  o 19 1.15083e+01 1.17061e+00 2.10293e+02 307.265 1.29454e+01  -1.70149e+01 0.00000e+00 0.00000e+00 2.14248e+02 307.265 3.95534e+00 307.265 0.9763 
1 1 1 -13 14  10 o 9  2.16698e+01 9.51366e-01 3.54206e+02 64.329  3.68950e+01  7.67619e+01  0.00000e+00 0.00000e+00 4.58855e+02 64.329  1.04648e+02 64.329  0.9941 
1 1 1 -13 14  11 o 15 7.42128e+00 1.39394e+00 9.71282e+01 242.264 -3.52851e+00 -6.71046e+00 0.00000e+00 0.00000e+00 1.63481e+02 242.264 6.63530e+01 242.264 0.9315 
1 1 1 -13 14  12 o 18 3.86623e+00 1.23404e+00 1.01504e+02 82.581  6.11728e-01  4.69769e+00  0.00000e+00 0.00000e+00 2.76071e+01 82.581  7.38968e+01 262.581 0.8869 
1 1 1 -13 14  13 o 4  4.45713e+00 1.30905e+00 7.09174e+01 325.927 3.30854e+00  -2.23781e+00 0.00000e+00 0.00000e+00 7.37775e+01 325.927 2.86010e+00 325.927 0.8633 
1 1 1 -13 14  14 o 1  3.84296e+00 1.21654e+00 3.12875e+00 232.292 -1.07225e-01 -1.38694e-01 0.00000e+00 0.00000e+00 9.47281e+00 232.292 6.34406e+00 232.292 0.0873 
1 1 1 -13 14  15 o 9  3.77848e+00 1.21328e+00 4.68156e+01 20.973  2.69154e+00  1.03172e+00  0.00000e+00 0.00000e+00 6.66690e+01 20.973  1.98533e+01 20.973  0.8009 
1 1 1 -13 14  16 o 11 5.96457e+00 1.50074e+00 1.46862e+02 261.953 -1.76304e+00 -1.24701e+01 0.00000e+00 0.00000e+00 6.74238e+01 261.953 7.94383e+01 81.953  0.9594 
1 1 1 -13 14  17 o 16 5.35203e+00 1.41939e+00 5.22184e+01 132.999 -3.11863e+00 3.34442e+00  0.00000e+00 0.00000e+00 1.24358e+02 132.999 7.21394e+01 132.999 0.8824 
1 1 1 -13 15  1  o 3  1.18130e+01 1.28065e+00 1.79873e+02 74.958  2.81409e+00  1.04714e+01  0.00000e+00 0.00000e+00 2.48180e+02 74.958  6.83067e+01 74.958  0.9527 
1 1 1 -13 15  2  o 11 1.49361e+01 1.13511e+00 1.61526e+02 246.871 -4.99801e+00 -1.17012e+01 0.00000e+00 0.00000e+00 3.83424e+02 246.871 2.21898e+02 246.871 0.9599 
1 1 1 -13 15  3  o 1  6.55891e+00 1.50747e+00 7.72497e+01 359.401 2.55737e+00  -2.67459e-02 0.00000e+00 0.00000e+00 1.14867e+02 359.401 3.76168e+01 359.401 0.7711 
1 1 1 -13 15  4  o 18 1.01684e+01 1.29085e+00 1.42209e+02 65.367  3.55327e+00  7.74913e+00  0.00000e+00 0.00000e+00 2.20357e+02 65.367  7.81482e+01 65.367  0.9394 
1 1 1 -13 15  5  o 12 9.17553e+00 1.33546e+00 2.13739e+02 98.162  -1.74693e+00 1.21801e+01  0.00000e+00 0.00000e+00 1.19806e+02 98.162  9.39334e+01 278.162 0.9585 
1 1 1 -13 15  6  o 12 1.49120e+01 1.02870e+00 2.30664e+02 52.357  1.59168e+01  2.06364e+01  0.00000e+00 0.00000e+00 3.23469e+02 52.357  9.28048e+01 52.357  0.9806 
1 1 1 -13 15  7  f 0  5.64631e+00 1.42814e+00 2.13594e+02 121.370 -4.47206e+00 7.33509e+00  0.00000e+00 0.00000e+00 1.26834e+01 301.370 2.26277e+02 301.370 0.9399 
1 1 1 -13 15  8  o 4  7.66848e+00 1.31405e+00 1.48701e+02 55.697  5.45648e+00  7.99786e+00  0.00000e+00 0.00000e+00 1.25925e+02 55.697  2.27765e+01 235.696 0.9469 
1 1 1 -13 15  9  o 8  1.20498e+01 1.10575e+00 1.93384e+02 139.382 -1.60061e+01 1.37276e+01  0.00000e+00 0.00000e+00 2.50963e+02 139.382 5.75792e+01 139.382 0.9760 
1 1 1 -13 15  10 o 17 3.91606e+00 1.25131e+00 5.33073e+01 290.787 7.77549e-01  -2.04827e+00 0.00000e+00 0.00000e+00 5.41051e+01 290.787 7.97791e-01 290.787 0.7268 
1 1 1 -13 15  11 o 4  4.04242e+00 1.24543e+00 1.07671e+02 98.375  -7.22623e-01 4.90866e+00  0.00000e+00 0.00000e+00 2.83330e+01 98.375  7.93377e+01 278.375 0.8925 
1 1 1 -13 15  12 o 19 3.99839e+00 1.25089e+00 1.96942e+01 192.439 -9.18873e-01 -2.02685e-01 0.00000e+00 0.00000e+00 4.42987e+01 192.439 2.46044e+01 192.439 0.4251 
1 1 1 -13 15  13 f 0  7.97644e+00 1.50593e+00 1.66915e+02 321.989 1.18914e+01  -9.29427e+00 0.00000e+00 0.00000e+00 1.22906e+02 321.989 4.40090e+01 141.989 0.9663 
1 1 1 -13 15  14 o 18 5.73252e+00 1.47225e+00 8.74345e+01 268.372 -1.74656e-01 -6.14519e+00 0.00000e+00 0.00000e+00 1.09447e+02 268.372 2.20128e+01 268.372 0.9146 
1 1 1 -13 15  15 o 3  5.52967e+00 1.45123e+00 9.14432e+01 235.388 -3.91888e+00 -5.67827e+00 0.00000e+00 0.00000e+00 1.00235e+02 235.388 8.79181e+00 235.388 0.9244 
1 1 1 -13 15  16 o 1  4.39989e+00 1.31698e+00 9.42888e+01 54.674  4.00563e+00  5.65186e+00  0.00000e+00 0.00000e+00 5.80562e+01 54.674  3.62326e+01 234.674 0.9247 
1 1 1 -13 15  17 o 6  4.99592e+00 1.43664e+00 8.63126e+01 271.793 2.17418e-01  -6.94501e+00 0.00000e+00 0.00000e+00 8.64497e+01 271.793 1.37055e-01 271.793 0.9250 
1 1 1 -13 16  1  o 1  1.55511e+01 1.08707e+00 1.98013e+02 309.807 1.05166e+01  -1.26195e+01 0.00000e+00 0.00000e+00 3.75143e+02 309.807 1.77129e+02 309.807 0.9691 
1 1 1 -13 16  2  o 4  8.89119e+00 1.50736e+00 1.06517e+02 88.068  1.61691e-01  4.79246e+00  0.00000e+00 0.00000e+00 1.93719e+02 88.068  8.72021e+01 88.068  0.8884 
1 1 1 -13 16  3  o 7  1.25286e+01 1.32296e+00 2.09023e+02 329.997 1.22736e+01  -7.08710e+00 0.00000e+00 0.00000e+00 2.49752e+02 329.997 4.07293e+01 329.997 0.9640 
1 1 1 -13 16  4  o 11 2.54852e+01 8.96889e-01 3.76115e+02 193.424 -6.28294e+01 -1.49961e+01 0.00000e+00 0.00000e+00 5.83674e+02 193.424 2.07559e+02 193.424 0.9922 
1 1 1 -13 16  5  o 10 1.79740e+01 9.26378e-01 2.58151e+02 10.914  3.20898e+01  6.18738e+00  0.00000e+00 0.00000e+00 4.13008e+02 10.914  1.54857e+02 10.914  0.9846 
1 1 1 -13 16  6  o 2  2.44589e+01 9.02080e-01 4.26713e+02 205.820 -7.00190e+01 -3.38792e+01 0.00000e+00 0.00000e+00 4.94126e+02 205.820 6.74130e+01 205.820 0.9936 
1 1 1 -13 16  7  o 6  9.51013e+00 1.32609e+00 2.07018e+02 3.302   1.45409e+01  8.38970e-01  0.00000e+00 0.00000e+00 1.40427e+02 3.302   6.65904e+01 183.302 0.9650 
1 1 1 -13 16  8  f 0  5.53004e+00 1.45223e+00 1.03054e+02 326.930 3.81738e+00  -2.48572e+00 0.00000e+00 0.00000e+00 8.14024e+01 326.930 2.16520e+01 146.930 0.8819 
1 1 1 -13 16  9  o 2  4.23879e+00 1.26740e+00 8.26595e+01 273.492 1.93673e-01  -3.17386e+00 0.00000e+00 0.00000e+00 4.90523e+01 273.492 3.36072e+01 93.492  0.8224 
1 1 1 -13 16  10 o 9  4.35023e+00 1.26910e+00 9.33481e+01 83.480  4.79346e-01  4.19447e+00  0.00000e+00 0.00000e+00 4.97375e+01 83.480  4.36107e+01 263.480 0.8715 
1 1 1 -13 16  11 o 2  1.52796e+01 1.05709e+00 2.58870e+02 282.286 1.05747e+01  -4.85578e+01 0.00000e+00 0.00000e+00 3.11278e+02 282.286 5.24080e+01 282.286 0.9899 
1 1 1 -13 16  12 o 3  4.64037e+00 1.25884e+00 5.09499e+01 31.131  2.40570e+00  1.45298e+00  0.00000e+00 0.00000e+00 8.79301e+01 31.131  3.69802e+01 31.131  0.7949 
1 1 1 -13 16  13 o 8  1.05761e+01 1.32929e+00 1.20685e+02 8.279   1.60218e+01  2.33123e+00  0.00000e+00 0.00000e+00 2.64501e+02 8.279   1.43816e+02 8.279   0.9686 
1 1 1 -13 16  14 o 1  6.15942e+00 1.51467e+00 1.53085e+02 199.097 -1.06142e+01 -3.67480e+00 0.00000e+00 0.00000e+00 6.76536e+01 199.097 8.54318e+01 19.097  0.9544 
1 1 1 -13 16  15 o 15 4.81194e+00 1.40182e+00 7.86310e+01 9.362   5.10572e+00  8.41772e-01  0.00000e+00 0.00000e+00 8.32700e+01 9.362   4.63896e+00 9.362   0.8973 
1 1 1 -13 16  16 o 2  4.82735e+00 1.39114e+00 6.11196e+01 203.333 -4.36647e+00 -1.88351e+00 0.00000e+00 0.00000e+00 9.92721e+01 203.333 3.81525e+01 203.333 0.8874 
1 1 1 -13 16  17 o 7  4.43042e+00 1.31850e+00 8.88479e+01 116.592 -3.14661e+00 6.28575e+00  0.00000e+00 0.00000e+00 6.45027e+01 116.592 2.43452e+01 296.592 0.9259 
1 1 1 -13 17  1  f 0  7.06243e+00 1.51189e+00 2.16899e+02 8.323   7.26378e+00  1.06266e+00  0.00000e+00 0.00000e+00 3.26644e+01 8.323   1.84235e+02 188.323 0.9292 
1 1 1 -13 17  2  o 10 1.08737e+01 1.29715e+00 2.27522e+02 165.269 -1.28257e+01 3.37223e+00  0.00000e+00 0.00000e+00 1.69859e+02 165.269 5.76631e+01 345.269 0.9615 
1 1 1 -13 17  3  o 8  5.60397e+00 1.50266e+00 8.88900e+01 359.705 2.55909e+00  -1.31778e-02 0.00000e+00 0.00000e+00 7.52765e+01 359.705 1.36135e+01 179.705 0.7713 
1 1 1 -13 17  4  o 19 1.39843e+01 1.04767e+00 2.19756e+02 353.626 1.98146e+01  -2.21357e+00 0.00000e+00 0.00000e+00 2.97516e+02 353.626 7.77595e+01 353.626 0.9746 
1 1 1 -13 17  5  o 6  8.50812e+00 1.41183e+00 1.38234e+02 288.987 2.30495e+00  -6.69896e+00 0.00000e+00 0.00000e+00 1.60697e+02 288.987 2.24630e+01 288.987 0.9265 
1 1 1 -13 17  6  o 16 1.89620e+01 9.16585e-01 2.46367e+02 79.948  6.04626e+00  3.41084e+01  0.00000e+00 0.00000e+00 4.61674e+02 79.948  2.15306e+02 79.948  0.9855 
1 1 1 -13 17  7  o 7  1.75880e+01 9.53726e-01 3.25992e+02 8.416   4.75757e+01  7.03860e+00  0.00000e+00 0.00000e+00 3.32864e+02 8.416   6.87151e+00 8.416   0.9895 
1 1 1 -13 17  8  o 7  1.89001e+01 9.31659e-01 4.14188e+02 179.594 -7.69384e+01 5.44825e-01  0.00000e+00 0.00000e+00 2.95933e+02 179.594 1.18255e+02 359.594 0.9935 
1 1 1 -13 17  9  o 12 4.61827e+00 1.29454e+00 1.31641e+02 9.124   5.37912e+00  8.63885e-01  0.00000e+00 0.00000e+00 2.58812e+01 9.124   1.05760e+02 189.124 0.9028 
1 1 1 -13 17  10 o 18 7.98233e+00 1.47678e+00 1.11493e+02 141.849 -6.35221e+00 4.98991e+00  0.00000e+00 0.00000e+00 1.70429e+02 141.849 5.89357e+01 141.849 0.9359 
1 1 1 -13 17  11 o 10 1.52241e+01 1.11478e+00 2.85352e+02 111.332 -1.89064e+01 4.84126e+01  0.00000e+00 0.00000e+00 2.82958e+02 111.332 2.39379e+00 291.332 0.9903 
1 1 1 -13 17  12 o 3  5.20617e+00 1.40917e+00 4.92029e+01 310.192 1.85849e+00  -2.19988e+00 0.00000e+00 0.00000e+00 1.07733e+02 310.192 5.85303e+01 310.192 0.8007 
1 1 1 -13 17  13 o 19 6.42736e+00 1.50642e+00 1.36519e+02 302.072 5.27560e+00  -8.41902e+00 0.00000e+00 0.00000e+00 9.26398e+01 302.072 4.38795e+01 122.072 0.9483 
1 1 1 -13 17  14 o 15 5.57385e+00 1.47927e+00 1.33174e+02 356.281 8.51750e+00  -5.53621e-01 0.00000e+00 0.00000e+00 6.34440e+01 356.281 6.97302e+01 176.281 0.9395 
1 1 1 -13 17  15 o 19 5.91504e+00 1.50010e+00 9.94675e+01 325.622 6.18511e+00  -4.23158e+00 0.00000e+00 0.00000e+00 1.06943e+02 325.622 7.47594e+00 325.622 0.9307 
1 1 1 -13 17  16 o 11 4.03655e+00 1.28291e+00 6.35779e+01 77.832  9.54772e-01  4.42801e+00  0.00000e+00 0.00000e+00 6.95982e+01 77.832  6.02030e+00 77.832  0.8812 
1 1 1 -13 17  17 o 18 6.29365e+00 1.43701e+00 6.25311e+01 210.430 -5.54009e+00 -3.25419e+00 0.00000e+00 0.00000e+00 1.53570e+02 210.430 9.10387e+01 210.430 0.9185 
1 1 1 -13 18  1  o 14 1.17915e+01 1.29338e+00 1.12419e+02 116.059 -3.12613e+00 6.39290e+00  0.00000e+00 0.00000e+00 3.03181e+02 116.059 1.90762e+02 116.059 0.9268 
1 1 1 -13 18  2  o 18 6.71200e+00 1.46321e+00 1.49708e+02 224.478 -3.66671e+00 -3.60053e+00 0.00000e+00 0.00000e+00 7.89877e+01 224.478 7.07198e+01 44.478  0.8965 
1 1 1 -13 18  3  o 3  8.32562e+00 1.51074e+00 1.06215e+02 39.459  3.77560e+00  3.10780e+00  0.00000e+00 0.00000e+00 1.75455e+02 39.459  6.92400e+01 39.459  0.8908 
1 1 1 -13 18  4  o 8  8.44970e+00 1.47479e+00 1.32406e+02 205.487 -5.77855e+00 -2.75460e+00 0.00000e+00 0.00000e+00 1.62039e+02 205.487 2.96331e+01 205.487 0.9182 
1 1 1 -13 18  5  o 13 1.37063e+01 1.05404e+00 2.36090e+02 199.460 -2.04073e+01 -7.21056e+00 0.00000e+00 0.00000e+00 2.71524e+02 199.460 3.54340e+01 199.460 0.9766 
1 1 1 -13 18  6  o 11 1.02952e+01 1.16728e+00 2.27655e+02 34.206  1.44469e+01  9.82042e+00  0.00000e+00 0.00000e+00 1.51088e+02 34.206  7.65673e+01 214.206 0.9709 
1 1 1 -13 18  7  o 10 1.11646e+01 1.13994e+00 2.40004e+02 314.851 1.49303e+01  -1.50079e+01 0.00000e+00 0.00000e+00 1.72518e+02 314.851 6.74864e+01 134.851 0.9761 
1 1 1 -13 18  8  o 5  3.44050e+00 1.11750e+00 9.02992e+01 185.219 -2.79915e+00 -2.55677e-01 0.00000e+00 0.00000e+00 1.31335e+01 185.219 7.71657e+01 5.219   0.7950 
1 1 1 -13 18  9  o 6  1.39237e+01 1.07367e+00 2.66404e+02 221.200 -2.74147e+01 -2.39996e+01 0.00000e+00 0.00000e+00 2.52334e+02 221.200 1.40700e+01 41.200  0.9862 
1 1 1 -13 18  10 o 15 8.35640e+00 1.44209e+00 1.55539e+02 242.277 -5.58101e+00 -1.06200e+01 0.00000e+00 0.00000e+00 1.46356e+02 242.277 9.18344e+00 62.277  0.9574 
1 1 1 -13 18  11 o 1  7.70969e+00 1.47552e+00 1.30616e+02 335.675 9.06326e+00  -4.09689e+00 0.00000e+00 0.00000e+00 1.44958e+02 335.675 1.43424e+01 335.675 0.9483 
1 1 1 -13 18  12 o 18 5.86442e+00 1.35831e+00 6.43164e+01 285.334 1.15515e+00  -4.21258e+00 0.00000e+00 0.00000e+00 1.29150e+02 285.334 6.48340e+01 285.334 0.8763 
1 1 1 -13 18  13 o 15 3.47209e+00 1.15520e+00 6.41411e+01 173.061 -2.98444e+00 3.63245e-01  0.00000e+00 0.00000e+00 4.16580e+01 173.061 2.24831e+01 353.060 0.8105 
1 1 1 -13 18  14 o 1  5.20923e+00 1.44699e+00 8.62713e+01 189.435 -5.20030e+00 -8.64201e-01 0.00000e+00 0.00000e+00 8.96267e+01 189.435 3.35541e+00 189.435 0.8993 
1 1 1 -13 18  15 o 14 1.34885e+01 1.24207e+00 2.28987e+02 278.987 7.39018e+00  -4.67275e+01 0.00000e+00 0.00000e+00 2.71373e+02 278.987 4.23860e+01 278.987 0.9894 
1 1 1 -13 18  16 o 2  9.95543e+00 1.39510e+00 1.71686e+02 81.775  3.92406e+00  2.71487e+01  0.00000e+00 0.00000e+00 1.94174e+02 81.775  2.24880e+01 81.775  0.9816 
1 1 1 -13 18  17 f 0  3.60312e+00 1.16377e+00 6.95830e+01 243.065 -2.36642e+00 -4.65743e+00 0.00000e+00 0.00000e+00 5.14133e+01 243.065 1.81697e+01 63.065  0.8983 
1 1 1 -13 19  1  o 14 1.14965e+01 1.33469e+00 2.03122e+02 332.151 1.09463e+01  -5.78330e+00 0.00000e+00 0.00000e+00 2.16014e+02 332.151 1.28917e+01 332.151 0.9587 
1 1 1 -13 19  2  o 10 7.55204e+00 1.52930e+00 1.90482e+02 45.373  5.15800e+00  5.22560e+00  0.00000e+00 0.00000e+00 7.61963e+01 45.373  1.14286e+02 225.373 0.9292 
1 1 1 -13 19  3  o 2  8.68027e+00 1.53607e+00 1.20304e+02 101.964 -1.18592e+00 5.59643e+00  0.00000e+00 0.00000e+00 1.78959e+02 101.964 5.86547e+01 101.964 0.9078 
1 1 1 -13 19  4  o 13 2.04929e+01 1.05758e+00 4.31193e+02 275.448 5.69593e+00  -5.97246e+01 0.00000e+00 0.00000e+00 3.40008e+02 275.448 9.11854e+01 95.448  0.9916 
1 1 1 -13 19  5  o 2  1.41085e+01 1.01170e+00 2.39127e+02 134.355 -1.67793e+01 1.71615e+01  0.00000e+00 0.00000e+00 2.84600e+02 134.355 4.54731e+01 134.355 0.9789 
1 1 1 -13 19  6  o 17 4.18219e+00 1.20448e+00 9.20220e+01 5.772   2.81512e+00  2.84574e-01  0.00000e+00 0.00000e+00 3.41917e+01 5.772   5.78303e+01 185.772 0.7965 
1 1 1 -13 19  7  o 17 1.66174e+01 9.33829e-01 2.67358e+02 97.215  -4.70491e+00 3.71636e+01  0.00000e+00 0.00000e+00 3.53198e+02 97.215  8.58402e+01 97.215  0.9866 
1 1 1 -13 19  8  o 12 1.23504e+01 1.07621e+00 2.79908e+02 208.707 -2.78345e+01 -1.52434e+01 0.00000e+00 0.00000e+00 1.79706e+02 208.707 1.00202e+02 28.707  0.9841 
1 1 1 -13 19  9  o 12 7.86299e+00 1.30305e+00 1.19074e+02 301.767 4.56948e+00  -7.37936e+00 0.00000e+00 0.00000e+00 1.60282e+02 301.767 4.12081e+01 301.767 0.9405 
1 1 1 -13 19  10 o 12 1.61620e+01 1.06683e+00 3.06722e+02 54.600  3.16776e+01  4.45748e+01  0.00000e+00 0.00000e+00 2.97535e+02 54.600  9.18667e+00 234.600 0.9908 
1 1 1 -13 19  11 o 15 4.55363e+00 1.33862e+00 8.23056e+01 0.901   3.93780e+00  6.19493e-02  0.00000e+00 0.00000e+00 6.54837e+01 0.901   1.68219e+01 180.901 0.8611 
1 1 1 -13 19  12 o 17 7.12730e+00 1.47686e+00 1.51186e+02 200.865 -1.03609e+01 -3.94911e+00 0.00000e+00 0.00000e+00 1.04714e+02 200.865 4.64718e+01 20.865  0.9538 
1 1 1 -13 19  13 o 9  7.52030e+00 1.49568e+00 9.40983e+01 22.302  7.18649e+00  2.94764e+00  0.00000e+00 0.00000e+00 1.69749e+02 22.302  7.56505e+01 22.302  0.9332 
1 1 1 -13 19  14 o 12 4.06019e+00 1.28923e+00 5.96761e+01 210.501 -2.82896e+00 -1.66644e+00 0.00000e+00 0.00000e+00 6.66850e+01 210.501 7.00888e+00 210.501 0.8289 
1 1 1 -13 19  15 o 4  4.34763e+00 1.34287e+00 5.75821e+01 97.452  -4.60292e-01 3.51892e+00  0.00000e+00 0.00000e+00 7.99285e+01 97.452  2.23465e+01 97.452  0.8436 
1 1 1 -13 19  16 o 3  5.24983e+00 1.44604e+00 9.12617e+01 54.545  4.28576e+00  6.01833e+00  0.00000e+00 0.00000e+00 9.14449e+01 54.545  1.83281e-01 54.545  0.9296 
1 1 1 -13 19  17 o 4  5.00754e+00 1.36028e+00 6.34671e+01 295.994 2.56376e+00  -5.25794e+00 0.00000e+00 0.00000e+00 1.06858e+02 295.994 4.33911e+01 295.994 0.9100 
1 1 1 -13 20  1  o 15 1.19299e+01 1.29685e+00 2.11800e+02 96.416  -1.53980e+00 1.36929e+01  0.00000e+00 0.00000e+00 2.25055e+02 96.416  1.32546e+01 96.416  0.9630 
1 1 1 -13 20  2  o 8  1.38213e+01 1.13774e+00 2.13526e+02 168.765 -1.64140e+01 3.26039e+00  0.00000e+00 0.00000e+00 2.95765e+02 168.765 8.22392e+01 168.765 0.9696 
1 1 1 -13 20  3  o 17 1.24069e+01 1.24338e+00 2.30988e+02 342.937 1.63708e+01  -5.02473e+00 0.00000e+00 0.00000e+00 2.26207e+02 342.937 4.78103e+00 162.937 0.9703 
1 1 1 -13 20  4  o 11 9.87198e+00 1.34451e+00 2.69054e+02 199.804 -1.55610e+01 -5.60340e+00 0.00000e+00 0.00000e+00 9.40620e+01 199.804 1.74992e+02 19.804  0.9693 
1 1 1 -13 20  5  o 12 8.96541e+00 1.48016e+00 1.44357e+02 36.281  6.40525e+00  4.70184e+00  0.00000e+00 0.00000e+00 1.73419e+02 36.281  2.90615e+01 36.281  0.9348 
1 1 1 -13 20  6  o 11 1.44170e+01 1.01172e+00 2.73122e+02 293.591 1.24711e+01  -2.85569e+01 0.00000e+00 0.00000e+00 2.64235e+02 293.591 8.88770e+00 113.591 0.9838 
1 1 1 -13 20  7  o 4  7.06455e+00 1.36613e+00 1.40999e+02 201.321 -7.05490e+00 -2.75358e+00 0.00000e+00 0.00000e+00 1.08060e+02 201.321 3.29389e+01 21.321  0.9314 
1 1 1 -13 20  8  o 8  1.32182e+01 1.04239e+00 2.15791e+02 68.989  9.90020e+00  2.57758e+01  0.00000e+00 0.00000e+00 2.74895e+02 68.989  5.91042e+01 68.989  0.9817 
1 1 1 -13 20  9  o 10 5.83447e+00 1.29942e+00 7.57641e+01 207.553 -3.63563e+00 -1.89690e+00 0.00000e+00 0.00000e+00 1.15377e+02 207.553 3.96133e+01 207.553 0.8673 
1 1 1 -13 20  10 o 17 8.99387e+00 1.35389e+00 2.42618e+02 14.343  2.14282e+01  5.47917e+00  0.00000e+00 0.00000e+00 8.89777e+01 14.343  1.53640e+02 194.343 0.9771 
1 1 1 -13 20  11 o 16 1.28970e+01 1.14810e+00 2.67242e+02 228.789 -2.63137e+01 -3.00466e+01 0.00000e+00 0.00000e+00 2.12699e+02 228.789 5.45433e+01 48.789  0.9874 
1 1 1 -13 20  12 o 6  1.28880e+01 1.13225e+00 1.92812e+02 88.417  8.54407e-01  3.09259e+01  0.00000e+00 0.00000e+00 2.84412e+02 88.417  9.16004e+01 88.417  0.9837 
1 1 1 -13 20  13 o 19 7.35891e+00 1.34928e+00 1.37675e+02 356.201 1.29066e+01  -8.56958e-01 0.00000e+00 0.00000e+00 1.28054e+02 356.201 9.62144e+00 176.201 0.9605 
1 1 1 -13 20  14 o 5  7.13287e+00 1.53349e+00 1.20202e+02 184.546 -9.84696e+00 -7.82930e-01 0.00000e+00 0.00000e+00 1.33647e+02 184.546 1.34450e+01 184.546 0.9479 
1 1 1 -13 20  15 o 6  5.11223e+00 1.43490e+00 7.26588e+01 348.710 4.83201e+00  -9.64667e-01 0.00000e+00 0.00000e+00 9.82362e+01 348.710 2.55774e+01 348.710 0.8917 
1 1 1 -13 20  16 o 19 6.34646e+00 1.48048e+00 1.04525e+02 332.369 8.80252e+00  -4.60794e+00 0.00000e+00 0.00000e+00 1.20761e+02 332.369 1.62359e+01 332.369 0.9483 
1 1 1 -13 20  17 o 5  4.27190e+00 1.28504e+00 6.33344e+01 147.569 -4.51021e+00 2.86564e+00  0.00000e+00 0.00000e+00 8.04966e+01 147.569 1.71622e+01 147.569 0.9008 
1 1 1 -13 21  1  o 17 1.82108e+01 1.24002e+00 2.65828e+02 235.145 -1.52915e+01 -2.19565e+01 0.00000e+00 0.00000e+00 4.13539e+02 235.145 1.47711e+02 235.145 0.9811 
1 1 1 -13 21  2  o 9  1.36669e+01 1.15343e+00 3.09603e+02 251.468 -8.26093e+00 -2.46434e+01 0.00000e+00 0.00000e+00 1.99644e+02 251.468 1.09959e+02 71.468  0.9806 
1 1 1 -13 21  3  o 9  1.79722e+01 1.05707e+00 2.97042e+02 140.589 -2.67166e+01 2.19535e+01  0.00000e+00 0.00000e+00 3.75492e+02 140.589 7.84505e+01 140.589 0.9854 
1 1 1 -13 21  4  o 4  5.41527e+00 1.44112e+00 1.12991e+02 158.593 -3.45571e+00 1.35474e+00  0.00000e+00 0.00000e+00 6.19707e+01 158.593 5.10204e+01 338.593 0.8514 
1 1 1 -13 21  5  f 0  9.58013e+00 1.40477e+00 1.02292e+02 102.368 -1.41016e+00 6.43086e+00  0.00000e+00 0.00000e+00 2.32093e+02 102.368 1.29800e+02 102.368 0.9206 
1 1 1 -13 21  6  o 18 7.19012e+00 1.41401e+00 1.49778e+02 127.231 -4.49268e+00 5.91225e+00  0.00000e+00 0.00000e+00 1.03540e+02 127.231 4.62379e+01 307.231 0.9300 
1 1 1 -13 21  7  o 14 7.82155e+00 1.34541e+00 1.63330e+02 267.129 -4.89816e-01 -9.76823e+00 0.00000e+00 0.00000e+00 1.17134e+02 267.129 4.61959e+01 87.129  0.9474 
1 1 1 -13 21  8  o 18 3.04808e+01 9.45300e-01 5.28311e+02 79.432  2.96048e+01  1.58688e+02  0.00000e+00 0.00000e+00 6.20627e+02 79.432  9.23157e+01 79.432  0.9969 
1 1 1 -13 21  9  o 10 1.29247e+01 1.05132e+00 1.78118e+02 300.748 1.27534e+01  -2.14382e+01 0.00000e+00 0.00000e+00 3.00183e+02 300.748 1.22066e+02 300.748 0.9797 
1 1 1 -13 21  10 o 5  5.07885e+00 1.38916e+00 1.06902e+02 87.904  1.97502e-01  5.39536e+00  0.00000e+00 0.00000e+00 6.59206e+01 87.904  4.09815e+01 267.904 0.9019 
1 1 1 -13 21  11 o 11 9.95715e+00 1.28337e+00 1.28745e+02 311.098 1.00650e+01  -1.15385e+01 0.00000e+00 0.00000e+00 2.34032e+02 311.098 1.05287e+02 311.098 0.9668 
1 1 1 -13 21  12 o 19 6.25149e+00 1.47568e+00 6.29526e+01 73.970  1.11756e+00  3.88959e+00  0.00000e+00 0.00000e+00 1.40658e+02 73.970  7.77051e+01 73.970  0.8653 
1 1 1 -13 21  13 o 3  3.61237e+00 1.15124e+00 6.62619e+01 51.655  2.14977e+00  2.71772e+00  0.00000e+00 0.00000e+00 4.77051e+01 51.655  1.85568e+01 231.655 0.8393 
1 1 1 -13 21  14 o 12 3.93103e+00 1.24817e+00 6.74324e+01 343.447 3.58731e+00  -1.06622e+00 0.00000e+00 0.00000e+00 5.84232e+01 343.447 9.00914e+00 163.447 0.8528 
1 1 1 -13 21  15 o 12 3.58089e+00 1.16894e+00 8.96189e+01 201.737 -5.07463e+00 -2.02328e+00 0.00000e+00 0.00000e+00 3.16156e+01 201.737 5.80033e+01 21.737  0.9031 
1 1 1 -13 21  16 o 19 3.95454e+00 1.24246e+00 7.26150e+01 25.776  4.43056e+00  2.13957e+00  0.00000e+00 0.00000e+00 5.93526e+01 25.776  1.32625e+01 205.776 0.8915 
1 1 1 -13 21  17 o 19 3.75855e+00 1.19396e+00 5.40816e+01 5.368   4.35814e+00  4.09485e-01  0.00000e+00 0.00000e+00 6.90625e+01 5.368   1.49809e+01 5.368   0.8766 
1 1 1 -13 22  1  o 11 4.95414e+00 1.39023e+00 1.62475e+02 188.486 -4.56962e+00 -6.81778e-01 0.00000e+00 0.00000e+00 3.99078e+00 188.486 1.58484e+02 8.486   0.8838 
1 1 1 -13 22  2  o 5  2.32179e+01 1.01144e+00 4.19133e+02 302.039 3.28312e+01  -5.24616e+01 0.00000e+00 0.00000e+00 4.55933e+02 302.039 3.67999e+01 302.039 0.9919 
1 1 1 -13 22  3  f 0  1.19971e+01 1.27279e+00 1.76648e+02 147.409 -1.08770e+01 6.95375e+00  0.00000e+00 0.00000e+00 2.60888e+02 147.409 8.42404e+01 147.409 0.9605 
1 1 1 -13 22  4  o 2  1.28737e+01 1.22222e+00 2.17780e+02 29.848  1.57922e+01  9.06191e+00  0.00000e+00 0.00000e+00 2.57089e+02 29.848  3.93088e+01 29.848  0.9721 
1 1 1 -13 22  5  o 15 1.35300e+01 1.14430e+00 2.04326e+02 169.006 -1.98797e+01 3.86208e+00  0.00000e+00 0.00000e+00 2.95814e+02 169.006 9.14881e+01 169.006 0.9750 
1 1 1 -13 22  6  o 9  7.10536e+00 1.57854e+00 2.16226e+02 309.085 6.51843e+00  -8.02512e+00 0.00000e+00 0.00000e+00 3.95634e+01 309.085 1.76663e+02 129.085 0.9503 
1 1 1 -13 22  7  o 12 1.23997e+01 1.04481e+00 3.05625e+02 109.387 -1.08691e+01 3.08861e+01  0.00000e+00 0.00000e+00 1.56433e+02 109.387 1.49192e+02 289.387 0.9846 
1 1 1 -13 22  8  o 1  5.65173e+00 1.43219e+00 1.56308e+02 280.910 1.33840e+00  -6.94376e+00 0.00000e+00 0.00000e+00 4.16344e+01 280.910 1.14673e+02 100.910 0.9263 
1 1 1 -13 22  9  o 7  1.57758e+01 1.02832e+00 2.74629e+02 41.655  3.53918e+01  3.14834e+01  0.00000e+00 0.00000e+00 3.14892e+02 41.655  4.02625e+01 41.655  0.9894 
1 1 1 -13 22  10 o 14 7.34656e+00 1.41930e+00 1.28972e+02 304.038 5.21445e+00  -7.71983e+00 0.00000e+00 0.00000e+00 1.32870e+02 304.038 3.89812e+00 304.038 0.9447 
1 1 1 -13 22  11 o 12 5.49594e+00 1.36146e+00 1.17220e+02 288.570 2.34064e+00  -6.96722e+00 0.00000e+00 0.00000e+00 7.52336e+01 288.570 4.19865e+01 108.570 0.9292 
1 1 1 -13 22  12 o 8  3.40113e+00 1.12229e+00 8.67756e+01 19.321  3.84695e+00  1.34878e+00  0.00000e+00 0.00000e+00 2.41331e+01 19.321  6.26425e+01 199.321 0.8664 
1 1 1 -13 22  13 o 5  4.42646e+00 1.30998e+00 5.09793e+01 282.506 6.61467e-01  -2.98231e+00 0.00000e+00 0.00000e+00 8.44521e+01 282.506 3.34728e+01 282.506 0.8140 
1 1 1 -13 22  14 o 13 5.33127e+00 1.43899e+00 1.06803e+02 27.711  6.26052e+00  3.28835e+00  0.00000e+00 0.00000e+00 7.85800e+01 27.711  2.82230e+01 207.711 0.9263 
1 1 1 -13 22  15 o 13 4.62859e+00 1.38322e+00 5.53475e+01 198.821 -3.51233e+00 -1.19715e+00 0.00000e+00 0.00000e+00 9.23750e+01 198.821 3.70275e+01 198.821 0.8514 
1 1 1 -13 22  16 o 19 4.30114e+00 1.29599e+00 4.28197e+01 46.018  2.09820e+00  2.17412e+00  0.00000e+00 0.00000e+00 8.78364e+01 46.018  4.50167e+01 46.018  0.8116 
1 1 1 -13 22  17 o 3  3.78748e+00 1.18248e+00 6.44912e+01 177.914 -5.21197e+00 1.89863e-01  0.00000e+00 0.00000e+00 6.26420e+01 177.914 1.84919e+00 357.914 0.8982 
1 1 1 -13 23  1  o 9  1.60950e+01 1.22977e+00 2.53287e+02 227.163 -1.66451e+01 -1.79517e+01 0.00000e+00 0.00000e+00 3.45992e+02 227.163 9.27046e+01 227.163 0.9794 
1 1 1 -13 23  2  o 5  2.39728e+01 9.53652e-01 4.24750e+02 101.420 -1.34144e+01 6.64060e+01  0.00000e+00 0.00000e+00 4.79353e+02 101.420 5.46028e+01 101.420 0.9926 
1 1 1 -13 23  3  o 12 1.71009e+01 9.95892e-01 2.65252e+02 213.443 -2.61319e+01 -1.72591e+01 0.00000e+00 0.00000e+00 3.73610e+02 213.443 1.08358e+02 213.443 0.9839 
1 1 1 -13 23  4  o 15 1.64918e+01 1.03557e+00 3.24530e+02 75.270  9.15904e+00  3.48391e+01  0.00000e+00 0.00000e+00 2.92447e+02 75.270  3.20830e+01 255.270 0.9860 
1 1 1 -13 23  5  o 8  1.52204e+01 1.08091e+00 3.45293e+02 293.958 1.51627e+01  -3.41231e+01 0.00000e+00 0.00000e+00 2.23951e+02 293.958 1.21342e+02 113.958 0.9865 
1 1 1 -13 23  6  o 9  6.40406e+00 1.49433e+00 1.08811e+02 73.344  1.38789e+00  4.63888e+00  0.00000e+00 0.00000e+00 1.06982e+02 73.344  1.82944e+00 253.344 0.8896 
1 1 1 -13 23  7  o 12 8.28200e+00 1.48991e+00 1.14757e+02 270.971 1.17423e-01  -6.92624e+00 0.00000e+00 0.00000e+00 1.75067e+02 270.971 6.03092e+01 270.971 0.9247 
1 1 1 -13 23  8  o 4  1.23994e+01 1.15152e+00 2.75720e+02 356.156 3.06356e+01  -2.05860e+00 0.00000e+00 0.00000e+00 1.85360e+02 356.156 9.03601e+01 176.156 0.9836 
1 1 1 -13 23  9  o 16 9.97474e+00 1.29662e+00 1.32512e+02 74.800  3.47314e+00  1.27834e+01  0.00000e+00 0.00000e+00 2.29694e+02 74.800  9.71824e+01 74.800  0.9615 
1 1 1 -13 23  10 o 7  6.62121e+00 1.37935e+00 1.49508e+02 192.671 -9.69110e+00 -2.17882e+00 0.00000e+00 0.00000e+00 8.73520e+01 192.671 6.21557e+01 12.671  0.9482 
1 1 1 -13 23  11 o 2  1.03073e+01 1.19135e+00 1.77064e+02 314.648 1.58243e+01  -1.60202e+01 0.00000e+00 0.00000e+00 2.02607e+02 314.648 2.55430e+01 314.648 0.9775 
1 1 1 -13 23  12 o 19 4.98047e+00 1.38853e+00 1.58568e+02 115.641 -3.80257e+00 7.92214e+00  0.00000e+00 0.00000e+00 1.78615e+01 115.641 1.40707e+02 295.641 0.9413 
1 1 1 -13 23  13 o 17 5.07564e+00 1.36363e+00 7.46426e+01 1.809   4.94263e+00  1.56082e-01  0.00000e+00 0.00000e+00 9.55487e+01 1.809   2.09061e+01 1.809   0.8921 
1 1 1 -13 23  14 o 5  5.66479e+00 1.42851e+00 1.18780e+02 123.028 -4.63763e+00 7.13372e+00  0.00000e+00 0.00000e+00 8.09386e+01 123.028 3.78411e+01 303.028 0.9393 
1 1 1 -13 23  15 o 16 4.31745e+00 1.33078e+00 1.30644e+02 245.440 -3.50941e+00 -7.67951e+00 0.00000e+00 0.00000e+00 2.12792e+01 245.440 1.09365e+02 65.440  0.9388 
1 1 1 -13 23  16 o 8  3.38126e+00 1.11646e+00 4.46623e+01 333.646 2.73010e+00  -1.35252e+00 0.00000e+00 0.00000e+00 5.82751e+01 333.646 1.36128e+01 333.646 0.8134 
1 1 1 -13 24  1  o 16 9.32647e+00 1.41265e+00 1.55790e+02 113.176 -3.34548e+00 7.81445e+00  0.00000e+00 0.00000e+00 1.77208e+02 113.176 2.14183e+01 113.176 0.9392 
1 1 1 -13 24  2  o 19 1.35530e+01 1.14473e+00 1.97490e+02 324.231 1.37304e+01  -9.89120e+00 0.00000e+00 0.00000e+00 3.01971e+02 324.231 1.04481e+02 324.231 0.9700 
1 1 1 -13 24  3  f 0  1.06252e+01 1.32131e+00 2.82449e+02 203.982 -1.73123e+01 -7.70153e+00 0.00000e+00 0.00000e+00 1.10165e+02 203.982 1.72284e+02 23.982  0.9732 
1 1 1 -13 24  4  f 0  1.84580e+01 1.00413e+00 2.86979e+02 59.318  1.83052e+01  3.08521e+01  0.00000e+00 0.00000e+00 4.03470e+02 59.318  1.16492e+02 59.318  0.9860 
1 1 1 -13 24  5  o 7  9.93782e+00 1.33310e+00 2.16830e+02 37.863  1.11519e+01  8.66997e+00  0.00000e+00 0.00000e+00 1.46310e+02 37.863  7.05202e+01 217.863 0.9639 
1 1 1 -13 24  6  o 15 1.48807e+01 1.11838e+00 2.51786e+02 137.226 -2.19315e+01 2.02904e+01  0.00000e+00 0.00000e+00 3.02325e+02 137.226 5.05386e+01 137.226 0.9831 
1 1 1 -13 24  7  o 19 8.35783e+00 1.51850e+00 1.88445e+02 308.452 7.06187e+00  -8.89322e+00 0.00000e+00 0.00000e+00 1.13562e+02 308.452 7.48830e+01 128.452 0.9549 
1 1 1 -13 24  8  o 10 9.03775e+00 1.42445e+00 1.29943e+02 229.635 -6.36150e+00 -7.48395e+00 0.00000e+00 0.00000e+00 1.93832e+02 229.635 6.38894e+01 229.635 0.9476 
1 1 1 -13 24  9  o 2  4.74683e+00 1.36820e+00 1.11327e+02 20.098  4.79615e+00  1.75494e+00  0.00000e+00 0.00000e+00 4.92586e+01 20.098  6.20682e+01 200.098 0.8958 
1 1 1 -13 24  10 o 14 9.32560e+00 1.26451e+00 1.14448e+02 328.917 1.00160e+01  -6.03783e+00 0.00000e+00 0.00000e+00 2.21948e+02 328.917 1.07501e+02 328.917 0.9562 
1 1 1 -13 24  11 o 15 1.51153e+01 1.02443e+00 2.98716e+02 142.234 -4.81434e+01 3.72978e+01  0.00000e+00 0.00000e+00 2.66117e+02 142.234 3.25997e+01 322.234 0.9918 
1 1 1 -13 24  12 o 14 4.98737e+00 1.36443e+00 1.26266e+02 320.889 5.50830e+00  -4.47827e+00 0.00000e+00 0.00000e+00 4.76510e+01 320.889 7.86146e+01 140.889 0.9266 
1 1 1 -13 24  13 o 11 5.83249e+00 1.46221e+00 9.52222e+01 248.192 -2.42062e+00 -6.04967e+00 0.00000e+00 0.00000e+00 1.06385e+02 248.192 1.11630e+01 248.192 0.9197 
1 1 1 -13 24  14 o 13 4.10134e+00 1.28602e+00 6.15668e+01 352.874 3.48509e+00  -4.35693e-01 0.00000e+00 0.00000e+00 6.80095e+01 352.874 6.44267e+00 352.874 0.8417 
1 1 1 -13 24  15 o 3  5.20737e+00 1.44898e+00 1.28740e+02 216.274 -7.40254e+00 -5.43257e+00 0.00000e+00 0.00000e+00 5.54803e+01 216.274 7.32601e+01 36.274  0.9439 
1 1 1 -13 24  16 o 15 3.52329e+00 1.15107e+00 4.18765e+01 331.366 2.53548e+00  -1.38431e+00 0.00000e+00 0.00000e+00 6.37992e+01 331.366 2.19227e+01 331.366 0.8014 
1 1 1 -13 25  1  o 8  7.78991e+00 1.55294e+00 1.52417e+02 73.382  1.89589e+00  6.35249e+00  0.00000e+00 0.00000e+00 1.20355e+02 73.382  3.20620e+01 253.382 0.9211 
1 1 1 -13 25  2  o 5  1.06554e+01 1.23257e+00 1.14617e+02 204.469 -7.18212e+00 -3.26842e+00 0.00000e+00 0.00000e+00 2.63588e+02 204.469 1.48972e+02 204.469 0.9343 
1 1 1 -13 25  3  o 9  3.06131e+01 1.03062e+00 5.28636e+02 175.936 -1.10846e+02 7.87576e+00  0.00000e+00 0.00000e+00 6.28333e+02 175.936 9.96966e+01 175.936 0.9955 
1 1 1 -13 25  4  o 10 9.71506e+00 1.33742e+00 1.41521e+02 39.249  6.86031e+00  5.60497e+00  0.00000e+00 0.00000e+00 2.05564e+02 39.249  6.40428e+01 39.249  0.9417 
1 1 1 -13 25  5  o 19 1.86033e+01 1.00847e+00 2.58445e+02 170.263 -3.71294e+01 6.37160e+00  0.00000e+00 0.00000e+00 4.37311e+02 170.263 1.78866e+02 170.263 0.9866 
1 1 1 -13 25  6  o 15 1.25390e+01 1.19056e+00 2.44868e+02 331.622 2.09855e+01  -1.13363e+01 0.00000e+00 0.00000e+00 2.19966e+02 331.622 2.49019e+01 151.622 0.9788 
1 1 1 -13 25  7  o 8  1.00279e+01 1.34621e+00 2.07167e+02 264.546 -1.52449e+00 -1.59658e+01 0.00000e+00 0.00000e+00 1.60250e+02 264.546 4.69172e+01 84.546  0.9683 
1 1 1 -13 25  8  o 19 4.59514e+00 1.34928e+00 7.72047e+01 184.415 -3.05575e+00 -2.35928e-01 0.00000e+00 0.00000e+00 6.43059e+01 184.415 1.28988e+01 4.415   0.8147 
1 1 1 -13 25  9  f 0  1.09246e+01 1.38869e+00 4.50227e+01 119.495 -2.31324e+00 4.08941e+00  0.00000e+00 0.00000e+00 3.20438e+02 119.495 2.75415e+02 119.495 0.8859 
1 1 1 -13 25  10 o 13 4.87211e+00 1.43430e+00 9.74550e+01 243.660 -2.10733e+00 -4.25647e+00 0.00000e+00 0.00000e+00 6.55991e+01 243.660 3.18558e+01 63.660  0.8872 
1 1 1 -13 25  11 o 7  1.00656e+01 1.61848e+00 1.49852e+02 226.879 -9.98147e+00 -1.06585e+01 0.00000e+00 0.00000e+00 2.16160e+02 226.879 6.63075e+01 226.879 0.9651 
1 1 1 -13 25  12 o 1  4.68566e+00 1.45538e+00 4.36687e+01 10.468  2.30429e+00  4.25730e-01  0.00000e+00 0.00000e+00 8.80128e+01 10.468  4.43441e+01 10.468  0.7468 
1 1 1 -13 25  13 o 18 5.64092e+00 1.60657e+00 1.42627e+02 112.196 -3.24647e+00 7.95686e+00  0.00000e+00 0.00000e+00 5.66240e+01 112.196 8.60033e+01 292.196 0.9399 
1 1 1 -13 25  14 o 12 5.77237e+00 1.69364e+00 6.50653e+01 47.502  2.70342e+00  2.95049e+00  0.00000e+00 0.00000e+00 1.22026e+02 47.502  5.69611e+01 47.502  0.8636 
1 1 1 -13 25  15 f 0  6.10492e+00 1.74093e+00 1.15010e+02 234.953 -4.47142e+00 -6.37481e+00 0.00000e+00 0.00000e+00 9.85503e+01 234.953 1.64600e+01 54.953  0.9334 
1 1 1 -13 25  16 o 16 3.88704e+00 1.29511e+00 9.27686e+00 39.336  4.80069e-01  3.93438e-01  0.00000e+00 0.00000e+00 3.38248e+01 39.336  2.45479e+01 39.336  0.2963 
1 1 1 -13 26  1  o 2  1.77764e+01 1.32558e+00 2.76931e+02 75.028  7.98287e+00  2.98509e+01  0.00000e+00 0.00000e+00 3.87739e+02 75.028  1.10808e+02 75.028  0.9837 
1 1 1 -13 26  2  o 1  6.14825e+00 1.33368e+00 1.51251e+02 247.446 -2.24391e+00 -5.40291e+00 0.00000e+00 0.00000e+00 6.12790e+01 247.446 8.99715e+01 67.446  0.9100 
1 1 1 -13 26  3  o 13 2.59984e+01 9.84756e-01 4.88751e+02 60.826  4.22937e+01  7.57549e+01  0.00000e+00 0.00000e+00 4.92491e+02 60.826  3.73998e+00 60.826  0.9942 
1 1 1 -13 26  4  o 2  1.02480e+01 1.27234e+00 2.09606e+02 335.618 1.37657e+01  -6.23917e+00 0.00000e+00 0.00000e+00 1.66052e+02 335.618 4.35537e+01 155.618 0.9663 
1 1 1 -13 26  5  f 0  4.11427e+00 1.24820e+00 6.51525e+01 137.697 -1.43534e+00 1.30620e+00  0.00000e+00 0.00000e+00 4.21056e+01 137.697 2.30469e+01 317.697 0.6878 
1 1 1 -13 26  6  o 16 5.65466e+00 1.40945e+00 1.63226e+02 202.167 -6.12555e+00 -2.49563e+00 0.00000e+00 0.00000e+00 3.39946e+01 202.167 1.29231e+02 22.167  0.9210 
1 1 1 -13 26  7  o 2  6.66852e+00 1.50076e+00 1.09978e+02 328.248 4.87966e+00  -3.01989e+00 0.00000e+00 0.00000e+00 1.19144e+02 328.248 9.16562e+00 328.248 0.9081 
1 1 1 -13 26  8  o 13 7.37033e+00 1.47723e+00 1.30172e+02 203.740 -6.83391e+00 -3.00563e+00 0.00000e+00 0.00000e+00 1.29026e+02 203.740 1.14554e+00 23.740  0.9304 
1 1 1 -13 26  9  o 10 1.21959e+01 1.34769e+00 1.83722e+02 200.052 -1.96401e+01 -7.16875e+00 0.00000e+00 0.00000e+00 2.65636e+02 200.052 8.19138e+01 200.052 0.9758 
1 1 1 -13 26  10 o 19 7.29704e+00 1.65459e+00 1.29302e+02 84.599  7.61607e-01  8.05621e+00  0.00000e+00 0.00000e+00 1.28313e+02 84.599  9.89548e-01 264.599 0.9360 
1 1 1 -13 26  11 o 11 6.59378e+00 1.63809e+00 1.40507e+02 65.100  3.73015e+00  8.03595e+00  0.00000e+00 0.00000e+00 9.34354e+01 65.100  4.70719e+01 245.100 0.9417 
1 1 1 -13 26  12 o 8  5.94462e+00 1.63525e+00 1.25185e+02 318.513 5.69739e+00  -5.03829e+00 0.00000e+00 0.00000e+00 8.32261e+01 318.513 4.19593e+01 138.513 0.9317 
1 1 1 -13 26  13 o 10 5.13815e+00 1.54643e+00 9.15857e+01 302.779 2.86937e+00  -4.45596e+00 0.00000e+00 0.00000e+00 8.21745e+01 302.779 9.41120e+00 122.779 0.8999 
1 1 1 -13 26  14 o 2  1.01615e+01 1.81833e+00 1.87673e+02 333.659 1.67316e+01  -8.28415e+00 0.00000e+00 0.00000e+00 1.83318e+02 333.659 4.35489e+00 153.659 0.9728 
1 1 1 -13 26  15 o 8  3.96266e+00 1.32794e+00 5.61565e+01 208.617 -2.89798e+00 -1.58114e+00 0.00000e+00 0.00000e+00 6.71026e+01 208.617 1.09461e+01 208.617 0.8300 
1 1 1 -13 26  16 o 17 3.81292e+00 1.26438e+00 6.27554e+01 301.291 2.23868e+00  -3.68320e+00 0.00000e+00 0.00000e+00 6.20162e+01 301.291 7.39132e-01 121.292 0.8745 
1 1 1 -13 27  1  o 13 1.48510e+01 1.19163e+00 3.01448e+02 120.018 -1.47198e+01 2.54768e+01  0.00000e+00 0.00000e+00 2.53335e+02 120.018 4.81132e+01 300.018 0.9829 
1 1 1 -13 27  2  o 16 1.67784e+01 9.71191e-01 3.07513e+02 210.561 -3.09985e+01 -1.83037e+01 0.00000e+00 0.00000e+00 3.20894e+02 210.561 1.33807e+01 210.561 0.9860 
1 1 1 -13 27  3  o 8  1.07290e+01 1.29618e+00 2.14932e+02 6.657   1.42907e+01  1.66792e+00  0.00000e+00 0.00000e+00 1.77913e+02 6.657   3.70196e+01 186.657 0.9646 
1 1 1 -13 27  4  o 18 4.98466e+00 1.33393e+00 1.46923e+02 117.613 -2.33333e+00 4.46078e+00  0.00000e+00 0.00000e+00 2.21407e+01 117.613 1.24782e+02 297.613 0.8942 
1 1 1 -13 27  5  o 6  1.33826e+01 1.15096e+00 2.35374e+02 317.838 1.76626e+01  -1.59941e+01 0.00000e+00 0.00000e+00 2.61079e+02 317.838 2.57047e+01 317.838 0.9788 
1 1 1 -13 27  6  o 15 1.18332e+01 1.20840e+00 2.92467e+02 92.123  -9.88176e-01 2.66568e+01  0.00000e+00 0.00000e+00 1.47155e+02 92.123  1.45311e+02 272.123 0.9811 
1 1 1 -13 27  7  o 7  6.52454e+00 1.50013e+00 8.04896e+01 163.883 -3.89870e+00 1.12658e+00  0.00000e+00 0.00000e+00 1.33210e+02 163.883 5.27204e+01 163.883 0.8657 
1 1 1 -13 27  8  o 9  7.20086e+00 1.50015e+00 1.36920e+02 60.452  3.97498e+00  7.01214e+00  0.00000e+00 0.00000e+00 1.17756e+02 60.452  1.91647e+01 240.452 0.9357 
1 1 1 -13 27  9  o 7  9.90255e+00 1.42663e+00 1.17761e+02 106.305 -2.93862e+00 1.00459e+01  0.00000e+00 0.00000e+00 2.37792e+02 106.305 1.20031e+02 106.305 0.9510 
1 1 1 -13 27  10 o 6  6.37215e+00 1.56985e+00 1.59911e+02 149.500 -8.06543e+00 4.75096e+00  0.00000e+00 0.00000e+00 6.71909e+01 149.500 9.27200e+01 329.500 0.9450 
1 1 1 -13 27  11 o 17 8.68149e+00 1.63281e+00 1.34173e+02 152.869 -9.89665e+00 5.07120e+00  0.00000e+00 0.00000e+00 1.77799e+02 152.869 4.36264e+01 152.869 0.9539 
1 1 1 -13 27  12 f 0  4.65811e+00 1.41590e+00 8.52792e+01 77.918  9.33120e-01  4.35915e+00  0.00000e+00 0.00000e+00 6.87896e+01 77.918  1.64896e+01 257.918 0.8791 
1 1 1 -13 27  13 o 1  4.99537e+00 1.52390e+00 9.05430e+01 59.760  2.48185e+00  4.25741e+00  0.00000e+00 0.00000e+00 7.68342e+01 59.760  1.37088e+01 239.760 0.8917 
1 1 1 -13 27  14 o 10 3.41824e+00 1.18851e+00 3.70215e+01 334.899 1.74351e+00  -8.16753e-01 0.00000e+00 0.00000e+00 5.08609e+01 334.899 1.38394e+01 334.899 0.6851 
1 1 1 -13 27  15 o 10 5.19448e+00 1.60094e+00 1.19316e+02 146.358 -6.25771e+00 4.16416e+00  0.00000e+00 0.00000e+00 6.18838e+01 146.358 5.74318e+01 326.358 0.9309 
1 1 1 -13 27  16 o 4  4.87026e+00 1.49423e+00 1.08456e+02 303.404 4.31247e+00  -6.53912e+00 0.00000e+00 0.00000e+00 6.17150e+01 303.404 4.67406e+01 123.404 0.9338 
1 1 1 -13 28  1  o 2  1.58698e+01 1.33167e+00 2.62946e+02 95.939  -2.71355e+00 2.60845e+01  0.00000e+00 0.00000e+00 3.28577e+02 95.939  6.56315e+01 95.939  0.9807 
1 1 1 -13 28  2  o 19 1.07284e+01 1.15417e+00 2.19300e+02 53.469  9.13433e+00  1.23306e+01  0.00000e+00 0.00000e+00 1.74676e+02 53.469  4.46241e+01 233.469 0.9668 
1 1 1 -13 28  3  o 16 9.14858e+00 1.22815e+00 1.73012e+02 311.401 6.98748e+00  -7.92539e+00 0.00000e+00 0.00000e+00 1.57368e+02 311.401 1.56442e+01 131.401 0.9514 
1 1 1 -13 28  4  o 19 1.27032e+01 1.16742e+00 1.42741e+02 226.115 -8.69664e+00 -9.04197e+00 0.00000e+00 0.00000e+00 3.19447e+02 226.115 1.76706e+02 226.115 0.9593 
1 1 1 -13 28  5  o 2  1.51809e+01 1.04067e+00 2.88631e+02 134.641 -2.52531e+01 2.55715e+01  0.00000e+00 0.00000e+00 2.78631e+02 134.641 1.00001e+01 314.641 0.9860 
1 1 1 -13 28  6  o 4  6.81586e+00 1.46292e+00 1.57903e+02 153.658 -7.05082e+00 3.49109e+00  0.00000e+00 0.00000e+00 8.31746e+01 153.658 7.47280e+01 333.658 0.9341 
1 1 1 -13 28  7  o 18 4.59109e+00 1.32787e+00 1.22057e+02 146.420 -3.87873e+00 2.57510e+00  0.00000e+00 0.00000e+00 3.16068e+01 146.420 9.04498e+01 326.420 0.8847 
1 1 1 -13 28  8  o 1  8.42450e+00 1.43454e+00 1.80761e+02 155.354 -1.16480e+01 5.34425e+00  0.00000e+00 0.00000e+00 1.24943e+02 155.354 5.58179e+01 335.354 0.9602 
1 1 1 -13 28  9  o 14 8.01948e+00 1.54765e+00 1.46881e+02 349.298 1.04317e+01  -1.97148e+00 0.00000e+00 0.00000e+00 1.41253e+02 349.298 5.62855e+00 169.298 0.9517 
1 1 1 -13 28  10 o 18 5.89794e+00 1.58238e+00 7.53473e+01 118.022 -1.90317e+00 3.57599e+00  0.00000e+00 0.00000e+00 1.17150e+02 118.022 4.18031e+01 118.022 0.8655 
1 1 1 -13 28  11 o 8  3.63411e+00 1.20948e+00 3.23601e+01 232.165 -8.82729e-01 -1.13658e+00 0.00000e+00 0.00000e+00 4.71343e+01 232.165 1.47742e+01 232.165 0.5807 
1 1 1 -13 28  12 o 9  4.51418e+00 1.41575e+00 9.09817e+01 221.865 -3.62982e+00 -3.25285e+00 0.00000e+00 0.00000e+00 6.02341e+01 221.865 3.07475e+01 41.865  0.8904 
1 1 1 -13 28  13 o 13 9.62174e+00 1.79994e+00 1.94175e+02 299.934 8.54387e+00  -1.48380e+01 0.00000e+00 0.00000e+00 1.56628e+02 299.934 3.75476e+01 119.934 0.9703 
1 1 1 -13 28  14 o 10 4.36436e+00 1.41174e+00 1.49124e+02 138.539 -6.57100e+00 5.80554e+00  0.00000e+00 0.00000e+00 4.99832e+00 138.539 1.44125e+02 318.539 0.9411 
1 1 1 -13 28  15 o 7  8.37465e+00 2.37035e+00 6.96626e+01 353.697 4.16598e+00  -4.60135e-01 0.00000e+00 0.00000e+00 2.03498e+02 353.697 1.33836e+02 353.697 0.8705 
1 1 1 -13 28  16 o 19 5.26814e+00 1.57712e+00 1.24340e+02 198.453 -8.43005e+00 -2.81292e+00 0.00000e+00 0.00000e+00 6.13227e+01 198.453 6.30174e+01 18.453  0.9419 
1 1 1 -13 29  1  o 16 7.32385e+00 1.53469e+00 2.44597e+02 91.945  -3.51802e-01 1.03595e+01  0.00000e+00 0.00000e+00 1.99397e+01 91.945  2.24657e+02 271.945 0.9505 
1 1 1 -13 29  2  o 11 5.02460e+00 1.37849e+00 1.20033e+02 62.037  1.71945e+00  3.23888e+00  0.00000e+00 0.00000e+00 4.20521e+01 62.037  7.79806e+01 242.037 0.8494 
1 1 1 -13 29  3  f 0  2.97073e+01 9.59642e-01 5.23282e+02 247.532 -4.61112e+01 -1.11496e+02 0.00000e+00 0.00000e+00 5.99524e+02 247.532 7.62422e+01 247.532 0.9958 
1 1 1 -13 29  4  o 15 1.83681e+01 8.61369e-01 3.70621e+02 40.171  4.25305e+01  3.59048e+01  0.00000e+00 0.00000e+00 3.19706e+02 40.171  5.09146e+01 220.171 0.9910 
1 1 1 -13 29  5  o 7  7.39649e+00 1.44970e+00 1.19331e+02 164.048 -5.99784e+00 1.71443e+00  0.00000e+00 0.00000e+00 1.37388e+02 164.048 1.80567e+01 164.048 0.9159 
1 1 1 -13 29  6  o 6  1.03331e+01 1.29639e+00 1.97293e+02 339.954 1.50961e+01  -5.50821e+00 0.00000e+00 0.00000e+00 1.81567e+02 339.954 1.57261e+01 159.954 0.9684 
1 1 1 -13 29  7  f 0  5.08554e+00 1.40937e+00 1.27490e+02 272.842 2.67116e-01  -5.38060e+00 0.00000e+00 0.00000e+00 4.59638e+01 272.842 8.15261e+01 92.842  0.9017 
1 1 1 -13 29  8  o 15 1.08689e+01 1.30329e+00 2.43368e+02 352.604 2.43198e+01  -3.15693e+00 0.00000e+00 0.00000e+00 1.58910e+02 352.604 8.44587e+01 172.604 0.9794 
1 1 1 -13 29  9  o 7  6.00850e+00 1.53083e+00 1.17681e+02 243.579 -2.77816e+00 -5.59155e+00 0.00000e+00 0.00000e+00 9.00897e+01 243.579 2.75909e+01 63.579  0.9160 
1 1 1 -13 29  10 o 10 1.11794e+01 1.47858e+00 1.93251e+02 38.360  1.69916e+01  1.34483e+01  0.00000e+00 0.00000e+00 2.18471e+02 38.360  2.52200e+01 38.360  0.9766 
1 1 1 -13 29  11 o 7  4.05202e+00 1.31184e+00 8.55694e+01 43.147  2.91890e+00  2.73593e+00  0.00000e+00 0.00000e+00 4.62260e+01 43.147  3.93434e+01 223.147 0.8635 
1 1 1 -13 29  12 o 18 7.04254e+00 1.67207e+00 1.67838e+02 111.773 -4.41893e+00 1.10629e+01  0.00000e+00 0.00000e+00 8.57206e+01 111.773 8.21177e+01 291.773 0.9571 
1 1 1 -13 29  13 o 16 7.31137e+00 1.75097e+00 1.22564e+02 167.749 -8.71235e+00 1.89182e+00  0.00000e+00 0.00000e+00 1.36233e+02 167.749 1.36695e+01 167.749 0.9421 
1 1 1 -13 29  14 o 7  6.72076e+00 1.80133e+00 1.63758e+02 11.121  1.10444e+01  2.17105e+00  0.00000e+00 0.00000e+00 7.69296e+01 11.121  8.68284e+01 191.121 0.9545 
1 1 1 -13 29  15 o 1  4.71654e+00 1.46608e+00 8.03763e+01 22.010  4.91479e+00  1.98674e+00  0.00000e+00 0.00000e+00 7.86553e+01 22.010  1.72103e+00 202.010 0.8999 
1 1 1 -13 29  16 o 7  7.53196e+00 1.75123e+00 1.29301e+02 246.125 -4.65886e+00 -1.05259e+01 0.00000e+00 0.00000e+00 1.39953e+02 246.125 1.06527e+01 246.125 0.9555 
1 1 1 -13 30  1  o 16 1.28430e+01 1.22304e+00 1.97573e+02 156.031 -1.55244e+01 6.90175e+00  0.00000e+00 0.00000e+00 2.75863e+02 156.031 7.82898e+01 156.031 0.9701 
1 1 1 -13 30  2  o 10 1.16984e+01 1.10289e+00 2.26138e+02 287.001 5.36106e+00  -1.75341e+01 0.00000e+00 0.00000e+00 2.05829e+02 287.001 2.03090e+01 107.001 0.9723 
1 1 1 -13 30  3  o 10 8.73732e+00 1.23134e+00 1.32076e+02 196.815 -7.86346e+00 -2.37641e+00 0.00000e+00 0.00000e+00 1.78616e+02 196.815 4.65398e+01 196.815 0.9370 
1 1 1 -13 30  4  o 5  7.48770e+00 1.21192e+00 7.37502e+01 131.194 -2.66698e+00 3.04715e+00  0.00000e+00 0.00000e+00 1.71979e+02 131.194 9.82287e+01 131.194 0.8654 
1 1 1 -13 30  5  o 2  1.46475e+01 1.11801e+00 1.72896e+02 32.162  1.70878e+01  1.07448e+01  0.00000e+00 0.00000e+00 3.68197e+02 32.162  1.95301e+02 32.162  0.9749 
1 1 1 -13 30  6  o 4  9.97370e+00 1.27039e+00 1.37097e+02 130.971 -7.12987e+00 8.21031e+00  0.00000e+00 0.00000e+00 2.22695e+02 130.971 8.55979e+01 130.971 0.9528 
1 1 1 -13 30  7  o 14 2.26157e+01 1.02018e+00 4.07892e+02 306.080 5.13541e+01  -7.04746e+01 0.00000e+00 0.00000e+00 4.42615e+02 306.080 3.47228e+01 306.080 0.9942 
1 1 1 -13 30  8  o 9  7.66764e+00 1.50572e+00 1.87018e+02 159.811 -1.17874e+01 4.33441e+00  0.00000e+00 0.00000e+00 9.09362e+01 159.811 9.60816e+01 339.811 0.9593 
1 1 1 -13 30  9  o 5  4.80023e+00 1.38451e+00 6.57956e+01 20.268  2.81317e+00  1.03882e+00  0.00000e+00 0.00000e+00 8.09572e+01 20.268  1.51616e+01 20.268  0.8099 
1 1 1 -13 30  10 o 18 4.19190e+00 1.31547e+00 1.77820e+02 75.372  2.02916e+00  7.77440e+00  0.00000e+00 0.00000e+00 2.99496e+01 255.372 2.07769e+02 255.372 0.9355 
1 1 1 -13 30  11 o 6  1.27419e+01 1.41355e+00 2.26753e+02 232.002 -1.93666e+01 -2.47902e+01 0.00000e+00 0.00000e+00 2.45446e+02 232.002 1.86921e+01 232.002 0.9840 
1 1 1 -13 30  12 o 15 6.62075e+00 1.62160e+00 5.62471e+01 246.402 -1.54790e+00 -3.54331e+00 0.00000e+00 0.00000e+00 1.57483e+02 246.402 1.01236e+02 246.402 0.8582 
1 1 1 -13 30  13 o 18 5.80885e+00 1.64823e+00 8.69843e+01 137.540 -3.93236e+00 3.59829e+00  0.00000e+00 0.00000e+00 1.09531e+02 137.540 2.25470e+01 137.540 0.9005 
1 1 1 -13 30  14 o 18 1.17513e+01 1.61975e+00 2.13887e+02 353.932 2.88898e+01  -3.07123e+00 0.00000e+00 0.00000e+00 2.19333e+02 353.932 5.44552e+00 353.932 0.9826 
1 1 1 -13 30  15 o 4  3.72742e+00 1.26458e+00 6.84271e+01 203.925 -3.80529e+00 -1.68823e+00 0.00000e+00 0.00000e+00 5.29953e+01 203.925 1.54317e+01 23.925  0.8695 
1 1 1 -13 30  16 o 16 4.61178e+00 1.47200e+00 3.33915e+01 262.242 -3.11176e-01 -2.28407e+00 0.00000e+00 0.00000e+00 9.46266e+01 262.242 6.12351e+01 262.242 0.7420 
1 1 1 -13 31  1  o 5  9.22904e+00 1.63439e+00 2.03306e+02 264.682 -1.01121e+00 -1.08635e+01 0.00000e+00 0.00000e+00 1.30883e+02 264.682 7.24222e+01 84.682  0.9530 
1 1 1 -13 31  2  o 15 7.95730e+00 1.30178e+00 1.36912e+02 10.782  7.45345e+00  1.41934e+00  0.00000e+00 0.00000e+00 1.44567e+02 10.782  7.65490e+00 10.782  0.9316 
1 1 1 -13 31  3  o 2  7.23675e+00 1.42133e+00 1.43901e+02 222.271 -4.90737e+00 -4.46083e+00 0.00000e+00 0.00000e+00 1.09066e+02 222.271 3.48343e+01 42.271  0.9212 
1 1 1 -13 31  4  o 7  1.00476e+01 1.19490e+00 2.01112e+02 294.824 6.32529e+00  -1.36738e+01 0.00000e+00 0.00000e+00 1.67014e+02 294.824 3.40987e+01 114.824 0.9662 
1 1 1 -13 31  5  o 3  4.43228e+00 1.25937e+00 1.64128e+02 191.861 -5.39737e+00 -1.13354e+00 0.00000e+00 0.00000e+00 1.22989e+01 11.861  1.76426e+02 11.861  0.9041 
1 1 1 -13 31  6  o 16 6.20111e+00 1.33761e+00 1.66852e+02 17.893  7.63296e+00  2.46429e+00  0.00000e+00 0.00000e+00 5.27363e+01 17.893  1.14115e+02 197.893 0.9354 
1 1 1 -13 31  7  o 1  8.10043e+00 1.24826e+00 1.52811e+02 195.893 -1.02856e+01 -2.92865e+00 0.00000e+00 0.00000e+00 1.38862e+02 195.893 1.39495e+01 15.893  0.9520 
1 1 1 -13 31  8  o 12 1.06218e+01 1.30641e+00 2.03733e+02 95.641  -2.05129e+00 2.07669e+01  0.00000e+00 0.00000e+00 1.87866e+02 95.641  1.58666e+01 275.641 0.9757 
1 1 1 -13 31  9  o 7  5.00087e+00 1.40556e+00 1.24561e+02 326.552 5.12737e+00  -3.38708e+00 0.00000e+00 0.00000e+00 4.80677e+01 326.552 7.64934e+01 146.552 0.9146 
1 1 1 -13 31  10 o 16 1.45619e+01 1.23419e+00 2.63491e+02 289.566 1.44459e+01  -4.06444e+01 0.00000e+00 0.00000e+00 2.79136e+02 289.566 1.56452e+01 289.566 0.9883 
1 1 1 -13 31  11 o 3  4.23042e+00 1.29563e+00 9.49786e+01 118.798 -2.32744e+00 4.23402e+00  0.00000e+00 0.00000e+00 4.67033e+01 118.798 4.82752e+01 298.798 0.8893 
1 1 1 -13 31  12 o 7  7.77788e+00 1.74326e+00 1.36072e+02 23.075  9.47935e+00  4.03832e+00  0.00000e+00 0.00000e+00 1.41897e+02 23.075  5.82567e+00 23.075  0.9502 
1 1 1 -13 31  13 o 2  3.72018e+00 1.24186e+00 5.94162e+01 3.976   3.02848e+00  2.10507e-01  0.00000e+00 0.00000e+00 5.41418e+01 3.976   5.27442e+00 183.976 0.8126 
1 1 1 -13 31  14 f 0  9.92482e+00 1.56524e+00 1.84072e+02 252.746 -6.59742e+00 -2.12420e+01 0.00000e+00 0.00000e+00 1.79780e+02 252.746 4.29229e+00 72.746  0.9773 
1 1 1 -13 31  15 o 17 3.66840e+00 1.20842e+00 5.30854e+01 24.707  3.01667e+00  1.38797e+00  0.00000e+00 0.00000e+00 6.11342e+01 24.707  8.04881e+00 24.707  0.8312 
1 1 1 -13 31  16 o 1  3.60780e+00 1.18787e+00 6.23250e+01 187.120 -4.33252e+00 -5.41194e-01 0.00000e+00 0.00000e+00 5.59296e+01 187.120 6.39537e+00 7.120   0.8763 
1 1 1 -13 32  1  o 10 3.01983e+01 1.25191e+00 5.96420e+02 121.862 -6.73020e+01 1.08284e+02  0.00000e+00 0.00000e+00 5.46389e+02 121.862 5.00311e+01 301.862 0.9961 
1 1 1 -13 32  2  o 14 1.13316e+01 1.25788e+00 2.37766e+02 125.566 -1.05560e+01 1.47629e+01  0.00000e+00 0.00000e+00 1.80462e+02 125.566 5.73043e+01 305.566 0.9720 
1 1 1 -13 32  3  o 15 2.11554e+01 9.13394e-01 3.75157e+02 246.321 -2.56850e+01 -5.85706e+01 0.00000e+00 0.00000e+00 4.21255e+02 246.321 4.60975e+01 246.321 0.9922 
1 1 1 -13 32  4  o 11 5.43909e+00 1.27132e+00 1.54633e+02 343.450 6.10569e+00  -1.81435e+00 0.00000e+00 0.00000e+00 3.46308e+01 343.450 1.20002e+02 163.450 0.9177 
1 1 1 -13 32  5  o 14 9.06973e+00 1.18165e+00 1.09295e+02 37.589  6.11256e+00  4.70548e+00  0.00000e+00 0.00000e+00 2.11201e+02 37.589  1.01907e+02 37.589  0.9327 
1 1 1 -13 32  6  o 11 4.97466e+00 1.22384e+00 1.16481e+02 229.006 -3.34959e+00 -3.85409e+00 0.00000e+00 0.00000e+00 5.22014e+01 229.006 6.42793e+01 49.006  0.8958 
1 1 1 -13 32  7  o 2  1.45553e+01 1.34595e+00 2.68648e+02 212.955 -2.84048e+01 -1.84146e+01 0.00000e+00 0.00000e+00 2.73612e+02 212.955 4.96386e+00 212.955 0.9851 
1 1 1 -13 32  8  o 13 5.48851e+00 1.30406e+00 1.01892e+02 228.208 -3.72106e+00 -4.16297e+00 0.00000e+00 0.00000e+00 8.58450e+01 228.208 1.60466e+01 48.208  0.9054 
1 1 1 -13 32  9  o 16 4.58353e+00 1.28429e+00 9.68669e+01 180.375 -4.68323e+00 -3.06827e-02 0.00000e+00 0.00000e+00 5.63118e+01 180.375 4.05550e+01 0.375   0.8855 
1 1 1 -13 32  10 o 3  5.55260e+00 1.26398e+00 9.65918e+01 300.780 2.99718e+00  -5.03186e+00 0.00000e+00 0.00000e+00 9.39162e+01 300.780 2.67561e+00 120.780 0.9101 
1 1 1 -13 32  11 o 6  1.26678e+01 1.09318e+00 3.00909e+02 58.511  2.68544e+01  4.38405e+01  0.00000e+00 0.00000e+00 1.71448e+02 58.511  1.29460e+02 238.510 0.9902 
1 1 1 -13 32  12 o 3  3.94875e+00 1.22294e+00 7.14655e+01 219.788 -2.93972e+00 -2.44822e+00 0.00000e+00 0.00000e+00 5.57297e+01 219.788 1.57359e+01 39.788  0.8565 
1 1 1 -13 32  13 o 14 5.05312e+00 1.30254e+00 1.15168e+02 39.021  6.22042e+00  5.04094e+00  0.00000e+00 0.00000e+00 6.23520e+01 39.021  5.28161e+01 219.021 0.9353 
1 1 1 -13 32  14 o 1  4.63418e+00 1.34131e+00 4.18970e+01 162.769 -2.64921e+00 8.21635e-01  0.00000e+00 0.00000e+00 9.57350e+01 162.769 5.38380e+01 162.769 0.7918 
1 1 1 -13 32  15 o 10 5.22390e+00 1.50300e+00 7.94645e+01 139.983 -4.49258e+00 3.77199e+00  0.00000e+00 0.00000e+00 9.86453e+01 139.983 1.91808e+01 139.983 0.9102 
1 1 1 -13 32  16 o 12 3.90705e+00 1.24943e+00 3.46008e+01 225.970 -1.88294e+00 -1.94780e+00 0.00000e+00 0.00000e+00 8.02539e+01 225.970 4.56531e+01 225.970 0.7860 
1 1 1 -13 33  1  o 2  9.90515e+00 1.30188e+00 1.99003e+02 136.387 -9.47040e+00 9.02267e+00  0.00000e+00 0.00000e+00 1.62605e+02 136.387 3.63974e+01 316.387 0.9610 
1 1 1 -13 33  2  o 1  8.90565e+00 1.36158e+00 1.70005e+02 302.387 5.26677e+00  -8.30336e+00 0.00000e+00 0.00000e+00 1.50424e+02 302.387 1.95810e+01 122.387 0.9477 
1 1 1 -13 33  3  o 15 1.58210e+01 9.26973e-01 2.71769e+02 81.944  4.89353e+00  3.45737e+01  0.00000e+00 0.00000e+00 3.19826e+02 81.944  4.80575e+01 81.944  0.9856 
1 1 1 -13 33  4  o 14 1.71696e+01 9.00202e-01 2.95914e+02 293.296 1.71806e+01  -3.99000e+01 0.00000e+00 0.00000e+00 3.47488e+02 293.296 5.15735e+01 293.296 0.9884 
1 1 1 -13 33  5  o 18 2.03305e+01 9.64784e-01 3.66210e+02 105.371 -1.73256e+01 6.30237e+01  0.00000e+00 0.00000e+00 3.98036e+02 105.371 3.18256e+01 105.371 0.9923 
1 1 1 -13 33  6  o 11 1.05298e+01 1.07464e+00 1.28389e+02 278.799 1.90308e+00  -1.22942e+01 0.00000e+00 0.00000e+00 2.53787e+02 278.799 1.25398e+02 278.799 0.9589 
1 1 1 -13 33  7  o 12 9.91633e+00 1.22335e+00 2.45340e+02 84.249  2.11053e+00  2.09565e+01  0.00000e+00 0.00000e+00 1.20630e+02 84.249  1.24711e+02 264.249 0.9760 
1 1 1 -13 33  8  o 17 5.40672e+00 1.29883e+00 1.19257e+02 289.909 2.19377e+00  -6.05728e+00 0.00000e+00 0.00000e+00 6.83952e+01 289.909 5.08617e+01 109.909 0.9187 
1 1 1 -13 33  9  o 7  1.11321e+01 1.15899e+00 2.02688e+02 122.893 -1.41858e+01 2.19334e+01  0.00000e+00 0.00000e+00 2.09293e+02 122.893 6.60491e+00 122.893 0.9807 
1 1 1 -13 33  10 o 15 4.99939e+00 1.30691e+00 1.02640e+02 36.204  4.87703e+00  3.56999e+00  0.00000e+00 0.00000e+00 6.94309e+01 36.204  3.32086e+01 216.204 0.9130 
1 1 1 -13 33  11 o 19 9.09955e+00 1.37501e+00 1.59225e+02 37.224  1.25679e+01  9.54793e+00  0.00000e+00 0.00000e+00 1.72358e+02 37.224  1.31331e+01 37.224  0.9678 
1 1 1 -13 33  12 o 3  7.40839e+00 1.39957e+00 1.23990e+02 233.421 -6.37588e+00 -8.59157e+00 0.00000e+00 0.00000e+00 1.41255e+02 233.421 1.72657e+01 233.421 0.9521 
1 1 1 -13 33  13 o 7  9.80095e+00 1.42698e+00 1.84524e+02 104.888 -5.52428e+00 2.07795e+01  0.00000e+00 0.00000e+00 1.74915e+02 104.888 9.60831e+00 284.888 0.9765 
1 1 1 -13 33  14 o 15 8.78647e+00 1.51287e+00 1.61597e+02 293.213 7.29481e+00  -1.70092e+01 0.00000e+00 0.00000e+00 1.58929e+02 293.213 2.66771e+00 113.213 0.9726 
1 1 1 -13 33  15 o 17 5.14352e+00 1.44422e+00 7.30578e+01 137.725 -4.11441e+00 3.74052e+00  0.00000e+00 0.00000e+00 1.01278e+02 137.725 2.82197e+01 137.725 0.9049 
1 1 1 -13 33  16 o 6  5.68780e+00 1.52807e+00 1.07705e+02 174.353 -9.46488e+00 9.35807e-01  0.00000e+00 0.00000e+00 9.35009e+01 174.353 1.42045e+01 354.353 0.9459 
1 1 1 -13 34  1  o 18 1.22187e+01 1.56506e+00 2.29859e+02 157.007 -1.67197e+01 7.09460e+00  0.00000e+00 0.00000e+00 2.21317e+02 157.007 8.54158e+00 337.007 0.9721 
1 1 1 -13 34  2  o 4  1.75925e+01 1.29044e+00 3.64438e+02 84.081  4.72387e+00  4.55631e+01  0.00000e+00 0.00000e+00 2.96088e+02 84.081  6.83501e+01 264.081 0.9890 
1 1 1 -13 34  3  f 0  2.25676e+01 9.05013e-01 4.46771e+02 223.545 -5.95757e+01 -5.66253e+01 0.00000e+00 0.00000e+00 4.04150e+02 223.545 4.26203e+01 43.546  0.9939 
1 1 1 -13 34  4  o 7  2.13987e+01 8.72844e-01 4.53459e+02 293.928 3.38494e+01  -7.62841e+01 0.00000e+00 0.00000e+00 3.52867e+02 293.928 1.00591e+02 113.928 0.9940 
1 1 1 -13 34  5  o 3  1.17244e+01 1.03002e+00 1.88385e+02 148.314 -1.63214e+01 1.00746e+01  0.00000e+00 0.00000e+00 2.43982e+02 148.314 5.55972e+01 148.314 0.9736 
1 1 1 -13 34  6  o 3  6.76331e+00 1.24983e+00 1.60051e+02 116.483 -4.14039e+00 8.31059e+00  0.00000e+00 0.00000e+00 8.17098e+01 116.483 7.83408e+01 296.483 0.9445 
1 1 1 -13 34  7  o 12 1.13344e+01 1.05853e+00 1.79337e+02 278.025 2.81058e+00  -1.99357e+01 0.00000e+00 0.00000e+00 2.38447e+02 278.025 5.91104e+01 278.025 0.9748 
1 1 1 -13 34  8  o 7  1.14774e+01 1.08240e+00 2.32357e+02 82.026  3.89534e+00  2.78083e+01  0.00000e+00 0.00000e+00 1.93401e+02 82.026  3.89557e+01 262.026 0.9820 
1 1 1 -13 34  9  o 6  1.18466e+01 1.11509e+00 2.13630e+02 145.685 -2.47120e+01 1.68666e+01  0.00000e+00 0.00000e+00 2.25863e+02 145.685 1.22330e+01 145.685 0.9831 
1 1 1 -13 34  10 o 18 1.35505e+01 1.04651e+00 2.86691e+02 298.267 2.45457e+01  -4.56490e+01 0.00000e+00 0.00000e+00 2.19117e+02 298.267 6.75744e+01 118.267 0.9903 
1 1 1 -13 34  11 o 15 3.82492e+00 1.21025e+00 9.08035e+01 6.279   4.52752e+00  4.98183e-01  0.00000e+00 0.00000e+00 3.61974e+01 6.279   5.46061e+01 186.279 0.8819 
1 1 1 -13 34  12 o 2  8.71382e+00 1.39137e+00 2.73439e+02 101.337 -5.81703e+00 2.90143e+01  0.00000e+00 0.00000e+00 4.86410e+01 101.337 2.24798e+02 281.337 0.9830 
1 1 1 -13 34  13 o 15 5.93063e+00 1.28959e+00 1.62070e+02 243.529 -5.80514e+00 -1.16580e+01 0.00000e+00 0.00000e+00 5.19226e+01 243.529 1.10147e+02 63.529  0.9608 
1 1 1 -13 34  14 o 15 4.83564e+00 1.32825e+00 9.99345e+01 324.822 5.69146e+00  -4.01162e+00 0.00000e+00 0.00000e+00 6.78410e+01 324.822 3.20935e+01 144.822 0.9251 
1 1 1 -13 34  15 f 0  3.97854e+00 1.28461e+00 1.07101e+02 90.329  -4.19816e-02 7.30674e+00  0.00000e+00 0.00000e+00 3.12922e+01 90.329  7.58085e+01 270.329 0.9288 
1 1 1 -13 35  1  o 10 1.77040e+01 1.32626e+00 2.98990e+02 38.501  2.95674e+01  2.35195e+01  0.00000e+00 0.00000e+00 3.64487e+02 38.501  6.54972e+01 38.501  0.9867 
1 1 1 -13 35  2  o 17 1.02976e+01 1.31153e+00 2.03333e+02 52.192  9.19613e+00  1.18521e+01  0.00000e+00 0.00000e+00 1.74292e+02 52.192  2.90411e+01 232.192 0.9661 
1 1 1 -13 35  3  o 15 1.42884e+01 9.47741e-01 2.22979e+02 297.081 1.22337e+01  -2.39263e+01 0.00000e+00 0.00000e+00 3.08846e+02 297.081 8.58666e+01 297.081 0.9812 
1 1 1 -13 35  4  o 15 1.17269e+01 9.70698e-01 1.75733e+02 13.970  1.66965e+01  4.15349e+00  0.00000e+00 0.00000e+00 2.55661e+02 13.970  7.99279e+01 13.970  0.9705 
1 1 1 -13 35  5  o 16 6.99920e+00 1.19781e+00 1.84100e+02 252.716 -3.13409e+00 -1.00721e+01 0.00000e+00 0.00000e+00 6.80978e+01 252.716 1.16002e+02 72.716  0.9513 
1 1 1 -13 35  6  o 17 2.16532e+01 9.23513e-01 2.78767e+02 26.713  5.44885e+01  2.74199e+01  0.00000e+00 0.00000e+00 5.33898e+02 26.713  2.55132e+02 26.713  0.9918 
1 1 1 -13 35  7  o 14 4.34588e+00 1.22769e+00 1.62410e+02 153.304 -5.81394e+00 2.92361e+00  0.00000e+00 0.00000e+00 1.13155e+01 333.304 1.73726e+02 333.304 0.9196 
1 1 1 -13 35  8  f 0  6.38703e+00 1.41719e+00 5.59819e+01 249.173 -1.14611e+00 -3.01295e+00 0.00000e+00 0.00000e+00 1.43101e+02 249.173 8.71192e+01 249.173 0.8252 
1 1 1 -13 35  9  o 1  6.56062e+00 1.29382e+00 1.12962e+02 36.202  6.19510e+00  4.53445e+00  0.00000e+00 0.00000e+00 1.17842e+02 36.202  4.88006e+00 36.202  0.9324 
1 1 1 -13 35  10 o 16 5.89004e+00 1.37923e+00 7.09214e+01 103.735 -1.10490e+00 4.52064e+00  0.00000e+00 0.00000e+00 1.25471e+02 103.735 5.45492e+01 103.735 0.8847 
1 1 1 -13 35  11 o 19 5.30660e+00 1.40435e+00 7.09380e+01 41.665  3.09920e+00  2.75785e+00  0.00000e+00 0.00000e+00 1.02662e+02 41.665  3.17245e+01 41.665  0.8690 
1 1 1 -13 35  12 o 15 5.27123e+00 1.39827e+00 4.38991e+01 243.550 -1.31523e+00 -2.64369e+00 0.00000e+00 0.00000e+00 1.15932e+02 243.550 7.20328e+01 243.550 0.8064 
1 1 1 -13 35  13 o 16 3.97428e+00 1.21033e+00 8.10382e+01 321.422 3.58733e+00  -2.86144e+00 0.00000e+00 0.00000e+00 5.07216e+01 321.422 3.03166e+01 141.422 0.8829 
1 1 1 -13 35  14 o 8  3.81156e+00 1.21669e+00 5.17197e+01 71.222  9.84061e-01  2.89423e+00  0.00000e+00 0.00000e+00 6.46447e+01 71.222  1.29250e+01 71.222  0.8141 
1 1 1 -13 35  15 o 1  6.09676e+00 1.42731e+00 1.52476e+02 4.715   1.44778e+01  1.19419e+00  0.00000e+00 0.00000e+00 6.78286e+01 4.715   8.46475e+01 184.715 0.9649 
1 1 1 -13 36  1  o 4  1.82421e+01 9.75637e-01 3.45419e+02 118.527 -2.40560e+01 4.42566e+01  0.00000e+00 0.00000e+00 3.40478e+02 118.527 4.94165e+00 298.527 0.9900 
1 1 1 -13 36  2  o 7  1.24537e+01 1.10435e+00 1.60382e+02 326.567 1.33918e+01  -8.84133e+00 0.00000e+00 0.00000e+00 2.97329e+02 326.567 1.36947e+02 326.567 0.9683 
1 1 1 -13 36  3  o 9  1.92886e+01 8.75859e-01 3.07099e+02 168.582 -4.99521e+01 1.00886e+01  0.00000e+00 0.00000e+00 4.17293e+02 168.582 1.10194e+02 168.582 0.9901 
1 1 1 -13 36  4  o 14 1.51688e+01 9.40673e-01 2.69560e+02 206.866 -3.23024e+01 -1.63642e+01 0.00000e+00 0.00000e+00 2.97367e+02 206.866 2.78070e+01 206.866 0.9861 
1 1 1 -13 36  5  o 1  1.12455e+01 1.00096e+00 1.64723e+02 28.714  1.56211e+01  8.55728e+00  0.00000e+00 0.00000e+00 2.49026e+02 28.714  8.43028e+01 28.714  0.9715 
1 1 1 -13 36  6  o 14 4.40234e+00 1.23016e+00 5.47874e+01 157.128 -1.93555e+00 8.16503e-01  0.00000e+00 0.00000e+00 6.40903e+01 157.128 9.30282e+00 157.128 0.7136 
1 1 1 -13 36  7  o 18 1.33320e+01 1.16621e+00 2.29473e+02 280.048 5.25679e+00  -2.96674e+01 0.00000e+00 0.00000e+00 2.66095e+02 280.048 3.66220e+01 280.048 0.9833 
1 1 1 -13 36  8  o 7  8.31700e+00 1.26638e+00 7.41296e+01 87.208  3.12634e-01  6.41094e+00  0.00000e+00 0.00000e+00 2.14348e+02 87.208  1.40219e+02 87.208  0.9184 
1 1 1 -13 36  9  o 13 4.83578e+00 1.38190e+00 1.25555e+02 158.049 -5.72153e+00 2.30601e+00  0.00000e+00 0.00000e+00 4.13613e+01 158.049 8.41940e+01 338.048 0.9149 
1 1 1 -13 36  10 o 5  5.83942e+00 1.33930e+00 9.32715e+01 218.042 -4.88397e+00 -3.82157e+00 0.00000e+00 0.00000e+00 1.08170e+02 218.042 1.48981e+01 218.042 0.9154 
1 1 1 -13 36  11 o 14 6.84790e+00 1.43850e+00 1.37479e+02 183.783 -1.08731e+01 -7.18906e-01 0.00000e+00 0.00000e+00 1.08161e+02 183.783 2.93184e+01 3.783   0.9529 
1 1 1 -13 36  12 o 13 1.15200e+01 1.19336e+00 1.91915e+02 357.248 3.07601e+01  -1.47850e+00 0.00000e+00 0.00000e+00 2.34096e+02 357.248 4.21810e+01 357.248 0.9836 
1 1 1 -13 36  13 o 12 8.34152e+00 1.48099e+00 1.28160e+02 117.573 -5.97353e+00 1.14395e+01  0.00000e+00 0.00000e+00 1.72651e+02 117.573 4.44915e+01 117.573 0.9604 
1 1 1 -13 36  14 o 11 4.94423e+00 1.40930e+00 1.22968e+02 279.500 1.42631e+00  -8.52366e+00 0.00000e+00 0.00000e+00 5.13429e+01 279.500 7.16254e+01 99.500  0.9402 
1 1 1 -13 36  15 o 8  4.55460e+00 1.39626e+00 1.11068e+02 327.154 6.83194e+00  -4.41069e+00 0.00000e+00 0.00000e+00 4.86158e+01 327.154 6.24518e+01 147.154 0.9363 
1 1 1 -13 37  1  o 8  1.65181e+01 1.01852e+00 3.50930e+02 33.420  3.99420e+01  2.63574e+01  0.00000e+00 0.00000e+00 2.69754e+02 33.420  8.11759e+01 213.420 0.9895 
1 1 1 -13 37  2  o 18 6.86184e+00 1.29947e+00 7.48767e+01 174.768 -3.83039e+00 3.50770e-01  0.00000e+00 0.00000e+00 1.48390e+02 174.768 7.35137e+01 174.768 0.8573 
1 1 1 -13 37  3  o 6  1.14816e+01 1.04326e+00 1.89483e+02 78.574  3.51984e+00  1.74164e+01  0.00000e+00 0.00000e+00 2.33529e+02 78.574  4.40454e+01 78.574  0.9714 
1 1 1 -13 37  4  o 18 1.40532e+01 9.43427e-01 3.39341e+02 243.605 -1.89558e+01 -3.81939e+01 0.00000e+00 0.00000e+00 1.86962e+02 243.605 1.52378e+02 63.605  0.9882 
1 1 1 -13 37  5  o 17 4.52944e+00 1.23061e+00 1.03823e+02 287.627 1.23392e+00  -3.88340e+00 0.00000e+00 0.00000e+00 4.47693e+01 287.627 5.90541e+01 107.627 0.8663 
1 1 1 -13 37  6  o 13 1.48422e+01 1.00895e+00 3.25134e+02 334.875 4.34956e+01  -2.03976e+01 0.00000e+00 0.00000e+00 2.30545e+02 334.875 9.45891e+01 154.875 0.9895 
1 1 1 -13 37  7  o 18 1.45285e+01 9.73551e-01 2.63897e+02 144.371 -3.48890e+01 2.50047e+01  0.00000e+00 0.00000e+00 2.78849e+02 144.371 1.49519e+01 144.371 0.9883 
1 1 1 -13 37  8  o 15 8.36790e+00 1.20668e+00 1.56461e+02 200.666 -1.26842e+01 -4.78447e+00 0.00000e+00 0.00000e+00 1.47648e+02 200.666 8.81325e+00 20.666  0.9624 
1 1 1 -13 37  9  o 17 5.65597e+00 1.33897e+00 9.40415e+01 134.785 -4.06175e+00 4.09234e+00  0.00000e+00 0.00000e+00 9.98124e+01 134.785 5.77093e+00 134.785 0.9086 
1 1 1 -13 37  10 o 18 4.13382e+00 1.24662e+00 9.08117e+01 104.775 -1.14193e+00 4.32975e+00  0.00000e+00 0.00000e+00 4.62157e+01 104.775 4.45960e+01 284.775 0.8797 
1 1 1 -13 37  11 o 13 5.92291e+00 1.44659e+00 1.90862e+02 299.717 6.44617e+00  -1.12936e+01 0.00000e+00 0.00000e+00 2.33141e+01 299.717 1.67548e+02 119.717 0.9607 
1 1 1 -13 37  12 o 18 7.13670e+00 1.68510e+00 1.25891e+02 161.553 -8.65337e+00 2.88654e+00  0.00000e+00 0.00000e+00 1.27229e+02 161.553 1.33873e+00 161.553 0.9435 
1 1 1 -13 37  13 o 13 3.61441e+00 1.18783e+00 7.04066e+01 192.174 -3.69505e+00 -7.97150e-01 0.00000e+00 0.00000e+00 4.55469e+01 192.174 2.48596e+01 12.174  0.8545 
1 1 1 -13 37  14 f 0  4.25982e+00 1.29558e+00 2.94826e+01 24.536  1.75646e+00  8.01800e-01  0.00000e+00 0.00000e+00 8.00932e+01 24.536  5.06106e+01 24.536  0.6861 
1 1 1 -13 37  15 o 3  3.89882e+00 1.25185e+00 5.06588e+01 264.427 -3.26195e-01 -3.34289e+00 0.00000e+00 0.00000e+00 7.09905e+01 264.427 2.03317e+01 264.427 0.8334 
1 1 1 -13 38  1  o 16 4.50290e+00 1.30061e+00 8.22648e+01 323.175 2.21743e+00  -1.66036e+00 0.00000e+00 0.00000e+00 5.30558e+01 323.175 2.92090e+01 143.175 0.7914 
1 1 1 -13 38  2  o 11 2.08070e+01 9.25766e-01 3.18246e+02 120.999 -2.89201e+01 4.81323e+01  0.00000e+00 0.00000e+00 4.64266e+02 120.999 1.46020e+02 120.999 0.9911 
1 1 1 -13 38  3  o 8  1.61330e+01 8.41715e-01 3.71378e+02 153.029 -4.87778e+01 2.48223e+01  0.00000e+00 0.00000e+00 2.34799e+02 153.029 1.36580e+02 333.029 0.9908 
1 1 1 -13 38  4  o 16 1.39967e+01 9.20110e-01 1.86593e+02 358.374 2.35307e+01  -6.68036e-01 0.00000e+00 0.00000e+00 3.32405e+02 358.374 1.45812e+02 358.374 0.9785 
1 1 1 -13 38  5  o 19 7.79795e+00 1.15255e+00 1.40391e+02 273.089 5.26120e-01  -9.74988e+00 0.00000e+00 0.00000e+00 1.39313e+02 273.089 1.07765e+00 93.089  0.9473 
1 1 1 -13 38  6  o 8  7.70189e+00 1.19403e+00 1.93545e+02 114.493 -5.41442e+00 1.18848e+01  0.00000e+00 0.00000e+00 8.64382e+01 114.493 1.07107e+02 294.493 0.9609 
1 1 1 -13 38  7  o 2  8.91976e+00 1.22127e+00 1.37478e+02 166.245 -1.23824e+01 3.03108e+00  0.00000e+00 0.00000e+00 1.86150e+02 166.245 4.86727e+01 166.245 0.9599 
1 1 1 -13 38  8  o 19 5.69817e+00 1.30561e+00 1.54153e+02 350.228 8.99435e+00  -1.54906e+00 0.00000e+00 0.00000e+00 4.88518e+01 350.228 1.05301e+02 170.228 0.9435 
1 1 1 -13 38  9  o 19 6.24368e+00 1.27559e+00 7.46545e+01 121.795 -2.70444e+00 4.36265e+00  0.00000e+00 0.00000e+00 1.36451e+02 121.795 6.17967e+01 121.795 0.8964 
1 1 1 -13 38  10 o 2  1.22641e+01 1.09301e+00 1.58677e+02 168.538 -2.48543e+01 5.03949e+00  0.00000e+00 0.00000e+00 2.94208e+02 168.538 1.35531e+02 168.538 0.9801 
1 1 1 -13 38  11 o 6  3.22052e+00 1.05256e+00 4.46300e+01 267.096 -1.00728e-01 -1.98564e+00 0.00000e+00 0.00000e+00 3.97054e+01 267.096 4.92455e+00 87.096  0.6958 
1 1 1 -13 38  12 o 3  5.14391e+00 1.27975e+00 6.84300e+01 50.785  2.98040e+00  3.65241e+00  0.00000e+00 0.00000e+00 1.02936e+02 50.785  3.45060e+01 50.785  0.8863 
1 1 1 -13 38  13 o 9  4.59902e+00 1.35780e+00 1.00624e+02 11.214  6.08090e+00  1.20563e+00  0.00000e+00 0.00000e+00 5.74070e+01 11.214  4.32174e+01 191.214 0.9153 
1 1 1 -13 38  14 o 11 6.37886e+00 1.43141e+00 1.22913e+02 213.954 -9.02399e+00 -6.07616e+00 0.00000e+00 0.00000e+00 1.04954e+02 213.954 1.79583e+01 33.954  0.9529 
1 1 1 -13 38  15 o 13 4.71421e+00 1.40083e+00 1.24347e+02 55.240  5.30886e+00  7.64982e+00  0.00000e+00 0.00000e+00 4.23714e+01 55.240  8.19754e+01 235.240 0.9447 
1 1 1 -13 39  1  o 17 4.16906e+00 1.24012e+00 5.73455e+01 231.899 -1.12680e+00 -1.43700e+00 0.00000e+00 0.00000e+00 4.82390e+01 231.899 9.10643e+00 51.899  0.6670 
1 1 1 -13 39  2  o 16 1.87533e+01 9.41167e-01 2.92820e+02 60.177  2.30055e+01  4.01324e+01  0.00000e+00 0.00000e+00 4.11012e+02 60.177  1.18192e+02 60.177  0.9891 
1 1 1 -13 39  3  f 0  7.80205e+00 1.22419e+00 1.60698e+02 239.724 -5.12634e+00 -8.78103e+00 0.00000e+00 0.00000e+00 1.20192e+02 239.724 4.05065e+01 59.724  0.9495 
1 1 1 -13 39  4  o 15 7.55988e+00 1.15753e+00 1.06095e+02 82.297  9.74168e-01  7.20213e+00  0.00000e+00 0.00000e+00 1.59841e+02 82.297  5.37458e+01 82.297  0.9284 
1 1 1 -13 39  5  o 11 8.55523e+00 1.07130e+00 1.41522e+02 276.676 1.34671e+00  -1.15058e+01 0.00000e+00 0.00000e+00 1.68064e+02 276.676 2.65421e+01 276.676 0.9558 
1 1 1 -13 39  6  o 7  3.96556e+00 1.16573e+00 7.11042e+01 196.477 -2.56358e+00 -7.58248e-01 0.00000e+00 0.00000e+00 4.62914e+01 196.477 2.48128e+01 16.477  0.7826 
1 1 1 -13 39  7  o 5  5.13593e+00 1.22483e+00 8.46335e+01 242.089 -2.10715e+00 -3.97782e+00 0.00000e+00 0.00000e+00 8.62455e+01 242.089 1.61201e+00 242.089 0.8804 
1 1 1 -13 39  8  o 3  5.81756e+00 1.16977e+00 1.16246e+02 332.652 6.71120e+00  -3.47101e+00 0.00000e+00 0.00000e+00 8.82983e+01 332.652 2.79475e+01 152.652 0.9313 
1 1 1 -13 39  9  o 14 4.36423e+00 1.19198e+00 8.82464e+01 160.779 -4.12519e+00 1.43819e+00  0.00000e+00 0.00000e+00 5.59996e+01 160.779 3.22469e+01 340.779 0.8763 
1 1 1 -13 39  10 o 11 7.69160e+00 1.36079e+00 1.30093e+02 144.554 -9.14835e+00 6.51251e+00  0.00000e+00 0.00000e+00 1.46462e+02 144.554 1.63691e+01 144.554 0.9544 
1 1 1 -13 39  11 o 2  5.28963e+00 1.27907e+00 4.43470e+01 273.230 1.70746e-01  -3.02553e+00 0.00000e+00 0.00000e+00 1.17322e+02 273.230 7.29754e+01 273.230 0.8122 
1 1 1 -13 39  12 o 6  3.85121e+00 1.20782e+00 2.74664e+01 74.052  3.84160e-01  1.34437e+00  0.00000e+00 0.00000e+00 5.50288e+01 74.052  2.75624e+01 74.052  0.5699 
1 1 1 -13 39  13 o 13 5.51851e+00 1.38257e+00 7.69562e+01 116.118 -2.49009e+00 5.07890e+00  0.00000e+00 0.00000e+00 1.10852e+02 116.118 3.38961e+01 116.118 0.9067 
1 1 1 -13 39  14 o 18 3.99517e+00 1.24971e+00 3.08238e+01 164.012 -1.88860e+00 5.41116e-01  0.00000e+00 0.00000e+00 7.27910e+01 164.012 4.19672e+01 164.012 0.6919 
1 1 1 -13 39  15 f 0  4.36312e+00 1.31267e+00 5.32065e+01 330.177 3.41810e+00  -1.95939e+00 0.00000e+00 0.00000e+00 8.74414e+01 330.177 3.42350e+01 330.177 0.8612 
1 1 1 -13 40  1  o 19 1.81306e+01 8.63042e-01 3.14454e+02 117.155 -2.36270e+01 4.60614e+01  0.00000e+00 0.00000e+00 3.67155e+02 117.155 5.27008e+01 117.155 0.9903 
1 1 1 -13 40  2  o 7  7.91822e+00 1.19899e+00 1.20292e+02 68.655  2.80809e+00  7.18582e+00  0.00000e+00 0.00000e+00 1.59915e+02 68.655  3.96233e+01 68.655  0.9327 
1 1 1 -13 40  3  o 14 4.25131e+00 1.25638e+00 9.12525e+01 190.886 -3.05386e+00 -5.87333e-01 0.00000e+00 0.00000e+00 4.05611e+01 190.886 5.06914e+01 10.886  0.8178 
1 1 1 -13 40  4  o 9  6.80576e+00 1.12291e+00 1.38665e+02 343.342 8.17552e+00  -2.44621e+00 0.00000e+00 0.00000e+00 1.03562e+02 343.342 3.51024e+01 163.342 0.9394 
1 1 1 -13 40  5  o 5  1.12749e+01 9.25775e-01 2.74931e+02 176.056 -3.01996e+01 2.08201e+00  0.00000e+00 0.00000e+00 1.44775e+02 176.056 1.30157e+02 356.056 0.9833 
1 1 1 -13 40  6  o 15 9.71237e+00 1.09858e+00 1.05804e+02 243.383 -4.67480e+00 -9.32833e+00 0.00000e+00 0.00000e+00 2.43473e+02 243.383 1.37669e+02 243.383 0.9508 
1 1 1 -13 40  7  o 6  6.34588e+00 1.22933e+00 1.17115e+02 3.743   7.31212e+00  4.78409e-01  0.00000e+00 0.00000e+00 1.05663e+02 3.743   1.14518e+01 183.743 0.9290 
1 1 1 -13 40  8  o 2  1.00001e+01 1.00929e+00 1.47982e+02 207.407 -1.63649e+01 -8.48514e+00 0.00000e+00 0.00000e+00 2.19145e+02 207.407 7.11630e+01 207.407 0.9725 
1 1 1 -13 40  9  o 9  6.06310e+00 1.28127e+00 9.88905e+01 87.331  3.33973e-01  7.16335e+00  0.00000e+00 0.00000e+00 1.13158e+02 87.331  1.42678e+01 87.331  0.9274 
1 1 1 -13 40  10 o 18 3.23152e+00 1.05492e+00 5.49325e+01 86.470  1.50682e-01  2.44252e+00  0.00000e+00 0.00000e+00 3.74770e+01 86.470  1.74554e+01 266.470 0.7591 
1 1 1 -13 40  11 o 14 1.00375e+01 1.12055e+00 1.68866e+02 211.553 -2.04869e+01 -1.25806e+01 0.00000e+00 0.00000e+00 2.00866e+02 211.553 3.19997e+01 211.553 0.9790 
1 1 1 -13 40  12 o 3  5.35542e+00 1.33406e+00 9.15993e+01 16.971  6.14275e+00  1.87468e+00  0.00000e+00 0.00000e+00 9.32472e+01 16.971  1.64785e+00 16.971  0.9185 
1 1 1 -13 40  13 o 10 4.78868e+00 1.35327e+00 1.03131e+02 309.410 4.40290e+00  -5.35821e+00 0.00000e+00 0.00000e+00 6.30802e+01 309.410 4.00513e+01 129.410 0.9248 
1 1 1 -13 40  14 o 8  3.64448e+00 1.17770e+00 3.45835e+01 239.230 -1.06704e+00 -1.79213e+00 0.00000e+00 0.00000e+00 6.25879e+01 239.230 2.80043e+01 239.230 0.7114 
1 1 1 -13 40  15 o 10 7.78827e+00 1.49006e+00 1.83910e+02 6.195   2.12067e+01  2.30193e+00  0.00000e+00 0.00000e+00 1.00675e+02 6.195   8.32342e+01 186.195 0.9763 
1 1 1 -13 41  1  o 9  1.01330e+01 1.32369e+00 2.14914e+02 162.952 -1.62536e+01 4.98409e+00  0.00000e+00 0.00000e+00 1.58230e+02 162.952 5.66842e+01 342.952 0.9701 
1 1 1 -13 41  2  o 12 5.77581e+00 1.38586e+00 1.67265e+02 29.362  6.40678e+00  3.60445e+00  0.00000e+00 0.00000e+00 3.63415e+01 29.362  1.30923e+02 209.362 0.9293 
1 1 1 -13 41  3  o 17 5.46368e+00 1.25828e+00 1.08150e+02 18.818  4.86668e+00  1.65846e+00  0.00000e+00 0.00000e+00 7.75514e+01 18.818  3.05985e+01 198.818 0.8966 
1 1 1 -13 41  4  o 9  1.70419e+01 8.11466e-01 2.92487e+02 169.822 -5.16163e+01 9.26715e+00  0.00000e+00 0.00000e+00 3.46902e+02 169.822 5.44148e+01 169.822 0.9904 
1 1 1 -13 41  5  o 14 6.74996e+00 1.11355e+00 9.95048e+01 191.039 -6.29768e+00 -1.22856e+00 0.00000e+00 0.00000e+00 1.35136e+02 191.039 3.56317e+01 191.039 0.9184 
1 1 1 -13 41  6  o 7  1.19234e+01 9.77629e-01 1.39751e+02 311.859 1.24419e+01  -1.38866e+01 0.00000e+00 0.00000e+00 2.98913e+02 311.859 1.59162e+02 311.859 0.9728 
1 1 1 -13 41  7  o 11 7.44116e+00 1.13487e+00 1.01712e+02 106.013 -2.31961e+00 8.08236e+00  0.00000e+00 0.00000e+00 1.62155e+02 106.013 6.04422e+01 106.013 0.9385 
1 1 1 -13 41  8  o 6  1.79486e+01 8.46086e-01 2.86635e+02 241.892 -3.09227e+01 -5.78945e+01 0.00000e+00 0.00000e+00 3.85687e+02 241.892 9.90517e+01 241.892 0.9924 
1 1 1 -13 41  9  o 4  7.96356e+00 1.17710e+00 1.13371e+02 347.895 1.09810e+01  -2.35518e+00 0.00000e+00 0.00000e+00 1.73217e+02 347.895 5.98458e+01 347.895 0.9544 
1 1 1 -13 41  10 o 2  4.87812e+00 1.26453e+00 7.70522e+01 119.033 -2.11447e+00 3.80937e+00  0.00000e+00 0.00000e+00 8.38969e+01 119.033 6.84476e+00 119.033 0.8760 
1 1 1 -13 41  11 o 1  3.19313e+00 1.04898e+00 9.08393e+01 252.910 -1.28555e+00 -4.18142e+00 0.00000e+00 0.00000e+00 1.44595e+01 252.910 7.63798e+01 72.910  0.8765 
1 1 1 -13 41  12 o 10 4.97350e+00 1.36341e+00 8.16712e+01 109.544 -1.72579e+00 4.86169e+00  0.00000e+00 0.00000e+00 8.59525e+01 109.544 4.28133e+00 109.544 0.8969 
1 1 1 -13 41  13 o 9  4.95982e+00 1.38496e+00 1.00948e+02 102.753 -1.50876e+00 6.66605e+00  0.00000e+00 0.00000e+00 7.09682e+01 102.753 2.99800e+01 282.753 0.9236 
1 1 1 -13 41  14 o 18 4.43091e+00 1.29603e+00 6.22397e+01 115.322 -1.80233e+00 3.80905e+00  0.00000e+00 0.00000e+00 8.24409e+01 115.322 2.02012e+01 115.322 0.8713 
1 1 1 -13 41  15 o 5  4.18282e+00 1.29624e+00 4.78361e+01 231.202 -2.19477e+00 -2.72990e+00 0.00000e+00 0.00000e+00 8.38515e+01 231.202 3.60155e+01 231.202 0.8412 
1 1 1 -13 42  1  o 4  8.73024e+00 1.34274e+00 1.83098e+02 295.311 5.29685e+00  -1.11998e+01 0.00000e+00 0.00000e+00 1.34584e+02 295.311 4.85138e+01 115.311 0.9588 
1 1 1 -13 42  2  o 19 6.45501e+00 1.31364e+00 1.07326e+02 211.976 -4.60097e+00 -2.87235e+00 0.00000e+00 0.00000e+00 1.13614e+02 211.976 6.28797e+00 211.976 0.9024 
1 1 1 -13 42  3  o 14 5.50613e+00 1.20190e+00 1.19392e+02 190.555 -5.66737e+00 -1.05601e+00 0.00000e+00 0.00000e+00 7.02309e+01 190.555 4.91614e+01 10.555  0.9085 
1 1 1 -13 42  4  f 0  1.22234e+01 9.20439e-01 2.69998e+02 75.247  8.23988e+00  3.12897e+01  0.00000e+00 0.00000e+00 1.85779e+02 75.247  8.42183e+01 255.247 0.9844 
1 1 1 -13 42  5  o 11 8.19425e+00 1.11781e+00 1.01917e+02 259.874 -1.32420e+00 -7.41490e+00 0.00000e+00 0.00000e+00 1.86823e+02 259.874 8.49062e+01 259.874 0.9310 
1 1 1 -13 42  6  o 12 9.40628e+00 1.05172e+00 2.36277e+02 38.382  1.96144e+01  1.55364e+01  0.00000e+00 0.00000e+00 1.12235e+02 38.382  1.24043e+02 218.382 0.9798 
1 1 1 -13 42  7  o 10 7.90327e+00 1.10245e+00 1.21910e+02 319.089 7.91764e+00  -6.86103e+00 0.00000e+00 0.00000e+00 1.62044e+02 319.089 4.01343e+01 319.089 0.9510 
1 1 1 -13 42  8  o 16 6.95349e+00 1.16950e+00 1.02991e+02 265.464 -6.42468e-01 -8.09760e+00 0.00000e+00 0.00000e+00 1.42723e+02 265.464 3.97324e+01 265.464 0.9363 
1 1 1 -13 42  9  o 9  2.96371e+00 9.80049e-01 1.20076e+02 1.381   4.90842e+00  1.18373e-01  0.00000e+00 0.00000e+00 2.04869e+01 181.381 1.40563e+02 181.381 0.8912 
1 1 1 -13 42  10 o 4  5.00488e+00 1.27036e+00 6.65550e+01 278.794 6.44230e-01  -4.16417e+00 0.00000e+00 0.00000e+00 9.76712e+01 278.794 3.11163e+01 278.794 0.8713 
1 1 1 -13 42  11 o 6  6.90709e+00 1.28924e+00 1.40614e+02 84.703  1.11700e+00  1.20470e+01  0.00000e+00 0.00000e+00 1.08234e+02 84.703  3.23796e+01 264.703 0.9577 
1 1 1 -13 42  12 o 14 4.57960e+00 1.26377e+00 1.15411e+02 281.587 1.49905e+00  -7.31116e+00 0.00000e+00 0.00000e+00 4.46707e+01 281.587 7.07405e+01 101.587 0.9304 
1 1 1 -13 42  13 o 1  3.98112e+00 1.24965e+00 6.68218e+01 212.384 -3.43125e+00 -2.17616e+00 0.00000e+00 0.00000e+00 6.25313e+01 212.384 4.29048e+00 32.384  0.8659 
1 1 1 -13 42  14 o 1  6.02063e+00 1.50322e+00 1.48120e+02 269.410 -1.24594e-01 -1.21087e+01 0.00000e+00 0.00000e+00 6.79627e+01 269.410 8.01574e+01 89.410  0.9578 
1 1 1 -13 42  15 o 4  3.26467e+00 1.06478e+00 4.51669e+01 295.468 1.30893e+00  -2.74823e+00 0.00000e+00 0.00000e+00 5.41750e+01 295.468 9.00810e+00 295.468 0.8132 
1 1 1 -13 43  1  o 11 9.48182e+00 1.36296e+00 1.54456e+02 30.575  1.04933e+01  6.19945e+00  0.00000e+00 0.00000e+00 1.90284e+02 30.575  3.58282e+01 30.575  0.9581 
1 1 1 -13 43  2  o 17 5.84890e+00 1.28927e+00 1.59008e+02 262.933 -9.81278e-01 -7.91518e+00 0.00000e+00 0.00000e+00 4.84078e+01 262.933 1.10600e+02 82.933  0.9350 
1 1 1 -13 43  3  o 8  4.38523e+00 1.20572e+00 5.75453e+01 19.471  2.16108e+00  7.64059e-01  0.00000e+00 0.00000e+00 6.55069e+01 19.471  7.96158e+00 19.471  0.7404 
1 1 1 -13 43  4  o 19 3.45098e+00 1.06671e+00 7.79397e+01 315.633 1.87492e+00  -1.83393e+00 0.00000e+00 0.00000e+00 2.37059e+01 315.633 5.42338e+01 135.633 0.7777 
1 1 1 -13 43  5  o 14 3.42546e+00 1.01466e+00 1.00637e+02 299.500 1.70929e+00  -3.02111e+00 0.00000e+00 0.00000e+00 8.19695e+00 299.500 9.24398e+01 119.500 0.8396 
1 1 1 -13 43  6  o 1  7.31419e+00 1.19563e+00 1.28710e+02 200.098 -9.28969e+00 -3.39916e+00 0.00000e+00 0.00000e+00 1.33465e+02 200.098 4.75512e+00 200.098 0.9480 
1 1 1 -13 43  7  o 10 7.13396e+00 1.23936e+00 1.38720e+02 57.797  5.66975e+00  9.00232e+00  0.00000e+00 0.00000e+00 1.17772e+02 57.797  2.09476e+01 237.797 0.9518 
1 1 1 -13 43  8  o 11 5.27919e+00 1.21634e+00 1.04838e+02 203.645 -5.87312e+00 -2.57145e+00 0.00000e+00 0.00000e+00 7.81145e+01 203.645 2.67234e+01 23.645  0.9183 
1 1 1 -13 43  9  o 6  1.04656e+01 1.07110e+00 1.37551e+02 269.169 -2.74450e-01 -1.89221e+01 0.00000e+00 0.00000e+00 2.46419e+02 269.169 1.08868e+02 269.169 0.9732 
1 1 1 -13 43  10 f 0  1.08748e+01 1.00079e+00 1.78249e+02 303.880 1.49078e+01  -2.22019e+01 0.00000e+00 0.00000e+00 2.23536e+02 303.880 4.52868e+01 303.880 0.9811 
1 1 1 -13 43  11 o 7  1.05319e+01 1.11069e+00 1.67076e+02 203.543 -2.39557e+01 -1.04378e+01 0.00000e+00 0.00000e+00 2.21409e+02 203.543 5.43335e+01 203.543 0.9807 
1 1 1 -13 43  12 o 4  1.01575e+01 1.57161e+00 7.02595e+01 182.033 -7.72750e+00 -2.74299e-01 0.00000e+00 0.00000e+00 2.85723e+02 182.033 2.15463e+02 182.033 0.9329 
1 1 1 -13 43  13 o 19 4.17002e+00 1.27110e+00 6.24111e+01 354.353 4.04374e+00  -3.99855e-01 0.00000e+00 0.00000e+00 7.30657e+01 354.353 1.06546e+01 354.353 0.8659 
1 1 1 -13 43  14 o 12 6.13808e+00 1.45880e+00 9.02674e+01 358.758 7.78192e+00  -1.68651e-01 0.00000e+00 0.00000e+00 1.24390e+02 358.758 3.41224e+01 358.758 0.9334 
1 1 1 -13 43  15 o 1  4.88082e+00 1.37121e+00 1.00386e+02 126.656 -4.75893e+00 6.39476e+00  0.00000e+00 0.00000e+00 7.03608e+01 126.656 3.00252e+01 306.656 0.9350 
1 1 1 -13 44  1  o 19 9.71074e+00 1.33942e+00 1.23247e+02 306.054 5.83590e+00  -8.01656e+00 0.00000e+00 0.00000e+00 2.26124e+02 306.054 1.02877e+02 306.054 0.9481 
1 1 1 -13 44  2  o 8  1.44781e+01 1.00031e+00 2.56675e+02 33.617  2.92496e+01  1.94456e+01  0.00000e+00 0.00000e+00 2.84492e+02 33.617  2.78172e+01 33.617  0.9857 
1 1 1 -13 44  3  o 18 8.05633e+00 1.20655e+00 1.10085e+02 68.595  2.85149e+00  7.27418e+00  0.00000e+00 0.00000e+00 1.74954e+02 68.595  6.48681e+01 68.595  0.9336 
1 1 1 -13 44  4  o 5  1.55082e+01 8.28059e-01 2.44539e+02 221.186 -2.85478e+01 -2.49797e+01 0.00000e+00 0.00000e+00 3.34937e+02 221.186 9.03973e+01 221.186 0.9867 
1 1 1 -13 44  5  o 19 1.10741e+01 9.60268e-01 2.66314e+02 36.525  2.54313e+01  1.88356e+01  0.00000e+00 0.00000e+00 1.46035e+02 36.525  1.20279e+02 216.525 0.9841 
1 1 1 -13 44  6  o 7  1.49666e+01 8.34073e-01 2.68555e+02 153.545 -4.18685e+01 2.08337e+01  0.00000e+00 0.00000e+00 2.91185e+02 153.545 2.26300e+01 153.545 0.9892 
1 1 1 -13 44  7  o 15 9.16190e+00 1.04012e+00 1.22565e+02 17.288  1.27532e+01  3.96934e+00  0.00000e+00 0.00000e+00 2.10269e+02 17.288  8.77037e+01 17.288  0.9618 
1 1 1 -13 44  8  o 11 4.50206e+00 1.17976e+00 1.67809e+02 218.059 -6.88697e+00 -5.39210e+00 0.00000e+00 0.00000e+00 7.95744e+00 38.059  1.75766e+02 38.059  0.9410 
1 1 1 -13 44  9  o 3  8.66564e+00 1.13812e+00 1.36849e+02 343.852 1.45038e+01  -4.19956e+00 0.00000e+00 0.00000e+00 1.78788e+02 343.852 4.19387e+01 343.852 0.9663 
1 1 1 -13 44  10 o 6  3.21629e+00 1.04900e+00 7.42247e+01 317.146 2.56637e+00  -2.38095e+00 0.00000e+00 0.00000e+00 2.76393e+01 317.146 4.65853e+01 137.146 0.8411 
1 1 1 -13 44  11 o 7  5.48677e+00 1.29128e+00 8.80890e+01 9.427   6.53192e+00  1.08450e+00  0.00000e+00 0.00000e+00 1.01969e+02 9.427   1.38803e+01 9.427   0.9210 
1 1 1 -13 44  12 o 2  5.76436e+00 1.38216e+00 1.03108e+02 203.952 -6.91838e+00 -3.07333e+00 0.00000e+00 0.00000e+00 9.85629e+01 203.952 4.54493e+00 23.952  0.9314 
1 1 1 -13 44  13 o 7  4.12266e+00 1.25707e+00 9.93843e+01 10.080  6.11934e+00  1.08787e+00  0.00000e+00 0.00000e+00 4.22186e+01 10.080  5.71657e+01 190.080 0.9156 
1 1 1 -13 44  14 o 19 7.52863e+00 1.38159e+00 1.75326e+02 178.422 -2.05360e+01 5.65756e-01  0.00000e+00 0.00000e+00 9.97728e+01 178.422 7.55531e+01 358.422 0.9753 
1 1 1 -13 45  1  o 4  8.62171e+00 1.36129e+00 1.13675e+02 281.455 1.65380e+00  -8.16120e+00 0.00000e+00 0.00000e+00 1.93118e+02 281.455 7.94424e+01 281.455 0.9379 
1 1 1 -13 45  2  o 15 1.38571e+01 1.02871e+00 2.12615e+02 184.927 -2.85678e+01 -2.46287e+00 0.00000e+00 0.00000e+00 3.03564e+02 184.927 9.09493e+01 184.927 0.9824 
1 1 1 -13 45  3  o 10 5.09747e+00 1.29504e+00 1.38455e+02 287.458 1.87759e+00  -5.97025e+00 0.00000e+00 0.00000e+00 3.85102e+01 287.458 9.99449e+01 107.458 0.9162 
1 1 1 -13 45  4  o 8  1.31844e+01 1.09556e+00 2.63275e+02 213.157 -2.83853e+01 -1.85446e+01 0.00000e+00 0.00000e+00 2.28518e+02 213.157 3.47564e+01 33.157  0.9851 
1 1 1 -13 45  5  o 12 6.21094e+00 1.16587e+00 1.56069e+02 144.920 -8.17175e+00 5.73889e+00  0.00000e+00 0.00000e+00 6.68168e+01 144.920 8.92517e+01 324.920 0.9485 
1 1 1 -13 45  6  o 6  7.58167e+00 1.11010e+00 1.68308e+02 168.743 -1.40747e+01 2.80134e+00  0.00000e+00 0.00000e+00 1.08113e+02 168.743 6.01950e+01 348.743 0.9645 
1 1 1 -13 45  7  o 12 1.09432e+01 9.34811e-01 1.68777e+02 72.420  7.19480e+00  2.27083e+01  0.00000e+00 0.00000e+00 2.35734e+02 72.420  6.69569e+01 72.420  0.9788 
1 1 1 -13 45  8  o 13 3.42757e+00 1.05422e+00 1.04616e+02 165.330 -4.21302e+00 1.10289e+00  0.00000e+00 0.00000e+00 8.65572e+00 165.330 9.59602e+01 345.330 0.8759 
1 1 1 -13 45  9  o 14 6.01499e+00 1.23405e+00 1.01783e+02 294.707 3.08987e+00  -6.71577e+00 0.00000e+00 0.00000e+00 1.08976e+02 294.707 7.19305e+00 294.707 0.9297 
1 1 1 -13 45  10 o 9  4.43469e+00 1.21657e+00 1.39802e+02 127.932 -4.80936e+00 6.17081e+00  0.00000e+00 0.00000e+00 1.60892e+01 127.932 1.23712e+02 307.932 0.9337 
1 1 1 -13 45  11 o 3  5.11975e+00 1.32504e+00 7.77437e+01 135.409 -3.62963e+00 3.57814e+00  0.00000e+00 0.00000e+00 9.46774e+01 135.409 1.69337e+01 135.409 0.8956 
1 1 1 -13 45  12 o 13 8.13344e+00 1.31047e+00 1.26010e+02 225.528 -9.71732e+00 -9.89805e+00 0.00000e+00 0.00000e+00 1.68241e+02 225.528 4.22313e+01 225.528 0.9633 
1 1 1 -13 45  13 o 19 3.69527e+00 1.16349e+00 2.70345e+01 99.958  -2.78134e-01 1.58420e+00  0.00000e+00 0.00000e+00 5.91550e+01 99.958  3.21205e+01 99.958  0.6218 
1 1 1 -13 45  14 o 12 3.98621e+00 1.22943e+00 8.09516e+01 254.151 -1.58150e+00 -5.57076e+00 0.00000e+00 0.00000e+00 5.47781e+01 254.151 2.61735e+01 74.151  0.9090 
1 1 1 -13 46  1  f 0  1.35268e+01 1.13862e+00 2.29150e+02 244.912 -1.18895e+01 -2.53956e+01 0.00000e+00 0.00000e+00 2.74768e+02 244.912 4.56179e+01 244.912 0.9820 
1 1 1 -13 46  2  o 16 1.73174e+01 8.75287e-01 2.77225e+02 37.667  3.98156e+01  3.07360e+01  0.00000e+00 0.00000e+00 3.72762e+02 37.667  9.55364e+01 37.667  0.9900 
1 1 1 -13 46  3  o 8  6.09715e+00 1.27702e+00 1.15033e+02 230.418 -3.79085e+00 -4.58521e+00 0.00000e+00 0.00000e+00 9.55405e+01 230.418 1.94926e+01 50.418  0.9116 
1 1 1 -13 46  4  o 12 7.04352e+00 1.27526e+00 1.55769e+02 117.743 -4.80178e+00 9.12944e+00  0.00000e+00 0.00000e+00 9.76167e+01 117.743 5.81518e+01 297.743 0.9502 
1 1 1 -13 46  5  o 4  1.50569e+01 8.28832e-01 2.52656e+02 238.363 -2.46387e+01 -3.99921e+01 0.00000e+00 0.00000e+00 3.10831e+02 238.363 5.81743e+01 238.363 0.9893 
1 1 1 -13 46  6  o 15 1.29564e+01 8.82375e-01 2.32119e+02 101.686 -7.27918e+00 3.51936e+01  0.00000e+00 0.00000e+00 2.50722e+02 101.686 1.86037e+01 101.686 0.9860 
1 1 1 -13 46  7  o 12 5.67599e+00 1.21477e+00 1.19271e+02 121.169 -3.77808e+00 6.24596e+00  0.00000e+00 0.00000e+00 7.97877e+01 121.169 3.94836e+01 301.169 0.9287 
1 1 1 -13 46  8  o 14 5.60708e+00 1.22465e+00 8.69775e+01 54.962  3.45857e+00  4.93246e+00  0.00000e+00 0.00000e+00 1.06087e+02 54.962  1.91096e+01 54.962  0.9127 
1 1 1 -13 46  9  o 9  1.16526e+01 1.00308e+00 2.22869e+02 17.772  3.50910e+01  1.12477e+01  0.00000e+00 0.00000e+00 2.10261e+02 17.772  1.26081e+01 197.772 0.9863 
1 1 1 -13 46  10 o 3  5.98460e+00 1.28743e+00 1.23724e+02 331.808 8.38918e+00  -4.49667e+00 0.00000e+00 0.00000e+00 8.93725e+01 331.808 3.43511e+01 151.808 0.9459 
1 1 1 -13 46  11 o 4  9.57294e+00 1.21096e+00 1.91541e+02 234.160 -1.50278e+01 -2.08058e+01 0.00000e+00 0.00000e+00 1.61314e+02 234.160 3.02264e+01 54.160  0.9803 
1 1 1 -13 46  12 o 19 1.06050e+01 1.17716e+00 2.19635e+02 343.067 3.33273e+01  -1.01464e+01 0.00000e+00 0.00000e+00 1.72863e+02 343.067 4.67728e+01 163.067 0.9855 
1 1 1 -13 46  13 o 13 7.54883e+00 1.40441e+00 1.01078e+02 186.107 -1.08207e+01 -1.15778e+00 0.00000e+00 0.00000e+00 1.68703e+02 186.107 6.76252e+01 186.107 0.9529 
1 1 1 -13 46  14 o 17 4.08162e+00 1.20769e+00 9.03756e+01 73.266  1.99711e+00  6.64250e+00  0.00000e+00 0.00000e+00 5.10055e+01 73.266  3.93701e+01 253.266 0.9248 
1 1 1 -13 47  1  o 13 3.45843e+00 1.11936e+00 2.39695e+01 4.957   7.88123e-01  6.83535e-02  0.00000e+00 0.00000e+00 2.42417e+01 4.957   2.72247e-01 4.957   0.3675 
1 1 1 -13 47  2  o 8  4.19002e+00 1.29436e+00 1.49579e+02 293.338 2.09212e+00  -4.84900e+00 0.00000e+00 0.00000e+00 6.70517e+00 113.338 1.56284e+02 113.338 0.8995 
1 1 1 -13 47  3  o 8  8.97141e+00 1.23273e+00 2.00679e+02 306.344 9.83877e+00  -1.33722e+01 0.00000e+00 0.00000e+00 1.28777e+02 306.344 7.19027e+01 126.344 0.9694 
1 1 1 -13 47  4  o 1  1.30651e+01 1.02097e+00 2.53474e+02 127.656 -2.22394e+01 2.88198e+01  0.00000e+00 0.00000e+00 2.34254e+02 127.656 1.92203e+01 307.656 0.9862 
1 1 1 -13 47  5  o 19 4.44730e+00 1.17357e+00 1.40124e+02 341.253 6.26029e+00  -2.12466e+00 0.00000e+00 0.00000e+00 1.47871e+01 341.253 1.25337e+02 161.253 0.9209 
1 1 1 -13 47  6  o 10 1.29764e+01 8.89270e-01 2.45240e+02 134.436 -2.82272e+01 2.87883e+01  0.00000e+00 0.00000e+00 2.39035e+02 134.436 6.20492e+00 314.436 0.9875 
1 1 1 -13 47  7  o 15 6.54312e+00 1.18942e+00 1.18153e+02 11.971  8.48961e+00  1.79996e+00  0.00000e+00 0.00000e+00 1.14191e+02 11.971  3.96159e+00 191.971 0.9405 
1 1 1 -13 47  8  o 17 5.84809e+00 1.23638e+00 1.62462e+02 147.830 -9.67378e+00 6.08483e+00  0.00000e+00 0.00000e+00 4.82422e+01 147.830 1.14219e+02 327.830 0.9552 
1 1 1 -13 47  9  f 0  1.08532e+01 9.84908e-01 1.14438e+02 18.866  1.58009e+01  5.39925e+00  0.00000e+00 0.00000e+00 2.82071e+02 18.866  1.67632e+02 18.866  0.9696 
1 1 1 -13 47  10 o 13 6.13111e+00 1.31580e+00 7.17261e+01 241.515 -2.63991e+00 -4.86517e+00 0.00000e+00 0.00000e+00 1.36997e+02 241.515 6.52705e+01 241.515 0.9045 
1 1 1 -13 47  11 o 2  4.73773e+00 1.30841e+00 7.45483e+01 268.045 -1.49757e-01 -4.38848e+00 0.00000e+00 0.00000e+00 8.16644e+01 268.045 7.11604e+00 268.045 0.8770 
1 1 1 -13 47  12 o 18 4.35574e+00 1.26930e+00 6.81350e+01 122.904 -2.29252e+00 3.54309e+00  0.00000e+00 0.00000e+00 7.43978e+01 122.904 6.26286e+00 122.904 0.8715 
1 1 1 -13 47  13 o 13 4.01806e+00 1.20768e+00 3.71894e+01 189.852 -2.41502e+00 -4.19412e-01 0.00000e+00 0.00000e+00 7.72630e+01 189.852 4.00737e+01 189.852 0.7596 
1 1 1 -13 47  14 o 11 2.62390e+00 9.18795e-01 6.87709e+01 69.974  1.48703e+00  4.07989e+00  0.00000e+00 0.00000e+00 1.72608e+01 69.974  5.15101e+01 249.974 0.8755 
1 1 1 -13 48  1  o 17 9.16110e+00 1.38835e+00 1.63321e+02 88.242  3.71314e-01  1.20972e+01  0.00000e+00 0.00000e+00 1.69445e+02 88.242  6.12365e+00 88.242  0.9578 
1 1 1 -13 48  2  o 14 7.92689e+00 1.44560e+00 1.48015e+02 311.864 6.56863e+00  -7.33013e+00 0.00000e+00 0.00000e+00 1.36739e+02 311.864 1.12763e+01 131.864 0.9478 
1 1 1 -13 48  3  o 8  8.80483e+00 1.07145e+00 1.74565e+02 194.893 -1.52593e+01 -4.05826e+00 0.00000e+00 0.00000e+00 1.48198e+02 194.893 2.63670e+01 14.893  0.9678 
1 1 1 -13 48  4  o 9  5.06557e+00 1.23255e+00 1.34781e+02 111.155 -2.54985e+00 6.58931e+00  0.00000e+00 0.00000e+00 4.28077e+01 111.155 9.19738e+01 291.155 0.9263 
1 1 1 -13 48  5  o 13 1.39467e+01 8.40503e-01 2.63051e+02 252.384 -1.40666e+01 -4.43002e+01 0.00000e+00 0.00000e+00 2.58695e+02 252.384 4.35575e+00 72.384  0.9892 
1 1 1 -13 48  6  o 8  1.34483e+01 8.65037e-01 2.23294e+02 57.549  2.07188e+01  3.25839e+01  0.00000e+00 0.00000e+00 2.78247e+02 57.549  5.49533e+01 57.549  0.9870 
1 1 1 -13 48  7  o 2  3.95326e+00 1.05407e+00 1.04859e+02 266.505 -3.18240e-01 -5.21075e+00 0.00000e+00 0.00000e+00 2.91991e+01 266.505 7.56595e+01 86.505  0.8983 
1 1 1 -13 48  8  o 1  1.42540e+01 8.41048e-01 2.17044e+02 62.852  2.09771e+01  4.09084e+01  0.00000e+00 0.00000e+00 3.14662e+02 62.852  9.76183e+01 62.852  0.9891 
1 1 1 -13 48  9  o 8  6.30660e+00 1.26359e+00 1.47139e+02 21.402  1.09759e+01  4.30191e+00  0.00000e+00 0.00000e+00 8.01523e+01 21.402  6.69862e+01 201.402 0.9566 
1 1 1 -13 48  10 o 13 1.10846e+01 1.11332e+00 1.61567e+02 300.648 1.32439e+01  -2.23515e+01 0.00000e+00 0.00000e+00 2.47481e+02 300.648 8.59144e+01 300.648 0.9806 
1 1 1 -13 48  11 o 2  6.84257e+00 1.29908e+00 9.98553e+01 146.344 -7.53768e+00 5.01868e+00  0.00000e+00 0.00000e+00 1.42709e+02 146.344 4.28534e+01 146.344 0.9431 
1 1 1 -13 48  12 o 13 4.38660e+00 1.21994e+00 8.12486e+01 275.278 4.87904e-01  -5.28169e+00 0.00000e+00 0.00000e+00 6.69703e+01 275.278 1.42783e+01 95.278  0.9000 
1 1 1 -13 48  13 o 11 3.91046e+00 1.22569e+00 4.52751e+01 165.460 -2.78451e+00 7.22193e-01  0.00000e+00 0.00000e+00 7.20882e+01 165.460 2.68131e+01 165.460 0.8004 
1 1 1 -13 48  14 o 7  3.68519e+00 1.17742e+00 5.56265e+01 40.202  3.00114e+00  2.53633e+00  0.00000e+00 0.00000e+00 6.31498e+01 40.202  7.52322e+00 40.202  0.8608 
1 1 1 -13 49  1  o 1  4.23526e+00 1.17330e+00 9.19025e+01 130.256 -2.37693e+00 2.80714e+00  0.00000e+00 0.00000e+00 4.45967e+01 130.256 4.73058e+01 310.256 0.8499 
1 1 1 -13 49  2  o 11 1.08287e+01 1.25104e+00 1.68168e+02 343.206 1.65713e+01  -5.00118e+00 0.00000e+00 0.00000e+00 2.30179e+02 343.206 6.20111e+01 343.206 0.9707 
1 1 1 -13 49  3  o 3  6.70583e+00 1.22716e+00 1.29470e+02 254.133 -2.37912e+00 -8.37025e+00 0.00000e+00 0.00000e+00 1.09423e+02 254.133 2.00469e+01 74.133  0.9407 
1 1 1 -13 49  4  o 5  5.64969e+00 1.28713e+00 9.19872e+01 274.883 4.44702e-01  -5.20546e+00 0.00000e+00 0.00000e+00 1.00085e+02 274.883 8.09774e+00 274.883 0.8983 
1 1 1 -13 49  5  o 11 1.50445e+01 8.27789e-01 2.76892e+02 357.545 5.08304e+01  -2.17953e+00 0.00000e+00 0.00000e+00 2.86382e+02 357.545 9.48982e+00 357.545 0.9901 
1 1 1 -13 49  6  o 18 8.34779e+00 1.07258e+00 2.05060e+02 267.708 -8.27072e-01 -2.06652e+01 0.00000e+00 0.00000e+00 1.02610e+02 267.708 1.02450e+02 87.708  0.9755 
1 1 1 -13 49  7  o 6  4.97563e+00 1.21211e+00 1.26553e+02 256.480 -1.67502e+00 -6.96623e+00 0.00000e+00 0.00000e+00 4.76120e+01 256.480 7.89406e+01 76.480  0.9273 
1 1 1 -13 49  8  o 7  5.07155e+00 1.12459e+00 8.14852e+01 203.838 -4.82353e+00 -2.13123e+00 0.00000e+00 0.00000e+00 9.05137e+01 203.838 9.02845e+00 203.838 0.8994 
1 1 1 -13 49  9  o 12 5.57064e+00 1.24823e+00 7.37881e+01 10.446  4.87233e+00  8.98308e-01  0.00000e+00 0.00000e+00 1.13462e+02 10.446  3.96742e+01 10.446  0.8923 
1 1 1 -13 49  10 o 3  4.93600e+00 1.24296e+00 8.65196e+01 194.469 -5.29389e+00 -1.36605e+00 0.00000e+00 0.00000e+00 8.12365e+01 194.469 5.28314e+00 14.469  0.9032 
1 1 1 -13 49  11 o 19 5.33952e+00 1.26720e+00 1.03439e+02 119.296 -3.80993e+00 6.79039e+00  0.00000e+00 0.00000e+00 8.38763e+01 119.296 1.95629e+01 299.296 0.9334 
1 1 1 -13 49  12 o 1  6.73050e+00 1.41386e+00 1.14387e+02 356.569 1.02804e+01  -6.16347e-01 0.00000e+00 0.00000e+00 1.25670e+02 356.569 1.12834e+01 356.569 0.9501 
1 1 1 -13 49  13 o 18 5.77776e+00 1.43534e+00 8.83892e+01 329.463 6.02153e+00  -3.55214e+00 0.00000e+00 0.00000e+00 1.12070e+02 329.463 2.36805e+01 329.463 0.9254 
1 1 1 -13 49  14 o 11 3.75824e+00 1.17463e+00 8.34350e+01 196.465 -5.72635e+00 -1.69239e+00 0.00000e+00 0.00000e+00 4.48782e+01 196.465 3.85568e+01 16.465  0.9119 
1 1 1 -13 50  1  o 1  1.37905e+01 1.12345e+00 2.58439e+02 166.606 -3.64832e+01 8.68760e+00  0.00000e+00 0.00000e+00 2.57422e+02 166.606 1.01703e+00 346.606 0.9866 
1 1 1 -13 50  2  f 0  6.01342e+00 1.44915e+00 1.30899e+02 351.621 7.01566e+00  -1.03337e+00 0.00000e+00 0.00000e+00 8.02258e+01 351.621 5.06735e+01 171.621 0.9265 
1 1 1 -13 50  3  o 1  4.48430e+00 1.26485e+00 5.19242e+01 47.678  1.59649e+00  1.75317e+00  0.00000e+00 0.00000e+00 7.54691e+01 47.678  2.35448e+01 47.678  0.7502 
1 1 1 -13 50  4  o 11 1.16158e+01 1.01992e+00 2.47377e+02 134.985 -2.19605e+01 2.19718e+01  0.00000e+00 0.00000e+00 1.85019e+02 134.985 6.23575e+01 314.985 0.9838 
1 1 1 -13 50  5  o 4  1.65728e+01 8.26666e-01 2.37834e+02 317.068 3.75392e+01  -3.49232e+01 0.00000e+00 0.00000e+00 3.82623e+02 317.068 1.44789e+02 317.068 0.9902 
1 1 1 -13 50  6  o 6  4.69216e+00 1.17974e+00 5.12390e+01 236.692 -1.44769e+00 -2.20318e+00 0.00000e+00 0.00000e+00 8.68478e+01 236.692 3.56088e+01 236.692 0.7790 
1 1 1 -13 50  7  o 17 5.72732e+00 1.11626e+00 6.34865e+01 211.064 -4.09138e+00 -2.46455e+00 0.00000e+00 0.00000e+00 1.28445e+02 211.064 6.49589e+01 211.064 0.8879 
1 1 1 -13 50  8  o 7  3.07846e+00 9.90344e-01 7.86553e+01 19.104  3.14611e+00  1.08971e+00  0.00000e+00 0.00000e+00 1.78788e+01 19.104  6.07765e+01 199.104 0.8317 
1 1 1 -13 50  9  o 11 6.18189e+00 1.19831e+00 1.31572e+02 272.603 4.95648e-01  -1.09022e+01 0.00000e+00 0.00000e+00 9.03315e+01 272.603 4.12404e+01 92.603  0.9530 
1 1 1 -13 50  10 o 7  4.37314e+00 1.22401e+00 1.13800e+02 150.025 -6.17959e+00 3.56421e+00  0.00000e+00 0.00000e+00 3.87217e+01 150.025 7.50782e+01 330.025 0.9270 
1 1 1 -13 50  11 o 3  5.43814e+00 1.33680e+00 7.47020e+01 242.901 -2.32985e+00 -4.55315e+00 0.00000e+00 0.00000e+00 1.08403e+02 242.901 3.37008e+01 242.901 0.8960 
1 1 1 -13 50  12 o 13 4.59913e+00 1.30446e+00 4.82851e+01 115.343 -1.39586e+00 2.94721e+00  0.00000e+00 0.00000e+00 9.45728e+01 115.343 4.62877e+01 115.343 0.8276 
1 1 1 -13 50  13 o 9  4.08320e+00 1.20106e+00 6.17088e+01 92.147  -1.54672e-01 4.12597e+00  0.00000e+00 0.00000e+00 7.11935e+01 92.147  9.48474e+00 92.147  0.8683 
1 1 1 -13 50  14 o 18 3.56342e+00 1.15237e+00 6.08650e+01 353.460 4.26805e+00  -4.89320e-01 0.00000e+00 0.00000e+00 5.57247e+01 353.460 5.14031e+00 173.460 0.8740 
1 1 1 -13 51  1  o 13 7.53150e+00 1.38757e+00 1.53788e+02 15.809  1.06898e+01  3.02666e+00  0.00000e+00 0.00000e+00 1.18567e+02 15.809  3.52214e+01 195.809 0.9539 
1 1 1 -13 51  2  o 17 1.54233e+01 1.07866e+00 2.37410e+02 359.561 4.07236e+01  -3.12306e-01 0.00000e+00 0.00000e+00 3.39718e+02 359.561 1.02309e+02 359.561 0.9876 
1 1 1 -13 51  3  o 4  4.44337e+00 1.17179e+00 7.02094e+01 171.076 -3.27374e+00 5.14084e-01  0.00000e+00 0.00000e+00 6.95516e+01 171.076 6.57815e-01 351.075 0.8308 
1 1 1 -13 51  4  o 19 4.81803e+00 1.27089e+00 1.44592e+02 71.596  2.28564e+00  6.86926e+00  0.00000e+00 0.00000e+00 2.45890e+01 71.596  1.20003e+02 251.596 0.9281 
1 1 1 -13 51  5  o 1  1.64300e+01 9.30230e-01 2.51704e+02 267.608 -2.15800e+00 -5.16706e+01 0.00000e+00 0.00000e+00 3.63375e+02 267.608 1.11671e+02 267.608 0.9903 
1 1 1 -13 51  6  o 7  6.48858e+00 1.14384e+00 8.21127e+01 192.005 -6.27599e+00 -1.33462e+00 0.00000e+00 0.00000e+00 1.42964e+02 192.005 6.08514e+01 192.005 0.9184 
1 1 1 -13 51  7  o 9  4.94029e+00 1.13960e+00 7.22063e+01 148.917 -3.87928e+00 2.33859e+00  0.00000e+00 0.00000e+00 9.20736e+01 148.917 1.98672e+01 148.917 0.8812 
1 1 1 -13 51  8  o 6  5.71976e+00 1.25013e+00 1.03577e+02 292.061 2.74848e+00  -6.78182e+00 0.00000e+00 0.00000e+00 9.67268e+01 292.061 6.84976e+00 112.061 0.9289 
1 1 1 -13 51  9  o 13 3.57701e+00 1.09906e+00 6.03064e+01 223.045 -2.12583e+00 -1.98552e+00 0.00000e+00 0.00000e+00 4.78678e+01 223.045 1.24386e+01 43.045  0.8030 
1 1 1 -13 51  10 o 10 1.29527e+01 9.68635e-01 2.15057e+02 60.407  2.19495e+01  3.86498e+01  0.00000e+00 0.00000e+00 2.66689e+02 60.407  5.16317e+01 60.407  0.9887 
1 1 1 -13 51  11 o 7  4.69717e+00 1.27524e+00 2.95217e+01 49.994  1.21852e+00  1.45185e+00  0.00000e+00 0.00000e+00 9.04643e+01 49.994  6.09426e+01 49.994  0.6798 
1 1 1 -13 51  12 o 7  5.31240e+00 1.35235e+00 8.68362e+01 317.218 4.97425e+00  -4.60329e+00 0.00000e+00 0.00000e+00 9.71708e+01 317.218 1.03346e+01 317.218 0.9230 
1 1 1 -13 51  13 o 8  3.48756e+00 1.13784e+00 3.93491e+01 179.334 -2.47190e+00 2.87292e-02  0.00000e+00 0.00000e+00 6.02454e+01 179.334 2.08963e+01 179.334 0.7619 
1 1 1 -13 52  1  o 16 6.29203e+00 1.22741e+00 1.27137e+02 243.824 -3.65427e+00 -7.43426e+00 0.00000e+00 0.00000e+00 9.64682e+01 243.824 3.06687e+01 63.824  0.9375 
1 1 1 -13 52  2  o 19 1.61175e+01 1.08464e+00 2.76434e+02 307.006 2.96670e+01  -3.93605e+01 0.00000e+00 0.00000e+00 3.27905e+02 307.006 5.14706e+01 307.006 0.9898 
1 1 1 -13 52  3  o 1  9.04641e+00 1.34452e+00 1.40020e+02 162.488 -1.21116e+01 3.82155e+00  0.00000e+00 0.00000e+00 1.88672e+02 162.488 4.86514e+01 162.488 0.9598 
1 1 1 -13 52  4  o 14 4.45800e+00 1.23367e+00 6.99848e+01 299.194 1.64227e+00  -2.93927e+00 0.00000e+00 0.00000e+00 7.06334e+01 299.194 6.48668e-01 299.194 0.8338 
1 1 1 -13 52  5  o 5  6.98966e+00 1.25771e+00 1.09491e+02 279.408 1.37590e+00  -8.30423e+00 0.00000e+00 0.00000e+00 1.38477e+02 279.408 2.89855e+01 279.408 0.9386 
1 1 1 -13 52  6  o 18 6.59104e+00 1.09154e+00 7.63047e+01 316.734 4.43621e+00  -4.17554e+00 0.00000e+00 0.00000e+00 1.51146e+02 316.734 7.48418e+01 316.734 0.9138 
1 1 1 -13 52  7  o 17 6.51991e+00 1.06820e+00 7.27447e+01 129.926 -4.03552e+00 4.82191e+00  0.00000e+00 0.00000e+00 1.52744e+02 129.926 7.99995e+01 129.926 0.9166 
1 1 1 -13 52  8  o 3  1.45576e+01 8.59392e-01 2.48573e+02 258.760 -1.00727e+01 -5.06847e+01 0.00000e+00 0.00000e+00 2.94825e+02 258.760 4.62520e+01 258.760 0.9903 
1 1 1 -13 52  9  o 3  1.22869e+01 9.42803e-01 2.60568e+02 171.161 -4.98158e+01 7.74640e+00  0.00000e+00 0.00000e+00 1.97479e+02 171.161 6.30889e+01 351.161 0.9900 
1 1 1 -13 52  10 o 3  6.87938e+00 1.23874e+00 1.34885e+02 68.819  4.61239e+00  1.19034e+01  0.00000e+00 0.00000e+00 1.13519e+02 68.819  2.13660e+01 248.819 0.9600 
1 1 1 -13 52  11 o 9  5.16409e+00 1.34722e+00 8.93949e+01 51.882  3.76288e+00  4.79595e+00  0.00000e+00 0.00000e+00 8.78973e+01 51.882  1.49760e+00 231.882 0.9138 
1 1 1 -13 52  12 o 5  5.81167e+00 1.31159e+00 5.80108e+01 232.231 -3.01056e+00 -3.88551e+00 0.00000e+00 0.00000e+00 1.36375e+02 232.231 7.83643e+01 232.231 0.8914 
1 1 1 -13 52  13 o 16 8.81215e+00 1.46982e+00 1.02819e+02 41.528  9.83932e+00  8.71360e+00  0.00000e+00 0.00000e+00 2.14592e+02 41.528  1.11773e+02 41.528  0.9612 
1 1 1 -13 53  1  o 10 1.38042e+01 8.50664e-01 1.89269e+02 197.277 -2.88673e+01 -8.97859e+00 0.00000e+00 0.00000e+00 3.25182e+02 197.277 1.35913e+02 197.277 0.9833 
1 1 1 -13 53  2  o 15 8.48912e+00 1.32364e+00 7.36814e+01 12.859  6.18014e+00  1.41080e+00  0.00000e+00 0.00000e+00 2.21275e+02 12.859  1.47593e+02 12.859  0.9173 
1 1 1 -13 53  3  o 8  6.76861e+00 1.37451e+00 1.31952e+02 58.094  4.51107e+00  7.24575e+00  0.00000e+00 0.00000e+00 1.08734e+02 58.094  2.32175e+01 238.094 0.9395 
1 1 1 -13 53  4  o 19 1.18987e+01 1.02727e+00 2.13145e+02 276.840 3.61684e+00  -3.01544e+01 0.00000e+00 0.00000e+00 2.29428e+02 276.840 1.62830e+01 276.840 0.9834 
1 1 1 -13 53  5  o 17 3.71318e+00 1.11660e+00 7.68553e+01 142.210 -2.62877e+00 2.03834e+00  0.00000e+00 0.00000e+00 3.98301e+01 142.210 3.70251e+01 322.210 0.8315 
1 1 1 -13 53  6  o 2  8.31919e+00 1.08125e+00 1.57496e+02 29.303  1.36988e+01  7.68828e+00  0.00000e+00 0.00000e+00 1.46471e+02 29.303  1.10248e+01 209.303 0.9676 
1 1 1 -13 53  7  o 11 6.06593e+00 1.21255e+00 1.29263e+02 171.655 -9.43598e+00 1.38410e+00  0.00000e+00 0.00000e+00 8.72258e+01 171.655 4.20368e+01 351.655 0.9460 
1 1 1 -13 53  8  o 7  6.26555e+00 1.23455e+00 8.63072e+01 105.142 -1.82569e+00 6.74669e+00  0.00000e+00 0.00000e+00 1.32219e+02 105.142 4.59121e+01 105.142 0.9254 
1 1 1 -13 53  9  o 16 9.63536e+00 1.08752e+00 1.63996e+02 308.012 1.43510e+01  -1.83607e+01 0.00000e+00 0.00000e+00 1.90897e+02 308.012 2.69007e+01 308.012 0.9783 
1 1 1 -13 53  10 f 0  8.76069e+00 1.19604e+00 1.09211e+02 15.459  1.22758e+01  3.39485e+00  0.00000e+00 0.00000e+00 2.07047e+02 15.459  9.78355e+01 15.459  0.9599 
1 1 1 -13 53  11 o 6  6.75701e+00 1.36250e+00 4.09552e+01 8.889   3.61043e+00  5.64653e-01  0.00000e+00 0.00000e+00 1.74480e+02 8.889   1.33525e+02 8.889   0.8488 
1 1 1 -13 53  12 o 4  4.68676e+00 1.30495e+00 9.70865e+01 229.489 -4.30118e+00 -5.03407e+00 0.00000e+00 0.00000e+00 6.48670e+01 229.489 3.22195e+01 49.489  0.9210 
1 1 1 -13 53  13 o 14 3.41423e+00 1.12030e+00 8.18549e+00 98.955  -8.54565e-02 5.42317e-01  0.00000e+00 0.00000e+00 2.56718e+01 98.955  1.74863e+01 98.955  0.2647 
1 1 1 -13 54  1  o 12 1.44531e+01 8.48525e-01 2.30569e+02 192.561 -3.94829e+01 -8.79721e+00 0.00000e+00 0.00000e+00 3.10308e+02 192.561 7.97382e+01 192.561 0.9876 
1 1 1 -13 54  2  o 12 3.36183e+00 1.09551e+00 6.83134e+01 190.928 -2.46213e+00 -4.75399e-01 0.00000e+00 0.00000e+00 2.91878e+01 190.928 3.91257e+01 10.928  0.7658 
1 1 1 -13 54  3  o 13 1.28850e+01 1.13484e+00 1.95501e+02 33.209  2.38667e+01  1.56232e+01  0.00000e+00 0.00000e+00 2.83512e+02 33.209  8.80112e+01 33.209  0.9823 
1 1 1 -13 54  4  o 15 3.75991e+00 1.11181e+00 6.53847e+01 258.078 -6.02101e-01 -2.85186e+00 0.00000e+00 0.00000e+00 4.88622e+01 258.078 1.65225e+01 78.078  0.8035 
1 1 1 -13 54  5  o 8  7.32742e+00 1.15332e+00 6.09715e+01 108.438 -1.69293e+00 5.07801e+00  0.00000e+00 0.00000e+00 1.88492e+02 108.438 1.27520e+02 108.438 0.9010 
1 1 1 -13 54  6  o 10 6.60464e+00 1.16067e+00 1.14495e+02 91.337  -2.26060e-01 9.68274e+00  0.00000e+00 0.00000e+00 1.21615e+02 91.337  7.11921e+00 91.337  0.9469 
1 1 1 -13 54  7  o 15 1.22389e+01 9.15753e-01 2.02666e+02 228.483 -2.34793e+01 -2.65224e+01 0.00000e+00 0.00000e+00 2.52422e+02 228.483 4.97556e+01 228.483 0.9858 
1 1 1 -13 54  8  o 11 4.67641e+00 1.18343e+00 1.05452e+02 262.598 -7.93648e-01 -6.10938e+00 0.00000e+00 0.00000e+00 5.57525e+01 262.598 4.96998e+01 82.598  0.9148 
1 1 1 -13 54  9  o 16 6.25910e+00 1.27565e+00 1.03797e+02 67.476  3.12640e+00  7.53892e+00  0.00000e+00 0.00000e+00 1.16873e+02 67.476  1.30755e+01 67.476  0.9366 
1 1 1 -13 54  10 o 14 4.05959e+00 1.20313e+00 7.38382e+01 237.765 -2.25389e+00 -3.57427e+00 0.00000e+00 0.00000e+00 5.92213e+01 237.765 1.46169e+01 57.765  0.8717 
1 1 1 -13 54  11 o 13 7.31233e+00 1.31895e+00 1.94111e+02 137.563 -1.45833e+01 1.33338e+01  0.00000e+00 0.00000e+00 7.34856e+01 137.563 1.20625e+02 317.563 0.9744 
1 1 1 -13 54  12 o 14 8.82772e+00 1.26498e+00 1.59298e+02 297.102 1.00754e+01  -1.96869e+01 0.00000e+00 0.00000e+00 1.64274e+02 297.102 4.97590e+00 297.102 0.9771 
1 1 1 -13 54  13 o 15 8.41516e+00 1.34139e+00 1.42808e+02 86.797  1.12720e+00  2.01435e+01  0.00000e+00 0.00000e+00 1.64542e+02 86.797  2.17343e+01 86.797  0.9749 
1 1 1 -13 55  1  o 15 6.01551e+00 1.14919e+00 1.60363e+02 201.021 -1.01375e+01 -3.89571e+00 0.00000e+00 0.00000e+00 5.67955e+01 201.021 1.03568e+02 21.021  0.9528 
1 1 1 -13 55  2  o 18 6.56152e+00 1.46195e+00 1.04893e+02 141.820 -5.18300e+00 4.07568e+00  0.00000e+00 0.00000e+00 1.23857e+02 141.820 1.89642e+01 141.820 0.9207 
1 1 1 -13 55  3  o 10 8.46444e+00 1.38608e+00 1.87893e+02 264.274 -1.58764e+00 -1.58344e+01 0.00000e+00 0.00000e+00 1.22166e+02 264.274 6.57268e+01 84.274  0.9681 
1 1 1 -13 55  4  o 5  8.72543e+00 1.20671e+00 1.58316e+02 319.542 1.13765e+01  -9.70212e+00 0.00000e+00 0.00000e+00 1.60377e+02 319.542 2.06182e+00 319.542 0.9660 
1 1 1 -13 55  5  o 13 6.53707e+00 1.22398e+00 1.08520e+02 123.476 -4.42795e+00 6.69603e+00  0.00000e+00 0.00000e+00 1.22523e+02 123.476 1.40031e+01 123.476 0.9355 
1 1 1 -13 55  6  o 13 7.16027e+00 1.15393e+00 1.49825e+02 259.753 -2.41700e+00 -1.33701e+01 0.00000e+00 0.00000e+00 1.10323e+02 259.753 3.95021e+01 79.753  0.9625 
1 1 1 -13 55  7  o 6  6.94079e+00 1.08406e+00 1.89807e+02 55.298  1.01837e+01  1.47059e+01  0.00000e+00 0.00000e+00 6.45354e+01 55.298  1.25271e+02 235.298 0.9716 
1 1 1 -13 55  8  o 10 4.80093e+00 1.21844e+00 7.25207e+01 256.888 -9.96367e-01 -4.27765e+00 0.00000e+00 0.00000e+00 8.61298e+01 256.888 1.36091e+01 256.888 0.8771 
1 1 1 -13 55  9  o 6  1.16610e+01 9.36545e-01 2.04105e+02 308.694 2.45346e+01  -3.06307e+01 0.00000e+00 0.00000e+00 2.29166e+02 308.694 2.50606e+01 308.694 0.9872 
1 1 1 -13 55  10 o 19 3.68554e+00 1.13477e+00 6.21660e+01 186.152 -3.50618e+00 -3.77903e-01 0.00000e+00 0.00000e+00 5.45702e+01 186.152 7.59577e+00 6.152   0.8425 
1 1 1 -13 55  11 o 18 7.67726e+00 1.20337e+00 1.14212e+02 24.291  1.24810e+01  5.63291e+00  0.00000e+00 0.00000e+00 1.63354e+02 24.291  4.91424e+01 24.291  0.9628 
1 1 1 -13 55  12 o 10 2.97370e+00 9.88880e-01 3.21043e+01 177.094 -1.84456e+00 9.36378e-02  0.00000e+00 0.00000e+00 4.27308e+01 177.094 1.06265e+01 177.094 0.6710 
1 1 1 -13 55  13 o 17 4.64857e+00 1.32208e+00 1.54673e+02 181.457 -1.15592e+01 -2.93955e-01 0.00000e+00 0.00000e+00 1.17457e+01 181.457 1.42928e+02 1.457   0.9557 
1 1 1 -13 56  1  o 6  3.28984e+00 1.00201e+00 4.01488e+01 175.506 -1.59614e+00 1.25441e-01  0.00000e+00 0.00000e+00 3.71387e+01 175.506 3.01012e+00 355.506 0.6201 
1 1 1 -13 56  2  o 14 7.19368e+00 1.36201e+00 1.29904e+02 215.991 -7.87949e+00 -5.72283e+00 0.00000e+00 0.00000e+00 1.28059e+02 215.991 1.84493e+00 35.991  0.9472 
1 1 1 -13 56  3  o 9  8.99762e+00 1.27527e+00 1.28404e+02 355.285 1.20594e+01  -9.94714e-01 0.00000e+00 0.00000e+00 1.97627e+02 355.285 6.92236e+01 355.285 0.9577 
1 1 1 -13 56  4  o 13 9.09640e+00 1.08742e+00 1.75002e+02 177.662 -1.97229e+01 8.05220e-01  0.00000e+00 0.00000e+00 1.60070e+02 177.662 1.49317e+01 357.662 0.9743 
1 1 1 -13 56  5  o 15 3.55327e+00 1.07050e+00 5.92055e+01 357.202 2.53143e+00  -1.23699e-01 0.00000e+00 0.00000e+00 4.39745e+01 357.202 1.52310e+01 177.202 0.7687 
1 1 1 -13 56  6  o 6  1.21646e+01 1.03964e+00 1.96332e+02 359.851 3.19217e+01  -8.27116e-02 0.00000e+00 0.00000e+00 2.55551e+02 359.851 5.92189e+01 359.851 0.9842 
1 1 1 -13 56  7  o 11 4.37756e+00 1.16341e+00 7.03214e+01 132.771 -2.56103e+00 2.76844e+00  0.00000e+00 0.00000e+00 7.06694e+01 132.771 3.48014e-01 132.771 0.8541 
1 1 1 -13 56  8  o 5  3.63232e+00 1.08538e+00 9.87403e+01 247.791 -1.97218e+00 -4.83057e+00 0.00000e+00 0.00000e+00 2.41649e+01 247.791 7.45754e+01 67.791  0.8982 
1 1 1 -13 56  9  o 3  1.11922e+01 9.91569e-01 1.70559e+02 249.062 -1.07441e+01 -2.80800e+01 0.00000e+00 0.00000e+00 2.43565e+02 249.062 7.30059e+01 249.062 0.9832 
1 1 1 -13 56  10 o 6  8.02720e+00 1.19326e+00 8.10471e+01 87.180  4.40667e-01  8.94516e+00  0.00000e+00 0.00000e+00 2.03320e+02 87.180  1.22273e+02 87.180  0.9424 
1 1 1 -13 56  11 o 16 6.05288e+00 1.39794e+00 1.19818e+02 55.475  5.55519e+00  8.07536e+00  0.00000e+00 0.00000e+00 9.55236e+01 55.475  2.42947e+01 235.475 0.9475 
1 1 1 -13 56  12 o 2  5.22433e+00 1.32587e+00 5.58115e+01 190.921 -4.24897e+00 -8.19849e-01 0.00000e+00 0.00000e+00 1.15621e+02 190.921 5.98097e+01 190.921 0.8750 
1 1 1 -13 56  13 o 18 4.39086e+00 1.22824e+00 9.96408e+01 265.911 -5.72546e-01 -8.00921e+00 0.00000e+00 0.00000e+00 5.41992e+01 265.911 4.54417e+01 85.911  0.9355 
1 1 1 -13 57  1  o 18 2.41032e+01 8.17033e-01 4.32676e+02 104.128 -3.46074e+01 1.37496e+02  0.00000e+00 0.00000e+00 4.77056e+02 104.128 4.43802e+01 104.128 0.9965 
1 1 1 -13 57  2  o 17 1.60244e+01 8.09719e-01 2.95528e+02 296.919 2.78036e+01  -5.47585e+01 0.00000e+00 0.00000e+00 3.06096e+02 296.919 1.05672e+01 296.919 0.9918 
1 1 1 -13 57  3  o 17 1.77065e+01 1.05268e+00 3.08487e+02 143.105 -5.24945e+01 3.94068e+01  0.00000e+00 0.00000e+00 3.56194e+02 143.105 4.77065e+01 143.105 0.9924 
1 1 1 -13 57  4  o 3  1.10122e+01 1.25368e+00 1.25688e+02 266.314 -9.91485e-01 -1.53918e+01 0.00000e+00 0.00000e+00 2.76847e+02 266.314 1.51159e+02 266.314 0.9670 
1 1 1 -13 57  5  o 19 1.01726e+01 1.09588e+00 1.68206e+02 109.605 -7.46770e+00 2.09663e+01  0.00000e+00 0.00000e+00 2.07281e+02 109.605 3.90757e+01 109.605 0.9773 
1 1 1 -13 57  6  o 15 6.91455e+00 1.21435e+00 8.45560e+01 337.782 6.60282e+00  -2.69703e+00 0.00000e+00 0.00000e+00 1.57329e+02 337.782 7.27730e+01 337.782 0.9270 
1 1 1 -13 57  7  o 11 4.77189e+00 1.17135e+00 4.07767e+01 7.847   2.58661e+00  3.56467e-01  0.00000e+00 0.00000e+00 9.89365e+01 7.847   5.81598e+01 7.847   0.7766 
1 1 1 -13 57  8  o 17 5.27910e+00 1.12690e+00 6.33479e+01 161.109 -4.47122e+00 1.53007e+00  0.00000e+00 0.00000e+00 1.12947e+02 161.109 4.95988e+01 161.109 0.8866 
1 1 1 -13 57  9  o 14 5.20603e+00 1.22561e+00 1.39628e+02 262.096 -1.38692e+00 -9.98988e+00 0.00000e+00 0.00000e+00 4.62764e+01 262.096 9.33516e+01 82.096  0.9490 
1 1 1 -13 57  10 f 0  4.01852e+00 1.19887e+00 3.58529e+01 70.077  7.04759e-01  1.94441e+00  0.00000e+00 0.00000e+00 7.11803e+01 70.077  3.53274e+01 70.077  0.7087 
1 1 1 -13 57  11 o 15 5.96845e+00 1.38140e+00 1.25227e+02 127.303 -6.51480e+00 8.55095e+00  0.00000e+00 0.00000e+00 8.81450e+01 127.303 3.70820e+01 307.303 0.9523 
1 1 1 -13 57  12 o 16 4.50767e+00 1.26357e+00 5.64652e+01 298.929 2.01290e+00  -3.64206e+00 0.00000e+00 0.00000e+00 9.04856e+01 298.929 3.40204e+01 298.929 0.8694 
1 1 1 -13 57  13 o 1  3.74983e+00 1.18415e+00 7.62925e+01 142.835 -4.30281e+00 3.26189e+00  0.00000e+00 0.00000e+00 5.03505e+01 142.835 2.59420e+01 322.835 0.9019 
1 1 1 -13 58  1  o 17 5.46598e+00 1.19960e+00 2.37433e+01 206.801 -1.29588e+00 -6.54632e-01 0.00000e+00 0.00000e+00 9.71463e+01 206.801 7.34031e+01 206.801 0.5840 
1 1 1 -13 58  2  o 18 1.04614e+01 9.28302e-01 2.08798e+02 178.593 -2.77978e+01 6.82667e-01  0.00000e+00 0.00000e+00 1.79957e+02 178.593 2.88407e+01 358.593 0.9819 
1 1 1 -13 58  3  o 3  9.64654e+00 1.27672e+00 1.36914e+02 207.953 -1.30828e+01 -6.94238e+00 0.00000e+00 0.00000e+00 2.15398e+02 207.953 7.84835e+01 207.953 0.9656 
1 1 1 -13 58  4  o 18 6.81767e+00 1.38633e+00 1.13632e+02 22.140  7.34866e+00  2.99000e+00  0.00000e+00 0.00000e+00 1.27203e+02 22.140  1.35706e+01 22.140  0.9347 
1 1 1 -13 58  5  o 12 1.12563e+01 9.72750e-01 1.78411e+02 207.751 -2.47726e+01 -1.30341e+01 0.00000e+00 0.00000e+00 2.39010e+02 207.751 6.05989e+01 207.751 0.9820 
1 1 1 -13 58  6  o 4  1.59874e+01 9.15316e-01 2.53927e+02 18.344  5.73006e+01  1.89990e+01  0.00000e+00 0.00000e+00 3.44287e+02 18.344  9.03604e+01 18.344  0.9917 
1 1 1 -13 58  7  o 16 7.09471e+00 1.14629e+00 8.42440e+01 43.992  5.95868e+00  5.75262e+00  0.00000e+00 0.00000e+00 1.66497e+02 43.992  8.22529e+01 43.992  0.9375 
1 1 1 -13 58  8  o 14 6.45076e+00 1.23231e+00 1.07139e+02 92.558  -3.98122e-01 8.90984e+00  0.00000e+00 0.00000e+00 1.21742e+02 92.558  1.46031e+01 92.558  0.9421 
1 1 1 -13 58  9  f 0  6.90140e+00 1.24934e+00 1.21629e+02 79.824  1.91147e+00  1.06496e+01  0.00000e+00 0.00000e+00 1.25700e+02 79.824  4.07161e+00 79.824  0.9526 
1 1 1 -13 58  10 o 14 1.04099e+01 1.08115e+00 1.67490e+02 197.815 -2.64645e+01 -8.50472e+00 0.00000e+00 0.00000e+00 2.16603e+02 197.815 4.91133e+01 197.815 0.9818 
1 1 1 -13 58  11 o 13 4.15884e+00 1.23004e+00 4.95663e+01 357.711 3.18442e+00  -1.27281e-01 0.00000e+00 0.00000e+00 7.88924e+01 357.711 2.93261e+01 357.711 0.8229 
1 1 1 -13 58  12 o 15 3.59998e+00 1.13949e+00 4.16681e+01 344.548 2.59984e+00  -7.18660e-01 0.00000e+00 0.00000e+00 6.42571e+01 344.548 2.25890e+01 344.548 0.7849 
1 1 1 -13 58  13 f 0  3.46653e+00 1.12602e+00 4.49403e+01 153.012 -2.72819e+00 1.38935e+00  0.00000e+00 0.00000e+00 6.07656e+01 153.012 1.58253e+01 153.012 0.8144 
1 1 1 -13 59  1  o 11 9.35765e+00 1.05343e+00 1.06887e+02 114.106 -5.15377e+00 1.15183e+01  0.00000e+00 0.00000e+00 2.33097e+02 114.106 1.26210e+02 114.106 0.9595 
1 1 1 -13 59  2  o 9  3.87362e+00 1.06801e+00 6.78701e+01 190.500 -3.17170e+00 -5.87829e-01 0.00000e+00 0.00000e+00 5.31177e+01 190.500 1.47525e+01 10.500  0.8254 
1 1 1 -13 59  3  f 0  6.57454e+00 1.35277e+00 1.28704e+02 293.482 3.51854e+00  -8.09892e+00 0.00000e+00 0.00000e+00 1.05387e+02 293.482 2.33174e+01 113.482 0.9415 
1 1 1 -13 59  4  o 3  3.64347e+00 1.11528e+00 1.02498e+02 131.533 -3.18762e+00 3.59882e+00  0.00000e+00 0.00000e+00 1.98606e+01 131.533 8.26378e+01 311.533 0.8887 
1 1 1 -13 59  5  o 9  1.36333e+01 9.32400e-01 2.61363e+02 91.724  -1.51251e+00 5.02474e+01  0.00000e+00 0.00000e+00 2.48259e+02 91.724  1.31042e+01 271.724 0.9900 
1 1 1 -13 59  6  o 7  4.56114e+00 1.20989e+00 5.16481e+01 347.709 2.75081e+00  -5.99327e-01 0.00000e+00 0.00000e+00 8.52088e+01 347.709 3.35607e+01 347.709 0.7953 
1 1 1 -13 59  7  o 16 5.90266e+00 1.16557e+00 1.10937e+02 51.512  5.29659e+00  6.66158e+00  0.00000e+00 0.00000e+00 9.80285e+01 51.512  1.29080e+01 231.512 0.9393 
1 1 1 -13 59  8  o 1  6.31866e+00 1.22922e+00 1.07914e+02 79.558  1.70380e+00  9.24550e+00  0.00000e+00 0.00000e+00 1.16974e+02 79.558  9.06011e+00 79.558  0.9452 
1 1 1 -13 59  9  o 18 7.23276e+00 1.24218e+00 1.24095e+02 228.758 -8.13314e+00 -9.27657e+00 0.00000e+00 0.00000e+00 1.36692e+02 228.758 1.25973e+01 228.758 0.9586 
1 1 1 -13 59  10 o 18 5.84899e+00 1.23971e+00 1.48913e+02 189.800 -1.24551e+01 -2.15143e+00 0.00000e+00 0.00000e+00 6.19701e+01 189.800 8.69428e+01 9.800   0.9596 
1 1 1 -13 59  11 o 5  9.26111e+00 1.24381e+00 2.06633e+02 70.874  9.52995e+00  2.74799e+01  0.00000e+00 0.00000e+00 1.34901e+02 70.874  7.17322e+01 250.874 0.9827 
1 1 1 -13 59  12 o 5  6.11329e+00 1.39228e+00 1.13425e+02 186.833 -1.06214e+01 -1.27278e+00 0.00000e+00 0.00000e+00 1.04733e+02 186.833 8.69223e+00 6.833   0.9520 
1 1 1 -13 59  13 o 2  4.98891e+00 1.33943e+00 5.98552e+01 34.721  4.10232e+00  2.84285e+00  0.00000e+00 0.00000e+00 1.06954e+02 34.721  4.70987e+01 34.721  0.8932 
1 1 1 -13 60  1  o 18 3.83649e+00 1.05079e+00 8.72522e+01 351.684 4.03793e+00  -5.90225e-01 0.00000e+00 0.00000e+00 3.86112e+01 351.684 4.86411e+01 171.684 0.8666 
1 1 1 -13 60  2  o 6  1.46652e+01 7.96017e-01 2.73294e+02 116.700 -2.45991e+01 4.89109e+01  0.00000e+00 0.00000e+00 2.76479e+02 116.700 3.18485e+00 116.700 0.9908 
1 1 1 -13 60  3  o 11 5.22744e+00 1.35819e+00 7.36842e+01 194.661 -4.26156e+00 -1.11491e+00 0.00000e+00 0.00000e+00 9.97468e+01 194.661 2.60626e+01 194.661 0.8775 
1 1 1 -13 60  4  o 12 4.72775e+00 1.30016e+00 5.99446e+01 236.887 -1.80451e+00 -2.76680e+00 0.00000e+00 0.00000e+00 8.83356e+01 236.887 2.83911e+01 236.887 0.8301 
1 1 1 -13 60  5  f 0  6.58526e+00 1.16402e+00 1.12865e+02 280.871 1.75972e+00  -9.16305e+00 0.00000e+00 0.00000e+00 1.22014e+02 280.871 9.14910e+00 280.871 0.9448 
1 1 1 -13 60  6  o 11 3.80979e+00 1.09458e+00 6.11129e+01 187.789 -3.23870e+00 -4.43031e-01 0.00000e+00 0.00000e+00 5.78807e+01 187.789 3.23215e+00 7.789   0.8281 
1 1 1 -13 60  7  o 14 4.96779e+00 1.17282e+00 9.64630e+01 333.518 5.90460e+00  -2.94165e+00 0.00000e+00 0.00000e+00 7.59072e+01 333.518 2.05558e+01 153.518 0.9207 
1 1 1 -13 60  8  f 0  5.22605e+00 1.22892e+00 7.86884e+01 74.882  1.53101e+00  5.66701e+00  0.00000e+00 0.00000e+00 1.00410e+02 74.882  2.17220e+01 74.882  0.9103 
1 1 1 -13 60  9  o 18 4.40420e+00 1.20128e+00 8.24066e+01 359.667 5.34337e+00  -3.10877e-02 0.00000e+00 0.00000e+00 6.67943e+01 359.667 1.56123e+01 179.667 0.9008 
1 1 1 -13 60  10 o 12 4.73247e+00 1.21327e+00 8.02739e+01 131.020 -3.86935e+00 4.44800e+00  0.00000e+00 0.00000e+00 8.16348e+01 131.020 1.36091e+00 131.020 0.9107 
1 1 1 -13 60  11 f 0  4.77435e+00 1.14121e+00 3.68031e+01 13.603  2.94399e+00  7.12397e-01  0.00000e+00 0.00000e+00 1.08684e+02 13.603  7.18810e+01 13.603  0.8121 
1 1 1 -13 60  12 o 6  4.40252e+00 1.27893e+00 4.37255e+01 23.047  3.13763e+00  1.33489e+00  0.00000e+00 0.00000e+00 9.42504e+01 23.047  5.05248e+01 23.047  0.8362 
1 1 1 -13 60  13 o 9  3.77830e+00 1.17728e+00 4.50189e+01 94.532  -2.63120e-01 3.31970e+00  0.00000e+00 0.00000e+00 7.25998e+01 94.532  2.75808e+01 94.532  0.8317 
1 1 1 -13 61  1  o 18 3.86035e+00 1.11776e+00 3.47051e+01 23.548  1.61306e+00  7.02990e-01  0.00000e+00 0.00000e+00 6.08703e+01 23.548  2.61652e+01 23.548  0.6541 
1 1 1 -13 61  2  o 9  8.14206e+00 1.06161e+00 1.93374e+02 136.646 -1.54969e+01 1.46311e+01  0.00000e+00 0.00000e+00 1.07319e+02 136.646 8.60544e+01 316.646 0.9763 
1 1 1 -13 61  3  o 8  6.76046e+00 1.20197e+00 1.46776e+02 337.075 1.12726e+01  -4.76761e+00 0.00000e+00 0.00000e+00 9.81202e+01 337.075 4.86555e+01 157.075 0.9582 
1 1 1 -13 61  4  o 1  4.94428e+00 1.33851e+00 1.78056e+02 192.053 -9.79920e+00 -2.09243e+00 0.00000e+00 0.00000e+00 8.62603e-01 12.053  1.78919e+02 12.053  0.9487 
1 1 1 -13 61  5  o 12 3.08796e+00 1.02665e+00 3.32241e+01 357.374 1.43531e+00  -6.58263e-02 0.00000e+00 0.00000e+00 3.43930e+01 357.374 1.16882e+00 357.374 0.5801 
1 1 1 -13 61  6  o 19 7.39335e+00 1.19607e+00 1.55862e+02 109.206 -5.09828e+00 1.46354e+01  0.00000e+00 0.00000e+00 1.13813e+02 109.206 4.20486e+01 289.206 0.9672 
1 1 1 -13 61  7  o 16 8.99485e+00 1.16067e+00 1.47871e+02 11.905  1.83565e+01  3.87010e+00  0.00000e+00 0.00000e+00 1.81880e+02 11.905  3.40096e+01 11.905  0.9730 
1 1 1 -13 61  8  o 9  3.54270e+00 1.06190e+00 7.37539e+01 320.478 3.10055e+00  -2.55792e+00 0.00000e+00 0.00000e+00 4.14980e+01 320.478 3.22559e+01 140.478 0.8643 
1 1 1 -13 61  9  o 10 3.74913e+00 1.11957e+00 4.20297e+01 67.519  9.11692e-01  2.20304e+00  0.00000e+00 0.00000e+00 6.39550e+01 67.519  2.19252e+01 67.519  0.7518 
1 1 1 -13 61  10 o 12 2.98957e+00 9.93022e-01 4.91324e+01 41.468  1.97320e+00  1.74378e+00  0.00000e+00 0.00000e+00 3.83136e+01 41.468  1.08188e+01 221.468 0.7788 
1 1 1 -13 61  11 o 8  3.14312e+00 1.03125e+00 1.08258e+02 94.863  -5.40993e-01 6.35854e+00  0.00000e+00 0.00000e+00 1.86325e-02 274.863 1.08277e+02 274.863 0.9179 
1 1 1 -13 61  12 o 11 4.34353e+00 1.22644e+00 6.24517e+01 145.823 -4.16410e+00 2.82747e+00  0.00000e+00 0.00000e+00 8.30764e+01 145.823 2.06246e+01 145.823 0.8942 
1 1 1 -13 62  1  o 3  7.62177e+00 1.20017e+00 1.43950e+02 64.226  5.85901e+00  1.21341e+01  0.00000e+00 0.00000e+00 1.33585e+02 64.226  1.03654e+01 244.226 0.9621 
1 1 1 -13 62  2  o 3  7.39758e+00 1.13219e+00 1.81617e+02 131.320 -1.13711e+01 1.29345e+01  0.00000e+00 0.00000e+00 8.99321e+01 131.320 9.16845e+01 311.320 0.9705 
1 1 1 -13 62  3  o 2  6.31392e+00 1.15333e+00 8.37795e+01 310.743 4.34214e+00  -5.04057e+00 0.00000e+00 0.00000e+00 1.36121e+02 310.743 5.23413e+01 310.743 0.9214 
1 1 1 -13 62  4  o 2  7.16040e+00 1.35817e+00 1.03518e+02 269.493 -7.37609e-02 -8.33532e+00 0.00000e+00 0.00000e+00 1.50143e+02 269.493 4.66251e+01 269.493 0.9379 
1 1 1 -13 62  5  o 14 5.11410e+00 1.33732e+00 1.58777e+02 151.829 -8.69857e+00 4.65847e+00  0.00000e+00 0.00000e+00 2.41673e+01 151.829 1.34610e+02 331.829 0.9479 
1 1 1 -13 62  6  o 1  7.21744e+00 1.27371e+00 1.42341e+02 47.768  8.42955e+00  9.28604e+00  0.00000e+00 0.00000e+00 1.18719e+02 47.768  2.36219e+01 227.768 0.9593 
1 1 1 -13 62  7  o 18 9.33558e+00 1.11761e+00 2.12626e+02 304.096 1.53463e+01  -2.26699e+01 0.00000e+00 0.00000e+00 1.32580e+02 304.096 8.00452e+01 124.096 0.9816 
1 1 1 -13 62  8  o 17 9.39590e+00 1.06554e+00 1.63016e+02 105.377 -5.83847e+00 2.12303e+01  0.00000e+00 0.00000e+00 1.82474e+02 105.377 1.94584e+01 105.377 0.9770 
1 1 1 -13 62  9  o 13 6.37880e+00 1.32483e+00 1.47578e+02 320.252 9.70502e+00  -8.07108e+00 0.00000e+00 0.00000e+00 8.25337e+01 320.252 6.50440e+01 140.252 0.9595 
1 1 1 -13 62  10 o 5  3.74773e+00 1.12925e+00 5.05813e+01 122.539 -1.76946e+00 2.77331e+00  0.00000e+00 0.00000e+00 6.61395e+01 122.539 1.55582e+01 122.539 0.8293 
1 1 1 -13 62  11 o 11 4.09817e+00 1.21028e+00 1.34418e+02 320.187 6.89739e+00  -5.74937e+00 0.00000e+00 0.00000e+00 1.04755e+01 320.187 1.23943e+02 140.187 0.9426 
1 1 1 -13 62  12 o 10 3.99304e+00 1.17284e+00 5.11779e+01 135.716 -2.81489e+00 2.74541e+00  0.00000e+00 0.00000e+00 7.76044e+01 135.716 2.64264e+01 135.716 0.8609 
1 1 1 -13 63  1  o 8  5.26077e+00 1.20342e+00 1.44892e+02 30.086  8.07360e+00  4.67749e+00  0.00000e+00 0.00000e+00 4.31833e+01 30.086  1.01709e+02 210.086 0.9448 
1 1 1 -13 63  2  o 13 6.51684e+00 1.16329e+00 6.86638e+01 327.536 4.72146e+00  -3.00378e+00 0.00000e+00 0.00000e+00 1.54512e+02 327.536 8.58480e+01 327.536 0.9056 
1 1 1 -13 63  3  o 1  8.01308e+00 1.10846e+00 9.85006e+01 101.818 -2.09415e+00 1.00080e+01  0.00000e+00 0.00000e+00 1.89107e+02 101.818 9.06065e+01 101.818 0.9498 
1 1 1 -13 63  4  o 2  4.48089e+00 1.24660e+00 5.67231e+01 161.120 -2.81945e+00 9.64213e-01  0.00000e+00 0.00000e+00 8.00806e+01 161.120 2.33575e+01 161.120 0.8085 
1 1 1 -13 63  5  o 9  1.05044e+01 1.34602e+00 8.78200e+01 85.674  7.92933e-01  1.04833e+01  0.00000e+00 0.00000e+00 2.89189e+02 85.674  2.01369e+02 85.674  0.9512 
1 1 1 -13 63  6  o 16 7.71139e+00 1.17517e+00 1.42989e+02 253.477 -4.30996e+00 -1.45292e+01 0.00000e+00 0.00000e+00 1.37971e+02 253.477 5.01805e+00 73.477  0.9664 
1 1 1 -13 63  7  o 11 6.65899e+00 1.25100e+00 1.81354e+02 291.603 6.25988e+00  -1.58082e+01 0.00000e+00 0.00000e+00 6.19693e+01 291.603 1.19385e+02 111.603 0.9701 
1 1 1 -13 63  8  o 17 3.81592e+00 1.12263e+00 5.68906e+01 36.143  2.59973e+00  1.89873e+00  0.00000e+00 0.00000e+00 6.15657e+01 36.143  4.67514e+00 36.143  0.8250 
1 1 1 -13 63  9  o 11 4.81993e+00 1.22436e+00 1.14080e+02 345.739 7.82412e+00  -1.98866e+00 0.00000e+00 0.00000e+00 5.54744e+01 345.739 5.86058e+01 165.739 0.9358 
1 1 1 -13 63  10 o 14 3.69648e+00 1.11352e+00 4.40242e+01 295.852 1.19168e+00  -2.45937e+00 0.00000e+00 0.00000e+00 6.53629e+01 295.852 2.13387e+01 295.852 0.7881 
1 1 1 -13 63  11 o 15 6.45671e+00 1.32474e+00 1.01820e+02 123.543 -5.65972e+00 8.53697e+00  0.00000e+00 0.00000e+00 1.28190e+02 123.543 2.63699e+01 123.543 0.9499 
1 1 1 -13 63  12 o 8  4.56376e+00 1.27591e+00 3.71401e+01 264.649 -2.76342e-01 -2.95063e+00 0.00000e+00 0.00000e+00 1.00860e+02 264.649 6.37200e+01 264.649 0.8073 
1 1 1 -13 64  1  o 11 9.49333e+00 1.02357e+00 1.64324e+02 272.316 8.53325e-01  -2.11021e+01 0.00000e+00 0.00000e+00 1.86229e+02 272.316 2.19045e+01 272.316 0.9760 
1 1 1 -13 64  2  o 5  1.23113e+01 8.76046e-01 1.88837e+02 58.683  1.76379e+01  2.89904e+01  0.00000e+00 0.00000e+00 2.69741e+02 58.683  8.09036e+01 58.683  0.9852 
1 1 1 -13 64  3  o 11 1.55414e+01 8.02566e-01 2.50206e+02 157.756 -5.65882e+01 2.31438e+01  0.00000e+00 0.00000e+00 3.32189e+02 157.756 8.19826e+01 157.756 0.9918 
1 1 1 -13 64  4  o 5  9.98356e+00 1.21650e+00 1.76385e+02 311.139 1.51461e+01  -1.73385e+01 0.00000e+00 0.00000e+00 1.92278e+02 311.139 1.58921e+01 311.139 0.9780 
1 1 1 -13 64  5  o 18 6.02103e+00 1.44375e+00 5.90128e+01 223.561 -2.84311e+00 -2.70381e+00 0.00000e+00 0.00000e+00 1.36453e+02 223.561 7.74406e+01 223.561 0.8605 
1 1 1 -13 64  6  o 14 4.50845e+00 1.22624e+00 6.43299e+01 298.893 1.89718e+00  -3.43778e+00 0.00000e+00 0.00000e+00 8.19271e+01 298.893 1.75971e+01 298.893 0.8606 
1 1 1 -13 64  7  o 9  5.09829e+00 1.28846e+00 3.91349e+01 253.341 -7.49673e-01 -2.50537e+00 0.00000e+00 0.00000e+00 1.10039e+02 253.341 7.09040e+01 253.341 0.7770 
1 1 1 -13 64  8  o 7  1.05847e+01 9.83064e-01 1.60161e+02 15.595  2.76912e+01  7.72896e+00  0.00000e+00 0.00000e+00 2.31071e+02 15.595  7.09106e+01 15.595  0.9825 
1 1 1 -13 64  9  o 1  6.42793e+00 1.22973e+00 1.35333e+02 227.408 -8.71088e+00 -9.47569e+00 0.00000e+00 0.00000e+00 9.66633e+01 227.408 3.86701e+01 47.408  0.9603 
1 1 1 -13 64  10 o 9  7.00044e+00 1.26570e+00 1.22718e+02 111.086 -4.89602e+00 1.26976e+01  0.00000e+00 0.00000e+00 1.30239e+02 111.086 7.52118e+00 111.086 0.9625 
1 1 1 -13 64  11 o 19 3.16737e+00 1.04702e+00 9.53900e+01 309.309 3.90780e+00  -4.77290e+00 0.00000e+00 0.00000e+00 1.32717e+01 309.309 8.21183e+01 129.309 0.9149 
1 1 1 -13 64  12 o 10 2.99247e+00 1.00106e+00 9.27078e+01 111.863 -2.25070e+00 5.60916e+00  0.00000e+00 0.00000e+00 9.61877e+00 111.863 8.30890e+01 291.863 0.9130 
1 1 1 -13 65  1  o 9  7.83242e+00 1.06890e+00 1.34143e+02 240.380 -7.11624e+00 -1.25168e+01 0.00000e+00 0.00000e+00 1.51648e+02 240.380 1.75043e+01 240.380 0.9646 
1 1 1 -13 65  2  o 17 1.28451e+01 8.75950e-01 1.70238e+02 107.773 -1.01212e+01 3.15753e+01  0.00000e+00 0.00000e+00 3.07969e+02 107.773 1.37731e+02 107.773 0.9848 
1 1 1 -13 65  3  o 12 6.03911e+00 1.16122e+00 9.03121e+01 52.153  4.52520e+00  5.82398e+00  0.00000e+00 0.00000e+00 1.21746e+02 52.153  3.14344e+01 52.153  0.9295 
1 1 1 -13 65  4  o 5  6.29290e+00 1.14381e+00 1.26492e+02 142.741 -8.79857e+00 6.69271e+00  0.00000e+00 0.00000e+00 1.00050e+02 142.741 2.64419e+01 322.741 0.9536 
1 1 1 -13 65  5  o 12 5.36520e+00 1.34495e+00 6.43803e+01 284.082 1.04225e+00  -4.15501e+00 0.00000e+00 0.00000e+00 1.12414e+02 284.082 4.80341e+01 284.082 0.8736 
1 1 1 -13 65  6  o 14 4.38117e+00 1.21004e+00 1.31057e+02 112.740 -3.10016e+00 7.39682e+00  0.00000e+00 0.00000e+00 2.33914e+01 112.740 1.07665e+02 292.740 0.9354 
1 1 1 -13 65  7  o 5  3.06387e+00 1.00399e+00 7.23623e+01 245.608 -1.36486e+00 -3.00992e+00 0.00000e+00 0.00000e+00 2.34140e+01 245.608 4.89483e+01 65.608  0.8302 
1 1 1 -13 65  8  o 4  2.77085e+00 9.22594e-01 5.96888e+01 339.551 2.64674e+00  -9.86914e-01 0.00000e+00 0.00000e+00 2.32909e+01 339.551 3.63979e+01 159.551 0.7961 
1 1 1 -13 65  9  o 13 3.51896e+00 1.08724e+00 7.96361e+01 218.464 -3.69392e+00 -2.93452e+00 0.00000e+00 0.00000e+00 3.75711e+01 218.464 4.20650e+01 38.464  0.8864 
1 1 1 -13 65  10 o 9  2.67027e+00 9.06893e-01 3.40575e+01 181.272 -1.85484e+00 -4.11909e-02 0.00000e+00 0.00000e+00 3.33477e+01 181.272 7.09775e-01 1.272   0.6725 
1 1 1 -13 65  11 o 18 3.10316e+00 1.01714e+00 9.17770e+01 52.163  3.73481e+00  4.80850e+00  0.00000e+00 0.00000e+00 1.45247e+01 52.163  7.72523e+01 232.163 0.9137 
1 1 1 -13 65  12 o 8  3.03890e+00 1.01530e+00 6.24937e+01 294.194 1.70875e+00  -3.80315e+00 0.00000e+00 0.00000e+00 3.64746e+01 294.194 2.60192e+01 114.194 0.8697 
1 1 1 -13 66  1  o 7  8.15407e+00 1.09156e+00 1.46440e+02 176.109 -1.67922e+01 1.14213e+00  0.00000e+00 0.00000e+00 1.52637e+02 176.109 6.19694e+00 176.109 0.9698 
1 1 1 -13 66  2  o 13 5.13041e+00 1.11263e+00 9.57830e+01 26.869  6.09783e+00  3.08948e+00  0.00000e+00 0.00000e+00 8.33227e+01 26.869  1.24604e+01 206.869 0.9237 
1 1 1 -13 66  3  o 19 1.03643e+01 9.36331e-01 1.54980e+02 298.019 1.07707e+01  -2.02409e+01 0.00000e+00 0.00000e+00 2.27852e+02 298.019 7.28718e+01 298.019 0.9779 
1 1 1 -13 66  4  o 3  7.48367e+00 1.06962e+00 8.68657e+01 2.174   8.91606e+00  3.38421e-01  0.00000e+00 0.00000e+00 1.79256e+02 2.174   9.23906e+01 2.174   0.9422 
1 1 1 -13 66  5  o 19 4.40494e+00 1.27150e+00 1.07669e+02 285.479 1.66662e+00  -6.01804e+00 0.00000e+00 0.00000e+00 4.44991e+01 285.479 6.31696e+01 105.479 0.9160 
1 1 1 -13 66  6  o 16 4.11780e+00 1.23186e+00 7.53252e+01 99.103  -6.99451e-01 4.36528e+00  0.00000e+00 0.00000e+00 6.08990e+01 99.103  1.44262e+01 279.103 0.8780 
1 1 1 -13 66  7  o 19 1.59307e+01 9.26011e-01 2.67138e+02 212.982 -6.04613e+01 -3.92370e+01 0.00000e+00 0.00000e+00 3.28408e+02 212.982 6.12697e+01 212.982 0.9930 
1 1 1 -13 66  8  o 8  6.58778e+00 1.29504e+00 1.49644e+02 8.362   1.33333e+01  1.95973e+00  0.00000e+00 0.00000e+00 8.87363e+01 8.362   6.09075e+01 188.361 0.9622 
1 1 1 -13 66  9  o 1  4.82480e+00 1.24103e+00 1.38303e+02 156.561 -9.40527e+00 4.07759e+00  0.00000e+00 0.00000e+00 3.38799e+01 156.561 1.04423e+02 336.561 0.9499 
1 1 1 -13 66  10 o 11 5.77822e+00 1.20565e+00 8.86163e+01 350.619 8.20249e+00  -1.35506e+00 0.00000e+00 0.00000e+00 1.14735e+02 350.619 2.61191e+01 350.619 0.9378 
1 1 1 -13 66  11 o 12 4.18845e+00 1.21301e+00 9.53583e+01 76.825  1.70967e+00  7.30352e+00  0.00000e+00 0.00000e+00 5.07677e+01 76.825  4.45906e+01 256.825 0.9307 
1 1 1 -13 66  12 o 15 3.45833e+00 1.11186e+00 5.11978e+01 299.470 1.98729e+00  -3.51687e+00 0.00000e+00 0.00000e+00 6.08002e+01 299.470 9.60240e+00 299.470 0.8650 
1 1 1 -13 67  1  o 17 8.24917e+00 1.08923e+00 1.07583e+02 43.675  8.46154e+00  8.07886e+00  0.00000e+00 0.00000e+00 1.90696e+02 43.675  8.31131e+01 43.675  0.9563 
1 1 1 -13 67  2  f 0  3.92263e+00 1.07995e+00 2.44654e+01 82.420  1.82678e-01  1.37284e+00  0.00000e+00 0.00000e+00 5.94906e+01 82.420  3.50252e+01 82.420  0.5664 
1 1 1 -13 67  3  o 2  8.37198e+00 9.95160e-01 1.43699e+02 95.305  -1.59144e+00 1.71395e+01  0.00000e+00 0.00000e+00 1.63134e+02 95.305  1.94347e+01 95.305  0.9705 
1 1 1 -13 67  4  o 11 5.36627e+00 1.18896e+00 3.95036e+01 351.992 2.86178e+00  -4.02582e-01 0.00000e+00 0.00000e+00 1.22803e+02 351.992 8.32995e+01 351.992 0.8015 
1 1 1 -13 67  5  o 7  6.96366e+00 1.40720e+00 1.71640e+02 154.385 -1.24935e+01 5.98981e+00  0.00000e+00 0.00000e+00 8.12704e+01 154.385 9.03693e+01 334.385 0.9632 
1 1 1 -13 67  6  f 0  3.14906e+00 1.49172e+00 1.84179e+02 287.133 1.99477e+00  -6.47093e+00 0.00000e+00 0.00000e+00 7.46919e+01 107.133 2.58871e+02 107.133 0.9229 
1 1 1 -13 67  7  o 2  4.63888e+00 1.24848e+00 3.18104e+01 148.492 -1.79543e+00 1.10060e+00  0.00000e+00 0.00000e+00 9.29290e+01 148.492 6.11186e+01 148.492 0.7144 
1 1 1 -13 67  8  o 3  4.49421e+00 1.13334e+00 1.24537e+02 187.495 -8.65339e+00 -1.13843e+00 0.00000e+00 0.00000e+00 3.44551e+01 187.495 9.00822e+01 7.495   0.9408 
1 1 1 -13 67  9  o 11 4.80924e+00 1.27585e+00 1.45906e+02 171.851 -1.03994e+01 1.48915e+00  0.00000e+00 0.00000e+00 2.59161e+01 171.851 1.19990e+02 351.851 0.9511 
1 1 1 -13 67  10 o 14 1.31311e+01 9.84231e-01 2.33045e+02 80.774  9.41868e+00  5.79882e+01  0.00000e+00 0.00000e+00 2.55438e+02 80.774  2.23933e+01 80.774  0.9915 
1 1 1 -13 67  11 o 2  1.02992e+01 1.18303e+00 1.76863e+02 272.087 1.19049e+00  -3.26709e+01 0.00000e+00 0.00000e+00 2.03176e+02 272.087 2.63131e+01 272.087 0.9846 
1 1 1 -13 67  12 o 15 3.33729e+00 1.09334e+00 4.04941e+01 324.688 2.49891e+00  -1.77012e+00 0.00000e+00 0.00000e+00 6.12515e+01 324.688 2.07574e+01 324.688 0.8145 
1 1 1 -13 68  1  o 14 5.43427e+00 1.14687e+00 8.80468e+01 4.804   6.27430e+00  5.27274e-01  0.00000e+00 0.00000e+00 1.00292e+02 4.804   1.22453e+01 4.804   0.9167 
1 1 1 -13 68  2  o 19 7.70212e+00 1.07986e+00 1.25021e+02 235.518 -7.44293e+00 -1.08368e+01 0.00000e+00 0.00000e+00 1.54688e+02 235.518 2.96670e+01 235.518 0.9612 
1 1 1 -13 68  3  o 5  6.45305e+00 1.12015e+00 9.68282e+01 269.570 -6.68059e-02 -8.90480e+00 0.00000e+00 0.00000e+00 1.32701e+02 269.570 3.58728e+01 269.570 0.9421 
1 1 1 -13 68  4  o 2  2.91835e+00 9.22878e-01 5.44180e+01 2.210   2.57794e+00  9.94814e-02  0.00000e+00 0.00000e+00 3.07396e+01 2.210   2.36784e+01 182.210 0.7734 
1 1 1 -13 68  5  o 2  6.94417e+00 1.38409e+00 1.06563e+02 288.267 2.98768e+00  -9.05129e+00 0.00000e+00 0.00000e+00 1.41086e+02 288.267 3.45229e+01 288.267 0.9460 
1 1 1 -13 68  6  o 13 3.52825e+00 1.12762e+00 3.48041e+01 92.215  -6.58165e-02 1.70152e+00  0.00000e+00 0.00000e+00 5.05710e+01 92.215  1.57669e+01 92.215  0.6424 
1 1 1 -13 68  7  f 0  5.88838e+00 1.32947e+00 9.41047e+01 143.967 -5.91561e+00 4.30311e+00  0.00000e+00 0.00000e+00 1.11729e+02 143.967 1.76238e+01 143.967 0.9289 
1 1 1 -13 68  8  o 7  4.41595e+00 1.24605e+00 6.56375e+01 134.953 -3.10560e+00 3.11067e+00  0.00000e+00 0.00000e+00 7.99890e+01 134.953 1.43515e+01 134.953 0.8772 
1 1 1 -13 68  9  o 7  1.00027e+01 1.06778e+00 1.72648e+02 57.125  1.61256e+01  2.49500e+01  0.00000e+00 0.00000e+00 1.96633e+02 57.125  2.39851e+01 57.125  0.9830 
1 1 1 -13 68  10 o 4  4.31025e+00 1.19704e+00 9.98084e+01 301.554 3.87439e+00  -6.30914e+00 0.00000e+00 0.00000e+00 5.05332e+01 301.554 4.92752e+01 121.554 0.9298 
1 1 1 -13 68  11 o 6  5.07861e+00 1.28845e+00 9.84910e+01 341.442 8.20682e+00  -2.75519e+00 0.00000e+00 0.00000e+00 8.04526e+01 341.442 1.80384e+01 161.442 0.9403 
1 1 1 -13 68  12 o 18 3.66455e+00 1.08165e+00 4.62536e+01 287.783 1.16241e+00  -3.62421e+00 0.00000e+00 0.00000e+00 7.10906e+01 287.783 2.48370e+01 287.783 0.8556 
1 1 1 -13 69  1  o 14 4.84638e+00 1.16781e+00 1.18265e+02 227.045 -5.40948e+00 -5.81012e+00 0.00000e+00 0.00000e+00 5.29619e+01 227.045 6.53027e+01 47.045  0.9347 
1 1 1 -13 69  2  o 13 9.29913e+00 9.66658e-01 1.32022e+02 296.908 8.64212e+00  -1.70290e+01 0.00000e+00 0.00000e+00 2.09930e+02 296.908 7.79075e+01 296.908 0.9735 
1 1 1 -13 69  3  f 0  4.51563e+00 1.06035e+00 1.37682e+02 21.281  8.69137e+00  3.38539e+00  0.00000e+00 0.00000e+00 2.33669e+01 21.281  1.14315e+02 201.281 0.9448 
1 1 1 -13 69  4  o 1  3.37027e+00 1.02677e+00 9.17564e+01 75.464  1.21524e+00  4.68700e+00  0.00000e+00 0.00000e+00 2.13390e+01 75.464  7.04174e+01 255.464 0.8896 
1 1 1 -13 69  5  o 10 3.11416e+00 9.86491e-01 6.18323e+01 291.510 1.13824e+00  -2.88805e+00 0.00000e+00 0.00000e+00 3.41134e+01 291.510 2.77189e+01 111.510 0.8174 
1 1 1 -13 69  6  o 6  5.25906e+00 1.33183e+00 1.05811e+02 103.729 -1.71278e+00 7.01049e+00  0.00000e+00 0.00000e+00 7.79576e+01 103.729 2.78533e+01 283.729 0.9279 
1 1 1 -13 69  7  o 9  8.61651e+00 1.14105e+00 1.51128e+02 303.735 1.09459e+01  -1.63908e+01 0.00000e+00 0.00000e+00 1.64731e+02 303.735 1.36025e+01 303.735 0.9743 
1 1 1 -13 69  8  o 18 1.06017e+01 1.16679e+00 2.69803e+02 132.662 -3.08494e+01 3.34753e+01  0.00000e+00 0.00000e+00 1.24289e+02 132.662 1.45514e+02 312.662 0.9890 
1 1 1 -13 69  9  o 6  3.93565e+00 1.15073e+00 7.46774e+01 9.681   4.95922e+00  8.45964e-01  0.00000e+00 0.00000e+00 5.74498e+01 9.681   1.72276e+01 189.681 0.8941 
1 1 1 -13 69  10 o 14 3.65706e+00 1.13131e+00 9.26528e+01 284.588 1.62644e+00  -6.24935e+00 0.00000e+00 0.00000e+00 3.33926e+01 284.588 5.92602e+01 104.588 0.9189 
1 1 1 -13 69  11 o 4  4.01551e+00 1.20164e+00 7.59293e+01 82.231  7.60873e-01  5.57713e+00  0.00000e+00 0.00000e+00 6.03912e+01 82.231  1.55381e+01 262.231 0.9062 
1 1 1 -13 69  12 o 11 4.35754e+00 1.16458e+00 7.85973e+01 227.799 -4.99839e+00 -5.51228e+00 0.00000e+00 0.00000e+00 7.30622e+01 227.799 5.53508e+00 47.799  0.9302 
1 1 1 -13 70  1  o 17 4.68487e+00 1.17960e+00 1.00587e+02 236.230 -3.65456e+00 -5.46532e+00 0.00000e+00 0.00000e+00 6.23773e+01 236.230 3.82094e+01 56.230  0.9205 
1 1 1 -13 70  2  o 16 1.11068e+01 9.02983e-01 1.69601e+02 300.038 1.54954e+01  -2.67982e+01 0.00000e+00 0.00000e+00 2.43048e+02 300.038 7.34468e+01 300.038 0.9837 
1 1 1 -13 70  3  o 12 6.48004e+00 1.08692e+00 1.71007e+02 111.699 -6.18747e+00 1.55492e+01  0.00000e+00 0.00000e+00 6.61429e+01 111.699 1.04864e+02 291.699 0.9696 
1 1 1 -13 70  4  o 17 8.07219e+00 1.08715e+00 1.33941e+02 329.907 1.39278e+01  -8.07134e+00 0.00000e+00 0.00000e+00 1.60886e+02 329.907 2.69459e+01 329.907 0.9684 
1 1 1 -13 70  5  o 14 4.97732e+00 1.16157e+00 7.40052e+01 173.229 -4.97392e+00 5.90521e-01  0.00000e+00 0.00000e+00 9.36035e+01 173.229 1.95983e+01 173.229 0.8936 
1 1 1 -13 70  6  o 14 7.53433e+00 1.48123e+00 1.06754e+02 308.664 5.77268e+00  -7.21485e+00 0.00000e+00 0.00000e+00 1.61109e+02 308.664 5.43549e+01 308.664 0.9442 
1 1 1 -13 70  7  o 1  8.00476e+00 1.51753e+00 1.12999e+02 45.507  7.61326e+00  7.74916e+00  0.00000e+00 0.00000e+00 1.73907e+02 45.507  6.09082e+01 45.507  0.9528 
1 1 1 -13 70  8  o 19 2.78022e+00 9.40291e-01 4.93940e+01 194.248 -2.64607e+00 -6.71926e-01 0.00000e+00 0.00000e+00 3.29239e+01 194.248 1.64701e+01 14.248  0.7879 
1 1 1 -13 70  9  o 14 5.91964e+00 1.29815e+00 1.00446e+02 16.038  8.66729e+00  2.49149e+00  0.00000e+00 0.00000e+00 1.09076e+02 16.038  8.63051e+00 16.038  0.9428 
1 1 1 -13 70  10 o 13 4.91487e+00 1.25308e+00 9.00767e+01 255.198 -2.04719e+00 -7.74738e+00 0.00000e+00 0.00000e+00 8.23148e+01 255.198 7.76193e+00 75.198  0.9353 
1 1 1 -13 70  11 o 12 2.99822e+00 1.00220e+00 5.23811e+01 41.060  2.62836e+00  2.28964e+00  0.00000e+00 0.00000e+00 4.19929e+01 41.060  1.03882e+01 221.060 0.8404 
1 1 1 -13 70  12 o 3  3.86686e+00 1.14451e+00 2.52702e+01 259.431 -4.15041e-01 -2.22446e+00 0.00000e+00 0.00000e+00 8.12789e+01 259.431 5.60087e+01 259.431 0.7365 
1 1 1 -13 71  1  o 15 3.59592e+00 1.05882e+00 7.82409e+01 156.212 -3.95734e+00 1.74443e+00  0.00000e+00 0.00000e+00 4.06363e+01 156.212 3.76047e+01 336.212 0.8749 
1 1 1 -13 71  2  o 13 4.35801e+00 1.13458e+00 6.02492e+01 253.403 -1.09869e+00 -3.68625e+00 0.00000e+00 0.00000e+00 8.08378e+01 253.403 2.05886e+01 253.403 0.8573 
1 1 1 -13 71  3  o 8  3.92315e+00 1.08499e+00 6.09207e+01 349.653 3.68978e+00  -6.73693e-01 0.00000e+00 0.00000e+00 6.53886e+01 349.653 4.46796e+00 349.653 0.8532 
1 1 1 -13 71  4  o 16 5.62426e+00 1.18237e+00 1.26905e+02 325.195 8.36070e+00  -5.81197e+00 0.00000e+00 0.00000e+00 7.44711e+01 325.195 5.24343e+01 145.195 0.9495 
1 1 1 -13 71  5  o 11 6.18499e+00 1.18881e+00 1.11200e+02 194.875 -9.45586e+00 -2.51166e+00 0.00000e+00 0.00000e+00 1.09582e+02 194.875 1.61807e+00 14.875  0.9474 
1 1 1 -13 71  6  o 10 1.16728e+01 1.27908e+00 2.34378e+02 359.476 3.72900e+01  -3.40887e-01 0.00000e+00 0.00000e+00 1.99110e+02 359.476 3.52674e+01 179.476 0.9865 
1 1 1 -13 71  7  o 8  8.99209e+00 1.41647e+00 1.39198e+02 187.752 -1.66544e+01 -2.26727e+00 0.00000e+00 0.00000e+00 1.88776e+02 187.752 4.95781e+01 187.752 0.9698 
1 1 1 -13 71  8  o 3  6.00109e+00 1.35070e+00 1.27883e+02 61.708  5.13064e+00  9.53199e+00  0.00000e+00 0.00000e+00 8.69165e+01 61.708  4.09661e+01 241.708 0.9526 
1 1 1 -13 71  9  o 15 6.09060e+00 1.36819e+00 1.15341e+02 120.668 -5.18973e+00 8.75163e+00  0.00000e+00 0.00000e+00 1.01722e+02 120.668 1.36188e+01 300.668 0.9495 
1 1 1 -13 71  10 o 4  4.61128e+00 1.24202e+00 7.36513e+01 51.195  3.64849e+00  4.53703e+00  0.00000e+00 0.00000e+00 8.35921e+01 51.195  9.94080e+00 51.195  0.9095 
1 1 1 -13 71  11 f 0  7.69617e+00 1.40985e+00 1.82842e+02 256.822 -5.53953e+00 -2.36597e+01 0.00000e+00 0.00000e+00 9.93777e+01 256.822 8.34647e+01 76.822  0.9792 
1 1 1 -13 71  12 o 8  4.67795e+00 1.23605e+00 5.62353e+01 35.837  4.53834e+00  3.27766e+00  0.00000e+00 0.00000e+00 1.02222e+02 35.837  4.59866e+01 35.837  0.9056 
1 1 1 -13 72  1  o 2  4.06212e+00 1.11845e+00 9.56616e+01 20.240  5.60092e+00  2.06520e+00  0.00000e+00 0.00000e+00 4.42698e+01 20.240  5.13918e+01 200.240 0.9119 
1 1 1 -13 72  2  o 14 4.74196e+00 1.10690e+00 1.04071e+02 227.544 -4.90016e+00 -5.35586e+00 0.00000e+00 0.00000e+00 6.21212e+01 227.544 4.19499e+01 47.544  0.9283 
1 1 1 -13 72  3  o 1  8.20098e+00 1.09685e+00 1.50303e+02 60.675  9.09428e+00  1.61895e+01  0.00000e+00 0.00000e+00 1.50652e+02 60.675  3.49749e-01 60.675  0.9727 
1 1 1 -13 72  4  o 6  7.27667e+00 1.10044e+00 1.09801e+02 166.969 -1.18657e+01 2.74610e+00  0.00000e+00 0.00000e+00 1.53015e+02 166.969 4.32142e+01 166.969 0.9580 
1 1 1 -13 72  5  o 11 6.56622e+00 1.04739e+00 5.97800e+01 340.922 5.58941e+00  -1.93315e+00 0.00000e+00 0.00000e+00 1.65556e+02 340.922 1.05776e+02 340.922 0.9110 
1 1 1 -13 72  6  o 10 5.19317e+00 1.35790e+00 6.23913e+01 289.643 1.44411e+00  -4.04580e+00 0.00000e+00 0.00000e+00 1.08440e+02 289.643 4.60486e+01 289.643 0.8740 
1 1 1 -13 72  7  o 8  1.24783e+01 1.18496e+00 1.56452e+02 301.852 1.61890e+01  -2.60576e+01 0.00000e+00 0.00000e+00 3.05056e+02 301.852 1.48604e+02 301.852 0.9836 
1 1 1 -13 72  8  o 10 7.92753e+00 1.26067e+00 1.30568e+02 127.635 -1.00407e+01 1.30218e+01  0.00000e+00 0.00000e+00 1.58035e+02 127.635 2.74671e+01 127.635 0.9691 
1 1 1 -13 72  9  o 16 5.62094e+00 1.30280e+00 7.45905e+01 16.193  6.38293e+00  1.85351e+00  0.00000e+00 0.00000e+00 1.19757e+02 16.193  4.51670e+01 16.193  0.9214 
1 1 1 -13 72  10 o 11 8.36913e+00 1.25450e+00 2.05254e+02 260.894 -4.87785e+00 -3.04316e+01 0.00000e+00 0.00000e+00 1.03334e+02 260.894 1.01920e+02 80.894  0.9836 
1 1 1 -13 72  11 f 0  9.82711e+00 1.05622e+00 2.08463e+02 78.693  9.06575e+00  4.53408e+01  0.00000e+00 0.00000e+00 1.55480e+02 78.693  5.29828e+01 258.693 0.9891 
1 1 1 -13 72  12 o 14 4.84350e+00 1.27373e+00 9.25522e+01 302.934 4.89754e+00  -7.56047e+00 0.00000e+00 0.00000e+00 7.82034e+01 302.934 1.43488e+01 122.934 0.9427 
1 1 1 -13 73  1  o 4  4.91856e+00 1.17871e+00 7.86614e+01 168.053 -5.41646e+00 1.14603e+00  0.00000e+00 0.00000e+00 8.93663e+01 168.053 1.07049e+01 168.053 0.9045 
1 1 1 -13 73  2  o 8  3.89310e+00 1.08153e+00 7.44640e+01 231.638 -2.73431e+00 -3.45459e+00 0.00000e+00 0.00000e+00 5.44825e+01 231.638 1.99815e+01 51.638  0.8775 
1 1 1 -13 73  3  o 7  3.96158e+00 1.09022e+00 6.98073e+01 207.007 -3.78242e+00 -1.92785e+00 0.00000e+00 0.00000e+00 6.05478e+01 207.007 9.25944e+00 27.007  0.8723 
1 1 1 -13 73  4  o 17 3.53394e+00 1.05026e+00 9.33080e+00 241.929 -2.52613e-01 -4.73673e-01 0.00000e+00 0.00000e+00 2.51935e+01 241.929 1.58627e+01 241.929 0.2592 
1 1 1 -13 73  5  o 1  9.40544e+00 1.01201e+00 1.78603e+02 281.710 5.51426e+00  -2.66034e+01 0.00000e+00 0.00000e+00 1.69047e+02 281.710 9.55541e+00 101.710 0.9814 
1 1 1 -13 73  6  o 16 3.83041e+00 1.11024e+00 8.03191e+01 203.963 -4.51394e+00 -2.00628e+00 0.00000e+00 0.00000e+00 4.82474e+01 203.963 3.20717e+01 23.963  0.8920 
1 1 1 -13 73  7  o 14 5.38526e+00 1.44772e+00 1.20070e+02 48.845  5.82240e+00  6.66141e+00  0.00000e+00 0.00000e+00 7.05809e+01 48.845  4.94887e+01 228.845 0.9417 
1 1 1 -13 73  8  o 7  2.77152e+00 9.45246e-01 4.69897e+01 59.647  1.31417e+00  2.24418e+00  0.00000e+00 0.00000e+00 3.37371e+01 59.647  1.32526e+01 239.647 0.7755 
1 1 1 -13 73  9  o 5  3.75093e+00 1.17643e+00 4.19912e+01 36.748  2.36887e+00  1.76882e+00  0.00000e+00 0.00000e+00 7.15388e+01 36.748  2.95476e+01 36.748  0.8067 
1 1 1 -13 73  10 o 18 5.24545e+00 1.27217e+00 7.43988e+01 350.386 6.87844e+00  -1.16507e+00 0.00000e+00 0.00000e+00 1.07498e+02 350.386 3.30993e+01 350.386 0.9253 
1 1 1 -13 73  11 o 15 6.72422e+00 1.26369e+00 8.67111e+01 204.160 -1.01241e+01 -4.54155e+00 0.00000e+00 0.00000e+00 1.53380e+02 204.160 6.66684e+01 204.160 0.9538 
1 1 1 -13 73  12 o 17 2.61234e+00 8.84749e-01 4.83733e+01 94.848  -3.38151e-01 3.98724e+00  0.00000e+00 0.00000e+00 3.59738e+01 94.848  1.23995e+01 274.847 0.8636 
1 1 1 -13 74  1  o 6  5.50772e+00 1.23988e+00 9.50040e+01 84.443  7.06624e-01  7.26225e+00  0.00000e+00 0.00000e+00 9.81473e+01 84.443  3.14328e+00 84.443  0.9287 
1 1 1 -13 74  2  o 19 8.73873e+00 1.10139e+00 1.22763e+02 130.353 -1.05797e+01 1.24520e+01  0.00000e+00 0.00000e+00 1.96765e+02 130.353 7.40016e+01 130.353 0.9689 
1 1 1 -13 74  3  o 7  5.95499e+00 1.19236e+00 1.30883e+02 229.018 -7.25115e+00 -8.34690e+00 0.00000e+00 0.00000e+00 8.32860e+01 229.018 4.75971e+01 49.018  0.9536 
1 1 1 -13 74  4  o 18 9.90817e+00 9.63646e-01 1.40490e+02 64.703  9.39817e+00  1.98845e+01  0.00000e+00 0.00000e+00 2.24309e+02 64.703  8.38193e+01 64.703  0.9770 
1 1 1 -13 74  5  o 8  3.20068e+00 9.65967e-01 3.96650e+01 314.997 1.54042e+00  -1.54058e+00 0.00000e+00 0.00000e+00 4.77162e+01 314.997 8.05120e+00 314.997 0.7250 
1 1 1 -13 74  6  o 19 5.64298e+00 1.19384e+00 1.36466e+02 219.635 -9.27357e+00 -7.68145e+00 0.00000e+00 0.00000e+00 6.68209e+01 219.635 6.96449e+01 39.636  0.9575 
1 1 1 -13 74  7  o 4  4.37758e+00 1.22537e+00 7.03782e+01 145.549 -3.91776e+00 2.68763e+00  0.00000e+00 0.00000e+00 7.56163e+01 145.549 5.23807e+00 145.549 0.8873 
1 1 1 -13 74  8  o 14 2.92393e+00 9.81077e-01 5.98170e+01 13.140  3.28151e+00  7.66058e-01  0.00000e+00 0.00000e+00 3.17529e+01 13.140  2.80642e+01 193.140 0.8340 
1 1 1 -13 74  9  o 14 5.30990e+00 1.32666e+00 7.76238e+01 177.441 -6.99857e+00 3.12797e-01  0.00000e+00 0.00000e+00 1.06739e+02 177.441 2.91154e+01 177.441 0.9256 
1 1 1 -13 74  10 o 4  3.95712e+00 1.17779e+00 4.00760e+01 320.181 2.33385e+00  -1.94577e+00 0.00000e+00 0.00000e+00 8.04411e+01 320.181 4.03651e+01 320.181 0.8128 
1 1 1 -13 74  11 o 18 4.17565e+00 1.18509e+00 5.71162e+01 279.001 7.94574e-01  -5.01619e+00 0.00000e+00 0.00000e+00 8.27828e+01 279.001 2.56666e+01 279.001 0.8952 
1 1 1 -13 74  12 o 12 2.59081e+00 8.86430e-01 5.12780e+01 38.219  3.38128e+00  2.66259e+00  0.00000e+00 0.00000e+00 3.33915e+01 38.219  1.78865e+01 218.219 0.8743 
1 1 1 -13 75  1  o 17 9.47651e+00 1.03236e+00 1.42203e+02 59.055  1.14199e+01  1.90474e+01  0.00000e+00 0.00000e+00 2.07421e+02 59.055  6.52175e+01 59.055  0.9772 
1 1 1 -13 75  2  o 9  4.87417e+00 1.23180e+00 8.21333e+01 164.481 -5.56970e+00 1.54665e+00  0.00000e+00 0.00000e+00 8.50011e+01 164.481 2.86778e+00 164.481 0.9088 
1 1 1 -13 75  3  o 19 9.99559e+00 9.65452e-01 1.98582e+02 11.401  3.07315e+01  6.19700e+00  0.00000e+00 0.00000e+00 1.72242e+02 11.401  2.63398e+01 191.401 0.9839 
1 1 1 -13 75  4  o 3  3.36780e+00 1.03450e+00 5.84820e+01 191.515 -3.12986e+00 -6.37626e-01 0.00000e+00 0.00000e+00 4.59954e+01 191.515 1.24865e+01 11.515  0.8234 
1 1 1 -13 75  5  o 6  5.14631e+00 1.19181e+00 8.04074e+01 298.492 2.99929e+00  -5.52587e+00 0.00000e+00 0.00000e+00 9.71792e+01 298.492 1.67718e+01 298.492 0.9166 
1 1 1 -13 75  6  f 0  7.14921e+00 1.16416e+00 1.56185e+02 165.805 -1.75667e+01 4.44351e+00  0.00000e+00 0.00000e+00 1.05201e+02 165.805 5.09843e+01 345.805 0.9720 
1 1 1 -13 75  7  o 6  3.49158e+00 1.12181e+00 6.71845e+01 304.125 2.31882e+00  -3.42160e+00 0.00000e+00 0.00000e+00 4.67697e+01 304.125 2.04148e+01 124.125 0.8685 
1 1 1 -13 75  8  o 9  3.53041e+00 1.12774e+00 4.67729e+01 168.439 -2.93411e+00 6.00176e-01  0.00000e+00 0.00000e+00 6.05346e+01 168.439 1.37616e+01 168.439 0.8096 
1 1 1 -13 75  9  o 1  5.53928e+00 1.37115e+00 5.71318e+01 3.879   4.87978e+00  3.30859e-01  0.00000e+00 0.00000e+00 1.27926e+02 3.879   7.07945e+01 3.879   0.8908 
1 1 1 -13 75  10 o 16 4.18497e+00 1.24213e+00 7.22431e+01 280.686 1.13093e+00  -5.99341e+00 0.00000e+00 0.00000e+00 7.10343e+01 280.686 1.20877e+00 100.686 0.9139 
1 1 1 -13 75  11 o 7  5.87871e+00 1.28144e+00 7.21643e+01 33.797  6.74157e+00  4.51253e+00  0.00000e+00 0.00000e+00 1.33770e+02 33.797  6.16058e+01 33.797  0.9362 
1 1 1 -13 76  1  o 3  8.19609e+00 1.08654e+00 9.85045e+01 275.511 1.14038e+00  -1.18192e+01 0.00000e+00 0.00000e+00 1.97537e+02 275.511 9.90321e+01 275.511 0.9569 
1 1 1 -13 76  2  o 12 4.31469e+00 1.18418e+00 8.83983e+01 30.657  4.76517e+00  2.82454e+00  0.00000e+00 0.00000e+00 5.88284e+01 30.657  2.95699e+01 210.657 0.9046 
1 1 1 -13 76  3  f 0  7.47426e+00 1.12521e+00 1.72623e+02 146.197 -1.64128e+01 1.09887e+01  0.00000e+00 0.00000e+00 1.01908e+02 146.197 7.07156e+01 326.197 0.9743 
1 1 1 -13 76  4  o 6  8.32401e+00 1.05127e+00 1.22970e+02 239.024 -8.67771e+00 -1.44557e+01 0.00000e+00 0.00000e+00 1.81145e+02 239.024 5.81744e+01 239.024 0.9699 
1 1 1 -13 76  5  o 1  4.56944e+00 1.17233e+00 7.29134e+01 33.521  4.40908e+00  2.92060e+00  0.00000e+00 0.00000e+00 8.18220e+01 33.521  8.90862e+00 33.521  0.8997 
1 1 1 -13 76  6  o 4  5.36161e+00 1.23148e+00 1.01660e+02 229.321 -5.48831e+00 -6.38555e+00 0.00000e+00 0.00000e+00 8.75919e+01 229.321 1.40680e+01 49.321  0.9386 
1 1 1 -13 76  7  o 14 4.81042e+00 1.30443e+00 8.88102e+01 42.582  4.81821e+00  4.42772e+00  0.00000e+00 0.00000e+00 7.74794e+01 42.582  1.13308e+01 222.582 0.9201 
1 1 1 -13 76  8  f 0  4.50311e+00 1.32950e+00 8.59360e+01 15.141  6.06309e+00  1.64063e+00  0.00000e+00 0.00000e+00 6.89795e+01 15.141  1.69565e+01 195.141 0.9165 
1 1 1 -13 76  9  o 7  4.38388e+00 1.22380e+00 4.31714e+01 318.940 2.60719e+00  -2.27123e+00 0.00000e+00 0.00000e+00 9.47207e+01 318.940 5.15493e+01 318.940 0.8389 
1 1 1 -13 76  10 o 9  7.58141e+00 1.23095e+00 1.01053e+02 156.245 -1.39895e+01 6.15704e+00  0.00000e+00 0.00000e+00 1.73456e+02 156.245 7.24036e+01 156.245 0.9667 
1 1 1 -13 76  11 o 17 3.46310e+00 1.06956e+00 3.74176e+01 55.862  1.76544e+00  2.60378e+00  0.00000e+00 0.00000e+00 6.88488e+01 55.862  3.14312e+01 55.862  0.8202 
1 1 1 -13 77  1  o 17 5.51529e+00 1.18326e+00 5.34830e+01 59.555  2.20286e+00  3.74792e+00  0.00000e+00 0.00000e+00 1.28775e+02 59.555  7.52919e+01 59.555  0.8757 
1 1 1 -13 77  2  o 7  9.18404e+00 1.09732e+00 2.03589e+02 255.574 -7.36092e+00 -2.86144e+01 0.00000e+00 0.00000e+00 1.36873e+02 255.574 6.67164e+01 75.574  0.9829 
1 1 1 -13 77  3  o 6  3.65009e+00 1.04834e+00 2.31609e+01 357.189 1.39411e+00  -6.84635e-02 0.00000e+00 0.00000e+00 5.51567e+01 357.189 3.19958e+01 357.189 0.5693 
1 1 1 -13 77  4  o 5  3.32454e+00 1.01061e+00 6.59723e+01 126.541 -2.33459e+00 3.15027e+00  0.00000e+00 0.00000e+00 4.17581e+01 126.541 2.42142e+01 306.541 0.8604 
1 1 1 -13 77  5  o 8  4.12447e+00 1.12279e+00 7.93412e+01 331.262 4.79401e+00  -2.62882e+00 0.00000e+00 0.00000e+00 6.08445e+01 331.262 1.84966e+01 151.262 0.9032 
1 1 1 -13 77  6  o 16 4.94415e+00 1.19960e+00 1.17627e+02 66.337  3.88435e+00  8.86446e+00  0.00000e+00 0.00000e+00 5.83856e+01 66.337  5.92414e+01 246.337 0.9468 
1 1 1 -13 77  7  o 14 3.11643e+00 9.97207e-01 2.05182e+00 158.864 -1.13508e-01 4.38805e-02  0.00000e+00 0.00000e+00 5.05821e+00 158.864 3.00639e+00 158.864 0.0607 
1 1 1 -13 77  8  o 8  4.92198e+00 1.40117e+00 7.13881e+01 261.143 -8.63850e-01 -5.54370e+00 0.00000e+00 0.00000e+00 9.59316e+01 261.143 2.45435e+01 261.143 0.9059 
1 1 1 -13 77  9  o 14 5.87652e+00 1.33185e+00 1.05195e+02 128.348 -6.35380e+00 8.03151e+00  0.00000e+00 0.00000e+00 1.04057e+02 128.348 1.13811e+00 308.348 0.9498 
1 1 1 -13 77  10 o 18 3.66090e+00 1.11202e+00 3.76135e+01 257.273 -6.62381e-01 -2.93289e+00 0.00000e+00 0.00000e+00 7.34957e+01 257.273 3.58823e+01 257.273 0.8105 
1 1 1 -13 77  11 f 0  6.40217e+00 1.30200e+00 9.90098e+01 301.843 6.53461e+00  -1.05216e+01 0.00000e+00 0.00000e+00 1.30573e+02 301.843 3.15634e+01 301.843 0.9587 
1 1 1 -13 78  1  o 16 8.20104e+00 1.11996e+00 1.82997e+02 38.413  1.85191e+01  1.46848e+01  0.00000e+00 0.00000e+00 1.19810e+02 38.413  6.31868e+01 218.413 0.9786 
1 1 1 -13 78  2  o 7  1.16005e+01 9.64785e-01 2.08606e+02 146.967 -3.53053e+01 2.29562e+01  0.00000e+00 0.00000e+00 2.23586e+02 146.967 1.49807e+01 146.967 0.9881 
1 1 1 -13 78  3  o 17 2.76687e+00 8.69064e-01 7.43857e+01 270.532 3.75648e-02  -4.04318e+00 0.00000e+00 0.00000e+00 1.58161e+01 270.532 5.85696e+01 90.532  0.8652 
1 1 1 -13 78  4  o 12 2.58814e+00 8.72780e-01 4.73893e+01 113.495 -9.70835e-01 2.23331e+00  0.00000e+00 0.00000e+00 2.64564e+01 113.495 2.09330e+01 293.495 0.7578 
1 1 1 -13 78  5  o 12 3.47705e+00 1.06315e+00 6.09465e+01 310.945 2.41586e+00  -2.78448e+00 0.00000e+00 0.00000e+00 5.02858e+01 310.945 1.06607e+01 130.945 0.8503 
1 1 1 -13 78  6  o 12 9.26827e+00 1.05473e+00 1.44046e+02 24.967  2.23492e+01  1.04058e+01  0.00000e+00 0.00000e+00 1.97217e+02 24.967  5.31717e+01 24.967  0.9795 
1 1 1 -13 78  7  o 10 9.94934e+00 1.03240e+00 1.46654e+02 204.037 -2.60157e+01 -1.16031e+01 0.00000e+00 0.00000e+00 2.20390e+02 204.037 7.37355e+01 204.037 0.9823 
1 1 1 -13 78  8  o 10 5.71378e+00 1.47472e+00 1.22611e+02 68.366  3.67873e+00  9.27534e+00  0.00000e+00 0.00000e+00 8.07234e+01 68.366  4.18880e+01 248.366 0.9485 
1 1 1 -13 78  9  o 11 4.00744e+00 1.21058e+00 5.87075e+01 317.802 3.32020e+00  -3.01034e+00 0.00000e+00 0.00000e+00 7.34378e+01 317.802 1.47303e+01 317.802 0.8798 
1 1 1 -13 78  10 o 13 2.92493e+00 9.60807e-01 5.20438e+01 102.131 -8.42940e-01 3.92146e+00  0.00000e+00 0.00000e+00 4.25641e+01 102.131 9.47973e+00 282.131 0.8639 
1 1 1 -13 78  11 o 2  3.39202e+00 1.03727e+00 5.54392e+01 356.001 4.86656e+00  -3.40236e-01 0.00000e+00 0.00000e+00 5.75157e+01 356.001 2.07649e+00 356.001 0.8905 
1 1 1 -13 79  1  o 3  4.43712e+00 1.15571e+00 4.72636e+01 179.832 -3.39090e+00 9.96880e-03  0.00000e+00 0.00000e+00 9.25289e+01 179.832 4.52654e+01 179.832 0.8352 
1 1 1 -13 79  2  o 4  1.19886e+01 9.13994e-01 2.16759e+02 195.946 -4.76211e+01 -1.36070e+01 0.00000e+00 0.00000e+00 2.30610e+02 195.946 1.38517e+01 195.946 0.9899 
1 1 1 -13 79  3  o 19 1.21478e+01 9.14657e-01 2.32788e+02 315.936 3.83767e+01  -3.71427e+01 0.00000e+00 0.00000e+00 2.20552e+02 315.936 1.22358e+01 135.936 0.9906 
1 1 1 -13 79  4  o 11 1.09834e+01 9.19876e-01 1.77550e+02 104.390 -9.76854e+00 3.80734e+01  0.00000e+00 0.00000e+00 2.30632e+02 104.390 5.30811e+01 104.390 0.9872 
1 1 1 -13 79  5  o 7  3.64013e+00 1.08033e+00 6.24523e+01 214.417 -3.41014e+00 -2.33650e+00 0.00000e+00 0.00000e+00 5.64637e+01 214.417 5.98868e+00 34.417  0.8685 
1 1 1 -13 79  6  o 10 9.81854e+00 1.02370e+00 1.74699e+02 1.415   3.20619e+01  7.91922e-01  0.00000e+00 0.00000e+00 1.88512e+02 1.415   1.38133e+01 1.415   0.9843 
1 1 1 -13 79  7  o 18 3.39065e+00 1.03754e+00 6.41594e+01 27.205  4.07212e+00  2.09324e+00  0.00000e+00 0.00000e+00 4.82072e+01 27.205  1.59522e+01 207.205 0.8826 
1 1 1 -13 79  8  o 9  4.78919e+00 1.38424e+00 5.97221e+01 200.781 -4.27411e+00 -1.62198e+00 0.00000e+00 0.00000e+00 9.88001e+01 200.781 3.90780e+01 200.781 0.8824 
1 1 1 -13 79  9  o 7  5.62681e+00 1.50831e+00 9.95413e+01 352.865 8.77567e+00  -1.09846e+00 0.00000e+00 0.00000e+00 9.90043e+01 352.865 5.36962e-01 172.865 0.9416 
1 1 1 -13 79  10 o 16 5.09759e+00 1.23150e+00 7.73325e+01 174.855 -7.85970e+00 7.07665e-01  0.00000e+00 0.00000e+00 1.00941e+02 174.855 2.36084e+01 174.855 0.9343 
1 1 1 -13 79  11 o 10 2.17544e+00 7.62288e-01 2.50246e+01 156.617 -1.65852e+00 7.17128e-01  0.00000e+00 0.00000e+00 2.89307e+01 156.617 3.90617e+00 156.617 0.6634 
1 1 1 -13 80  1  o 6  9.45831e+00 1.03599e+00 1.70912e+02 21.124  2.68222e+01  1.03626e+01  0.00000e+00 0.00000e+00 1.79537e+02 21.124  8.62532e+00 21.124  0.9825 
1 1 1 -13 80  2  o 12 5.58385e+00 1.18550e+00 6.31424e+01 335.428 5.12771e+00  -2.34467e+00 0.00000e+00 0.00000e+00 1.27605e+02 335.428 6.44630e+01 335.428 0.9063 
1 1 1 -13 80  3  o 18 1.05535e+01 9.23625e-01 2.22021e+02 245.672 -1.94114e+01 -4.29353e+01 0.00000e+00 0.00000e+00 1.71234e+02 245.672 5.07873e+01 65.672  0.9893 
1 1 1 -13 80  4  f 0  4.41075e+00 1.19804e+00 1.14610e+02 71.616  2.50475e+00  7.53657e+00  0.00000e+00 0.00000e+00 4.05646e+01 71.616  7.40457e+01 251.616 0.9347 
1 1 1 -13 80  5  o 3  8.38805e+00 1.11392e+00 1.14810e+02 320.628 1.31549e+01  -1.07946e+01 0.00000e+00 0.00000e+00 1.91226e+02 320.628 7.64162e+01 320.628 0.9702 
1 1 1 -13 80  6  o 5  5.58834e+00 1.21490e+00 1.08986e+02 226.130 -7.15788e+00 -7.44601e+00 0.00000e+00 0.00000e+00 9.05554e+01 226.130 1.84303e+01 46.130  0.9503 
1 1 1 -13 80  7  o 18 6.32993e+00 1.29144e+00 1.10271e+02 85.972  8.61396e-01  1.22314e+01  0.00000e+00 0.00000e+00 1.17449e+02 85.972  7.17804e+00 85.972  0.9583 
1 1 1 -13 80  8  o 5  3.26012e+00 1.07971e+00 2.34185e+01 19.336  1.47163e+00  5.16401e-01  0.00000e+00 0.00000e+00 5.12275e+01 19.336  2.78089e+01 19.336  0.6105 
1 1 1 -13 80  9  o 4  3.35933e+00 1.11154e+00 3.28601e+01 265.683 -1.78328e-01 -2.36225e+00 0.00000e+00 0.00000e+00 6.15258e+01 265.683 2.86657e+01 265.683 0.7500 
1 1 1 -13 80  10 o 11 5.05388e+00 1.26368e+00 6.16549e+01 146.914 -5.25546e+00 3.42412e+00  0.00000e+00 0.00000e+00 1.11664e+02 146.914 5.00089e+01 146.914 0.9164 
1 1 1 -13 80  11 o 16 3.68329e+00 1.11703e+00 9.64969e+01 264.050 -9.51566e-01 -9.13039e+00 0.00000e+00 0.00000e+00 3.34514e+01 264.050 6.30455e+01 84.050  0.9439 
1 1 1 -13 81  1  o 13 1.00183e+01 9.48222e-01 1.58450e+02 98.445  -4.39688e+00 2.96131e+01  0.00000e+00 0.00000e+00 2.12930e+02 98.445  5.44804e+01 98.445  0.9832 
1 1 1 -13 81  2  o 6  3.28384e+00 1.03020e+00 4.32903e+01 282.423 5.44773e-01  -2.47296e+00 0.00000e+00 0.00000e+00 5.18007e+01 282.423 8.51043e+00 282.423 0.7685 
1 1 1 -13 81  3  o 3  2.99588e+00 9.37925e-01 6.05570e+01 249.011 -1.22191e+00 -3.18507e+00 0.00000e+00 0.00000e+00 3.37943e+01 249.011 2.67627e+01 69.011  0.8363 
1 1 1 -13 81  4  o 7  6.99239e+00 1.20959e+00 1.21801e+02 26.832  1.24504e+01  6.29793e+00  0.00000e+00 0.00000e+00 1.31704e+02 26.832  9.90287e+00 26.832  0.9635 
1 1 1 -13 81  5  o 1  2.78506e+00 9.19987e-01 3.87687e+01 290.785 7.70526e-01  -2.03004e+00 0.00000e+00 0.00000e+00 3.70448e+01 290.785 1.72391e+00 110.785 0.7240 
1 1 1 -13 81  6  o 8  3.37739e+00 1.03833e+00 7.39491e+01 287.995 1.58522e+00  -4.88025e+00 0.00000e+00 0.00000e+00 3.97757e+01 287.995 3.41734e+01 107.995 0.8963 
1 1 1 -13 81  7  o 18 5.48452e+00 1.24048e+00 7.28456e+01 310.176 4.68422e+00  -5.54781e+00 0.00000e+00 0.00000e+00 1.18247e+02 310.176 4.54015e+01 310.176 0.9283 
1 1 1 -13 81  8  o 19 3.38606e+00 1.07428e+00 5.75865e+01 87.439  1.82007e-01  4.06882e+00  0.00000e+00 0.00000e+00 5.23953e+01 87.439  5.19117e+00 267.439 0.8663 
1 1 1 -13 81  9  o 1  3.97812e+00 1.22797e+00 4.21113e+01 266.171 -2.33148e-01 -3.48371e+00 0.00000e+00 0.00000e+00 8.31504e+01 266.171 4.10390e+01 266.171 0.8407 
1 1 1 -13 81  10 o 5  2.65642e+00 8.86395e-01 3.17393e+01 219.871 -2.04765e+00 -1.71036e+00 0.00000e+00 0.00000e+00 4.59926e+01 219.871 1.42534e+01 219.871 0.7821 
1 1 1 -13 81  11 o 6  2.96672e+00 9.61577e-01 6.11260e+01 48.590  3.86910e+00  4.38703e+00  0.00000e+00 0.00000e+00 3.97602e+01 48.590  2.13659e+01 228.590 0.9100 
1 1 1 -13 82  1  o 9  8.74419e+00 1.05631e+00 1.89520e+02 246.490 -1.22531e+01 -2.81666e+01 0.00000e+00 0.00000e+00 1.34698e+02 246.490 5.48214e+01 66.490  0.9836 
1 1 1 -13 82  2  f 0  5.24971e+00 1.17836e+00 8.79375e+01 320.111 5.98989e+00  -5.00635e+00 0.00000e+00 0.00000e+00 9.66990e+01 320.111 8.76149e+00 320.111 0.9336 
1 1 1 -13 82  3  o 16 3.08653e+00 9.74951e-01 1.12160e+02 161.351 -6.38324e+00 2.15423e+00  0.00000e+00 0.00000e+00 4.96691e+00 341.351 1.17127e+02 341.351 0.9225 
1 1 1 -13 82  4  o 14 4.06827e+00 1.16435e+00 8.74545e+01 344.476 5.73363e+00  -1.59266e+00 0.00000e+00 0.00000e+00 5.20640e+01 344.476 3.53905e+01 164.476 0.9116 
1 1 1 -13 82  5  o 2  3.54183e+00 1.05986e+00 3.47066e+01 117.008 -1.06769e+00 2.09470e+00  0.00000e+00 0.00000e+00 6.48525e+01 117.008 3.01459e+01 117.008 0.7478 
1 1 1 -13 82  6  o 8  5.71511e+00 1.24460e+00 1.22478e+02 117.249 -5.84042e+00 1.13403e+01  0.00000e+00 0.00000e+00 8.35771e+01 117.249 3.89010e+01 297.249 0.9600 
1 1 1 -13 82  7  o 2  3.32681e+00 1.03165e+00 2.44140e+01 337.877 1.61277e+00  -6.55634e-01 0.00000e+00 0.00000e+00 5.67661e+01 337.877 3.23521e+01 337.877 0.6503 
1 1 1 -13 82  8  o 9  3.97654e+00 1.13914e+00 6.29083e+01 347.611 5.42721e+00  -1.19211e+00 0.00000e+00 0.00000e+00 7.19779e+01 347.611 9.06967e+00 347.611 0.9049 
1 1 1 -13 82  9  o 11 3.04145e+00 1.03610e+00 1.69139e+01 212.782 -1.11583e+00 -7.18617e-01 0.00000e+00 0.00000e+00 4.57771e+01 212.782 2.88631e+01 212.782 0.5504 
1 1 1 -13 82  10 o 17 5.02459e+00 1.36179e+00 1.29684e+02 144.296 -1.04083e+01 7.48020e+00  0.00000e+00 0.00000e+00 5.07793e+01 144.296 7.89048e+01 324.296 0.9602 
1 1 1 -13 83  1  o 16 4.33413e+00 1.13708e+00 1.18122e+02 27.406  7.85656e+00  4.07344e+00  0.00000e+00 0.00000e+00 3.56981e+01 27.406  8.24242e+01 207.406 0.9417 
1 1 1 -13 83  2  o 6  6.19196e+00 1.17043e+00 7.16061e+01 336.833 6.90883e+00  -2.95635e+00 0.00000e+00 0.00000e+00 1.45492e+02 336.833 7.38859e+01 336.833 0.9309 
1 1 1 -13 83  3  f 0  2.93382e+00 9.45287e-01 9.59493e+01 142.280 -4.35858e+00 3.37113e+00  0.00000e+00 0.00000e+00 3.87859e+00 142.280 9.20707e+01 322.280 0.9040 
1 1 1 -13 83  4  o 19 5.68218e+00 1.26435e+00 1.55863e+02 248.421 -5.31914e+00 -1.34490e+01 0.00000e+00 0.00000e+00 5.03285e+01 248.421 1.05535e+02 68.421  0.9648 
1 1 1 -13 83  5  o 10 9.02669e+00 1.07140e+00 1.53661e+02 260.874 -4.50348e+00 -2.80354e+01 0.00000e+00 0.00000e+00 1.79551e+02 260.874 2.58899e+01 260.874 0.9822 
1 1 1 -13 83  6  o 10 6.12521e+00 1.14608e+00 5.78546e+01 301.796 3.45243e+00  -5.56907e+00 0.00000e+00 0.00000e+00 1.53783e+02 301.796 9.59285e+01 301.796 0.9202 
1 1 1 -13 83  7  o 15 4.11258e+00 1.16373e+00 6.00823e+01 158.668 -4.37916e+00 1.71020e+00  0.00000e+00 0.00000e+00 7.66068e+01 158.668 1.65245e+01 158.668 0.8860 
1 1 1 -13 83  8  o 4  7.57571e+00 1.15447e+00 1.33150e+02 1.619   2.08218e+01  5.88688e-01  0.00000e+00 0.00000e+00 1.43872e+02 1.619   1.07224e+01 1.619   0.9757 
1 1 1 -13 83  9  o 11 7.30061e+00 1.66380e+00 1.47430e+02 146.528 -1.27834e+01 8.45228e+00  0.00000e+00 0.00000e+00 1.16825e+02 146.528 3.06051e+01 326.527 0.9668 
1 1 1 -13 83  10 o 7  3.68028e+00 1.20267e+00 7.63185e+01 297.525 2.93509e+00  -5.63218e+00 0.00000e+00 0.00000e+00 4.99598e+01 297.525 2.63586e+01 117.525 0.9175 
1 1 1 -13 84  1  o 8  3.04405e+00 9.65881e-01 5.27322e+01 144.671 -2.52599e+00 1.79043e+00  0.00000e+00 0.00000e+00 4.09597e+01 144.671 1.17726e+01 324.671 0.8169 
1 1 1 -13 84  2  o 13 6.60999e+00 1.20653e+00 5.42805e+01 138.179 -4.37108e+00 3.91102e+00  0.00000e+00 0.00000e+00 1.72281e+02 138.179 1.18000e+02 138.179 0.9102 
1 1 1 -13 84  3  o 9  4.26763e+00 1.15813e+00 7.98742e+01 250.943 -1.97350e+00 -5.71299e+00 0.00000e+00 0.00000e+00 6.67561e+01 250.943 1.31182e+01 70.943  0.9130 
1 1 1 -13 84  4  o 11 3.61847e+00 1.05838e+00 6.06068e+01 5.621   4.41507e+00  4.34521e-01  0.00000e+00 0.00000e+00 5.89184e+01 5.621   1.68839e+00 185.621 0.8784 
1 1 1 -13 84  5  o 13 5.57521e+00 1.19591e+00 7.13381e+01 144.478 -6.16878e+00 4.40366e+00  0.00000e+00 0.00000e+00 1.23788e+02 144.478 5.24497e+01 144.478 0.9315 
1 1 1 -13 84  6  o 9  4.24932e+00 1.14300e+00 1.04318e+02 332.975 7.71682e+00  -3.93619e+00 0.00000e+00 0.00000e+00 4.56942e+01 332.975 5.86241e+01 152.975 0.9404 
1 1 1 -13 84  7  o 1  3.30765e+00 1.01326e+00 5.26903e+01 133.880 -2.72490e+00 2.83353e+00  0.00000e+00 0.00000e+00 5.41017e+01 133.880 1.41140e+00 133.880 0.8608 
1 1 1 -13 84  8  o 4  8.47783e+00 1.08160e+00 1.01061e+02 95.143  -1.84383e+00 2.04841e+01  0.00000e+00 0.00000e+00 2.08779e+02 95.143  1.07718e+02 95.143  0.9754 
1 1 1 -13 84  9  o 3  3.87951e+00 1.23188e+00 3.42488e+01 248.101 -1.03582e+00 -2.57683e+00 0.00000e+00 0.00000e+00 8.07686e+01 248.101 4.65198e+01 248.101 0.7921 
1 1 1 -13 84  10 o 9  3.85230e+00 1.21516e+00 3.11235e+01 291.032 1.00019e+00  -2.60125e+00 0.00000e+00 0.00000e+00 8.30829e+01 291.032 5.19594e+01 291.032 0.7929 
1 1 1 -13 85  1  o 12 3.39700e+00 1.02318e+00 4.78150e+01 180.894 -3.19215e+00 -4.98382e-02 0.00000e+00 0.00000e+00 5.75374e+01 180.894 9.72239e+00 180.894 0.8233 
1 1 1 -13 85  2  o 3  9.71076e+00 1.02809e+00 1.54694e+02 124.519 -1.66825e+01 2.42563e+01  0.00000e+00 0.00000e+00 2.04632e+02 124.519 4.99379e+01 124.519 0.9829 
1 1 1 -13 85  3  o 9  4.39582e+00 1.16611e+00 7.21881e+01 117.115 -2.68130e+00 5.23632e+00  0.00000e+00 0.00000e+00 7.83913e+01 117.115 6.20319e+00 117.115 0.9105 
1 1 1 -13 85  4  o 18 3.17979e+00 9.90982e-01 4.19767e+01 350.196 2.97554e+00  -5.14151e-01 0.00000e+00 0.00000e+00 5.50236e+01 350.196 1.30469e+01 350.196 0.8114 
1 1 1 -13 85  5  o 19 9.32609e+00 1.00682e+00 1.64681e+02 222.789 -2.49474e+01 -2.30928e+01 0.00000e+00 0.00000e+00 1.80458e+02 222.789 1.57774e+01 222.789 0.9852 
1 1 1 -13 85  6  o 18 7.69953e+00 1.15386e+00 1.10196e+02 24.362  1.48324e+01  6.71645e+00  0.00000e+00 0.00000e+00 1.69766e+02 24.362  5.95701e+01 24.362  0.9688 
1 1 1 -13 85  7  o 4  5.02610e+00 1.14228e+00 4.09140e+01 168.886 -4.36874e+00 8.58202e-01  0.00000e+00 0.00000e+00 1.24732e+02 168.886 8.38181e+01 168.886 0.8789 
1 1 1 -13 85  8  o 15 3.35781e+00 1.00411e+00 4.22823e+01 142.493 -2.99940e+00 2.30209e+00  0.00000e+00 0.00000e+00 6.52074e+01 142.493 2.29251e+01 142.493 0.8545 
1 1 1 -13 85  9  o 7  3.61281e+00 1.09045e+00 1.07478e+02 357.854 9.54410e+00  -3.57579e-01 0.00000e+00 0.00000e+00 2.04334e+01 357.854 8.70445e+01 177.854 0.9461 
1 1 1 -13 85  10 o 2  2.91090e+00 9.95929e-01 6.30493e+01 229.138 -3.71930e+00 -4.29944e+00 0.00000e+00 0.00000e+00 3.56606e+01 229.138 2.73887e+01 49.138  0.9072 
1 1 1 -13 86  1  o 13 7.56695e+00 1.25480e+00 1.04564e+02 254.228 -3.70730e+00 -1.31261e+01 0.00000e+00 0.00000e+00 1.69769e+02 254.228 6.52057e+01 254.228 0.9626 
1 1 1 -13 86  2  o 2  3.82293e+00 1.11812e+00 4.35342e+01 137.460 -2.41499e+00 2.21604e+00  0.00000e+00 0.00000e+00 7.56923e+01 137.460 3.21581e+01 137.460 0.8286 
1 1 1 -13 86  3  f 0  5.51328e+00 1.21621e+00 1.23035e+02 109.070 -4.13844e+00 1.19712e+01  0.00000e+00 0.00000e+00 7.59764e+01 109.070 4.70589e+01 289.070 0.9597 
1 1 1 -13 86  4  o 14 8.12111e+00 1.09279e+00 1.42218e+02 292.287 8.45259e+00  -2.06224e+01 0.00000e+00 0.00000e+00 1.56092e+02 292.287 1.38740e+01 292.287 0.9773 
1 1 1 -13 86  5  o 10 4.62005e+00 1.16436e+00 1.04127e+02 50.138  6.04720e+00  7.24215e+00  0.00000e+00 0.00000e+00 5.99122e+01 50.138  4.42150e+01 230.138 0.9454 
1 1 1 -13 86  6  o 5  6.38934e+00 1.21807e+00 7.97987e+01 155.264 -8.75545e+00 4.03367e+00  0.00000e+00 0.00000e+00 1.47154e+02 155.264 6.73548e+01 155.264 0.9466 
1 1 1 -13 86  7  o 17 3.36950e+00 1.01555e+00 1.16328e+02 2.634   9.33078e+00  4.29193e-01  0.00000e+00 0.00000e+00 3.02419e+00 2.634   1.13304e+02 182.634 0.9449 
1 1 1 -13 86  8  o 13 4.43778e+00 1.15361e+00 9.33011e+01 303.219 5.23338e+00  -7.99169e+00 0.00000e+00 0.00000e+00 6.39473e+01 303.219 2.93538e+01 123.219 0.9461 
1 1 1 -13 86  9  o 19 2.96075e+00 9.58315e-01 4.47801e+01 23.781  3.33019e+00  1.46749e+00  0.00000e+00 0.00000e+00 4.91598e+01 23.781  4.37970e+00 23.781  0.8481 
1 1 1 -13 87  1  f 0  4.43438e+00 1.23180e+00 1.62706e+01 72.951  3.89545e-01  1.27025e+00  0.00000e+00 0.00000e+00 7.57007e+01 72.951  5.94301e+01 72.951  0.5508 
1 1 1 -13 87  2  o 18 4.24174e+00 1.07746e+00 7.75497e+01 32.106  5.87527e+00  3.68637e+00  0.00000e+00 0.00000e+00 7.00657e+01 32.106  7.48395e+00 212.106 0.9248 
1 1 1 -13 87  3  o 10 3.35316e+00 1.02697e+00 5.65535e+01 351.540 3.81213e+00  -5.66976e-01 0.00000e+00 0.00000e+00 5.15934e+01 351.540 4.96012e+00 171.540 0.8577 
1 1 1 -13 87  4  o 12 4.06522e+00 1.09927e+00 9.00762e+01 111.588 -2.73183e+00 6.90385e+00  0.00000e+00 0.00000e+00 5.19876e+01 111.588 3.80887e+01 291.589 0.9300 
1 1 1 -13 87  5  f 0  3.21079e+00 1.00235e+00 7.42397e+01 314.153 3.68907e+00  -3.79983e+00 0.00000e+00 0.00000e+00 3.42387e+01 314.153 4.00010e+01 134.153 0.8998 
1 1 1 -13 87  6  o 2  3.25728e+00 9.86984e-01 1.57973e+01 282.585 2.80456e-01  -1.25618e+00 0.00000e+00 0.00000e+00 5.00583e+01 282.585 3.42609e+01 282.585 0.5389 
1 1 1 -13 87  7  o 10 6.93326e+00 1.16975e+00 1.00386e+02 187.392 -1.49020e+01 -1.93319e+00 0.00000e+00 0.00000e+00 1.50672e+02 187.392 5.02868e+01 187.392 0.9661 
1 1 1 -13 87  8  o 7  4.23536e+00 1.18741e+00 9.00567e+01 345.578 8.05628e+00  -2.07183e+00 0.00000e+00 0.00000e+00 5.86668e+01 345.578 3.13899e+01 165.578 0.9378 
1 1 1 -13 87  9  o 18 3.40199e+00 1.01540e+00 3.07608e+01 196.505 -2.89346e+00 -8.57341e-01 0.00000e+00 0.00000e+00 7.24752e+01 196.505 4.17144e+01 196.505 0.8113 
1 1 1 -13 88  1  o 9  3.49204e+00 1.10002e+00 6.45131e+01 218.936 -3.58744e+00 -2.89838e+00 0.00000e+00 0.00000e+00 5.16317e+01 218.936 1.28814e+01 38.936  0.8835 
1 1 1 -13 88  2  o 18 4.24978e+00 1.07729e+00 2.14147e+01 80.239  3.21790e-01  1.87046e+00  0.00000e+00 0.00000e+00 8.73495e+01 80.239  6.59348e+01 80.239  0.6803 
1 1 1 -13 88  3  o 14 9.14891e+00 1.05364e+00 1.62613e+02 79.087  5.93207e+00  3.07666e+01  0.00000e+00 0.00000e+00 1.75812e+02 79.087  1.31994e+01 79.087  0.9839 
1 1 1 -13 88  4  o 19 9.05347e+00 1.06069e+00 1.54736e+02 233.117 -1.74331e+01 -2.32328e+01 0.00000e+00 0.00000e+00 1.79477e+02 233.117 2.47413e+01 233.117 0.9826 
1 1 1 -13 88  5  o 13 4.25059e+00 1.13651e+00 5.66574e+01 176.732 -5.35667e+00 3.05830e-01  0.00000e+00 0.00000e+00 8.71396e+01 176.732 3.04822e+01 176.732 0.9012 
1 1 1 -13 88  6  o 8  4.15146e+00 1.03845e+00 2.78562e+01 67.281  1.04257e+00  2.49004e+00  0.00000e+00 0.00000e+00 9.43799e+01 67.281  6.65237e+01 67.281  0.7851 
1 1 1 -13 88  7  o 18 4.00481e+00 1.09825e+00 5.74619e+01 326.102 4.66248e+00  -3.13280e+00 0.00000e+00 0.00000e+00 7.84920e+01 326.102 2.10301e+01 326.102 0.9060 
1 1 1 -13 88  8  o 9  4.66168e+00 1.14558e+00 2.81032e+01 113.935 -1.23634e+00 2.78537e+00  0.00000e+00 0.00000e+00 1.13846e+02 113.935 8.57430e+01 113.935 0.8134 
1 1 1 -13 88  9  o 10 2.85817e+00 9.41187e-01 3.92222e+01 339.397 3.46418e+00  -1.30230e+00 0.00000e+00 0.00000e+00 5.17287e+01 339.397 1.25065e+01 339.397 0.8509 
1 1 1 -13 89  1  o 2  6.83620e+00 1.21006e+00 9.57050e+01 336.155 1.12860e+01  -4.98829e+00 0.00000e+00 0.00000e+00 1.50920e+02 336.155 5.52147e+01 336.155 0.9586 
1 1 1 -13 89  2  o 7  2.72497e+00 9.03315e-01 4.91364e+01 177.894 -3.27402e+00 1.20421e-01  0.00000e+00 0.00000e+00 3.57778e+01 177.894 1.33585e+01 357.893 0.8285 
1 1 1 -13 89  3  o 12 1.09635e+01 1.09737e+00 1.58080e+02 228.547 -2.30725e+01 -2.61215e+01 0.00000e+00 0.00000e+00 2.48043e+02 228.547 8.99634e+01 228.547 0.9855 
1 1 1 -13 89  4  o 3  7.05447e+00 1.16729e+00 1.51246e+02 21.330  1.96331e+01  7.66652e+00  0.00000e+00 0.00000e+00 1.07347e+02 21.330  4.38990e+01 201.330 0.9760 
1 1 1 -13 89  5  o 3  7.23858e+00 1.19425e+00 1.31836e+02 226.372 -1.31285e+01 -1.37726e+01 0.00000e+00 0.00000e+00 1.32581e+02 226.372 7.45157e-01 226.372 0.9734 
1 1 1 -13 89  6  o 12 6.12969e+00 1.14030e+00 6.12195e+01 102.517 -1.80561e+00 8.13338e+00  0.00000e+00 0.00000e+00 1.54352e+02 102.517 9.31329e+01 102.517 0.9379 
1 1 1 -13 89  7  o 8  7.35399e+00 1.11756e+00 1.03634e+02 301.893 9.40940e+00  -1.51207e+01 0.00000e+00 0.00000e+00 1.64011e+02 301.893 6.03766e+01 301.893 0.9715 
1 1 1 -13 89  8  o 13 2.80205e+00 9.23739e-01 4.55872e+01 120.535 -1.95858e+00 3.32040e+00  0.00000e+00 0.00000e+00 4.43581e+01 120.535 1.22906e+00 300.535 0.8577 
1 1 1 -13 89  9  o 5  2.75595e+00 9.05517e-01 5.22391e+01 113.755 -1.88273e+00 4.27782e+00  0.00000e+00 0.00000e+00 3.89694e+01 113.755 1.32696e+01 293.755 0.8852 
1 1 1 -13 90  1  o 9  3.17842e+00 9.49477e-01 3.64679e+01 86.949  1.43321e-01  2.68861e+00  0.00000e+00 0.00000e+00 5.73392e+01 86.949  2.08713e+01 86.949  0.7844 
1 1 1 -13 90  2  o 3  8.47987e+00 1.06956e+00 1.22203e+02 178.346 -2.17380e+01 6.27778e-01  0.00000e+00 0.00000e+00 1.89243e+02 178.346 6.70403e+01 178.346 0.9767 
1 1 1 -13 90  3  o 7  7.08692e+00 1.21931e+00 8.14682e+01 5.453   1.08507e+01  1.03583e+00  0.00000e+00 0.00000e+00 1.72312e+02 5.453   9.08443e+01 5.453   0.9530 
1 1 1 -13 90  4  o 16 2.87832e+00 9.31884e-01 3.08730e+01 250.716 -7.72321e-01 -2.20740e+00 0.00000e+00 0.00000e+00 4.97804e+01 250.716 1.89074e+01 250.716 0.7462 
1 1 1 -13 90  5  o 8  5.19352e+00 1.26565e+00 3.85574e+01 303.393 2.21524e+00  -3.36049e+00 0.00000e+00 0.00000e+00 1.29893e+02 303.393 9.13355e+01 303.393 0.8645 
1 1 1 -13 90  6  o 18 3.06627e+00 9.46693e-01 3.65165e+01 232.051 -1.95833e+00 -2.51119e+00 0.00000e+00 0.00000e+00 5.80557e+01 232.051 2.15392e+01 232.051 0.8228 
1 1 1 -13 90  7  o 16 5.51449e+00 1.17903e+00 1.13059e+02 49.006  9.21002e+00  1.05972e+01  0.00000e+00 0.00000e+00 8.59770e+01 49.006  2.70823e+01 229.006 0.9637 
1 1 1 -13 90  8  o 12 5.69624e+00 1.21822e+00 7.59425e+01 85.312  8.29160e-01  1.01110e+01  0.00000e+00 0.00000e+00 1.26395e+02 85.312  5.04520e+01 85.312  0.9494 
1 1 1 -13 91  1  o 11 4.17214e+00 1.14783e+00 9.61998e+01 128.804 -5.54221e+00 6.89218e+00  0.00000e+00 0.00000e+00 5.15828e+01 128.804 4.46170e+01 308.804 0.9416 
1 1 1 -13 91  2  o 6  4.59272e+00 1.18397e+00 3.58125e+01 215.801 -2.83917e+00 -2.04773e+00 0.00000e+00 0.00000e+00 1.09414e+02 215.801 7.36017e+01 215.801 0.8411 
1 1 1 -13 91  3  o 15 2.98637e+00 9.55604e-01 6.94346e+01 42.486  3.77618e+00  3.45854e+00  0.00000e+00 0.00000e+00 3.11012e+01 42.486  3.83334e+01 222.486 0.8961 
1 1 1 -13 91  4  o 3  5.69360e+00 1.14464e+00 1.19606e+02 229.632 -9.96661e+00 -1.17240e+01 0.00000e+00 0.00000e+00 8.70669e+01 229.632 3.25391e+01 49.632  0.9669 
1 1 1 -13 91  5  o 11 2.40119e+00 8.08905e-01 8.36209e+01 110.564 -2.28199e+00 6.08282e+00  0.00000e+00 0.00000e+00 8.07115e-01 290.564 8.44280e+01 290.564 0.9194 
1 1 1 -13 91  6  o 18 4.84899e+00 1.16103e+00 6.33049e+01 236.098 -3.83425e+00 -5.70557e+00 0.00000e+00 0.00000e+00 1.04632e+02 236.098 4.13273e+01 236.098 0.9241 
1 1 1 -13 91  7  o 2  3.01210e+00 9.57286e-01 5.95576e+01 189.974 -4.85645e+00 -8.54061e-01 0.00000e+00 0.00000e+00 4.10179e+01 189.974 1.85397e+01 9.974   0.8918 
1 1 1 -13 91  8  f 0  4.08153e+00 1.10671e+00 6.00120e+01 17.845  6.23296e+00  2.00664e+00  0.00000e+00 0.00000e+00 8.04676e+01 17.845  2.04556e+01 17.845  0.9201 
1 1 1 -13 92  1  o 9  3.84565e+00 1.12964e+00 4.71424e+01 169.723 -3.76772e+00 6.83141e-01  0.00000e+00 0.00000e+00 7.67446e+01 169.723 2.96022e+01 169.723 0.8566 
1 1 1 -13 92  2  o 15 7.97395e+00 1.15398e+00 1.45005e+02 346.902 2.36847e+01  -5.51086e+00 0.00000e+00 0.00000e+00 1.48459e+02 346.902 3.45415e+00 346.902 0.9792 
1 1 1 -13 92  3  f 0  3.74681e+00 1.11875e+00 1.07035e+02 146.419 -7.73985e+00 5.13865e+00  0.00000e+00 0.00000e+00 2.58851e+01 146.419 8.11502e+01 326.419 0.9445 
1 1 1 -13 92  4  o 17 3.18868e+00 1.00133e+00 6.64949e+01 219.523 -4.37179e+00 -3.60677e+00 0.00000e+00 0.00000e+00 4.20328e+01 219.523 2.44621e+01 39.523  0.9069 
1 1 1 -13 92  5  o 19 3.84622e+00 1.03663e+00 5.31200e+01 128.399 -3.29204e+00 4.15370e+00  0.00000e+00 0.00000e+00 7.66792e+01 128.399 2.35591e+01 128.399 0.8999 
1 1 1 -13 92  6  o 11 4.62401e+00 1.16097e+00 2.88404e+01 177.341 -3.05376e+00 1.41802e-01  0.00000e+00 0.00000e+00 1.12209e+02 177.341 8.33689e+01 177.341 0.8141 
1 1 1 -13 92  7  o 17 1.11821e+01 9.92253e-01 1.75103e+02 48.808  3.81433e+01  4.35833e+01  0.00000e+00 0.00000e+00 2.39859e+02 48.808  6.47559e+01 48.808  0.9913 
1 1 1 -13 92  8  o 6  6.55837e+00 1.10914e+00 9.03706e+01 185.227 -1.58787e+01 -1.45271e+00 0.00000e+00 0.00000e+00 1.47075e+02 185.227 5.67043e+01 185.227 0.9681 
1 1 1 -13 93  1  o 15 4.58373e+00 1.20533e+00 6.69421e+01 85.406  5.23128e-01  6.51024e+00  0.00000e+00 0.00000e+00 9.15896e+01 85.406  2.46475e+01 85.406  0.9199 
1 1 1 -13 93  2  o 12 3.52371e+00 1.06353e+00 6.32361e+01 73.920  1.47550e+00  5.11861e+00  0.00000e+00 0.00000e+00 5.59851e+01 73.920  7.25105e+00 253.920 0.9005 
1 1 1 -13 93  3  o 13 6.44823e+00 1.24366e+00 8.59004e+01 318.519 8.71102e+00  -7.70172e+00 0.00000e+00 0.00000e+00 1.45566e+02 318.519 5.96655e+01 318.519 0.9560 
1 1 1 -13 93  4  o 1  5.20907e+00 1.08911e+00 9.99013e+01 104.978 -3.31140e+00 1.23772e+01  0.00000e+00 0.00000e+00 8.77601e+01 104.978 1.21412e+01 284.978 0.9601 
1 1 1 -13 93  5  o 5  2.39099e+00 7.98917e-01 6.89647e+01 284.058 1.38934e+00  -5.54831e+00 0.00000e+00 0.00000e+00 1.24091e+01 284.058 5.65556e+01 104.058 0.9078 
1 1 1 -13 93  6  o 19 2.49669e+00 8.34574e-01 9.10156e+01 145.024 -5.76972e+00 4.03639e+00  0.00000e+00 0.00000e+00 4.41344e+00 325.024 9.54291e+01 325.024 0.9260 
1 1 1 -13 93  7  o 18 2.52937e+00 8.40803e-01 4.50228e+01 295.441 1.81541e+00  -3.81613e+00 0.00000e+00 0.00000e+00 3.74910e+01 295.441 7.53178e+00 115.441 0.8717 
1 1 1 -13 93  8  o 18 2.89545e+00 9.33741e-01 6.22078e+01 64.626  2.64012e+00  5.56649e+00  0.00000e+00 0.00000e+00 3.68224e+01 64.626  2.53854e+01 244.626 0.9148 
1 1 1 -13 94  1  o 14 1.22700e+01 9.84652e-01 1.99483e+02 203.374 -6.10032e+01 -2.63657e+01 0.00000e+00 0.00000e+00 2.58237e+02 203.374 5.87545e+01 203.374 0.9924 
1 1 1 -13 94  2  o 18 2.83063e+00 9.30327e-01 6.57009e+01 2.824   4.91999e+00  2.42706e-01  0.00000e+00 0.00000e+00 2.91087e+01 2.824   3.65921e+01 182.824 0.8916 
1 1 1 -13 94  3  o 14 3.97517e+00 1.16363e+00 7.44316e+01 38.195  5.31115e+00  4.17871e+00  0.00000e+00 0.00000e+00 6.32624e+01 38.195  1.11692e+01 218.195 0.9227 
1 1 1 -13 94  4  f 0  5.81809e+00 1.14080e+00 5.06255e+01 212.658 -5.66022e+00 -3.62793e+00 0.00000e+00 0.00000e+00 1.50664e+02 212.658 1.00038e+02 212.658 0.9223 
1 1 1 -13 94  5  o 6  3.34715e+00 1.00736e+00 3.87507e+01 144.496 -3.00416e+00 2.14313e+00  0.00000e+00 0.00000e+00 6.79451e+01 144.496 2.91944e+01 144.496 0.8505 
1 1 1 -13 94  6  o 8  8.06180e+00 1.08664e+00 1.21611e+02 8.478   2.58646e+01  3.85548e+00  0.00000e+00 0.00000e+00 1.74469e+02 8.478   5.28586e+01 8.478   0.9807 
1 1 1 -13 94  7  o 5  2.63648e+00 8.63035e-01 5.99907e+01 301.255 2.79073e+00  -4.59798e+00 0.00000e+00 0.00000e+00 2.89350e+01 301.255 3.10557e+01 121.256 0.9015 
1 1 1 -13 94  8  o 7  3.04660e+00 9.66051e-01 6.11261e+01 122.595 -3.17978e+00 4.97301e+00  0.00000e+00 0.00000e+00 4.25950e+01 122.595 1.85310e+01 302.595 0.9108 
1 1 1 -13 95  1  o 4  4.79358e+00 1.17039e+00 1.26323e+02 10.724  1.30903e+01  2.47920e+00  0.00000e+00 0.00000e+00 4.69128e+01 10.724  7.94103e+01 190.724 0.9617 
1 1 1 -13 95  2  o 2  2.83891e+00 9.27676e-01 8.22561e+01 80.536  1.06927e+00  6.41424e+00  0.00000e+00 0.00000e+00 1.57792e+01 80.536  6.64770e+01 260.536 0.9195 
1 1 1 -13 95  3  o 6  3.63192e+00 1.05636e+00 5.85850e+01 304.923 3.01890e+00  -4.32385e+00 0.00000e+00 0.00000e+00 6.40019e+01 304.923 5.41688e+00 304.923 0.8994 
1 1 1 -13 95  4  o 9  4.58043e+00 1.15130e+00 1.16190e+02 26.556  1.10101e+01  5.50292e+00  0.00000e+00 0.00000e+00 4.84519e+01 26.556  6.77385e+01 206.556 0.9585 
1 1 1 -13 95  5  o 9  3.20620e+00 9.91572e-01 6.21197e+01 89.150  8.29780e-02  5.59529e+00  0.00000e+00 0.00000e+00 4.66798e+01 89.150  1.54399e+01 269.150 0.9056 
1 1 1 -13 95  6  o 5  3.81408e+00 1.11542e+00 7.82710e+01 331.617 7.09597e+00  -3.83410e+00 0.00000e+00 0.00000e+00 5.53573e+01 331.617 2.29137e+01 151.617 0.9358 
1 1 1 -13 95  7  o 14 3.93479e+00 1.13704e+00 8.57247e+01 184.913 -9.06022e+00 -7.78875e-01 0.00000e+00 0.00000e+00 5.31121e+01 184.913 3.26126e+01 4.913   0.9433 
1 1 1 -13 96  1  o 16 4.38296e+00 1.17196e+00 5.92496e+01 145.994 -5.04741e+00 3.40524e+00  0.00000e+00 0.00000e+00 9.12030e+01 145.994 3.19534e+01 145.994 0.9137 
1 1 1 -13 96  2  o 3  3.58953e+00 1.07930e+00 7.80488e+01 345.689 7.00496e+00  -1.78701e+00 0.00000e+00 0.00000e+00 4.70183e+01 345.689 3.10304e+01 165.689 0.9280 
1 1 1 -13 96  3  o 1  3.19293e+00 9.76193e-01 6.18354e+01 240.385 -2.87096e+00 -5.05077e+00 0.00000e+00 0.00000e+00 4.70964e+01 240.385 1.47391e+01 60.385  0.9093 
1 1 1 -13 96  4  o 16 4.46124e+00 1.16059e+00 7.89200e+01 137.635 -6.13714e+00 5.59712e+00  0.00000e+00 0.00000e+00 7.79238e+01 137.635 9.96217e-01 317.635 0.9377 
1 1 1 -13 96  5  o 11 3.17526e+00 9.58006e-01 5.69758e+01 276.544 6.42766e-01  -5.60337e+00 0.00000e+00 0.00000e+00 5.08397e+01 276.544 6.13607e+00 96.544  0.9064 
1 1 1 -13 96  6  o 2  3.00187e+00 9.31368e-01 3.37745e+01 134.545 -2.34112e+00 2.37859e+00  0.00000e+00 0.00000e+00 5.97247e+01 134.545 2.59501e+01 134.545 0.8321 
1 1 1 -13 96  7  o 7  2.64733e+00 8.93477e-01 8.02866e+01 232.543 -4.45601e+00 -5.81623e+00 0.00000e+00 0.00000e+00 1.16839e+01 232.543 6.86027e+01 52.543  0.9290 
1 1 1 -13 97  1  o 15 5.15218e+00 1.25506e+00 4.34964e+01 255.018 -1.26769e+00 -4.73714e+00 0.00000e+00 0.00000e+00 1.28939e+02 255.018 8.54424e+01 255.018 0.8911 
1 1 1 -13 97  2  o 14 4.55503e+00 1.13904e+00 4.70827e+01 333.045 4.39299e+00  -2.23399e+00 0.00000e+00 0.00000e+00 1.05374e+02 333.045 5.82916e+01 333.045 0.8917 
1 1 1 -13 97  3  o 14 4.99228e+00 1.18013e+00 8.28494e+01 77.151  2.12577e+00  9.32008e+00  0.00000e+00 0.00000e+00 9.43270e+01 77.151  1.14776e+01 77.151  0.9462 
1 1 1 -13 97  4  o 8  2.54504e+00 8.44122e-01 3.68737e+01 263.341 -3.85731e-01 -3.30398e+00 0.00000e+00 0.00000e+00 4.24455e+01 263.341 5.57187e+00 263.341 0.8315 
1 1 1 -13 97  5  o 10 2.99927e+00 9.11213e-01 7.61917e+01 24.699  6.70594e+00  3.08425e+00  0.00000e+00 0.00000e+00 2.82249e+01 24.699  4.79669e+01 204.699 0.9296 
1 1 1 -13 97  6  f 0  2.63443e+00 8.53339e-01 2.77447e+01 193.367 -2.67894e+00 -6.36579e-01 0.00000e+00 0.00000e+00 5.01315e+01 193.367 2.23869e+01 193.367 0.7900 
1 1 1 -13 97  7  o 5  3.10192e+00 9.46943e-01 6.45537e+01 165.576 -6.97126e+00 1.79300e+00  0.00000e+00 0.00000e+00 4.30268e+01 165.576 2.15269e+01 345.576 0.9277 
1 1 1 -13 98  1  o 18 5.68894e+00 1.13733e+00 9.02216e+01 237.604 -6.94460e+00 -1.09448e+01 0.00000e+00 0.00000e+00 1.14976e+02 237.604 2.47541e+01 237.604 0.9606 
1 1 1 -13 98  2  o 18 3.18101e+00 9.80040e-01 5.93939e+01 79.608  1.02149e+00  5.57027e+00  0.00000e+00 0.00000e+00 4.88471e+01 79.608  1.05468e+01 259.608 0.9068 
1 1 1 -13 98  3  o 15 3.37912e+00 1.01187e+00 1.67366e+01 352.218 1.64492e+00  -2.24788e-01 0.00000e+00 0.00000e+00 6.35150e+01 352.218 4.67784e+01 352.218 0.6333 
1 1 1 -13 98  4  o 5  3.05460e+00 9.49229e-01 4.20855e+01 144.000 -3.31534e+00 2.40877e+00  0.00000e+00 0.00000e+00 5.71749e+01 144.000 1.50894e+01 144.000 0.8672 
1 1 1 -13 98  5  o 2  2.76362e+00 9.07244e-01 7.51704e+01 268.336 -2.11568e-01 -7.28181e+00 0.00000e+00 0.00000e+00 2.09157e+01 268.336 5.42547e+01 88.336  0.9286 
1 1 1 -13 98  6  o 6  4.40310e+00 1.12520e+00 6.95097e+01 25.914  7.28758e+00  3.54084e+00  0.00000e+00 0.00000e+00 8.46827e+01 25.914  1.51731e+01 25.914  0.9361 
1 1 1 -13 99  1  o 17 2.87579e+00 9.00276e-01 4.98585e+01 11.150  4.87149e+00  9.60133e-01  0.00000e+00 0.00000e+00 4.64960e+01 11.150  3.36243e+00 191.150 0.8926 
1 1 1 -13 99  2  o 12 2.38379e+00 7.98320e-01 3.83580e+01 251.498 -1.13148e+00 -3.38127e+00 0.00000e+00 0.00000e+00 3.71600e+01 251.498 1.19807e+00 71.498  0.8445 
1 1 1 -13 99  3  f 0  2.46546e+00 8.19477e-01 8.74969e+01 307.775 4.72226e+00  -6.09339e+00 0.00000e+00 0.00000e+00 1.28927e+00 127.775 8.87862e+01 127.775 0.9327 
1 1 1 -13 99  4  o 12 3.21091e+00 9.93922e-01 7.43202e+01 74.620  1.93737e+00  7.04334e+00  0.00000e+00 0.00000e+00 3.74013e+01 74.620  3.69189e+01 254.620 0.9288 
1 1 1 -13 99  5  o 19 2.74176e+00 8.90727e-01 1.77754e+01 14.960  1.70774e+00  4.56306e-01  0.00000e+00 0.00000e+00 4.95171e+01 14.960  3.17417e+01 14.960  0.6557 
1 1 1 -13 99  6  f 0  2.42325e+00 8.11725e-01 2.15402e+01 78.945  4.04747e-01  2.07163e+00  0.00000e+00 0.00000e+00 4.32741e+01 78.945  2.17339e+01 78.945  0.7152 
1 1 1 -13 100 1  f 0  3.99565e+00 1.11578e+00 6.88368e+01 208.783 -6.21687e+00 -3.41529e+00 0.00000e+00 0.00000e+00 7.00994e+01 208.783 1.26264e+00 208.783 0.9266 
1 1 1 -13 100 2  o 15 3.34656e+00 9.77590e-01 6.31395e+01 297.205 3.01543e+00  -5.86602e+00 0.00000e+00 0.00000e+00 5.24220e+01 297.205 1.07174e+01 117.205 0.9207 
1 1 1 -13 100 3  o 19 2.05935e+00 7.10555e-01 3.43208e+01 38.820  2.44121e+00  1.96417e+00  0.00000e+00 0.00000e+00 2.89212e+01 38.820  5.39953e+00 218.820 0.8194 
1 1 1 -13 100 4  o 12 3.11874e+00 9.76715e-01 5.52877e+01 192.221 -5.51337e+00 -1.19410e+00 0.00000e+00 0.00000e+00 5.05816e+01 192.221 4.70607e+00 12.221  0.9064 
1 1 1 -13 100 5  o 4  2.35304e+00 8.04543e-01 8.86921e+01 112.399 -3.43666e+00 8.33849e+00  0.00000e+00 0.00000e+00 5.67240e+00 292.399 9.43645e+01 292.399 0.9428 
1 1 1 -13 101 1  o 5  2.97074e+00 9.44724e-01 4.53553e+01 188.332 -4.50167e+00 -6.59311e-01 0.00000e+00 0.00000e+00 5.29227e+01 188.332 7.56744e+00 188.332 0.8818 
1 1 1 -13 101 2  o 11 2.47521e+00 8.26202e-01 2.23311e+01 180.008 -2.15126e+00 -3.00129e-04 0.00000e+00 0.00000e+00 4.45930e+01 180.008 2.22619e+01 180.008 0.7211 
1 1 1 -13 101 3  o 18 3.23632e+00 9.89479e-01 3.80455e+01 198.738 -3.75473e+00 -1.27367e+00 0.00000e+00 0.00000e+00 6.65017e+01 198.738 2.84562e+01 198.738 0.8622 
1 1 1 -13 101 4  o 15 2.58430e+00 8.48644e-01 2.15383e+01 234.199 -1.24406e+00 -1.72490e+00 0.00000e+00 0.00000e+00 4.78895e+01 234.199 2.63512e+01 234.199 0.7175 
1 1 1 -13 102 1  o 3  3.14082e+00 9.64642e-01 2.32225e+01 354.014 2.30324e+00  -2.41502e-01 0.00000e+00 0.00000e+00 6.43517e+01 354.014 4.11292e+01 354.014 0.7434 
1 1 1 -13 102 2  o 7  2.42248e+00 8.26023e-01 3.77082e+01 236.425 -1.88084e+00 -2.83355e+00 0.00000e+00 0.00000e+00 3.81822e+01 236.425 4.74006e-01 236.425 0.8358 
1 1 1 -13 102 3  o 13 3.16368e+00 9.78328e-01 5.39537e+01 41.237  4.43427e+00  3.88694e+00  0.00000e+00 0.00000e+00 5.39738e+01 41.237  2.01612e-02 41.237  0.9107 
1 1 1 -13 103 1  o 17 4.22114e+00 1.13894e+00 4.29322e+01 9.891   5.05036e+00  8.80580e-01  0.00000e+00 0.00000e+00 9.89226e+01 9.891   5.59904e+01 9.891   0.8962 
1 1 1 -13 103 2  o 17 3.57812e+00 1.03157e+00 1.10403e+02 177.968 -1.22111e+01 4.33337e-01  0.00000e+00 0.00000e+00 1.80723e+01 177.968 9.23305e+01 357.968 0.9582 
1 1 1 -13 104 1  o 1  2.30639e+00 7.82872e-01 4.42037e+01 348.768 4.38479e+00  -8.70735e-01 0.00000e+00 0.00000e+00 3.18316e+01 348.768 1.23721e+01 168.768 0.8795 
1 1 1 -13 104 2  o 11 2.70425e+00 9.08414e-01 1.28150e+01 307.122 7.80533e-01  -1.03122e+00 0.00000e+00 0.00000e+00 4.19664e+01 307.122 2.91514e+01 307.122 0.5407 
1 1 1 -13 105 1  o 5  3.16776e+00 9.91116e-01 7.19369e+01 123.659 -4.06865e+00 6.11020e+00  0.00000e+00 0.00000e+00 3.83651e+01 123.659 3.35718e+01 303.659 0.9292 
1 1 1 -12 0   1  o 3  2.10145e+01 1.21548e+00 2.88980e+02 180.000 -1.03321e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.09032e+02 180.000 2.20053e+02 180.000 1.0000 
1 1 1 -12 0   2  o 14 1.14013e+01 1.70129e+00 3.03484e+02 180.000 -5.61698e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.29213e+02 180.000 1.74271e+02 0.000   1.0000 
1 1 1 -12 0   3  o 19 2.19478e+01 1.19890e+00 2.23527e+02 180.000 -9.40643e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.08916e+02 180.000 3.85389e+02 180.000 1.0000 
1 1 1 -12 0   4  o 5  2.15417e+01 1.21255e+00 3.47718e+02 0.000   1.56093e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.68752e+02 0.000   1.21034e+02 0.000   1.0000 
1 1 1 -12 0   5  o 4  1.13327e+01 1.66467e+00 2.20067e+02 0.000   5.55056e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.09123e+02 0.000   1.09441e+01 180.000 1.0000 
1 1 1 -12 0   6  o 19 1.48414e+01 1.45817e+00 2.86279e+02 180.000 -1.18255e+01 0.00000e+00  0.00000e+00 0.00000e+00 2.75352e+02 180.000 1.09269e+01 0.000   1.0000 
1 1 1 -12 0   7  o 4  1.15593e+01 1.76164e+00 1.68174e+02 180.000 -5.35000e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.68850e+02 180.000 1.00677e+02 180.000 1.0000 
1 1 1 -12 0   8  o 19 1.32867e+01 1.44436e+00 1.69328e+02 0.000   7.57462e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.32552e+02 0.000   1.63224e+02 0.000   1.0000 
1 1 1 -12 0   9  f 0  9.17046e+00 1.98361e+00 1.41777e+02 180.000 -4.67769e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.04213e+02 180.000 6.24361e+01 180.000 0.9998 
1 1 1 -12 0   10 o 2  2.90562e+00 1.87970e+00 1.96325e+00 0.000   2.39974e-02  0.00000e+00  0.00000e+00 0.00000e+00 6.64632e-01 0.000   1.29862e+00 180.000 0.0240 
1 1 1 -12 0   11 o 1  3.46056e+00 2.07376e+00 1.21730e+02 0.000   1.80577e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.71591e+00 0.000   1.20014e+02 180.000 0.9474 
1 1 1 -12 0   12 o 1  5.99963e+00 2.40058e+00 7.10096e+01 180.000 -1.80276e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.42687e+02 180.000 7.16774e+01 180.000 0.9471 
1 1 1 -12 0   13 o 8  4.47881e+00 2.35129e+00 1.10371e+02 0.000   2.32974e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.47021e+01 0.000   5.56685e+01 180.000 0.9812 
1 1 1 -12 0   14 o 12 2.02278e+01 1.32430e+00 3.25760e+02 180.000 -5.21644e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.33029e+02 180.000 1.07269e+02 180.000 1.0000 
1 1 1 -12 0   15 f 0  1.79018e+00 1.28103e+00 2.54486e+01 0.000   3.84158e-01  0.00000e+00  0.00000e+00 0.00000e+00 8.83102e-01 180.000 2.63317e+01 180.000 0.3663 
1 1 1 -12 0   16 o 7  2.63315e+00 1.72179e+00 6.37155e+01 0.000   1.36232e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.26612e+01 0.000   4.10544e+01 180.000 0.8769 
1 1 1 -12 0   17 o 11 1.33565e+01 1.42673e+00 2.34064e+02 0.000   3.48195e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.64819e+02 0.000   3.07542e+01 0.000   1.0000 
1 1 1 -12 0   18 o 5  2.29537e+00 1.59186e+00 4.81908e+01 180.000 -1.19293e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.29862e+01 180.000 2.52046e+01 0.000   0.8315 
1 1 1 -12 1   1  o 11 2.69465e+01 8.44103e-01 3.66178e+02 126.563 -2.00343e+01 2.70128e+01  0.00000e+00 0.00000e+00 6.41765e+02 126.563 2.75588e+02 126.563 0.9850 
1 1 1 -12 1   2  o 7  2.97255e+01 8.63323e-01 5.93751e+02 197.096 -5.72438e+01 -1.76060e+01 0.00000e+00 0.00000e+00 5.24947e+02 197.096 6.88037e+01 17.096  0.9916 
1 1 1 -12 1   3  o 16 5.20225e+00 1.43311e+00 1.59933e+02 304.166 1.63313e+00  -2.40617e+00 0.00000e+00 0.00000e+00 1.50106e+00 124.166 1.61434e+02 124.166 0.8030 
1 1 1 -12 1   4  o 4  1.75007e+01 8.95110e-01 2.00336e+02 12.298  1.42022e+01  3.09610e+00  0.00000e+00 0.00000e+00 4.39732e+02 12.298  2.39395e+02 12.298  0.9650 
1 1 1 -12 1   5  o 6  1.14002e+01 1.40024e+00 3.22388e+02 104.534 -3.91547e+00 1.51033e+01  0.00000e+00 0.00000e+00 9.52983e+01 104.534 2.27090e+02 284.534 0.9674 
1 1 1 -12 1   6  o 7  7.88290e+00 1.44041e+00 1.01585e+02 212.910 -3.38178e+00 -2.18863e+00 0.00000e+00 0.00000e+00 1.56329e+02 212.910 5.47435e+01 212.910 0.8646 
1 1 1 -12 1   7  o 14 7.36676e+00 1.50950e+00 1.22477e+02 241.550 -2.19941e+00 -4.05925e+00 0.00000e+00 0.00000e+00 1.23649e+02 241.550 1.17180e+00 241.550 0.8837 
1 1 1 -12 1   8  o 6  4.93521e+00 1.33695e+00 8.23990e+01 290.910 8.92724e-01  -2.33663e+00 0.00000e+00 0.00000e+00 6.02381e+01 290.910 2.21609e+01 110.910 0.7651 
1 1 1 -12 1   9  o 12 7.32501e+00 1.36902e+00 9.52193e+01 225.066 -3.58998e+00 -3.59827e+00 0.00000e+00 0.00000e+00 1.52243e+02 225.066 5.70239e+01 225.066 0.8953 
1 1 1 -12 1   10 o 17 9.34393e+00 1.22924e+00 9.89966e+01 77.687  1.72974e+00  7.92468e+00  0.00000e+00 0.00000e+00 2.30738e+02 77.687  1.31742e+02 77.687  0.9362 
1 1 1 -12 1   11 o 16 1.60537e+01 9.44108e-01 2.67262e+02 210.062 -3.99533e+01 -2.31250e+01 0.00000e+00 0.00000e+00 3.30620e+02 210.062 6.33573e+01 210.062 0.9891 
1 1 1 -12 1   12 o 14 1.10843e+01 1.12549e+00 2.95888e+02 69.979  1.27886e+01  3.50971e+01  0.00000e+00 0.00000e+00 1.15353e+02 69.979  1.80536e+02 249.979 0.9865 
1 1 1 -12 1   13 o 14 1.78564e+01 9.47758e-01 3.67297e+02 197.393 -8.80923e+01 -2.75948e+01 0.00000e+00 0.00000e+00 2.99766e+02 197.393 6.75306e+01 17.393  0.9946 
1 1 1 -12 1   14 o 3  4.29791e+00 1.23587e+00 1.79779e+01 249.607 -3.57270e-01 -9.61021e-01 0.00000e+00 0.00000e+00 5.54233e+01 249.607 3.74454e+01 249.607 0.4553 
1 1 1 -12 1   15 o 11 3.98645e+00 1.19239e+00 1.29855e+02 31.923  6.22704e+00  3.87944e+00  0.00000e+00 0.00000e+00 8.89348e+00 31.923  1.20962e+02 211.923 0.9291 
1 1 1 -12 1   16 o 7  3.26766e+00 1.06062e+00 3.84999e+01 316.490 1.66216e+00  -1.57785e+00 0.00000e+00 0.00000e+00 5.19928e+01 316.490 1.34929e+01 316.490 0.7403 
1 1 1 -12 1   17 o 16 3.37250e+00 1.05204e+00 5.28641e+01 226.923 -2.61545e+00 -2.79719e+00 0.00000e+00 0.00000e+00 5.50435e+01 226.923 2.17940e+00 226.923 0.8566 
1 1 1 -12 1   18 o 2  7.91759e+00 1.48048e+00 1.70081e+02 105.258 -5.57139e+00 2.04244e+01  0.00000e+00 0.00000e+00 1.18133e+02 105.258 5.19486e+01 285.258 0.9761 
1 1 1 -12 2   1  o 14 2.18840e+01 8.55133e-01 2.85352e+02 304.879 1.21549e+01  -1.74373e+01 0.00000e+00 0.00000e+00 5.25882e+02 304.879 2.40530e+02 304.879 0.9762 
1 1 1 -12 2   2  o 9  1.57918e+01 9.58575e-01 1.80419e+02 335.407 8.69271e+00  -3.97855e+00 0.00000e+00 0.00000e+00 3.86647e+02 335.407 2.06228e+02 335.407 0.9462 
1 1 1 -12 2   3  f 0  1.89028e+01 8.93267e-01 4.83164e+02 264.993 -3.03881e+00 -3.46832e+01 0.00000e+00 0.00000e+00 2.23412e+02 264.993 2.59752e+02 84.993  0.9855 
1 1 1 -12 2   4  o 1  2.30160e+01 8.26861e-01 3.77865e+02 142.527 -2.88785e+01 2.21378e+01  0.00000e+00 0.00000e+00 4.82409e+02 142.527 1.04543e+02 142.527 0.9862 
1 1 1 -12 2   5  o 12 2.11063e+01 8.59355e-01 5.25681e+02 339.149 4.88077e+01  -1.85898e+01 0.00000e+00 0.00000e+00 2.65986e+02 339.149 2.59695e+02 159.149 0.9904 
1 1 1 -12 2   6  o 10 9.55725e+00 1.34659e+00 2.70403e+02 293.794 5.37807e+00  -1.21970e+01 0.00000e+00 0.00000e+00 7.74192e+01 293.794 1.92984e+02 113.794 0.9617 
1 1 1 -12 2   7  o 15 1.38574e+01 1.08158e+00 2.54474e+02 103.375 -4.67507e+00 1.96613e+01  0.00000e+00 0.00000e+00 2.56321e+02 103.375 1.84739e+00 103.375 0.9749 
1 1 1 -12 2   8  o 2  2.15343e+01 8.53196e-01 3.58929e+02 135.771 -3.88438e+01 3.78124e+01  0.00000e+00 0.00000e+00 4.46947e+02 135.771 8.80180e+01 135.771 0.9907 
1 1 1 -12 2   9  f 0  1.38993e+01 9.90582e-01 1.62575e+02 213.748 -1.56070e+01 -1.04274e+01 0.00000e+00 0.00000e+00 3.47747e+02 213.748 1.85172e+02 213.748 0.9730 
1 1 1 -12 2   10 o 11 4.65816e+00 1.32359e+00 1.45434e+02 27.571  5.06382e+00  2.64407e+00  0.00000e+00 0.00000e+00 1.39392e+01 27.571  1.31495e+02 207.571 0.9076 
1 1 1 -12 2   11 o 16 6.81031e+00 1.39839e+00 1.70835e+02 154.984 -9.33124e+00 4.35444e+00  0.00000e+00 0.00000e+00 7.28024e+01 154.984 9.80324e+01 334.984 0.9501 
1 1 1 -12 2   12 o 14 4.44923e+00 1.26077e+00 5.57987e+01 321.042 2.05648e+00  -1.66280e+00 0.00000e+00 0.00000e+00 7.46914e+01 321.042 1.88927e+01 321.042 0.7799 
1 1 1 -12 2   13 o 18 6.01267e+00 1.29655e+00 9.93623e+01 236.031 -3.89266e+00 -5.77794e+00 0.00000e+00 0.00000e+00 1.09578e+02 236.031 1.02155e+01 236.031 0.9252 
1 1 1 -12 2   14 o 9  6.31244e+00 1.33024e+00 9.35166e+01 64.716  3.15529e+00  6.67978e+00  0.00000e+00 0.00000e+00 1.26610e+02 64.716  3.30933e+01 64.716  0.9296 
1 1 1 -12 2   15 o 12 7.04713e+00 1.36337e+00 2.07415e+02 10.799  1.82329e+01  3.47787e+00  0.00000e+00 0.00000e+00 4.93626e+01 10.799  1.58052e+02 190.799 0.9727 
1 1 1 -12 2   16 o 7  3.68001e+00 1.16230e+00 6.56721e+01 235.626 -2.30782e+00 -3.37373e+00 0.00000e+00 0.00000e+00 5.36511e+01 235.626 1.20210e+01 55.626  0.8668 
1 1 1 -12 2   17 o 2  6.49668e+00 1.38292e+00 1.09362e+02 238.998 -5.94029e+00 -9.88545e+00 0.00000e+00 0.00000e+00 1.22526e+02 238.998 1.31639e+01 238.998 0.9556 
1 1 1 -12 2   18 o 5  5.83006e+00 1.42389e+00 1.17118e+02 323.197 9.02988e+00  -6.75593e+00 0.00000e+00 0.00000e+00 9.04288e+01 323.197 2.66889e+01 143.197 0.9546 
1 1 1 -12 3   1  o 9  1.36687e+01 9.79819e-01 2.65170e+02 93.901  -8.26945e-01 1.21267e+01  0.00000e+00 0.00000e+00 2.32050e+02 93.901  3.31197e+01 273.901 0.9579 
1 1 1 -12 3   2  o 1  8.98475e+00 1.22844e+00 2.18373e+02 21.932  5.88446e+00  2.36938e+00  0.00000e+00 0.00000e+00 9.44458e+01 21.932  1.23928e+02 201.932 0.9174 
1 1 1 -12 3   3  o 8  2.54325e+01 8.48848e-01 4.43287e+02 81.836  6.74469e+00  4.70157e+01  0.00000e+00 0.00000e+00 5.11106e+02 81.836  6.78185e+01 81.836  0.9894 
1 1 1 -12 3   4  o 7  6.11558e+00 1.48154e+00 1.06792e+02 257.317 -5.51052e-01 -2.44856e+00 0.00000e+00 0.00000e+00 7.07719e+01 257.317 3.60204e+01 77.317  0.7661 
1 1 1 -12 3   5  o 4  7.24687e+00 1.41227e+00 8.19595e+01 88.819  5.17977e-02  2.51342e+00  0.00000e+00 0.00000e+00 1.28414e+02 88.819  4.64548e+01 88.819  0.7665 
1 1 1 -12 3   6  o 13 1.92889e+01 9.05763e-01 4.57599e+02 138.945 -3.80076e+01 3.31031e+01  0.00000e+00 0.00000e+00 2.65048e+02 138.945 1.92552e+02 318.945 0.9900 
1 1 1 -12 3   7  o 5  1.99560e+01 9.00118e-01 3.18162e+02 45.460  2.65516e+01  2.69811e+01  0.00000e+00 0.00000e+00 4.26308e+02 45.460  1.08146e+02 45.460  0.9867 
1 1 1 -12 3   8  o 6  6.69811e+00 1.38379e+00 9.10845e+01 330.714 3.22434e+00  -1.80835e+00 0.00000e+00 0.00000e+00 1.24163e+02 330.714 3.30785e+01 330.714 0.8508 
1 1 1 -12 3   9  o 3  9.47084e+00 1.16714e+00 1.51888e+02 287.280 3.34864e+00  -1.07647e+01 0.00000e+00 0.00000e+00 1.89254e+02 287.280 3.73667e+01 287.280 0.9546 
1 1 1 -12 3   10 o 4  5.11378e+00 1.25709e+00 1.51337e+02 130.192 -4.32899e+00 5.12405e+00  0.00000e+00 0.00000e+00 2.64129e+01 130.192 1.24924e+02 310.192 0.9221 
1 1 1 -12 3   11 o 13 4.74310e+00 1.30246e+00 1.02730e+02 21.470  4.37994e+00  1.72267e+00  0.00000e+00 0.00000e+00 5.55173e+01 21.470  4.72131e+01 201.470 0.8861 
1 1 1 -12 3   12 o 10 5.10088e+00 1.26864e+00 9.90267e+01 103.918 -1.32771e+00 5.35777e+00  0.00000e+00 0.00000e+00 7.44259e+01 103.918 2.46008e+01 283.918 0.9042 
1 1 1 -12 3   13 o 11 3.63759e+00 1.11616e+00 5.30032e+01 40.358  1.89359e+00  1.60919e+00  0.00000e+00 0.00000e+00 5.12946e+01 40.358  1.70864e+00 220.358 0.7634 
1 1 1 -12 3   14 o 12 3.41507e+00 1.08893e+00 5.75496e+01 14.515  2.75884e+00  7.14249e-01  0.00000e+00 0.00000e+00 4.47085e+01 14.515  1.28411e+01 194.515 0.7982 
1 1 1 -12 3   15 o 8  3.23147e+00 1.04082e+00 8.05597e+01 289.568 1.35751e+00  -3.81903e+00 0.00000e+00 0.00000e+00 2.42149e+01 289.568 5.63447e+01 109.568 0.8655 
1 1 1 -12 3   16 o 19 9.10424e+00 1.27174e+00 2.32135e+02 196.388 -3.16249e+01 -9.30032e+00 0.00000e+00 0.00000e+00 1.03219e+02 196.388 1.28916e+02 16.388  0.9847 
1 1 1 -12 3   17 o 13 4.79509e+00 1.29253e+00 8.37549e+01 18.828  6.65797e+00  2.27021e+00  0.00000e+00 0.00000e+00 8.20775e+01 18.828  1.67743e+00 198.828 0.9259 
1 1 1 -12 3   18 o 15 4.06737e+00 1.22191e+00 2.38230e+01 66.540  7.62597e-01  1.75720e+00  0.00000e+00 0.00000e+00 7.98392e+01 66.540  5.60162e+01 66.540  0.6834 
1 1 1 -12 4   1  o 2  3.22129e+01 8.72105e-01 5.80484e+02 146.216 -5.27729e+01 3.53072e+01  0.00000e+00 0.00000e+00 6.33081e+02 146.216 5.25965e+01 146.216 0.9921 
1 1 1 -12 4   2  o 3  1.67393e+01 9.19962e-01 4.04342e+02 168.877 -2.23757e+01 4.39912e+00  0.00000e+00 0.00000e+00 2.16854e+02 168.877 1.87488e+02 348.877 0.9778 
1 1 1 -12 4   3  o 1  1.10240e+01 1.19973e+00 1.99072e+02 208.888 -7.65293e+00 -4.22252e+00 0.00000e+00 0.00000e+00 1.94341e+02 208.888 4.73180e+00 28.888  0.9409 
1 1 1 -12 4   4  o 14 1.81113e+01 9.14111e-01 1.76917e+02 188.573 -1.35095e+01 -2.03666e+00 0.00000e+00 0.00000e+00 4.83899e+02 188.573 3.06982e+02 188.573 0.9627 
1 1 1 -12 4   5  o 19 7.01475e+00 1.42710e+00 3.46554e+01 326.810 8.57976e-01  -5.61229e-01 0.00000e+00 0.00000e+00 8.62909e+01 326.810 5.16355e+01 326.810 0.4553 
1 1 1 -12 4   6  f 0  1.13816e+01 1.17805e+00 1.61528e+02 81.287  1.49801e+00  9.77464e+00  0.00000e+00 0.00000e+00 2.46773e+02 81.287  8.52450e+01 81.287  0.9480 
1 1 1 -12 4   7  o 11 1.35775e+01 1.04445e+00 2.39054e+02 296.325 8.31621e+00  -1.68077e+01 0.00000e+00 0.00000e+00 2.60401e+02 296.325 2.13472e+01 296.325 0.9730 
1 1 1 -12 4   8  o 8  3.06224e+01 9.08289e-01 5.18520e+02 99.926  -1.89428e+01 1.08245e+02  0.00000e+00 0.00000e+00 6.32885e+02 99.926  1.14364e+02 99.926  0.9954 
1 1 1 -12 4   9  o 10 1.14543e+01 1.07351e+00 2.87362e+02 284.131 6.49770e+00  -2.58090e+01 0.00000e+00 0.00000e+00 1.36661e+02 284.131 1.50701e+02 104.131 0.9810 
1 1 1 -12 4   10 o 11 1.21982e+01 1.00261e+00 2.14494e+02 258.640 -4.92897e+00 -2.45340e+01 0.00000e+00 0.00000e+00 2.36027e+02 258.640 2.15327e+01 258.640 0.9798 
1 1 1 -12 4   11 o 9  6.67206e+00 1.34783e+00 1.42687e+02 63.145  4.06466e+00  8.02743e+00  0.00000e+00 0.00000e+00 9.41287e+01 63.145  4.85581e+01 243.145 0.9427 
1 1 1 -12 4   12 o 19 9.61694e+00 1.23408e+00 1.89445e+02 253.688 -5.69237e+00 -1.94513e+01 0.00000e+00 0.00000e+00 1.63184e+02 253.688 2.62614e+01 73.688  0.9750 
1 1 1 -12 4   13 o 5  1.04563e+01 1.12340e+00 1.75794e+02 46.020  1.63849e+01  1.69788e+01  0.00000e+00 0.00000e+00 2.08534e+02 46.020  3.27402e+01 46.020  0.9786 
1 1 1 -12 4   14 o 19 6.99650e+00 1.28392e+00 1.33854e+02 313.140 8.24671e+00  -8.80033e+00 0.00000e+00 0.00000e+00 1.17466e+02 313.140 1.63875e+01 133.140 0.9576 
1 1 1 -12 4   15 o 8  4.96160e+00 1.28073e+00 7.26600e+01 322.224 3.81618e+00  -2.95755e+00 0.00000e+00 0.00000e+00 9.26147e+01 322.224 1.99546e+01 322.224 0.8892 
1 1 1 -12 4   16 o 1  6.07524e+00 1.35903e+00 8.84786e+01 280.297 1.40442e+00  -7.73020e+00 0.00000e+00 0.00000e+00 1.23777e+02 280.297 3.52981e+01 280.297 0.9340 
1 1 1 -12 4   17 o 5  7.92594e+00 1.37504e+00 1.21257e+02 46.467  1.08148e+01  1.13831e+01  0.00000e+00 0.00000e+00 1.65194e+02 46.467  4.39366e+01 46.467  0.9676 
1 1 1 -12 4   18 o 4  4.01670e+00 1.23067e+00 5.61924e+01 227.146 -3.01060e+00 -3.24507e+00 0.00000e+00 0.00000e+00 7.53461e+01 227.146 1.91537e+01 227.146 0.8781 
1 1 1 -12 5   1  o 11 8.49663e+00 1.37609e+00 4.03635e+01 6.906   1.07699e+00  1.30454e-01  0.00000e+00 0.00000e+00 1.13102e+02 6.906   7.27387e+01 6.906   0.4757 
1 1 1 -12 5   2  o 17 1.47132e+01 9.49898e-01 3.31659e+02 46.562  1.12594e+01  1.18909e+01  0.00000e+00 0.00000e+00 2.09396e+02 46.562  1.22262e+02 226.562 0.9690 
1 1 1 -12 5   3  o 6  1.89314e+01 8.83753e-01 3.22962e+02 285.893 7.01418e+00  -2.46342e+01 0.00000e+00 0.00000e+00 3.80890e+02 285.893 5.79278e+01 285.893 0.9803 
1 1 1 -12 5   4  o 18 2.48374e+01 8.54905e-01 3.76709e+02 100.799 -7.53547e+00 3.95067e+01  0.00000e+00 0.00000e+00 5.52866e+02 100.799 1.76157e+02 100.799 0.9875 
1 1 1 -12 5   5  o 1  1.54224e+01 9.51930e-01 1.91545e+02 49.675  8.85911e+00  1.04371e+01  0.00000e+00 0.00000e+00 3.70777e+02 49.675  1.79232e+02 49.675  0.9628 
1 1 1 -12 5   6  o 17 1.33590e+01 1.05067e+00 2.10085e+02 98.238  -2.22661e+00 1.53786e+01  0.00000e+00 0.00000e+00 2.78882e+02 98.238  6.87964e+01 98.238  0.9673 
1 1 1 -12 5   7  o 9  1.47956e+01 9.83827e-01 3.48399e+02 231.427 -1.88152e+01 -2.35921e+01 0.00000e+00 0.00000e+00 2.01638e+02 231.427 1.46762e+02 51.427  0.9833 
1 1 1 -12 5   8  o 14 7.69931e+00 1.43924e+00 1.00449e+02 12.193  4.49723e+00  9.71794e-01  0.00000e+00 0.00000e+00 1.56408e+02 12.193  5.59591e+01 12.193  0.8832 
1 1 1 -12 5   9  o 10 1.67399e+01 9.12978e-01 2.53994e+02 126.037 -2.12518e+01 2.92111e+01  0.00000e+00 0.00000e+00 3.68864e+02 126.037 1.14870e+02 126.037 0.9861 
1 1 1 -12 5   10 o 18 6.69849e+00 1.37821e+00 1.03633e+02 88.369  1.62662e-01  5.71396e+00  0.00000e+00 0.00000e+00 1.25557e+02 88.369  2.19247e+01 88.369  0.9077 
1 1 1 -12 5   11 o 9  3.15365e+00 1.03260e+00 3.11919e+01 325.099 8.79834e-01  -6.13804e-01 0.00000e+00 0.00000e+00 2.48040e+01 325.099 6.38792e+00 145.099 0.4716 
1 1 1 -12 5   12 o 8  1.31672e+01 1.05487e+00 2.76180e+02 80.631  7.20260e+00  4.36537e+01  0.00000e+00 0.00000e+00 2.13368e+02 80.631  6.28120e+01 260.631 0.9886 
1 1 1 -12 5   13 o 7  4.09096e+00 1.20177e+00 1.21792e+02 275.325 5.68466e-01  -6.09911e+00 0.00000e+00 0.00000e+00 1.86912e+01 275.325 1.03101e+02 95.325  0.9143 
1 1 1 -12 5   14 o 14 7.36108e+00 1.32409e+00 1.45294e+02 84.515  1.28394e+00  1.33700e+01  0.00000e+00 0.00000e+00 1.20340e+02 84.515  2.49543e+01 264.515 0.9620 
1 1 1 -12 5   15 o 3  8.67765e+00 1.21524e+00 1.52777e+02 220.218 -1.41350e+01 -1.19525e+01 0.00000e+00 0.00000e+00 1.63377e+02 220.218 1.05999e+01 220.218 0.9726 
1 1 1 -12 5   16 o 17 9.31761e+00 1.24828e+00 1.46244e+02 203.598 -1.98124e+01 -8.65493e+00 0.00000e+00 0.00000e+00 1.94131e+02 203.598 4.78867e+01 203.598 0.9766 
1 1 1 -12 5   17 o 14 4.50480e+00 1.26101e+00 7.80535e+01 21.508  5.88321e+00  2.31845e+00  0.00000e+00 0.00000e+00 7.62549e+01 21.508  1.79862e+00 201.508 0.9171 
1 1 1 -12 5   18 o 5  4.71668e+00 1.34865e+00 8.96696e+01 243.835 -3.29100e+00 -6.69847e+00 0.00000e+00 0.00000e+00 7.39779e+01 243.835 1.56918e+01 63.835  0.9304 
1 1 1 -12 6   1  o 9  2.13886e+01 8.73484e-01 4.86638e+02 202.629 -3.25887e+01 -1.35848e+01 0.00000e+00 0.00000e+00 3.13953e+02 202.629 1.72684e+02 22.629  0.9857 
1 1 1 -12 6   2  o 3  8.81147e+00 1.33123e+00 1.60837e+02 55.186  2.89175e+00  4.15851e+00  0.00000e+00 0.00000e+00 1.38409e+02 55.186  2.24275e+01 235.186 0.8949 
1 1 1 -12 6   3  o 14 7.22716e+00 1.45360e+00 1.75118e+02 29.271  4.18021e+00  2.34305e+00  0.00000e+00 0.00000e+00 6.83726e+01 29.271  1.06746e+02 209.271 0.8883 
1 1 1 -12 6   4  f 0  1.99846e+01 8.90705e-01 2.52027e+02 187.280 -2.13566e+01 -2.72832e+00 0.00000e+00 0.00000e+00 4.87587e+02 187.280 2.35559e+02 187.280 0.9765 
1 1 1 -12 6   5  o 15 1.41816e+01 9.94677e-01 3.18789e+02 288.648 6.51819e+00  -1.93151e+01 0.00000e+00 0.00000e+00 2.04944e+02 288.648 1.13845e+02 108.648 0.9752 
1 1 1 -12 6   6  o 8  9.99765e+00 1.58748e+00 1.80273e+02 275.750 8.70178e-01  -8.64242e+00 0.00000e+00 0.00000e+00 1.75547e+02 275.750 4.72531e+00 95.750  0.9405 
1 1 1 -12 6   7  o 3  1.18128e+01 1.11583e+00 1.98061e+02 276.162 1.42569e+00  -1.32061e+01 0.00000e+00 0.00000e+00 2.31391e+02 276.162 3.33299e+01 276.162 0.9616 
1 1 1 -12 6   8  o 5  5.45615e+00 1.43238e+00 8.65702e+01 60.385  1.39114e+00  2.44733e+00  0.00000e+00 0.00000e+00 7.73358e+01 60.385  9.23439e+00 240.385 0.7953 
1 1 1 -12 6   9  o 18 6.91312e+00 1.35994e+00 1.28831e+02 196.005 -6.25248e+00 -1.79350e+00 0.00000e+00 0.00000e+00 1.11039e+02 196.005 1.77925e+01 16.005  0.9195 
1 1 1 -12 6   10 o 12 1.09243e+01 1.18294e+00 1.68205e+02 66.449  6.46736e+00  1.48375e+01  0.00000e+00 0.00000e+00 2.30640e+02 66.449  6.24350e+01 66.449  0.9686 
1 1 1 -12 6   11 o 7  7.90123e+00 1.30862e+00 4.03213e+01 299.168 1.49474e+00  -2.67799e+00 0.00000e+00 0.00000e+00 2.02076e+02 299.168 1.61755e+02 299.168 0.8148 
1 1 1 -12 6   12 o 8  1.88970e+01 9.56033e-01 2.89805e+02 316.689 5.07822e+01  -4.78731e+01 0.00000e+00 0.00000e+00 4.15733e+02 316.689 1.25928e+02 316.689 0.9928 
1 1 1 -12 6   13 o 15 6.01856e+00 1.23702e+00 8.17795e+01 321.568 4.62328e+00  -3.66861e+00 0.00000e+00 0.00000e+00 1.24112e+02 321.568 4.23325e+01 321.568 0.9108 
1 1 1 -12 6   14 o 19 8.28567e+00 1.26454e+00 1.23777e+02 263.789 -1.44577e+00 -1.32840e+01 0.00000e+00 0.00000e+00 1.75156e+02 263.789 5.13789e+01 263.789 0.9618 
1 1 1 -12 6   15 o 16 4.20690e+00 1.19402e+00 8.04552e+01 299.825 2.38184e+00  -4.15470e+00 0.00000e+00 0.00000e+00 5.95205e+01 299.825 2.09347e+01 119.825 0.8882 
1 1 1 -12 6   16 o 18 3.61108e+00 1.14132e+00 4.41047e+01 134.820 -1.92696e+00 1.93911e+00  0.00000e+00 0.00000e+00 6.23603e+01 134.820 1.82557e+01 134.820 0.7882 
1 1 1 -12 6   17 o 15 4.07972e+00 1.23170e+00 5.82612e+01 142.807 -3.49026e+00 2.64861e+00  0.00000e+00 0.00000e+00 7.53330e+01 142.807 1.70718e+01 142.807 0.8767 
1 1 1 -12 6   18 o 9  3.26189e+00 1.06897e+00 4.65859e+01 307.386 2.24463e+00  -2.93737e+00 0.00000e+00 0.00000e+00 5.69017e+01 307.386 1.03158e+01 307.386 0.8508 
1 1 1 -12 7   1  o 8  8.41371e+00 1.36157e+00 1.60808e+02 289.264 1.41401e+00  -4.04602e+00 0.00000e+00 0.00000e+00 1.18319e+02 289.264 4.24894e+01 109.264 0.8737 
1 1 1 -12 7   2  o 2  6.50900e+00 1.42115e+00 9.23489e+01 302.848 1.14541e+00  -1.77406e+00 0.00000e+00 0.00000e+00 8.43392e+01 302.848 8.00965e+00 122.848 0.7153 
1 1 1 -12 7   3  o 9  3.12377e+01 8.83551e-01 5.70024e+02 13.245  7.25207e+01  1.70694e+01  0.00000e+00 0.00000e+00 6.06712e+02 13.245  3.66875e+01 13.245  0.9933 
1 1 1 -12 7   4  o 9  2.93304e+01 8.70716e-01 5.59049e+02 236.964 -3.82986e+01 -5.88948e+01 0.00000e+00 0.00000e+00 5.44615e+02 236.964 1.44338e+01 56.965  0.9929 
1 1 1 -12 7   5  o 9  1.59812e+01 9.53347e-01 2.40004e+02 187.799 -1.72411e+01 -2.36147e+00 0.00000e+00 0.00000e+00 3.47558e+02 187.799 1.07555e+02 187.799 0.9708 
1 1 1 -12 7   6  o 18 1.57519e+01 9.53260e-01 3.65615e+02 7.818   3.22157e+01  4.42348e+00  0.00000e+00 0.00000e+00 2.21193e+02 7.818   1.44422e+02 187.818 0.9845 
1 1 1 -12 7   7  o 15 1.11853e+01 1.14167e+00 1.53642e+02 103.978 -2.55078e+00 1.02470e+01  0.00000e+00 0.00000e+00 2.48681e+02 103.978 9.50385e+01 103.978 0.9514 
1 1 1 -12 7   8  o 3  1.57947e+01 9.52803e-01 3.08406e+02 348.622 3.44214e+01  -6.92705e+00 0.00000e+00 0.00000e+00 2.79611e+02 348.622 2.87948e+01 168.622 0.9857 
1 1 1 -12 7   9  o 11 5.36278e+00 1.38348e+00 9.47051e+01 189.766 -3.62168e+00 -6.23349e-01 0.00000e+00 0.00000e+00 7.72430e+01 189.766 1.74621e+01 9.766   0.8497 
1 1 1 -12 7   10 o 3  1.73932e+01 9.06719e-01 3.70572e+02 344.969 6.06186e+01  -1.62784e+01 0.00000e+00 0.00000e+00 2.79781e+02 344.969 9.07909e+01 164.969 0.9920 
1 1 1 -12 7   11 o 5  8.83804e+00 1.27460e+00 8.89702e+01 101.500 -1.53323e+00 7.53588e+00  0.00000e+00 0.00000e+00 2.21328e+02 101.500 1.32358e+02 101.500 0.9325 
1 1 1 -12 7   12 o 12 9.17905e+00 1.27032e+00 1.17514e+02 178.041 -1.17632e+01 4.02410e-01  0.00000e+00 0.00000e+00 2.12664e+02 178.041 9.51497e+01 178.041 0.9565 
1 1 1 -12 7   13 o 19 8.36410e+00 1.24651e+00 1.59681e+02 289.843 5.40651e+00  -1.49817e+01 0.00000e+00 0.00000e+00 1.44436e+02 289.843 1.52452e+01 109.843 0.9681 
1 1 1 -12 7   14 o 8  4.95497e+00 1.21972e+00 1.08932e+02 39.775  5.55500e+00  4.62416e+00  0.00000e+00 0.00000e+00 6.35433e+01 39.775  4.53891e+01 219.775 0.9280 
1 1 1 -12 7   15 f 0  5.05199e+00 1.34205e+00 1.12113e+02 185.511 -7.55611e+00 -7.29053e-01 0.00000e+00 0.00000e+00 6.41805e+01 185.511 4.79326e+01 5.511   0.9316 
1 1 1 -12 7   16 o 4  1.12932e+01 1.09901e+00 2.15158e+02 131.880 -2.75196e+01 3.06923e+01  0.00000e+00 0.00000e+00 2.02106e+02 131.880 1.30515e+01 311.880 0.9878 
1 1 1 -12 7   17 o 8  3.97208e+00 1.19659e+00 1.90028e+01 110.319 -4.97651e-01 1.34395e+00  0.00000e+00 0.00000e+00 6.69176e+01 110.319 4.79147e+01 110.319 0.5792 
1 1 1 -12 7   18 o 6  4.79709e+00 1.35226e+00 8.64511e+01 259.051 -1.46129e+00 -7.55381e+00 0.00000e+00 0.00000e+00 8.03706e+01 259.051 6.08043e+00 79.051  0.9325 
1 1 1 -12 8   1  o 14 1.39893e+01 1.02814e+00 2.39525e+02 233.908 -6.56331e+00 -9.00329e+00 0.00000e+00 0.00000e+00 2.67231e+02 233.908 2.77062e+01 233.908 0.9540 
1 1 1 -12 8   2  o 4  1.55537e+01 9.19766e-01 4.24744e+02 38.053  1.98126e+01  1.55091e+01  0.00000e+00 0.00000e+00 1.53656e+02 38.053  2.71087e+02 218.053 0.9799 
1 1 1 -12 8   3  o 7  9.24819e+00 1.33449e+00 9.84680e+01 216.021 -2.85304e+00 -2.07449e+00 0.00000e+00 0.00000e+00 1.97038e+02 216.021 9.85703e+01 216.021 0.8425 
1 1 1 -12 8   4  o 14 7.97087e+00 1.48947e+00 2.28032e+02 73.405  1.98718e+00  6.66804e+00  0.00000e+00 0.00000e+00 5.14138e+01 73.405  1.76618e+02 253.405 0.9251 
1 1 1 -12 8   5  o 19 1.02357e+01 1.21498e+00 1.64030e+02 116.308 -3.21669e+00 6.50610e+00  0.00000e+00 0.00000e+00 1.95804e+02 116.308 3.17742e+01 116.308 0.9283 
1 1 1 -12 8   6  o 16 1.85633e+01 8.97615e-01 2.64671e+02 144.085 -2.27020e+01 1.64425e+01  0.00000e+00 0.00000e+00 4.25095e+02 144.085 1.60425e+02 144.085 0.9820 
1 1 1 -12 8   7  o 16 1.54665e+01 9.71024e-01 2.76072e+02 295.203 1.16532e+01  -2.47608e+01 0.00000e+00 0.00000e+00 2.97859e+02 295.203 2.17873e+01 295.203 0.9816 
1 1 1 -12 8   8  o 19 1.24601e+01 1.08173e+00 1.65547e+02 294.439 5.93636e+00  -1.30628e+01 0.00000e+00 0.00000e+00 2.88360e+02 294.439 1.22814e+02 294.439 0.9645 
1 1 1 -12 8   9  o 12 1.69959e+01 8.71381e-01 2.96845e+02 46.256  2.99464e+01  3.12885e+01  0.00000e+00 0.00000e+00 3.36997e+02 46.256  4.01524e+01 46.256  0.9884 
1 1 1 -12 8   10 o 5  7.66603e+00 1.35942e+00 1.70761e+02 151.093 -9.38765e+00 5.18381e+00  0.00000e+00 0.00000e+00 1.04365e+02 151.093 6.63965e+01 331.093 0.9522 
1 1 1 -12 8   11 o 1  7.99501e+00 1.27554e+00 1.42911e+02 319.168 8.44895e+00  -7.30111e+00 0.00000e+00 0.00000e+00 1.44286e+02 319.168 1.37506e+00 319.168 0.9541 
1 1 1 -12 8   12 o 9  8.23942e+00 1.28164e+00 1.82866e+02 160.528 -1.54057e+01 5.44687e+00  0.00000e+00 0.00000e+00 1.17340e+02 160.528 6.55260e+01 340.528 0.9689 
1 1 1 -12 8   13 o 8  8.02160e+00 1.25631e+00 1.46435e+02 246.143 -5.63332e+00 -1.27381e+01 0.00000e+00 0.00000e+00 1.43814e+02 246.143 2.62075e+00 66.143  0.9634 
1 1 1 -12 8   14 o 9  1.14613e+01 1.09535e+00 1.54547e+02 67.306  9.86160e+00  2.35821e+01  0.00000e+00 0.00000e+00 2.66858e+02 67.306  1.12311e+02 67.306  0.9802 
1 1 1 -12 8   15 o 15 9.86080e+00 1.12817e+00 1.86443e+02 30.468  2.44782e+01  1.44004e+01  0.00000e+00 0.00000e+00 1.76356e+02 30.468  1.00865e+01 210.468 0.9822 
1 1 1 -12 8   16 o 9  5.10387e+00 1.30677e+00 8.87793e+01 214.268 -5.48176e+00 -3.73498e+00 0.00000e+00 0.00000e+00 8.70810e+01 214.268 1.69830e+00 34.268  0.9212 
1 1 1 -12 8   17 o 8  3.53312e+00 1.13074e+00 5.45543e+01 92.124  -1.43401e-01 3.86623e+00  0.00000e+00 0.00000e+00 5.87012e+01 92.124  4.14689e+00 92.124  0.8583 
1 1 1 -12 8   18 o 15 4.71025e+00 1.27572e+00 6.53117e+01 59.207  3.13976e+00  5.26844e+00  0.00000e+00 0.00000e+00 9.52955e+01 59.207  2.99838e+01 59.207  0.9144 
1 1 1 -12 9   1  o 6  2.78687e+01 1.06044e+00 5.82002e+02 179.270 -6.06467e+01 7.73040e-01  0.00000e+00 0.00000e+00 4.67417e+02 179.270 1.14585e+02 359.270 0.9917 
1 1 1 -12 9   2  o 18 2.21796e+01 8.46433e-01 6.05286e+02 82.683  6.56777e+00  5.11525e+01  0.00000e+00 0.00000e+00 2.28191e+02 82.683  3.77095e+02 262.683 0.9903 
1 1 1 -12 9   3  o 4  1.88872e+01 8.87555e-01 3.98556e+02 332.971 2.79931e+01  -1.42810e+01 0.00000e+00 0.00000e+00 3.06233e+02 332.971 9.23224e+01 152.971 0.9840 
1 1 1 -12 9   4  o 1  1.50343e+01 9.47448e-01 1.97324e+02 206.989 -1.11835e+01 -5.69569e+00 0.00000e+00 0.00000e+00 3.49248e+02 206.989 1.51924e+02 206.989 0.9593 
1 1 1 -12 9   5  o 12 3.46223e+01 9.17175e-01 5.38232e+02 139.064 -6.41307e+01 5.56232e+01  0.00000e+00 0.00000e+00 7.65130e+02 139.064 2.26898e+02 139.064 0.9941 
1 1 1 -12 9   6  o 5  1.88030e+01 8.81988e-01 2.49597e+02 271.380 6.23070e-01  -2.58707e+01 0.00000e+00 0.00000e+00 4.47984e+02 271.380 1.98387e+02 271.380 0.9805 
1 1 1 -12 9   7  o 2  1.27631e+01 1.07330e+00 2.08219e+02 23.911  1.51753e+01  6.72814e+00  0.00000e+00 0.00000e+00 2.59519e+02 23.911  5.13000e+01 23.911  0.9694 
1 1 1 -12 9   8  o 11 1.59292e+01 9.45847e-01 2.98205e+02 275.663 3.38086e+00  -3.40957e+01 0.00000e+00 0.00000e+00 2.94578e+02 275.663 3.62640e+00 95.663  0.9853 
1 1 1 -12 9   9  o 5  5.27957e+00 1.30199e+00 1.47283e+02 266.110 -3.93400e-01 -5.78556e+00 0.00000e+00 0.00000e+00 3.38171e+01 266.110 1.13466e+02 86.110  0.9091 
1 1 1 -12 9   10 f 0  8.00668e+00 1.32764e+00 1.65946e+02 227.604 -7.43359e+00 -8.14206e+00 0.00000e+00 0.00000e+00 1.21804e+02 227.604 4.41411e+01 47.604  0.9535 
1 1 1 -12 9   11 o 17 4.56079e+00 1.29864e+00 1.12172e+02 121.130 -2.55612e+00 4.23229e+00  0.00000e+00 0.00000e+00 4.10036e+01 121.130 7.11687e+01 301.130 0.8921 
1 1 1 -12 9   12 o 5  4.26434e+00 1.21650e+00 5.59168e+01 169.821 -2.63193e+00 4.72583e-01  0.00000e+00 0.00000e+00 6.95895e+01 169.821 1.36727e+01 169.821 0.7827 
1 1 1 -12 9   13 o 18 9.06497e+00 1.16911e+00 1.02787e+02 97.721  -1.55723e+00 1.14858e+01  0.00000e+00 0.00000e+00 2.22632e+02 97.721  1.19845e+02 97.721  0.9558 
1 1 1 -12 9   14 o 17 4.57821e+00 1.24183e+00 7.34042e+01 301.506 2.31452e+00  -3.77608e+00 0.00000e+00 0.00000e+00 7.74007e+01 301.506 3.99649e+00 301.506 0.8782 
1 1 1 -12 9   15 o 5  6.12768e+00 1.36971e+00 1.69292e+02 70.649  4.51948e+00  1.28690e+01  0.00000e+00 0.00000e+00 5.16494e+01 70.649  1.17643e+02 250.649 0.9626 
1 1 1 -12 9   16 o 14 3.05546e+00 1.01918e+00 4.55157e+01 287.331 7.42146e-01  -2.37821e+00 0.00000e+00 0.00000e+00 4.18026e+01 287.331 3.71308e+00 107.331 0.7640 
1 1 1 -12 9   17 o 14 4.06096e+00 1.22472e+00 8.94098e+01 100.788 -1.26409e+00 6.63409e+00  0.00000e+00 0.00000e+00 5.05280e+01 100.788 3.88818e+01 280.788 0.9227 
1 1 1 -12 9   18 o 16 3.98651e+00 1.15119e+00 4.29844e+01 353.770 3.82498e+00  -4.17523e-01 0.00000e+00 0.00000e+00 8.44718e+01 353.770 4.14874e+01 353.770 0.8574 
1 1 1 -12 10  1  o 19 1.39872e+01 9.99168e-01 1.51077e+02 328.799 6.81403e+00  -4.12693e+00 0.00000e+00 0.00000e+00 3.45458e+02 328.799 1.94381e+02 328.799 0.9350 
1 1 1 -12 10  2  o 3  2.65772e+01 8.53256e-01 4.62131e+02 19.674  4.43507e+01  1.58574e+01  0.00000e+00 0.00000e+00 5.35635e+02 19.674  7.35045e+01 19.674  0.9893 
1 1 1 -12 10  3  o 14 1.84115e+01 9.01046e-01 2.12828e+02 212.327 -1.37710e+01 -8.71488e+00 0.00000e+00 0.00000e+00 4.63622e+02 212.327 2.50794e+02 212.327 0.9688 
1 1 1 -12 10  4  o 16 1.85590e+01 1.02745e+00 3.33060e+02 277.267 3.41554e+00  -2.67828e+01 0.00000e+00 0.00000e+00 3.57114e+02 277.267 2.40538e+01 277.267 0.9813 
1 1 1 -12 10  5  o 4  1.73709e+01 9.01474e-01 2.93815e+02 296.562 1.04119e+01  -2.08263e+01 0.00000e+00 0.00000e+00 3.49701e+02 296.562 5.58864e+01 296.562 0.9783 
1 1 1 -12 10  6  o 7  1.11362e+01 1.19340e+00 1.73800e+02 263.541 -1.12372e+00 -9.92547e+00 0.00000e+00 0.00000e+00 2.25876e+02 263.541 5.20760e+01 263.541 0.9485 
1 1 1 -12 10  7  o 13 9.63513e+00 1.29368e+00 1.19820e+02 42.603  4.99635e+00  4.59486e+00  0.00000e+00 0.00000e+00 2.16407e+02 42.603  9.65862e+01 42.603  0.9231 
1 1 1 -12 10  8  o 14 1.04801e+01 1.19364e+00 2.27273e+02 347.998 1.56632e+01  -3.32995e+00 0.00000e+00 0.00000e+00 1.55975e+02 347.998 7.12982e+01 167.998 0.9683 
1 1 1 -12 10  9  o 11 7.86633e+00 1.22251e+00 1.16184e+02 176.696 -6.99859e+00 4.03974e-01  0.00000e+00 0.00000e+00 1.58546e+02 176.696 4.23618e+01 176.696 0.9256 
1 1 1 -12 10  10 o 4  1.07754e+01 1.14240e+00 2.40493e+02 16.317  2.22153e+01  6.50336e+00  0.00000e+00 0.00000e+00 1.56759e+02 16.317  8.37344e+01 196.317 0.9782 
1 1 1 -12 10  11 o 14 6.11514e+00 1.26921e+00 1.05942e+02 215.475 -5.35490e+00 -3.81606e+00 0.00000e+00 0.00000e+00 1.05967e+02 215.475 2.53807e-02 215.475 0.9205 
1 1 1 -12 10  12 o 16 8.83749e+00 1.18309e+00 1.85021e+02 70.031  6.10941e+00  1.68138e+01  0.00000e+00 0.00000e+00 1.37869e+02 70.031  4.71522e+01 250.031 0.9716 
1 1 1 -12 10  13 o 12 4.42737e+00 1.24906e+00 7.07533e+01 103.665 -8.80525e-01 3.62173e+00  0.00000e+00 0.00000e+00 7.09373e+01 103.665 1.83983e-01 103.665 0.8521 
1 1 1 -12 10  14 o 9  1.14966e+01 1.10595e+00 1.35816e+02 324.681 1.82204e+01  -1.29097e+01 0.00000e+00 0.00000e+00 2.85619e+02 324.681 1.49804e+02 324.681 0.9773 
1 1 1 -12 10  15 o 2  6.68521e+00 1.24749e+00 5.69879e+01 117.957 -2.54827e+00 4.80136e+00  0.00000e+00 0.00000e+00 1.69021e+02 117.957 1.12033e+02 117.957 0.9026 
1 1 1 -12 10  16 o 15 3.35239e+00 1.08223e+00 9.64548e+01 283.019 1.24889e+00  -5.40152e+00 0.00000e+00 0.00000e+00 1.69744e+01 283.019 7.94804e+01 103.019 0.9046 
1 1 1 -12 10  17 o 13 4.04419e+00 1.22943e+00 7.83383e+01 144.209 -4.75935e+00 3.43146e+00  0.00000e+00 0.00000e+00 5.91417e+01 144.209 1.91966e+01 324.209 0.9102 
1 1 1 -12 10  18 o 2  2.48191e+00 8.70593e-01 5.04164e+01 18.108  3.50116e+00  1.14490e+00  0.00000e+00 0.00000e+00 2.82617e+01 18.108  2.21547e+01 198.108 0.8501 
1 1 1 -12 11  1  o 13 3.58318e+01 9.28422e-01 5.87497e+02 127.175 -4.83789e+01 6.37954e+01  0.00000e+00 0.00000e+00 7.64444e+02 127.175 1.76947e+02 127.175 0.9937 
1 1 1 -12 11  2  o 19 1.95104e+01 8.90308e-01 3.46008e+02 261.820 -4.02401e+00 -2.79935e+01 0.00000e+00 0.00000e+00 3.81129e+02 261.820 3.51206e+01 261.820 0.9822 
1 1 1 -12 11  3  o 5  1.27199e+01 1.05350e+00 2.31897e+02 244.193 -5.21255e+00 -1.07794e+01 0.00000e+00 0.00000e+00 2.29863e+02 244.193 2.03365e+00 64.193  0.9573 
1 1 1 -12 11  4  o 10 9.66698e+00 1.31187e+00 9.54711e+01 137.548 -2.81628e+00 2.57633e+00  0.00000e+00 0.00000e+00 2.18147e+02 137.548 1.22676e+02 137.548 0.8561 
1 1 1 -12 11  5  o 15 1.20565e+01 1.10360e+00 1.99668e+02 76.552  2.64119e+00  1.10454e+01  0.00000e+00 0.00000e+00 2.36285e+02 76.552  3.66168e+01 76.552  0.9549 
1 1 1 -12 11  6  o 15 8.99243e+00 1.37188e+00 2.05038e+02 345.099 8.79363e+00  -2.34002e+00 0.00000e+00 0.00000e+00 1.15921e+02 345.099 8.91170e+01 165.099 0.9433 
1 1 1 -12 11  7  o 14 8.25790e+00 1.31850e+00 1.43280e+02 110.315 -2.39601e+00 6.47208e+00  0.00000e+00 0.00000e+00 1.45293e+02 110.315 2.01243e+00 110.315 0.9244 
1 1 1 -12 11  8  o 3  2.08595e+01 8.80566e-01 3.23858e+02 241.377 -2.36947e+01 -4.34170e+01 0.00000e+00 0.00000e+00 4.55935e+02 241.377 1.32078e+02 241.377 0.9898 
1 1 1 -12 11  9  o 4  1.10204e+01 1.12541e+00 2.55545e+02 199.818 -2.10028e+01 -7.56909e+00 0.00000e+00 0.00000e+00 1.50821e+02 199.818 1.04724e+02 19.818  0.9773 
1 1 1 -12 11  10 o 15 6.42008e+00 1.38716e+00 4.93263e+01 301.480 1.38642e+00  -2.26424e+00 0.00000e+00 0.00000e+00 1.39614e+02 301.480 9.02874e+01 301.480 0.7809 
1 1 1 -12 11  11 o 6  1.89262e+01 9.35838e-01 3.72554e+02 121.786 -4.38357e+01 7.07384e+01  0.00000e+00 0.00000e+00 3.35659e+02 121.786 3.68952e+01 301.786 0.9940 
1 1 1 -12 11  12 o 2  1.45948e+01 9.19953e-01 2.99942e+02 300.566 2.74700e+01  -4.65112e+01 0.00000e+00 0.00000e+00 2.43748e+02 300.566 5.61941e+01 120.567 0.9907 
1 1 1 -12 11  13 f 0  6.55425e+00 1.27016e+00 1.92453e+02 136.393 -1.07925e+01 1.02800e+01  0.00000e+00 0.00000e+00 4.52855e+01 136.393 1.47168e+02 316.393 0.9658 
1 1 1 -12 11  14 o 5  7.33743e+00 1.36590e+00 1.09088e+02 205.387 -8.81809e+00 -4.18468e+00 0.00000e+00 0.00000e+00 1.51606e+02 205.387 4.25178e+01 205.387 0.9473 
1 1 1 -12 11  15 o 12 5.19197e+00 1.28784e+00 1.01449e+02 8.819   7.22612e+00  1.12109e+00  0.00000e+00 0.00000e+00 7.91805e+01 8.819   2.22689e+01 188.819 0.9289 
1 1 1 -12 11  16 o 5  3.98423e+00 1.20158e+00 4.02463e+01 120.102 -1.26749e+00 2.18639e+00  0.00000e+00 0.00000e+00 7.41854e+01 120.102 3.39391e+01 120.102 0.7679 
1 1 1 -12 11  17 o 4  3.82449e+00 1.17040e+00 6.14217e+01 167.837 -4.47027e+00 9.63476e-01  0.00000e+00 0.00000e+00 6.46134e+01 167.837 3.19174e+00 167.837 0.8824 
1 1 1 -12 11  18 o 4  9.98717e+00 1.26058e+00 1.46246e+02 348.454 2.84173e+01  -5.80547e+00 0.00000e+00 0.00000e+00 2.19671e+02 348.454 7.34250e+01 348.454 0.9826 
1 1 1 -12 12  1  o 15 1.49400e+01 9.75389e-01 1.64646e+02 6.512   9.22575e+00  1.05315e+00  0.00000e+00 0.00000e+00 3.71104e+02 6.512   2.06459e+02 6.512   0.9445 
1 1 1 -12 12  2  o 7  2.44879e+01 8.66108e-01 4.96680e+02 307.827 3.13168e+01  -4.03336e+01 0.00000e+00 0.00000e+00 4.23369e+02 307.827 7.33105e+01 127.827 0.9902 
1 1 1 -12 12  3  o 6  7.41417e+00 1.25097e+00 1.36264e+02 133.441 -2.72148e+00 2.87373e+00  0.00000e+00 0.00000e+00 1.06055e+02 133.441 3.02088e+01 313.441 0.8619 
1 1 1 -12 12  4  o 7  2.02145e+01 8.63934e-01 2.76347e+02 7.839   2.47491e+01  3.40747e+00  0.00000e+00 0.00000e+00 4.74178e+02 7.839   1.97830e+02 7.839   0.9798 
1 1 1 -12 12  5  o 15 1.37771e+01 9.91884e-01 1.10160e+02 146.829 -6.11313e+00 3.99587e+00  0.00000e+00 0.00000e+00 3.74361e+02 146.829 2.64201e+02 146.829 0.9288 
1 1 1 -12 12  6  o 14 1.53080e+01 9.36578e-01 2.45975e+02 161.807 -1.94593e+01 6.39527e+00  0.00000e+00 0.00000e+00 3.18879e+02 161.807 7.29041e+01 161.807 0.9753 
1 1 1 -12 12  7  o 13 1.48108e+01 9.65616e-01 2.80434e+02 147.573 -2.31761e+01 1.47235e+01  0.00000e+00 0.00000e+00 2.69142e+02 147.573 1.12913e+01 327.573 0.9816 
1 1 1 -12 12  8  o 11 1.40102e+01 9.62219e-01 2.51618e+02 14.376  2.63916e+01  6.76434e+00  0.00000e+00 0.00000e+00 2.67683e+02 14.376  1.60649e+01 14.376  0.9815 
1 1 1 -12 12  9  o 12 4.70183e+00 1.34560e+00 9.53802e+01 154.081 -2.95520e+00 1.43616e+00  0.00000e+00 0.00000e+00 5.16889e+01 154.081 4.36913e+01 334.081 0.8291 
1 1 1 -12 12  10 o 14 9.08934e+00 1.21871e+00 1.70712e+02 327.532 1.17872e+01  -7.50003e+00 0.00000e+00 0.00000e+00 1.59348e+02 327.532 1.13639e+01 147.532 0.9635 
1 1 1 -12 12  11 o 12 4.83412e+00 1.32447e+00 9.45420e+01 352.545 4.47316e+00  -5.85325e-01 0.00000e+00 0.00000e+00 6.57228e+01 352.545 2.88192e+01 172.545 0.8807 
1 1 1 -12 12  12 o 5  5.53496e+00 1.27105e+00 7.12559e+01 137.260 -3.03155e+00 2.80133e+00  0.00000e+00 0.00000e+00 1.09445e+02 137.260 3.81887e+01 137.260 0.8683 
1 1 1 -12 12  13 o 6  3.51277e+00 1.11635e+00 6.92465e+01 63.973  1.37242e+00  2.81049e+00  0.00000e+00 0.00000e+00 3.87941e+01 63.973  3.04525e+01 243.973 0.8190 
1 1 1 -12 12  14 o 17 8.33420e+00 1.24754e+00 1.48630e+02 355.972 1.62074e+01  -1.14138e+00 0.00000e+00 0.00000e+00 1.54165e+02 355.972 5.53459e+00 355.972 0.9687 
1 1 1 -12 12  15 o 12 4.36588e+00 1.24936e+00 6.78257e+01 110.208 -1.36014e+00 3.69511e+00  0.00000e+00 0.00000e+00 7.29747e+01 110.208 5.14904e+00 110.208 0.8611 
1 1 1 -12 12  16 o 10 4.86398e+00 1.20565e+00 4.37017e+01 124.255 -1.86996e+00 2.74588e+00  0.00000e+00 0.00000e+00 1.07512e+02 124.255 6.38099e+01 124.255 0.8312 
1 1 1 -12 12  17 o 4  4.50981e+00 1.21515e+00 6.62472e+01 37.875  4.41774e+00  3.43600e+00  0.00000e+00 0.00000e+00 8.62690e+01 37.875  2.00218e+01 37.875  0.9056 
1 1 1 -12 12  18 o 15 2.72063e+00 9.27646e-01 4.91144e+01 16.205  3.48757e+00  1.01357e+00  0.00000e+00 0.00000e+00 3.68784e+01 16.205  1.22360e+01 196.205 0.8477 
1 1 1 -12 13  1  o 16 1.28529e+01 1.03942e+00 1.94584e+02 126.650 -6.11521e+00 8.21918e+00  0.00000e+00 0.00000e+00 2.68917e+02 126.650 7.43334e+01 126.650 0.9499 
1 1 1 -12 13  2  f 0  2.46545e+01 8.53324e-01 2.56355e+02 294.398 1.09657e+01  -2.41764e+01 0.00000e+00 0.00000e+00 6.61333e+02 294.398 4.04978e+02 294.398 0.9810 
1 1 1 -12 13  3  f 0  3.11221e+01 8.76383e-01 4.47883e+02 165.676 -5.61673e+01 1.43418e+01  0.00000e+00 0.00000e+00 7.22030e+02 165.676 2.74146e+02 165.676 0.9913 
1 1 1 -12 13  4  o 16 2.56072e+01 8.41008e-01 4.11656e+02 40.598  3.58659e+01  3.07384e+01  0.00000e+00 0.00000e+00 5.48352e+02 40.598  1.36696e+02 40.598  0.9894 
1 1 1 -12 13  5  o 16 1.81519e+01 8.81618e-01 3.82482e+02 227.319 -2.30495e+01 -2.49955e+01 0.00000e+00 0.00000e+00 2.94643e+02 227.319 8.78386e+01 47.319  0.9852 
1 1 1 -12 13  6  o 7  1.17891e+01 1.12008e+00 2.41075e+02 226.302 -1.03691e+01 -1.08513e+01 0.00000e+00 0.00000e+00 1.89820e+02 226.302 5.12550e+01 46.302  0.9661 
1 1 1 -12 13  7  o 8  9.39423e+00 1.26955e+00 2.11402e+02 19.541  1.13951e+01  4.04439e+00  0.00000e+00 0.00000e+00 1.28684e+02 19.541  8.27176e+01 199.541 0.9577 
1 1 1 -12 13  8  f 0  1.32836e+01 1.01295e+00 2.87694e+02 263.135 -3.47547e+00 -2.88691e+01 0.00000e+00 0.00000e+00 2.05253e+02 263.135 8.24411e+01 83.135  0.9827 
1 1 1 -12 13  9  o 2  1.50746e+01 9.30437e-01 2.97895e+02 86.989  1.98885e+00  3.78069e+01  0.00000e+00 0.00000e+00 2.63257e+02 86.989  3.46373e+01 266.989 0.9867 
1 1 1 -12 13  10 o 12 6.42196e+00 1.37102e+00 1.08628e+02 178.231 -5.88127e+00 1.81641e-01  0.00000e+00 0.00000e+00 1.11737e+02 178.231 3.10875e+00 178.231 0.9105 
1 1 1 -12 13  11 o 18 7.00855e+00 1.38588e+00 1.26019e+02 225.604 -5.91362e+00 -6.03959e+00 0.00000e+00 0.00000e+00 1.21675e+02 225.604 4.34404e+00 45.604  0.9388 
1 1 1 -12 13  12 o 12 4.93804e+00 1.20485e+00 3.77879e+01 15.034  1.94782e+00  5.23150e-01  0.00000e+00 0.00000e+00 9.22765e+01 15.034  5.44886e+01 15.034  0.7005 
1 1 1 -12 13  13 o 17 1.04493e+01 1.13368e+00 2.08307e+02 113.705 -1.11413e+01 2.53743e+01  0.00000e+00 0.00000e+00 1.76946e+02 113.705 3.13611e+01 293.705 0.9818 
1 1 1 -12 13  14 o 5  1.03578e+01 1.17194e+00 1.63509e+02 233.767 -1.40087e+01 -1.91173e+01 0.00000e+00 0.00000e+00 2.16657e+02 233.767 5.31481e+01 233.767 0.9787 
1 1 1 -12 13  15 o 13 3.72847e+00 1.14180e+00 6.74044e+01 147.163 -2.99813e+00 1.93490e+00  0.00000e+00 0.00000e+00 5.05336e+01 147.163 1.68708e+01 327.163 0.8446 
1 1 1 -12 13  16 o 17 4.24983e+00 1.23080e+00 3.63154e+01 47.682  1.59452e+00  1.75128e+00  0.00000e+00 0.00000e+00 8.28710e+01 47.682  4.65557e+01 47.682  0.7499 
1 1 1 -12 13  17 o 9  4.07561e+00 1.22587e+00 8.93025e+01 180.961 -6.31857e+00 -1.05939e-01 0.00000e+00 0.00000e+00 5.02684e+01 180.961 3.90341e+01 0.961   0.9171 
1 1 1 -12 13  18 o 1  4.42092e+00 1.27112e+00 3.72250e+01 66.014  1.31460e+00  2.95465e+00  0.00000e+00 0.00000e+00 9.89095e+01 66.014  6.16845e+01 66.014  0.8259 
1 1 1 -12 14  1  o 18 2.26298e+01 8.35157e-01 3.86599e+02 347.093 3.59518e+01  -8.23900e+00 0.00000e+00 0.00000e+00 4.60792e+02 347.093 7.41924e+01 347.093 0.9863 
1 1 1 -12 14  2  o 13 3.43911e+01 9.09345e-01 5.44490e+02 224.576 -5.55102e+01 -5.46950e+01 0.00000e+00 0.00000e+00 7.51989e+02 224.576 2.07499e+02 224.576 0.9936 
1 1 1 -12 14  3  o 1  1.52808e+01 9.74704e-01 2.82794e+02 304.739 1.04025e+01  -1.50015e+01 0.00000e+00 0.00000e+00 2.80525e+02 304.739 2.26922e+00 124.739 0.9722 
1 1 1 -12 14  4  o 17 1.08997e+01 1.18878e+00 2.50642e+02 11.194  1.19212e+01  2.35918e+00  0.00000e+00 0.00000e+00 1.44989e+02 11.194  1.05653e+02 191.194 0.9579 
1 1 1 -12 14  5  o 13 1.37868e+01 9.76058e-01 2.54272e+02 227.687 -1.13546e+01 -1.24729e+01 0.00000e+00 0.00000e+00 2.52018e+02 227.687 2.25378e+00 47.687  0.9699 
1 1 1 -12 14  6  o 5  1.45671e+01 9.95190e-01 3.24579e+02 325.374 2.10835e+01  -1.45587e+01 0.00000e+00 0.00000e+00 2.15659e+02 325.374 1.08920e+02 145.374 0.9803 
1 1 1 -12 14  7  o 8  1.32745e+01 1.02050e+00 1.60235e+02 89.542  1.10795e-01  1.38467e+01  0.00000e+00 0.00000e+00 3.23053e+02 89.542  1.62818e+02 89.542  0.9632 
1 1 1 -12 14  8  o 18 1.41121e+01 9.41191e-01 2.33577e+02 255.894 -6.23057e+00 -2.47939e+01 0.00000e+00 0.00000e+00 2.88811e+02 255.894 5.52340e+01 255.894 0.9802 
1 1 1 -12 14  9  o 8  2.00023e+01 8.83013e-01 4.41737e+02 104.116 -1.84055e+01 7.31915e+01  0.00000e+00 0.00000e+00 3.07837e+02 104.116 1.33900e+02 284.116 0.9934 
1 1 1 -12 14  10 o 14 1.85781e+01 9.12600e-01 4.77851e+02 214.557 -7.39246e+01 -5.09154e+01 0.00000e+00 0.00000e+00 2.18353e+02 214.557 2.59497e+02 34.557  0.9944 
1 1 1 -12 14  11 o 6  5.01511e+00 1.30944e+00 1.34046e+02 139.671 -5.08780e+00 4.31922e+00  0.00000e+00 0.00000e+00 3.99546e+01 139.671 9.40913e+01 319.671 0.9217 
1 1 1 -12 14  12 o 3  4.73110e+00 1.24563e+00 9.65300e+01 128.454 -3.09543e+00 3.89797e+00  0.00000e+00 0.00000e+00 6.22919e+01 128.454 3.42381e+01 308.454 0.8929 
1 1 1 -12 14  13 o 18 9.25146e+00 1.20594e+00 1.72230e+02 237.914 -1.03520e+01 -1.65113e+01 0.00000e+00 0.00000e+00 1.66139e+02 237.914 6.09128e+00 57.914  0.9740 
1 1 1 -12 14  14 o 17 5.45478e+00 1.36434e+00 1.24410e+02 95.441  -7.97895e-01 8.37764e+00  0.00000e+00 0.00000e+00 6.75866e+01 95.441  5.68233e+01 275.440 0.9386 
1 1 1 -12 14  15 o 4  8.32583e+00 1.28278e+00 1.31366e+02 230.052 -9.13516e+00 -1.09068e+01 0.00000e+00 0.00000e+00 1.69276e+02 230.052 3.79100e+01 230.052 0.9642 
1 1 1 -12 14  16 o 8  1.41267e+01 9.50312e-01 2.11307e+02 75.096  1.42810e+01  5.36587e+01  0.00000e+00 0.00000e+00 3.12213e+02 75.096  1.00907e+02 75.096  0.9910 
1 1 1 -12 14  17 o 3  4.50997e+00 1.28089e+00 3.41696e+01 178.998 -2.55951e+00 4.47615e-02  0.00000e+00 0.00000e+00 9.57339e+01 178.998 6.15643e+01 178.998 0.7714 
1 1 1 -12 14  18 o 11 5.83672e+00 1.38618e+00 1.22943e+02 338.749 1.18145e+01  -4.59474e+00 0.00000e+00 0.00000e+00 8.59025e+01 338.749 3.70401e+01 158.749 0.9597 
1 1 1 -12 15  1  o 12 5.57192e+00 1.33933e+00 7.51419e+01 149.892 -1.40186e+00 8.12900e-01  0.00000e+00 0.00000e+00 5.69636e+01 149.892 1.81783e+01 329.892 0.6245 
1 1 1 -12 15  2  f 0  1.94513e+01 8.70563e-01 4.18844e+02 224.658 -2.41916e+01 -2.39048e+01 0.00000e+00 0.00000e+00 3.08220e+02 224.658 1.10624e+02 44.658  0.9852 
1 1 1 -12 15  3  o 6  3.88991e+01 9.58563e-01 5.95461e+02 358.842 9.79522e+01  -1.97997e+00 0.00000e+00 0.00000e+00 8.71915e+02 358.842 2.76454e+02 358.842 0.9949 
1 1 1 -12 15  4  o 14 1.13948e+01 1.40469e+00 1.00511e+02 114.768 -2.03613e+00 4.41309e+00  0.00000e+00 0.00000e+00 2.83763e+02 114.768 1.83252e+02 114.768 0.8900 
1 1 1 -12 15  5  o 5  1.38215e+01 9.75172e-01 2.04870e+02 343.571 1.40022e+01  -4.12875e+00 0.00000e+00 0.00000e+00 3.00178e+02 343.571 9.53086e+01 343.571 0.9651 
1 1 1 -12 15  6  f 0  4.58039e+01 1.06548e+00 7.45946e+02 223.717 -1.31726e+02 -1.25955e+02 0.00000e+00 0.00000e+00 9.82076e+02 223.717 2.36129e+02 223.717 0.9973 
1 1 1 -12 15  7  o 15 1.89795e+01 9.00614e-01 3.05421e+02 338.880 3.81521e+01  -1.47371e+01 0.00000e+00 0.00000e+00 4.03122e+02 338.880 9.77009e+01 338.880 0.9877 
1 1 1 -12 15  8  o 13 1.13893e+01 1.05902e+00 2.50465e+02 168.952 -1.99651e+01 3.89822e+00  0.00000e+00 0.00000e+00 1.68903e+02 168.952 8.15618e+01 348.952 0.9751 
1 1 1 -12 15  9  f 0  7.06198e+00 1.29124e+00 1.26774e+02 189.651 -6.59112e+00 -1.12080e+00 0.00000e+00 0.00000e+00 1.18809e+02 189.651 7.96492e+00 9.651   0.9218 
1 1 1 -12 15  10 o 16 9.60667e+00 1.29617e+00 1.65127e+02 121.294 -6.97534e+00 1.14752e+01  0.00000e+00 0.00000e+00 1.83135e+02 121.294 1.80084e+01 121.294 0.9620 
1 1 1 -12 15  11 o 16 5.65372e+00 1.39662e+00 1.08558e+02 345.525 5.64837e+00  -1.45814e+00 0.00000e+00 0.00000e+00 8.50362e+01 345.525 2.35217e+01 165.525 0.9097 
1 1 1 -12 15  12 o 5  1.18249e+01 1.01456e+00 2.82723e+02 296.002 1.78767e+01  -3.66495e+01 0.00000e+00 0.00000e+00 1.56367e+02 296.002 1.26357e+02 116.002 0.9877 
1 1 1 -12 15  13 o 19 4.48318e+00 1.19646e+00 6.53143e+01 93.010  -1.89270e-01 3.59937e+00  0.00000e+00 0.00000e+00 7.71657e+01 93.010  1.18514e+01 93.010  0.8464 
1 1 1 -12 15  14 o 14 3.84289e+00 1.17840e+00 6.52860e+01 94.891  -2.97910e-01 3.48108e+00  0.00000e+00 0.00000e+00 5.58791e+01 94.891  9.40688e+00 274.891 0.8408 
1 1 1 -12 15  15 o 11 8.78677e+00 1.26363e+00 1.15584e+02 47.175  9.51022e+00  1.02611e+01  0.00000e+00 0.00000e+00 2.01487e+02 47.175  8.59036e+01 47.175  0.9636 
1 1 1 -12 15  16 f 0  3.33368e+00 1.08655e+00 9.32733e+01 155.115 -5.10385e+00 2.36749e+00  0.00000e+00 0.00000e+00 1.96896e+01 155.115 7.35837e+01 335.115 0.9061 
1 1 1 -12 15  17 o 2  3.89415e+00 1.16045e+00 5.89789e+01 105.999 -1.15637e+00 4.03306e+00  0.00000e+00 0.00000e+00 6.76189e+01 105.999 8.64001e+00 105.999 0.8706 
1 1 1 -12 15  18 f 0  3.56244e+00 1.11642e+00 7.95211e+01 332.410 5.98328e+00  -3.12660e+00 0.00000e+00 0.00000e+00 4.30193e+01 332.410 3.65018e+01 152.410 0.9226 
1 1 1 -12 16  1  o 18 1.15033e+01 1.10936e+00 2.75695e+02 327.487 1.07718e+01  -6.86572e+00 0.00000e+00 0.00000e+00 1.43526e+02 327.487 1.32169e+02 147.487 0.9600 
1 1 1 -12 16  2  o 1  7.50352e+00 1.34435e+00 1.49312e+02 19.067  4.07528e+00  1.40855e+00  0.00000e+00 0.00000e+00 9.96456e+01 19.067  4.96665e+01 199.067 0.8745 
1 1 1 -12 16  3  o 19 1.25461e+01 1.03492e+00 2.43021e+02 37.994  1.00271e+01  7.83251e+00  0.00000e+00 0.00000e+00 2.13572e+02 37.994  2.94482e+01 217.994 0.9599 
1 1 1 -12 16  4  o 15 1.60200e+01 9.07473e-01 2.83162e+02 244.537 -9.10820e+00 -1.91274e+01 0.00000e+00 0.00000e+00 3.09308e+02 244.537 2.61462e+01 244.537 0.9761 
1 1 1 -12 16  5  o 1  2.11410e+01 8.45556e-01 4.38693e+02 214.634 -4.02093e+01 -2.77734e+01 0.00000e+00 0.00000e+00 3.53470e+02 214.634 8.52229e+01 34.634  0.9897 
1 1 1 -12 16  6  o 18 2.65889e+01 8.40884e-01 4.65901e+02 348.653 7.20656e+01  -1.44611e+01 0.00000e+00 0.00000e+00 5.33059e+02 348.653 6.71577e+01 348.653 0.9932 
1 1 1 -12 16  7  o 8  6.53575e+00 1.44000e+00 1.52469e+02 257.074 -1.34467e+00 -5.85882e+00 0.00000e+00 0.00000e+00 7.29469e+01 257.074 7.95216e+01 77.074  0.9125 
1 1 1 -12 16  8  o 10 1.64254e+01 8.78142e-01 2.71915e+02 138.087 -2.48423e+01 2.23001e+01  0.00000e+00 0.00000e+00 3.38947e+02 138.087 6.70315e+01 138.087 0.9849 
1 1 1 -12 16  9  o 18 6.75064e+00 1.29945e+00 1.18520e+02 61.268  2.99605e+00  5.46517e+00  0.00000e+00 0.00000e+00 1.14693e+02 61.268  3.82688e+00 241.268 0.9158 
1 1 1 -12 16  10 o 15 1.64484e+01 9.74166e-01 3.05051e+02 30.298  4.14804e+01  2.42371e+01  0.00000e+00 0.00000e+00 3.08271e+02 30.298  3.21977e+00 30.298  0.9895 
1 1 1 -12 16  11 o 2  1.06559e+01 1.14937e+00 2.24871e+02 229.063 -1.68081e+01 -1.93784e+01 0.00000e+00 0.00000e+00 1.68315e+02 229.063 5.65560e+01 49.063  0.9803 
1 1 1 -12 16  12 o 4  6.48154e+00 1.35618e+00 1.70481e+02 132.445 -7.66661e+00 8.38287e+00  0.00000e+00 0.00000e+00 6.22072e+01 132.445 1.08273e+02 312.445 0.9549 
1 1 1 -12 16  13 o 3  4.38894e+00 1.21775e+00 2.38248e+01 165.632 -1.23128e+00 3.15410e-01  0.00000e+00 0.00000e+00 6.42152e+01 165.632 4.03904e+01 165.632 0.5342 
1 1 1 -12 16  14 o 13 1.00724e+01 1.19379e+00 1.82311e+02 65.166  1.01711e+01  2.19778e+01  0.00000e+00 0.00000e+00 1.87513e+02 65.166  5.20167e+00 65.166  0.9791 
1 1 1 -12 16  15 o 7  1.02312e+01 1.19151e+00 2.37052e+02 169.547 -3.44052e+01 6.34733e+00  0.00000e+00 0.00000e+00 1.40565e+02 169.547 9.64874e+01 349.547 0.9856 
1 1 1 -12 16  16 o 3  1.19807e+01 1.07893e+00 1.53049e+02 349.671 3.28038e+01  -5.97886e+00 0.00000e+00 0.00000e+00 2.88187e+02 349.671 1.35138e+02 349.671 0.9849 
1 1 1 -12 16  17 o 6  3.27436e+00 1.07235e+00 6.25196e+01 165.608 -4.15141e+00 1.06531e+00  0.00000e+00 0.00000e+00 4.42961e+01 165.608 1.82235e+01 345.608 0.8737 
1 1 1 -12 16  18 o 5  3.76687e+00 1.12349e+00 4.83570e+01 259.060 -8.17689e-01 -4.23028e+00 0.00000e+00 0.00000e+00 7.44381e+01 259.060 2.60811e+01 259.060 0.8744 
1 1 1 -12 17  1  o 9  2.39019e+01 8.38725e-01 3.37962e+02 34.833  2.77812e+01  1.93318e+01  0.00000e+00 0.00000e+00 5.55830e+02 34.833  2.17869e+02 34.833  0.9851 
1 1 1 -12 17  2  o 9  2.22272e+01 8.30836e-01 4.72232e+02 176.374 -4.52391e+01 2.86656e+00  0.00000e+00 0.00000e+00 3.61655e+02 176.374 1.10577e+02 356.374 0.9889 
1 1 1 -12 17  3  o 18 1.42502e+01 9.53454e-01 2.85824e+02 291.701 6.65487e+00  -1.67225e+01 0.00000e+00 0.00000e+00 2.39218e+02 291.701 4.66063e+01 111.701 0.9718 
1 1 1 -12 17  4  o 12 1.86269e+01 8.46509e-01 2.72750e+02 247.418 -9.00023e+00 -2.16404e+01 0.00000e+00 0.00000e+00 4.17743e+02 247.418 1.44993e+02 247.418 0.9784 
1 1 1 -12 17  5  o 12 1.82352e+01 8.89946e-01 3.15633e+02 172.217 -3.26986e+01 4.46952e+00  0.00000e+00 0.00000e+00 3.64177e+02 172.217 4.85440e+01 172.217 0.9847 
1 1 1 -12 17  6  o 1  1.04162e+01 1.16086e+00 1.26118e+02 50.974  4.57243e+00  5.64119e+00  0.00000e+00 0.00000e+00 2.39661e+02 50.974  1.13543e+02 50.974  0.9283 
1 1 1 -12 17  7  o 14 8.19076e+00 1.24868e+00 9.71512e+01 218.310 -3.99608e+00 -3.15708e+00 0.00000e+00 0.00000e+00 1.80057e+02 218.310 8.29054e+01 218.310 0.8955 
1 1 1 -12 17  8  o 12 1.68893e+01 9.55075e-01 2.65373e+02 226.260 -2.26788e+01 -2.36986e+01 0.00000e+00 0.00000e+00 3.62539e+02 226.260 9.71658e+01 226.260 0.9846 
1 1 1 -12 17  9  o 7  1.01980e+01 1.16432e+00 1.96046e+02 258.288 -3.32075e+00 -1.60179e+01 0.00000e+00 0.00000e+00 1.76675e+02 258.288 1.93713e+01 78.288  0.9689 
1 1 1 -12 17  10 o 18 1.20051e+01 1.04657e+00 2.12446e+02 231.689 -1.54894e+01 -1.96055e+01 0.00000e+00 0.00000e+00 2.30762e+02 231.689 1.83166e+01 231.689 0.9798 
1 1 1 -12 17  11 f 0  7.45760e+00 1.29171e+00 3.26447e+01 299.699 1.15370e+00  -2.02273e+00 0.00000e+00 0.00000e+00 1.76467e+02 299.699 1.43822e+02 299.699 0.7450 
1 1 1 -12 17  12 o 4  5.14474e+00 1.30669e+00 7.69478e+01 266.133 -2.94238e-01 -4.35325e+00 0.00000e+00 0.00000e+00 9.25094e+01 266.133 1.55617e+01 266.133 0.8762 
1 1 1 -12 17  13 o 3  4.25544e+00 1.23000e+00 1.89350e+02 36.149  8.12265e+00  5.93390e+00  0.00000e+00 0.00000e+00 3.77358e+01 216.149 2.27085e+02 216.149 0.9489 
1 1 1 -12 17  14 o 10 7.54726e+00 1.36665e+00 1.16895e+02 229.508 -6.80521e+00 -7.97026e+00 0.00000e+00 0.00000e+00 1.52247e+02 229.508 3.53521e+01 229.508 0.9510 
1 1 1 -12 17  15 o 4  1.41411e+01 9.92003e-01 1.80875e+02 15.783  4.02071e+01  1.13647e+01  0.00000e+00 0.00000e+00 3.42276e+02 15.783  1.61402e+02 15.783  0.9880 
1 1 1 -12 17  16 o 12 8.94440e+00 1.27814e+00 1.42412e+02 52.499  1.21535e+01  1.58382e+01  0.00000e+00 0.00000e+00 1.83553e+02 52.499  4.11408e+01 52.499  0.9746 
1 1 1 -12 17  17 o 13 5.94927e+00 1.28685e+00 5.41388e+01 199.634 -5.29983e+00 -1.89078e+00 0.00000e+00 0.00000e+00 1.47139e+02 199.634 9.30003e+01 199.634 0.9061 
1 1 1 -12 17  18 o 17 3.49110e+00 1.09981e+00 5.38335e+01 356.407 4.24487e+00  -2.66521e-01 0.00000e+00 0.00000e+00 5.97297e+01 356.407 5.89618e+00 356.407 0.8726 
1 1 1 -12 18  1  o 17 2.09862e+01 8.64825e-01 2.68436e+02 92.891  -1.18431e+00 2.34485e+01  0.00000e+00 0.00000e+00 5.10994e+02 92.891  2.42557e+02 92.891  0.9785 
1 1 1 -12 18  2  o 8  1.26459e+01 9.87534e-01 2.88453e+02 44.190  1.10210e+01  1.07138e+01  0.00000e+00 0.00000e+00 1.75397e+02 44.190  1.13056e+02 224.190 0.9669 
1 1 1 -12 18  3  o 4  4.17108e+01 9.86891e-01 6.32427e+02 239.114 -5.94022e+01 -9.93103e+01 0.00000e+00 0.00000e+00 9.42042e+02 239.114 3.09614e+02 239.114 0.9957 
1 1 1 -12 18  4  o 17 7.86394e+00 1.35391e+00 1.84133e+02 201.732 -5.64359e+00 -2.24956e+00 0.00000e+00 0.00000e+00 8.80263e+01 201.732 9.61071e+01 21.732  0.9135 
1 1 1 -12 18  5  o 17 1.37373e+01 9.49462e-01 1.62239e+02 83.688  1.38636e+00  1.25335e+01  0.00000e+00 0.00000e+00 3.36737e+02 83.688  1.74498e+02 83.688  0.9595 
1 1 1 -12 18  6  o 1  8.74044e+00 1.24650e+00 1.12443e+02 294.046 2.20742e+00  -4.94724e+00 0.00000e+00 0.00000e+00 1.85846e+02 294.046 7.34023e+01 294.046 0.9022 
1 1 1 -12 18  7  o 4  2.86033e+01 8.57484e-01 6.26137e+02 167.687 -1.25158e+02 2.73182e+01  0.00000e+00 0.00000e+00 4.50613e+02 167.687 1.75525e+02 347.687 0.9961 
1 1 1 -12 18  8  o 15 2.72021e+01 8.67040e-01 4.74099e+02 351.910 1.03827e+02  -1.47579e+01 0.00000e+00 0.00000e+00 5.48047e+02 351.910 7.39480e+01 351.910 0.9952 
1 1 1 -12 18  9  o 7  4.62768e+00 1.30503e+00 1.42670e+02 287.520 1.55913e+00  -4.93886e+00 0.00000e+00 0.00000e+00 1.39663e+01 287.520 1.28704e+02 107.520 0.8974 
1 1 1 -12 18  10 o 4  5.09264e+00 1.34624e+00 1.19794e+02 115.960 -2.30863e+00 4.74170e+00  0.00000e+00 0.00000e+00 5.27794e+01 115.960 6.70145e+01 295.960 0.8994 
1 1 1 -12 18  11 o 1  4.30390e+00 1.19136e+00 5.44391e+01 265.850 -1.69665e-01 -2.33850e+00 0.00000e+00 0.00000e+00 6.65592e+01 265.850 1.21201e+01 265.850 0.7470 
1 1 1 -12 18  12 o 6  1.06519e+01 1.02362e+00 1.97664e+02 80.998  4.20325e+00  2.65320e+01  0.00000e+00 0.00000e+00 1.95229e+02 80.998  2.43489e+00 260.998 0.9812 
1 1 1 -12 18  13 o 18 4.26834e+00 1.23043e+00 5.03934e+01 315.190 1.90342e+00  -1.89084e+00 0.00000e+00 0.00000e+00 7.51673e+01 315.190 2.47739e+01 315.190 0.7835 
1 1 1 -12 18  14 o 17 3.28942e+00 1.08046e+00 8.71399e+01 220.334 -3.30638e+00 -2.80736e+00 0.00000e+00 0.00000e+00 2.08243e+01 220.334 6.63157e+01 40.334  0.8754 
1 1 1 -12 18  15 o 11 1.97240e+01 9.57872e-01 2.77673e+02 75.753  2.28864e+01  9.01382e+01  0.00000e+00 0.00000e+00 4.56892e+02 75.753  1.79220e+02 75.753  0.9946 
1 1 1 -12 18  16 o 19 3.86292e+00 1.17137e+00 7.49749e+01 170.331 -4.81144e+00 8.19714e-01  0.00000e+00 0.00000e+00 5.36522e+01 170.331 2.13227e+01 350.331 0.8905 
1 1 1 -12 18  17 o 4  3.92449e+00 1.10557e+00 2.73166e+01 322.977 1.72724e+00  -1.30263e+00 0.00000e+00 0.00000e+00 7.85970e+01 322.977 5.12804e+01 322.977 0.7229 
1 1 1 -12 18  18 o 12 3.95351e+00 1.10918e+00 1.04251e+02 66.346  3.70768e+00  8.46471e+00  0.00000e+00 0.00000e+00 3.49053e+01 66.346  6.93458e+01 246.346 0.9442 
1 1 1 -12 19  1  o 16 4.54781e+00 1.29759e+00 8.97533e+01 182.568 -1.62712e+00 -7.29918e-02 0.00000e+00 0.00000e+00 1.83704e+01 182.568 7.13829e+01 2.569   0.6264 
1 1 1 -12 19  2  o 5  1.40018e+01 9.57760e-01 2.08109e+02 268.537 -3.14528e-01 -1.23114e+01 0.00000e+00 0.00000e+00 3.00987e+02 268.537 9.28783e+01 268.537 0.9585 
1 1 1 -12 19  3  o 13 2.11491e+01 8.37446e-01 2.64324e+02 121.071 -1.36607e+01 2.26716e+01  0.00000e+00 0.00000e+00 5.22133e+02 121.071 2.57809e+02 121.071 0.9809 
1 1 1 -12 19  4  o 14 1.34263e+01 9.72258e-01 2.29808e+02 265.364 -1.20579e+00 -1.48700e+01 0.00000e+00 0.00000e+00 2.61467e+02 265.364 3.16588e+01 265.364 0.9659 
1 1 1 -12 19  5  o 16 7.17685e+00 1.38957e+00 1.80717e+02 82.537  8.57198e-01  6.54393e+00  0.00000e+00 0.00000e+00 6.94339e+01 82.537  1.11284e+02 262.537 0.9208 
1 1 1 -12 19  6  o 14 2.91339e+01 8.64977e-01 5.91004e+02 156.285 -9.47109e+01 4.16056e+01  0.00000e+00 0.00000e+00 5.05598e+02 156.285 8.54063e+01 336.285 0.9952 
1 1 1 -12 19  7  o 13 5.37629e+00 1.37141e+00 6.19668e+01 238.125 -1.08851e+00 -1.75050e+00 0.00000e+00 0.00000e+00 8.17953e+01 238.125 1.98285e+01 238.125 0.7076 
1 1 1 -12 19  8  o 11 9.77547e+00 1.10921e+00 1.26396e+02 48.159  6.23517e+00  6.96366e+00  0.00000e+00 0.00000e+00 2.22333e+02 48.159  9.59374e+01 48.159  0.9449 
1 1 1 -12 19  9  o 19 9.41267e+00 1.18881e+00 1.81961e+02 272.713 6.63917e-01  -1.40110e+01 0.00000e+00 0.00000e+00 1.60154e+02 272.713 2.18066e+01 92.713  0.9637 
1 1 1 -12 19  10 o 9  9.70526e+00 1.11640e+00 1.06469e+02 210.088 -8.50563e+00 -4.92824e+00 0.00000e+00 0.00000e+00 2.40062e+02 210.088 1.33593e+02 210.088 0.9477 
1 1 1 -12 19  11 o 1  6.82288e+00 1.28320e+00 1.23551e+02 198.780 -8.23659e+00 -2.80080e+00 0.00000e+00 0.00000e+00 1.17980e+02 198.780 5.57006e+00 18.780  0.9406 
1 1 1 -12 19  12 o 6  6.48889e+00 1.28737e+00 5.56423e+01 213.583 -3.28813e+00 -2.18326e+00 0.00000e+00 0.00000e+00 1.54478e+02 213.583 9.88355e+01 213.583 0.8615 
1 1 1 -12 19  13 o 17 1.19787e+01 1.03286e+00 2.43120e+02 331.017 3.54665e+01  -1.96454e+01 0.00000e+00 0.00000e+00 2.01012e+02 331.017 4.21078e+01 151.017 0.9876 
1 1 1 -12 19  14 o 5  7.53758e+00 1.33364e+00 8.52765e+01 162.524 -7.90118e+00 2.48762e+00  0.00000e+00 0.00000e+00 1.79682e+02 162.524 9.44057e+01 162.524 0.9375 
1 1 1 -12 19  15 o 9  3.52295e+00 1.14085e+00 9.48019e+01 91.583  -1.39507e-01 5.04799e+00  0.00000e+00 0.00000e+00 2.31926e+01 91.583  7.16094e+01 271.583 0.8945 
1 1 1 -12 19  16 o 2  6.24798e+00 1.34102e+00 1.17744e+02 292.196 4.12664e+00  -1.01139e+01 0.00000e+00 0.00000e+00 1.04896e+02 292.196 1.28485e+01 112.196 0.9531 
1 1 1 -12 19  17 o 11 2.98484e+00 9.75147e-01 1.02697e+02 80.494  1.13700e+00  6.78978e+00  0.00000e+00 0.00000e+00 2.90948e-01 80.494  1.02406e+02 260.494 0.9242 
1 1 1 -12 19  18 o 11 6.64597e+00 1.26727e+00 1.10193e+02 250.870 -4.64830e+00 -1.34007e+01 0.00000e+00 0.00000e+00 1.28637e+02 250.870 1.84446e+01 250.870 0.9641 
1 1 1 -12 20  1  o 9  1.56415e+01 9.02563e-01 3.04102e+02 339.395 1.89850e+01  -7.13782e+00 0.00000e+00 0.00000e+00 2.74722e+02 339.395 2.93801e+01 159.395 0.9750 
1 1 1 -12 20  2  o 5  1.65271e+01 8.91505e-01 3.19481e+02 127.839 -1.44533e+01 1.86068e+01  0.00000e+00 0.00000e+00 2.93967e+02 127.839 2.55133e+01 307.839 0.9785 
1 1 1 -12 20  3  o 11 2.64265e+01 8.32994e-01 4.95365e+02 242.880 -2.82323e+01 -5.51226e+01 0.00000e+00 0.00000e+00 4.98278e+02 242.880 2.91275e+00 242.880 0.9919 
1 1 1 -12 20  4  o 13 3.15899e+01 8.68115e-01 4.99248e+02 20.353  7.26085e+01  2.69346e+01  0.00000e+00 0.00000e+00 6.89659e+02 20.353  1.90411e+02 20.353  0.9935 
1 1 1 -12 20  5  f 0  1.27993e+01 9.64692e-01 2.39560e+02 147.496 -1.40234e+01 8.93534e+00  0.00000e+00 0.00000e+00 2.30121e+02 147.496 9.43903e+00 327.496 0.9694 
1 1 1 -12 20  6  o 9  6.47416e+00 1.57204e+00 1.14332e+02 317.634 2.74396e+00  -2.50263e+00 0.00000e+00 0.00000e+00 9.41775e+01 317.634 2.01541e+01 137.634 0.8515 
1 1 1 -12 20  7  o 7  1.90813e+01 8.24884e-01 3.84657e+02 347.382 5.06293e+01  -1.13336e+01 0.00000e+00 0.00000e+00 3.29406e+02 347.382 5.52507e+01 167.382 0.9903 
1 1 1 -12 20  8  o 13 1.14874e+01 1.03333e+00 1.86501e+02 318.405 1.25616e+01  -1.11509e+01 0.00000e+00 0.00000e+00 2.34062e+02 318.405 4.75608e+01 318.405 0.9698 
1 1 1 -12 20  9  o 16 4.37141e+00 1.26247e+00 1.07690e+02 62.847  1.71038e+00  3.33479e+00  0.00000e+00 0.00000e+00 3.29527e+01 62.847  7.47375e+01 242.847 0.8531 
1 1 1 -12 20  10 o 1  4.06139e+00 1.22362e+00 1.88378e+01 154.681 -5.97491e-01 2.82679e-01  0.00000e+00 0.00000e+00 2.91566e+01 154.681 1.03188e+01 154.681 0.3137 
1 1 1 -12 20  11 f 0  9.04974e+00 1.12993e+00 1.37502e+02 163.224 -1.32360e+01 3.99025e+00  0.00000e+00 0.00000e+00 1.90501e+02 163.224 5.29993e+01 163.224 0.9631 
1 1 1 -12 20  12 o 9  1.03654e+01 1.12834e+00 1.73418e+02 324.206 1.72933e+01  -1.24694e+01 0.00000e+00 0.00000e+00 2.06941e+02 324.206 3.35231e+01 324.206 0.9763 
1 1 1 -12 20  13 o 6  6.03128e+00 1.28567e+00 1.26898e+02 98.136  -1.23984e+00 8.67270e+00  0.00000e+00 0.00000e+00 8.61765e+01 98.136  4.07220e+01 278.136 0.9411 
1 1 1 -12 20  14 o 11 5.93314e+00 1.24619e+00 7.43584e+01 31.172  5.14101e+00  3.11009e+00  0.00000e+00 0.00000e+00 1.28619e+02 31.172  5.42604e+01 31.172  0.9125 
1 1 1 -12 20  15 o 4  5.99478e+00 1.32672e+00 5.91966e+01 60.057  2.39891e+00  4.16463e+00  0.00000e+00 0.00000e+00 1.40265e+02 60.057  8.10684e+01 60.057  0.8887 
1 1 1 -12 20  16 o 5  4.53584e+00 1.27928e+00 4.88175e+01 310.290 2.23680e+00  -2.63846e+00 0.00000e+00 0.00000e+00 9.34491e+01 310.290 4.46316e+01 310.290 0.8389 
1 1 1 -12 20  17 o 5  3.95839e+00 1.17782e+00 4.45738e+01 26.726  2.98965e+00  1.50534e+00  0.00000e+00 0.00000e+00 7.84760e+01 26.726  3.39021e+01 26.726  0.8327 
1 1 1 -12 20  18 o 1  3.85884e+00 1.12543e+00 5.02695e+01 248.866 -1.66157e+00 -4.29850e+00 0.00000e+00 0.00000e+00 7.67954e+01 248.866 2.65258e+01 248.866 0.8834 
1 1 1 -12 21  1  o 1  2.03194e+01 8.28349e-01 3.62427e+02 295.778 1.44311e+01  -2.98813e+01 0.00000e+00 0.00000e+00 3.97012e+02 295.778 3.45854e+01 295.778 0.9848 
1 1 1 -12 21  2  o 12 2.82884e+01 8.43080e-01 4.83399e+02 249.276 -2.16995e+01 -5.73522e+01 0.00000e+00 0.00000e+00 5.80781e+02 249.276 9.73825e+01 249.276 0.9918 
1 1 1 -12 21  3  o 10 1.93981e+01 8.17320e-01 3.74231e+02 143.886 -2.72069e+01 1.98494e+01  0.00000e+00 0.00000e+00 3.50062e+02 143.886 2.41690e+01 323.886 0.9850 
1 1 1 -12 21  4  o 12 1.01880e+01 1.13405e+00 1.18504e+02 243.099 -2.72989e+00 -5.38080e+00 0.00000e+00 0.00000e+00 2.33785e+02 243.099 1.15282e+02 243.099 0.9129 
1 1 1 -12 21  5  o 1  1.36402e+01 9.11076e-01 1.48334e+02 237.914 -5.87681e+00 -9.37357e+00 0.00000e+00 0.00000e+00 3.44033e+02 237.914 1.95699e+02 237.914 0.9537 
1 1 1 -12 21  6  o 1  2.41665e+01 8.32980e-01 4.10996e+02 110.197 -2.26516e+01 6.15750e+01  0.00000e+00 0.00000e+00 4.95972e+02 110.197 8.49763e+01 110.197 0.9923 
1 1 1 -12 21  7  o 13 1.67025e+01 8.56888e-01 2.65766e+02 304.901 1.77920e+01  -2.55033e+01 0.00000e+00 0.00000e+00 3.55122e+02 304.901 8.93557e+01 304.901 0.9838 
1 1 1 -12 21  8  o 7  1.61308e+01 8.76434e-01 2.80693e+02 252.238 -1.13151e+01 -3.53223e+01 0.00000e+00 0.00000e+00 3.19986e+02 252.238 3.92927e+01 252.238 0.9864 
1 1 1 -12 21  9  f 0  4.79582e+00 1.29286e+00 1.50717e+02 153.598 -5.10069e+00 2.53216e+00  0.00000e+00 0.00000e+00 1.33865e+01 153.598 1.37330e+02 333.599 0.9073 
1 1 1 -12 21  10 o 2  4.89072e+00 1.34156e+00 1.19248e+02 307.000 2.88665e+00  -3.83068e+00 0.00000e+00 0.00000e+00 4.44430e+01 307.000 7.48046e+01 127.000 0.8884 
1 1 1 -12 21  11 o 2  4.95680e+00 1.29294e+00 6.91274e+01 119.991 -1.70092e+00 2.94720e+00  0.00000e+00 0.00000e+00 8.67813e+01 119.991 1.76539e+01 119.991 0.8359 
1 1 1 -12 21  12 o 12 8.40410e+00 1.28225e+00 1.85300e+02 193.567 -1.63701e+01 -3.95051e+00 0.00000e+00 0.00000e+00 1.21044e+02 193.567 6.42561e+01 13.567  0.9698 
1 1 1 -12 21  13 o 19 6.92810e+00 1.30335e+00 8.54633e+01 266.061 -4.60718e-01 -6.69060e+00 0.00000e+00 0.00000e+00 1.54348e+02 266.061 6.88846e+01 266.061 0.9221 
1 1 1 -12 21  14 o 17 3.54229e+00 1.12413e+00 6.23693e+01 218.456 -2.64396e+00 -2.09981e+00 0.00000e+00 0.00000e+00 4.84344e+01 218.456 1.39349e+01 38.456  0.8344 
1 1 1 -12 21  15 o 1  3.80464e+00 1.17593e+00 8.48755e+01 198.688 -4.57675e+00 -1.54809e+00 0.00000e+00 0.00000e+00 4.17983e+01 198.688 4.30772e+01 18.688  0.8893 
1 1 1 -12 21  16 o 10 4.90734e+00 1.28718e+00 6.70198e+01 83.796  5.51477e-01  5.07340e+00  0.00000e+00 0.00000e+00 9.73089e+01 83.796  3.02891e+01 83.796  0.8957 
1 1 1 -12 21  17 o 6  5.33097e+00 1.27223e+00 1.17618e+02 333.463 1.00337e+01  -5.01064e+00 0.00000e+00 0.00000e+00 7.22904e+01 333.463 4.53280e+01 153.463 0.9543 
1 1 1 -12 22  1  o 5  2.86222e+01 8.24986e-01 4.13240e+02 279.700 8.96290e+00  -5.24375e+01 0.00000e+00 0.00000e+00 6.62689e+02 279.700 2.49450e+02 279.700 0.9906 
1 1 1 -12 22  2  o 7  1.56648e+01 8.78447e-01 2.19052e+02 114.263 -6.63314e+00 1.47160e+01  0.00000e+00 0.00000e+00 3.56365e+02 114.263 1.37312e+02 114.263 0.9685 
1 1 1 -12 22  3  f 0  1.32653e+01 9.59566e-01 2.27054e+02 260.653 -2.21496e+00 -1.34563e+01 0.00000e+00 0.00000e+00 2.56941e+02 260.653 2.98864e+01 260.653 0.9626 
1 1 1 -12 22  4  o 5  1.34940e+01 9.06611e-01 2.36947e+02 343.685 1.60079e+01  -4.68560e+00 0.00000e+00 0.00000e+00 2.58594e+02 343.685 2.16474e+01 343.685 0.9695 
1 1 1 -12 22  5  o 14 1.18378e+01 1.00863e+00 2.26639e+02 116.676 -6.51309e+00 1.29634e+01  0.00000e+00 0.00000e+00 2.05669e+02 116.676 2.09702e+01 296.676 0.9649 
1 1 1 -12 22  6  o 19 1.31109e+01 1.10790e+00 2.70614e+02 218.893 -1.70712e+01 -1.37715e+01 0.00000e+00 0.00000e+00 2.13764e+02 218.893 5.68506e+01 38.893  0.9769 
1 1 1 -12 22  7  o 8  1.18746e+01 9.89221e-01 1.74473e+02 328.678 1.26338e+01  -7.68802e+00 0.00000e+00 0.00000e+00 2.58750e+02 328.678 8.42770e+01 328.678 0.9656 
1 1 1 -12 22  8  o 3  6.86906e+00 1.24053e+00 8.24124e+01 175.165 -4.31079e+00 3.64651e-01  0.00000e+00 0.00000e+00 1.44467e+02 175.165 6.20549e+01 175.165 0.8750 
1 1 1 -12 22  9  o 6  5.78560e+00 1.37660e+00 6.81597e+01 24.428  2.73456e+00  1.24206e+00  0.00000e+00 0.00000e+00 1.08615e+02 24.428  4.04556e+01 24.428  0.8102 
1 1 1 -12 22  10 o 18 1.49338e+01 9.73673e-01 2.64362e+02 40.253  3.07502e+01  2.60349e+01  0.00000e+00 0.00000e+00 2.91173e+02 40.253  2.68103e+01 40.253  0.9875 
1 1 1 -12 22  11 o 11 1.08268e+01 9.91236e-01 2.01185e+02 332.509 2.20021e+01  -1.14492e+01 0.00000e+00 0.00000e+00 1.97906e+02 332.509 3.27833e+00 152.509 0.9796 
1 1 1 -12 22  12 o 18 3.98383e+00 1.17909e+00 1.08912e+02 55.463  2.80270e+00  4.07238e+00  0.00000e+00 0.00000e+00 2.46518e+01 55.463  8.42600e+01 235.463 0.8921 
1 1 1 -12 22  13 o 8  5.67405e+00 1.36189e+00 7.08566e+01 305.547 2.79492e+00  -3.91156e+00 0.00000e+00 0.00000e+00 1.18425e+02 305.547 4.75687e+01 305.547 0.8887 
1 1 1 -12 22  14 o 1  3.90317e+00 1.18530e+00 7.18481e+01 284.275 1.01501e+00  -3.98916e+00 0.00000e+00 0.00000e+00 5.51347e+01 284.275 1.67134e+01 104.276 0.8678 
1 1 1 -12 22  15 o 6  4.73620e+00 1.33272e+00 1.06139e+02 175.806 -6.83425e+00 5.01163e-01  0.00000e+00 0.00000e+00 5.76628e+01 175.806 4.84764e+01 355.806 0.9238 
1 1 1 -12 22  16 o 18 4.47628e+00 1.25871e+00 6.51946e+01 306.955 2.73831e+00  -3.63979e+00 0.00000e+00 0.00000e+00 8.23808e+01 306.955 1.71862e+01 306.955 0.8819 
1 1 1 -12 22  17 o 19 5.67953e+00 1.24653e+00 2.94379e+01 287.162 9.01203e-01  -2.91810e+00 0.00000e+00 0.00000e+00 1.43108e+02 287.162 1.13670e+02 287.162 0.8139 
1 1 1 -12 23  1  o 8  1.44818e+01 8.99260e-01 3.16452e+02 294.769 9.00548e+00  -1.95171e+01 0.00000e+00 0.00000e+00 2.20147e+02 294.769 9.63046e+01 114.769 0.9765 
1 1 1 -12 23  2  o 5  2.93530e+01 8.16595e-01 4.89228e+02 186.328 -6.76573e+01 -7.50300e+00 0.00000e+00 0.00000e+00 6.15775e+02 186.328 1.26547e+02 186.328 0.9926 
1 1 1 -12 23  3  o 19 1.23600e+01 9.59847e-01 2.38977e+02 134.691 -1.00711e+01 1.01803e+01  0.00000e+00 0.00000e+00 2.12814e+02 134.691 2.61632e+01 314.691 0.9644 
1 1 1 -12 23  4  o 17 1.69747e+01 8.14065e-01 2.70903e+02 287.557 8.06748e+00  -2.54986e+01 0.00000e+00 0.00000e+00 3.59867e+02 287.557 8.89638e+01 287.557 0.9811 
1 1 1 -12 23  5  o 19 1.74947e+01 8.34693e-01 3.63758e+02 25.185  3.21431e+01  1.51152e+01  0.00000e+00 0.00000e+00 2.88952e+02 25.185  7.48063e+01 205.185 0.9858 
1 1 1 -12 23  6  o 7  1.20127e+01 1.01729e+00 2.79815e+02 240.449 -1.08144e+01 -1.90746e+01 0.00000e+00 0.00000e+00 1.63958e+02 240.449 1.15857e+02 60.449  0.9769 
1 1 1 -12 23  7  o 16 4.31103e+00 1.24415e+00 1.10282e+02 252.664 -9.37810e-01 -3.00430e+00 0.00000e+00 0.00000e+00 2.33274e+01 252.664 8.69546e+01 72.664  0.8203 
1 1 1 -12 23  8  o 19 4.62286e+00 1.24299e+00 4.75217e+01 41.008  1.26371e+00  1.09885e+00  0.00000e+00 0.00000e+00 6.35321e+01 41.008  1.60103e+01 41.008  0.6364 
1 1 1 -12 23  9  o 12 1.34803e+01 9.63480e-01 2.34834e+02 251.137 -9.94000e+00 -2.90933e+01 0.00000e+00 0.00000e+00 2.65143e+02 251.137 3.03084e+01 251.137 0.9836 
1 1 1 -12 23  10 o 8  5.71497e+00 1.22927e+00 9.83607e+01 150.102 -4.48265e+00 2.57742e+00  0.00000e+00 0.00000e+00 9.47798e+01 150.102 3.58086e+00 330.102 0.8972 
1 1 1 -12 23  11 o 1  6.94210e+00 1.09895e+00 1.46122e+02 335.926 1.06514e+01  -4.75867e+00 0.00000e+00 0.00000e+00 1.03619e+02 335.926 4.25026e+01 155.926 0.9561 
1 1 1 -12 23  12 o 11 3.89387e+00 1.11486e+00 7.19873e+01 42.281  2.72153e+00  2.47477e+00  0.00000e+00 0.00000e+00 5.23843e+01 42.281  1.96030e+01 222.281 0.8499 
1 1 1 -12 23  13 o 19 6.93870e+00 1.30041e+00 1.13350e+02 280.480 1.77450e+00  -9.59345e+00 0.00000e+00 0.00000e+00 1.33356e+02 280.480 2.00059e+01 280.480 0.9473 
1 1 1 -12 23  14 o 6  9.82776e+00 1.22324e+00 2.22854e+02 172.228 -2.96300e+01 4.04418e+00  0.00000e+00 0.00000e+00 1.39326e+02 172.228 8.35281e+01 352.228 0.9831 
1 1 1 -12 23  15 o 17 1.09674e+01 1.18585e+00 1.89080e+02 271.769 9.62416e-01  -3.11691e+01 0.00000e+00 0.00000e+00 2.14834e+02 271.769 2.57545e+01 271.769 0.9838 
1 1 1 -12 23  16 o 2  9.45666e+00 1.14767e+00 1.93026e+02 41.291  2.31938e+01  2.03699e+01  0.00000e+00 0.00000e+00 1.54691e+02 41.291  3.83345e+01 221.291 0.9837 
1 1 1 -12 23  17 o 17 6.71810e+00 1.20323e+00 7.22949e+01 344.581 8.62701e+00  -2.37931e+00 0.00000e+00 0.00000e+00 1.63999e+02 344.581 9.17040e+01 344.581 0.9424 
1 1 1 -12 24  1  o 8  7.48164e+00 1.39109e+00 1.37370e+02 77.031  9.81678e-01  4.26256e+00  0.00000e+00 0.00000e+00 1.11459e+02 77.031  2.59114e+01 257.031 0.8765 
1 1 1 -12 24  2  o 2  4.37488e+00 1.25797e+00 4.55744e+01 154.037 -7.68870e-01 3.74388e-01  0.00000e+00 0.00000e+00 1.95824e+01 154.037 2.59920e+01 334.037 0.3927 
1 1 1 -12 24  3  o 18 1.56579e+01 8.63184e-01 2.18360e+02 151.740 -1.47998e+01 7.95569e+00  0.00000e+00 0.00000e+00 3.57109e+02 151.740 1.38750e+02 151.740 0.9698 
1 1 1 -12 24  4  o 18 7.97733e+00 1.24070e+00 1.21721e+02 209.541 -4.47188e+00 -2.53433e+00 0.00000e+00 0.00000e+00 1.49136e+02 209.541 2.74150e+01 209.541 0.8965 
1 1 1 -12 24  5  o 13 1.81450e+01 8.03976e-01 2.87539e+02 201.356 -2.90075e+01 -1.13426e+01 0.00000e+00 0.00000e+00 3.88012e+02 201.356 1.00474e+02 201.356 0.9838 
1 1 1 -12 24  6  o 11 4.43233e+00 1.24853e+00 1.41692e+02 52.538  2.33689e+00  3.04973e+00  0.00000e+00 0.00000e+00 1.96612e+00 52.538  1.39725e+02 232.538 0.8572 
1 1 1 -12 24  7  o 8  2.02577e+01 7.94533e-01 4.41004e+02 151.513 -6.34032e+01 3.44069e+01  0.00000e+00 0.00000e+00 3.18986e+02 151.513 1.22019e+02 331.513 0.9930 
1 1 1 -12 24  8  o 11 9.60578e+00 1.05019e+00 1.83336e+02 51.063  9.00418e+00  1.11441e+01  0.00000e+00 0.00000e+00 1.66327e+02 51.063  1.70091e+01 231.063 0.9644 
1 1 1 -12 24  9  o 3  5.56495e+00 1.29769e+00 8.65227e+01 237.423 -2.20894e+00 -3.45711e+00 0.00000e+00 0.00000e+00 9.54732e+01 237.423 8.95050e+00 237.423 0.8674 
1 1 1 -12 24  10 o 16 1.04279e+01 1.01534e+00 1.86093e+02 50.989  1.27974e+01  1.57971e+01  0.00000e+00 0.00000e+00 1.96893e+02 50.989  1.08008e+01 50.989  0.9751 
1 1 1 -12 24  11 o 13 3.60689e+00 1.11010e+00 1.05980e+02 6.641   4.33892e+00  5.05189e-01  0.00000e+00 0.00000e+00 1.29393e+01 6.641   9.30409e+01 186.641 0.8763 
1 1 1 -12 24  12 o 18 9.03694e+00 1.18008e+00 2.03040e+02 289.713 7.82864e+00  -2.18493e+01 0.00000e+00 0.00000e+00 1.29156e+02 289.713 7.38839e+01 109.713 0.9782 
1 1 1 -12 24  13 o 14 4.57341e+00 1.23935e+00 8.68117e+01 170.387 -4.73712e+00 8.02322e-01  0.00000e+00 0.00000e+00 6.57217e+01 170.387 2.10901e+01 350.387 0.8886 
1 1 1 -12 24  14 o 14 7.77473e+00 1.32104e+00 8.31513e+01 278.776 1.26511e+00  -8.19506e+00 0.00000e+00 0.00000e+00 1.90083e+02 278.776 1.06931e+02 278.776 0.9376 
1 1 1 -12 24  15 o 3  6.67051e+00 1.41828e+00 1.12996e+02 36.580  7.86677e+00  5.83819e+00  0.00000e+00 0.00000e+00 1.23580e+02 36.580  1.05847e+01 36.580  0.9475 
1 1 1 -12 24  16 o 15 4.98646e+00 1.29430e+00 6.99468e+01 146.451 -4.45120e+00 2.95161e+00  0.00000e+00 0.00000e+00 9.79335e+01 146.451 2.79867e+01 146.451 0.9007 
1 1 1 -12 24  17 o 14 3.22392e+00 1.02029e+00 3.18763e+01 192.062 -2.15061e+00 -4.59547e-01 0.00000e+00 0.00000e+00 5.57084e+01 192.062 2.38322e+01 192.062 0.7279 
1 1 1 -12 25  1  o 11 1.72301e+01 9.53852e-01 3.10607e+02 59.973  1.21524e+01  2.10255e+01  0.00000e+00 0.00000e+00 3.29530e+02 59.973  1.89239e+01 59.973  0.9792 
1 1 1 -12 25  2  o 9  2.91998e+01 8.15194e-01 5.44895e+02 176.885 -7.89642e+01 4.29654e+00  0.00000e+00 0.00000e+00 5.55337e+02 176.885 1.04418e+01 176.885 0.9937 
1 1 1 -12 25  3  o 6  2.19862e+01 7.75210e-01 3.15661e+02 56.057  2.07034e+01  3.07603e+01  0.00000e+00 0.00000e+00 5.06211e+02 56.057  1.90550e+02 56.057  0.9864 
1 1 1 -12 25  4  o 15 1.67316e+01 8.20395e-01 3.09619e+02 270.774 3.90267e-01  -2.88767e+01 0.00000e+00 0.00000e+00 3.12929e+02 270.774 3.31012e+00 270.774 0.9825 
1 1 1 -12 25  5  o 4  1.93018e+01 7.98895e-01 3.74107e+02 42.852  3.22638e+01  2.99309e+01  0.00000e+00 0.00000e+00 3.47938e+02 42.852  2.61694e+01 222.852 0.9886 
1 1 1 -12 25  6  o 1  3.36971e+01 8.71038e-01 5.72609e+02 186.901 -1.35914e+02 -1.64490e+01 0.00000e+00 0.00000e+00 6.96806e+02 186.901 1.24197e+02 186.901 0.9963 
1 1 1 -12 25  7  o 8  7.55292e+00 1.25861e+00 1.03551e+02 318.519 4.12264e+00  -3.64501e+00 0.00000e+00 0.00000e+00 1.54344e+02 318.519 5.07934e+01 318.519 0.9039 
1 1 1 -12 25  8  o 9  2.61853e+01 8.13985e-01 5.08464e+02 60.473  5.71665e+01  1.00931e+02  0.00000e+00 0.00000e+00 4.75520e+02 60.473  3.29437e+01 240.473 0.9957 
1 1 1 -12 25  9  o 7  1.38605e+01 9.08540e-01 3.24890e+02 243.739 -1.93797e+01 -3.92797e+01 0.00000e+00 0.00000e+00 1.91694e+02 243.739 1.33195e+02 63.739  0.9885 
1 1 1 -12 25  10 o 12 5.32403e+00 1.22560e+00 8.02417e+01 358.723 4.27691e+00  -9.53349e-02 0.00000e+00 0.00000e+00 9.48951e+01 358.723 1.46534e+01 358.723 0.8734 
1 1 1 -12 25  11 o 6  5.58348e+00 1.20721e+00 1.25239e+02 152.696 -6.80566e+00 3.51319e+00  0.00000e+00 0.00000e+00 7.05778e+01 152.696 5.46615e+01 332.696 0.9322 
1 1 1 -12 25  12 o 17 1.14445e+01 1.02308e+00 2.18471e+02 299.043 1.63691e+01  -2.94784e+01 0.00000e+00 0.00000e+00 2.05140e+02 299.043 1.33305e+01 119.043 0.9851 
1 1 1 -12 25  13 o 1  4.73786e+00 1.26190e+00 4.06339e+01 202.615 -2.29405e+00 -9.55635e-01 0.00000e+00 0.00000e+00 9.50990e+01 202.615 5.44651e+01 202.615 0.7634 
1 1 1 -12 25  14 o 8  6.47676e+00 1.33579e+00 1.58768e+02 41.676  9.92008e+00  8.83088e+00  0.00000e+00 0.00000e+00 7.46548e+01 41.676  8.41137e+01 221.676 0.9616 
1 1 1 -12 25  15 o 17 5.50554e+00 1.39100e+00 1.38684e+02 229.419 -6.57269e+00 -7.67371e+00 0.00000e+00 0.00000e+00 5.69015e+01 229.419 8.17825e+01 49.419  0.9491 
1 1 1 -12 25  16 o 18 3.51312e+00 1.11597e+00 4.06989e+01 342.649 2.38001e+00  -7.43620e-01 0.00000e+00 0.00000e+00 5.96545e+01 342.649 1.89557e+01 342.649 0.7643 
1 1 1 -12 25  17 o 13 4.73442e+00 1.21280e+00 1.00747e+02 0.327   8.86970e+00  5.06809e-02  0.00000e+00 0.00000e+00 6.56595e+01 0.327   3.50872e+01 180.327 0.9418 
1 1 1 -12 26  1  o 7  1.89443e+01 9.08398e-01 4.53704e+02 241.769 -1.99052e+01 -3.70748e+01 0.00000e+00 0.00000e+00 2.56433e+02 241.769 1.97271e+02 61.769  0.9880 
1 1 1 -12 26  2  o 16 8.39402e+00 1.27908e+00 1.55980e+02 29.238  5.18800e+00  2.90400e+00  0.00000e+00 0.00000e+00 1.34131e+02 29.238  2.18491e+01 209.238 0.9115 
1 1 1 -12 26  3  o 13 1.95855e+01 7.98113e-01 2.73532e+02 51.314  1.77814e+01  2.22060e+01  0.00000e+00 0.00000e+00 4.55461e+02 51.314  1.81929e+02 51.314  0.9823 
1 1 1 -12 26  4  o 5  7.57710e+00 1.16700e+00 1.91260e+02 104.292 -1.85456e+00 7.28002e+00  0.00000e+00 0.00000e+00 7.58182e+01 104.292 1.15442e+02 284.292 0.9308 
1 1 1 -12 26  5  o 8  2.87634e+01 8.01438e-01 5.78748e+02 349.705 9.95555e+01  -1.80839e+01 0.00000e+00 0.00000e+00 5.04212e+02 349.705 7.45359e+01 169.705 0.9950 
1 1 1 -12 26  6  o 15 1.47572e+01 8.56796e-01 2.16733e+02 156.148 -2.09388e+01 9.25786e+00  0.00000e+00 0.00000e+00 3.28869e+02 156.148 1.12136e+02 156.148 0.9779 
1 1 1 -12 26  7  o 3  1.59492e+01 8.16048e-01 2.62129e+02 42.627  2.33487e+01  2.14903e+01  0.00000e+00 0.00000e+00 3.30762e+02 42.627  6.86327e+01 42.627  0.9841 
1 1 1 -12 26  8  o 19 1.05173e+01 1.07592e+00 2.07151e+02 354.667 1.74719e+01  -1.63103e+00 0.00000e+00 0.00000e+00 1.78273e+02 354.667 2.88784e+01 174.667 0.9711 
1 1 1 -12 26  9  o 19 8.62601e+00 1.15037e+00 1.62927e+02 238.974 -6.71057e+00 -1.11566e+01 0.00000e+00 0.00000e+00 1.49526e+02 238.974 1.34006e+01 58.974  0.9608 
1 1 1 -12 26  10 o 11 9.08377e+00 1.10599e+00 1.13526e+02 99.055  -1.71371e+00 1.07535e+01  0.00000e+00 0.00000e+00 2.12463e+02 99.055  9.89365e+01 99.055  0.9529 
1 1 1 -12 26  11 o 19 4.45569e+00 1.23282e+00 4.67156e+01 67.275  8.68873e-01  2.07452e+00  0.00000e+00 0.00000e+00 7.64341e+01 67.275  2.97185e+01 67.275  0.7347 
1 1 1 -12 26  12 o 1  4.36232e+00 1.19816e+00 6.10316e+01 12.880  3.18363e+00  7.27966e-01  0.00000e+00 0.00000e+00 7.46610e+01 12.880  1.36294e+01 12.880  0.8279 
1 1 1 -12 26  13 o 8  4.30163e+00 1.17919e+00 1.06657e+02 161.183 -5.88866e+00 2.00660e+00  0.00000e+00 0.00000e+00 4.11537e+01 161.183 6.55035e+01 341.183 0.9157 
1 1 1 -12 26  14 o 16 5.10913e+00 1.30420e+00 1.37166e+02 110.352 -3.04036e+00 8.19616e+00  0.00000e+00 0.00000e+00 4.30010e+01 110.352 9.41654e+01 290.352 0.9409 
1 1 1 -12 26  15 o 6  4.06825e+00 1.18251e+00 5.28107e+01 216.991 -2.71862e+00 -2.04794e+00 0.00000e+00 0.00000e+00 7.44636e+01 216.991 2.16529e+01 216.991 0.8359 
1 1 1 -12 26  16 o 3  6.98036e+00 1.28441e+00 1.48438e+02 336.229 1.52483e+01  -6.71598e+00 0.00000e+00 0.00000e+00 1.04482e+02 336.229 4.39563e+01 156.229 0.9695 
1 1 1 -12 26  17 o 19 3.39110e+00 1.05333e+00 9.11428e+01 177.756 -6.73552e+00 2.63970e-01  0.00000e+00 0.00000e+00 2.55972e+01 177.756 6.55456e+01 357.756 0.9225 
1 1 1 -12 27  1  o 16 1.06607e+01 1.17776e+00 1.95913e+02 247.422 -3.72029e+00 -8.94726e+00 0.00000e+00 0.00000e+00 1.87040e+02 247.422 8.87288e+00 67.422  0.9469 
1 1 1 -12 27  2  o 17 1.57018e+01 9.59651e-01 2.10414e+02 223.721 -1.23626e+01 -1.18227e+01 0.00000e+00 0.00000e+00 3.67240e+02 223.721 1.56826e+02 223.721 0.9703 
1 1 1 -12 27  3  o 2  8.45556e+00 1.16848e+00 2.15484e+02 83.733  1.07272e+00  9.76755e+00  0.00000e+00 0.00000e+00 8.81327e+01 83.733  1.27351e+02 263.733 0.9477 
1 1 1 -12 27  4  o 2  1.32274e+01 9.12032e-01 2.40333e+02 36.995  1.39941e+01  1.05432e+01  0.00000e+00 0.00000e+00 2.45999e+02 36.995  5.66574e+00 36.995  0.9710 
1 1 1 -12 27  5  o 1  1.02180e+01 9.81904e-01 6.78412e+01 275.086 3.92949e-01  -4.41500e+00 0.00000e+00 0.00000e+00 2.71716e+02 275.086 2.03874e+02 275.086 0.8783 
1 1 1 -12 27  6  o 15 1.58417e+01 8.24472e-01 2.76011e+02 240.491 -1.55030e+01 -2.73918e+01 0.00000e+00 0.00000e+00 3.13281e+02 240.491 3.72700e+01 240.491 0.9840 
1 1 1 -12 27  7  o 18 9.21520e+00 1.05358e+00 1.07633e+02 74.445  2.05205e+00  7.37179e+00  0.00000e+00 0.00000e+00 2.16822e+02 74.445  1.09188e+02 74.445  0.9322 
1 1 1 -12 27  8  o 8  1.68844e+01 8.23678e-01 3.09960e+02 12.226  4.68208e+01  1.01450e+01  0.00000e+00 0.00000e+00 3.20495e+02 12.226  1.05354e+01 12.226  0.9895 
1 1 1 -12 27  9  o 7  8.32655e+00 1.13044e+00 9.36952e+01 5.538   7.24195e+00  7.02131e-01  0.00000e+00 0.00000e+00 1.97750e+02 5.538   1.04054e+02 5.538   0.9285 
1 1 1 -12 27  10 o 19 7.66070e+00 1.22922e+00 1.57932e+02 254.857 -3.26978e+00 -1.20819e+01 0.00000e+00 0.00000e+00 1.18775e+02 254.857 3.91574e+01 74.856  0.9592 
1 1 1 -12 27  11 o 13 2.96932e+00 9.90173e-01 8.89764e+01 130.416 -2.14834e+00 2.52290e+00  0.00000e+00 0.00000e+00 3.81071e+00 130.416 8.51657e+01 310.416 0.8307 
1 1 1 -12 27  12 o 2  6.20357e+00 1.23859e+00 1.21190e+02 230.378 -5.77897e+00 -6.98014e+00 0.00000e+00 0.00000e+00 9.86193e+01 230.378 2.25702e+01 50.378  0.9431 
1 1 1 -12 27  13 f 0  9.21900e+00 1.15713e+00 1.54525e+02 345.455 1.79908e+01  -4.66790e+00 0.00000e+00 0.00000e+00 1.81968e+02 345.455 2.74429e+01 345.455 0.9727 
1 1 1 -12 27  14 o 18 3.42090e+00 1.08507e+00 3.71456e+01 340.697 1.70226e+00  -5.96205e-01 0.00000e+00 0.00000e+00 4.78166e+01 340.697 1.06709e+01 340.697 0.6627 
1 1 1 -12 27  15 o 9  7.86754e+00 1.34810e+00 1.57022e+02 15.312  1.67005e+01  4.57249e+00  0.00000e+00 0.00000e+00 1.28775e+02 15.312  2.82464e+01 195.312 0.9707 
1 1 1 -12 27  16 o 4  6.09068e+00 1.33219e+00 1.41630e+02 186.107 -1.33001e+01 -1.42313e+00 0.00000e+00 0.00000e+00 7.72968e+01 186.107 6.43336e+01 6.107   0.9619 
1 1 1 -12 27  17 o 11 3.13049e+00 9.80690e-01 6.26992e+01 297.680 2.11328e+00  -4.02863e+00 0.00000e+00 0.00000e+00 4.03007e+01 297.680 2.23985e+01 117.680 0.8818 
1 1 1 -12 28  1  o 10 1.45895e+01 9.85161e-01 2.18643e+02 149.965 -1.42263e+01 8.22531e+00  0.00000e+00 0.00000e+00 3.17676e+02 149.965 9.90327e+01 149.965 0.9691 
1 1 1 -12 28  2  o 7  1.00623e+01 1.13955e+00 1.93601e+02 192.598 -9.46810e+00 -2.11598e+00 0.00000e+00 0.00000e+00 1.67646e+02 192.598 2.59545e+01 12.598  0.9470 
1 1 1 -12 28  3  o 3  9.96419e+00 1.19785e+00 6.80974e+01 153.054 -3.12362e+00 1.58789e+00  0.00000e+00 0.00000e+00 2.49515e+02 153.054 1.81417e+02 153.054 0.8413 
1 1 1 -12 28  4  o 2  1.17597e+01 9.37080e-01 1.83506e+02 316.598 9.13444e+00  -8.63865e+00 0.00000e+00 0.00000e+00 2.43639e+02 316.598 6.01328e+01 316.598 0.9594 
1 1 1 -12 28  5  o 2  1.62696e+01 8.28738e-01 2.54305e+02 10.652  2.68372e+01  5.04752e+00  0.00000e+00 0.00000e+00 3.49837e+02 10.652  9.55325e+01 10.652  0.9815 
1 1 1 -12 28  6  o 18 9.32737e+00 1.11413e+00 1.31790e+02 342.742 7.71395e+00  -2.39646e+00 0.00000e+00 0.00000e+00 1.98191e+02 342.742 6.64008e+01 342.742 0.9359 
1 1 1 -12 28  7  o 19 6.75441e+00 1.20252e+00 1.31562e+02 334.562 5.89068e+00  -2.80183e+00 0.00000e+00 0.00000e+00 1.03077e+02 334.562 2.84855e+01 154.562 0.9198 
1 1 1 -12 28  8  o 11 6.80356e+00 1.25838e+00 1.10457e+02 126.736 -3.55272e+00 4.76005e+00  0.00000e+00 0.00000e+00 1.23516e+02 126.736 1.30590e+01 126.736 0.9114 
1 1 1 -12 28  9  o 17 4.80256e+00 1.24630e+00 7.30596e+01 85.540  2.35751e-01  3.02225e+00  0.00000e+00 0.00000e+00 7.39888e+01 85.540  9.29143e-01 85.540  0.8123 
1 1 1 -12 28  10 o 16 8.50169e+00 1.14560e+00 1.56857e+02 341.499 1.35938e+01  -4.54857e+00 0.00000e+00 0.00000e+00 1.51895e+02 341.499 4.96263e+00 161.499 0.9645 
1 1 1 -12 28  11 o 9  5.13355e+00 1.24838e+00 7.77239e+01 315.032 2.99065e+00  -2.98732e+00 0.00000e+00 0.00000e+00 9.05915e+01 315.032 1.28675e+01 315.032 0.8717 
1 1 1 -12 28  12 o 8  7.47598e+00 1.22596e+00 1.62987e+02 333.154 1.31163e+01  -6.63865e+00 0.00000e+00 0.00000e+00 1.08141e+02 333.154 5.48468e+01 153.154 0.9654 
1 1 1 -12 28  13 o 9  6.23397e+00 1.33643e+00 8.03469e+01 22.081  5.45296e+00  2.21212e+00  0.00000e+00 0.00000e+00 1.32629e+02 22.081  5.22823e+01 22.081  0.9105 
1 1 1 -12 28  14 o 16 5.46240e+00 1.40755e+00 1.14549e+02 203.717 -7.14674e+00 -3.13970e+00 0.00000e+00 0.00000e+00 7.65367e+01 203.717 3.80127e+01 23.717  0.9336 
1 1 1 -12 28  15 o 1  1.07383e+01 1.16238e+00 1.52729e+02 175.447 -2.60775e+01 2.07643e+00  0.00000e+00 0.00000e+00 2.41347e+02 175.447 8.86178e+01 175.447 0.9807 
1 1 1 -12 28  16 o 10 3.08922e+00 1.02530e+00 1.04170e+02 251.129 -2.03948e+00 -5.96663e+00 0.00000e+00 0.00000e+00 1.66783e+00 251.129 1.02502e+02 71.129  0.9169 
1 1 1 -12 28  17 f 0  3.28034e+00 9.79471e-01 4.48311e+01 274.521 2.99786e-01  -3.79121e+00 0.00000e+00 0.00000e+00 5.98765e+01 274.521 1.50454e+01 274.521 0.8555 
1 1 1 -12 29  1  o 10 1.21233e+01 1.05738e+00 2.09595e+02 288.520 4.47615e+00  -1.33620e+01 0.00000e+00 0.00000e+00 2.33620e+02 288.520 2.40241e+01 288.520 0.9638 
1 1 1 -12 29  2  o 11 1.39792e+01 9.66737e-01 2.50882e+02 195.308 -1.90853e+01 -5.22397e+00 0.00000e+00 0.00000e+00 2.65484e+02 195.308 1.46026e+01 195.308 0.9744 
1 1 1 -12 29  3  o 14 2.15101e+01 8.84063e-01 3.67930e+02 66.108  1.76305e+01  3.98015e+01  0.00000e+00 0.00000e+00 4.37557e+02 66.108  6.96274e+01 66.108  0.9884 
1 1 1 -12 29  4  o 13 2.02328e+01 8.97612e-01 2.95208e+02 47.686  2.35532e+01  2.58719e+01  0.00000e+00 0.00000e+00 4.59743e+02 47.686  1.64534e+02 47.686  0.9856 
1 1 1 -12 29  5  o 16 6.07195e+00 1.30171e+00 1.66585e+02 348.025 5.96757e+00  -1.26573e+00 0.00000e+00 0.00000e+00 4.33349e+01 348.025 1.23250e+02 168.025 0.9139 
1 1 1 -12 29  6  o 14 1.44344e+01 1.03591e+00 2.91120e+02 309.836 1.89804e+01  -2.27519e+01 0.00000e+00 0.00000e+00 2.45191e+02 309.836 4.59285e+01 129.836 0.9830 
1 1 1 -12 29  7  o 17 8.67877e+00 1.09154e+00 1.04218e+02 189.955 -6.85648e+00 -1.20339e+00 0.00000e+00 0.00000e+00 1.98987e+02 189.955 9.47690e+01 189.955 0.9251 
1 1 1 -12 29  8  o 16 3.80634e+00 1.14388e+00 1.70310e+01 208.904 -4.72572e-01 -2.60918e-01 0.00000e+00 0.00000e+00 2.03845e+01 208.904 3.35345e+00 208.904 0.2605 
1 1 1 -12 29  9  o 8  8.90105e+00 1.11282e+00 2.40010e+02 302.900 1.10771e+01  -1.71227e+01 0.00000e+00 0.00000e+00 8.71550e+01 302.900 1.52855e+02 122.900 0.9752 
1 1 1 -12 29  10 o 12 1.37184e+01 8.85620e-01 2.40515e+02 198.289 -3.76310e+01 -1.24375e+01 0.00000e+00 0.00000e+00 2.69449e+02 198.289 2.89338e+01 198.289 0.9873 
1 1 1 -12 29  11 o 15 5.42600e+00 1.17596e+00 1.11596e+02 107.374 -1.98245e+00 6.33613e+00  0.00000e+00 0.00000e+00 7.64058e+01 107.374 3.51899e+01 287.374 0.9213 
1 1 1 -12 29  12 o 5  4.35044e+00 1.23797e+00 9.18136e+01 221.159 -3.60060e+00 -3.14759e+00 0.00000e+00 0.00000e+00 5.33196e+01 221.159 3.84940e+01 41.159  0.8881 
1 1 1 -12 29  13 o 18 1.67672e+01 8.71898e-01 2.04370e+02 152.976 -5.00327e+01 2.55195e+01  0.00000e+00 0.00000e+00 4.19076e+02 152.976 2.14706e+02 152.976 0.9911 
1 1 1 -12 29  14 o 13 9.56079e+00 1.23012e+00 1.54712e+02 131.893 -1.36739e+01 1.52433e+01  0.00000e+00 0.00000e+00 1.94661e+02 131.893 3.99494e+01 131.893 0.9753 
1 1 1 -12 29  15 o 10 4.58410e+00 1.34633e+00 8.32456e+01 117.269 -2.49075e+00 4.83220e+00  0.00000e+00 0.00000e+00 7.15748e+01 117.269 1.16708e+01 297.269 0.9026 
1 1 1 -12 29  16 o 7  4.20444e+00 1.21343e+00 6.31257e+01 21.711  4.39944e+00  1.75171e+00  0.00000e+00 0.00000e+00 7.61959e+01 21.711  1.30702e+01 21.711  0.8869 
1 1 1 -12 29  17 o 11 3.61425e+00 1.08077e+00 6.72563e+01 141.724 -4.37916e+00 3.45542e+00  0.00000e+00 0.00000e+00 5.48113e+01 141.724 1.24450e+01 321.724 0.9053 
1 1 1 -12 30  1  o 11 1.49615e+01 9.70687e-01 2.22491e+02 350.675 1.85119e+01  -3.03986e+00 0.00000e+00 0.00000e+00 3.29624e+02 350.675 1.07133e+02 350.675 0.9730 
1 1 1 -12 30  2  o 15 1.69034e+01 9.23538e-01 2.88212e+02 339.185 2.49332e+01  -9.47879e+00 0.00000e+00 0.00000e+00 3.40396e+02 339.185 5.21841e+01 339.185 0.9811 
1 1 1 -12 30  3  o 3  9.07965e+00 1.23982e+00 1.63766e+02 91.314  -1.75161e-01 7.63363e+00  0.00000e+00 0.00000e+00 1.56799e+02 91.314  6.96681e+00 271.314 0.9320 
1 1 1 -12 30  4  o 9  9.81583e+00 1.17225e+00 1.45964e+02 161.974 -7.64354e+00 2.48734e+00  0.00000e+00 0.00000e+00 2.01669e+02 161.974 5.57048e+01 161.974 0.9356 
1 1 1 -12 30  5  o 15 1.84641e+01 9.09379e-01 3.73453e+02 306.284 2.87258e+01  -3.91285e+01 0.00000e+00 0.00000e+00 3.17745e+02 306.284 5.57079e+01 126.284 0.9896 
1 1 1 -12 30  6  o 10 1.71158e+01 9.56349e-01 3.45842e+02 80.452  7.05817e+00  4.19619e+01  0.00000e+00 0.00000e+00 2.93409e+02 80.452  5.24325e+01 260.452 0.9882 
1 1 1 -12 30  7  o 19 1.42332e+01 8.55418e-01 2.35484e+02 248.133 -1.08033e+01 -2.69189e+01 0.00000e+00 0.00000e+00 2.92646e+02 248.133 5.71618e+01 248.133 0.9826 
1 1 1 -12 30  8  o 11 6.86671e+00 1.17563e+00 1.27171e+02 355.546 7.17445e+00  -5.58859e-01 0.00000e+00 0.00000e+00 1.13146e+02 355.546 1.40252e+01 175.546 0.9277 
1 1 1 -12 30  9  o 3  4.54928e+00 1.17283e+00 1.17285e+02 182.801 -4.95739e+00 -2.42581e-01 0.00000e+00 0.00000e+00 3.57446e+01 182.801 8.15404e+01 2.801   0.8925 
1 1 1 -12 30  10 o 10 1.12685e+01 9.57134e-01 1.76358e+02 193.933 -2.13444e+01 -5.29525e+00 0.00000e+00 0.00000e+00 2.38125e+02 193.933 6.17671e+01 193.933 0.9770 
1 1 1 -12 30  11 o 18 3.57450e+00 1.10150e+00 7.02314e+01 35.702  2.38627e+00  1.71485e+00  0.00000e+00 0.00000e+00 3.80251e+01 35.702  3.22063e+01 215.702 0.8053 
1 1 1 -12 30  12 o 7  5.02221e+00 1.37415e+00 1.09463e+02 220.871 -4.62681e+00 -4.00373e+00 0.00000e+00 0.00000e+00 6.29877e+01 220.871 4.64750e+01 40.871  0.9142 
1 1 1 -12 30  13 o 15 4.21342e+00 1.32146e+00 4.56819e+01 174.036 -2.40119e+00 2.50829e-01  0.00000e+00 0.00000e+00 7.37116e+01 174.036 2.80297e+01 174.036 0.7553 
1 1 1 -12 30  14 o 9  5.01084e+00 1.39834e+00 8.72667e+01 136.392 -3.92878e+00 3.74241e+00  0.00000e+00 0.00000e+00 8.21469e+01 136.392 5.11973e+00 316.392 0.9024 
1 1 1 -12 30  15 o 13 4.11523e+00 1.24674e+00 1.12883e+02 62.292  3.43467e+00  6.53994e+00  0.00000e+00 0.00000e+00 3.02492e+01 62.292  8.26343e+01 242.292 0.9296 
1 1 1 -12 30  16 o 15 4.20529e+00 1.30094e+00 5.81524e+01 196.999 -3.96109e+00 -1.21094e+00 0.00000e+00 0.00000e+00 7.83437e+01 196.999 2.01912e+01 196.999 0.8688 
1 1 1 -12 30  17 o 7  2.70067e+00 9.02608e-01 6.37830e+01 292.555 1.78434e+00  -4.29616e+00 0.00000e+00 0.00000e+00 2.53433e+01 292.555 3.84397e+01 112.555 0.8846 
1 1 1 -12 31  1  o 3  2.49631e+01 8.90446e-01 3.59226e+02 0.724   4.93764e+01  6.24249e-01  0.00000e+00 0.00000e+00 5.77847e+02 0.724   2.18621e+02 0.724   0.9898 
1 1 1 -12 31  2  o 18 2.73066e+01 9.06997e-01 3.73369e+02 233.489 -3.35450e+01 -4.53155e+01 0.00000e+00 0.00000e+00 6.52400e+02 233.489 2.79031e+02 233.489 0.9911 
1 1 1 -12 31  3  o 19 1.94392e+01 8.64794e-01 4.02111e+02 11.827  4.52247e+01  9.47054e+00  0.00000e+00 0.00000e+00 3.26201e+02 11.827  7.59092e+01 191.827 0.9891 
1 1 1 -12 31  4  o 14 2.37121e+01 8.94024e-01 4.62830e+02 55.780  4.02825e+01  5.92293e+01  0.00000e+00 0.00000e+00 4.28430e+02 55.780  3.44003e+01 235.780 0.9930 
1 1 1 -12 31  5  o 6  9.77094e+00 1.21288e+00 2.51789e+02 277.801 2.17488e+00  -1.58747e+01 0.00000e+00 0.00000e+00 1.06055e+02 277.801 1.45735e+02 97.801  0.9683 
1 1 1 -12 31  6  o 10 6.84415e+00 1.37135e+00 1.27722e+02 258.759 -1.15478e+00 -5.81045e+00 0.00000e+00 0.00000e+00 1.07956e+02 258.759 1.97666e+01 78.759  0.9112 
1 1 1 -12 31  7  o 3  1.77764e+01 9.22862e-01 3.44818e+02 40.752  3.93149e+01  3.38783e+01  0.00000e+00 0.00000e+00 3.19903e+02 40.752  2.49149e+01 220.752 0.9903 
1 1 1 -12 31  8  o 7  1.33539e+01 1.05745e+00 2.31605e+02 215.133 -2.16946e+01 -1.52657e+01 0.00000e+00 0.00000e+00 2.62564e+02 215.133 3.09586e+01 215.133 0.9810 
1 1 1 -12 31  9  o 3  4.39301e+00 1.17725e+00 9.13258e+01 88.187  1.11684e-01  3.52774e+00  0.00000e+00 0.00000e+00 4.81743e+01 88.187  4.31515e+01 268.187 0.8426 
1 1 1 -12 31  10 o 11 4.86804e+00 1.30975e+00 1.87139e+02 29.422  8.08418e+00  4.55924e+00  0.00000e+00 0.00000e+00 1.40530e+01 209.422 2.01192e+02 209.422 0.9445 
1 1 1 -12 31  11 o 12 9.82015e+00 1.40254e+00 1.94754e+02 64.894  8.48820e+00  1.81154e+01  0.00000e+00 0.00000e+00 1.65164e+02 64.894  2.95898e+01 244.894 0.9747 
1 1 1 -12 31  12 o 13 6.48718e+00 1.56432e+00 1.16445e+02 177.648 -7.52540e+00 3.09065e-01  0.00000e+00 0.00000e+00 1.10400e+02 177.648 6.04537e+00 357.648 0.9310 
1 1 1 -12 31  13 o 7  5.42834e+00 1.51497e+00 9.70564e+01 61.030  2.87605e+00  5.19497e+00  0.00000e+00 0.00000e+00 8.85257e+01 61.030  8.53063e+00 241.030 0.9114 
1 1 1 -12 31  14 o 7  5.42493e+00 1.52501e+00 1.34996e+02 46.073  6.01313e+00  6.24276e+00  0.00000e+00 0.00000e+00 5.61265e+01 46.073  7.88693e+01 226.073 0.9404 
1 1 1 -12 31  15 o 17 5.68822e+00 1.53414e+00 1.20596e+02 131.424 -5.82540e+00 6.60212e+00  0.00000e+00 0.00000e+00 7.97327e+01 131.424 4.08630e+01 311.424 0.9414 
1 1 1 -12 31  16 o 13 3.26297e+00 1.09542e+00 4.11661e+01 48.580  1.78092e+00  2.01864e+00  0.00000e+00 0.00000e+00 5.44455e+01 48.580  1.32794e+01 48.580  0.7844 
1 1 1 -12 31  17 o 16 8.54923e+00 1.00004e+00 1.53211e+02 305.931 1.82175e+01  -2.51379e+01 0.00000e+00 0.00000e+00 1.60515e+02 305.931 7.30360e+00 305.931 0.9838 
1 1 1 -12 32  1  o 18 2.56578e+01 8.95655e-01 4.73420e+02 228.715 -4.44013e+01 -5.05678e+01 0.00000e+00 0.00000e+00 4.92294e+02 228.715 1.88746e+01 228.715 0.9925 
1 1 1 -12 32  2  o 4  2.21418e+01 8.96701e-01 3.19460e+02 218.638 -3.05427e+01 -2.44150e+01 0.00000e+00 0.00000e+00 5.08897e+02 218.638 1.89437e+02 218.638 0.9871 
1 1 1 -12 32  3  o 5  1.08669e+01 1.09976e+00 2.42000e+02 13.183  1.46526e+01  3.43205e+00  0.00000e+00 0.00000e+00 1.55665e+02 13.183  8.63351e+01 193.183 0.9662 
1 1 1 -12 32  4  o 12 1.14522e+01 1.04839e+00 2.47620e+02 342.641 1.75493e+01  -5.48598e+00 0.00000e+00 0.00000e+00 1.73875e+02 342.641 7.37452e+01 162.641 0.9724 
1 1 1 -12 32  5  f 0  2.16286e+01 8.91249e-01 4.72297e+02 122.961 -3.94066e+01 6.07723e+01  0.00000e+00 0.00000e+00 3.40028e+02 122.961 1.32269e+02 302.961 0.9931 
1 1 1 -12 32  6  o 7  2.14539e+01 8.89657e-01 3.07839e+02 291.485 1.80497e+01  -4.58574e+01 0.00000e+00 0.00000e+00 4.94616e+02 291.485 1.86777e+02 291.485 0.9898 
1 1 1 -12 32  7  o 11 1.03564e+01 1.14351e+00 1.66549e+02 349.822 1.33845e+01  -2.40296e+00 0.00000e+00 0.00000e+00 2.09801e+02 349.822 4.32518e+01 349.822 0.9625 
1 1 1 -12 32  8  o 15 8.00566e+00 1.33958e+00 1.16617e+02 211.054 -6.70377e+00 -4.03664e+00 0.00000e+00 0.00000e+00 1.65345e+02 211.054 4.87276e+01 211.054 0.9337 
1 1 1 -12 32  9  o 19 1.24773e+01 1.18698e+00 2.04474e+02 92.874  -1.19996e+00 2.38981e+01  0.00000e+00 0.00000e+00 2.55766e+02 92.874  5.12925e+01 92.874  0.9789 
1 1 1 -12 32  10 o 4  5.29337e+00 1.41041e+00 1.01712e+02 248.021 -1.94824e+00 -4.82712e+00 0.00000e+00 0.00000e+00 7.72060e+01 248.021 2.45062e+01 68.021  0.8979 
1 1 1 -12 32  11 o 13 5.20740e+00 1.45205e+00 1.59027e+02 99.223  -1.32821e+00 8.17977e+00  0.00000e+00 0.00000e+00 2.45467e+01 99.223  1.34480e+02 279.223 0.9376 
1 1 1 -12 32  12 o 10 4.05810e+00 1.26569e+00 1.78720e+01 48.827  5.83976e-01  6.67698e-01  0.00000e+00 0.00000e+00 4.38421e+01 48.827  2.59701e+01 48.827  0.4049 
1 1 1 -12 32  13 o 3  3.99092e+00 1.26153e+00 2.63095e+01 217.930 -1.09545e+00 -8.53699e-01 0.00000e+00 0.00000e+00 5.86301e+01 217.930 3.23206e+01 217.930 0.5674 
1 1 1 -12 32  14 o 10 3.49127e+00 1.16860e+00 6.83606e+01 159.848 -3.13079e+00 1.14890e+00  0.00000e+00 0.00000e+00 4.04486e+01 159.848 2.79120e+01 339.848 0.8320 
1 1 1 -12 32  15 o 13 4.29147e+00 1.35658e+00 5.95569e+01 203.291 -3.31445e+00 -1.42682e+00 0.00000e+00 0.00000e+00 7.63492e+01 203.291 1.67924e+01 203.291 0.8466 
1 1 1 -12 32  16 o 13 4.27216e+00 1.28586e+00 9.14715e+01 226.705 -4.71879e+00 -5.00827e+00 0.00000e+00 0.00000e+00 5.60140e+01 226.705 3.54575e+01 46.705  0.9242 
1 1 1 -12 32  17 f 0  4.19677e+00 1.11365e+00 4.83679e+01 339.240 4.14067e+00  -1.56955e+00 0.00000e+00 0.00000e+00 8.90985e+01 339.240 4.07306e+01 339.240 0.8782 
1 1 1 -12 33  1  o 14 6.98401e+00 1.35005e+00 1.67466e+02 276.439 6.93101e-01  -6.14115e+00 0.00000e+00 0.00000e+00 7.48608e+01 276.439 9.26047e+01 96.439  0.9151 
1 1 1 -12 33  2  o 15 7.70611e+00 1.28815e+00 1.63398e+02 103.073 -1.52680e+00 6.57499e+00  0.00000e+00 0.00000e+00 1.06037e+02 103.073 5.73612e+01 283.073 0.9226 
1 1 1 -12 33  3  o 17 3.02731e+01 9.17768e-01 5.49839e+02 269.875 -2.16045e-01 -9.89282e+01 0.00000e+00 0.00000e+00 5.90846e+02 269.875 4.10072e+01 269.875 0.9949 
1 1 1 -12 33  4  o 15 1.87802e+01 8.81839e-01 2.61543e+02 88.852  6.62460e-01  3.30701e+01  0.00000e+00 0.00000e+00 4.38373e+02 88.852  1.76829e+02 88.852  0.9848 
1 1 1 -12 33  5  o 2  1.52379e+01 9.24600e-01 3.03698e+02 161.059 -3.02111e+01 1.03677e+01  0.00000e+00 0.00000e+00 2.63455e+02 161.059 4.02432e+01 341.059 0.9842 
1 1 1 -12 33  6  o 4  6.79755e+00 1.28606e+00 1.11044e+02 153.855 -4.84467e+00 2.37814e+00  0.00000e+00 0.00000e+00 1.20593e+02 153.855 9.54958e+00 153.855 0.9018 
1 1 1 -12 33  7  o 1  8.52346e+00 1.27591e+00 9.46599e+01 184.236 -6.05102e+00 -4.48164e-01 0.00000e+00 0.00000e+00 1.99254e+02 184.236 1.04594e+02 184.236 0.9134 
1 1 1 -12 33  8  o 17 1.00951e+01 1.22536e+00 1.50351e+02 24.943  1.19191e+01  5.54345e+00  0.00000e+00 0.00000e+00 2.15621e+02 24.943  6.52699e+01 24.943  0.9612 
1 1 1 -12 33  9  o 14 1.05663e+01 1.19425e+00 1.39615e+02 176.268 -1.43223e+01 9.34328e-01  0.00000e+00 0.00000e+00 2.44383e+02 176.268 1.04768e+02 176.268 0.9645 
1 1 1 -12 33  10 o 15 8.52475e+00 1.38307e+00 1.43732e+02 38.229  9.14097e+00  7.20065e+00  0.00000e+00 0.00000e+00 1.63018e+02 38.229  1.92858e+01 38.229  0.9560 
1 1 1 -12 33  11 o 18 3.70833e+00 1.17124e+00 4.77768e+01 310.810 1.34367e+00  -1.55613e+00 0.00000e+00 0.00000e+00 5.07592e+01 310.810 2.98241e+00 310.810 0.7068 
1 1 1 -12 33  12 o 7  8.64060e+00 1.44327e+00 5.28573e+01 4.361   5.01067e+00  3.82125e-01  0.00000e+00 0.00000e+00 2.37209e+02 4.361   1.84352e+02 4.361   0.8940 
1 1 1 -12 33  13 o 3  5.72925e+00 1.52868e+00 1.24578e+02 169.868 -7.55749e+00 1.35055e+00  0.00000e+00 0.00000e+00 7.57717e+01 169.868 4.88063e+01 349.868 0.9324 
1 1 1 -12 33  14 o 9  4.20516e+00 1.44312e+00 9.63525e+01 347.981 4.85158e+00  -1.03291e+00 0.00000e+00 0.00000e+00 4.42173e+01 347.981 5.21352e+01 167.981 0.8925 
1 1 1 -12 33  15 o 1  4.17117e+00 1.30514e+00 1.32540e+02 94.831  -6.77974e-01 8.02182e+00  0.00000e+00 0.00000e+00 1.34435e+01 94.831  1.19096e+02 274.831 0.9357 
1 1 1 -12 33  16 o 7  3.68115e+00 1.17276e+00 3.53645e+01 191.333 -2.48097e+00 -4.97233e-01 0.00000e+00 0.00000e+00 7.02673e+01 191.333 3.49028e+01 191.333 0.7683 
1 1 1 -12 33  17 o 1  3.66368e+00 9.92512e-01 3.95730e+01 314.013 2.63966e+00  -2.73220e+00 0.00000e+00 0.00000e+00 7.72982e+01 314.013 3.77252e+01 314.013 0.8553 
1 1 1 -12 34  1  o 19 6.70847e+00 1.27176e+00 1.46181e+02 120.275 -2.65983e+00 4.55633e+00  0.00000e+00 0.00000e+00 8.25801e+01 120.275 6.36011e+01 300.275 0.8994 
1 1 1 -12 34  2  o 15 2.03420e+01 8.91797e-01 2.97126e+02 267.309 -1.69901e+00 -3.61480e+01 0.00000e+00 0.00000e+00 4.62954e+02 267.309 1.65827e+02 267.309 0.9861 
1 1 1 -12 34  3  o 8  1.03640e+01 1.12796e+00 1.08948e+02 238.270 -3.65923e+00 -5.91794e+00 0.00000e+00 0.00000e+00 2.54106e+02 238.270 1.45158e+02 238.270 0.9251 
1 1 1 -12 34  4  o 13 2.24208e+01 8.85125e-01 4.23216e+02 44.333  4.80270e+01  4.69219e+01  0.00000e+00 0.00000e+00 4.18885e+02 44.333  4.33075e+00 224.333 0.9925 
1 1 1 -12 34  5  o 5  1.59813e+01 9.50291e-01 2.41153e+02 182.828 -2.77612e+01 -1.37138e+00 0.00000e+00 0.00000e+00 3.52178e+02 182.828 1.11025e+02 182.828 0.9818 
1 1 1 -12 34  6  o 5  4.59269e+00 1.22961e+00 1.87744e+02 31.616  5.34018e+00  3.28740e+00  0.00000e+00 0.00000e+00 2.87336e+01 211.616 2.16478e+02 211.616 0.9164 
1 1 1 -12 34  7  o 5  1.46475e+01 9.84875e-01 2.86794e+02 258.740 -7.14968e+00 -3.59105e+01 0.00000e+00 0.00000e+00 2.58529e+02 258.740 2.82649e+01 78.740  0.9862 
1 1 1 -12 34  8  o 4  1.36380e+01 1.03647e+00 2.60618e+02 61.174  1.66036e+01  3.01689e+01  0.00000e+00 0.00000e+00 2.46195e+02 61.174  1.44232e+01 241.174 0.9854 
1 1 1 -12 34  9  o 4  3.64624e+00 1.13194e+00 7.17729e+01 265.601 -2.00256e-01 -2.60332e+00 0.00000e+00 0.00000e+00 3.49051e+01 265.601 3.68678e+01 85.601  0.7766 
1 1 1 -12 34  10 o 12 4.54641e+00 1.26733e+00 1.14791e+02 62.635  2.53946e+00  4.90643e+00  0.00000e+00 0.00000e+00 3.99372e+01 62.635  7.48534e+01 242.635 0.9043 
1 1 1 -12 34  11 o 18 8.17865e+00 1.34579e+00 1.34837e+02 117.465 -5.31685e+00 1.02286e+01  0.00000e+00 0.00000e+00 1.58970e+02 117.465 2.41338e+01 117.465 0.9556 
1 1 1 -12 34  12 o 6  8.63832e+00 1.47207e+00 1.64921e+02 344.011 1.41143e+01  -4.04423e+00 0.00000e+00 0.00000e+00 1.48187e+02 344.011 1.67346e+01 164.011 0.9653 
1 1 1 -12 34  13 o 2  4.11650e+00 1.29121e+00 8.81519e+01 27.979  4.24493e+00  2.25506e+00  0.00000e+00 0.00000e+00 4.90419e+01 27.979  3.91100e+01 207.979 0.8887 
1 1 1 -12 34  14 o 12 6.76412e+00 1.61957e+00 1.23900e+02 257.324 -2.00104e+00 -8.89691e+00 0.00000e+00 0.00000e+00 1.15112e+02 257.324 8.78755e+00 77.324  0.9435 
1 1 1 -12 34  15 o 12 4.68130e+00 1.35077e+00 6.09957e+01 41.750  3.16497e+00  2.82482e+00  0.00000e+00 0.00000e+00 9.17207e+01 41.750  3.07251e+01 41.750  0.8722 
1 1 1 -12 34  16 o 17 8.27622e+00 1.31794e+00 1.36771e+02 198.887 -1.72855e+01 -5.91388e+00 0.00000e+00 0.00000e+00 1.63747e+02 198.887 2.69762e+01 198.887 0.9722 
1 1 1 -12 34  17 o 5  2.79928e+00 8.65395e-01 5.56812e+01 204.300 -4.20300e+00 -1.89771e+00 0.00000e+00 0.00000e+00 3.65507e+01 204.300 1.91305e+01 24.300  0.8835 
1 1 1 -12 35  1  o 17 1.48701e+01 8.46005e-01 1.72406e+02 239.392 -7.88093e+00 -1.33218e+01 0.00000e+00 0.00000e+00 3.72803e+02 239.392 2.00397e+02 239.392 0.9671 
1 1 1 -12 35  2  o 16 7.42202e+00 1.29616e+00 1.39203e+02 163.128 -5.82588e+00 1.76695e+00  0.00000e+00 0.00000e+00 1.17741e+02 163.128 2.14621e+01 343.128 0.9137 
1 1 1 -12 35  3  o 15 5.83230e+00 1.29557e+00 1.53096e+02 351.033 5.33511e+00  -8.41881e-01 0.00000e+00 0.00000e+00 4.60828e+01 351.033 1.07013e+02 171.033 0.9019 
1 1 1 -12 35  4  o 12 1.60075e+01 9.11320e-01 1.90042e+02 164.856 -2.07490e+01 5.61565e+00  0.00000e+00 0.00000e+00 4.01393e+02 164.856 2.11351e+02 164.856 0.9765 
1 1 1 -12 35  5  o 10 6.44652e+00 1.20447e+00 1.15878e+02 16.690  5.13984e+00  1.54109e+00  0.00000e+00 0.00000e+00 1.03788e+02 16.690  1.20896e+01 196.690 0.9012 
1 1 1 -12 35  6  o 18 5.25645e+00 1.24256e+00 1.94452e+01 10.802  7.34661e-01  1.40175e-01  0.00000e+00 0.00000e+00 5.00648e+01 10.802  3.06195e+01 10.802  0.3500 
1 1 1 -12 35  7  o 17 2.41861e+01 9.01129e-01 3.54939e+02 132.510 -5.17905e+01 5.64998e+01  0.00000e+00 0.00000e+00 5.51998e+02 132.510 1.97059e+02 132.510 0.9935 
1 1 1 -12 35  8  o 3  3.50777e+00 1.10202e+00 9.61873e+01 293.618 1.27488e+00  -2.91552e+00 0.00000e+00 0.00000e+00 1.26231e+01 293.618 8.35642e+01 113.618 0.8226 
1 1 1 -12 35  9  o 8  7.43234e+00 1.37999e+00 9.80729e+01 19.444  6.39288e+00  2.25681e+00  0.00000e+00 0.00000e+00 1.60354e+02 19.444  6.22814e+01 19.444  0.9230 
1 1 1 -12 35  10 o 7  6.80785e+00 1.44364e+00 1.19846e+02 158.549 -7.36793e+00 2.89501e+00  0.00000e+00 0.00000e+00 1.19571e+02 158.549 2.74332e-01 338.549 0.9345 
1 1 1 -12 35  11 o 13 6.38194e+00 1.38486e+00 5.62561e+01 324.946 3.30609e+00  -2.31961e+00 0.00000e+00 0.00000e+00 1.51251e+02 324.946 9.49949e+01 324.946 0.8650 
1 1 1 -12 35  12 o 17 7.01085e+00 1.52659e+00 1.59239e+02 342.422 1.14986e+01  -3.64278e+00 0.00000e+00 0.00000e+00 9.28238e+01 342.422 6.64155e+01 162.422 0.9576 
1 1 1 -12 35  13 o 15 4.75137e+00 1.39663e+00 8.82539e+01 219.705 -4.12070e+00 -3.42173e+00 0.00000e+00 0.00000e+00 7.22816e+01 219.705 1.59723e+01 39.705  0.9010 
1 1 1 -12 35  14 o 7  1.08014e+01 1.41482e+00 1.79761e+02 315.903 1.75981e+01  -1.70517e+01 0.00000e+00 0.00000e+00 2.16400e+02 315.903 3.66392e+01 315.903 0.9794 
1 1 1 -12 35  15 o 1  4.54923e+00 1.31601e+00 7.72010e+01 236.713 -2.93620e+00 -4.47218e+00 0.00000e+00 0.00000e+00 7.60725e+01 236.713 1.12855e+00 56.713  0.9009 
1 1 1 -12 35  16 o 4  5.92215e+00 1.32963e+00 8.43755e+01 139.116 -6.03356e+00 5.22348e+00  0.00000e+00 0.00000e+00 1.22424e+02 139.116 3.80487e+01 139.116 0.9351 
1 1 1 -12 36  1  o 11 1.62345e+01 8.59689e-01 2.02659e+02 116.884 -9.78744e+00 1.93051e+01  0.00000e+00 0.00000e+00 3.98352e+02 116.884 1.95693e+02 116.884 0.9766 
1 1 1 -12 36  2  o 4  1.20109e+01 9.08443e-01 2.15161e+02 42.216  1.24296e+01  1.12766e+01  0.00000e+00 0.00000e+00 2.26102e+02 42.216  1.09408e+01 42.216  0.9697 
1 1 1 -12 36  3  o 12 1.57955e+01 9.02363e-01 2.28348e+02 218.978 -1.97911e+01 -1.60139e+01 0.00000e+00 0.00000e+00 3.57820e+02 218.978 1.29472e+02 218.978 0.9802 
1 1 1 -12 36  4  o 9  1.46243e+01 9.16428e-01 2.70383e+02 322.967 2.18619e+01  -1.64938e+01 0.00000e+00 0.00000e+00 2.72722e+02 322.967 2.33878e+00 322.967 0.9816 
1 1 1 -12 36  5  o 10 7.24058e+00 1.26434e+00 7.50584e+01 80.357  6.39196e-01  3.76203e+00  0.00000e+00 0.00000e+00 1.59274e+02 80.357  8.42160e+01 80.357  0.8561 
1 1 1 -12 36  6  o 18 7.90316e+00 1.21194e+00 7.43530e+01 32.123  3.83962e+00  2.41071e+00  0.00000e+00 0.00000e+00 1.88755e+02 32.123  1.14402e+02 32.123  0.8813 
1 1 1 -12 36  7  o 13 1.76904e+01 9.10054e-01 2.94155e+02 143.481 -3.76487e+01 2.78783e+01  0.00000e+00 0.00000e+00 3.66346e+02 143.481 7.21912e+01 143.481 0.9893 
1 1 1 -12 36  8  o 11 7.29151e+00 2.03914e+00 1.46105e+02 344.181 6.21553e+00  -1.76099e+00 0.00000e+00 0.00000e+00 1.06549e+02 344.181 3.95563e+01 164.181 0.9190 
1 1 1 -12 36  9  o 1  1.00187e+01 1.25698e+00 2.42875e+02 219.260 -1.92285e+01 -1.57159e+01 0.00000e+00 0.00000e+00 1.26834e+02 219.260 1.16041e+02 39.260  0.9797 
1 1 1 -12 36  10 o 8  3.99392e+00 1.19754e+00 1.14557e+02 330.157 4.36434e+00  -2.50378e+00 0.00000e+00 0.00000e+00 1.98134e+01 330.157 9.47436e+01 150.157 0.8941 
1 1 1 -12 36  11 o 13 6.14421e+00 1.41597e+00 1.25251e+02 73.237  2.40875e+00  7.99688e+00  0.00000e+00 0.00000e+00 9.13829e+01 73.237  3.38683e+01 253.237 0.9381 
1 1 1 -12 36  12 o 17 1.31343e+01 1.25677e+00 2.53142e+02 272.595 1.80498e+00  -3.98216e+01 0.00000e+00 0.00000e+00 2.33714e+02 272.595 1.94286e+01 92.595  0.9874 
1 1 1 -12 36  13 o 13 9.75126e+00 1.20205e+00 2.20365e+02 294.993 1.31805e+01  -2.82739e+01 0.00000e+00 0.00000e+00 1.39346e+02 294.993 8.10192e+01 114.993 0.9838 
1 1 1 -12 36  14 o 15 5.27707e+00 1.23335e+00 1.00560e+02 221.226 -5.75064e+00 -5.03890e+00 0.00000e+00 0.00000e+00 8.36263e+01 221.226 1.69340e+01 41.226  0.9321 
1 1 1 -12 36  15 o 14 6.51085e+00 1.40167e+00 1.18197e+02 279.833 1.86520e+00  -1.07612e+01 0.00000e+00 0.00000e+00 1.13842e+02 279.833 4.35536e+00 99.833  0.9531 
1 1 1 -12 36  16 f 0  7.96863e+00 1.22744e+00 1.22820e+02 126.400 -1.06642e+01 1.44644e+01  0.00000e+00 0.00000e+00 1.66334e+02 126.400 4.35134e+01 126.400 0.9718 
1 1 1 -12 37  1  o 18 9.83371e+00 1.05374e+00 1.06890e+02 345.554 6.59152e+00  -1.69801e+00 0.00000e+00 0.00000e+00 2.37252e+02 345.554 1.30362e+02 345.554 0.9233 
1 1 1 -12 37  2  o 18 1.66979e+01 8.31649e-01 3.30806e+02 175.880 -3.75353e+01 2.70377e+00  0.00000e+00 0.00000e+00 2.93270e+02 175.880 3.75355e+01 355.880 0.9866 
1 1 1 -12 37  3  o 4  9.07184e+00 9.95301e-01 1.92743e+02 300.877 6.21489e+00  -1.03938e+01 0.00000e+00 0.00000e+00 1.36191e+02 300.877 5.65529e+01 120.877 0.9578 
1 1 1 -12 37  4  o 17 1.14757e+01 1.03869e+00 2.08445e+02 342.353 1.60708e+01  -5.11252e+00 0.00000e+00 0.00000e+00 2.12614e+02 342.353 4.16831e+00 342.353 0.9699 
1 1 1 -12 37  5  o 13 1.30574e+01 9.61242e-01 1.68888e+02 264.240 -1.61836e+00 -1.60451e+01 0.00000e+00 0.00000e+00 3.09151e+02 264.240 1.40264e+02 264.240 0.9685 
1 1 1 -12 37  6  o 10 1.64609e+01 8.77075e-01 2.97491e+02 129.690 -2.68230e+01 3.23200e+01  0.00000e+00 0.00000e+00 3.16810e+02 129.690 1.93198e+01 129.690 0.9880 
1 1 1 -12 37  7  o 8  1.31031e+01 1.00913e+00 2.52671e+02 149.406 -2.48630e+01 1.47003e+01  0.00000e+00 0.00000e+00 2.33176e+02 149.406 1.94942e+01 329.406 0.9825 
1 1 1 -12 37  8  o 13 5.47485e+00 1.30213e+00 1.17603e+02 19.778  5.33971e+00  1.92008e+00  0.00000e+00 0.00000e+00 6.96112e+01 19.778  4.79922e+01 199.778 0.9070 
1 1 1 -12 37  9  o 3  8.89122e+00 1.27049e+00 1.11485e+02 200.865 -9.37218e+00 -3.57234e+00 0.00000e+00 0.00000e+00 2.06238e+02 200.865 9.47528e+01 200.865 0.9488 
1 1 1 -12 37  10 o 16 4.29453e+00 1.20648e+00 4.24588e+01 77.265  4.53194e-01  2.00528e+00  0.00000e+00 0.00000e+00 7.17352e+01 77.265  2.92765e+01 77.265  0.7067 
1 1 1 -12 37  11 o 6  1.17161e+01 9.60945e-01 2.05870e+02 321.228 2.63289e+01  -2.11474e+01 0.00000e+00 0.00000e+00 2.27877e+02 321.228 2.20072e+01 321.228 0.9851 
1 1 1 -12 37  12 o 17 4.52181e+00 1.24459e+00 1.17522e+02 336.944 6.37886e+00  -2.71503e+00 0.00000e+00 0.00000e+00 3.94472e+01 336.944 7.80744e+01 156.944 0.9248 
1 1 1 -12 37  13 o 18 6.70077e+00 1.33049e+00 1.15580e+02 182.157 -9.86958e+00 -3.71784e-01 0.00000e+00 0.00000e+00 1.22558e+02 182.157 6.97742e+00 182.157 0.9479 
1 1 1 -12 37  14 o 17 4.68917e+00 1.32985e+00 5.11135e+01 219.436 -2.52751e+00 -2.07879e+00 0.00000e+00 0.00000e+00 9.43079e+01 219.436 4.31945e+01 219.436 0.8283 
1 1 1 -12 37  15 o 6  8.37002e+00 1.32585e+00 1.32182e+02 101.794 -3.40915e+00 1.63273e+01  0.00000e+00 0.00000e+00 1.71246e+02 101.794 3.90640e+01 101.794 0.9695 
1 1 1 -12 37  16 o 13 5.16754e+00 1.23800e+00 9.27010e+01 68.181  3.21389e+00  8.02745e+00  0.00000e+00 0.00000e+00 8.87140e+01 68.181  3.98700e+00 248.181 0.9403 
1 1 1 -12 38  1  o 10 9.30342e+00 1.07162e+00 1.76838e+02 341.388 1.05423e+01  -3.55043e+00 0.00000e+00 0.00000e+00 1.59512e+02 341.388 1.73266e+01 161.388 0.9539 
1 1 1 -12 38  2  o 7  1.40641e+01 8.74478e-01 2.72076e+02 145.858 -2.24712e+01 1.52383e+01  0.00000e+00 0.00000e+00 2.50730e+02 145.858 2.13464e+01 325.858 0.9814 
1 1 1 -12 38  3  o 6  1.40861e+01 9.07657e-01 2.81076e+02 283.420 6.49068e+00  -2.72024e+01 0.00000e+00 0.00000e+00 2.42507e+02 283.420 3.85689e+01 103.420 0.9820 
1 1 1 -12 38  4  o 8  7.47582e+00 1.17135e+00 1.30666e+02 132.477 -4.46475e+00 4.87638e+00  0.00000e+00 0.00000e+00 1.29759e+02 132.477 9.06615e-01 312.477 0.9209 
1 1 1 -12 38  5  o 18 1.35929e+01 8.07345e-01 2.13536e+02 75.325  6.06852e+00  2.31729e+01  0.00000e+00 0.00000e+00 2.89408e+02 75.325  7.58718e+01 75.325  0.9789 
1 1 1 -12 38  6  o 16 1.39781e+01 7.85234e-01 2.49816e+02 4.826   3.05674e+01  2.58057e+00  0.00000e+00 0.00000e+00 2.69421e+02 4.826   1.96051e+01 4.826   0.9836 
1 1 1 -12 38  7  o 4  1.49787e+01 1.00747e+00 2.68390e+02 171.218 -3.79935e+01 5.86940e+00  0.00000e+00 0.00000e+00 2.89415e+02 171.218 2.10259e+01 171.218 0.9869 
1 1 1 -12 38  8  o 3  9.37434e+00 9.77177e-01 1.00298e+02 160.570 -8.40375e+00 2.96429e+00  0.00000e+00 0.00000e+00 2.32638e+02 160.570 1.32340e+02 160.570 0.9421 
1 1 1 -12 38  9  o 1  3.40874e+00 1.06689e+00 4.30018e+01 320.087 1.18950e+00  -9.95031e-01 0.00000e+00 0.00000e+00 3.51074e+01 320.087 7.89436e+00 140.087 0.6084 
1 1 1 -12 38  10 o 12 9.17143e+00 1.11624e+00 2.12173e+02 188.164 -2.17410e+01 -3.11911e+00 0.00000e+00 0.00000e+00 1.24914e+02 188.164 8.72591e+01 8.164   0.9770 
1 1 1 -12 38  11 o 16 4.37107e+00 1.22964e+00 1.13018e+02 180.760 -5.98014e+00 -7.93222e-02 0.00000e+00 0.00000e+00 3.67942e+01 180.760 7.62237e+01 0.760   0.9121 
1 1 1 -12 38  12 o 13 4.79212e+00 1.28141e+00 7.33608e+01 263.853 -4.79522e-01 -4.45261e+00 0.00000e+00 0.00000e+00 8.48658e+01 263.853 1.15050e+01 263.853 0.8797 
1 1 1 -12 38  13 o 3  3.77998e+00 1.15489e+00 6.14557e+01 247.773 -1.27358e+00 -3.11660e+00 0.00000e+00 0.00000e+00 5.66979e+01 247.773 4.75783e+00 67.773  0.8338 
1 1 1 -12 38  14 o 19 4.01151e+00 1.19131e+00 4.49414e+01 236.529 -1.50986e+00 -2.28365e+00 0.00000e+00 0.00000e+00 7.34852e+01 236.529 2.85439e+01 236.529 0.7886 
1 1 1 -12 38  15 o 15 5.21217e+00 1.39477e+00 9.52576e+01 94.529  -5.53342e-01 6.98533e+00  0.00000e+00 0.00000e+00 8.51124e+01 94.529  1.01452e+01 274.529 0.9256 
1 1 1 -12 38  16 o 14 5.63736e+00 1.32465e+00 9.36257e+01 196.016 -8.67822e+00 -2.49100e+00 0.00000e+00 0.00000e+00 1.04813e+02 196.016 1.11874e+01 196.016 0.9429 
1 1 1 -12 39  1  f 0  1.34454e+01 9.01525e-01 2.55894e+02 18.934  2.30934e+01  7.92198e+00  0.00000e+00 0.00000e+00 2.43075e+02 18.934  1.28190e+01 198.934 0.9793 
1 1 1 -12 39  2  o 7  5.19567e+00 1.20186e+00 8.19987e+01 97.050  -3.41444e-01 2.76100e+00  0.00000e+00 0.00000e+00 7.39446e+01 97.050  8.05412e+00 277.050 0.7925 
1 1 1 -12 39  3  o 3  1.91189e+01 8.12029e-01 3.33880e+02 191.981 -4.42001e+01 -9.37964e+00 0.00000e+00 0.00000e+00 3.81705e+02 191.981 4.78242e+01 191.981 0.9889 
1 1 1 -12 39  4  o 14 3.07206e+01 8.83367e-01 5.98021e+02 293.038 5.66722e+01  -1.33262e+02 0.00000e+00 0.00000e+00 5.59902e+02 293.038 3.81197e+01 113.038 0.9965 
1 1 1 -12 39  5  o 13 1.52595e+01 8.53090e-01 2.58626e+02 63.045  1.47593e+01  2.90226e+01  0.00000e+00 0.00000e+00 3.09167e+02 63.045  5.05413e+01 63.045  0.9845 
1 1 1 -12 39  6  o 18 6.12375e+00 1.26358e+00 1.12954e+02 300.194 2.74895e+00  -4.72429e+00 0.00000e+00 0.00000e+00 9.59066e+01 300.194 1.70477e+01 120.194 0.9032 
1 1 1 -12 39  7  o 16 1.70805e+01 8.69994e-01 2.92775e+02 267.282 -2.33843e+00 -4.92500e+01 0.00000e+00 0.00000e+00 3.45104e+02 267.282 5.23289e+01 267.282 0.9898 
1 1 1 -12 39  8  o 4  4.40468e+00 1.11960e+00 5.69994e+01 110.792 -8.59417e-01 2.26333e+00  0.00000e+00 0.00000e+00 6.85412e+01 110.792 1.15418e+01 110.792 0.7561 
1 1 1 -12 39  9  o 8  5.08177e+00 1.17138e+00 7.62123e+01 54.380  2.45976e+00  3.43327e+00  0.00000e+00 0.00000e+00 9.05787e+01 54.380  1.43664e+01 54.380  0.8716 
1 1 1 -12 39  10 o 10 8.01300e+00 1.10131e+00 1.66789e+02 227.156 -1.06387e+01 -1.14710e+01 0.00000e+00 0.00000e+00 1.24834e+02 227.156 4.19549e+01 47.156  0.9675 
1 1 1 -12 39  11 o 6  1.25260e+01 1.09687e+00 2.47764e+02 325.793 3.31910e+01  -2.25627e+01 0.00000e+00 0.00000e+00 2.16989e+02 325.793 3.07753e+01 145.793 0.9875 
1 1 1 -12 39  12 o 18 8.09870e+00 1.28120e+00 1.97357e+02 191.593 -1.90027e+01 -3.89839e+00 0.00000e+00 0.00000e+00 9.86448e+01 191.593 9.87120e+01 11.593  0.9739 
1 1 1 -12 39  13 o 6  4.93792e+00 1.23460e+00 4.64433e+01 94.876  -2.53401e-01 2.97045e+00  0.00000e+00 0.00000e+00 1.03217e+02 94.876  5.67734e+01 94.876  0.8086 
1 1 1 -12 39  14 f 0  4.26112e+00 1.22410e+00 4.33093e+01 344.919 2.74282e+00  -7.39102e-01 0.00000e+00 0.00000e+00 8.38967e+01 344.919 4.05873e+01 344.919 0.7975 
1 1 1 -12 39  15 o 10 7.91280e+00 1.33224e+00 1.05143e+02 55.232  7.06148e+00  1.01722e+01  0.00000e+00 0.00000e+00 1.78452e+02 55.232  7.33088e+01 55.232  0.9587 
1 1 1 -12 39  16 o 7  4.06691e+00 1.19334e+00 5.01201e+01 58.015  2.00585e+00  3.21196e+00  0.00000e+00 0.00000e+00 7.96504e+01 58.015  2.95303e+01 58.015  0.8548 
1 1 1 -12 40  1  o 18 1.22829e+01 1.17899e+00 1.63499e+02 229.487 -8.44079e+00 -9.87852e+00 0.00000e+00 0.00000e+00 2.83629e+02 229.487 1.20130e+02 229.487 0.9607 
1 1 1 -12 40  2  o 10 1.04803e+01 9.82564e-01 1.27896e+02 239.313 -4.65857e+00 -7.84997e+00 0.00000e+00 0.00000e+00 2.46572e+02 239.313 1.18676e+02 239.313 0.9435 
1 1 1 -12 40  3  o 19 1.65846e+01 8.17927e-01 2.16005e+02 50.356  1.70142e+01  2.05348e+01  0.00000e+00 0.00000e+00 3.99758e+02 50.356  1.83754e+02 50.356  0.9811 
1 1 1 -12 40  4  o 8  6.41988e+00 1.10298e+00 1.55109e+02 143.997 -5.66419e+00 4.11566e+00  0.00000e+00 0.00000e+00 6.96069e+01 143.997 8.55025e+01 323.997 0.9255 
1 1 1 -12 40  5  o 6  4.30782e+00 1.16096e+00 1.35527e+02 30.514  3.95000e+00  2.32802e+00  0.00000e+00 0.00000e+00 8.18316e+00 30.514  1.27343e+02 210.514 0.8828 
1 1 1 -12 40  6  o 13 1.79846e+01 1.00357e+00 2.92197e+02 322.454 3.64566e+01  -2.80206e+01 0.00000e+00 0.00000e+00 3.79459e+02 322.454 8.72614e+01 322.454 0.9891 
1 1 1 -12 40  7  o 17 3.50272e+00 1.06796e+00 5.06240e+01 131.443 -1.12317e+00 1.27206e+00  0.00000e+00 0.00000e+00 3.41044e+01 131.443 1.65196e+01 311.443 0.6412 
1 1 1 -12 40  8  o 9  4.71554e+00 1.18368e+00 9.96030e+01 230.461 -2.92116e+00 -3.53875e+00 0.00000e+00 0.00000e+00 5.73117e+01 230.461 4.22913e+01 50.461  0.8829 
1 1 1 -12 40  9  o 11 8.91932e+00 1.03425e+00 1.57686e+02 64.513  6.77502e+00  1.42122e+01  0.00000e+00 0.00000e+00 1.67303e+02 64.513  9.61618e+00 64.513  0.9677 
1 1 1 -12 40  10 o 6  3.98923e+00 1.11622e+00 1.15405e+02 138.626 -4.20976e+00 3.70801e+00  0.00000e+00 0.00000e+00 2.05114e+01 138.626 9.48937e+01 318.626 0.9058 
1 1 1 -12 40  11 o 13 4.70185e+00 1.21752e+00 6.35409e+01 215.464 -2.95831e+00 -2.10737e+00 0.00000e+00 0.00000e+00 8.62085e+01 215.464 2.26676e+01 215.464 0.8477 
1 1 1 -12 40  12 o 2  3.93780e+00 1.17448e+00 9.40213e+01 80.598  8.32582e-01  5.02801e+00  0.00000e+00 0.00000e+00 3.83165e+01 80.598  5.57048e+01 260.598 0.8956 
1 1 1 -12 40  13 o 3  9.61110e+00 1.17378e+00 1.04104e+02 10.001  1.43083e+01  2.52314e+00  0.00000e+00 0.00000e+00 2.43483e+02 10.001  1.39379e+02 10.001  0.9649 
1 1 1 -12 40  14 o 4  4.16358e+00 1.25226e+00 6.43182e+01 337.828 3.71880e+00  -1.51549e+00 0.00000e+00 0.00000e+00 7.03490e+01 337.828 6.03074e+00 337.828 0.8641 
1 1 1 -12 40  15 o 13 5.46174e+00 1.35665e+00 1.25946e+02 89.122  1.60261e-01  1.04617e+01  0.00000e+00 0.00000e+00 6.81906e+01 89.122  5.77557e+01 269.122 0.9509 
1 1 1 -12 40  16 f 0  4.60461e+00 1.25368e+00 1.01290e+02 15.197  8.08958e+00  2.19749e+00  0.00000e+00 0.00000e+00 5.99750e+01 15.197  4.13151e+01 195.197 0.9383 
1 1 1 -12 41  1  o 15 1.67725e+01 9.54404e-01 2.67335e+02 275.212 2.94148e+00  -3.22451e+01 0.00000e+00 0.00000e+00 3.58233e+02 275.212 9.08984e+01 275.212 0.9844 
1 1 1 -12 41  2  o 9  1.51659e+01 8.41694e-01 2.80479e+02 61.841  1.48798e+01  2.77991e+01  0.00000e+00 0.00000e+00 2.84597e+02 61.841  4.11857e+00 61.841  0.9840 
1 1 1 -12 41  3  o 16 1.67851e+01 8.50486e-01 3.02012e+02 209.093 -3.52444e+01 -1.96109e+01 0.00000e+00 0.00000e+00 3.25230e+02 209.093 2.32179e+01 209.093 0.9875 
1 1 1 -12 41  4  o 4  1.57975e+01 8.14967e-01 2.48100e+02 337.954 2.99284e+01  -1.21200e+01 0.00000e+00 0.00000e+00 3.39952e+02 337.954 9.18516e+01 337.954 0.9844 
1 1 1 -12 41  5  o 13 1.26062e+01 8.47272e-01 2.71575e+02 229.244 -1.93273e+01 -2.24255e+01 0.00000e+00 0.00000e+00 1.96646e+02 229.244 7.49293e+01 49.244  0.9830 
1 1 1 -12 41  6  o 12 1.23437e+01 8.93824e-01 1.97632e+02 36.829  1.77061e+01  1.32600e+01  0.00000e+00 0.00000e+00 2.57745e+02 36.829  6.01128e+01 36.829  0.9771 
1 1 1 -12 41  7  o 14 3.33384e+00 1.01109e+00 2.87418e+01 227.814 -6.09033e-01 -6.72008e-01 0.00000e+00 0.00000e+00 2.31260e+01 227.814 5.61579e+00 47.814  0.4124 
1 1 1 -12 41  8  o 17 3.48481e+00 1.05135e+00 1.39333e+02 299.605 2.59623e+00  -4.56916e+00 0.00000e+00 0.00000e+00 2.12698e+01 119.605 1.60602e+02 119.605 0.8990 
1 1 1 -12 41  9  o 4  5.22198e+00 1.17449e+00 1.83281e+02 220.002 -8.13373e+00 -6.82546e+00 0.00000e+00 0.00000e+00 3.81847e+00 220.002 1.79462e+02 40.002  0.9517 
1 1 1 -12 41  10 o 4  3.80136e+00 1.00686e+00 1.92037e+02 124.107 -5.15533e+00 7.61250e+00  0.00000e+00 0.00000e+00 5.70890e+01 304.107 2.49126e+02 304.107 0.9439 
1 1 1 -12 41  11 o 15 4.35096e+00 1.18273e+00 9.30796e+01 117.313 -2.30297e+00 4.45943e+00  0.00000e+00 0.00000e+00 5.30141e+01 117.313 4.00655e+01 297.313 0.8938 
1 1 1 -12 41  12 o 3  5.16541e+00 1.28272e+00 1.19985e+02 163.055 -7.61149e+00 2.31909e+00  0.00000e+00 0.00000e+00 6.12062e+01 163.055 5.87785e+01 343.055 0.9349 
1 1 1 -12 41  13 o 10 6.69858e+00 1.30746e+00 7.39064e+01 6.359   6.47803e+00  7.21890e-01  0.00000e+00 0.00000e+00 1.56970e+02 6.359   8.30635e+01 6.359   0.9197 
1 1 1 -12 41  14 o 18 3.47172e+00 1.08310e+00 9.41061e+01 358.330 5.61165e+00  -1.63576e-01 0.00000e+00 0.00000e+00 2.36007e+01 358.330 7.05054e+01 178.330 0.9059 
1 1 1 -12 41  15 o 10 8.53142e+00 1.28456e+00 1.59240e+02 314.194 1.52292e+01  -1.56638e+01 0.00000e+00 0.00000e+00 1.52233e+02 314.194 7.00744e+00 134.194 0.9768 
1 1 1 -12 41  16 o 3  3.69865e+00 1.08883e+00 7.23405e+01 338.556 5.26733e+00  -2.06889e+00 0.00000e+00 0.00000e+00 5.28202e+01 338.556 1.95204e+01 158.556 0.9067 
1 1 1 -12 42  1  o 10 2.25107e+01 1.02263e+00 3.83944e+02 186.100 -6.54450e+01 -6.99400e+00 0.00000e+00 0.00000e+00 4.62315e+02 186.100 7.83714e+01 186.100 0.9924 
1 1 1 -12 42  2  o 4  8.05213e+00 1.15900e+00 1.19541e+02 212.819 -5.89422e+00 -3.80129e+00 0.00000e+00 0.00000e+00 1.62663e+02 212.819 4.31218e+01 212.819 0.9257 
1 1 1 -12 42  3  o 2  1.20602e+01 8.67092e-01 1.28553e+02 49.300  7.58115e+00  8.81393e+00  0.00000e+00 0.00000e+00 3.07675e+02 49.300  1.79121e+02 49.300  0.9560 
1 1 1 -12 42  4  o 13 1.63909e+01 9.68113e-01 2.48734e+02 140.180 -2.50165e+01 2.08578e+01  0.00000e+00 0.00000e+00 3.61420e+02 140.180 1.12686e+02 140.180 0.9845 
1 1 1 -12 42  5  o 16 1.19209e+01 8.66713e-01 1.79673e+02 316.991 1.34541e+01  -1.25503e+01 0.00000e+00 0.00000e+00 2.58302e+02 316.991 7.86289e+01 316.991 0.9724 
1 1 1 -12 42  6  o 5  4.69894e+00 1.16045e+00 8.71321e+01 218.939 -2.87740e+00 -2.32497e+00 0.00000e+00 0.00000e+00 6.38029e+01 218.939 2.33292e+01 38.939  0.8509 
1 1 1 -12 42  7  f 0  5.68276e+00 1.13257e+00 8.03666e+01 234.138 -2.53397e+00 -3.50538e+00 0.00000e+00 0.00000e+00 1.07172e+02 234.138 2.68053e+01 234.138 0.8750 
1 1 1 -12 42  8  o 14 8.21367e+00 1.04365e+00 1.55421e+02 99.033  -2.25987e+00 1.42157e+01  0.00000e+00 0.00000e+00 1.43133e+02 99.033  1.22879e+01 279.033 0.9646 
1 1 1 -12 42  9  o 7  1.15587e+01 9.32521e-01 1.45133e+02 350.364 2.06263e+01  -3.50217e+00 0.00000e+00 0.00000e+00 2.79454e+02 350.364 1.34321e+02 350.364 0.9758 
1 1 1 -12 42  10 o 2  6.77990e+00 1.15038e+00 1.59779e+02 86.712  7.18481e-01  1.25067e+01  0.00000e+00 0.00000e+00 8.47752e+01 86.712  7.50039e+01 266.712 0.9592 
1 1 1 -12 42  11 o 11 4.34543e+00 1.14210e+00 8.86571e+01 247.132 -1.96331e+00 -4.65506e+00 0.00000e+00 0.00000e+00 5.73581e+01 247.132 3.12989e+01 67.132  0.8946 
1 1 1 -12 42  12 f 0  4.69359e+00 1.25409e+00 9.38389e+00 353.244 5.81259e-01  -6.88553e-02 0.00000e+00 0.00000e+00 4.00630e+01 353.244 3.06792e+01 353.244 0.2808 
1 1 1 -12 42  13 o 14 5.61959e+00 1.37534e+00 1.25349e+02 332.018 8.14680e+00  -4.32845e+00 0.00000e+00 0.00000e+00 7.34567e+01 332.018 5.18925e+01 152.018 0.9441 
1 1 1 -12 42  14 o 3  6.14919e+00 1.34022e+00 1.40613e+02 85.297  1.05164e+00  1.27844e+01  0.00000e+00 0.00000e+00 8.03384e+01 85.297  6.02750e+01 265.297 0.9602 
1 1 1 -12 42  15 o 11 4.94762e+00 1.30288e+00 6.97477e+01 1.744   5.72522e+00  1.74339e-01  0.00000e+00 0.00000e+00 9.81196e+01 1.744   2.83719e+01 1.744   0.9079 
1 1 1 -12 42  16 o 3  4.69097e+00 1.15997e+00 4.92892e+01 98.500  -7.45163e-01 4.98574e+00  0.00000e+00 0.00000e+00 1.07265e+02 98.500  5.79758e+01 98.500  0.8943 
1 1 1 -12 43  1  o 8  9.24607e+00 1.11981e+00 2.05486e+02 353.029 1.32430e+01  -1.61930e+00 0.00000e+00 0.00000e+00 1.31346e+02 353.029 7.41408e+01 173.029 0.9618 
1 1 1 -12 43  2  o 11 1.54716e+01 8.38410e-01 2.47941e+02 48.234  1.93187e+01  2.16329e+01  0.00000e+00 0.00000e+00 3.27570e+02 48.234  7.96295e+01 48.234  0.9826 
1 1 1 -12 43  3  o 18 4.92507e+00 1.19560e+00 1.00618e+02 176.641 -3.64266e+00 2.13770e-01  0.00000e+00 0.00000e+00 5.74835e+01 176.641 4.31346e+01 356.641 0.8485 
1 1 1 -12 43  4  o 3  1.95862e+01 8.03742e-01 3.96212e+02 244.586 -2.91859e+01 -6.14255e+01 0.00000e+00 0.00000e+00 3.38795e+02 244.586 5.74173e+01 64.586  0.9926 
1 1 1 -12 43  5  o 11 1.13751e+01 8.61240e-01 2.01539e+02 159.141 -1.93885e+01 7.38786e+00  0.00000e+00 0.00000e+00 2.17692e+02 159.141 1.61535e+01 159.141 0.9756 
1 1 1 -12 43  6  o 6  4.90981e+00 1.08738e+00 5.05219e+01 10.293  2.23240e+00  4.05402e-01  0.00000e+00 0.00000e+00 8.61278e+01 10.293  3.56059e+01 10.293  0.7373 
1 1 1 -12 43  7  o 13 7.52212e+00 1.05467e+00 1.19141e+02 358.382 8.26490e+00  -2.33432e-01 0.00000e+00 0.00000e+00 1.46788e+02 358.382 2.76463e+01 358.382 0.9374 
1 1 1 -12 43  8  o 1  7.08353e+00 1.06940e+00 9.77742e+01 296.131 3.39149e+00  -6.91334e+00 0.00000e+00 0.00000e+00 1.51129e+02 296.131 5.33547e+01 296.131 0.9326 
1 1 1 -12 43  9  o 5  6.68760e+00 1.16696e+00 9.53522e+01 165.128 -7.09859e+00 1.88510e+00  0.00000e+00 0.00000e+00 1.38543e+02 165.128 4.31910e+01 165.128 0.9292 
1 1 1 -12 43  10 o 13 6.37331e+00 1.16554e+00 1.27251e+02 57.333  5.58454e+00  8.70993e+00  0.00000e+00 0.00000e+00 1.00491e+02 57.333  2.67596e+01 237.333 0.9504 
1 1 1 -12 43  11 o 13 6.80214e+00 1.28776e+00 1.18641e+02 52.738  5.58410e+00  7.34025e+00  0.00000e+00 0.00000e+00 1.22555e+02 52.738  3.91385e+00 52.738  0.9441 
1 1 1 -12 43  12 o 5  5.85086e+00 1.21779e+00 1.47528e+02 276.329 1.23595e+00  -1.11439e+01 0.00000e+00 0.00000e+00 6.19261e+01 276.329 8.56019e+01 96.329  0.9543 
1 1 1 -12 43  13 o 4  1.90483e+01 8.73067e-01 3.22070e+02 119.326 -4.98363e+01 8.87116e+01  0.00000e+00 0.00000e+00 3.88081e+02 119.326 6.60103e+01 119.326 0.9951 
1 1 1 -12 43  14 o 13 6.44522e+00 1.32805e+00 1.34692e+02 297.736 5.82671e+00  -1.10812e+01 0.00000e+00 0.00000e+00 9.66276e+01 297.736 3.80648e+01 117.736 0.9592 
1 1 1 -12 43  15 o 12 5.03715e+00 1.31427e+00 8.97773e+01 137.597 -5.59261e+00 5.10732e+00  0.00000e+00 0.00000e+00 8.55342e+01 137.597 4.24310e+00 317.597 0.9314 
1 1 1 -12 43  16 o 19 3.29843e+00 1.01294e+00 5.12895e+01 349.518 4.06360e+00  -7.51829e-01 0.00000e+00 0.00000e+00 5.55909e+01 349.518 4.30141e+00 349.518 0.8684 
1 1 1 -12 44  1  o 10 9.71740e+00 1.13368e+00 1.81571e+02 4.002   1.32635e+01  9.27909e-01  0.00000e+00 0.00000e+00 1.72339e+02 4.002   9.23236e+00 184.002 0.9616 
1 1 1 -12 44  2  o 16 1.01045e+01 9.66444e-01 1.40222e+02 63.272  5.04546e+00  1.00197e+01  0.00000e+00 0.00000e+00 2.24786e+02 63.272  8.45638e+01 63.272  0.9543 
1 1 1 -12 44  3  o 15 1.40243e+01 8.20674e-01 2.61807e+02 139.341 -2.31814e+01 1.99105e+01  0.00000e+00 0.00000e+00 2.59946e+02 139.341 1.86105e+00 319.341 0.9835 
1 1 1 -12 44  4  o 3  1.02293e+01 9.01741e-01 1.78637e+02 304.151 8.73187e+00  -1.28722e+01 0.00000e+00 0.00000e+00 1.95398e+02 304.151 1.67609e+01 304.151 0.9673 
1 1 1 -12 44  5  o 4  8.38576e+00 1.00047e+00 1.45642e+02 177.619 -1.06818e+01 4.44162e-01  0.00000e+00 0.00000e+00 1.55913e+02 177.619 1.02709e+01 177.619 0.9520 
1 1 1 -12 44  6  o 8  9.47042e+00 9.93959e-01 1.99491e+02 112.173 -7.02254e+00 1.72315e+01  0.00000e+00 0.00000e+00 1.48198e+02 112.173 5.12923e+01 292.173 0.9727 
1 1 1 -12 44  7  o 4  6.67070e+00 1.04038e+00 1.11998e+02 183.714 -7.42317e+00 -4.81867e-01 0.00000e+00 0.00000e+00 1.21969e+02 183.714 9.97078e+00 183.714 0.9301 
1 1 1 -12 44  8  o 3  5.38253e+00 1.13726e+00 8.25943e+01 252.899 -1.34166e+00 -4.36099e+00 0.00000e+00 0.00000e+00 9.62839e+01 252.899 1.36896e+01 252.899 0.8821 
1 1 1 -12 44  9  o 7  1.28750e+01 9.56311e-01 2.49579e+02 22.081  3.62113e+01  1.46899e+01  0.00000e+00 0.00000e+00 2.28733e+02 22.081  2.08463e+01 202.081 0.9871 
1 1 1 -12 44  10 o 8  4.91465e+00 1.22265e+00 8.09308e+01 113.771 -1.94138e+00 4.40768e+00  0.00000e+00 0.00000e+00 8.33163e+01 113.771 2.38555e+00 113.771 0.8889 
1 1 1 -12 44  11 o 5  1.02065e+01 9.72903e-01 1.08840e+02 333.614 1.49391e+01  -7.41113e+00 0.00000e+00 0.00000e+00 2.62767e+02 333.614 1.53927e+02 333.614 0.9695 
1 1 1 -12 44  12 o 5  3.84354e+00 1.14489e+00 5.75926e+01 286.553 9.15833e-01  -3.08127e+00 0.00000e+00 0.00000e+00 6.12964e+01 286.553 3.70374e+00 286.553 0.8247 
1 1 1 -12 44  13 o 2  9.17130e+00 1.18196e+00 1.37392e+02 253.986 -5.04491e+00 -1.75774e+01 0.00000e+00 0.00000e+00 1.96649e+02 253.986 5.92570e+01 253.986 0.9723 
1 1 1 -12 44  14 o 3  9.19605e+00 1.23139e+00 1.76109e+02 34.734  2.04298e+01  1.41644e+01  0.00000e+00 0.00000e+00 1.60948e+02 34.734  1.51612e+01 214.734 0.9797 
1 1 1 -12 44  15 o 2  8.14762e+00 1.27804e+00 1.09826e+02 203.629 -1.45354e+01 -6.35910e+00 0.00000e+00 0.00000e+00 1.84826e+02 203.629 7.49994e+01 203.629 0.9680 
1 1 1 -12 44  16 o 16 7.00927e+00 1.09959e+00 1.37517e+02 5.138   2.08361e+01  1.87345e+00  0.00000e+00 0.00000e+00 1.17656e+02 5.138   1.98609e+01 185.138 0.9758 
1 1 1 -12 45  1  o 6  1.43378e+01 1.04241e+00 2.81218e+02 66.176  1.27620e+01  2.89033e+01  0.00000e+00 0.00000e+00 2.53078e+02 66.176  2.81394e+01 246.176 0.9840 
1 1 1 -12 45  2  o 19 1.67132e+01 9.53636e-01 2.98662e+02 247.556 -1.53075e+01 -3.70576e+01 0.00000e+00 0.00000e+00 3.25949e+02 247.556 2.72873e+01 247.556 0.9874 
1 1 1 -12 45  3  o 7  1.19394e+01 8.51044e-01 2.35055e+02 150.247 -2.10799e+01 1.20497e+01  0.00000e+00 0.00000e+00 2.07130e+02 150.247 2.79246e+01 330.247 0.9792 
1 1 1 -12 45  4  o 6  5.41436e+00 1.19754e+00 5.44580e+01 109.693 -7.68050e-01 2.14590e+00  0.00000e+00 0.00000e+00 9.67114e+01 109.693 4.22534e+01 109.693 0.7387 
1 1 1 -12 45  5  o 12 9.60829e+00 9.63469e-01 2.22301e+02 167.142 -1.84505e+01 4.21158e+00  0.00000e+00 0.00000e+00 1.30864e+02 167.142 9.14366e+01 347.142 0.9732 
1 1 1 -12 45  6  o 6  7.23431e+00 1.15096e+00 1.19303e+02 8.100   7.67783e+00  1.09273e+00  0.00000e+00 0.00000e+00 1.35437e+02 8.100   1.61341e+01 8.100   0.9331 
1 1 1 -12 45  7  o 12 3.66857e+00 1.04530e+00 1.30900e+02 45.715  3.47357e+00  3.56142e+00  0.00000e+00 0.00000e+00 7.40913e+00 225.715 1.38310e+02 225.715 0.8928 
1 1 1 -12 45  8  o 3  7.04902e+00 1.15806e+00 1.51288e+02 157.075 -1.07773e+01 4.55813e+00  0.00000e+00 0.00000e+00 1.02626e+02 157.075 4.86618e+01 337.075 0.9563 
1 1 1 -12 45  9  o 9  1.49911e+01 7.94047e-01 2.45431e+02 22.293  4.57749e+01  1.87674e+01  0.00000e+00 0.00000e+00 3.12965e+02 22.293  6.75340e+01 22.293  0.9898 
1 1 1 -12 45  10 o 2  3.45014e+00 1.05579e+00 4.95619e+01 291.086 8.19437e-01  -2.12516e+00 0.00000e+00 0.00000e+00 4.62150e+01 291.086 3.34687e+00 111.086 0.7385 
1 1 1 -12 45  11 o 14 3.46842e+00 9.99186e-01 4.56099e+01 183.686 -2.17491e+00 -1.40115e-01 0.00000e+00 0.00000e+00 4.88280e+01 183.686 3.21809e+00 183.686 0.7251 
1 1 1 -12 45  12 o 17 3.14236e+00 1.01173e+00 7.20223e+01 40.093  2.83981e+00  2.39076e+00  0.00000e+00 0.00000e+00 2.83234e+01 40.093  4.36989e+01 220.093 0.8515 
1 1 1 -12 45  13 o 13 5.07638e+00 1.19640e+00 8.74325e+01 67.991  2.42642e+00  6.00290e+00  0.00000e+00 0.00000e+00 8.73415e+01 67.991  9.10054e-02 247.991 0.9192 
1 1 1 -12 45  14 o 4  3.59410e+00 1.13469e+00 6.76869e+01 150.357 -3.69222e+00 2.10114e+00  0.00000e+00 0.00000e+00 4.96099e+01 150.357 1.80770e+01 330.357 0.8724 
1 1 1 -12 45  15 o 12 3.95126e+00 1.19313e+00 7.82724e+01 1.987   5.90386e+00  2.04864e-01  0.00000e+00 0.00000e+00 5.61820e+01 1.987   2.20904e+01 181.987 0.9109 
1 1 1 -12 45  16 o 3  2.71048e+00 9.03478e-01 3.53594e+01 316.303 1.82650e+00  -1.74525e+00 0.00000e+00 0.00000e+00 4.22756e+01 316.303 6.91619e+00 316.303 0.7678 
1 1 1 -12 46  1  o 17 2.05453e+01 9.07650e-01 3.45516e+02 0.855   6.06132e+01  9.05014e-01  0.00000e+00 0.00000e+00 4.25972e+02 0.855   8.04551e+01 0.855   0.9917 
1 1 1 -12 46  2  o 4  2.06381e+01 8.58473e-01 3.55520e+02 238.292 -3.33288e+01 -5.39477e+01 0.00000e+00 0.00000e+00 4.19294e+02 238.292 6.37738e+01 238.292 0.9921 
1 1 1 -12 46  3  o 1  2.05414e+01 7.25170e-01 3.28746e+02 107.165 -1.77870e+01 5.75851e+01  0.00000e+00 0.00000e+00 4.41626e+02 107.165 1.12879e+02 107.165 0.9917 
1 1 1 -12 46  4  o 13 1.17479e+01 8.20811e-01 2.46837e+02 353.563 2.63641e+01  -2.97461e+00 0.00000e+00 0.00000e+00 1.88690e+02 353.563 5.81470e+01 173.563 0.9810 
1 1 1 -12 46  5  o 8  1.04083e+01 8.51454e-01 1.63510e+02 331.482 1.50905e+01  -8.19979e+00 0.00000e+00 0.00000e+00 2.17921e+02 331.482 5.44106e+01 331.482 0.9704 
1 1 1 -12 46  6  f 0  1.00928e+01 8.70254e-01 8.99093e+01 216.835 -7.59447e+00 -5.68871e+00 0.00000e+00 0.00000e+00 2.70254e+02 216.835 1.80345e+02 216.835 0.9457 
1 1 1 -12 46  7  f 0  6.43664e+00 1.10008e+00 1.20882e+02 40.619  6.25825e+00  5.36750e+00  0.00000e+00 0.00000e+00 1.06544e+02 40.619  1.43378e+01 220.619 0.9372 
1 1 1 -12 46  8  o 10 5.86515e+00 1.14533e+00 4.48789e+01 262.594 -3.61210e-01 -2.77881e+00 0.00000e+00 0.00000e+00 1.30569e+02 262.594 8.56896e+01 262.594 0.7942 
1 1 1 -12 46  9  o 6  5.01616e+00 1.14951e+00 1.50574e+02 8.118   8.96274e+00  1.27840e+00  0.00000e+00 0.00000e+00 2.74135e+01 8.118   1.23160e+02 188.118 0.9430 
1 1 1 -12 46  10 o 5  4.04513e+00 1.11967e+00 1.25184e+02 279.202 1.03503e+00  -6.38867e+00 0.00000e+00 0.00000e+00 1.45589e+01 279.202 1.10625e+02 99.203  0.9191 
1 1 1 -12 46  11 o 11 4.59767e+00 1.21918e+00 7.59849e+01 46.298  3.19404e+00  3.34220e+00  0.00000e+00 0.00000e+00 7.65773e+01 46.298  5.92384e-01 46.298  0.8838 
1 1 1 -12 46  12 o 9  4.12750e+00 1.18156e+00 1.35006e+02 203.404 -7.16169e+00 -3.09981e+00 0.00000e+00 0.00000e+00 9.48460e+00 203.404 1.25522e+02 23.405  0.9335 
1 1 1 -12 46  13 o 19 4.76235e+00 1.25538e+00 6.78240e+01 218.249 -3.60039e+00 -2.83824e+00 0.00000e+00 0.00000e+00 8.96272e+01 218.249 2.18032e+01 218.249 0.8828 
1 1 1 -12 46  14 o 17 3.28433e+00 1.06771e+00 3.73672e+01 299.818 1.10976e+00  -1.93637e+00 0.00000e+00 0.00000e+00 5.26045e+01 299.818 1.52372e+01 299.818 0.7324 
1 1 1 -12 46  15 o 14 3.81435e+00 1.16014e+00 6.78753e+01 6.074   4.70754e+00  5.00909e-01  0.00000e+00 0.00000e+00 5.84752e+01 6.074   9.40009e+00 186.074 0.8868 
1 1 1 -12 46  16 f 0  4.11380e+00 1.08592e+00 1.19780e+02 203.143 -1.08388e+01 -4.63282e+00 0.00000e+00 0.00000e+00 2.69998e+01 203.143 9.27799e+01 23.143  0.9566 
1 1 1 -12 47  1  o 17 1.15059e+01 9.82570e-01 1.55738e+02 249.143 -5.31294e+00 -1.39449e+01 0.00000e+00 0.00000e+00 2.65010e+02 249.143 1.09271e+02 249.143 0.9659 
1 1 1 -12 47  2  o 17 7.26581e+00 1.17056e+00 1.69109e+02 185.163 -9.56573e+00 -8.64399e-01 0.00000e+00 0.00000e+00 9.10809e+01 185.163 7.80280e+01 5.163   0.9464 
1 1 1 -12 47  3  o 14 1.64071e+01 7.37680e-01 2.52865e+02 111.673 -1.43833e+01 3.61932e+01  0.00000e+00 0.00000e+00 3.59529e+02 111.673 1.06664e+02 111.673 0.9871 
1 1 1 -12 47  4  o 7  1.19434e+01 8.15468e-01 1.98241e+02 197.953 -2.09179e+01 -6.77763e+00 0.00000e+00 0.00000e+00 2.42680e+02 197.953 4.44389e+01 197.953 0.9770 
1 1 1 -12 47  5  o 16 1.09731e+01 8.24596e-01 2.76213e+02 62.522  1.39831e+01  2.68861e+01  0.00000e+00 0.00000e+00 1.31220e+02 62.522  1.44993e+02 242.522 0.9834 
1 1 1 -12 47  6  o 1  3.31334e+00 9.69044e-01 9.79342e+01 169.267 -3.03350e+00 5.75000e-01  0.00000e+00 0.00000e+00 4.10111e+00 169.267 9.38330e+01 349.267 0.8163 
1 1 1 -12 47  7  o 6  4.96270e+00 1.07741e+00 7.17192e+01 83.403  4.54000e-01  3.92582e+00  0.00000e+00 0.00000e+00 8.94663e+01 83.403  1.77471e+01 83.403  0.8617 
1 1 1 -12 47  8  o 11 1.15818e+01 8.33520e-01 1.94174e+02 146.667 -2.43025e+01 1.59838e+01  0.00000e+00 0.00000e+00 2.34420e+02 146.667 4.02458e+01 146.667 0.9827 
1 1 1 -12 47  9  o 2  7.74305e+00 1.04171e+00 1.49910e+02 102.242 -3.05000e+00 1.40567e+01  0.00000e+00 0.00000e+00 1.31076e+02 102.242 1.88336e+01 282.242 0.9646 
1 1 1 -12 47  10 o 2  6.64851e+00 1.13041e+00 1.33164e+02 99.422  -1.84886e+00 1.11409e+01  0.00000e+00 0.00000e+00 1.05362e+02 99.422  2.78019e+01 279.422 0.9546 
1 1 1 -12 47  11 o 13 1.48062e+01 8.01941e-01 2.24466e+02 73.729  1.58538e+01  5.43175e+01  0.00000e+00 0.00000e+00 3.26407e+02 73.729  1.01942e+02 73.729  0.9911 
1 1 1 -12 47  12 o 10 3.75100e+00 1.13292e+00 1.01446e+02 297.220 2.40705e+00  -4.67952e+00 0.00000e+00 0.00000e+00 2.50089e+01 297.220 7.64372e+01 117.220 0.8991 
1 1 1 -12 47  13 o 18 5.26960e+00 1.29071e+00 1.10691e+02 72.601  2.44398e+00  7.79903e+00  0.00000e+00 0.00000e+00 7.41437e+01 72.601  3.65478e+01 252.600 0.9367 
1 1 1 -12 47  14 o 2  4.58229e+00 1.30429e+00 1.13055e+02 209.307 -6.92481e+00 -3.88708e+00 0.00000e+00 0.00000e+00 4.71325e+01 209.307 6.59222e+01 29.307  0.9347 
1 1 1 -12 47  15 o 4  2.72304e+00 9.05121e-01 2.48765e+01 149.384 -1.40099e+00 8.29077e-01  0.00000e+00 0.00000e+00 3.88074e+01 149.384 1.39309e+01 149.384 0.6262 
1 1 1 -12 47  16 o 12 2.51205e+00 8.50766e-01 5.13995e+01 124.245 -2.12144e+00 3.11631e+00  0.00000e+00 0.00000e+00 2.86118e+01 124.245 2.27877e+01 304.245 0.8541 
1 1 1 -12 48  1  f 0  1.02939e+01 1.04351e+00 6.61355e+01 252.801 -1.64188e+00 -5.30453e+00 0.00000e+00 0.00000e+00 2.86439e+02 252.801 2.20304e+02 252.801 0.9048 
1 1 1 -12 48  2  o 14 9.34036e+00 1.03061e+00 2.64456e+02 86.318  1.29722e+00  2.01602e+01  0.00000e+00 0.00000e+00 8.00548e+01 86.318  1.84402e+02 266.318 0.9749 
1 1 1 -12 48  3  o 5  4.20441e+00 1.10757e+00 4.72426e+01 128.264 -1.03935e+00 1.31773e+00  0.00000e+00 0.00000e+00 5.40516e+01 128.264 6.80899e+00 128.264 0.6372 
1 1 1 -12 48  4  o 13 1.59419e+01 7.50669e-01 2.94834e+02 166.575 -4.76890e+01 1.13832e+01  0.00000e+00 0.00000e+00 3.01312e+02 166.575 6.47779e+00 166.575 0.9897 
1 1 1 -12 48  5  o 4  4.69781e+00 1.13478e+00 9.04095e+01 3.795   3.94799e+00  2.61906e-01  0.00000e+00 0.00000e+00 6.24452e+01 3.795   2.79644e+01 183.795 0.8618 
1 1 1 -12 48  6  o 9  7.66362e+00 9.69892e-01 1.47749e+02 146.344 -9.64092e+00 6.41906e+00  0.00000e+00 0.00000e+00 1.28567e+02 146.344 1.91819e+01 326.344 0.9558 
1 1 1 -12 48  7  o 1  6.16563e+00 1.09575e+00 9.60084e+01 323.803 5.24674e+00  -3.83959e+00 0.00000e+00 0.00000e+00 1.17666e+02 323.803 2.16581e+01 323.803 0.9195 
1 1 1 -12 48  8  o 8  5.92786e+00 1.13049e+00 1.57468e+02 177.683 -1.06071e+01 4.29238e-01  0.00000e+00 0.00000e+00 5.49518e+01 177.683 1.02516e+02 357.683 0.9517 
1 1 1 -12 48  9  f 0  3.63451e+00 1.01382e+00 6.84177e+01 150.776 -2.68286e+00 1.50088e+00  0.00000e+00 0.00000e+00 4.30501e+01 150.776 2.53676e+01 330.776 0.8153 
1 1 1 -12 48  10 o 10 4.73203e+00 1.15239e+00 8.08057e+01 268.368 -1.37216e-01 -4.81562e+00 0.00000e+00 0.00000e+00 7.72644e+01 268.368 3.54130e+00 88.368  0.8890 
1 1 1 -12 48  11 o 19 3.65051e+00 1.07635e+00 7.67931e+01 320.030 3.12872e+00  -2.62251e+00 0.00000e+00 0.00000e+00 4.19495e+01 320.030 3.48436e+01 140.030 0.8666 
1 1 1 -12 48  12 o 15 6.61711e+00 1.24607e+00 1.03747e+02 70.286  3.21244e+00  8.96489e+00  0.00000e+00 0.00000e+00 1.30914e+02 70.286  2.71669e+01 70.286  0.9459 
1 1 1 -12 48  13 o 13 3.36439e+00 9.96247e-01 5.37376e+01 172.722 -3.09551e+00 3.95355e-01  0.00000e+00 0.00000e+00 4.93733e+01 172.722 4.36432e+00 352.722 0.8185 
1 1 1 -12 48  14 o 17 4.83850e+00 1.17103e+00 6.78265e+01 148.256 -4.64269e+00 2.87233e+00  0.00000e+00 0.00000e+00 9.55617e+01 148.256 2.77352e+01 148.256 0.9030 
1 1 1 -12 48  15 o 14 4.40897e+00 1.17552e+00 3.91410e+01 184.203 -3.27270e+00 -2.40505e-01 0.00000e+00 0.00000e+00 9.73181e+01 184.203 5.81772e+01 184.203 0.8288 
1 1 1 -12 48  16 o 15 7.65207e+00 1.06074e+00 9.83531e+01 247.471 -7.25996e+00 -1.75018e+01 0.00000e+00 0.00000e+00 1.79352e+02 247.471 8.09984e+01 247.471 0.9732 
1 1 1 -12 49  1  o 2  2.09867e+01 9.70946e-01 3.19133e+02 307.871 3.60209e+01  -4.63191e+01 0.00000e+00 0.00000e+00 4.68404e+02 307.871 1.49270e+02 307.871 0.9914 
1 1 1 -12 49  2  o 18 1.50508e+01 8.58727e-01 1.72842e+02 48.195  1.59033e+01  1.77838e+01  0.00000e+00 0.00000e+00 3.84432e+02 48.195  2.11590e+02 48.195  0.9788 
1 1 1 -12 49  3  o 12 8.06861e+00 9.89185e-01 1.31353e+02 286.632 2.66930e+00  -8.93554e+00 0.00000e+00 0.00000e+00 1.56821e+02 286.632 2.54680e+01 286.632 0.9448 
1 1 1 -12 49  4  o 19 7.75088e+00 9.84728e-01 1.86167e+02 128.677 -8.56158e+00 1.06954e+01  0.00000e+00 0.00000e+00 9.57427e+01 128.677 9.04243e+01 308.677 0.9628 
1 1 1 -12 49  5  f 0  6.29178e+00 1.04154e+00 9.12967e+01 234.857 -3.24941e+00 -4.61611e+00 0.00000e+00 0.00000e+00 1.23995e+02 234.857 3.26979e+01 234.857 0.9065 
1 1 1 -12 49  6  o 15 4.16362e+00 1.02361e+00 2.84204e+01 206.892 -1.10272e+00 -5.59259e-01 0.00000e+00 0.00000e+00 5.38574e+01 206.892 2.54370e+01 206.892 0.5239 
1 1 1 -12 49  7  f 0  3.54716e+00 1.00737e+00 1.19385e+02 77.693  9.78412e-01  4.48484e+00  0.00000e+00 0.00000e+00 1.36207e+00 257.693 1.20747e+02 257.693 0.8829 
1 1 1 -12 49  8  o 8  7.21419e+00 1.02020e+00 1.31256e+02 184.187 -1.16796e+01 -8.54997e-01 0.00000e+00 0.00000e+00 1.28483e+02 184.187 2.77307e+00 4.187   0.9563 
1 1 1 -12 49  9  o 16 4.80359e+00 1.06800e+00 1.23311e+02 91.792  -2.49420e-01 7.97031e+00  0.00000e+00 0.00000e+00 4.56177e+01 91.792  7.76933e+01 271.792 0.9350 
1 1 1 -12 49  10 o 15 5.03178e+00 1.19638e+00 1.19485e+02 95.909  -7.44540e-01 7.19400e+00  0.00000e+00 0.00000e+00 5.59611e+01 95.909  6.35239e+01 275.909 0.9280 
1 1 1 -12 49  11 o 12 5.08044e+00 1.20977e+00 1.21868e+02 36.656  6.79047e+00  5.05328e+00  0.00000e+00 0.00000e+00 5.71511e+01 36.656  6.47168e+01 216.656 0.9389 
1 1 1 -12 49  12 o 19 1.07290e+01 1.04352e+00 1.96253e+02 141.745 -2.57172e+01 2.02771e+01  0.00000e+00 0.00000e+00 1.99730e+02 141.745 3.47645e+00 141.745 0.9846 
1 1 1 -12 49  13 o 1  5.46649e+00 1.34370e+00 1.38671e+02 86.065  7.31353e-01  1.06329e+01  0.00000e+00 0.00000e+00 5.61311e+01 86.065  8.25400e+01 266.065 0.9519 
1 1 1 -12 49  14 o 4  6.93976e+00 1.33500e+00 8.50801e+01 185.882 -8.72155e+00 -8.98520e-01 0.00000e+00 0.00000e+00 1.59111e+02 185.882 7.40306e+01 185.882 0.9411 
1 1 1 -12 49  15 o 17 6.54009e+00 1.19230e+00 8.34918e+01 217.412 -8.29804e+00 -6.34718e+00 0.00000e+00 0.00000e+00 1.48701e+02 217.412 6.52095e+01 217.412 0.9509 
1 1 1 -12 49  16 o 6  3.60833e+00 1.03413e+00 9.51471e+01 122.582 -4.44202e+00 6.95055e+00  0.00000e+00 0.00000e+00 3.09470e+01 122.582 6.42001e+01 302.582 0.9373 
1 1 1 -12 50  1  o 11 3.76974e+00 1.08414e+00 2.57903e+01 352.212 8.20318e-01  -1.12188e-01 0.00000e+00 0.00000e+00 2.87256e+01 352.212 2.93527e+00 352.212 0.3821 
1 1 1 -12 50  2  o 8  1.21588e+01 1.03553e+00 1.83170e+02 229.517 -1.25339e+01 -1.46842e+01 0.00000e+00 0.00000e+00 2.64634e+02 229.517 8.14639e+01 229.517 0.9737 
1 1 1 -12 50  3  o 5  6.81346e+00 1.06675e+00 1.37293e+02 217.994 -6.90429e+00 -5.39303e+00 0.00000e+00 0.00000e+00 1.05069e+02 217.994 3.22233e+01 37.994  0.9411 
1 1 1 -12 50  4  o 11 3.89234e+00 1.03597e+00 8.53998e+01 233.611 -1.91138e+00 -2.59353e+00 0.00000e+00 0.00000e+00 3.59126e+01 233.611 4.94872e+01 53.611  0.8251 
1 1 1 -12 50  5  f 0  1.13137e+01 7.67836e-01 1.51915e+02 170.873 -1.72360e+01 2.76902e+00  0.00000e+00 0.00000e+00 2.62687e+02 170.873 1.10772e+02 170.873 0.9709 
1 1 1 -12 50  6  o 13 8.89306e+00 8.92161e-01 1.82498e+02 108.342 -5.89843e+00 1.77916e+01  0.00000e+00 0.00000e+00 1.43809e+02 108.342 3.86888e+01 288.342 0.9729 
1 1 1 -12 50  7  o 15 4.64672e+00 1.13066e+00 1.09068e+02 31.626  4.79283e+00  2.95152e+00  0.00000e+00 0.00000e+00 4.95900e+01 31.626  5.94781e+01 211.626 0.9062 
1 1 1 -12 50  8  o 15 5.83241e+00 1.11274e+00 4.53001e+01 115.353 -1.27886e+00 2.69899e+00  0.00000e+00 0.00000e+00 1.32318e+02 115.353 8.70180e+01 115.353 0.8090 
1 1 1 -12 50  9  o 14 4.18662e+00 1.08727e+00 8.60004e+01 225.869 -3.26807e+00 -3.36877e+00 0.00000e+00 0.00000e+00 5.34551e+01 225.869 3.25454e+01 45.869  0.8858 
1 1 1 -12 50  10 o 7  5.92416e+00 1.17433e+00 1.11290e+02 321.135 6.87550e+00  -5.54084e+00 0.00000e+00 0.00000e+00 9.82500e+01 321.135 1.30396e+01 141.135 0.9415 
1 1 1 -12 50  11 o 12 9.17260e+00 1.06481e+00 1.20848e+02 127.702 -9.63164e+00 1.24610e+01  0.00000e+00 0.00000e+00 2.12230e+02 127.702 9.13819e+01 127.702 0.9677 
1 1 1 -12 50  12 o 15 5.53543e+00 1.30269e+00 7.11347e+01 242.465 -2.50374e+00 -4.80248e+00 0.00000e+00 0.00000e+00 1.16042e+02 242.465 4.49076e+01 242.465 0.9022 
1 1 1 -12 50  13 o 13 5.24496e+00 1.21175e+00 9.84047e+01 150.469 -7.04593e+00 3.99142e+00  0.00000e+00 0.00000e+00 8.53729e+01 150.469 1.30318e+01 330.469 0.9361 
1 1 1 -12 50  14 o 14 3.41865e+00 1.10682e+00 8.35891e+01 355.267 5.24695e+00  -4.34381e-01 0.00000e+00 0.00000e+00 3.13281e+01 355.267 5.22610e+01 175.267 0.8992 
1 1 1 -12 50  15 o 1  4.03603e+00 1.15868e+00 8.31925e+01 178.762 -6.41177e+00 1.38611e-01  0.00000e+00 0.00000e+00 5.51783e+01 178.762 2.80143e+01 358.761 0.9183 
1 1 1 -12 50  16 o 7  4.48498e+00 1.14300e+00 3.68735e+01 270.052 3.47363e-03  -3.85802e+00 0.00000e+00 0.00000e+00 1.06553e+02 270.052 6.96794e+01 270.052 0.8578 
1 1 1 -12 51  1  o 9  1.65550e+01 9.93601e-01 2.91585e+02 162.556 -4.04242e+01 1.27026e+01  0.00000e+00 0.00000e+00 3.27404e+02 162.556 3.58184e+01 162.556 0.9881 
1 1 1 -12 51  2  o 1  7.31254e+00 1.06522e+00 1.12341e+02 335.704 7.01952e+00  -3.16887e+00 0.00000e+00 0.00000e+00 1.45566e+02 335.704 3.32251e+01 335.704 0.9326 
1 1 1 -12 51  3  o 16 8.38691e+00 1.04467e+00 1.66989e+02 303.729 7.22147e+00  -1.08163e+01 0.00000e+00 0.00000e+00 1.37539e+02 303.729 2.94505e+01 123.729 0.9608 
1 1 1 -12 51  4  o 13 7.04129e+00 9.97031e-01 1.25356e+02 97.256  -1.06052e+00 8.32902e+00  0.00000e+00 0.00000e+00 1.24193e+02 97.256  1.16310e+00 277.256 0.9384 
1 1 1 -12 51  5  o 2  1.56919e+01 7.00945e-01 2.44037e+02 91.713  -1.28216e+00 4.28841e+01  0.00000e+00 0.00000e+00 3.41207e+02 91.713  9.71698e+01 91.713  0.9883 
1 1 1 -12 51  6  o 7  1.42774e+01 7.52778e-01 2.29903e+02 195.309 -4.01240e+01 -1.09837e+01 0.00000e+00 0.00000e+00 3.01950e+02 195.309 7.20462e+01 195.309 0.9879 
1 1 1 -12 51  7  o 6  1.36023e+01 7.59633e-01 2.32434e+02 350.261 4.15389e+01  -7.12936e+00 0.00000e+00 0.00000e+00 2.73904e+02 350.261 4.14706e+01 350.261 0.9881 
1 1 1 -12 51  8  o 14 4.04571e+00 9.09992e-01 4.57498e+01 54.348  1.45530e+00  2.02887e+00  0.00000e+00 0.00000e+00 7.06878e+01 54.348  2.49379e+01 54.348  0.7647 
1 1 1 -12 51  9  o 17 3.69072e+00 1.05285e+00 7.81339e+01 160.694 -3.62926e+00 1.27137e+00  0.00000e+00 0.00000e+00 4.08385e+01 160.694 3.72954e+01 340.694 0.8573 
1 1 1 -12 51  10 o 2  3.91791e+00 1.12016e+00 3.15891e+01 114.155 -6.54971e-01 1.46047e+00  0.00000e+00 0.00000e+00 5.96558e+01 114.155 2.80668e+01 114.155 0.6200 
1 1 1 -12 51  11 o 4  9.12699e+00 1.05237e+00 1.26776e+02 87.564  7.56405e-01  1.77779e+01  0.00000e+00 0.00000e+00 2.05891e+02 87.564  7.91142e+01 87.564  0.9715 
1 1 1 -12 51  12 o 10 3.65426e+00 1.11188e+00 4.89613e+01 82.951  3.17367e-01  2.56644e+00  0.00000e+00 0.00000e+00 5.70355e+01 82.951  8.07428e+00 82.951  0.7740 
1 1 1 -12 51  13 o 7  3.22420e+00 1.02997e+00 8.45309e+01 20.945  4.74136e+00  1.81485e+00  0.00000e+00 0.00000e+00 2.34884e+01 20.945  6.10424e+01 200.945 0.8951 
1 1 1 -12 51  14 o 19 1.05923e+01 1.14531e+00 1.92250e+02 178.664 -3.64055e+01 8.48719e-01  0.00000e+00 0.00000e+00 1.98201e+02 178.664 5.95055e+00 178.664 0.9862 
1 1 1 -12 51  15 o 19 3.53228e+00 1.03535e+00 4.71858e+01 45.419  2.59120e+00  2.62938e+00  0.00000e+00 0.00000e+00 6.49560e+01 45.419  1.77702e+01 45.419  0.8505 
1 1 1 -12 51  16 o 9  2.74439e+00 9.13952e-01 4.94226e+01 125.842 -2.26474e+00 3.13529e+00  0.00000e+00 0.00000e+00 3.83702e+01 125.842 1.10524e+01 305.842 0.8582 
1 1 1 -12 52  1  o 7  9.53540e+00 1.26669e+00 1.83351e+02 150.214 -1.29481e+01 7.41135e+00  0.00000e+00 0.00000e+00 1.65100e+02 150.214 1.82507e+01 330.214 0.9659 
1 1 1 -12 52  2  o 19 1.42692e+01 8.50085e-01 2.32363e+02 332.444 2.91980e+01  -1.52357e+01 0.00000e+00 0.00000e+00 2.98929e+02 332.444 6.65664e+01 332.444 0.9847 
1 1 1 -12 52  3  o 15 1.27928e+01 8.82091e-01 2.08584e+02 29.078  2.38801e+01  1.32796e+01  0.00000e+00 0.00000e+00 2.65900e+02 29.078  5.73150e+01 29.078  0.9815 
1 1 1 -12 52  4  o 5  1.28663e+01 7.89706e-01 1.41395e+02 274.022 1.36905e+00  -1.94694e+01 0.00000e+00 0.00000e+00 3.31843e+02 274.022 1.90448e+02 274.022 0.9740 
1 1 1 -12 52  5  o 12 5.19725e+00 1.08180e+00 1.21130e+02 16.127  6.17044e+00  1.78421e+00  0.00000e+00 0.00000e+00 5.89892e+01 16.127  6.21404e+01 196.127 0.9185 
1 1 1 -12 52  6  o 8  1.43996e+01 7.50896e-01 2.40754e+02 54.824  2.38852e+01  3.38892e+01  0.00000e+00 0.00000e+00 2.95553e+02 54.824  5.47995e+01 54.824  0.9879 
1 1 1 -12 52  7  o 11 9.49812e+00 8.57901e-01 1.27098e+02 55.483  8.80664e+00  1.28055e+01  0.00000e+00 0.00000e+00 2.18976e+02 55.483  9.18789e+01 55.483  0.9673 
1 1 1 -12 52  8  o 2  3.74179e+00 1.05858e+00 6.11443e+01 266.984 -1.47927e-01 -2.80800e+00 0.00000e+00 0.00000e+00 5.08124e+01 266.984 1.03319e+01 86.984  0.7951 
1 1 1 -12 52  9  o 7  5.09366e+00 1.16278e+00 2.85851e+01 270.556 1.77149e-02  -1.82694e+00 0.00000e+00 0.00000e+00 9.91875e+01 270.556 7.06023e+01 270.556 0.6672 
1 1 1 -12 52  10 o 19 5.67447e+00 1.17367e+00 7.73672e+01 309.304 3.78443e+00  -4.62295e+00 0.00000e+00 0.00000e+00 1.16979e+02 309.304 3.96119e+01 309.304 0.9120 
1 1 1 -12 52  11 o 12 4.17896e+00 1.17064e+00 5.85042e+01 159.529 -3.39490e+00 1.26731e+00  0.00000e+00 0.00000e+00 7.43266e+01 159.529 1.58224e+01 159.529 0.8473 
1 1 1 -12 52  12 o 2  3.77753e+00 1.12613e+00 9.58902e+01 33.979  4.51497e+00  3.04303e+00  0.00000e+00 0.00000e+00 3.18874e+01 33.979  6.40027e+01 213.979 0.9028 
1 1 1 -12 52  13 o 5  4.51438e+00 1.23040e+00 8.66048e+01 85.249  5.00212e-01  6.01914e+00  0.00000e+00 0.00000e+00 6.76313e+01 85.249  1.89734e+01 265.249 0.9130 
1 1 1 -12 52  14 o 14 2.92310e+00 9.99520e-01 8.87590e+01 206.031 -5.05826e+00 -2.47049e+00 0.00000e+00 0.00000e+00 1.02381e+01 206.031 7.85209e+01 26.031  0.9062 
1 1 1 -12 52  15 o 2  3.61048e+00 1.08276e+00 6.17302e+01 39.760  4.01807e+00  3.34299e+00  0.00000e+00 0.00000e+00 5.93288e+01 39.760  2.40140e+00 219.760 0.8984 
1 1 1 -12 53  1  o 1  5.21529e+00 1.15594e+00 7.49289e+01 301.058 1.86611e+00  -3.09860e+00 0.00000e+00 0.00000e+00 9.21711e+01 301.058 1.72422e+01 301.058 0.8470 
1 1 1 -12 53  2  o 14 5.59353e+00 1.18821e+00 1.30884e+02 219.162 -5.17923e+00 -4.21833e+00 0.00000e+00 0.00000e+00 6.40446e+01 219.162 6.68397e+01 39.162  0.9218 
1 1 1 -12 53  3  o 1  3.79227e+00 1.04036e+00 1.76972e+01 173.342 -6.55652e-01 7.65364e-02  0.00000e+00 0.00000e+00 2.71913e+01 173.342 9.49414e+00 173.342 0.3133 
1 1 1 -12 53  4  o 8  6.06420e+00 1.07802e+00 6.67391e+01 264.602 -3.73927e-01 -3.95713e+00 0.00000e+00 0.00000e+00 1.30750e+02 264.602 6.40108e+01 264.602 0.8625 
1 1 1 -12 53  5  o 17 1.36216e+01 7.40016e-01 2.18966e+02 176.118 -3.63339e+01 2.46582e+00  0.00000e+00 0.00000e+00 2.87837e+02 176.118 6.88714e+01 176.118 0.9862 
1 1 1 -12 53  6  o 7  1.03207e+01 8.27966e-01 1.64611e+02 27.803  1.90828e+01  1.00624e+01  0.00000e+00 0.00000e+00 2.15317e+02 27.803  5.07064e+01 27.803  0.9765 
1 1 1 -12 53  7  o 7  1.30509e+01 7.38602e-01 2.56136e+02 208.804 -4.09718e+01 -2.25280e+01 0.00000e+00 0.00000e+00 2.30122e+02 208.804 2.60137e+01 28.804  0.9892 
1 1 1 -12 53  8  o 12 5.07814e+00 1.12392e+00 9.82795e+01 315.089 4.14208e+00  -4.12928e+00 0.00000e+00 0.00000e+00 7.55921e+01 315.089 2.26874e+01 135.089 0.9099 
1 1 1 -12 53  9  o 9  7.41051e+00 1.06146e+00 1.63318e+02 274.405 1.23138e+00  -1.59857e+01 0.00000e+00 0.00000e+00 1.06412e+02 274.405 5.69061e+01 94.405  0.9683 
1 1 1 -12 53  10 o 2  4.25286e+00 1.14036e+00 5.02992e+01 59.440  1.43153e+00  2.42447e+00  0.00000e+00 0.00000e+00 7.67176e+01 59.440  2.64184e+01 59.440  0.7954 
1 1 1 -12 53  11 o 2  4.69146e+00 1.21339e+00 7.48298e+01 75.857  1.19947e+00  4.76009e+00  0.00000e+00 0.00000e+00 8.19970e+01 75.857  7.16727e+00 75.857  0.8912 
1 1 1 -12 53  12 o 5  9.72835e+00 1.11412e+00 1.58140e+02 219.016 -1.86458e+01 -1.51077e+01 0.00000e+00 0.00000e+00 1.98642e+02 219.016 4.05020e+01 219.016 0.9789 
1 1 1 -12 53  13 o 4  5.31067e+00 1.14335e+00 8.21028e+01 139.601 -5.41477e+00 4.60814e+00  0.00000e+00 0.00000e+00 1.02049e+02 139.601 1.99459e+01 139.601 0.9267 
1 1 1 -12 53  14 o 1  6.09240e+00 1.22883e+00 1.59035e+02 89.753  7.71219e-02  1.79090e+01  0.00000e+00 0.00000e+00 6.21750e+01 89.753  9.68598e+01 269.753 0.9717 
1 1 1 -12 53  15 o 17 3.26790e+00 1.02586e+00 8.47013e+01 280.064 1.16693e+00  -6.57515e+00 0.00000e+00 0.00000e+00 2.77034e+01 280.064 5.69979e+01 100.064 0.9217 
1 1 1 -12 54  1  o 7  7.67346e+00 1.31561e+00 1.81816e+02 73.305  3.36934e+00  1.12343e+01  0.00000e+00 0.00000e+00 9.57529e+01 73.305  8.60629e+01 253.305 0.9564 
1 1 1 -12 54  2  o 2  6.20504e+00 1.13812e+00 1.20122e+02 181.695 -7.05075e+00 -2.08659e-01 0.00000e+00 0.00000e+00 9.71076e+01 181.695 2.30145e+01 1.695   0.9261 
1 1 1 -12 54  3  o 15 1.86914e+01 8.73057e-01 3.31952e+02 193.412 -5.93483e+01 -1.41514e+01 0.00000e+00 0.00000e+00 3.68340e+02 193.412 3.63885e+01 193.412 0.9918 
1 1 1 -12 54  4  o 4  1.51692e+01 7.55767e-01 2.72749e+02 352.974 4.74046e+01  -5.84227e+00 0.00000e+00 0.00000e+00 2.93870e+02 352.974 2.11210e+01 352.974 0.9895 
1 1 1 -12 54  5  o 7  4.44002e+00 1.11054e+00 4.83092e+01 163.923 -2.25104e+00 6.48768e-01  0.00000e+00 0.00000e+00 7.67601e+01 163.923 2.84509e+01 163.923 0.7467 
1 1 1 -12 54  6  o 10 1.04333e+01 8.12277e-01 1.51411e+02 250.949 -6.31523e+00 -1.82877e+01 0.00000e+00 0.00000e+00 2.31529e+02 250.949 8.01178e+01 250.949 0.9738 
1 1 1 -12 54  7  o 3  9.85948e+00 8.68159e-01 2.10215e+02 224.013 -1.87941e+01 -1.81577e+01 0.00000e+00 0.00000e+00 1.53898e+02 224.013 5.63173e+01 44.013  0.9807 
1 1 1 -12 54  8  o 15 5.48108e+00 1.10020e+00 1.52505e+02 193.386 -1.07551e+01 -2.55940e+00 0.00000e+00 0.00000e+00 4.41469e+01 193.386 1.08358e+02 13.386  0.9536 
1 1 1 -12 54  9  o 11 1.07651e+01 8.84538e-01 1.74432e+02 349.211 2.77746e+01  -5.29271e+00 0.00000e+00 0.00000e+00 2.22952e+02 349.211 4.85200e+01 349.211 0.9822 
1 1 1 -12 54  10 o 12 1.50762e+01 8.31086e-01 2.51551e+02 106.552 -1.80443e+01 6.07135e+01  0.00000e+00 0.00000e+00 3.09995e+02 106.552 5.84438e+01 106.552 0.9921 
1 1 1 -12 54  11 o 15 1.12841e+01 9.38055e-01 2.16395e+02 254.420 -1.01222e+01 -3.63018e+01 0.00000e+00 0.00000e+00 2.01135e+02 254.420 1.52599e+01 74.420  0.9866 
1 1 1 -12 54  12 f 0  5.09412e+00 1.21322e+00 3.19615e+01 23.043  2.21357e+00  9.41578e-01  0.00000e+00 0.00000e+00 1.11974e+02 23.043  8.00122e+01 23.043  0.7543 
1 1 1 -12 54  13 o 14 3.85769e+00 1.15684e+00 1.77028e+00 248.939 -4.18153e-02 -1.08585e-01 0.00000e+00 0.00000e+00 6.61205e+00 248.939 4.84177e+00 248.939 0.0581 
1 1 1 -12 54  14 o 9  3.34174e+00 1.00219e+00 3.49542e+01 270.234 1.06985e-02  -2.62232e+00 0.00000e+00 0.00000e+00 6.21427e+01 270.234 2.71885e+01 270.234 0.7777 
1 1 1 -12 54  15 o 12 2.86627e+00 9.31436e-01 6.59675e+01 205.068 -4.30959e+00 -2.01580e+00 0.00000e+00 0.00000e+00 2.89396e+01 205.068 3.70280e+01 25.068  0.8874 
1 1 1 -12 55  1  o 8  1.29942e+01 1.16573e+00 2.27951e+02 177.181 -2.76439e+01 1.36099e+00  0.00000e+00 0.00000e+00 2.54491e+02 177.181 2.65392e+01 177.181 0.9818 
1 1 1 -12 55  2  o 6  1.40620e+01 8.28182e-01 2.36571e+02 271.831 1.06039e+00  -3.31743e+01 0.00000e+00 0.00000e+00 2.86836e+02 271.831 5.02650e+01 271.831 0.9848 
1 1 1 -12 55  3  o 16 5.57422e+00 1.16449e+00 1.85024e+02 92.563  -4.36785e-01 9.75854e+00  0.00000e+00 0.00000e+00 1.44343e+01 92.563  1.70590e+02 272.563 0.9473 
1 1 1 -12 55  4  o 3  1.30338e+01 8.65400e-01 1.77545e+02 89.530  2.21759e-01  2.70192e+01  0.00000e+00 0.00000e+00 3.05224e+02 89.530  1.27679e+02 89.530  0.9813 
1 1 1 -12 55  5  o 1  1.52810e+01 7.35324e-01 1.86152e+02 259.407 -6.28451e+00 -3.36054e+01 0.00000e+00 0.00000e+00 3.81699e+02 259.407 1.95547e+02 259.407 0.9853 
1 1 1 -12 55  6  o 8  4.19865e+00 1.09741e+00 7.13410e+01 111.772 -1.27788e+00 3.19944e+00  0.00000e+00 0.00000e+00 6.12840e+01 111.772 1.00570e+01 291.772 0.8382 
1 1 1 -12 55  7  o 1  1.02774e+01 8.54828e-01 2.54828e+02 199.658 -3.41207e+01 -1.21886e+01 0.00000e+00 0.00000e+00 1.26762e+02 199.658 1.28066e+02 19.658  0.9861 
1 1 1 -12 55  8  o 6  1.12317e+01 8.28268e-01 2.16607e+02 69.401  1.27878e+01  3.40236e+01  0.00000e+00 0.00000e+00 2.00039e+02 69.401  1.65684e+01 249.401 0.9861 
1 1 1 -12 55  9  o 3  5.05845e+00 1.16567e+00 1.44305e+02 221.276 -6.70012e+00 -5.88130e+00 0.00000e+00 0.00000e+00 3.47848e+01 221.276 1.09521e+02 41.276  0.9421 
1 1 1 -12 55  10 o 6  5.48802e+00 1.16529e+00 1.33670e+02 229.157 -6.74098e+00 -7.79753e+00 0.00000e+00 0.00000e+00 6.20807e+01 229.157 7.15897e+01 49.157  0.9502 
1 1 1 -12 55  11 o 7  5.31427e+00 1.19342e+00 7.43163e+01 248.635 -2.06308e+00 -5.27387e+00 0.00000e+00 0.00000e+00 1.06377e+02 248.635 3.20609e+01 248.635 0.9068 
1 1 1 -12 55  12 f 0  4.14321e+00 1.20742e+00 7.38197e+01 121.731 -2.41458e+00 3.90485e+00  0.00000e+00 0.00000e+00 6.31902e+01 121.731 1.06294e+01 301.731 0.8829 
1 1 1 -12 55  13 o 10 3.84519e+00 1.15013e+00 6.79119e+01 291.978 1.67994e+00  -4.16264e+00 0.00000e+00 0.00000e+00 5.86609e+01 291.978 9.25102e+00 111.978 0.8800 
1 1 1 -12 55  14 o 16 3.12010e+00 9.82416e-01 6.07498e+01 138.663 -2.98852e+00 2.62890e+00  0.00000e+00 0.00000e+00 3.98109e+01 138.663 2.09389e+01 318.663 0.8628 
1 1 1 -12 55  15 o 6  4.50361e+00 1.20261e+00 4.98191e+01 119.671 -2.37465e+00 4.16810e+00  0.00000e+00 0.00000e+00 9.94504e+01 119.671 4.96313e+01 119.671 0.8885 
1 1 1 -12 56  1  o 5  1.08214e+01 1.24992e+00 1.80447e+02 80.883  2.83003e+00  1.76354e+01  0.00000e+00 0.00000e+00 2.17101e+02 80.883  3.66544e+01 80.883  0.9716 
1 1 1 -12 56  2  o 5  7.38558e+00 1.30448e+00 9.62399e+01 357.402 6.33413e+00  -2.87429e-01 0.00000e+00 0.00000e+00 1.59790e+02 357.402 6.35501e+01 357.402 0.9173 
1 1 1 -12 56  3  o 7  1.43567e+01 8.58967e-01 2.04605e+02 118.440 -1.55654e+01 2.87395e+01  0.00000e+00 0.00000e+00 3.29225e+02 118.440 1.24620e+02 118.440 0.9846 
1 1 1 -12 56  4  o 9  6.41201e+00 1.14974e+00 1.46198e+02 309.444 6.39590e+00  -7.77423e+00 0.00000e+00 0.00000e+00 8.34334e+01 309.444 6.27647e+01 129.444 0.9490 
1 1 1 -12 56  5  o 12 1.16655e+01 7.86573e-01 2.15722e+02 186.917 -3.22230e+01 -3.90917e+00 0.00000e+00 0.00000e+00 2.17361e+02 186.917 1.63952e+00 186.917 0.9845 
1 1 1 -12 56  6  o 9  7.46356e+00 9.87983e-01 1.25878e+02 223.896 -8.51144e+00 -8.18952e+00 0.00000e+00 0.00000e+00 1.43165e+02 223.896 1.72873e+01 223.896 0.9567 
1 1 1 -12 56  7  o 3  9.62784e+00 8.59735e-01 1.28444e+02 159.404 -1.56047e+01 5.86406e+00  0.00000e+00 0.00000e+00 2.22965e+02 159.404 9.45204e+01 159.404 0.9695 
1 1 1 -12 56  8  o 9  7.93904e+00 1.01295e+00 8.46751e+01 109.610 -3.05210e+00 8.56670e+00  0.00000e+00 0.00000e+00 1.96991e+02 109.610 1.12316e+02 109.610 0.9433 
1 1 1 -12 56  9  o 3  3.26830e+00 9.80508e-01 5.59776e+01 9.059   2.51719e+00  4.01320e-01  0.00000e+00 0.00000e+00 3.86064e+01 9.059   1.73712e+01 189.059 0.7702 
1 1 1 -12 56  10 o 16 5.37830e+00 1.19545e+00 3.43323e+01 66.934  9.52450e-01  2.23671e+00  0.00000e+00 0.00000e+00 1.18537e+02 66.934  8.42049e+01 66.934  0.7573 
1 1 1 -12 56  11 o 6  3.75401e+00 1.09020e+00 5.38125e+01 260.694 -4.93235e-01 -3.01008e+00 0.00000e+00 0.00000e+00 6.06997e+01 260.694 6.88713e+00 260.694 0.8136 
1 1 1 -12 56  12 o 4  4.26526e+00 1.17180e+00 9.00661e+01 40.482  4.65995e+00  3.97741e+00  0.00000e+00 0.00000e+00 5.59630e+01 40.482  3.41031e+01 220.482 0.9143 
1 1 1 -12 56  13 o 2  4.00029e+00 1.19552e+00 4.52260e+01 135.787 -2.11780e+00 2.06039e+00  0.00000e+00 0.00000e+00 7.54473e+01 135.787 3.02213e+01 135.787 0.8066 
1 1 1 -12 56  14 o 17 6.77445e+00 1.20647e+00 9.12958e+01 354.103 1.14078e+01  -1.17822e+00 0.00000e+00 0.00000e+00 1.50441e+02 354.103 5.91451e+01 354.103 0.9554 
1 1 1 -12 56  15 o 2  4.08027e+00 1.18603e+00 5.26737e+01 276.456 5.14350e-01  -4.54561e+00 0.00000e+00 0.00000e+00 8.16350e+01 276.456 2.89613e+01 276.456 0.8825 
1 1 1 -12 57  1  o 11 7.76203e+00 1.85769e+00 1.28055e+02 152.298 -6.24119e+00 3.27692e+00  0.00000e+00 0.00000e+00 1.43700e+02 152.298 1.56456e+01 152.298 0.9261 
1 1 1 -12 57  2  o 13 1.35215e+01 1.05722e+00 2.46939e+02 199.139 -3.41161e+01 -1.18396e+01 0.00000e+00 0.00000e+00 2.56831e+02 199.139 9.89199e+00 199.139 0.9861 
1 1 1 -12 57  3  o 19 1.08058e+01 9.75227e-01 1.78909e+02 252.523 -6.75239e+00 -2.14454e+01 0.00000e+00 0.00000e+00 2.19936e+02 252.523 4.10270e+01 252.523 0.9775 
1 1 1 -12 57  4  o 16 5.39749e+00 1.13210e+00 5.62250e+01 33.383  2.60872e+00  1.71902e+00  0.00000e+00 0.00000e+00 1.10529e+02 33.383  5.43035e+01 33.383  0.8188 
1 1 1 -12 57  5  o 19 7.50807e+00 9.59686e-01 1.59689e+02 300.264 7.41957e+00  -1.27153e+01 0.00000e+00 0.00000e+00 1.13610e+02 300.264 4.60784e+01 120.264 0.9654 
1 1 1 -12 57  6  o 16 6.73122e+00 1.07320e+00 1.39439e+02 354.644 1.07743e+01  -1.01018e+00 0.00000e+00 0.00000e+00 1.02134e+02 354.644 3.73052e+01 174.644 0.9526 
1 1 1 -12 57  7  o 3  1.33692e+01 7.71136e-01 2.90799e+02 106.420 -1.51038e+01 5.12534e+01  0.00000e+00 0.00000e+00 2.07694e+02 106.420 8.31044e+01 286.420 0.9906 
1 1 1 -12 57  8  o 6  4.26207e+00 1.11288e+00 4.98823e+01 86.199  1.81536e-01  2.73222e+00  0.00000e+00 0.00000e+00 7.65121e+01 86.199  2.66298e+01 86.199  0.7886 
1 1 1 -12 57  9  o 10 5.21200e+00 1.18281e+00 9.28891e+01 169.890 -6.45185e+00 1.15039e+00  0.00000e+00 0.00000e+00 8.72846e+01 169.890 5.60456e+00 349.890 0.9202 
1 1 1 -12 57  10 f 0  6.48031e+00 1.21161e+00 1.12823e+02 258.254 -2.15019e+00 -1.03409e+01 0.00000e+00 0.00000e+00 1.18551e+02 258.254 5.72799e+00 258.254 0.9514 
1 1 1 -12 57  11 o 10 9.96800e+00 1.01705e+00 1.60786e+02 162.783 -2.34269e+01 7.25936e+00  0.00000e+00 0.00000e+00 2.05170e+02 162.783 4.43840e+01 162.783 0.9794 
1 1 1 -12 57  12 o 1  3.58232e+00 1.02835e+00 3.23106e+01 171.191 -2.04061e+00 3.16223e-01  0.00000e+00 0.00000e+00 6.26717e+01 171.191 3.03612e+01 171.191 0.7082 
1 1 1 -12 57  13 o 16 6.51891e+00 1.37079e+00 9.98193e+01 222.646 -7.20362e+00 -6.63474e+00 0.00000e+00 0.00000e+00 1.31148e+02 222.646 3.13289e+01 222.646 0.9475 
1 1 1 -12 57  14 o 10 3.92452e+00 1.10554e+00 2.76986e+01 10.853  2.20012e+00  4.21796e-01  0.00000e+00 0.00000e+00 7.98087e+01 10.853  5.21101e+01 10.853  0.7335 
1 1 1 -12 57  15 o 14 3.89424e+00 1.14769e+00 6.74709e+01 120.717 -3.09888e+00 5.21553e+00  0.00000e+00 0.00000e+00 6.51824e+01 120.717 2.28854e+00 300.717 0.9134 
1 1 1 -12 58  1  o 19 7.74988e+00 1.39598e+00 1.28772e+02 233.298 -5.50864e+00 -7.38979e+00 0.00000e+00 0.00000e+00 1.47790e+02 233.298 1.90172e+01 233.298 0.9441 
1 1 1 -12 58  2  o 9  6.51347e+00 1.31870e+00 1.88606e+02 83.149  1.45291e+00  1.20928e+01  0.00000e+00 0.00000e+00 4.71300e+01 83.149  1.41476e+02 263.149 0.9580 
1 1 1 -12 58  3  o 19 2.79102e+00 9.09084e-01 8.60747e+01 86.431  1.78249e-01  2.85756e+00  0.00000e+00 0.00000e+00 1.84804e+00 266.431 8.79228e+01 266.431 0.7993 
1 1 1 -12 58  4  o 1  1.23198e+01 8.29245e-01 1.58062e+02 173.991 -2.45775e+01 2.58722e+00  0.00000e+00 0.00000e+00 2.97228e+02 173.991 1.39166e+02 173.991 0.9796 
1 1 1 -12 58  5  o 17 5.47242e+00 1.02967e+00 1.14610e+02 39.980  5.73832e+00  4.81163e+00  0.00000e+00 0.00000e+00 7.73795e+01 39.980  3.72301e+01 219.980 0.9306 
1 1 1 -12 58  6  o 5  8.34535e+00 9.37293e-01 1.67711e+02 145.757 -1.46241e+01 9.95444e+00  0.00000e+00 0.00000e+00 1.37622e+02 145.757 3.00888e+01 325.757 0.9713 
1 1 1 -12 58  7  o 16 5.35058e+00 1.06884e+00 1.26604e+02 106.684 -2.56275e+00 8.55099e+00  0.00000e+00 0.00000e+00 6.31255e+01 106.684 6.34783e+01 286.684 0.9422 
1 1 1 -12 58  8  o 4  3.60259e+00 1.02179e+00 3.83300e+01 225.081 -1.36821e+00 -1.37208e+00 0.00000e+00 0.00000e+00 5.47642e+01 225.081 1.64342e+01 225.081 0.6873 
1 1 1 -12 58  9  o 19 3.86060e+00 1.08166e+00 5.49774e+01 257.082 -6.45345e-01 -2.81362e+00 0.00000e+00 0.00000e+00 6.12114e+01 257.082 6.23404e+00 257.082 0.8012 
1 1 1 -12 58  10 o 2  9.84188e+00 9.94345e-01 1.63352e+02 339.381 2.36226e+01  -8.88809e+00 0.00000e+00 0.00000e+00 1.98540e+02 339.381 3.51883e+01 339.381 0.9800 
1 1 1 -12 58  11 o 7  5.42506e+00 1.20400e+00 6.38048e+01 308.708 3.09686e+00  -3.86436e+00 0.00000e+00 0.00000e+00 1.17617e+02 308.708 5.38125e+01 308.708 0.8923 
1 1 1 -12 58  12 o 16 3.73210e+00 1.10020e+00 7.17432e+01 125.591 -2.75763e+00 3.85314e+00  0.00000e+00 0.00000e+00 5.21719e+01 125.591 1.95713e+01 305.591 0.8869 
1 1 1 -12 58  13 o 15 3.17477e+00 9.80306e-01 3.32186e+01 47.260  1.45133e+00  1.57059e+00  0.00000e+00 0.00000e+00 5.21565e+01 47.260  1.89379e+01 47.260  0.7193 
1 1 1 -12 58  14 o 1  2.74652e+00 8.91830e-01 2.04057e+01 348.767 1.30463e+00  -2.59096e-01 0.00000e+00 0.00000e+00 3.61265e+01 348.767 1.57208e+01 348.767 0.5512 
1 1 1 -12 58  15 o 6  3.15081e+00 1.00584e+00 6.17211e+01 177.874 -5.20577e+00 1.93244e-01  0.00000e+00 0.00000e+00 4.37862e+01 177.874 1.79349e+01 357.874 0.8980 
1 1 1 -12 59  1  o 12 5.35127e+00 1.29475e+00 1.03918e+02 256.956 -1.25677e+00 -5.42458e+00 0.00000e+00 0.00000e+00 7.91284e+01 256.956 2.47895e+01 76.956  0.9051 
1 1 1 -12 59  2  o 8  6.46813e+00 1.27303e+00 7.78519e+01 164.086 -4.89660e+00 1.39608e+00  0.00000e+00 0.00000e+00 1.40922e+02 164.086 6.30698e+01 164.086 0.8955 
1 1 1 -12 59  3  f 0  6.27062e+00 1.10899e+00 7.45748e+01 236.029 -2.93912e+00 -4.36226e+00 0.00000e+00 0.00000e+00 1.38239e+02 236.029 6.36646e+01 236.029 0.8991 
1 1 1 -12 59  4  o 5  7.15585e+00 1.04451e+00 2.02011e+02 302.279 9.12245e+00  -1.44420e+01 0.00000e+00 0.00000e+00 5.98933e+01 302.279 1.42118e+02 122.279 0.9703 
1 1 1 -12 59  5  o 18 8.49458e+00 9.15002e-01 1.11949e+02 329.496 1.06446e+01  -6.27122e+00 0.00000e+00 0.00000e+00 1.94990e+02 329.496 8.30407e+01 329.496 0.9586 
1 1 1 -12 59  6  o 10 4.72758e+00 1.09541e+00 4.58538e+01 298.493 1.24864e+00  -2.30041e+00 0.00000e+00 0.00000e+00 9.25242e+01 298.493 4.66704e+01 298.493 0.7772 
1 1 1 -12 59  7  o 9  3.03219e+00 9.39149e-01 3.20981e+01 97.152  -1.71496e-01 1.36675e+00  0.00000e+00 0.00000e+00 3.22927e+01 97.152  1.94607e-01 97.152  0.5644 
1 1 1 -12 59  8  o 9  8.76426e+00 9.62229e-01 1.14399e+02 321.088 1.05884e+01  -8.54749e+00 0.00000e+00 0.00000e+00 2.02731e+02 321.088 8.83317e+01 321.088 0.9625 
1 1 1 -12 59  9  o 8  3.72469e+00 1.08352e+00 7.69039e+01 12.434  4.05613e+00  8.94293e-01  0.00000e+00 0.00000e+00 4.46790e+01 12.434  3.22249e+01 192.434 0.8692 
1 1 1 -12 59  10 o 5  6.03331e+00 1.21021e+00 9.02641e+01 32.326  6.44116e+00  4.07596e+00  0.00000e+00 0.00000e+00 1.20662e+02 32.326  3.03984e+01 32.326  0.9319 
1 1 1 -12 59  11 o 19 3.88400e+00 1.12218e+00 4.68359e+01 294.110 1.15328e+00  -2.57702e+00 0.00000e+00 0.00000e+00 6.90228e+01 294.110 2.21869e+01 294.110 0.7960 
1 1 1 -12 59  12 o 8  6.29452e+00 1.22853e+00 1.08678e+02 154.234 -9.47632e+00 4.57406e+00  0.00000e+00 0.00000e+00 1.15429e+02 154.234 6.75102e+00 154.234 0.9512 
1 1 1 -12 59  13 o 5  5.14347e+00 1.08339e+00 1.05328e+02 331.677 9.44368e+00  -5.08973e+00 0.00000e+00 0.00000e+00 7.77535e+01 331.677 2.75746e+01 151.677 0.9522 
1 1 1 -12 59  14 o 4  2.91116e+00 9.61386e-01 4.60102e+01 171.281 -3.12229e+00 4.78851e-01  0.00000e+00 0.00000e+00 4.32270e+01 171.281 2.78323e+00 351.281 0.8211 
1 1 1 -12 60  1  o 11 1.24757e+01 7.96971e-01 2.44624e+02 42.063  2.66809e+01  2.40767e+01  0.00000e+00 0.00000e+00 2.20195e+02 42.063  2.44285e+01 222.063 0.9860 
1 1 1 -12 60  2  o 1  6.95771e+00 1.28156e+00 1.13623e+02 275.179 7.37963e-01  -8.14223e+00 0.00000e+00 0.00000e+00 1.32501e+02 275.179 1.88778e+01 275.179 0.9367 
1 1 1 -12 60  3  o 19 6.88333e+00 1.26858e+00 1.40796e+02 334.253 8.77657e+00  -4.23269e+00 0.00000e+00 0.00000e+00 1.05276e+02 334.253 3.55208e+01 154.253 0.9472 
1 1 1 -12 60  4  o 1  9.96171e+00 9.08015e-01 1.73659e+02 154.517 -1.96949e+01 9.38662e+00  0.00000e+00 0.00000e+00 1.93335e+02 154.517 1.96761e+01 154.517 0.9768 
1 1 1 -12 60  5  o 8  1.29819e+01 8.63730e-01 3.07632e+02 342.954 4.99194e+01  -1.53053e+01 0.00000e+00 0.00000e+00 1.76902e+02 342.954 1.30731e+02 162.954 0.9904 
1 1 1 -12 60  6  o 12 8.14072e+00 9.28260e-01 1.08730e+02 67.409  4.37310e+00  1.05104e+01  0.00000e+00 0.00000e+00 1.84024e+02 67.409  7.52940e+01 67.409  0.9550 
1 1 1 -12 60  7  o 16 4.67758e+00 1.11832e+00 1.47314e+02 339.756 8.26867e+00  -3.04947e+00 0.00000e+00 0.00000e+00 1.83608e+01 339.756 1.28954e+02 159.756 0.9414 
1 1 1 -12 60  8  o 1  3.56354e+00 1.00690e+00 2.51577e+01 205.085 -1.19636e+00 -5.60044e-01 0.00000e+00 0.00000e+00 4.83314e+01 205.085 2.31738e+01 205.085 0.5487 
1 1 1 -12 60  9  o 2  4.01578e+00 1.10877e+00 1.03773e+02 58.293  3.18430e+00  5.15449e+00  0.00000e+00 0.00000e+00 3.39383e+01 58.293  6.98345e+01 238.293 0.9133 
1 1 1 -12 60  10 o 3  1.08463e+01 9.55907e-01 1.73745e+02 308.111 1.93504e+01  -2.46691e+01 0.00000e+00 0.00000e+00 2.26552e+02 308.111 5.28076e+01 308.111 0.9839 
1 1 1 -12 60  11 o 5  3.58261e+00 1.08236e+00 7.56071e+01 214.274 -3.60655e+00 -2.45779e+00 0.00000e+00 0.00000e+00 4.20067e+01 214.274 3.36003e+01 34.274  0.8762 
1 1 1 -12 60  12 o 1  4.69213e+00 1.23241e+00 4.23250e+01 61.437  1.54092e+00  2.83060e+00  0.00000e+00 0.00000e+00 1.02574e+02 61.437  6.02494e+01 61.437  0.8252 
1 1 1 -12 60  13 o 6  3.26883e+00 1.02409e+00 6.79268e+01 47.253  3.31457e+00  3.58610e+00  0.00000e+00 0.00000e+00 4.08841e+01 47.253  2.70427e+01 227.253 0.8906 
1 1 1 -12 60  14 o 1  2.63514e+00 8.96200e-01 2.14485e+01 221.087 -1.19104e+00 -1.03854e+00 0.00000e+00 0.00000e+00 3.90792e+01 221.087 1.76307e+01 221.087 0.6154 
1 1 1 -12 61  1  o 7  7.07121e+00 1.06917e+00 7.08534e+01 151.328 -4.85409e+00 2.65441e+00  0.00000e+00 0.00000e+00 1.70770e+02 151.328 9.99165e+01 151.328 0.9044 
1 1 1 -12 61  2  o 15 6.89589e+00 1.27481e+00 1.65597e+02 252.179 -3.50280e+00 -1.08961e+01 0.00000e+00 0.00000e+00 8.31381e+01 252.179 8.24585e+01 72.179  0.9553 
1 1 1 -12 61  3  o 16 2.86667e+00 9.52250e-01 6.20637e+01 227.670 -1.47420e+00 -1.61845e+00 0.00000e+00 0.00000e+00 1.65276e+01 227.670 4.55361e+01 47.670  0.7265 
1 1 1 -12 61  4  o 3  3.79615e+00 1.07634e+00 7.20553e+01 330.335 2.86294e+00  -1.63068e+00 0.00000e+00 0.00000e+00 4.67038e+01 330.335 2.53515e+01 150.335 0.8296 
1 1 1 -12 61  5  o 19 9.09423e+00 9.35604e-01 2.04618e+02 293.279 9.80239e+00  -2.27837e+01 0.00000e+00 0.00000e+00 1.31075e+02 293.279 7.35437e+01 113.279 0.9796 
1 1 1 -12 61  6  o 19 6.64131e+00 1.03724e+00 1.08725e+02 303.883 5.39510e+00  -8.03380e+00 0.00000e+00 0.00000e+00 1.28023e+02 303.883 1.92980e+01 303.883 0.9468 
1 1 1 -12 61  7  o 4  4.61787e+00 1.06098e+00 1.25581e+02 102.209 -1.62546e+00 7.51248e+00  0.00000e+00 0.00000e+00 3.63974e+01 102.209 8.91833e+01 282.209 0.9325 
1 1 1 -12 61  8  f 0  1.02229e+01 8.94016e-01 1.59278e+02 306.952 1.56422e+01  -2.07940e+01 0.00000e+00 0.00000e+00 2.17450e+02 306.952 5.81719e+01 306.952 0.9806 
1 1 1 -12 61  9  o 10 5.03084e+00 1.13924e+00 1.10221e+02 161.536 -7.67583e+00 2.56288e+00  0.00000e+00 0.00000e+00 6.65657e+01 161.536 4.36557e+01 341.536 0.9360 
1 1 1 -12 61  10 f 0  3.50837e+00 1.05430e+00 7.74233e+01 225.016 -2.96587e+00 -2.96753e+00 0.00000e+00 0.00000e+00 3.71316e+01 225.016 4.02918e+01 45.016  0.8706 
1 1 1 -12 61  11 o 15 3.92485e+00 1.13042e+00 7.37428e+01 266.973 -2.41600e-01 -4.56825e+00 0.00000e+00 0.00000e+00 5.60081e+01 266.973 1.77346e+01 86.973  0.8825 
1 1 1 -12 61  12 o 8  3.15745e+00 1.02661e+00 9.16129e+01 64.932  2.29346e+00  4.90304e+00  0.00000e+00 0.00000e+00 1.49685e+01 64.932  7.66444e+01 244.932 0.9022 
1 1 1 -12 61  13 o 11 3.63915e+00 1.01584e+00 5.92767e+01 304.390 2.70412e+00  -3.95079e+00 0.00000e+00 0.00000e+00 6.15159e+01 304.390 2.23926e+00 304.390 0.8882 
1 1 1 -12 61  14 o 3  2.99670e+00 9.72790e-01 8.39515e+01 243.645 -2.71332e+00 -5.47688e+00 0.00000e+00 0.00000e+00 1.82781e+01 243.645 6.56733e+01 63.646  0.9141 
1 1 1 -12 62  1  o 18 8.34307e+00 9.20866e-01 1.99566e+02 17.759  1.98055e+01  6.34318e+00  0.00000e+00 0.00000e+00 1.07917e+02 17.759  9.16491e+01 197.759 0.9757 
1 1 1 -12 62  2  o 6  1.16332e+01 9.63969e-01 1.86385e+02 195.362 -2.57550e+01 -7.07581e+00 0.00000e+00 0.00000e+00 2.44501e+02 195.362 5.81151e+01 195.362 0.9811 
1 1 1 -12 62  3  o 3  1.01754e+01 1.01211e+00 1.93337e+02 49.276  1.59622e+01  1.85419e+01  0.00000e+00 0.00000e+00 1.82639e+02 49.276  1.06978e+01 229.276 0.9793 
1 1 1 -12 62  4  o 19 5.65196e+00 1.01607e+00 1.54170e+02 179.621 -1.06410e+01 7.04214e-02  0.00000e+00 0.00000e+00 4.86495e+01 179.621 1.05520e+02 359.621 0.9518 
1 1 1 -12 62  5  o 3  9.83739e+00 9.47003e-01 1.59348e+02 345.899 1.94119e+01  -4.87646e+00 0.00000e+00 0.00000e+00 2.01885e+02 345.899 4.25377e+01 345.899 0.9747 
1 1 1 -12 62  6  o 8  9.15243e+00 8.62213e-01 1.53675e+02 235.478 -1.17153e+01 -1.70317e+01 0.00000e+00 0.00000e+00 1.82412e+02 235.478 2.87371e+01 235.478 0.9755 
1 1 1 -12 62  7  o 15 4.04053e+00 1.07151e+00 7.79631e+01 137.475 -3.16763e+00 2.90518e+00  0.00000e+00 0.00000e+00 5.48661e+01 137.475 2.30970e+01 317.475 0.8741 
1 1 1 -12 62  8  o 8  6.07924e+00 1.19425e+00 1.14278e+02 340.266 8.34942e+00  -2.99509e+00 0.00000e+00 0.00000e+00 1.00858e+02 340.266 1.34196e+01 160.266 0.9418 
1 1 1 -12 62  9  o 10 5.79533e+00 1.17674e+00 1.30735e+02 74.644  2.96352e+00  1.07914e+01  0.00000e+00 0.00000e+00 7.68446e+01 74.644  5.38902e+01 254.644 0.9542 
1 1 1 -12 62  10 o 3  4.24092e+00 1.14932e+00 6.86703e+01 319.332 3.12518e+00  -2.68506e+00 0.00000e+00 0.00000e+00 6.93590e+01 319.332 6.88673e-01 319.332 0.8680 
1 1 1 -12 62  11 o 9  5.42965e+00 1.27719e+00 9.73950e+01 44.351  5.57000e+00  5.44517e+00  0.00000e+00 0.00000e+00 9.24293e+01 44.351  4.96577e+00 224.351 0.9334 
1 1 1 -12 62  12 o 6  2.90293e+00 9.29290e-01 6.18686e+01 68.045  1.32689e+00  3.29162e+00  0.00000e+00 0.00000e+00 2.97486e+01 68.045  3.21200e+01 248.045 0.8436 
1 1 1 -12 62  13 o 10 4.26543e+00 1.14573e+00 7.57917e+01 44.235  4.56016e+00  4.44003e+00  0.00000e+00 0.00000e+00 7.04607e+01 44.235  5.33104e+00 224.235 0.9177 
1 1 1 -12 62  14 o 16 3.67604e+00 1.03462e+00 3.90938e+01 216.173 -2.71735e+00 -1.98687e+00 0.00000e+00 0.00000e+00 7.52794e+01 216.173 3.61856e+01 216.173 0.8338 
1 1 1 -12 63  1  o 19 1.24898e+01 7.95539e-01 1.60464e+02 211.807 -2.33501e+01 -1.44819e+01 0.00000e+00 0.00000e+00 3.02587e+02 211.807 1.42123e+02 211.807 0.9816 
1 1 1 -12 63  2  o 12 5.45290e+00 1.22292e+00 5.15665e+01 107.858 -9.65555e-01 2.99689e+00  0.00000e+00 0.00000e+00 1.17294e+02 107.858 6.57274e+01 107.858 0.8204 
1 1 1 -12 63  3  o 4  7.75063e+00 1.19482e+00 1.32594e+02 227.383 -7.56983e+00 -8.22714e+00 0.00000e+00 0.00000e+00 1.46379e+02 227.383 1.37852e+01 227.383 0.9542 
1 1 1 -12 63  4  o 1  4.54441e+00 1.00839e+00 9.71645e+01 305.980 3.33890e+00  -4.59898e+00 0.00000e+00 0.00000e+00 5.82341e+01 305.980 3.89304e+01 125.980 0.9071 
1 1 1 -12 63  5  o 18 4.42915e+00 1.14914e+00 4.08312e+01 141.943 -1.83446e+00 1.43619e+00  0.00000e+00 0.00000e+00 8.34847e+01 141.943 4.26535e+01 141.943 0.7451 
1 1 1 -12 63  6  o 11 9.98893e+00 8.53004e-01 1.86947e+02 238.262 -1.44662e+01 -2.33879e+01 0.00000e+00 0.00000e+00 1.82103e+02 238.262 4.84371e+00 58.262  0.9816 
1 1 1 -12 63  7  o 16 5.83314e+00 1.07675e+00 6.22869e+01 32.100  4.36435e+00  2.73777e+00  0.00000e+00 0.00000e+00 1.34421e+02 32.100  7.21344e+01 32.100  0.8968 
1 1 1 -12 63  8  o 13 1.05497e+01 8.61250e-01 1.54050e+02 332.385 2.36704e+01  -1.23823e+01 0.00000e+00 0.00000e+00 2.34794e+02 332.385 8.07445e+01 332.385 0.9811 
1 1 1 -12 63  9  o 9  1.27853e+01 8.51396e-01 2.00603e+02 157.126 -4.11149e+01 1.73459e+01  0.00000e+00 0.00000e+00 2.73827e+02 157.126 7.32240e+01 157.126 0.9887 
1 1 1 -12 63  10 f 0  4.66152e+00 1.16482e+00 6.21613e+01 76.723  9.76601e-01  4.13881e+00  0.00000e+00 0.00000e+00 9.03322e+01 76.723  2.81709e+01 76.723  0.8726 
1 1 1 -12 63  11 o 2  6.70703e+00 1.23741e+00 9.05204e+01 252.842 -2.75677e+00 -8.92883e+00 0.00000e+00 0.00000e+00 1.46801e+02 252.842 5.62808e+01 252.842 0.9449 
1 1 1 -12 63  12 o 5  5.66157e+00 1.22803e+00 1.16320e+02 9.701   1.04284e+01  1.78267e+00  0.00000e+00 0.00000e+00 8.51739e+01 9.701   3.11460e+01 189.701 0.9515 
1 1 1 -12 63  13 o 8  7.10804e+00 1.21839e+00 1.30807e+02 261.778 -2.43974e+00 -1.68855e+01 0.00000e+00 0.00000e+00 1.26827e+02 261.778 3.98045e+00 81.778  0.9702 
1 1 1 -12 63  14 o 13 2.92027e+00 9.56101e-01 7.26590e+01 112.268 -2.12875e+00 5.19876e+00  0.00000e+00 0.00000e+00 2.60480e+01 112.268 4.66110e+01 292.268 0.9060 
1 1 1 -12 64  1  o 2  8.76508e+00 9.70968e-01 1.00297e+02 247.313 -4.10048e+00 -9.80903e+00 0.00000e+00 0.00000e+00 2.14714e+02 247.313 1.14417e+02 247.313 0.9517 
1 1 1 -12 64  2  o 13 5.41752e+00 9.49557e-01 9.74493e+01 45.510  4.66345e+00  4.74715e+00  0.00000e+00 0.00000e+00 9.09490e+01 45.510  6.50032e+00 225.510 0.9215 
1 1 1 -12 64  3  o 18 3.16954e+00 1.02050e+00 1.00510e+02 320.814 3.16237e+00  -2.57783e+00 0.00000e+00 0.00000e+00 3.07649e+00 320.814 9.74333e+01 140.814 0.8665 
1 1 1 -12 64  4  o 9  8.55406e+00 1.13555e+00 1.26265e+02 162.299 -1.20024e+01 3.83079e+00  0.00000e+00 0.00000e+00 1.83061e+02 162.299 5.67960e+01 162.299 0.9595 
1 1 1 -12 64  5  o 13 3.76438e+00 1.08679e+00 6.48412e+01 259.082 -6.06728e-01 -3.14545e+00 0.00000e+00 0.00000e+00 5.19729e+01 259.082 1.28683e+01 79.082  0.8240 
1 1 1 -12 64  6  o 17 6.47240e+00 1.13276e+00 2.06200e+02 211.464 -1.45149e+01 -8.88203e+00 0.00000e+00 0.00000e+00 3.00888e+01 211.464 1.76111e+02 31.464  0.9702 
1 1 1 -12 64  7  o 3  7.99423e+00 1.02288e+00 1.84756e+02 36.490  1.61696e+01  1.19607e+01  0.00000e+00 0.00000e+00 1.08233e+02 36.490  7.65230e+01 216.490 0.9748 
1 1 1 -12 64  8  o 8  1.07003e+01 8.73303e-01 1.67933e+02 333.569 2.68096e+01  -1.33267e+01 0.00000e+00 0.00000e+00 2.27217e+02 333.569 5.92832e+01 333.569 0.9832 
1 1 1 -12 64  9  o 9  4.65553e+00 1.14469e+00 7.77721e+01 303.835 2.76624e+00  -4.12678e+00 0.00000e+00 0.00000e+00 7.81664e+01 303.835 3.94241e-01 303.835 0.8926 
1 1 1 -12 64  10 o 13 8.13627e+00 1.14011e+00 1.68120e+02 87.770  8.16549e-01  2.09671e+01  0.00000e+00 0.00000e+00 1.29502e+02 87.770  3.86186e+01 267.770 0.9759 
1 1 1 -12 64  11 o 2  2.99908e+00 9.84877e-01 1.01558e+02 333.101 4.98298e+00  -2.52785e+00 0.00000e+00 0.00000e+00 1.13568e-01 333.101 1.01445e+02 153.102 0.9054 
1 1 1 -12 64  12 o 17 2.86379e+00 9.28383e-01 2.79197e+01 97.524  -2.20643e-01 1.67056e+00  0.00000e+00 0.00000e+00 4.04805e+01 97.524  1.25607e+01 97.524  0.6387 
1 1 1 -12 64  13 o 10 3.51810e+00 1.04406e+00 6.58112e+01 39.199  3.77260e+00  3.07673e+00  0.00000e+00 0.00000e+00 5.11687e+01 39.199  1.46425e+01 219.199 0.8902 
1 1 1 -12 64  14 o 7  5.77139e+00 1.34619e+00 1.00463e+02 240.046 -5.51108e+00 -9.56306e+00 0.00000e+00 0.00000e+00 1.04824e+02 240.046 4.36154e+00 240.046 0.9536 
1 1 1 -12 65  1  o 1  5.29449e+00 1.08914e+00 1.21188e+02 177.745 -7.93956e+00 3.12611e-01  0.00000e+00 0.00000e+00 6.56671e+01 177.745 5.55206e+01 357.745 0.9348 
1 1 1 -12 65  2  o 5  7.38107e+00 9.21147e-01 8.41235e+01 94.614  -6.70922e-01 8.31253e+00  0.00000e+00 0.00000e+00 1.77113e+02 94.614  9.29899e+01 94.614  0.9380 
1 1 1 -12 65  3  o 13 4.79297e+00 1.23176e+00 4.53447e+01 306.665 1.46115e+00  -1.96281e+00 0.00000e+00 0.00000e+00 9.18544e+01 306.665 4.65097e+01 306.665 0.7591 
1 1 1 -12 65  4  o 5  4.63258e+00 1.15176e+00 7.24158e+01 215.192 -3.52629e+00 -2.48678e+00 0.00000e+00 0.00000e+00 8.02670e+01 215.192 7.85117e+00 215.192 0.8746 
1 1 1 -12 65  5  o 11 1.11087e+01 8.99824e-01 2.24350e+02 251.565 -1.12881e+01 -3.38642e+01 0.00000e+00 0.00000e+00 1.88040e+02 251.565 3.63097e+01 71.565  0.9859 
1 1 1 -12 65  6  o 2  1.46067e+01 8.41105e-01 2.25731e+02 66.851  1.86564e+01  4.36361e+01  0.00000e+00 0.00000e+00 3.18004e+02 66.851  9.22728e+01 66.851  0.9894 
1 1 1 -12 65  7  o 19 1.06044e+01 8.23837e-01 2.12446e+02 305.440 2.03488e+01  -2.85916e+01 0.00000e+00 0.00000e+00 1.80454e+02 305.440 3.19925e+01 125.440 0.9856 
1 1 1 -12 65  8  o 4  4.13261e+00 1.09904e+00 3.41064e+01 84.216  2.12496e-01  2.09766e+00  0.00000e+00 0.00000e+00 7.68298e+01 84.216  4.27234e+01 84.216  0.7148 
1 1 1 -12 65  9  o 15 8.59832e+00 1.08737e+00 9.54813e+01 175.984 -1.24075e+01 8.70987e-01  0.00000e+00 0.00000e+00 2.13852e+02 175.984 1.18370e+02 175.984 0.9589 
1 1 1 -12 65  10 o 9  9.14408e+00 1.02179e+00 1.17660e+02 77.522  3.89475e+00  1.75998e+01  0.00000e+00 0.00000e+00 2.15391e+02 77.522  9.77310e+01 77.522  0.9719 
1 1 1 -12 65  11 o 15 8.00474e+00 1.17781e+00 1.10168e+02 299.351 6.88163e+00  -1.22375e+01 0.00000e+00 0.00000e+00 1.78614e+02 299.351 6.84454e+01 299.351 0.9637 
1 1 1 -12 65  12 o 15 3.93048e+00 1.13470e+00 9.04556e+01 104.206 -1.65791e+00 6.54891e+00  0.00000e+00 0.00000e+00 4.51475e+01 104.206 4.53081e+01 284.206 0.9227 
1 1 1 -12 65  13 o 8  3.58650e+00 1.08621e+00 9.96421e+01 287.049 2.16728e+00  -7.06720e+00 0.00000e+00 0.00000e+00 2.48727e+01 287.049 7.47694e+01 107.049 0.9297 
1 1 1 -12 65  14 o 18 3.12391e+00 9.92009e-01 4.38706e+01 138.786 -2.80060e+00 2.45294e+00  0.00000e+00 0.00000e+00 5.53885e+01 138.786 1.15178e+01 138.786 0.8520 
1 1 1 -12 66  1  o 7  5.29577e+00 1.09573e+00 5.83560e+01 292.656 1.43792e+00  -3.44492e+00 0.00000e+00 0.00000e+00 1.12045e+02 292.656 5.36889e+01 292.656 0.8524 
1 1 1 -12 66  2  o 13 3.56767e+00 9.94994e-01 7.38174e+01 117.954 -1.54274e+00 2.90710e+00  0.00000e+00 0.00000e+00 3.78158e+01 117.954 3.60016e+01 297.954 0.8294 
1 1 1 -12 66  3  o 16 9.69603e+00 1.07862e+00 1.22877e+02 338.221 1.48260e+01  -5.92360e+00 0.00000e+00 0.00000e+00 2.31047e+02 338.221 1.08170e+02 338.221 0.9682 
1 1 1 -12 66  4  o 10 4.81026e+00 1.23908e+00 6.41471e+01 80.758  5.97789e-01  3.67399e+00  0.00000e+00 0.00000e+00 9.02490e+01 80.758  2.61019e+01 80.758  0.8519 
1 1 1 -12 66  5  o 19 5.62594e+00 1.14658e+00 7.88989e+01 37.719  4.44816e+00  3.44034e+00  0.00000e+00 0.00000e+00 1.13011e+02 37.719  3.41122e+01 37.719  0.9061 
1 1 1 -12 66  6  o 6  4.44224e+00 1.09200e+00 9.89503e+01 329.747 5.33513e+00  -3.11174e+00 0.00000e+00 0.00000e+00 5.39509e+01 329.747 4.49994e+01 149.747 0.9150 
1 1 1 -12 66  7  o 12 5.88493e+00 1.13185e+00 7.32477e+01 116.486 -2.71636e+00 5.45152e+00  0.00000e+00 0.00000e+00 1.28852e+02 116.486 5.56043e+01 116.486 0.9137 
1 1 1 -12 66  8  o 10 3.36567e+00 9.99313e-01 7.83210e+01 195.280 -4.20477e+00 -1.14874e+00 0.00000e+00 0.00000e+00 3.23873e+01 195.280 4.59337e+01 15.280  0.8760 
1 1 1 -12 66  9  o 10 1.67628e+01 7.99874e-01 2.49721e+02 356.187 7.89758e+01  -5.26303e+00 0.00000e+00 0.00000e+00 3.75076e+02 356.187 1.25355e+02 356.187 0.9937 
1 1 1 -12 66  10 o 18 7.08714e+00 1.15682e+00 1.03060e+02 64.330  5.10697e+00  1.06255e+01  0.00000e+00 0.00000e+00 1.50974e+02 64.330  4.79137e+01 64.330  0.9566 
1 1 1 -12 66  11 o 8  8.42793e+00 1.28720e+00 1.44286e+02 250.743 -6.20109e+00 -1.77506e+01 0.00000e+00 0.00000e+00 1.62653e+02 250.743 1.83668e+01 250.743 0.9730 
1 1 1 -12 66  12 o 2  9.12315e+00 1.04201e+00 1.26030e+02 136.654 -1.81088e+01 1.70922e+01  0.00000e+00 0.00000e+00 2.08111e+02 136.654 8.20813e+01 136.654 0.9797 
1 1 1 -12 66  13 o 15 5.48629e+00 1.24173e+00 8.39367e+01 343.062 8.89448e+00  -2.70884e+00 0.00000e+00 0.00000e+00 1.09557e+02 343.062 2.56201e+01 343.062 0.9446 
1 1 1 -12 67  1  o 18 1.42685e+01 7.40857e-01 2.04273e+02 296.119 2.03733e+01  -4.15514e+01 0.00000e+00 0.00000e+00 3.28387e+02 296.119 1.24115e+02 296.119 0.9891 
1 1 1 -12 67  2  o 7  6.93893e+00 9.77612e-01 2.01758e+02 7.855   1.96116e+01  2.70574e+00  0.00000e+00 0.00000e+00 5.32762e+01 7.855   1.48482e+02 187.855 0.9744 
1 1 1 -12 67  3  o 9  8.25094e+00 1.10503e+00 1.63825e+02 17.161  1.66873e+01  5.15320e+00  0.00000e+00 0.00000e+00 1.38158e+02 17.161  2.56667e+01 197.161 0.9709 
1 1 1 -12 67  4  o 1  1.41243e+01 9.67580e-01 2.74802e+02 200.596 -5.03036e+01 -1.89043e+01 0.00000e+00 0.00000e+00 2.52277e+02 200.596 2.25251e+01 20.596  0.9907 
1 1 1 -12 67  5  o 4  2.79292e+00 8.95021e-01 8.32296e+01 282.084 7.29364e-01  -3.40688e+00 0.00000e+00 0.00000e+00 5.10553e+00 282.084 7.81241e+01 102.084 0.8403 
1 1 1 -12 67  6  o 9  6.18257e+00 1.12209e+00 6.57182e+01 86.178  3.80462e-01  5.69559e+00  0.00000e+00 0.00000e+00 1.45316e+02 86.178  7.95976e+01 86.178  0.9076 
1 1 1 -12 67  7  o 11 8.52658e+00 9.23853e-01 1.41191e+02 153.744 -1.75048e+01 8.63460e+00  0.00000e+00 0.00000e+00 1.70891e+02 153.744 2.97004e+01 153.744 0.9740 
1 1 1 -12 67  8  o 17 8.67899e+00 1.01053e+00 1.42328e+02 1.956   1.95736e+01  6.68311e-01  0.00000e+00 0.00000e+00 1.75062e+02 1.956   3.27343e+01 1.956   0.9741 
1 1 1 -12 67  9  o 9  1.20444e+01 9.01594e-01 1.58967e+02 193.045 -3.22203e+01 -7.46530e+00 0.00000e+00 0.00000e+00 2.85861e+02 193.045 1.26894e+02 193.045 0.9848 
1 1 1 -12 67  10 o 8  3.72295e+00 1.08731e+00 6.27852e+01 39.821  3.01634e+00  2.51502e+00  0.00000e+00 0.00000e+00 5.72572e+01 39.821  5.52796e+00 219.821 0.8607 
1 1 1 -12 67  11 o 5  5.84190e+00 1.14312e+00 1.24078e+02 242.330 -5.81059e+00 -1.10819e+01 0.00000e+00 0.00000e+00 8.56099e+01 242.330 3.84677e+01 62.330  0.9592 
1 1 1 -12 67  12 o 11 5.61671e+00 1.19651e+00 6.95123e+01 301.631 3.89647e+00  -6.32591e+00 0.00000e+00 0.00000e+00 1.25738e+02 301.631 5.62254e+01 301.631 0.9300 
1 1 1 -12 67  13 o 15 4.76130e+00 1.21022e+00 3.94146e+01 104.038 -9.26170e-01 3.70422e+00  0.00000e+00 0.00000e+00 1.12760e+02 104.038 7.33455e+01 104.038 0.8562 
1 1 1 -12 68  1  o 17 1.08841e+01 8.29875e-01 2.24347e+02 265.248 -3.00584e+00 -3.61565e+01 0.00000e+00 0.00000e+00 1.80658e+02 265.248 4.36893e+01 85.248  0.9861 
1 1 1 -12 68  2  o 5  4.36859e+00 1.01174e+00 7.47833e+01 349.113 4.38203e+00  -8.42843e-01 0.00000e+00 0.00000e+00 7.00679e+01 349.113 4.71548e+00 169.113 0.8792 
1 1 1 -12 68  3  o 12 6.83637e+00 1.03628e+00 1.01090e+02 183.683 -9.22535e+00 -5.93771e-01 0.00000e+00 0.00000e+00 1.42201e+02 183.683 4.11112e+01 183.683 0.9443 
1 1 1 -12 68  4  o 9  5.44884e+00 1.21999e+00 7.10858e+01 26.024  4.23100e+00  2.06575e+00  0.00000e+00 0.00000e+00 1.10766e+02 26.024  3.96800e+01 26.024  0.8861 
1 1 1 -12 68  5  o 4  6.69530e+00 1.28717e+00 9.44946e+01 262.035 -1.09781e+00 -7.84590e+00 0.00000e+00 0.00000e+00 1.40989e+02 262.035 4.64943e+01 262.035 0.9346 
1 1 1 -12 68  6  o 10 4.95730e+00 1.14573e+00 7.72992e+01 130.207 -3.24802e+00 3.84250e+00  0.00000e+00 0.00000e+00 8.93696e+01 130.207 1.20704e+01 130.207 0.8941 
1 1 1 -12 68  7  o 1  4.69768e+00 1.05037e+00 6.60064e+01 285.613 1.28702e+00  -4.60553e+00 0.00000e+00 0.00000e+00 9.07295e+01 285.613 2.47231e+01 285.613 0.8881 
1 1 1 -12 68  8  o 2  3.18878e+00 9.90021e-01 8.27084e+01 27.446  3.81715e+00  1.98253e+00  0.00000e+00 0.00000e+00 2.19217e+01 27.446  6.07867e+01 207.446 0.8742 
1 1 1 -12 68  9  o 1  1.07946e+01 9.23308e-01 1.99201e+02 292.909 1.45051e+01  -3.43237e+01 0.00000e+00 0.00000e+00 2.00095e+02 292.909 8.93941e-01 292.909 0.9865 
1 1 1 -12 68  10 o 14 2.89774e+00 9.52138e-01 5.20136e+01 227.301 -2.01308e+00 -2.18161e+00 0.00000e+00 0.00000e+00 3.56467e+01 227.301 1.63669e+01 47.301  0.8076 
1 1 1 -12 68  11 o 5  3.73427e+00 1.02270e+00 4.27865e+01 199.016 -2.81985e+00 -9.71849e-01 0.00000e+00 0.00000e+00 7.02014e+01 199.016 2.74149e+01 199.016 0.8087 
1 1 1 -12 68  12 o 12 6.02294e+00 1.14737e+00 7.80690e+01 107.794 -2.82313e+00 8.79639e+00  0.00000e+00 0.00000e+00 1.34455e+02 107.794 5.63864e+01 107.794 0.9442 
1 1 1 -12 68  13 o 18 3.58258e+00 1.11057e+00 1.02277e+02 307.201 4.84608e+00  -6.38434e+00 0.00000e+00 0.00000e+00 2.27954e+01 307.201 7.94818e+01 127.201 0.9354 
1 1 1 -12 69  1  f 0  6.83741e+00 1.05541e+00 9.87145e+01 39.238  6.92759e+00  5.65764e+00  0.00000e+00 0.00000e+00 1.44363e+02 39.238  4.56482e+01 39.238  0.9423 
1 1 1 -12 69  2  o 19 9.99198e+00 8.66857e-01 1.64319e+02 234.891 -1.37444e+01 -1.95498e+01 0.00000e+00 0.00000e+00 2.04464e+02 234.891 4.01452e+01 234.891 0.9788 
1 1 1 -12 69  3  o 14 1.18815e+01 7.79526e-01 1.50992e+02 93.665  -1.74814e+00 2.72941e+01  0.00000e+00 0.00000e+00 2.88456e+02 93.665  1.37464e+02 93.665  0.9815 
1 1 1 -12 69  4  o 4  4.04594e+00 1.15805e+00 1.37429e+02 54.346  3.98248e+00  5.55168e+00  0.00000e+00 0.00000e+00 3.28395e+00 54.346  1.34145e+02 234.346 0.9236 
1 1 1 -12 69  5  o 16 8.84556e+00 1.19955e+00 1.38125e+02 265.093 -1.29324e+00 -1.50637e+01 0.00000e+00 0.00000e+00 1.83501e+02 265.093 4.53756e+01 265.093 0.9663 
1 1 1 -12 69  6  o 11 2.91004e+00 9.31982e-01 5.29133e+01 290.211 8.41585e-01  -2.28598e+00 0.00000e+00 0.00000e+00 2.99994e+01 290.211 2.29139e+01 110.211 0.7578 
1 1 1 -12 69  7  o 7  5.47629e+00 1.20133e+00 1.04385e+02 43.520  6.02527e+00  5.72171e+00  0.00000e+00 0.00000e+00 8.85120e+01 43.520  1.58731e+01 223.520 0.9377 
1 1 1 -12 69  8  o 9  1.12760e+01 8.39106e-01 1.50366e+02 128.200 -1.83675e+01 2.33407e+01  0.00000e+00 0.00000e+00 2.65606e+02 128.200 1.15240e+02 128.200 0.9830 
1 1 1 -12 69  9  o 9  6.79177e+00 1.17266e+00 1.24641e+02 311.403 8.50002e+00  -9.64025e+00 0.00000e+00 0.00000e+00 1.19864e+02 311.403 4.77690e+00 131.403 0.9603 
1 1 1 -12 69  10 o 19 1.14354e+01 9.55748e-01 2.12718e+02 87.076  2.31830e+00  4.53959e+01  0.00000e+00 0.00000e+00 2.10799e+02 87.076  1.91917e+00 267.077 0.9889 
1 1 1 -12 69  11 o 11 9.68760e+00 9.60350e-01 1.16311e+02 266.418 -1.44962e+00 -2.31578e+01 0.00000e+00 0.00000e+00 2.38183e+02 266.418 1.21872e+02 266.418 0.9782 
1 1 1 -12 69  12 o 12 3.16334e+00 9.66814e-01 2.66249e+01 110.127 -6.72148e-01 1.83400e+00  0.00000e+00 0.00000e+00 5.49228e+01 110.127 2.82979e+01 110.127 0.6900 
1 1 1 -12 69  13 o 11 4.66624e+00 1.22557e+00 7.16585e+01 34.728  5.74294e+00  3.98082e+00  0.00000e+00 0.00000e+00 8.94797e+01 34.728  1.78211e+01 34.728  0.9254 
1 1 1 -12 70  1  o 9  1.29343e+01 7.94722e-01 2.71913e+02 225.186 -3.75669e+01 -3.78121e+01 0.00000e+00 0.00000e+00 2.11368e+02 225.186 6.05455e+01 45.186  0.9906 
1 1 1 -12 70  2  o 16 4.42892e+00 1.08554e+00 6.50738e+01 224.634 -2.68445e+00 -2.65040e+00 0.00000e+00 0.00000e+00 7.75394e+01 224.634 1.24656e+01 224.634 0.8542 
1 1 1 -12 70  3  o 14 7.35108e+00 9.73052e-01 1.41264e+02 118.640 -7.16728e+00 1.31242e+01  0.00000e+00 0.00000e+00 1.26256e+02 118.640 1.50086e+01 298.640 0.9660 
1 1 1 -12 70  4  o 12 6.13752e+00 1.21615e+00 8.36092e+01 2.723   6.69505e+00  3.18377e-01  0.00000e+00 0.00000e+00 1.29446e+02 2.723   4.58363e+01 2.723   0.9221 
1 1 1 -12 70  5  o 4  1.08844e+01 1.03157e+00 1.82792e+02 255.950 -6.76062e+00 -2.70150e+01 0.00000e+00 0.00000e+00 2.19252e+02 255.950 3.64597e+01 255.950 0.9819 
1 1 1 -12 70  6  f 0  2.92273e+00 9.37710e-01 3.16038e+01 16.410  1.35284e+00  3.98431e-01  0.00000e+00 0.00000e+00 3.13645e+01 16.410  2.39343e-01 196.410 0.5732 
1 1 1 -12 70  7  o 6  8.07589e+00 1.12920e+00 1.60970e+02 159.415 -1.79457e+01 6.74001e+00  0.00000e+00 0.00000e+00 1.34304e+02 159.415 2.66663e+01 339.415 0.9736 
1 1 1 -12 70  8  o 5  7.32651e+00 1.06897e+00 1.23306e+02 343.686 1.28723e+01  -3.76761e+00 0.00000e+00 0.00000e+00 1.41131e+02 343.686 1.78253e+01 343.686 0.9620 
1 1 1 -12 70  9  o 9  1.44755e+01 8.34788e-01 2.13350e+02 205.934 -5.56305e+01 -2.70540e+01 0.00000e+00 0.00000e+00 3.24824e+02 205.934 1.11474e+02 205.934 0.9919 
1 1 1 -12 70  10 o 2  4.57618e+00 1.15858e+00 7.31420e+01 144.871 -4.69358e+00 3.30230e+00  0.00000e+00 0.00000e+00 8.24559e+01 144.871 9.31383e+00 144.871 0.9081 
1 1 1 -12 70  11 o 10 3.43814e+00 1.03386e+00 2.49069e+01 229.933 -1.13566e+00 -1.35022e+00 0.00000e+00 0.00000e+00 5.93208e+01 229.933 3.44139e+01 229.933 0.6550 
1 1 1 -12 70  12 o 10 2.07400e+00 7.26930e-01 5.19126e+01 129.029 -1.82577e+00 2.25228e+00  0.00000e+00 0.00000e+00 1.02440e+01 129.029 4.16686e+01 309.029 0.8023 
1 1 1 -12 70  13 o 3  2.97412e+00 9.64289e-01 3.72872e+01 338.650 2.86320e+00  -1.11918e+00 0.00000e+00 0.00000e+00 5.31836e+01 338.650 1.58964e+01 338.650 0.8153 
1 1 1 -12 71  1  o 15 3.80141e+00 1.02895e+00 9.07537e+01 216.634 -3.87142e+00 -2.87870e+00 0.00000e+00 0.00000e+00 3.67154e+01 216.634 5.40383e+01 36.634  0.8891 
1 1 1 -12 71  2  o 17 1.19939e+01 8.97611e-01 1.89961e+02 27.752  2.82909e+01  1.48856e+01  0.00000e+00 0.00000e+00 2.54974e+02 27.752  6.50130e+01 27.752  0.9842 
1 1 1 -12 71  3  o 16 8.95287e+00 8.98295e-01 1.39984e+02 275.166 1.76711e+00  -1.95466e+01 0.00000e+00 0.00000e+00 1.88537e+02 275.166 4.85534e+01 275.166 0.9742 
1 1 1 -12 71  4  o 17 8.93829e+00 1.09493e+00 1.33193e+02 358.187 1.69853e+01  -5.37604e-01 0.00000e+00 0.00000e+00 1.93197e+02 358.187 6.00036e+01 358.187 0.9701 
1 1 1 -12 71  5  o 2  6.51322e+00 1.31439e+00 1.12287e+02 106.249 -2.57961e+00 8.85100e+00  0.00000e+00 0.00000e+00 1.18996e+02 106.249 6.70890e+00 106.249 0.9441 
1 1 1 -12 71  6  o 12 1.14900e+01 8.22222e-01 1.94934e+02 162.562 -3.75613e+01 1.17982e+01  0.00000e+00 0.00000e+00 2.31357e+02 162.562 3.64230e+01 162.562 0.9872 
1 1 1 -12 71  7  f 0  7.31052e+00 1.11279e+00 2.10389e+02 55.910  1.20443e+01  1.77961e+01  0.00000e+00 0.00000e+00 5.76434e+01 55.910  1.52745e+02 235.910 0.9764 
1 1 1 -12 71  8  o 11 9.39976e+00 9.57400e-01 1.53807e+02 247.954 -9.05548e+00 -2.23617e+01 0.00000e+00 0.00000e+00 1.91419e+02 247.954 3.76114e+01 247.954 0.9791 
1 1 1 -12 71  9  o 8  2.99399e+00 9.40825e-01 3.59057e+01 290.022 6.82253e-01  -1.87221e+00 0.00000e+00 0.00000e+00 4.22492e+01 290.022 6.34352e+00 290.022 0.6966 
1 1 1 -12 71  10 o 18 1.03514e+01 8.92823e-01 1.60932e+02 22.734  3.18051e+01  1.33267e+01  0.00000e+00 0.00000e+00 2.20918e+02 22.734  5.99864e+01 22.734  0.9854 
1 1 1 -12 71  11 f 0  3.95539e+00 1.12329e+00 2.92879e+01 121.786 -1.23349e+00 1.99053e+00  0.00000e+00 0.00000e+00 8.11423e+01 121.786 5.18544e+01 121.786 0.7466 
1 1 1 -12 71  12 o 9  3.54838e+00 1.04828e+00 2.84823e+01 224.765 -1.57101e+00 -1.55818e+00 0.00000e+00 0.00000e+00 6.82350e+01 224.765 3.97526e+01 224.765 0.7298 
1 1 1 -12 71  13 o 8  2.24492e+00 7.79660e-01 3.91531e+01 341.062 2.78963e+00  -9.57183e-01 0.00000e+00 0.00000e+00 2.83558e+01 341.062 1.07973e+01 161.062 0.8062 
1 1 1 -12 72  1  o 11 3.05793e+00 9.40288e-01 4.51620e+01 46.131  1.46631e+00  1.52536e+00  0.00000e+00 0.00000e+00 3.73824e+01 46.131  7.77959e+00 226.131 0.7159 
1 1 1 -12 72  2  o 5  9.24216e+00 1.03719e+00 1.68375e+02 61.498  1.07694e+01  1.98328e+01  0.00000e+00 0.00000e+00 1.72097e+02 61.498  3.72145e+00 61.498  0.9776 
1 1 1 -12 72  3  o 17 1.54168e+01 7.23937e-01 2.39863e+02 124.278 -3.63455e+01 5.33250e+01  0.00000e+00 0.00000e+00 3.36212e+02 124.278 9.63492e+01 124.278 0.9922 
1 1 1 -12 72  4  o 16 3.49144e+00 1.01500e+00 3.21632e+01 112.777 -6.59223e-01 1.57002e+00  0.00000e+00 0.00000e+00 5.22471e+01 112.777 2.00839e+01 112.777 0.6424 
1 1 1 -12 72  5  o 1  3.40420e+00 1.07860e+00 1.46773e+02 217.201 -5.89350e+00 -4.47353e+00 0.00000e+00 0.00000e+00 2.77539e+01 37.201  1.74527e+02 37.201  0.9297 
1 1 1 -12 72  6  o 15 3.47515e+00 1.07295e+00 4.20151e+01 343.522 2.09870e+00  -6.20783e-01 0.00000e+00 0.00000e+00 5.28394e+01 343.522 1.08243e+01 343.522 0.7264 
1 1 1 -12 72  7  o 14 4.54180e+00 1.15850e+00 8.06775e+01 213.192 -4.44074e+00 -2.90503e+00 0.00000e+00 0.00000e+00 7.27820e+01 213.192 7.89551e+00 33.192  0.9000 
1 1 1 -12 72  8  o 4  4.92823e+00 1.17864e+00 1.21487e+02 62.004  4.19873e+00  7.89808e+00  0.00000e+00 0.00000e+00 5.26887e+01 62.004  6.87980e+01 242.004 0.9423 
1 1 1 -12 72  9  o 12 4.21109e+00 1.12130e+00 7.09815e+01 174.097 -5.18424e+00 5.36011e-01  0.00000e+00 0.00000e+00 7.07176e+01 174.097 2.63828e-01 354.097 0.8981 
1 1 1 -12 72  10 o 7  3.87787e+00 1.09100e+00 7.22361e+01 63.090  2.23308e+00  4.39980e+00  0.00000e+00 0.00000e+00 5.72055e+01 63.090  1.50307e+01 243.090 0.8918 
1 1 1 -12 72  11 o 18 8.42412e+00 1.09297e+00 1.22464e+02 120.749 -1.01763e+01 1.71057e+01  0.00000e+00 0.00000e+00 1.84464e+02 120.749 6.20001e+01 120.749 0.9745 
1 1 1 -12 72  12 o 7  3.39273e+00 1.03864e+00 3.72897e+01 349.746 2.97024e+00  -5.37338e-01 0.00000e+00 0.00000e+00 6.54992e+01 349.746 2.82095e+01 349.746 0.8113 
1 1 1 -12 72  13 o 14 2.84649e+00 9.37623e-01 5.71260e+01 270.308 2.40959e-02  -4.47968e+00 0.00000e+00 0.00000e+00 3.62668e+01 270.308 2.08593e+01 90.308  0.8797 
1 1 1 -12 73  1  o 19 1.09476e+01 8.66096e-01 1.66284e+02 8.057   2.92981e+01  4.14732e+00  0.00000e+00 0.00000e+00 2.39380e+02 8.057   7.30961e+01 8.057   0.9830 
1 1 1 -12 73  2  o 10 8.69878e+00 1.01406e+00 1.73201e+02 164.872 -2.17608e+01 5.88310e+00  0.00000e+00 0.00000e+00 1.47181e+02 164.872 2.60195e+01 344.872 0.9776 
1 1 1 -12 73  3  o 10 5.56922e+00 1.07190e+00 1.17531e+02 233.823 -5.28887e+00 -7.23239e+00 0.00000e+00 0.00000e+00 8.00888e+01 233.823 3.74423e+01 53.823  0.9424 
1 1 1 -12 73  4  o 19 3.38425e+00 9.72525e-01 1.01523e+02 304.735 3.02587e+00  -4.36422e+00 0.00000e+00 0.00000e+00 1.30942e+01 304.735 8.84287e+01 124.735 0.9001 
1 1 1 -12 73  5  o 4  4.49704e+00 1.24716e+00 9.72300e+01 167.472 -5.81556e+00 1.29228e+00  0.00000e+00 0.00000e+00 5.69158e+01 167.472 4.03143e+01 347.472 0.9117 
1 1 1 -12 73  6  o 10 8.01125e+00 1.20580e+00 1.80754e+02 49.246  1.25235e+01  1.45322e+01  0.00000e+00 0.00000e+00 1.12248e+02 49.246  6.85061e+01 229.246 0.9736 
1 1 1 -12 73  7  o 18 4.98650e+00 1.19495e+00 1.08537e+02 151.100 -6.51661e+00 3.59736e+00  0.00000e+00 0.00000e+00 6.55551e+01 151.100 4.29819e+01 331.100 0.9302 
1 1 1 -12 73  8  o 10 1.07159e+01 1.05308e+00 2.06241e+02 335.683 3.35482e+01  -1.51594e+01 0.00000e+00 0.00000e+00 1.90089e+02 335.683 1.61524e+01 155.683 0.9863 
1 1 1 -12 73  9  o 13 6.74390e+00 1.15532e+00 8.43251e+01 176.448 -9.19261e+00 5.70577e-01  0.00000e+00 0.00000e+00 1.54169e+02 176.448 6.98435e+01 176.448 0.9440 
1 1 1 -12 73  10 o 5  4.92461e+00 1.17275e+00 1.15372e+02 21.259  9.27746e+00  3.60947e+00  0.00000e+00 0.00000e+00 5.93937e+01 21.259  5.59783e+01 201.259 0.9484 
1 1 1 -12 73  11 o 2  6.22024e+00 1.25603e+00 1.47617e+02 242.347 -7.63702e+00 -1.45754e+01 0.00000e+00 0.00000e+00 7.77074e+01 242.347 6.99097e+01 62.347  0.9691 
1 1 1 -12 73  12 o 7  4.51537e+00 1.16977e+00 2.59840e+01 358.619 2.38953e+00  -5.76242e-02 0.00000e+00 0.00000e+00 1.00872e+02 358.619 7.48885e+01 358.619 0.7525 
1 1 1 -12 74  1  o 13 7.30614e+00 9.99008e-01 1.03525e+02 164.467 -1.03843e+01 2.88629e+00  0.00000e+00 0.00000e+00 1.58742e+02 164.467 5.52169e+01 164.467 0.9524 
1 1 1 -12 74  2  o 17 1.25357e+01 8.43575e-01 1.81449e+02 88.761  8.20464e-01  3.79378e+01  0.00000e+00 0.00000e+00 2.84487e+02 88.761  1.03038e+02 88.761  0.9867 
1 1 1 -12 74  3  o 3  4.61646e+00 1.08204e+00 5.98923e+01 216.115 -3.24253e+00 -2.36578e+00 0.00000e+00 0.00000e+00 9.02664e+01 216.115 3.03741e+01 216.115 0.8641 
1 1 1 -12 74  4  o 7  9.97105e+00 8.60412e-01 1.44270e+02 38.597  1.78644e+01  1.42596e+01  0.00000e+00 0.00000e+00 2.22525e+02 38.597  7.82555e+01 38.597  0.9779 
1 1 1 -12 74  5  o 9  9.05384e+00 1.18130e+00 9.23562e+01 129.661 -7.48625e+00 9.02973e+00  0.00000e+00 0.00000e+00 2.33128e+02 129.661 1.40772e+02 129.661 0.9564 
1 1 1 -12 74  6  o 2  6.40262e+00 1.42090e+00 1.64048e+02 302.262 6.92989e+00  -1.09781e+01 0.00000e+00 0.00000e+00 6.69716e+01 302.262 9.70766e+01 122.262 0.9607 
1 1 1 -12 74  7  o 2  9.80610e+00 1.06106e+00 1.80633e+02 57.015  1.53725e+01  2.36852e+01  0.00000e+00 0.00000e+00 1.80773e+02 57.015  1.39638e-01 57.015  0.9821 
1 1 1 -12 74  8  o 9  5.40018e+00 1.24107e+00 7.10910e+01 74.788  1.52264e+00  5.59979e+00  0.00000e+00 0.00000e+00 1.12979e+02 74.788  4.18879e+01 74.788  0.9092 
1 1 1 -12 74  9  o 4  4.93504e+00 1.06320e+00 1.40788e+02 186.710 -1.26893e+01 -1.49280e+00 0.00000e+00 0.00000e+00 3.66561e+01 186.710 1.04132e+02 6.710   0.9600 
1 1 1 -12 74  10 o 5  6.27287e+00 1.09158e+00 6.74756e+01 141.236 -6.49746e+00 5.21742e+00  0.00000e+00 0.00000e+00 1.52644e+02 141.236 8.51684e+01 141.236 0.9379 
1 1 1 -12 74  11 o 1  7.42977e+00 1.18270e+00 1.23129e+02 84.348  1.73834e+00  1.75656e+01  0.00000e+00 0.00000e+00 1.46546e+02 84.348  2.34165e+01 84.348  0.9712 
1 1 1 -12 74  12 o 18 3.26957e+00 1.00019e+00 3.76957e+01 349.729 3.15190e+00  -5.71139e-01 0.00000e+00 0.00000e+00 6.28617e+01 349.729 2.51659e+01 349.729 0.8240 
1 1 1 -12 75  1  o 14 4.00380e+00 1.01478e+00 7.72164e+01 168.687 -4.57914e+00 9.16048e-01  0.00000e+00 0.00000e+00 5.63243e+01 168.687 2.08921e+01 348.687 0.8851 
1 1 1 -12 75  2  f 0  7.06795e+00 1.00819e+00 1.16963e+02 167.917 -1.25043e+01 2.67675e+00  0.00000e+00 0.00000e+00 1.38592e+02 167.917 2.16284e+01 167.917 0.9601 
1 1 1 -12 75  3  o 10 3.48001e+00 9.99235e-01 1.15694e+01 156.621 -5.45553e-01 2.35840e-01  0.00000e+00 0.00000e+00 2.57301e+01 156.621 1.41607e+01 156.621 0.2848 
1 1 1 -12 75  4  o 10 8.11873e+00 9.38416e-01 1.18510e+02 121.169 -8.56033e+00 1.41519e+01  0.00000e+00 0.00000e+00 1.77460e+02 121.169 5.89497e+01 121.169 0.9693 
1 1 1 -12 75  5  o 12 2.71013e+00 8.83012e-01 2.64079e+01 149.240 -9.79240e-01 5.82804e-01  0.00000e+00 0.00000e+00 2.38721e+01 149.240 2.53582e+00 329.241 0.4937 
1 1 1 -12 75  6  o 5  4.35890e+00 1.19979e+00 9.55566e+01 84.472  5.91182e-01  6.10858e+00  0.00000e+00 0.00000e+00 5.41209e+01 84.472  4.14356e+01 264.472 0.9144 
1 1 1 -12 75  7  o 14 5.99157e+00 1.22476e+00 9.86678e+01 288.139 2.66587e+00  -8.13768e+00 0.00000e+00 0.00000e+00 1.12561e+02 288.139 1.38929e+01 288.139 0.9397 
1 1 1 -12 75  8  o 4  7.56333e+00 1.19110e+00 1.33752e+02 199.596 -1.51606e+01 -5.39724e+00 0.00000e+00 0.00000e+00 1.40789e+02 199.596 7.03750e+00 199.596 0.9684 
1 1 1 -12 75  9  o 8  7.63374e+00 1.00429e+00 1.02950e+02 10.246  1.47855e+01  2.67250e+00  0.00000e+00 0.00000e+00 1.73215e+02 10.246  7.02654e+01 10.246  0.9661 
1 1 1 -12 75  10 o 3  9.20506e+00 9.87443e-01 1.20802e+02 273.941 1.73383e+00  -2.51668e+01 0.00000e+00 0.00000e+00 2.16622e+02 273.941 9.58199e+01 273.941 0.9800 
1 1 1 -12 75  11 o 15 4.80586e+00 1.09892e+00 8.35056e+01 108.299 -2.57967e+00 7.80079e+00  0.00000e+00 0.00000e+00 8.47467e+01 108.299 1.24115e+00 108.299 0.9370 
1 1 1 -12 75  12 o 18 4.64979e+00 1.21334e+00 6.11704e+01 233.920 -3.62696e+00 -4.97742e+00 0.00000e+00 0.00000e+00 9.75637e+01 233.920 3.63933e+01 233.920 0.9148 
1 1 1 -12 76  1  o 13 1.89111e+01 7.17345e-01 3.30783e+02 109.143 -3.50061e+01 1.00846e+02  0.00000e+00 0.00000e+00 3.78342e+02 109.143 4.75588e+01 109.143 0.9953 
1 1 1 -12 76  2  o 6  1.23367e+01 7.79834e-01 2.51523e+02 272.871 2.57069e+00  -5.12633e+01 0.00000e+00 0.00000e+00 2.08443e+02 272.871 4.30806e+01 92.871  0.9902 
1 1 1 -12 76  3  o 9  7.95887e+00 9.69312e-01 1.59758e+02 50.715  1.35878e+01  1.66098e+01  0.00000e+00 0.00000e+00 1.32663e+02 50.715  2.70954e+01 230.715 0.9764 
1 1 1 -12 76  4  o 9  2.78959e+00 8.92703e-01 7.64997e+01 153.120 -3.23817e+00 1.64140e+00  0.00000e+00 0.00000e+00 1.24144e+01 153.120 6.40853e+01 333.120 0.8476 
1 1 1 -12 76  5  o 12 2.39710e+00 8.06470e-01 2.08686e+01 298.188 4.28099e-01  -7.98807e-01 0.00000e+00 0.00000e+00 1.62582e+01 298.188 4.61044e+00 118.188 0.4122 
1 1 1 -12 76  6  o 3  3.58209e+00 1.09423e+00 1.83055e+01 249.056 -3.60019e-01 -9.40646e-01 0.00000e+00 0.00000e+00 4.20687e+01 249.056 2.37632e+01 249.056 0.4489 
1 1 1 -12 76  7  f 0  4.07405e+00 1.20339e+00 6.44232e+01 66.084  1.60199e+00  3.61242e+00  0.00000e+00 0.00000e+00 6.72521e+01 66.084  2.82888e+00 66.084  0.8616 
1 1 1 -12 76  8  o 4  3.50781e+00 1.08810e+00 4.89522e+01 30.236  2.53413e+00  1.47706e+00  0.00000e+00 0.00000e+00 5.68590e+01 30.236  7.90682e+00 30.236  0.8049 
1 1 1 -12 76  9  o 12 3.72653e+00 1.06226e+00 4.71910e+01 47.285  2.16552e+00  2.34555e+00  0.00000e+00 0.00000e+00 6.76635e+01 47.285  2.04726e+01 47.285  0.8233 
1 1 1 -12 76  10 o 1  2.88380e+00 8.87709e-01 2.98460e+01 286.073 5.88193e-01  -2.04146e+00 0.00000e+00 0.00000e+00 4.75021e+01 286.073 1.76561e+01 286.073 0.7172 
1 1 1 -12 76  11 o 12 3.99642e+00 1.10439e+00 8.68960e+01 17.077  7.62877e+00  2.34351e+00  0.00000e+00 0.00000e+00 5.26997e+01 17.077  3.41963e+01 197.077 0.9351 
1 1 1 -12 76  12 o 11 5.85185e+00 1.17756e+00 9.48804e+01 171.654 -1.23933e+01 1.81812e+00  0.00000e+00 0.00000e+00 1.14555e+02 171.654 1.96745e+01 171.654 0.9592 
1 1 1 -12 77  1  o 5  4.60809e+00 1.10967e+00 8.80563e+01 232.394 -3.82553e+00 -4.96640e+00 0.00000e+00 0.00000e+00 7.09957e+01 232.394 1.70606e+01 52.394  0.9163 
1 1 1 -12 77  2  o 1  4.14038e+00 1.08642e+00 7.34532e+01 49.685  3.08312e+00  3.63352e+00  0.00000e+00 0.00000e+00 6.48987e+01 49.685  8.55456e+00 229.685 0.8876 
1 1 1 -12 77  3  o 10 9.84970e+00 8.77424e-01 1.70465e+02 120.774 -1.44214e+01 2.42168e+01  0.00000e+00 0.00000e+00 1.93458e+02 120.774 2.29932e+01 120.774 0.9821 
1 1 1 -12 77  4  o 8  4.32725e+00 1.11631e+00 3.38578e+01 296.987 9.27401e-01  -1.82115e+00 0.00000e+00 0.00000e+00 8.08041e+01 296.987 4.69463e+01 296.987 0.7048 
1 1 1 -12 77  5  o 18 3.94554e+00 1.04990e+00 8.67587e+01 35.919  4.50477e+00  3.26316e+00  0.00000e+00 0.00000e+00 4.73766e+01 35.919  3.93821e+01 215.919 0.9050 
1 1 1 -12 77  6  o 1  5.03090e+00 1.24659e+00 7.28501e+01 276.192 5.65042e-01  -5.20844e+00 0.00000e+00 0.00000e+00 9.68483e+01 276.192 2.39982e+01 276.192 0.8986 
1 1 1 -12 77  7  o 9  8.55305e+00 1.30441e+00 1.37452e+02 157.626 -1.57071e+01 6.46560e+00  0.00000e+00 0.00000e+00 1.73719e+02 157.626 3.62662e+01 157.626 0.9701 
1 1 1 -12 77  8  o 8  7.84448e+00 1.07553e+00 1.52621e+02 263.573 -2.44398e+00 -2.16967e+01 0.00000e+00 0.00000e+00 1.34478e+02 263.573 1.81428e+01 83.573  0.9768 
1 1 1 -12 77  9  o 3  2.73460e+00 8.87067e-01 4.91836e+01 154.374 -2.63487e+00 1.26390e+00  0.00000e+00 0.00000e+00 3.31176e+01 154.374 1.60660e+01 334.374 0.8041 
1 1 1 -12 77  10 o 18 5.54775e+00 1.15602e+00 1.04789e+02 322.923 9.04449e+00  -6.83453e+00 0.00000e+00 0.00000e+00 9.32696e+01 322.923 1.15191e+01 142.923 0.9548 
1 1 1 -12 77  11 o 3  4.30980e+00 1.14194e+00 7.06538e+01 160.072 -6.20043e+00 2.24799e+00  0.00000e+00 0.00000e+00 7.75463e+01 160.072 6.89253e+00 160.072 0.9207 
1 1 1 -12 77  12 o 19 3.05326e+00 9.78078e-01 4.50088e+01 342.766 3.47724e+00  -1.07865e+00 0.00000e+00 0.00000e+00 5.15910e+01 342.766 6.58225e+00 342.766 0.8481 
1 1 1 -12 78  1  o 13 4.98786e+00 1.12251e+00 9.20396e+01 31.996  5.77258e+00  3.60653e+00  0.00000e+00 0.00000e+00 8.13912e+01 31.996  1.06485e+01 211.996 0.9233 
1 1 1 -12 78  2  o 10 1.03376e+01 8.48450e-01 1.20558e+02 184.442 -2.16663e+01 -1.68310e+00 0.00000e+00 0.00000e+00 2.59460e+02 184.442 1.38902e+02 184.442 0.9767 
1 1 1 -12 78  3  o 11 9.60798e+00 8.87017e-01 1.39318e+02 321.688 1.66681e+01  -1.31694e+01 0.00000e+00 0.00000e+00 2.13457e+02 321.688 7.41394e+01 321.688 0.9762 
1 1 1 -12 78  4  o 3  3.81929e+00 1.06416e+00 3.34443e+01 90.222  -7.61268e-03 1.96207e+00  0.00000e+00 0.00000e+00 6.58167e+01 90.222  3.23724e+01 90.222  0.6914 
1 1 1 -12 78  5  o 10 1.33629e+01 1.11759e+00 1.92161e+02 160.666 -3.66658e+01 1.28649e+01  0.00000e+00 0.00000e+00 3.03226e+02 160.666 1.11065e+02 160.666 0.9870 
1 1 1 -12 78  6  o 16 8.42684e+00 1.20225e+00 1.15751e+02 1.365   1.47091e+01  3.50594e-01  0.00000e+00 0.00000e+00 1.89545e+02 1.365   7.37937e+01 1.365   0.9654 
1 1 1 -12 78  7  o 9  4.30751e+00 1.22439e+00 8.75558e+01 53.745  3.60518e+00  4.91594e+00  0.00000e+00 0.00000e+00 6.00351e+01 53.745  2.75206e+01 233.745 0.9138 
1 1 1 -12 78  8  o 4  3.91187e+00 1.04423e+00 5.76178e+01 266.933 -2.24167e-01 -4.18368e+00 0.00000e+00 0.00000e+00 6.99326e+01 266.933 1.23149e+01 266.933 0.8704 
1 1 1 -12 78  9  o 7  4.36178e+00 1.07509e+00 7.28055e+01 13.629  6.29759e+00  1.52690e+00  0.00000e+00 0.00000e+00 7.72356e+01 13.629  4.43007e+00 13.629  0.9192 
1 1 1 -12 78  10 o 14 4.73199e+00 1.07960e+00 3.23869e+01 49.657  2.09032e+00  2.46110e+00  0.00000e+00 0.00000e+00 1.13652e+02 49.657  8.12651e+01 49.657  0.8256 
1 1 1 -12 78  11 o 9  6.73370e+00 1.18471e+00 1.12622e+02 198.861 -1.46694e+01 -5.01128e+00 0.00000e+00 0.00000e+00 1.30563e+02 198.861 1.79407e+01 198.861 0.9672 
1 1 1 -12 78  12 o 12 3.26704e+00 1.04186e+00 7.95948e+01 28.378  6.14450e+00  3.31926e+00  0.00000e+00 0.00000e+00 3.31558e+01 28.378  4.64390e+01 208.378 0.9253 
1 1 1 -12 79  1  o 5  1.00216e+01 8.81851e-01 1.57964e+02 61.022  1.22080e+01  2.20440e+01  0.00000e+00 0.00000e+00 2.11792e+02 61.022  5.38284e+01 61.022  0.9800 
1 1 1 -12 79  2  o 5  9.18033e+00 9.15315e-01 1.54419e+02 176.342 -2.41349e+01 1.54287e+00  0.00000e+00 0.00000e+00 1.83808e+02 176.342 2.93891e+01 176.342 0.9791 
1 1 1 -12 79  3  o 6  4.25222e+00 1.08216e+00 1.00607e+02 29.220  5.67416e+00  3.17378e+00  0.00000e+00 0.00000e+00 4.64267e+01 29.220  5.41805e+01 209.220 0.9195 
1 1 1 -12 79  4  o 3  4.11263e+00 1.08380e+00 5.05492e+01 238.107 -1.61606e+00 -2.59701e+00 0.00000e+00 0.00000e+00 7.52895e+01 238.107 2.47403e+01 238.107 0.8142 
1 1 1 -12 79  5  o 8  4.05532e+00 1.06488e+00 6.73782e+01 109.386 -1.46070e+00 4.15121e+00  0.00000e+00 0.00000e+00 6.62217e+01 109.386 1.15653e+00 289.386 0.8773 
1 1 1 -12 79  6  o 13 4.85985e+00 1.14158e+00 6.57897e+01 50.684  3.30134e+00  4.03117e+00  0.00000e+00 0.00000e+00 9.79596e+01 50.684  3.21699e+01 50.684  0.8980 
1 1 1 -12 79  7  o 13 5.04354e+00 1.33963e+00 8.35313e+01 215.749 -4.85968e+00 -3.49837e+00 0.00000e+00 0.00000e+00 8.89283e+01 215.749 5.39699e+00 215.749 0.9122 
1 1 1 -12 79  8  o 8  5.50777e+00 1.28695e+00 1.01074e+02 123.753 -4.76320e+00 7.12782e+00  0.00000e+00 0.00000e+00 9.27664e+01 123.753 8.30747e+00 303.753 0.9397 
1 1 1 -12 79  9  o 14 5.50836e+00 1.20049e+00 1.37201e+02 121.231 -7.41337e+00 1.22261e+01  0.00000e+00 0.00000e+00 6.15442e+01 121.231 7.56569e+01 301.231 0.9644 
1 1 1 -12 79  10 o 10 6.57249e+00 1.19942e+00 1.38044e+02 305.936 1.00163e+01  -1.38184e+01 0.00000e+00 0.00000e+00 1.00287e+02 305.936 3.77575e+01 125.936 0.9702 
1 1 1 -12 79  11 o 2  5.10459e+00 1.15591e+00 8.63322e+01 111.870 -3.59359e+00 8.95287e+00  0.00000e+00 0.00000e+00 9.40668e+01 111.870 7.73468e+00 111.870 0.9467 
1 1 1 -12 79  12 o 18 6.80818e+00 1.22459e+00 7.00020e+01 242.451 -4.98795e+00 -9.56173e+00 0.00000e+00 0.00000e+00 1.71786e+02 242.451 1.01784e+02 242.451 0.9524 
1 1 1 -12 80  1  o 17 8.53194e+00 9.84999e-01 1.65369e+02 2.513   2.27302e+01  9.97511e-01  0.00000e+00 0.00000e+00 1.48655e+02 2.513   1.67135e+01 182.513 0.9778 
1 1 1 -12 80  2  o 8  7.82867e+00 9.96942e-01 1.27578e+02 296.695 7.55040e+00  -1.50154e+01 0.00000e+00 0.00000e+00 1.58041e+02 296.695 3.04631e+01 296.695 0.9698 
1 1 1 -12 80  3  o 16 6.49531e+00 1.11284e+00 1.27949e+02 344.780 1.15992e+01  -3.15577e+00 0.00000e+00 0.00000e+00 1.05865e+02 344.780 2.20838e+01 164.780 0.9575 
1 1 1 -12 80  4  o 10 3.64806e+00 1.04052e+00 5.35049e+01 202.478 -2.91155e+00 -1.20467e+00 0.00000e+00 0.00000e+00 5.89600e+01 202.478 5.45517e+00 202.478 0.8206 
1 1 1 -12 80  5  o 14 7.77996e+00 1.02195e+00 1.45060e+02 116.296 -8.50442e+00 1.72108e+01  0.00000e+00 0.00000e+00 1.39304e+02 116.296 5.75643e+00 296.295 0.9736 
1 1 1 -12 80  6  o 1  6.02526e+00 1.14129e+00 8.33886e+01 80.250  1.40255e+00  8.16249e+00  0.00000e+00 0.00000e+00 1.28508e+02 80.250  4.51193e+01 80.250  0.9375 
1 1 1 -12 80  7  o 4  7.84085e+00 1.37734e+00 8.36821e+01 314.387 6.63841e+00  -6.78199e+00 0.00000e+00 0.00000e+00 1.94238e+02 314.387 1.10555e+02 314.387 0.9457 
1 1 1 -12 80  8  o 1  3.77792e+00 1.14866e+00 6.62015e+01 261.194 -6.84046e-01 -4.41586e+00 0.00000e+00 0.00000e+00 5.81957e+01 261.194 8.00579e+00 81.194  0.8794 
1 1 1 -12 80  9  o 4  7.69739e+00 1.12771e+00 7.75867e+01 193.205 -1.09026e+01 -2.55811e+00 0.00000e+00 0.00000e+00 1.97166e+02 193.205 1.19579e+02 193.205 0.9543 
1 1 1 -12 80  10 o 14 4.26325e+00 1.15137e+00 8.01600e+01 232.261 -4.59701e+00 -5.93942e+00 0.00000e+00 0.00000e+00 6.81201e+01 232.261 1.20399e+01 52.261  0.9308 
1 1 1 -12 80  11 o 1  2.92285e+00 9.18278e-01 6.71965e+01 40.823  3.97593e+00  3.43469e+00  0.00000e+00 0.00000e+00 3.08724e+01 40.823  3.63241e+01 220.823 0.8990 
1 1 1 -12 80  12 o 19 4.39025e+00 1.14730e+00 8.00199e+01 338.182 7.80295e+00  -3.12383e+00 0.00000e+00 0.00000e+00 7.35772e+01 338.182 6.44263e+00 158.182 0.9385 
1 1 1 -12 81  1  o 11 4.77482e+00 1.11758e+00 1.18731e+02 260.377 -1.36691e+00 -8.06170e+00 0.00000e+00 0.00000e+00 4.95887e+01 260.377 6.91426e+01 80.377  0.9367 
1 1 1 -12 81  2  o 5  2.70889e+00 8.86058e-01 6.08278e+01 28.970  2.51646e+00  1.39319e+00  0.00000e+00 0.00000e+00 2.07248e+01 28.970  4.01030e+01 208.970 0.8004 
1 1 1 -12 81  3  o 9  4.03777e+00 1.06980e+00 7.20809e+01 325.661 3.80946e+00  -2.60243e+00 0.00000e+00 0.00000e+00 6.20228e+01 325.661 1.00582e+01 145.661 0.8836 
1 1 1 -12 81  4  o 8  7.08278e+00 1.06246e+00 1.27479e+02 241.083 -7.13236e+00 -1.29111e+01 0.00000e+00 0.00000e+00 1.29383e+02 241.083 1.90380e+00 241.083 0.9655 
1 1 1 -12 81  5  o 16 3.54934e+00 1.03501e+00 2.28424e+01 75.331  3.57994e-01  1.36760e+00  0.00000e+00 0.00000e+00 5.36339e+01 75.331  3.07915e+01 75.331  0.5741 
1 1 1 -12 81  6  o 9  9.43429e+00 9.71908e-01 1.50683e+02 73.767  7.35271e+00  2.52548e+01  0.00000e+00 0.00000e+00 1.96340e+02 73.767  4.56574e+01 73.767  0.9808 
1 1 1 -12 81  7  o 2  6.07455e+00 1.38653e+00 1.15806e+02 258.219 -2.06802e+00 -9.91571e+00 0.00000e+00 0.00000e+00 1.00262e+02 258.219 1.55440e+01 78.219  0.9493 
1 1 1 -12 81  8  o 8  6.57251e+00 1.39028e+00 8.94324e+01 109.921 -3.09503e+00 8.54003e+00  0.00000e+00 0.00000e+00 1.42642e+02 109.921 5.32096e+01 109.921 0.9432 
1 1 1 -12 81  9  o 11 2.42995e+00 8.27331e-01 4.89881e+01 28.176  2.65307e+00  1.42116e+00  0.00000e+00 0.00000e+00 2.46834e+01 28.176  2.43047e+01 208.176 0.8107 
1 1 1 -12 81  10 o 7  2.90344e+00 9.22478e-01 7.51644e+01 251.580 -1.75119e+00 -5.25827e+00 0.00000e+00 0.00000e+00 2.29538e+01 251.580 5.22106e+01 71.580  0.9046 
1 1 1 -12 81  11 o 7  2.86680e+00 9.24867e-01 7.38513e+00 131.523 -3.91762e-01 4.42445e-01  0.00000e+00 0.00000e+00 2.29201e+01 131.523 1.55350e+01 131.523 0.2833 
1 1 1 -12 82  1  o 8  4.57985e+00 1.23271e+00 3.97840e+01 209.445 -2.26206e+00 -1.27694e+00 0.00000e+00 0.00000e+00 9.38002e+01 209.445 5.40162e+01 209.445 0.7752 
1 1 1 -12 82  2  o 4  9.21291e+00 9.31635e-01 1.85688e+02 278.098 4.22615e+00  -2.97021e+01 0.00000e+00 0.00000e+00 1.54931e+02 278.098 3.07568e+01 98.098  0.9832 
1 1 1 -12 82  3  f 0  5.75174e+00 1.15984e+00 7.46533e+01 59.464  3.34288e+00  5.66694e+00  0.00000e+00 0.00000e+00 1.24317e+02 59.464  4.96638e+01 59.464  0.9205 
1 1 1 -12 82  4  o 11 7.79781e+00 9.97965e-01 1.48051e+02 181.824 -2.07813e+01 -6.61702e-01 0.00000e+00 0.00000e+00 1.37656e+02 181.824 1.03945e+01 1.824   0.9756 
1 1 1 -12 82  5  o 2  3.22374e+00 9.89357e-01 5.66047e+01 242.556 -1.61483e+00 -3.10952e+00 0.00000e+00 0.00000e+00 4.51698e+01 242.556 1.14349e+01 62.556  0.8413 
1 1 1 -12 82  6  o 5  2.78670e+00 9.05927e-01 4.47467e+01 343.201 2.45942e+00  -7.42476e-01 0.00000e+00 0.00000e+00 3.59487e+01 343.201 8.79801e+00 163.201 0.7723 
1 1 1 -12 82  7  o 5  9.18051e+00 9.12309e-01 1.53474e+02 40.196  2.17041e+01  1.83390e+01  0.00000e+00 0.00000e+00 1.84337e+02 40.196  3.08631e+01 40.196  0.9822 
1 1 1 -12 82  8  o 17 3.59606e+00 1.17505e+00 8.08627e+01 254.975 -1.45745e+00 -5.42981e+00 0.00000e+00 0.00000e+00 4.10810e+01 254.975 3.97817e+01 74.975  0.9061 
1 1 1 -12 82  9  o 10 5.18189e+00 1.17009e+00 5.91206e+01 164.501 -5.58928e+00 1.54989e+00  0.00000e+00 0.00000e+00 1.17020e+02 164.501 5.78998e+01 164.501 0.9091 
1 1 1 -12 82  10 o 9  4.84855e+00 1.20430e+00 9.56595e+01 186.901 -9.82745e+00 -1.18936e+00 0.00000e+00 0.00000e+00 7.60238e+01 186.901 1.96357e+01 6.901   0.9481 
1 1 1 -12 82  11 o 17 3.89934e+00 1.15132e+00 8.16948e+01 341.457 7.24418e+00  -2.42984e+00 0.00000e+00 0.00000e+00 5.38946e+01 341.457 2.78001e+01 161.457 0.9321 
1 1 1 -12 83  1  o 14 5.53750e+00 1.28079e+00 9.30885e+01 21.588  6.76781e+00  2.67796e+00  0.00000e+00 0.00000e+00 1.00326e+02 21.588  7.23772e+00 21.588  0.9285 
1 1 1 -12 83  2  o 14 9.04665e+00 9.51341e-01 1.78886e+02 73.683  8.10228e+00  2.76771e+01  0.00000e+00 0.00000e+00 1.55278e+02 73.683  2.36082e+01 253.683 0.9825 
1 1 1 -12 83  3  o 1  8.85294e+00 9.69462e-01 1.28543e+02 285.266 5.50217e+00  -2.01592e+01 0.00000e+00 0.00000e+00 1.96018e+02 285.266 6.74743e+01 285.266 0.9758 
1 1 1 -12 83  4  o 18 3.66580e+00 1.05988e+00 6.16249e+01 257.006 -8.87364e-01 -3.84534e+00 0.00000e+00 0.00000e+00 5.69372e+01 257.006 4.68776e+00 77.006  0.8614 
1 1 1 -12 83  5  o 1  5.68678e+00 1.11947e+00 9.39031e+01 65.661  3.65659e+00  8.08364e+00  0.00000e+00 0.00000e+00 1.07038e+02 65.661  1.31352e+01 65.661  0.9418 
1 1 1 -12 83  6  o 14 3.74142e+00 1.01501e+00 9.36039e+01 285.216 1.74455e+00  -6.41384e+00 0.00000e+00 0.00000e+00 3.56190e+01 285.216 5.79848e+01 105.216 0.9214 
1 1 1 -12 83  7  o 12 8.34480e+00 9.44756e-01 1.54828e+02 47.720  1.80898e+01  1.98945e+01  0.00000e+00 0.00000e+00 1.51844e+02 47.720  2.98314e+00 227.720 0.9812 
1 1 1 -12 83  8  o 19 3.74827e+00 1.17323e+00 4.24293e+01 286.774 8.30141e-01  -2.75406e+00 0.00000e+00 0.00000e+00 6.98315e+01 286.774 2.74023e+01 286.774 0.8004 
1 1 1 -12 83  9  o 17 3.94757e+00 1.24125e+00 4.05269e+01 275.218 2.69745e-01  -2.95389e+00 0.00000e+00 0.00000e+00 7.86225e+01 275.218 3.80956e+01 275.218 0.8075 
1 1 1 -12 83  10 o 13 3.57720e+00 1.06075e+00 8.95685e+01 103.099 -1.82946e+00 7.86200e+00  0.00000e+00 0.00000e+00 3.54362e+01 103.099 5.41323e+01 283.099 0.9358 
1 1 1 -12 83  11 o 10 4.33419e+00 1.12683e+00 7.66421e+01 11.865  8.14906e+00  1.71213e+00  0.00000e+00 0.00000e+00 7.49750e+01 11.865  1.66709e+00 191.865 0.9379 
1 1 1 -12 84  1  o 4  5.47385e+00 1.20836e+00 6.23164e+01 165.658 -5.14404e+00 1.31525e+00  0.00000e+00 0.00000e+00 1.22981e+02 165.658 6.06646e+01 165.658 0.9001 
1 1 1 -12 84  2  o 13 3.76392e+00 1.09019e+00 8.89243e+01 160.940 -5.31567e+00 1.83653e+00  0.00000e+00 0.00000e+00 3.92641e+01 160.940 4.96602e+01 340.940 0.9061 
1 1 1 -12 84  3  o 16 4.60217e+00 1.13261e+00 8.39373e+01 250.826 -2.10658e+00 -6.05800e+00 0.00000e+00 0.00000e+00 7.48182e+01 250.826 9.11901e+00 70.826  0.9183 
1 1 1 -12 84  4  o 8  6.28407e+00 1.12481e+00 1.18672e+02 125.783 -7.26711e+00 1.00824e+01  0.00000e+00 0.00000e+00 1.07514e+02 125.783 1.11573e+01 305.783 0.9589 
1 1 1 -12 84  5  o 18 5.52821e+00 1.16343e+00 9.63355e+01 197.592 -8.61201e+00 -2.73050e+00 0.00000e+00 0.00000e+00 9.91821e+01 197.592 2.84667e+00 197.592 0.9429 
1 1 1 -12 84  6  o 10 1.22794e+01 7.76149e-01 1.95288e+02 332.588 4.70638e+01  -2.44080e+01 0.00000e+00 0.00000e+00 2.60553e+02 332.588 6.52647e+01 332.588 0.9905 
1 1 1 -12 84  7  o 18 3.38148e+00 9.68050e-01 8.69475e+01 261.823 -9.29985e-01 -6.47189e+00 0.00000e+00 0.00000e+00 2.95395e+01 261.823 5.74080e+01 81.823  0.9200 
1 1 1 -12 84  8  o 8  4.85590e+00 1.33341e+00 7.83238e+01 182.951 -6.32949e+00 -3.26324e-01 0.00000e+00 0.00000e+00 8.83111e+01 182.951 9.98737e+00 182.951 0.9173 
1 1 1 -12 84  9  o 15 5.93414e+00 1.49046e+00 1.35734e+02 110.600 -4.47790e+00 1.19133e+01  0.00000e+00 0.00000e+00 7.71369e+01 110.600 5.85973e+01 290.600 0.9599 
1 1 1 -12 84  10 o 5  2.90805e+00 9.36472e-01 4.48173e+01 232.306 -2.28930e+00 -2.96265e+00 0.00000e+00 0.00000e+00 4.77776e+01 232.306 2.96027e+00 232.306 0.8529 
1 1 1 -12 84  11 o 14 2.91098e+00 9.49307e-01 5.69194e+01 319.478 3.69942e+00  -3.16206e+00 0.00000e+00 0.00000e+00 3.97120e+01 319.478 1.72074e+01 139.478 0.8902 
1 1 1 -12 85  1  o 10 5.03387e+00 1.14523e+00 9.72533e+01 338.663 7.50237e+00  -2.93063e+00 0.00000e+00 0.00000e+00 7.98477e+01 338.663 1.74057e+01 158.663 0.9357 
1 1 1 -12 85  2  o 3  3.79832e+00 1.04761e+00 1.05854e+02 71.908  2.30026e+00  7.04115e+00  0.00000e+00 0.00000e+00 2.68628e+01 71.908  7.89912e+01 251.908 0.9298 
1 1 1 -12 85  3  o 18 6.62081e+00 1.16557e+00 9.08577e+01 229.728 -6.29730e+00 -7.43286e+00 0.00000e+00 0.00000e+00 1.44653e+02 229.728 5.37953e+01 229.728 0.9472 
1 1 1 -12 85  4  o 5  5.65892e+00 9.76074e-01 7.75390e+01 239.093 -4.42179e+00 -7.38636e+00 0.00000e+00 0.00000e+00 1.22085e+02 239.093 4.45461e+01 239.093 0.9400 
1 1 1 -12 85  5  o 11 4.30960e+00 1.09421e+00 7.96581e+01 349.359 5.94134e+00  -1.11631e+00 0.00000e+00 0.00000e+00 6.78997e+01 349.359 1.17584e+01 169.359 0.9131 
1 1 1 -12 85  6  o 7  7.79368e+00 9.73236e-01 1.42345e+02 145.817 -1.87144e+01 1.27101e+01  0.00000e+00 0.00000e+00 1.43147e+02 145.817 8.01689e-01 145.817 0.9776 
1 1 1 -12 85  7  o 10 3.03751e+00 9.44517e-01 8.85677e+01 349.813 6.23903e+00  -1.12112e+00 0.00000e+00 0.00000e+00 1.57432e+01 349.813 7.28244e+01 169.813 0.9173 
1 1 1 -12 85  8  o 1  2.46676e+00 8.46871e-01 6.42371e+01 359.059 3.89840e+00  -6.40069e-02 0.00000e+00 0.00000e+00 1.50610e+01 359.059 4.91761e+01 179.059 0.8595 
1 1 1 -12 85  9  o 4  3.34205e+00 1.15244e+00 1.00394e+02 182.771 -7.05559e+00 -3.41458e-01 0.00000e+00 0.00000e+00 1.52651e+01 182.771 8.51291e+01 2.771   0.9262 
1 1 1 -12 85  10 o 7  6.17082e+00 1.30598e+00 1.55316e+02 348.825 1.83294e+01  -3.62114e+00 0.00000e+00 0.00000e+00 6.87498e+01 348.825 8.65659e+01 168.825 0.9729 
1 1 1 -12 85  11 o 7  4.36394e+00 1.21485e+00 5.03434e+01 191.673 -5.06866e+00 -1.04721e+00 0.00000e+00 0.00000e+00 9.56430e+01 191.673 4.52996e+01 191.673 0.8973 
1 1 1 -12 86  1  o 19 7.27078e+00 1.09308e+00 1.64852e+02 158.001 -1.89356e+01 7.65009e+00  0.00000e+00 0.00000e+00 1.01686e+02 158.001 6.31653e+01 338.001 0.9752 
1 1 1 -12 86  2  o 19 6.66007e+00 1.15050e+00 4.51195e+01 235.288 -2.78281e+00 -4.01707e+00 0.00000e+00 0.00000e+00 1.77744e+02 235.288 1.32625e+02 235.288 0.8907 
1 1 1 -12 86  3  o 11 4.36813e+00 1.13695e+00 7.15287e+01 289.573 1.82531e+00  -5.13360e+00 0.00000e+00 0.00000e+00 7.65402e+01 289.573 5.01141e+00 289.573 0.9028 
1 1 1 -12 86  4  o 10 7.66058e+00 1.05644e+00 1.25695e+02 126.498 -1.05555e+01 1.42663e+01  0.00000e+00 0.00000e+00 1.53507e+02 126.498 2.78121e+01 126.498 0.9714 
1 1 1 -12 86  5  o 4  1.27245e+01 7.94423e-01 1.62202e+02 334.720 4.33419e+01  -2.04692e+01 0.00000e+00 0.00000e+00 3.09847e+02 334.720 1.47645e+02 334.720 0.9895 
1 1 1 -12 86  6  o 9  4.76338e+00 9.64254e-01 1.11953e+02 315.898 8.54659e+00  -8.28277e+00 0.00000e+00 0.00000e+00 5.88153e+01 315.898 5.31373e+01 135.898 0.9570 
1 1 1 -12 86  7  o 12 4.12101e+00 1.09973e+00 4.89262e+01 198.598 -3.90717e+00 -1.31474e+00 0.00000e+00 0.00000e+00 8.49632e+01 198.598 3.60370e+01 198.598 0.8681 
1 1 1 -12 86  8  o 19 3.32491e+00 9.47791e-01 6.41847e+01 340.431 4.79387e+00  -1.70404e+00 0.00000e+00 0.00000e+00 4.71329e+01 340.431 1.70518e+01 160.432 0.8954 
1 1 1 -12 86  9  o 13 3.25561e+00 1.07509e+00 5.73722e+01 180.461 -4.41451e+00 -3.54898e-02 0.00000e+00 0.00000e+00 4.93744e+01 180.461 7.99771e+00 0.461   0.8778 
1 1 1 -12 86  10 o 6  4.85174e+00 1.26610e+00 1.11853e+02 11.389  1.10051e+01  2.21677e+00  0.00000e+00 0.00000e+00 6.09266e+01 11.389  5.09266e+01 191.389 0.9544 
1 1 1 -12 86  11 o 18 4.78357e+00 1.27767e+00 1.18290e+02 245.323 -5.25285e+00 -1.14325e+01 0.00000e+00 0.00000e+00 5.27679e+01 245.323 6.55218e+01 65.323  0.9594 
1 1 1 -12 87  1  o 11 6.20736e+00 1.15190e+00 7.91232e+01 238.226 -4.45859e+00 -7.19817e+00 0.00000e+00 0.00000e+00 1.39920e+02 238.226 6.07966e+01 238.226 0.9389 
1 1 1 -12 87  2  o 17 3.74333e+00 1.03967e+00 7.90489e+01 0.351   5.49790e+00  3.37166e-02  0.00000e+00 0.00000e+00 4.80239e+01 0.351   3.10251e+01 180.351 0.9038 
1 1 1 -12 87  3  o 13 4.22866e+00 1.16850e+00 7.49601e+01 17.824  5.12026e+00  1.64627e+00  0.00000e+00 0.00000e+00 6.81309e+01 17.824  6.82917e+00 197.824 0.9015 
1 1 1 -12 87  4  o 17 4.64450e+00 1.16354e+00 1.11439e+02 329.300 7.50716e+00  -4.45736e+00 0.00000e+00 0.00000e+00 5.24748e+01 329.300 5.89640e+01 149.300 0.9409 
1 1 1 -12 87  5  o 12 9.62997e+00 8.79542e-01 1.31503e+02 94.516  -2.32258e+00 2.94077e+01  0.00000e+00 0.00000e+00 2.23276e+02 94.516  9.17727e+01 94.516  0.9829 
1 1 1 -12 87  6  f 0  5.50200e+00 1.12672e+00 1.41705e+02 301.120 8.14214e+00  -1.34869e+01 0.00000e+00 0.00000e+00 5.77012e+01 301.120 8.40037e+01 121.120 0.9677 
1 1 1 -12 87  7  o 9  5.82811e+00 1.07849e+00 9.54974e+01 263.110 -1.40739e+00 -1.16476e+01 0.00000e+00 0.00000e+00 1.13069e+02 263.110 1.75718e+01 263.110 0.9564 
1 1 1 -12 87  8  o 4  3.92293e+00 1.00403e+00 7.28934e+01 109.417 -2.33960e+00 6.63738e+00  0.00000e+00 0.00000e+00 6.28984e+01 109.417 9.99502e+00 289.417 0.9260 
1 1 1 -12 87  9  o 10 4.39276e+00 1.29718e+00 5.52622e+01 55.249  2.60799e+00  3.75926e+00  0.00000e+00 0.00000e+00 8.95127e+01 55.249  3.42505e+01 55.249  0.8825 
1 1 1 -12 87  10 o 6  4.98814e+00 1.25870e+00 7.87306e+01 150.006 -6.96529e+00 4.02042e+00  0.00000e+00 0.00000e+00 9.53704e+01 150.006 1.66398e+01 150.006 0.9356 
1 1 1 -12 88  1  o 15 3.59985e+00 1.01949e+00 2.91652e+01 331.853 1.75207e+00  -9.37361e-01 0.00000e+00 0.00000e+00 6.49250e+01 331.853 3.57598e+01 331.853 0.6956 
1 1 1 -12 88  2  f 0  7.57498e+00 1.04883e+00 8.28699e+01 192.094 -1.11686e+01 -2.39314e+00 0.00000e+00 0.00000e+00 1.88830e+02 192.094 1.05960e+02 192.094 0.9552 
1 1 1 -12 88  3  f 0  5.60343e+00 1.24030e+00 4.94136e+01 292.809 1.71064e+00  -4.06756e+00 0.00000e+00 0.00000e+00 1.35154e+02 292.809 8.57400e+01 292.809 0.8777 
1 1 1 -12 88  4  o 3  2.94595e+00 9.17755e-01 1.81771e+01 96.026  -1.19480e-01 1.13186e+00  0.00000e+00 0.00000e+00 3.63108e+01 96.026  1.81337e+01 96.026  0.4932 
1 1 1 -12 88  5  o 17 6.52609e+00 1.04835e+00 1.03994e+02 234.219 -8.55341e+00 -1.18679e+01 0.00000e+00 0.00000e+00 1.32046e+02 234.219 2.80521e+01 234.219 0.9652 
1 1 1 -12 88  6  o 5  2.60673e+00 8.44149e-01 2.21377e+01 165.631 -1.41178e+00 3.61662e-01  0.00000e+00 0.00000e+00 3.49999e+01 165.631 1.28623e+01 165.631 0.5854 
1 1 1 -12 88  7  o 19 3.18925e+00 9.71646e-01 5.24009e+01 30.007  3.29253e+00  1.90147e+00  0.00000e+00 0.00000e+00 4.96621e+01 30.007  2.73883e+00 210.007 0.8555 
1 1 1 -12 88  8  o 14 2.60847e+00 8.67587e-01 6.56732e+01 320.682 3.60442e+00  -2.95207e+00 0.00000e+00 0.00000e+00 2.05877e+01 320.682 4.50856e+01 140.682 0.8848 
1 1 1 -12 88  9  o 7  4.48750e+00 1.32989e+00 1.05736e+02 139.675 -6.84023e+00 5.80615e+00  0.00000e+00 0.00000e+00 5.21789e+01 139.675 5.35576e+01 319.675 0.9425 
1 1 1 -12 88  10 o 13 4.96866e+00 1.31899e+00 1.06466e+02 288.116 3.43640e+00  -1.05040e+01 0.00000e+00 0.00000e+00 7.02558e+01 288.116 3.62103e+01 108.116 0.9536 
1 1 1 -12 89  1  o 1  4.27923e+00 1.10769e+00 9.40857e+01 167.987 -6.91661e+00 1.47175e+00  0.00000e+00 0.00000e+00 5.48159e+01 167.987 3.92698e+01 347.987 0.9263 
1 1 1 -12 89  2  o 14 3.46874e+00 1.02899e+00 5.48909e+01 278.923 5.78203e-01  -3.68245e+00 0.00000e+00 0.00000e+00 5.60819e+01 278.923 1.19095e+00 278.923 0.8522 
1 1 1 -12 89  3  o 14 3.84985e+00 1.09749e+00 5.18871e+01 154.392 -3.34545e+00 1.60342e+00  0.00000e+00 0.00000e+00 7.10836e+01 154.392 1.91965e+01 154.392 0.8514 
1 1 1 -12 89  4  f 0  1.12304e+01 8.09144e-01 1.64046e+02 154.556 -4.19705e+01 1.99684e+01  0.00000e+00 0.00000e+00 2.52455e+02 154.556 8.84094e+01 154.556 0.9892 
1 1 1 -12 89  5  o 6  8.48613e+00 9.44433e-01 1.58525e+02 342.359 2.77754e+01  -8.83280e+00 0.00000e+00 0.00000e+00 1.53896e+02 342.359 4.62885e+00 162.359 0.9827 
1 1 1 -12 89  6  o 9  8.69971e+00 9.39628e-01 1.46069e+02 193.789 -2.92559e+01 -7.17988e+00 0.00000e+00 0.00000e+00 1.74137e+02 193.789 2.80676e+01 193.789 0.9833 
1 1 1 -12 89  7  o 8  3.86258e+00 1.08644e+00 8.80235e+01 84.187  7.86216e-01  7.72254e+00  0.00000e+00 0.00000e+00 4.67833e+01 84.187  4.12402e+01 264.187 0.9332 
1 1 1 -12 89  8  o 4  5.40288e+00 1.13556e+00 9.94636e+01 306.412 7.45964e+00  -1.01137e+01 0.00000e+00 0.00000e+00 9.42087e+01 306.412 5.25489e+00 126.412 0.9593 
1 1 1 -12 89  9  o 17 3.59350e+00 1.04503e+00 8.11279e+01 172.778 -7.74164e+00 9.80962e-01  0.00000e+00 0.00000e+00 4.40933e+01 172.778 3.70346e+01 352.778 0.9335 
1 1 1 -12 89  10 o 4  3.78673e+00 1.20845e+00 8.91002e+01 58.313  4.32479e+00  7.00590e+00  0.00000e+00 0.00000e+00 4.32237e+01 58.313  4.58765e+01 238.313 0.9371 
1 1 1 -12 90  1  o 14 4.65287e+00 1.12129e+00 1.05641e+02 255.534 -2.23805e+00 -8.67526e+00 0.00000e+00 0.00000e+00 5.90353e+01 255.534 4.66056e+01 75.534  0.9424 
1 1 1 -12 90  2  o 3  3.91154e+00 1.08355e+00 2.42258e+01 104.749 -4.78221e-01 1.81655e+00  0.00000e+00 0.00000e+00 7.51320e+01 104.749 5.09062e+01 104.749 0.6768 
1 1 1 -12 90  3  o 8  3.52503e+00 9.91071e-01 3.54959e+01 157.201 -2.51949e+00 1.05904e+00  0.00000e+00 0.00000e+00 6.87122e+01 157.201 3.32163e+01 157.201 0.7881 
1 1 1 -12 90  4  o 17 5.85063e+00 1.09267e+00 9.51352e+01 205.666 -1.04359e+01 -5.01474e+00 0.00000e+00 0.00000e+00 1.14469e+02 205.666 1.93342e+01 205.666 0.9558 
1 1 1 -12 90  5  o 1  2.59182e+00 8.60159e-01 7.63321e+01 218.405 -3.82428e+00 -3.03166e+00 0.00000e+00 0.00000e+00 1.01168e+01 218.405 6.62152e+01 38.405  0.8905 
1 1 1 -12 90  6  o 18 8.76882e+00 9.40376e-01 1.57520e+02 39.258  2.49723e+01  2.04091e+01  0.00000e+00 0.00000e+00 1.65516e+02 39.258  7.99548e+00 39.258  0.9844 
1 1 1 -12 90  7  o 6  3.76642e+00 1.06862e+00 6.39657e+01 172.226 -5.42563e+00 7.40741e-01  0.00000e+00 0.00000e+00 6.32554e+01 172.226 7.10277e-01 352.226 0.9034 
1 1 1 -12 90  8  o 3  9.34315e+00 9.72504e-01 1.93290e+02 328.762 4.27760e+01  -2.59448e+01 0.00000e+00 0.00000e+00 1.52226e+02 328.762 4.10643e+01 148.762 0.9900 
1 1 1 -12 90  9  o 12 4.97700e+00 1.14402e+00 8.79419e+01 91.138  -2.13781e-01 1.07650e+01  0.00000e+00 0.00000e+00 8.89445e+01 91.138  1.00257e+00 91.138  0.9524 
1 1 1 -12 91  1  o 2  6.07801e+00 1.18537e+00 6.39335e+01 78.203  1.52433e+00  7.29869e+00  0.00000e+00 0.00000e+00 1.48362e+02 78.203  8.44290e+01 78.203  0.9303 
1 1 1 -12 91  2  o 10 5.89248e+00 1.19264e+00 6.99785e+01 280.254 1.39874e+00  -7.73208e+00 0.00000e+00 0.00000e+00 1.36539e+02 280.254 6.65609e+01 280.254 0.9340 
1 1 1 -12 91  3  o 12 4.44678e+00 1.08462e+00 5.42647e+01 241.049 -2.44606e+00 -4.42167e+00 0.00000e+00 0.00000e+00 9.49137e+01 241.049 4.06490e+01 241.049 0.8946 
1 1 1 -12 91  4  o 17 6.53067e+00 1.10660e+00 1.03158e+02 58.574  7.14150e+00  1.16878e+01  0.00000e+00 0.00000e+00 1.32461e+02 58.574  2.93035e+01 58.574  0.9628 
1 1 1 -12 91  5  o 8  6.66437e+00 1.08160e+00 1.13410e+02 196.934 -1.47331e+01 -4.48586e+00 0.00000e+00 0.00000e+00 1.27897e+02 196.934 1.44867e+01 196.934 0.9670 
1 1 1 -12 91  6  o 18 6.87797e+00 1.05926e+00 7.50697e+01 24.287  1.10193e+01  4.97249e+00  0.00000e+00 0.00000e+00 1.71383e+02 24.287  9.63138e+01 24.287  0.9577 
1 1 1 -12 91  7  o 15 5.38915e+00 1.14724e+00 1.18434e+02 312.201 9.46666e+00  -1.04400e+01 0.00000e+00 0.00000e+00 7.57379e+01 312.201 4.26959e+01 132.201 0.9638 
1 1 1 -12 91  8  o 9  6.03136e+00 1.24571e+00 1.37176e+02 152.918 -1.52053e+01 7.77495e+00  0.00000e+00 0.00000e+00 8.13767e+01 152.918 5.57996e+01 332.918 0.9703 
1 1 1 -12 91  9  o 1  2.80511e+00 8.96982e-01 2.77119e+01 177.091 -2.55218e+00 1.29665e-01  0.00000e+00 0.00000e+00 5.29674e+01 177.091 2.52555e+01 177.091 0.7709 
1 1 1 -12 92  1  o 19 5.93224e+00 1.21118e+00 1.25020e+02 186.977 -1.29344e+01 -1.58296e+00 0.00000e+00 0.00000e+00 8.89300e+01 186.977 3.60905e+01 6.977   0.9608 
1 1 1 -12 92  2  o 15 5.44745e+00 1.11782e+00 7.32115e+01 246.049 -3.06143e+00 -6.89194e+00 0.00000e+00 0.00000e+00 1.17071e+02 246.049 4.38591e+01 246.049 0.9311 
1 1 1 -12 92  3  o 17 4.95588e+00 1.01682e+00 8.07022e+01 16.388  8.41044e+00  2.47334e+00  0.00000e+00 0.00000e+00 9.41546e+01 16.388  1.34524e+01 16.388  0.9411 
1 1 1 -12 92  4  o 19 1.12859e+01 8.35166e-01 1.48265e+02 97.777  -5.84823e+00 4.28200e+01  0.00000e+00 0.00000e+00 2.69634e+02 97.777  1.21369e+02 97.777  0.9884 
1 1 1 -12 92  5  o 17 5.97874e+00 1.07038e+00 5.53371e+01 298.332 3.37261e+00  -6.25511e+00 0.00000e+00 0.00000e+00 1.52078e+02 298.332 9.67405e+01 298.332 0.9267 
1 1 1 -12 92  6  o 19 9.38282e+00 9.42341e-01 1.23994e+02 42.269  2.19348e+01  1.99375e+01  0.00000e+00 0.00000e+00 2.21002e+02 42.269  9.70074e+01 42.269  0.9830 
1 1 1 -12 92  7  o 2  4.22786e+00 1.12418e+00 3.93019e+01 190.534 -3.61224e+00 -6.71708e-01 0.00000e+00 0.00000e+00 9.49568e+01 190.534 5.56549e+01 190.534 0.8497 
1 1 1 -12 92  8  o 4  7.66782e+00 1.12384e+00 1.48551e+02 252.333 -8.22641e+00 -2.58275e+01 0.00000e+00 0.00000e+00 1.32413e+02 252.333 1.61383e+01 72.333  0.9814 
1 1 1 -12 92  9  o 3  3.24829e+00 9.54554e-01 4.92751e+01 118.407 -2.47716e+00 4.58008e+00  0.00000e+00 0.00000e+00 5.95237e+01 118.407 1.02487e+01 118.407 0.8980 
1 1 1 -12 93  1  o 6  5.36892e+00 1.21414e+00 7.41624e+01 296.315 3.25128e+00  -6.57405e+00 0.00000e+00 0.00000e+00 1.13026e+02 296.315 3.88641e+01 296.315 0.9291 
1 1 1 -12 93  2  o 5  4.60428e+00 1.09492e+00 7.47499e+01 19.208  6.60974e+00  2.30284e+00  0.00000e+00 0.00000e+00 8.50727e+01 19.208  1.03228e+01 19.208  0.9255 
1 1 1 -12 93  3  o 6  5.59070e+00 9.50795e-01 1.14175e+02 171.563 -1.43328e+01 2.12584e+00  0.00000e+00 0.00000e+00 8.80049e+01 171.563 2.61702e+01 351.563 0.9649 
1 1 1 -12 93  4  o 4  6.00481e+00 1.08990e+00 6.71135e+01 31.828  7.23908e+00  4.49339e+00  0.00000e+00 0.00000e+00 1.44153e+02 31.828  7.70399e+01 31.828  0.9393 
1 1 1 -12 93  5  o 8  2.83111e+00 8.61396e-01 7.64750e+01 123.275 -3.33208e+00 5.07745e+00  0.00000e+00 0.00000e+00 2.03163e+01 123.275 5.61587e+01 303.275 0.9135 
1 1 1 -12 93  6  o 16 4.93771e+00 1.12558e+00 1.16959e+02 306.126 7.67249e+00  -1.05118e+01 0.00000e+00 0.00000e+00 6.04485e+01 306.126 5.65103e+01 126.126 0.9608 
1 1 1 -12 93  7  o 17 6.86031e+00 1.11485e+00 1.12274e+02 166.137 -1.73625e+01 4.28481e+00  0.00000e+00 0.00000e+00 1.36774e+02 166.137 2.44994e+01 166.137 0.9716 
1 1 1 -12 93  8  o 17 2.69003e+00 8.79032e-01 4.05623e+01 178.077 -3.23379e+00 1.08556e-01  0.00000e+00 0.00000e+00 4.23787e+01 178.077 1.81640e+00 178.077 0.8260 
1 1 1 -12 93  9  o 16 2.44039e+00 8.24013e-01 4.66022e+01 58.732  2.09655e+00  3.45254e+00  0.00000e+00 0.00000e+00 3.21168e+01 58.732  1.44854e+01 238.732 0.8650 
1 1 1 -12 94  1  o 5  5.45350e+00 1.13361e+00 1.24008e+02 59.422  6.71514e+00  1.13647e+01  0.00000e+00 0.00000e+00 7.26810e+01 59.422  5.13271e+01 239.422 0.9613 
1 1 1 -12 94  2  o 5  7.09239e+00 1.02220e+00 1.38029e+02 186.320 -2.12657e+01 -2.35531e+00 0.00000e+00 0.00000e+00 1.21611e+02 186.320 1.64176e+01 6.320   0.9763 
1 1 1 -12 94  3  o 4  2.50353e+00 8.09026e-01 7.58429e+01 160.582 -4.79813e+00 1.69140e+00  0.00000e+00 0.00000e+00 8.15283e+00 160.582 6.76901e+01 340.582 0.8954 
1 1 1 -12 94  4  o 19 3.38047e+00 9.94303e-01 1.04480e+02 331.160 7.69034e+00  -4.23485e+00 0.00000e+00 0.00000e+00 1.46592e+01 331.160 8.98210e+01 151.160 0.9412 
1 1 1 -12 94  5  o 12 3.24051e+00 9.58318e-01 6.43191e+01 200.737 -5.28075e+00 -1.99935e+00 0.00000e+00 0.00000e+00 4.55930e+01 200.737 1.87261e+01 20.737  0.9065 
1 1 1 -12 94  6  o 15 6.63167e+00 1.05207e+00 8.07292e+01 28.172  1.11567e+01  5.97513e+00  0.00000e+00 0.00000e+00 1.57198e+02 28.172  7.64688e+01 28.172  0.9596 
1 1 1 -12 94  7  o 4  7.60998e+00 1.05594e+00 1.36000e+02 168.354 -2.68215e+01 5.52791e+00  0.00000e+00 0.00000e+00 1.43019e+02 168.354 7.01983e+00 168.354 0.9816 
1 1 1 -12 94  8  o 15 2.89012e+00 9.26424e-01 3.95966e+01 135.624 -2.60051e+00 2.54445e+00  0.00000e+00 0.00000e+00 5.18649e+01 135.624 1.22684e+01 135.624 0.8480 
1 1 1 -12 95  1  o 13 8.94849e+00 9.56223e-01 1.26308e+02 160.877 -2.52934e+01 8.76993e+00  0.00000e+00 0.00000e+00 2.02995e+02 160.877 7.66862e+01 160.877 0.9811 
1 1 1 -12 95  2  o 2  5.82981e+00 1.10828e+00 5.76721e+01 348.015 7.52781e+00  -1.59797e+00 0.00000e+00 0.00000e+00 1.46124e+02 348.015 8.84521e+01 348.015 0.9326 
1 1 1 -12 95  3  o 2  3.88726e+00 1.06166e+00 3.31450e+01 247.982 -1.12762e+00 -2.78837e+00 0.00000e+00 0.00000e+00 8.48910e+01 247.982 5.17460e+01 247.982 0.8106 
1 1 1 -12 95  4  o 6  4.34318e+00 1.06557e+00 8.75937e+01 164.856 -8.36557e+00 2.26401e+00  0.00000e+00 0.00000e+00 6.53059e+01 164.856 2.22878e+01 344.856 0.9404 
1 1 1 -12 95  5  o 2  9.61756e+00 8.92329e-01 1.63399e+02 321.924 3.68645e+01  -2.88807e+01 0.00000e+00 0.00000e+00 1.92505e+02 321.924 2.91059e+01 321.924 0.9893 
1 1 1 -12 95  6  o 19 9.37506e+00 9.52036e-01 1.62346e+02 168.515 -4.05381e+01 8.23684e+00  0.00000e+00 0.00000e+00 1.83800e+02 168.515 2.14544e+01 168.515 0.9878 
1 1 1 -12 95  7  o 10 4.87880e+00 1.13300e+00 1.13467e+02 45.081  9.04294e+00  9.06865e+00  0.00000e+00 0.00000e+00 6.14605e+01 45.081  5.20068e+01 225.081 0.9601 
1 1 1 -12 95  8  o 10 2.70425e+00 8.76417e-01 4.26936e+01 221.789 -2.98329e+00 -2.66635e+00 0.00000e+00 0.00000e+00 4.44331e+01 221.789 1.73953e+00 221.789 0.8636 
1 1 1 -12 96  1  o 11 6.32914e+00 1.06050e+00 9.69205e+01 240.686 -6.75326e+00 -1.20275e+01 0.00000e+00 0.00000e+00 1.31634e+02 240.686 3.47133e+01 240.686 0.9630 
1 1 1 -12 96  2  o 7  6.23412e+00 1.08070e+00 1.34941e+02 79.279  3.45338e+00  1.82397e+01  0.00000e+00 0.00000e+00 9.23049e+01 79.279  4.26363e+01 259.279 0.9727 
1 1 1 -12 96  3  o 15 3.44258e+00 9.75169e-01 2.30507e+01 103.957 -4.73103e-01 1.90355e+00  0.00000e+00 0.00000e+00 6.60849e+01 103.957 4.30342e+01 103.957 0.6913 
1 1 1 -12 96  4  o 17 3.51100e+00 1.01463e+00 6.11978e+01 193.080 -5.23728e+00 -1.21688e+00 0.00000e+00 0.00000e+00 5.72538e+01 193.080 3.94402e+00 13.080  0.9014 
1 1 1 -12 96  5  o 14 6.26609e+00 1.13694e+00 1.07901e+02 89.183  2.26251e-01  1.58677e+01  0.00000e+00 0.00000e+00 1.18927e+02 89.183  1.10268e+01 89.183  0.9680 
1 1 1 -12 96  6  o 4  4.02737e+00 1.08881e+00 9.27800e+01 132.316 -6.20245e+00 6.81268e+00  0.00000e+00 0.00000e+00 4.92916e+01 132.316 4.34884e+01 312.315 0.9441 
1 1 1 -12 96  7  o 18 2.69653e+00 8.72560e-01 3.55849e+01 311.342 2.13961e+00  -2.43183e+00 0.00000e+00 0.00000e+00 4.75918e+01 311.342 1.20069e+01 311.342 0.8262 
1 1 1 -12 96  8  o 8  2.84288e+00 8.64922e-01 6.62406e+01 102.127 -1.40537e+00 6.54031e+00  0.00000e+00 0.00000e+00 3.15132e+01 102.127 3.47275e+01 282.127 0.9219 
1 1 1 -12 97  1  o 7  5.06521e+00 1.08460e+00 8.63385e+01 154.512 -9.45400e+00 4.50680e+00  0.00000e+00 0.00000e+00 9.42371e+01 154.512 7.89855e+00 154.512 0.9510 
1 1 1 -12 97  2  o 1  2.65670e+00 8.70928e-01 2.96562e+01 244.971 -9.81753e-01 -2.10262e+00 0.00000e+00 0.00000e+00 4.43965e+01 244.971 1.47402e+01 244.971 0.7440 
1 1 1 -12 97  3  o 4  3.13848e+00 9.60312e-01 2.91213e+01 164.176 -2.44936e+00 6.94212e-01  0.00000e+00 0.00000e+00 6.13495e+01 164.176 3.22282e+01 164.176 0.7699 
1 1 1 -12 97  4  o 15 2.73741e+00 8.54351e-01 4.43936e+01 32.316  3.20376e+00  2.02659e+00  0.00000e+00 0.00000e+00 4.31751e+01 32.316  1.21850e+00 212.316 0.8550 
1 1 1 -12 97  5  o 12 3.07399e+00 9.34871e-01 3.89001e+01 226.319 -2.30554e+00 -2.41423e+00 0.00000e+00 0.00000e+00 5.67424e+01 226.319 1.78422e+01 226.319 0.8322 
1 1 1 -12 97  6  o 12 3.17253e+00 9.51960e-01 5.40767e+01 46.293  3.27509e+00  3.42634e+00  0.00000e+00 0.00000e+00 5.10444e+01 46.293  3.03229e+00 226.293 0.8870 
1 1 1 -12 97  7  o 9  4.82856e+00 1.16016e+00 7.78451e+01 57.906  5.13775e+00  8.19228e+00  0.00000e+00 0.00000e+00 9.27866e+01 57.906  1.49414e+01 57.906  0.9468 
1 1 1 -12 97  8  o 14 2.12418e+00 7.32530e-01 4.70200e+01 286.233 1.21530e+00  -4.17406e+00 0.00000e+00 0.00000e+00 2.23400e+01 286.233 2.46801e+01 106.233 0.8757 
1 1 1 -12 98  1  o 18 2.66604e+00 8.41426e-01 6.11790e+01 13.811  4.96301e+00  1.22008e+00  0.00000e+00 0.00000e+00 2.83351e+01 13.811  3.28439e+01 193.811 0.8959 
1 1 1 -12 98  2  o 9  3.22350e+00 9.26478e-01 5.66185e+01 183.234 -4.84397e+00 -2.73683e-01 0.00000e+00 0.00000e+00 5.08183e+01 183.234 5.80016e+00 3.234   0.8898 
1 1 1 -12 98  3  f 0  2.25919e+00 7.61648e-01 6.21003e+00 316.472 3.47571e-01  -3.30149e-01 0.00000e+00 0.00000e+00 1.34987e+01 316.472 7.28866e+00 316.472 0.2331 
1 1 1 -12 98  4  o 14 2.37439e+00 7.96254e-01 6.67756e+01 56.361  2.80573e+00  4.21668e+00  0.00000e+00 0.00000e+00 1.27031e+01 56.361  5.40725e+01 236.361 0.8949 
1 1 1 -12 98  5  o 1  5.04362e+00 1.00793e+00 1.00445e+02 70.062  4.91402e+00  1.35464e+01  0.00000e+00 0.00000e+00 8.14093e+01 70.062  1.90362e+01 250.062 0.9647 
1 1 1 -12 98  6  o 17 3.14567e+00 9.62730e-01 3.40502e+01 312.344 2.20444e+00  -2.41894e+00 0.00000e+00 0.00000e+00 6.32579e+01 312.344 2.92077e+01 312.344 0.8283 
1 1 1 -12 98  7  o 4  4.00542e+00 1.08747e+00 1.03166e+02 320.187 8.44699e+00  -7.04091e+00 0.00000e+00 0.00000e+00 3.93261e+01 320.187 6.38395e+01 140.187 0.9534 
1 1 1 -12 99  1  o 4  7.24614e+00 1.03210e+00 1.15429e+02 140.974 -1.69313e+01 1.37234e+01  0.00000e+00 0.00000e+00 1.49761e+02 140.974 3.43317e+01 140.974 0.9768 
1 1 1 -12 99  2  o 2  2.91383e+00 9.39703e-01 4.39208e+01 115.658 -1.52525e+00 3.17514e+00  0.00000e+00 0.00000e+00 4.79796e+01 115.658 4.05879e+00 115.658 0.8423 
1 1 1 -12 99  3  o 3  3.72649e+00 1.04722e+00 7.65228e+01 357.313 7.12524e+00  -3.34431e-01 0.00000e+00 0.00000e+00 5.27480e+01 357.313 2.37748e+01 177.313 0.9270 
1 1 1 -12 99  4  o 7  5.86420e+00 1.08821e+00 6.25555e+01 279.156 1.43870e+00  -8.92599e+00 0.00000e+00 0.00000e+00 1.44232e+02 279.156 8.16767e+01 279.156 0.9430 
1 1 1 -12 99  5  o 14 2.49276e+00 8.18809e-01 6.62522e+01 356.095 5.53956e+00  -3.78092e-01 0.00000e+00 0.00000e+00 1.80274e+01 356.095 4.82248e+01 176.095 0.9048 
1 1 1 -12 99  6  o 11 4.94825e+00 1.16413e+00 4.71358e+01 284.616 1.50680e+00  -5.77789e+00 0.00000e+00 0.00000e+00 1.21341e+02 284.616 7.42050e+01 284.616 0.9119 
1 1 1 -12 99  7  o 14 2.38057e+00 8.04513e-01 5.45153e+01 32.817  4.35852e+00  2.81070e+00  0.00000e+00 0.00000e+00 2.51896e+01 32.817  2.93257e+01 212.817 0.8975 
1 1 1 -12 100 1  f 0  5.76276e+00 1.11365e+00 7.67449e+01 213.764 -9.16387e+00 -6.12627e+00 0.00000e+00 0.00000e+00 1.29074e+02 213.764 5.23293e+01 213.764 0.9535 
1 1 1 -12 100 2  o 5  4.41004e+00 1.18222e+00 7.37797e+01 355.723 7.52970e+00  -5.63183e-01 0.00000e+00 0.00000e+00 7.99556e+01 355.723 6.17592e+00 355.723 0.9312 
1 1 1 -12 100 3  o 11 4.24448e+00 1.09373e+00 4.84254e+01 117.103 -2.43046e+00 4.74893e+00  0.00000e+00 0.00000e+00 9.45848e+01 117.103 4.61594e+01 117.103 0.9006 
1 1 1 -12 100 4  o 15 4.86986e+00 1.09098e+00 1.02150e+02 294.486 5.22815e+00  -1.14795e+01 0.00000e+00 0.00000e+00 7.25401e+01 294.486 2.96095e+01 114.486 0.9595 
1 1 1 -12 100 5  o 4  3.62230e+00 1.03388e+00 4.22361e+01 250.142 -1.48923e+00 -4.12350e+00 0.00000e+00 0.00000e+00 7.64150e+01 250.142 3.41789e+01 250.142 0.8768 
1 1 1 -12 100 6  o 7  2.25231e+00 7.70310e-01 2.01923e+01 301.141 9.30979e-01  -1.54080e+00 0.00000e+00 0.00000e+00 3.54696e+01 301.141 1.52773e+01 301.141 0.6621 
1 1 1 -12 100 7  o 12 2.84906e+00 9.08683e-01 7.16007e+01 260.884 -1.09460e+00 -6.82201e+00 0.00000e+00 0.00000e+00 2.66300e+01 260.884 4.49707e+01 80.884  0.9245 
1 1 1 -12 101 1  f 0  9.64062e+00 9.12700e-01 1.11820e+02 166.571 -3.30123e+01 7.88258e+00  0.00000e+00 0.00000e+00 2.43830e+02 166.571 1.32010e+02 166.571 0.9852 
1 1 1 -12 101 2  o 6  1.08475e+01 9.55001e-01 1.78963e+02 336.565 4.90812e+01  -2.12744e+01 0.00000e+00 0.00000e+00 2.23193e+02 336.565 4.42298e+01 336.565 0.9906 
1 1 1 -12 101 3  f 0  7.09750e+00 1.17575e+00 9.77198e+01 131.546 -1.06844e+01 1.20572e+01  0.00000e+00 0.00000e+00 1.59361e+02 131.546 6.16412e+01 131.546 0.9684 
1 1 1 -12 101 4  o 17 3.11527e+00 9.63856e-01 2.73238e+01 330.616 2.29862e+00  -1.29437e+00 0.00000e+00 0.00000e+00 6.34030e+01 330.616 3.60793e+01 330.616 0.7792 
1 1 1 -12 101 5  o 11 4.04245e+00 1.02956e+00 9.90953e+01 253.076 -3.30752e+00 -1.08698e+01 0.00000e+00 0.00000e+00 4.50728e+01 253.076 5.40225e+01 73.076  0.9549 
1 1 1 -12 101 6  o 19 2.94413e+00 9.34324e-01 2.25447e+01 68.173  8.43643e-01  2.10639e+00  0.00000e+00 0.00000e+00 5.84651e+01 68.173  3.59204e+01 68.173  0.7374 
1 1 1 -12 102 1  o 15 4.86233e+00 1.13452e+00 1.02272e+02 297.200 5.76149e+00  -1.12104e+01 0.00000e+00 0.00000e+00 7.23784e+01 297.200 2.98936e+01 117.201 0.9595 
1 1 1 -12 102 2  o 11 3.28951e+00 9.61801e-01 3.64087e+01 136.398 -2.65258e+00 2.52622e+00  0.00000e+00 0.00000e+00 6.81059e+01 136.398 3.16972e+01 136.398 0.8492 
1 1 1 -12 102 3  o 9  2.56694e+00 8.47419e-01 4.76408e+01 286.610 1.23336e+00  -4.13457e+00 0.00000e+00 0.00000e+00 3.63051e+01 286.610 1.13357e+01 106.610 0.8746 
1 1 1 -12 102 4  o 18 2.59989e+00 8.52954e-01 4.08361e+01 205.226 -3.41417e+00 -1.60848e+00 0.00000e+00 0.00000e+00 4.21483e+01 205.226 1.31226e+00 205.226 0.8542 
1 1 1 -12 102 5  o 6  6.57410e+00 1.13368e+00 9.48542e+01 176.233 -1.67501e+01 1.10291e+00  0.00000e+00 0.00000e+00 1.43173e+02 176.233 4.83185e+01 176.233 0.9697 
1 1 1 -12 102 6  o 14 5.72847e+00 1.12222e+00 7.59097e+01 13.176  1.16931e+01  2.73747e+00  0.00000e+00 0.00000e+00 1.28696e+02 13.176  5.27860e+01 13.176  0.9574 
1 1 1 -12 103 1  o 1  2.60467e+00 8.44381e-01 2.47795e+01 93.948  -1.64269e-01 2.38005e+00  0.00000e+00 0.00000e+00 4.85239e+01 93.948  2.37444e+01 93.948  0.7520 
1 1 1 -12 103 2  o 2  2.81828e+00 8.75022e-01 4.77265e+01 286.141 1.29805e+00  -4.48515e+00 0.00000e+00 0.00000e+00 4.55769e+01 286.141 2.14956e+00 106.141 0.8851 
1 1 1 -12 103 3  f 0  2.50832e+00 8.35172e-01 2.51603e+01 194.510 -2.14453e+00 -5.55003e-01 0.00000e+00 0.00000e+00 4.32979e+01 194.510 1.81376e+01 194.510 0.7301 
1 1 1 -12 103 4  o 11 2.88727e+00 9.19487e-01 3.37393e+01 226.952 -2.29876e+00 -2.46101e+00 0.00000e+00 0.00000e+00 5.61961e+01 226.952 2.24567e+01 226.952 0.8339 
1 1 1 -12 103 5  o 18 2.55590e+00 8.44543e-01 4.68125e+01 128.914 -2.74253e+00 3.39721e+00  0.00000e+00 0.00000e+00 3.67840e+01 128.914 1.00285e+01 308.914 0.8763 
1 1 1 -12 104 1  o 8  3.18394e+00 9.51740e-01 6.35286e+01 232.128 -3.83014e+00 -4.92497e+00 0.00000e+00 0.00000e+00 4.55829e+01 232.128 1.79457e+01 52.128  0.9159 
1 1 1 -12 104 2  o 6  2.83729e+00 8.86291e-01 5.60916e+01 63.484  2.46228e+00  4.93520e+00  0.00000e+00 0.00000e+00 3.98307e+01 63.484  1.62610e+01 243.484 0.9041 
1 1 1 -12 104 3  o 5  3.17346e+00 9.46215e-01 4.30584e+01 185.636 -4.55149e+00 -4.49190e-01 0.00000e+00 0.00000e+00 6.15933e+01 185.636 1.85349e+01 185.636 0.8825 
1 1 1 -12 104 4  o 2  2.63209e+00 8.38275e-01 5.32139e+01 16.490  5.19052e+00  1.53647e+00  0.00000e+00 0.00000e+00 3.54613e+01 16.490  1.77526e+01 196.489 0.9022 
1 1 1 -12 104 5  o 18 2.46886e+00 8.14933e-01 5.30007e+01 56.844  3.05019e+00  4.66899e+00  0.00000e+00 0.00000e+00 3.03961e+01 56.844  2.26047e+01 236.844 0.9052 
1 1 1 -12 105 1  o 15 4.03228e+00 1.06304e+00 8.83663e+01 116.340 -4.64200e+00 9.37580e+00  0.00000e+00 0.00000e+00 5.50587e+01 116.340 3.33077e+01 296.340 0.9509 
1 1 1 -12 105 2  o 18 3.09348e+00 9.62051e-01 8.74205e+01 306.918 5.37017e+00  -7.14761e+00 0.00000e+00 0.00000e+00 2.15495e+01 306.918 6.58710e+01 126.918 0.9423 
1 1 1 -12 105 3  o 3  2.81154e+00 8.80056e-01 7.41787e+01 48.681  4.82236e+00  5.48558e+00  0.00000e+00 0.00000e+00 2.33769e+01 48.681  5.08018e+01 228.681 0.9288 
1 1 1 -12 105 4  o 16 3.74309e+00 1.05133e+00 8.57373e+01 172.846 -1.00477e+01 1.26120e+00  0.00000e+00 0.00000e+00 4.69134e+01 172.846 3.88239e+01 352.846 0.9493 
1 1 1 -12 106 1  o 10 3.96779e+00 1.08112e+00 8.36127e+01 28.284  8.12474e+00  4.37173e+00  0.00000e+00 0.00000e+00 5.64698e+01 28.284  2.71429e+01 208.284 0.9441 
1 1 1 -12 106 2  o 9  3.10056e+00 9.49123e-01 6.97690e+01 294.581 3.04640e+00  -6.65975e+00 0.00000e+00 0.00000e+00 3.78756e+01 294.581 3.18935e+01 114.581 0.9290 
1 1 1 -12 106 3  o 16 2.64012e+00 8.68648e-01 2.42537e+01 78.447  5.09753e-01  2.49366e+00  0.00000e+00 0.00000e+00 5.16544e+01 78.447  2.74007e+01 78.447  0.7698 
1 1 1 -12 107 1  o 7  5.51403e+00 1.03983e+00 1.05938e+02 88.275  5.38754e-01  1.78915e+01  0.00000e+00 0.00000e+00 9.43480e+01 88.275  1.15899e+01 268.275 0.9717 
1 1 1 -12 107 2  o 3  5.29574e+00 1.14028e+00 8.10034e+01 267.279 -5.54310e-01 -1.16633e+01 0.00000e+00 0.00000e+00 1.08180e+02 267.279 2.71764e+01 267.279 0.9562 
1 1 1 -12 107 3  o 6  1.95716e+00 6.79841e-01 3.14565e+01 348.103 3.01407e+00  -6.34996e-01 0.00000e+00 0.00000e+00 2.81543e+01 348.103 3.30224e+00 168.103 0.8157 
1 1 1 -12 108 1  o 6  4.83473e+00 1.16894e+00 1.01901e+02 254.309 -3.61062e+00 -1.28527e+01 0.00000e+00 0.00000e+00 7.18760e+01 254.309 3.00252e+01 74.309  0.9618 
1 1 1 -12 108 2  o 1  2.75747e+00 8.69813e-01 3.14315e+01 106.231 -1.08305e+00 3.72042e+00  0.00000e+00 0.00000e+00 5.69906e+01 106.231 2.55591e+01 106.231 0.8585 
1 1 1 -12 109 1  o 6  3.01369e+00 9.45985e-01 8.07920e+01 353.802 7.89675e+00  -8.57605e-01 0.00000e+00 0.00000e+00 2.44546e+01 353.802 5.63374e+01 173.802 0.9348 
1 1 1 -11 0   1  o 1  2.69995e+01 1.08234e+00 2.85964e+02 0.000   1.05385e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.37546e+02 0.000   4.51581e+02 0.000   1.0000 
1 1 1 -11 0   2  o 10 1.05450e+01 1.49701e+00 4.17412e+02 180.000 -5.97651e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.78879e+01 0.000   4.35300e+02 0.000   1.0000 
1 1 1 -11 0   3  o 5  2.87747e+01 1.11578e+00 5.36291e+02 180.000 -2.31030e+01 -0.00000e+00 0.00000e+00 0.00000e+00 5.53279e+02 180.000 1.69877e+01 180.000 1.0000 
1 1 1 -11 0   4  o 6  2.89548e+01 1.13430e+00 4.45756e+02 0.000   2.05401e+01  0.00000e+00  0.00000e+00 0.00000e+00 6.49912e+02 0.000   2.04155e+02 0.000   1.0000 
1 1 1 -11 0   5  o 3  3.83935e+01 1.29107e+00 7.33002e+02 180.000 -4.53084e+01 -0.00000e+00 0.00000e+00 0.00000e+00 7.18793e+02 180.000 1.42088e+01 0.000   1.0000 
1 1 1 -11 0   6  o 8  2.52119e+01 1.19402e+00 4.35495e+02 0.000   2.09993e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.17112e+02 0.000   8.16172e+01 0.000   1.0000 
1 1 1 -11 0   7  o 12 3.96904e+01 1.33849e+00 7.35760e+02 180.000 -6.77311e+01 0.00000e+00  0.00000e+00 0.00000e+00 7.62644e+02 180.000 2.68847e+01 180.000 1.0000 
1 1 1 -11 0   8  o 13 5.67795e+00 2.50528e+00 2.30716e+02 180.000 -2.89352e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.78630e+01 0.000   2.48579e+02 0.000   0.9939 
1 1 1 -11 0   9  o 6  1.27750e+01 1.35613e+00 1.12912e+02 0.000   4.75237e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.68404e+02 0.000   2.55491e+02 0.000   0.9999 
1 1 1 -11 0   10 f 0  3.55136e+00 2.05662e+00 1.96219e+02 0.000   2.33818e+00  0.00000e+00  0.00000e+00 0.00000e+00 6.50008e+01 180.000 2.61220e+02 180.000 0.9815 
1 1 1 -11 0   11 o 14 5.16180e+00 2.25251e+00 2.01101e+02 0.000   3.61657e+00  0.00000e+00  0.00000e+00 0.00000e+00 7.28377e+00 180.000 2.08384e+02 180.000 0.9986 
1 1 1 -11 0   12 o 1  3.75361e+00 2.06453e+00 1.18656e+02 0.000   1.91390e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.63237e+01 0.000   1.02332e+02 180.000 0.9574 
1 1 1 -11 0   13 o 16 2.12254e+01 1.52838e+00 3.89810e+02 180.000 -4.96173e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.06444e+02 180.000 1.66339e+01 180.000 1.0000 
1 1 1 -11 0   14 o 15 2.11956e+01 1.56044e+00 3.48699e+02 0.000   4.78161e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.45430e+02 0.000   9.67311e+01 0.000   1.0000 
1 1 1 -11 0   15 o 5  1.83900e+00 1.28458e+00 6.87975e+01 180.000 -1.03232e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.54812e+01 0.000   8.42787e+01 0.000   0.7748 
1 1 1 -11 0   16 o 19 2.99009e+00 1.81185e+00 5.97776e+00 0.000   1.21567e-01  0.00000e+00  0.00000e+00 0.00000e+00 7.53771e+00 0.000   1.55995e+00 0.000   0.1210 
1 1 1 -11 0   17 o 11 2.12676e+00 1.45793e+00 1.15102e+01 180.000 -2.28367e-01 -0.00000e+00 0.00000e+00 0.00000e+00 6.30244e+00 180.000 5.20771e+00 0.000   0.2245 
1 1 1 -11 0   18 o 9  5.38878e+00 2.36844e+00 9.55494e+01 180.000 -3.25391e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.04608e+02 180.000 9.05854e+00 180.000 0.9970 
1 1 1 -11 1   1  f 0  2.09492e+01 7.31366e-01 2.81208e+02 33.164  1.34972e+01  8.82011e+00  0.00000e+00 0.00000e+00 4.87907e+02 33.164  2.06699e+02 33.164  0.9685 
1 1 1 -11 1   2  o 15 2.72489e+01 7.71933e-01 4.12683e+02 216.073 -2.53658e+01 -1.84789e+01 0.00000e+00 0.00000e+00 6.03142e+02 216.073 1.90459e+02 216.073 0.9839 
1 1 1 -11 1   3  o 18 3.37206e+01 8.41647e-01 6.20807e+02 340.221 5.86942e+01  -2.11071e+01 0.00000e+00 0.00000e+00 6.45765e+02 340.221 2.49580e+01 340.221 0.9920 
1 1 1 -11 1   4  o 10 2.45989e+01 7.80223e-01 4.32387e+02 135.804 -2.43208e+01 2.36477e+01  0.00000e+00 0.00000e+00 4.84628e+02 135.804 5.22410e+01 135.804 0.9851 
1 1 1 -11 1   5  o 4  1.64581e+01 8.48266e-01 3.14076e+02 55.137  9.58003e+00  1.37514e+01  0.00000e+00 0.00000e+00 2.89400e+02 55.137  2.46765e+01 235.137 0.9697 
1 1 1 -11 1   6  o 6  8.49868e+00 1.35775e+00 1.74217e+02 11.202  5.13579e+00  1.01712e+00  0.00000e+00 0.00000e+00 1.14328e+02 11.202  5.98893e+01 191.202 0.8986 
1 1 1 -11 1   7  o 3  2.38100e+01 8.28920e-01 4.90318e+02 276.158 5.91735e+00  -5.48419e+01 0.00000e+00 0.00000e+00 4.00380e+02 276.158 8.99379e+01 96.158  0.9909 
1 1 1 -11 1   8  o 3  2.13206e+01 8.46131e-01 2.58216e+02 164.980 -2.94267e+01 7.89568e+00  0.00000e+00 0.00000e+00 5.32648e+02 164.980 2.74432e+02 164.980 0.9834 
1 1 1 -11 1   9  o 19 1.05109e+01 1.09651e+00 2.06915e+02 348.737 1.35776e+01  -2.70391e+00 0.00000e+00 0.00000e+00 1.74572e+02 348.737 3.23424e+01 168.737 0.9632 
1 1 1 -11 1   10 o 2  9.67236e+00 1.06131e+00 1.84725e+02 113.195 -5.39599e+00 1.25930e+01  0.00000e+00 0.00000e+00 1.65825e+02 113.195 1.88992e+01 293.195 0.9628 
1 1 1 -11 1   11 o 17 1.07805e+01 1.00106e+00 1.82412e+02 92.950  -8.82579e-01 1.71280e+01  0.00000e+00 0.00000e+00 2.10962e+02 92.950  2.85499e+01 92.950  0.9704 
1 1 1 -11 1   12 o 16 2.09436e+01 8.32934e-01 3.66244e+02 251.269 -2.75623e+01 -8.12870e+01 0.00000e+00 0.00000e+00 4.15792e+02 251.269 4.95476e+01 251.269 0.9942 
1 1 1 -11 1   13 o 19 8.08740e+00 1.04924e+00 1.10490e+02 40.479  8.27681e+00  7.06385e+00  0.00000e+00 0.00000e+00 1.78606e+02 40.479  6.81160e+01 40.479  0.9529 
1 1 1 -11 1   14 o 3  5.88120e+00 1.22367e+00 1.28265e+02 23.285  8.39596e+00  3.61325e+00  0.00000e+00 0.00000e+00 7.96559e+01 23.285  4.86094e+01 203.285 0.9436 
1 1 1 -11 1   15 o 12 5.95492e+00 1.22246e+00 7.70252e+01 156.626 -5.70496e+00 2.46572e+00  0.00000e+00 0.00000e+00 1.26978e+02 156.626 4.99532e+01 156.626 0.9156 
1 1 1 -11 1   16 o 12 5.78745e+00 1.25826e+00 8.18285e+01 287.781 1.99675e+00  -6.22611e+00 0.00000e+00 0.00000e+00 1.17117e+02 287.781 3.52881e+01 287.781 0.9200 
1 1 1 -11 1   17 o 9  5.01720e+00 1.24612e+00 7.91551e+01 36.416  5.09387e+00  3.75772e+00  0.00000e+00 0.00000e+00 9.25400e+01 36.416  1.33850e+01 36.416  0.9172 
1 1 1 -11 1   18 o 4  4.06332e+00 1.23582e+00 7.61905e+01 168.022 -5.47399e+00 1.16136e+00  0.00000e+00 0.00000e+00 6.08930e+01 168.022 1.52975e+01 348.022 0.9056 
1 1 1 -11 2   1  f 0  1.74230e+01 7.54335e-01 3.63853e+02 170.952 -1.71024e+01 2.72348e+00  0.00000e+00 0.00000e+00 2.77262e+02 170.952 8.65913e+01 350.952 0.9707 
1 1 1 -11 2   2  o 5  2.32639e+01 7.55157e-01 3.04814e+02 221.594 -1.48183e+01 -1.31535e+01 0.00000e+00 0.00000e+00 5.54070e+02 221.594 2.49256e+02 221.594 0.9744 
1 1 1 -11 2   3  o 19 9.27881e+00 1.05768e+00 7.76047e+01 228.894 -1.37843e+00 -1.57978e+00 0.00000e+00 0.00000e+00 1.72911e+02 228.894 9.53066e+01 228.894 0.7130 
1 1 1 -11 2   4  o 8  2.14359e+01 7.55193e-01 2.62296e+02 122.100 -9.54949e+00 1.52234e+01  0.00000e+00 0.00000e+00 5.25946e+02 122.100 2.63650e+02 122.100 0.9718 
1 1 1 -11 2   5  o 17 4.20608e+01 9.69394e-01 6.82199e+02 42.827  6.73121e+01  6.23901e+01  0.00000e+00 0.00000e+00 8.99571e+02 42.827  2.17372e+02 42.827  0.9945 
1 1 1 -11 2   6  o 16 1.71481e+01 8.70976e-01 3.80511e+02 184.928 -2.47803e+01 -2.13673e+00 0.00000e+00 0.00000e+00 2.54249e+02 184.928 1.26263e+02 4.928   0.9797 
1 1 1 -11 2   7  o 18 6.45569e+00 1.45816e+00 6.16653e+01 351.150 1.64695e+00  -2.56426e-01 0.00000e+00 0.00000e+00 9.30318e+01 351.150 3.13665e+01 351.150 0.6347 
1 1 1 -11 2   8  o 11 1.43278e+01 9.59621e-01 2.70476e+02 160.421 -1.97807e+01 7.03530e+00  0.00000e+00 0.00000e+00 2.56911e+02 160.421 1.35649e+01 340.421 0.9759 
1 1 1 -11 2   9  f 0  1.56936e+01 8.96754e-01 3.01570e+02 232.804 -2.01632e+01 -2.65678e+01 0.00000e+00 0.00000e+00 2.80861e+02 232.804 2.07095e+01 52.804  0.9849 
1 1 1 -11 2   10 o 12 7.00705e+00 1.28204e+00 1.57102e+02 309.821 5.02950e+00  -6.03214e+00 0.00000e+00 0.00000e+00 8.92515e+01 309.821 6.78510e+01 129.821 0.9340 
1 1 1 -11 2   11 f 0  8.24457e+00 1.20212e+00 1.69004e+02 68.354  4.17864e+00  1.05294e+01  0.00000e+00 0.00000e+00 1.26995e+02 68.354  4.20090e+01 248.354 0.9548 
1 1 1 -11 2   12 o 16 1.02945e+01 9.91454e-01 2.40256e+02 243.386 -1.16871e+01 -2.33241e+01 0.00000e+00 0.00000e+00 1.38913e+02 243.386 1.01343e+02 63.386  0.9806 
1 1 1 -11 2   13 o 5  3.60939e+00 1.02462e+00 8.63013e+01 142.680 -3.05201e+00 2.32667e+00  0.00000e+00 0.00000e+00 2.97361e+01 142.680 5.65652e+01 322.680 0.8570 
1 1 1 -11 2   14 o 12 8.95602e+00 1.00812e+00 1.28355e+02 190.730 -1.53620e+01 -2.91093e+00 0.00000e+00 0.00000e+00 1.96281e+02 190.730 6.79262e+01 190.730 0.9675 
1 1 1 -11 2   15 o 6  7.22749e+00 1.06599e+00 9.85707e+01 320.122 8.14704e+00  -6.80663e+00 0.00000e+00 0.00000e+00 1.58788e+02 320.122 6.02172e+01 320.122 0.9517 
1 1 1 -11 2   16 f 0  9.77696e+00 9.68352e-01 1.41319e+02 277.757 3.08899e+00  -2.26754e+01 0.00000e+00 0.00000e+00 2.15922e+02 277.757 7.46031e+01 277.757 0.9779 
1 1 1 -11 2   17 o 12 3.57756e+00 1.09844e+00 4.22827e+01 352.860 2.66678e+00  -3.34047e-01 0.00000e+00 0.00000e+00 6.23596e+01 352.860 2.00769e+01 352.860 0.7840 
1 1 1 -11 2   18 o 19 7.59139e+00 1.35767e+00 1.32453e+02 185.220 -1.63580e+01 -1.49452e+00 0.00000e+00 0.00000e+00 1.41609e+02 185.220 9.15528e+00 185.220 0.9691 
1 1 1 -11 3   1  o 4  3.35967e+01 8.31164e-01 5.95824e+02 291.325 1.97574e+01  -5.06101e+01 0.00000e+00 0.00000e+00 6.65982e+02 291.325 7.01587e+01 291.325 0.9908 
1 1 1 -11 3   2  o 8  3.26872e+01 8.28609e-01 5.50434e+02 328.173 4.24429e+01  -2.63432e+01 0.00000e+00 0.00000e+00 6.75549e+02 328.173 1.25115e+02 328.173 0.9899 
1 1 1 -11 3   3  o 9  1.94945e+01 7.58493e-01 4.47399e+02 25.005  2.37181e+01  1.10625e+01  0.00000e+00 0.00000e+00 2.76521e+02 25.005  1.70878e+02 205.005 0.9807 
1 1 1 -11 3   4  o 6  1.52742e+01 8.46735e-01 2.89067e+02 358.023 1.39758e+01  -4.82297e-01 0.00000e+00 0.00000e+00 2.67847e+02 358.023 2.12200e+01 178.023 0.9636 
1 1 1 -11 3   5  o 6  6.74672e+00 1.42150e+00 2.48633e+02 276.261 5.49146e-01  -5.00502e+00 0.00000e+00 0.00000e+00 2.05127e+01 96.261  2.69146e+02 96.261  0.8942 
1 1 1 -11 3   6  o 17 1.92667e+01 8.47414e-01 2.45904e+02 330.332 1.57343e+01  -8.96285e+00 0.00000e+00 0.00000e+00 4.61665e+02 330.332 2.15761e+02 330.332 0.9720 
1 1 1 -11 3   7  o 17 6.16845e+00 1.43505e+00 1.71674e+02 233.355 -2.65994e+00 -3.57581e+00 0.00000e+00 0.00000e+00 3.30291e+01 233.355 1.38645e+02 53.356  0.8790 
1 1 1 -11 3   8  o 4  1.68144e+01 8.80675e-01 2.52405e+02 288.921 7.56579e+00  -2.20717e+01 0.00000e+00 0.00000e+00 3.68055e+02 288.921 1.15650e+02 288.921 0.9783 
1 1 1 -11 3   9  o 9  9.44440e+00 1.19533e+00 1.20359e+02 26.093  6.64198e+00  3.25292e+00  0.00000e+00 0.00000e+00 2.10504e+02 26.093  9.01449e+01 26.093  0.9297 
1 1 1 -11 3   10 o 5  4.23039e+00 1.19924e+00 1.65250e+02 224.210 -3.67576e+00 -3.57582e+00 0.00000e+00 0.00000e+00 2.25238e+01 44.210  1.87774e+02 44.210  0.8963 
1 1 1 -11 3   11 o 8  4.49038e+00 1.16331e+00 5.45278e+01 313.199 1.38186e+00  -1.47160e+00 0.00000e+00 0.00000e+00 6.38045e+01 313.199 9.27674e+00 313.199 0.7008 
1 1 1 -11 3   12 o 13 8.07032e+00 1.18127e+00 1.65266e+02 230.321 -8.30293e+00 -1.00085e+01 0.00000e+00 0.00000e+00 1.25949e+02 230.321 3.93172e+01 50.321  0.9607 
1 1 1 -11 3   13 o 10 9.84203e+00 9.01242e-01 1.10382e+02 354.726 1.41011e+01  -1.30171e+00 0.00000e+00 0.00000e+00 2.45544e+02 354.726 1.35162e+02 354.726 0.9640 
1 1 1 -11 3   14 o 17 3.01351e+00 9.58147e-01 7.37963e+01 292.193 1.17175e+00  -2.87227e+00 0.00000e+00 0.00000e+00 1.84762e+01 292.193 5.53201e+01 112.193 0.8173 
1 1 1 -11 3   15 o 9  4.54368e+00 1.19679e+00 1.32570e+02 243.775 -3.66385e+00 -7.43778e+00 0.00000e+00 0.00000e+00 2.68300e+01 243.775 1.05740e+02 63.775  0.9376 
1 1 1 -11 3   16 o 16 6.13423e+00 1.20026e+00 8.45987e+01 118.617 -3.56202e+00 6.52861e+00  0.00000e+00 0.00000e+00 1.28585e+02 118.617 4.39865e+01 118.617 0.9301 
1 1 1 -11 3   17 o 19 3.59987e+00 1.02901e+00 7.11026e+01 251.434 -1.52235e+00 -4.53252e+00 0.00000e+00 0.00000e+00 4.81737e+01 251.434 2.29289e+01 71.434  0.8881 
1 1 1 -11 3   18 o 19 3.72828e+00 1.15803e+00 7.37322e+01 163.265 -5.19260e+00 1.56126e+00  0.00000e+00 0.00000e+00 5.15954e+01 163.265 2.21369e+01 343.265 0.9023 
1 1 1 -11 4   1  o 3  1.20924e+01 8.79611e-01 1.58229e+02 277.519 6.76454e-01  -5.12507e+00 0.00000e+00 0.00000e+00 2.53028e+02 277.519 9.47990e+01 277.519 0.8972 
1 1 1 -11 4   2  o 14 1.95941e+01 7.56469e-01 1.56790e+02 333.456 7.67402e+00  -3.83353e+00 0.00000e+00 0.00000e+00 5.40862e+02 333.456 3.84072e+02 333.456 0.9398 
1 1 1 -11 4   3  o 6  2.06124e+01 7.60115e-01 4.54354e+02 226.004 -1.95089e+01 -2.02050e+01 0.00000e+00 0.00000e+00 3.12107e+02 226.004 1.42246e+02 46.004  0.9820 
1 1 1 -11 4   4  o 15 4.08494e+01 9.37469e-01 6.81985e+02 4.895   8.70350e+01  7.45325e+00  0.00000e+00 0.00000e+00 8.54876e+02 4.895   1.72891e+02 4.895   0.9943 
1 1 1 -11 4   5  f 0  1.99110e+01 8.03654e-01 4.59444e+02 50.322  1.90081e+01  2.29136e+01  0.00000e+00 0.00000e+00 2.80692e+02 50.322  1.78752e+02 230.322 0.9831 
1 1 1 -11 4   6  o 4  8.20096e+00 1.35002e+00 1.49559e+02 305.036 2.49174e+00  -3.55385e+00 0.00000e+00 0.00000e+00 1.21704e+02 305.036 2.78552e+01 125.036 0.8754 
1 1 1 -11 4   7  o 17 1.07778e+01 1.15567e+00 1.74052e+02 45.475  5.87213e+00  5.97037e+00  0.00000e+00 0.00000e+00 2.07699e+02 45.475  3.36464e+01 45.475  0.9382 
1 1 1 -11 4   8  o 2  2.49537e+01 8.20637e-01 4.86984e+02 182.377 -6.74404e+01 -2.79989e+00 0.00000e+00 0.00000e+00 4.47208e+02 182.377 3.97751e+01 2.377   0.9926 
1 1 1 -11 4   9  o 18 1.89159e+01 8.20029e-01 3.38618e+02 281.857 9.43476e+00  -4.49394e+01 0.00000e+00 0.00000e+00 3.66350e+02 281.857 2.77323e+01 281.857 0.9891 
1 1 1 -11 4   10 o 15 1.15482e+01 9.65933e-01 2.01052e+02 84.161  1.86214e+00  1.82089e+01  0.00000e+00 0.00000e+00 2.21606e+02 84.161  2.05534e+01 84.161  0.9723 
1 1 1 -11 4   11 o 3  1.45074e+01 8.63648e-01 3.29958e+02 264.780 -3.96311e+00 -4.33768e+01 0.00000e+00 0.00000e+00 2.09247e+02 264.780 1.20711e+02 84.780  0.9885 
1 1 1 -11 4   12 o 9  6.38539e+00 1.26917e+00 1.01063e+02 33.410  5.28010e+00  3.48296e+00  0.00000e+00 0.00000e+00 1.18890e+02 33.410  1.78270e+01 33.410  0.9171 
1 1 1 -11 4   13 o 1  7.25895e+00 1.11037e+00 1.29311e+02 295.016 4.69086e+00  -1.00524e+01 0.00000e+00 0.00000e+00 1.30417e+02 295.016 1.10675e+00 295.016 0.9538 
1 1 1 -11 4   14 o 5  5.82527e+00 1.21768e+00 6.52066e+01 4.636   4.60145e+00  3.73150e-01  0.00000e+00 0.00000e+00 1.27651e+02 4.636   6.24442e+01 4.636   0.8837 
1 1 1 -11 4   15 o 4  4.08290e+00 1.14326e+00 9.64195e+01 132.671 -3.79477e+00 4.11649e+00  0.00000e+00 0.00000e+00 4.19310e+01 132.671 5.44885e+01 312.671 0.9056 
1 1 1 -11 4   16 o 12 4.82204e+00 1.24683e+00 6.51016e+01 264.426 -4.24001e-01 -4.34440e+00 0.00000e+00 0.00000e+00 9.27691e+01 264.426 2.76676e+01 264.426 0.8762 
1 1 1 -11 4   17 o 12 5.35750e+00 1.22890e+00 9.13218e+01 229.024 -5.17795e+00 -5.96151e+00 0.00000e+00 0.00000e+00 9.54430e+01 229.024 4.12123e+00 229.024 0.9343 
1 1 1 -11 4   18 o 19 7.94646e+00 1.30842e+00 1.57467e+02 90.799  -3.02717e-01 2.17166e+01  0.00000e+00 0.00000e+00 1.31669e+02 90.799  2.57981e+01 270.799 0.9767 
1 1 1 -11 5   1  o 9  1.56823e+01 7.63480e-01 4.03485e+02 133.696 -1.19224e+01 1.24780e+01  0.00000e+00 0.00000e+00 1.73499e+02 133.696 2.29986e+02 313.696 0.9706 
1 1 1 -11 5   2  o 2  1.78839e+01 7.58079e-01 3.75117e+02 227.629 -1.26169e+01 -1.38313e+01 0.00000e+00 0.00000e+00 2.84095e+02 227.629 9.10214e+01 47.629  0.9729 
1 1 1 -11 5   3  o 8  2.97300e+01 8.01402e-01 4.46275e+02 6.558   3.93639e+01  4.52565e+00  0.00000e+00 0.00000e+00 6.65133e+02 6.558   2.18858e+02 6.558   0.9873 
1 1 1 -11 5   4  o 7  1.59376e+01 8.23484e-01 2.89007e+02 46.399  1.00753e+01  1.05797e+01  0.00000e+00 0.00000e+00 2.93040e+02 46.399  4.03283e+00 46.399  0.9651 
1 1 1 -11 5   5  o 9  1.76251e+01 8.31201e-01 2.27688e+02 179.013 -1.30161e+01 2.24140e-01  0.00000e+00 0.00000e+00 4.12626e+02 179.013 1.84937e+02 179.013 0.9608 
1 1 1 -11 5   6  o 14 1.08244e+01 1.16834e+00 2.06793e+02 160.384 -8.42029e+00 3.00093e+00  0.00000e+00 0.00000e+00 1.78580e+02 160.384 2.82128e+01 340.384 0.9423 
1 1 1 -11 5   7  o 6  2.11649e+01 8.37343e-01 4.76242e+02 30.083  4.11200e+01  2.38203e+01  0.00000e+00 0.00000e+00 3.14302e+02 30.083  1.61940e+02 210.083 0.9894 
1 1 1 -11 5   8  o 6  3.12876e+01 8.57064e-01 6.52858e+02 238.943 -5.81322e+01 -9.65311e+01 0.00000e+00 0.00000e+00 5.21970e+02 238.943 1.30888e+02 58.943  0.9956 
1 1 1 -11 5   9  o 2  5.30114e+00 1.32049e+00 1.47445e+02 230.467 -3.11484e+00 -3.77421e+00 0.00000e+00 0.00000e+00 3.05037e+01 230.467 1.16942e+02 50.467  0.8909 
1 1 1 -11 5   10 o 16 8.30939e+00 1.16653e+00 1.68994e+02 195.753 -1.00154e+01 -2.82517e+00 0.00000e+00 0.00000e+00 1.28358e+02 195.753 4.06354e+01 15.753  0.9507 
1 1 1 -11 5   11 o 17 9.92005e+00 1.06425e+00 1.25801e+02 166.479 -1.13489e+01 2.72908e+00  0.00000e+00 0.00000e+00 2.30852e+02 166.479 1.05051e+02 166.479 0.9562 
1 1 1 -11 5   12 o 9  8.28757e+00 1.07005e+00 1.97288e+02 18.582  1.66124e+01  5.58501e+00  0.00000e+00 0.00000e+00 1.04964e+02 18.582  9.23231e+01 198.582 0.9710 
1 1 1 -11 5   13 o 1  6.61974e+00 1.16900e+00 1.51005e+02 40.000  8.78793e+00  7.37401e+00  0.00000e+00 0.00000e+00 8.62376e+01 40.000  6.47675e+01 220.000 0.9554 
1 1 1 -11 5   14 o 19 7.99123e+00 1.06554e+00 1.52754e+02 192.651 -1.57162e+01 -3.52756e+00 0.00000e+00 0.00000e+00 1.37192e+02 192.651 1.55624e+01 12.651  0.9684 
1 1 1 -11 5   15 o 7  4.10401e+00 1.00098e+00 9.59931e+01 217.677 -4.82537e+00 -3.72633e+00 0.00000e+00 0.00000e+00 4.43302e+01 217.677 5.16628e+01 37.677  0.9138 
1 1 1 -11 5   16 o 4  4.51387e+00 1.19028e+00 7.94355e+01 329.045 4.43352e+00  -2.65920e+00 0.00000e+00 0.00000e+00 7.18780e+01 329.045 7.55750e+00 149.045 0.8972 
1 1 1 -11 5   17 o 5  2.28793e+00 7.96630e-01 2.13497e+01 97.481  -1.39364e-01 1.06122e+00  0.00000e+00 0.00000e+00 1.88350e+01 97.481  2.51471e+00 277.481 0.4708 
1 1 1 -11 5   18 o 12 4.64247e+00 1.28419e+00 1.32754e+02 13.847  1.05998e+01  2.61285e+00  0.00000e+00 0.00000e+00 3.20699e+01 13.847  1.00684e+02 193.847 0.9530 
1 1 1 -11 6   1  o 16 7.00541e+00 1.16716e+00 1.10646e+02 139.630 -1.54764e+00 1.31576e+00  0.00000e+00 0.00000e+00 7.59984e+01 139.630 3.46480e+01 319.630 0.7029 
1 1 1 -11 6   2  o 8  7.68556e+00 1.21279e+00 1.61036e+02 115.391 -1.41330e+00 2.97764e+00  0.00000e+00 0.00000e+00 8.05517e+01 115.391 8.04848e+01 295.391 0.8297 
1 1 1 -11 6   3  o 18 1.41635e+01 8.49279e-01 2.86797e+02 80.069  2.08139e+00  1.18884e+01  0.00000e+00 0.00000e+00 2.26766e+02 80.069  6.00305e+01 260.069 0.9576 
1 1 1 -11 6   4  o 16 1.85225e+01 7.88479e-01 2.55662e+02 281.543 3.01406e+00  -1.47575e+01 0.00000e+00 0.00000e+00 4.21527e+02 281.543 1.65865e+02 281.543 0.9662 
1 1 1 -11 6   5  o 10 1.76353e+01 8.26158e-01 3.35867e+02 248.239 -7.12300e+00 -1.78441e+01 0.00000e+00 0.00000e+00 3.13363e+02 248.239 2.25031e+01 68.239  0.9736 
1 1 1 -11 6   6  o 18 2.68771e+01 8.20747e-01 4.75457e+02 261.539 -7.91730e+00 -5.32237e+01 0.00000e+00 0.00000e+00 5.30537e+02 261.539 5.50801e+01 261.539 0.9907 
1 1 1 -11 6   7  o 8  1.81333e+01 8.73973e-01 2.21855e+02 189.221 -1.86098e+01 -3.02107e+00 0.00000e+00 0.00000e+00 4.44276e+02 189.221 2.22420e+02 189.221 0.9731 
1 1 1 -11 6   8  o 12 1.50305e+01 8.84256e-01 2.48532e+02 65.374  8.54002e+00  1.86307e+01  0.00000e+00 0.00000e+00 3.04356e+02 65.374  5.58243e+01 65.374  0.9753 
1 1 1 -11 6   9  o 7  1.27950e+01 9.75826e-01 1.60342e+02 310.488 9.19415e+00  -1.07697e+01 0.00000e+00 0.00000e+00 3.04429e+02 310.488 1.44087e+02 310.488 0.9640 
1 1 1 -11 6   10 f 0  1.58908e+01 8.49158e-01 3.73870e+02 121.468 -2.52242e+01 4.12131e+01  0.00000e+00 0.00000e+00 2.18063e+02 121.468 1.55808e+02 301.468 0.9896 
1 1 1 -11 6   11 o 8  5.24615e+00 1.26054e+00 1.09123e+02 341.291 4.69341e+00  -1.58947e+00 0.00000e+00 0.00000e+00 6.68983e+01 341.291 4.22246e+01 161.291 0.8923 
1 1 1 -11 6   12 o 7  7.00514e+00 1.16781e+00 6.58601e+01 289.935 1.61466e+00  -4.45204e+00 0.00000e+00 0.00000e+00 1.67473e+02 289.935 1.01613e+02 289.935 0.8869 
1 1 1 -11 6   13 o 6  5.66285e+00 1.18322e+00 5.47460e+01 193.610 -3.29311e+00 -7.97268e-01 0.00000e+00 0.00000e+00 1.22640e+02 193.610 6.78943e+01 193.610 0.8350 
1 1 1 -11 6   14 o 10 3.15004e+00 9.86597e-01 3.87271e+01 3.016   1.67411e+00  8.82080e-02  0.00000e+00 0.00000e+00 3.64275e+01 3.016   2.29959e+00 183.016 0.6368 
1 1 1 -11 6   15 o 15 4.90754e+00 1.06431e+00 7.79744e+01 240.658 -2.79539e+00 -4.97289e+00 0.00000e+00 0.00000e+00 8.86593e+01 240.658 1.06849e+01 240.658 0.9075 
1 1 1 -11 6   16 o 2  7.29599e+00 1.14209e+00 1.60242e+02 105.643 -4.68619e+00 1.67351e+01  0.00000e+00 0.00000e+00 1.04395e+02 105.643 5.58468e+01 285.643 0.9708 
1 1 1 -11 6   17 o 10 3.71479e+00 1.12468e+00 8.08469e+01 163.475 -5.01554e+00 1.48809e+00  0.00000e+00 0.00000e+00 4.36793e+01 163.475 3.71676e+01 343.475 0.8985 
1 1 1 -11 6   18 o 2  3.28773e+00 1.07102e+00 4.52789e+01 280.207 5.59898e-01  -3.10973e+00 0.00000e+00 0.00000e+00 5.52904e+01 280.207 1.00114e+01 280.207 0.8211 
1 1 1 -11 7   1  o 13 4.44383e+01 9.82662e-01 6.79519e+02 96.407  -9.22702e+00 8.21713e+01  0.00000e+00 0.00000e+00 9.94739e+02 96.407  3.15221e+02 96.407  0.9939 
1 1 1 -11 7   2  o 15 9.76323e+00 1.03380e+00 1.07997e+02 24.856  2.59906e+00  1.20401e+00  0.00000e+00 0.00000e+00 1.87704e+02 24.856  7.97063e+01 24.856  0.7994 
1 1 1 -11 7   3  o 5  1.15340e+01 9.53960e-01 2.82396e+02 307.583 5.83613e+00  -7.58299e+00 0.00000e+00 0.00000e+00 1.30827e+02 307.583 1.51569e+02 127.583 0.9462 
1 1 1 -11 7   4  o 12 2.05026e+01 7.68132e-01 3.52959e+02 287.030 6.54317e+00  -2.13621e+01 0.00000e+00 0.00000e+00 4.05255e+02 287.030 5.22952e+01 287.030 0.9774 
1 1 1 -11 7   5  o 12 3.19032e+01 8.37386e-01 5.45440e+02 41.327  4.23113e+01  3.72070e+01  0.00000e+00 0.00000e+00 6.50097e+02 41.327  1.04657e+02 41.327  0.9911 
1 1 1 -11 7   6  o 19 2.48241e+01 8.12484e-01 5.01418e+02 238.845 -2.71263e+01 -4.48708e+01 0.00000e+00 0.00000e+00 4.27487e+02 238.845 7.39313e+01 58.845  0.9904 
1 1 1 -11 7   7  o 19 3.25686e+01 8.64929e-01 6.32343e+02 320.296 7.43205e+01  -6.17118e+01 0.00000e+00 0.00000e+00 5.90735e+02 320.296 4.16079e+01 140.296 0.9948 
1 1 1 -11 7   8  f 0  7.05724e+00 1.37044e+00 1.18684e+02 127.653 -2.51971e+00 3.26564e+00  0.00000e+00 0.00000e+00 1.12391e+02 127.653 6.29269e+00 307.653 0.8682 
1 1 1 -11 7   9  o 2  2.10190e+01 8.31945e-01 4.17710e+02 116.194 -2.76709e+01 5.62491e+01  0.00000e+00 0.00000e+00 3.67931e+02 116.194 4.97791e+01 296.194 0.9920 
1 1 1 -11 7   10 o 4  1.27740e+01 9.17771e-01 2.60384e+02 4.380   2.68455e+01  2.05608e+00  0.00000e+00 0.00000e+00 2.11427e+02 4.380   4.89574e+01 184.380 0.9813 
1 1 1 -11 7   11 o 9  5.13823e+00 1.23295e+00 5.04986e+01 305.353 1.31378e+00  -1.85187e+00 0.00000e+00 0.00000e+00 9.19963e+01 305.353 4.14977e+01 305.353 0.7376 
1 1 1 -11 7   12 o 5  8.33847e+00 1.08467e+00 1.82537e+02 194.305 -1.57026e+01 -4.00399e+00 0.00000e+00 0.00000e+00 1.20809e+02 194.305 6.17273e+01 14.305  0.9686 
1 1 1 -11 7   13 o 3  1.18813e+01 8.73765e-01 2.74490e+02 344.811 3.95469e+01  -1.07367e+01 0.00000e+00 0.00000e+00 1.65724e+02 344.811 1.08766e+02 164.811 0.9877 
1 1 1 -11 7   14 o 9  6.93739e+00 1.15624e+00 8.81663e+01 182.228 -7.67826e+00 -2.98710e-01 0.00000e+00 0.00000e+00 1.54182e+02 182.228 6.60161e+01 182.228 0.9325 
1 1 1 -11 7   15 f 0  2.79446e+00 8.74213e-01 6.62723e+01 188.603 -2.88367e+00 -4.36252e-01 0.00000e+00 0.00000e+00 1.77481e+01 188.603 4.85242e+01 8.603   0.8036 
1 1 1 -11 7   16 o 9  4.22578e+00 1.17176e+00 8.37501e+01 281.763 1.06980e+00  -5.13750e+00 0.00000e+00 0.00000e+00 5.81616e+01 281.763 2.55884e+01 101.763 0.8988 
1 1 1 -11 7   17 o 9  5.49543e+00 1.16694e+00 1.01787e+02 268.355 -2.71044e-01 -9.44046e+00 0.00000e+00 0.00000e+00 9.20584e+01 268.355 9.72900e+00 88.355  0.9455 
1 1 1 -11 7   18 o 11 5.18196e+00 1.25690e+00 5.03310e+01 7.870   4.68153e+00  6.47156e-01  0.00000e+00 0.00000e+00 1.20819e+02 7.870   7.04882e+01 7.870   0.8866 
1 1 1 -11 8   1  o 19 1.71909e+01 7.84526e-01 2.27558e+02 213.657 -9.07477e+00 -6.04238e+00 0.00000e+00 0.00000e+00 3.93421e+02 213.657 1.65863e+02 213.657 0.9530 
1 1 1 -11 8   2  o 12 2.07220e+01 7.66863e-01 3.00775e+02 339.715 1.62728e+01  -6.01469e+00 0.00000e+00 0.00000e+00 4.61304e+02 339.715 1.60528e+02 339.715 0.9707 
1 1 1 -11 8   3  o 10 2.29114e+01 7.69172e-01 3.80324e+02 185.882 -2.47571e+01 -2.55058e+00 0.00000e+00 0.00000e+00 4.69542e+02 185.882 8.92188e+01 185.882 0.9797 
1 1 1 -11 8   4  o 13 1.09540e+01 1.03746e+00 2.66868e+02 207.725 -7.76257e+00 -4.07969e+00 0.00000e+00 0.00000e+00 1.23203e+02 207.725 1.43665e+02 27.725  0.9411 
1 1 1 -11 8   5  o 15 1.19163e+01 1.08576e+00 2.23571e+02 54.896  4.81618e+00  6.85159e+00  0.00000e+00 0.00000e+00 1.99165e+02 54.896  2.44058e+01 234.896 0.9382 
1 1 1 -11 8   6  o 13 2.58965e+01 8.14919e-01 5.23710e+02 167.572 -5.57294e+01 1.22815e+01  0.00000e+00 0.00000e+00 4.46070e+02 167.572 7.76405e+01 347.572 0.9912 
1 1 1 -11 8   7  o 4  1.23476e+01 1.05879e+00 3.10707e+02 325.708 1.43843e+01  -9.80936e+00 0.00000e+00 0.00000e+00 1.41812e+02 325.708 1.68895e+02 145.708 0.9708 
1 1 1 -11 8   8  o 18 1.00610e+01 1.14552e+00 1.57266e+02 97.206  -1.03086e+00 8.15315e+00  0.00000e+00 0.00000e+00 1.98288e+02 97.206  4.10217e+01 97.206  0.9370 
1 1 1 -11 8   9  o 2  1.35449e+01 9.61597e-01 3.16556e+02 354.682 2.95389e+01  -2.74960e+00 0.00000e+00 0.00000e+00 1.85121e+02 354.682 1.31435e+02 174.682 0.9830 
1 1 1 -11 8   10 o 1  1.10583e+01 1.01220e+00 2.68110e+02 45.522  1.63519e+01  1.66528e+01  0.00000e+00 0.00000e+00 1.39109e+02 45.522  1.29001e+02 225.522 0.9783 
1 1 1 -11 8   11 o 6  6.91364e+00 1.22524e+00 1.19008e+02 186.774 -7.16888e+00 -8.51531e-01 0.00000e+00 0.00000e+00 1.22199e+02 186.774 3.19116e+00 186.774 0.9279 
1 1 1 -11 8   12 o 1  1.50194e+01 8.05409e-01 3.23157e+02 27.868  5.10544e+01  2.69957e+01  0.00000e+00 0.00000e+00 2.36011e+02 27.868  8.71461e+01 207.868 0.9913 
1 1 1 -11 8   13 o 18 6.59248e+00 1.17877e+00 1.71863e+02 274.047 8.75353e-01  -1.23710e+01 0.00000e+00 0.00000e+00 6.52371e+01 274.047 1.06626e+02 94.047  0.9588 
1 1 1 -11 8   14 o 11 3.71640e+00 1.09458e+00 3.20994e+01 78.549  3.07492e-01  1.51798e+00  0.00000e+00 0.00000e+00 5.25475e+01 78.549  2.04481e+01 78.549  0.6080 
1 1 1 -11 8   15 o 9  5.38267e+00 1.21524e+00 9.05797e+01 137.679 -4.69064e+00 4.27122e+00  0.00000e+00 0.00000e+00 9.41695e+01 137.679 3.58981e+00 137.679 0.9174 
1 1 1 -11 8   16 o 9  1.16851e+01 9.11923e-01 1.93373e+02 58.918  2.03412e+01  3.37437e+01  0.00000e+00 0.00000e+00 2.37623e+02 58.918  4.42498e+01 58.918  0.9872 
1 1 1 -11 8   17 o 15 4.84059e+00 1.22045e+00 9.35611e+01 164.142 -7.10981e+00 2.01968e+00  0.00000e+00 0.00000e+00 7.43256e+01 164.142 1.92354e+01 344.142 0.9297 
1 1 1 -11 8   18 o 1  5.18189e+00 1.33771e+00 9.23480e+01 47.554  5.46401e+00  5.97423e+00  0.00000e+00 0.00000e+00 8.83358e+01 47.554  4.01218e+00 227.554 0.9360 
1 1 1 -11 9   1  o 18 1.87462e+01 7.63251e-01 3.77482e+02 322.293 1.56171e+01  -1.20733e+01 0.00000e+00 0.00000e+00 3.14841e+02 322.293 6.26409e+01 142.293 0.9743 
1 1 1 -11 9   2  o 4  2.25252e+01 7.50552e-01 3.94530e+02 139.389 -2.03128e+01 1.74168e+01  0.00000e+00 0.00000e+00 4.42714e+02 139.389 4.81840e+01 139.389 0.9811 
1 1 1 -11 9   3  o 7  1.63739e+01 8.10271e-01 2.75416e+02 184.338 -1.27857e+01 -9.69877e-01 0.00000e+00 0.00000e+00 3.19834e+02 184.338 4.44186e+01 184.338 0.9602 
1 1 1 -11 9   4  o 15 1.67599e+01 8.18621e-01 2.37100e+02 82.351  1.62281e+00  1.20829e+01  0.00000e+00 0.00000e+00 3.70443e+02 82.351  1.33343e+02 82.351  0.9581 
1 1 1 -11 9   5  o 6  3.34244e+01 8.62274e-01 5.60907e+02 54.208  3.82380e+01  5.30339e+01  0.00000e+00 0.00000e+00 6.93146e+02 54.208  1.32239e+02 54.208  0.9923 
1 1 1 -11 9   6  o 14 2.15408e+01 8.18731e-01 2.84727e+02 242.755 -1.17980e+01 -2.29121e+01 0.00000e+00 0.00000e+00 5.13132e+02 242.755 2.28405e+02 242.755 0.9804 
1 1 1 -11 9   7  o 16 8.23375e+00 1.33720e+00 2.99933e+02 284.016 2.51934e+00  -1.00925e+01 0.00000e+00 0.00000e+00 4.46360e+00 104.016 3.04396e+02 104.016 0.9506 
1 1 1 -11 9   8  o 7  1.77214e+01 8.53466e-01 3.90762e+02 62.439  1.78151e+01  3.41343e+01  0.00000e+00 0.00000e+00 2.68847e+02 62.439  1.21914e+02 242.439 0.9869 
1 1 1 -11 9   9  o 18 8.98789e+00 1.20150e+00 1.48401e+02 230.728 -5.46806e+00 -6.68728e+00 0.00000e+00 0.00000e+00 1.69992e+02 230.728 2.15908e+01 230.728 0.9402 
1 1 1 -11 9   10 o 15 1.05001e+01 1.05206e+00 1.71534e+02 1.247   1.39957e+01  3.04568e-01  0.00000e+00 0.00000e+00 2.09293e+02 1.247   3.77594e+01 1.247   0.9636 
1 1 1 -11 9   11 o 6  1.38747e+01 8.92743e-01 2.78852e+02 54.720  2.21720e+01  3.13382e+01  0.00000e+00 0.00000e+00 2.35974e+02 54.720  4.28776e+01 234.720 0.9869 
1 1 1 -11 9   12 o 17 4.33759e+00 1.01965e+00 9.24905e+01 224.161 -3.14828e+00 -3.05744e+00 0.00000e+00 0.00000e+00 5.03664e+01 224.161 4.21242e+01 44.161  0.8770 
1 1 1 -11 9   13 o 19 5.60723e+00 1.18822e+00 1.22194e+02 212.638 -6.28431e+00 -4.02494e+00 0.00000e+00 0.00000e+00 7.34868e+01 212.638 4.87073e+01 32.638  0.9304 
1 1 1 -11 9   14 o 14 3.38161e+00 1.03578e+00 1.07684e+02 104.059 -1.18649e+00 4.73779e+00  0.00000e+00 0.00000e+00 5.14320e+00 104.059 1.02541e+02 284.059 0.8906 
1 1 1 -11 9   15 o 7  2.92543e+00 9.35497e-01 5.02405e+01 86.250  1.46472e-01  2.23470e+00  0.00000e+00 0.00000e+00 3.00325e+01 86.250  2.02079e+01 266.250 0.7334 
1 1 1 -11 9   16 o 18 1.32964e+01 8.42037e-01 1.98163e+02 358.674 4.78200e+01  -1.10691e+00 0.00000e+00 0.00000e+00 2.93381e+02 358.674 9.52178e+01 358.674 0.9895 
1 1 1 -11 9   17 o 5  3.62225e+00 1.08068e+00 2.76123e+01 78.477  3.61303e-01  1.77229e+00  0.00000e+00 0.00000e+00 6.20800e+01 78.477  3.44677e+01 78.477  0.6637 
1 1 1 -11 9   18 o 17 4.64395e+00 1.23000e+00 9.10995e+01 303.677 4.34639e+00  -6.52292e+00 0.00000e+00 0.00000e+00 7.04439e+01 303.677 2.06556e+01 123.676 0.9338 
1 1 1 -11 10  1  o 13 1.65220e+01 8.04684e-01 3.26306e+02 67.128  5.82003e+00  1.37966e+01  0.00000e+00 0.00000e+00 2.78645e+02 67.128  4.76617e+01 247.128 0.9660 
1 1 1 -11 10  2  o 2  1.93261e+01 7.46901e-01 2.69589e+02 252.246 -4.77936e+00 -1.49275e+01 0.00000e+00 0.00000e+00 4.38787e+02 252.246 1.69198e+02 252.246 0.9676 
1 1 1 -11 10  3  o 15 2.83016e+01 7.93667e-01 5.91431e+02 103.295 -1.09480e+01 4.63319e+01  0.00000e+00 0.00000e+00 4.68763e+02 103.295 1.22668e+02 283.295 0.9894 
1 1 1 -11 10  4  o 10 1.39609e+01 8.89626e-01 2.68556e+02 9.557   1.12530e+01  1.89454e+00  0.00000e+00 0.00000e+00 2.35957e+02 9.557   3.25997e+01 189.557 0.9551 
1 1 1 -11 10  5  o 6  1.65817e+01 8.90055e-01 2.53083e+02 224.024 -1.04784e+01 -1.01273e+01 0.00000e+00 0.00000e+00 3.51933e+02 224.024 9.88499e+01 224.024 0.9651 
1 1 1 -11 10  6  o 19 9.95842e+00 1.20745e+00 2.07721e+02 174.695 -8.13780e+00 7.55613e-01  0.00000e+00 0.00000e+00 1.44667e+02 174.695 6.30543e+01 354.695 0.9367 
1 1 1 -11 10  7  o 15 1.40429e+01 9.40453e-01 2.08550e+02 99.550  -2.20284e+00 1.30929e+01  0.00000e+00 0.00000e+00 3.01159e+02 99.550  9.26086e+01 99.550  0.9616 
1 1 1 -11 10  8  o 16 6.38644e+00 1.33986e+00 1.45378e+02 56.328  2.57268e+00  3.86160e+00  0.00000e+00 0.00000e+00 6.76101e+01 56.328  7.77679e+01 236.328 0.8843 
1 1 1 -11 10  9  o 14 7.26915e+00 1.35964e+00 1.62864e+02 331.895 6.48318e+00  -3.46248e+00 0.00000e+00 0.00000e+00 9.16355e+01 331.895 7.12289e+01 151.895 0.9292 
1 1 1 -11 10  10 o 17 7.37015e+00 1.29302e+00 1.20801e+02 220.496 -4.85757e+00 -4.14817e+00 0.00000e+00 0.00000e+00 1.33850e+02 220.496 1.30494e+01 220.496 0.9180 
1 1 1 -11 10  11 o 8  7.01795e+00 1.25752e+00 1.49722e+02 310.069 5.85143e+00  -6.95633e+00 0.00000e+00 0.00000e+00 9.91686e+01 310.069 5.05533e+01 130.069 0.9433 
1 1 1 -11 10  12 o 14 3.62341e+00 1.07897e+00 2.18542e+01 248.338 -3.23992e-01 -8.15720e-01 0.00000e+00 0.00000e+00 3.27642e+01 248.338 1.09100e+01 248.338 0.4014 
1 1 1 -11 10  13 o 6  3.51631e+00 1.07144e+00 4.21219e+01 181.487 -1.70381e+00 -4.42174e-02 0.00000e+00 0.00000e+00 4.26526e+01 181.487 5.30721e-01 181.487 0.6427 
1 1 1 -11 10  14 o 2  5.47011e+00 1.20948e+00 1.54729e+02 31.978  8.76602e+00  5.47299e+00  0.00000e+00 0.00000e+00 4.00073e+01 31.978  1.14722e+02 211.978 0.9503 
1 1 1 -11 10  15 o 3  6.54509e+00 1.15435e+00 1.18471e+02 262.952 -1.28197e+00 -1.03689e+01 0.00000e+00 0.00000e+00 1.14362e+02 262.952 4.10957e+00 82.952  0.9509 
1 1 1 -11 10  16 o 4  4.55061e+00 1.21102e+00 1.03797e+02 69.312  2.40911e+00  6.37965e+00  0.00000e+00 0.00000e+00 5.32001e+01 69.312  5.05965e+01 249.312 0.9235 
1 1 1 -11 10  17 o 1  5.83260e+00 1.21380e+00 7.36290e+01 214.253 -5.81727e+00 -3.96127e+00 0.00000e+00 0.00000e+00 1.27848e+02 214.253 5.42187e+01 214.253 0.9260 
1 1 1 -11 10  18 o 8  3.25992e+00 1.00051e+00 3.25676e+01 256.241 -5.49860e-01 -2.24551e+00 0.00000e+00 0.00000e+00 5.76405e+01 256.241 2.50729e+01 256.241 0.7429 
1 1 1 -11 11  1  o 16 2.21848e+01 7.43846e-01 4.98687e+02 245.752 -1.26700e+01 -2.81283e+01 0.00000e+00 0.00000e+00 3.28423e+02 245.752 1.70264e+02 65.752  0.9837 
1 1 1 -11 11  2  o 2  2.08431e+01 7.51781e-01 4.19982e+02 108.658 -8.41070e+00 2.49086e+01  0.00000e+00 0.00000e+00 3.54430e+02 108.658 6.55521e+01 288.658 0.9808 
1 1 1 -11 11  3  o 9  1.65931e+01 8.09212e-01 2.23602e+02 325.473 8.67162e+00  -5.96589e+00 0.00000e+00 0.00000e+00 3.73970e+02 325.473 1.50368e+02 325.473 0.9512 
1 1 1 -11 11  4  o 3  1.46150e+01 1.14622e+00 2.46513e+02 290.929 3.79870e+00  -9.93292e+00 0.00000e+00 0.00000e+00 2.79761e+02 290.929 3.32481e+01 290.929 0.9518 
1 1 1 -11 11  5  o 13 1.13038e+01 1.07270e+00 1.93604e+02 260.826 -1.18238e+00 -7.32132e+00 0.00000e+00 0.00000e+00 2.03804e+02 260.826 1.02003e+01 260.826 0.9299 
1 1 1 -11 11  6  o 14 2.58877e+01 8.19799e-01 4.85980e+02 35.484  4.29114e+01  3.05904e+01  0.00000e+00 0.00000e+00 4.82677e+02 35.484  3.30285e+00 215.484 0.9905 
1 1 1 -11 11  7  o 8  3.53140e+01 9.01086e-01 6.72948e+02 272.530 4.77895e+00  -1.08177e+02 0.00000e+00 0.00000e+00 6.53845e+02 272.530 1.91026e+01 92.529  0.9954 
1 1 1 -11 11  8  o 10 6.67338e+00 1.34307e+00 1.92305e+02 147.425 -5.39659e+00 3.44796e+00  0.00000e+00 0.00000e+00 3.87781e+01 147.425 1.53527e+02 327.425 0.9182 
1 1 1 -11 11  9  f 0  1.46107e+01 8.90383e-01 2.31706e+02 59.072  1.23154e+01  2.05549e+01  0.00000e+00 0.00000e+00 3.07150e+02 59.072  7.54437e+01 59.072  0.9789 
1 1 1 -11 11  10 o 1  1.60118e+01 8.42362e-01 2.14573e+02 289.875 9.62441e+00  -2.66230e+01 0.00000e+00 0.00000e+00 3.77326e+02 289.875 1.62753e+02 289.875 0.9822 
1 1 1 -11 11  11 o 1  7.97775e+00 1.16237e+00 1.54315e+02 200.366 -1.02306e+01 -3.79778e+00 0.00000e+00 0.00000e+00 1.31528e+02 200.366 2.27876e+01 20.366  0.9530 
1 1 1 -11 11  12 o 6  5.62036e+00 1.27985e+00 1.72399e+02 75.169  2.50122e+00  9.44617e+00  0.00000e+00 0.00000e+00 2.75539e+01 75.169  1.44845e+02 255.169 0.9474 
1 1 1 -11 11  13 o 10 5.02570e+00 1.14685e+00 6.06845e+01 212.462 -2.94507e+00 -1.87349e+00 0.00000e+00 0.00000e+00 9.77729e+01 212.462 3.70884e+01 212.462 0.8406 
1 1 1 -11 11  14 o 9  4.89764e+00 1.12399e+00 9.46810e+01 342.950 5.66868e+00  -1.73846e+00 0.00000e+00 0.00000e+00 7.25033e+01 342.950 2.21777e+01 162.950 0.9112 
1 1 1 -11 11  15 o 10 3.77953e+00 1.05548e+00 6.15214e+01 84.904  2.94356e-01  3.30083e+00  0.00000e+00 0.00000e+00 5.59438e+01 84.904  5.57762e+00 264.904 0.8308 
1 1 1 -11 11  16 o 18 6.43905e+00 1.20557e+00 1.65536e+02 149.101 -1.32458e+01 7.92715e+00  0.00000e+00 0.00000e+00 6.70914e+01 149.101 9.84448e+01 329.101 0.9670 
1 1 1 -11 11  17 o 2  5.99593e+00 1.21885e+00 1.25360e+02 28.260  1.08048e+01  5.80798e+00  0.00000e+00 0.00000e+00 8.89947e+01 28.260  3.63657e+01 208.260 0.9583 
1 1 1 -11 11  18 o 5  3.76147e+00 1.09205e+00 2.53599e+01 175.388 -1.92034e+00 1.54924e-01  0.00000e+00 0.00000e+00 7.06617e+01 175.388 4.53018e+01 175.388 0.6853 
1 1 1 -11 12  1  o 13 1.52624e+01 7.96731e-01 3.38378e+02 331.767 1.36367e+01  -7.32216e+00 0.00000e+00 0.00000e+00 2.21072e+02 331.767 1.17305e+02 151.767 0.9671 
1 1 1 -11 12  2  o 14 8.94796e+00 1.11530e+00 1.22658e+02 326.157 2.63251e+00  -1.76518e+00 0.00000e+00 0.00000e+00 1.55887e+02 326.157 3.32289e+01 326.157 0.8218 
1 1 1 -11 12  3  o 15 4.10477e+01 9.36202e-01 6.80221e+02 345.431 8.49912e+01  -2.20892e+01 0.00000e+00 0.00000e+00 8.64895e+02 345.431 1.84674e+02 345.431 0.9943 
1 1 1 -11 12  4  o 15 2.54175e+01 7.94207e-01 2.88604e+02 147.088 -1.95167e+01 1.26319e+01  0.00000e+00 0.00000e+00 6.52107e+02 147.088 3.63504e+02 147.088 0.9783 
1 1 1 -11 12  5  o 3  5.44972e+00 1.38890e+00 1.98811e+02 33.620  2.90878e+00  1.93404e+00  0.00000e+00 0.00000e+00 2.55911e+01 213.620 2.24402e+02 213.620 0.8407 
1 1 1 -11 12  6  o 7  8.79599e+00 1.26598e+00 2.13312e+02 65.379  3.04647e+00  6.64747e+00  0.00000e+00 0.00000e+00 9.53333e+01 65.379  1.17979e+02 245.378 0.9289 
1 1 1 -11 12  7  o 6  2.66723e+01 8.27408e-01 5.22842e+02 147.406 -5.40581e+01 3.45642e+01  0.00000e+00 0.00000e+00 4.76025e+02 147.406 4.68165e+01 327.406 0.9922 
1 1 1 -11 12  8  f 0  1.73413e+01 8.49146e-01 2.79693e+02 40.256  2.05493e+01  1.73998e+01  0.00000e+00 0.00000e+00 3.62000e+02 40.256  8.23075e+01 40.256  0.9813 
1 1 1 -11 12  9  o 18 1.35782e+01 9.30183e-01 2.34089e+02 51.436  1.38803e+01  1.74097e+01  0.00000e+00 0.00000e+00 2.65841e+02 51.436  3.17530e+01 51.436  0.9773 
1 1 1 -11 12  10 o 14 7.78323e+00 1.24927e+00 1.85424e+02 194.583 -1.06210e+01 -2.76313e+00 0.00000e+00 0.00000e+00 9.38229e+01 194.583 9.16014e+01 14.583  0.9533 
1 1 1 -11 12  11 o 4  1.26667e+01 8.54700e-01 1.75060e+02 320.767 1.69690e+01  -1.38560e+01 0.00000e+00 0.00000e+00 2.90150e+02 320.767 1.15090e+02 320.767 0.9769 
1 1 1 -11 12  12 o 12 7.56056e+00 1.16051e+00 9.66807e+01 188.840 -7.70561e+00 -1.19840e+00 0.00000e+00 0.00000e+00 1.68351e+02 188.840 7.16701e+01 188.840 0.9335 
1 1 1 -11 12  13 o 10 4.67946e+00 1.20399e+00 1.29596e+02 147.143 -5.66423e+00 3.65827e+00  0.00000e+00 0.00000e+00 3.23210e+01 147.143 9.72750e+01 327.143 0.9225 
1 1 1 -11 12  14 o 12 7.58744e+00 1.13969e+00 1.55486e+02 303.728 8.30013e+00  -1.24324e+01 0.00000e+00 0.00000e+00 1.19056e+02 303.728 3.64296e+01 123.728 0.9660 
1 1 1 -11 12  15 o 13 7.23004e+00 1.12199e+00 1.88509e+02 147.835 -1.69987e+01 1.06901e+01  0.00000e+00 0.00000e+00 7.51407e+01 147.835 1.13368e+02 327.835 0.9748 
1 1 1 -11 12  16 o 11 3.30567e+00 1.03054e+00 6.19437e+01 357.712 3.36358e+00  -1.34380e-01 0.00000e+00 0.00000e+00 4.10236e+01 357.712 2.09201e+01 177.712 0.8338 
1 1 1 -11 12  17 o 11 6.95280e+00 1.17210e+00 1.53327e+02 291.760 6.57076e+00  -1.64615e+01 0.00000e+00 0.00000e+00 9.86097e+01 291.760 5.47171e+01 111.760 0.9714 
1 1 1 -11 12  18 o 14 5.42328e+00 1.28144e+00 7.63679e+01 121.645 -3.75233e+00 6.08864e+00  0.00000e+00 0.00000e+00 1.10926e+02 121.645 3.45577e+01 121.645 0.9272 
1 1 1 -11 13  1  o 9  2.04125e+01 7.58777e-01 3.41471e+02 331.791 1.84435e+01  -9.89283e+00 0.00000e+00 0.00000e+00 4.13442e+02 331.791 7.19710e+01 331.791 0.9758 
1 1 1 -11 13  2  o 13 2.57951e+01 7.69612e-01 3.54899e+02 301.796 1.37867e+01  -2.22390e+01 0.00000e+00 0.00000e+00 6.03346e+02 301.796 2.48447e+02 301.796 0.9807 
1 1 1 -11 13  3  o 1  1.41588e+01 8.54422e-01 2.36216e+02 120.635 -5.39968e+00 9.11772e+00  0.00000e+00 0.00000e+00 2.73837e+02 120.635 3.76208e+01 120.635 0.9516 
1 1 1 -11 13  4  o 13 1.76197e+01 8.12894e-01 4.87009e+02 199.498 -2.55509e+01 -9.04691e+00 0.00000e+00 0.00000e+00 1.67163e+02 199.498 3.19846e+02 19.498  0.9814 
1 1 1 -11 13  5  o 10 1.67312e+01 8.27400e-01 3.67059e+02 89.568  1.57399e-01  2.08796e+01  0.00000e+00 0.00000e+00 2.50124e+02 89.568  1.16935e+02 269.568 0.9758 
1 1 1 -11 13  6  o 17 1.48518e+01 8.86122e-01 2.42922e+02 194.094 -1.44919e+01 -3.63860e+00 0.00000e+00 0.00000e+00 2.98997e+02 194.094 5.60758e+01 194.094 0.9659 
1 1 1 -11 13  7  o 3  9.32660e+00 1.19562e+00 1.84988e+02 274.764 6.61820e-01  -7.94176e+00 0.00000e+00 0.00000e+00 1.44141e+02 274.764 4.08476e+01 94.764  0.9350 
1 1 1 -11 13  8  o 19 6.48629e+00 1.35454e+00 1.34770e+02 249.300 -1.62448e+00 -4.29897e+00 0.00000e+00 0.00000e+00 8.12259e+01 249.300 5.35443e+01 69.300  0.8831 
1 1 1 -11 13  9  o 12 9.61252e+00 1.16306e+00 1.60507e+02 254.601 -2.69447e+00 -9.78273e+00 0.00000e+00 0.00000e+00 1.83292e+02 254.601 2.27854e+01 254.601 0.9494 
1 1 1 -11 13  10 o 18 8.06222e+00 1.19424e+00 1.48444e+02 34.036  7.68248e+00  5.18884e+00  0.00000e+00 0.00000e+00 1.38112e+02 34.036  1.03321e+01 214.036 0.9444 
1 1 1 -11 13  11 o 1  7.17720e+00 1.22619e+00 1.75844e+02 39.933  8.35506e+00  6.99410e+00  0.00000e+00 0.00000e+00 8.12784e+01 39.933  9.45659e+01 219.933 0.9529 
1 1 1 -11 13  12 o 18 7.17188e+00 1.18802e+00 1.80243e+02 193.684 -1.32215e+01 -3.21907e+00 0.00000e+00 0.00000e+00 7.89744e+01 193.684 1.01269e+02 13.684  0.9625 
1 1 1 -11 13  13 o 8  7.04254e+00 1.20962e+00 1.36112e+02 20.650  9.94006e+00  3.74619e+00  0.00000e+00 0.00000e+00 1.15264e+02 20.650  2.08474e+01 200.650 0.9517 
1 1 1 -11 13  14 o 18 4.35575e+00 1.14941e+00 7.53815e+01 339.422 4.01404e+00  -1.50700e+00 0.00000e+00 0.00000e+00 6.71753e+01 339.422 8.20627e+00 159.422 0.8737 
1 1 1 -11 13  15 o 8  4.64495e+00 1.14087e+00 8.74568e+01 31.413  5.04583e+00  3.08157e+00  0.00000e+00 0.00000e+00 7.08338e+01 31.413  1.66230e+01 211.413 0.9110 
1 1 1 -11 13  16 o 8  2.55899e+00 8.69859e-01 6.57231e+01 141.826 -2.39676e+00 1.88430e+00  0.00000e+00 0.00000e+00 1.20456e+01 141.826 5.36774e+01 321.826 0.8135 
1 1 1 -11 13  17 o 16 4.14153e+00 1.12762e+00 7.48609e+01 326.547 4.43928e+00  -2.93309e+00 0.00000e+00 0.00000e+00 6.42283e+01 326.547 1.06327e+01 146.547 0.9003 
1 1 1 -11 13  18 o 18 4.89549e+00 1.05190e+00 5.62136e+01 71.773  1.79475e+00  5.45003e+00  0.00000e+00 0.00000e+00 1.09363e+02 71.773  5.31493e+01 71.773  0.9081 
1 1 1 -11 14  1  o 13 6.24621e+00 1.34049e+00 1.60033e+02 247.386 -1.07749e+00 -2.58677e+00 0.00000e+00 0.00000e+00 2.79770e+01 247.386 1.32056e+02 67.386  0.7942 
1 1 1 -11 14  2  o 13 9.00098e+00 1.09080e+00 6.36237e+01 155.859 -1.44461e+00 6.47451e-01  0.00000e+00 0.00000e+00 1.46397e+02 155.859 8.27729e+01 155.859 0.6160 
1 1 1 -11 14  3  o 1  1.32211e+01 1.20554e+00 1.58347e+02 78.249  1.29284e+00  6.21519e+00  0.00000e+00 0.00000e+00 3.00828e+02 78.249  1.42481e+02 78.249  0.9175 
1 1 1 -11 14  4  o 11 3.61586e+01 8.77472e-01 6.81673e+02 201.025 -7.20888e+01 -2.77090e+01 0.00000e+00 0.00000e+00 6.77342e+02 201.025 4.33105e+00 21.025  0.9935 
1 1 1 -11 14  5  o 5  2.00663e+01 8.34404e-01 3.46044e+02 4.079   2.35034e+01  1.67590e+00  0.00000e+00 0.00000e+00 3.96254e+02 4.079   5.02093e+01 4.079   0.9785 
1 1 1 -11 14  6  o 2  1.93880e+01 7.91307e-01 3.05855e+02 86.353  1.63111e+00  2.55903e+01  0.00000e+00 0.00000e+00 4.12081e+02 86.353  1.06226e+02 86.353  0.9803 
1 1 1 -11 14  7  f 0  6.05977e+00 1.40817e+00 1.19183e+02 336.761 2.92014e+00  -1.25391e+00 0.00000e+00 0.00000e+00 6.88902e+01 336.761 5.02932e+01 156.761 0.8223 
1 1 1 -11 14  8  o 8  1.27842e+01 9.48053e-01 2.25913e+02 287.920 5.14336e+00  -1.59050e+01 0.00000e+00 0.00000e+00 2.41507e+02 287.920 1.55945e+01 287.920 0.9696 
1 1 1 -11 14  9  o 17 7.45603e+00 1.23248e+00 1.93237e+02 147.980 -7.74705e+00 4.84468e+00  0.00000e+00 0.00000e+00 7.17983e+01 147.980 1.21439e+02 327.980 0.9436 
1 1 1 -11 14  10 o 17 5.03057e+00 1.27831e+00 5.15002e+01 275.115 1.73498e-01  -1.93821e+00 0.00000e+00 0.00000e+00 7.88818e+01 275.115 2.73817e+01 275.115 0.6887 
1 1 1 -11 14  11 o 3  2.77101e+01 8.02650e-01 4.30196e+02 184.475 -1.24650e+02 -9.75537e+00 0.00000e+00 0.00000e+00 6.07322e+02 184.475 1.77127e+02 184.475 0.9960 
1 1 1 -11 14  12 o 6  5.05911e+00 1.20846e+00 4.24513e+01 247.862 -8.42725e-01 -2.07142e+00 0.00000e+00 0.00000e+00 9.67944e+01 247.862 5.43431e+01 247.862 0.7330 
1 1 1 -11 14  13 o 15 7.77543e+00 1.09746e+00 1.46704e+02 3.139   1.33311e+01  7.31056e-01  0.00000e+00 0.00000e+00 1.33764e+02 3.139   1.29403e+01 183.139 0.9618 
1 1 1 -11 14  14 o 18 1.16907e+01 8.70570e-01 1.92752e+02 198.184 -3.24038e+01 -1.06435e+01 0.00000e+00 0.00000e+00 2.38676e+02 198.184 4.59237e+01 198.184 0.9852 
1 1 1 -11 14  15 o 17 3.19125e+00 1.00723e+00 8.57255e+01 57.593  2.31328e+00  3.64420e+00  0.00000e+00 0.00000e+00 1.86884e+01 57.593  6.70370e+01 237.593 0.8747 
1 1 1 -11 14  16 o 3  5.49942e+00 1.23366e+00 9.19456e+01 275.196 6.58888e-01  -7.24549e+00 0.00000e+00 0.00000e+00 9.87933e+01 275.196 6.84775e+00 275.196 0.9285 
1 1 1 -11 14  17 o 5  4.66555e+00 1.14169e+00 7.13811e+01 164.107 -5.43806e+00 1.54840e+00  0.00000e+00 0.00000e+00 8.63977e+01 164.107 1.50166e+01 164.107 0.9066 
1 1 1 -11 14  18 o 7  4.26434e+00 1.26046e+00 7.74526e+01 65.344  2.46304e+00  5.36580e+00  0.00000e+00 0.00000e+00 6.72094e+01 65.344  1.02432e+01 245.344 0.9108 
1 1 1 -11 15  1  o 19 3.63146e+01 8.75649e-01 5.27899e+02 330.741 4.73497e+01  -2.65272e+01 0.00000e+00 0.00000e+00 8.35566e+02 330.741 3.07667e+02 330.741 0.9907 
1 1 1 -11 15  2  o 1  1.25022e+01 8.77048e-01 1.97210e+02 80.579  1.13879e+00  6.86338e+00  0.00000e+00 0.00000e+00 2.40837e+02 80.579  4.36268e+01 80.579  0.9251 
1 1 1 -11 15  3  o 15 3.13481e+01 8.17543e-01 6.08518e+02 172.089 -5.80833e+01 8.07072e+00  0.00000e+00 0.00000e+00 5.67968e+02 172.089 4.05497e+01 352.089 0.9914 
1 1 1 -11 15  4  o 5  1.99168e+01 7.72418e-01 3.56328e+02 42.668  1.70653e+01  1.57300e+01  0.00000e+00 0.00000e+00 3.80691e+02 42.668  2.43622e+01 42.668  0.9782 
1 1 1 -11 15  5  o 19 2.42433e+01 7.95410e-01 4.56980e+02 198.483 -3.57558e+01 -1.19517e+01 0.00000e+00 0.00000e+00 4.47226e+02 198.483 9.75443e+00 18.483  0.9866 
1 1 1 -11 15  6  o 1  2.42141e+01 7.84601e-01 4.62826e+02 90.530  -4.48280e-01 4.84376e+01  0.00000e+00 0.00000e+00 4.42310e+02 90.530  2.05161e+01 270.530 0.9896 
1 1 1 -11 15  7  o 14 2.05550e+01 8.00532e-01 3.73478e+02 234.903 -2.18207e+01 -3.10516e+01 0.00000e+00 0.00000e+00 3.91990e+02 234.903 1.85116e+01 234.903 0.9867 
1 1 1 -11 15  8  o 17 1.48495e+01 8.80452e-01 2.72360e+02 122.028 -1.25674e+01 2.00900e+01  0.00000e+00 0.00000e+00 2.75620e+02 122.028 3.25974e+00 122.028 0.9787 
1 1 1 -11 15  9  o 6  6.13871e+00 1.31684e+00 1.07743e+02 189.165 -4.03261e+00 -6.50645e-01 0.00000e+00 0.00000e+00 9.26799e+01 189.165 1.50633e+01 9.165   0.8667 
1 1 1 -11 15  10 o 8  1.27279e+01 9.03096e-01 1.77788e+02 301.997 1.01843e+01  -1.63000e+01 0.00000e+00 0.00000e+00 2.88556e+02 301.997 1.10768e+02 301.997 0.9736 
1 1 1 -11 15  11 o 13 4.33294e+00 1.19403e+00 8.94252e+01 296.655 1.57876e+00  -3.14518e+00 0.00000e+00 0.00000e+00 4.77356e+01 296.655 4.16895e+01 116.655 0.8421 
1 1 1 -11 15  12 o 16 1.15056e+01 9.08951e-01 2.01430e+02 37.440  2.18611e+01  1.67383e+01  0.00000e+00 0.00000e+00 2.22664e+02 37.440  2.12346e+01 37.440  0.9817 
1 1 1 -11 15  13 o 4  8.73770e+00 1.03659e+00 2.11260e+02 219.288 -1.81020e+01 -1.48100e+01 0.00000e+00 0.00000e+00 1.09343e+02 219.288 1.01917e+02 39.288  0.9784 
1 1 1 -11 15  14 o 1  3.32248e+00 1.03231e+00 9.76237e+01 107.445 -1.35289e+00 4.30519e+00  0.00000e+00 0.00000e+00 1.19745e+01 107.445 8.56492e+01 287.445 0.8807 
1 1 1 -11 15  15 o 18 3.86463e+00 1.09083e+00 1.50500e+02 93.547  -5.61606e-01 9.05956e+00  0.00000e+00 0.00000e+00 1.41547e+01 273.547 1.64655e+02 273.547 0.9432 
1 1 1 -11 15  16 o 1  1.36386e+01 8.09978e-01 2.56897e+02 229.908 -4.30099e+01 -5.10898e+01 0.00000e+00 0.00000e+00 2.48723e+02 229.908 8.17342e+00 49.908  0.9925 
1 1 1 -11 15  17 o 19 9.05948e+00 9.58889e-01 1.28932e+02 38.950  1.77447e+01  1.43438e+01  0.00000e+00 0.00000e+00 2.01489e+02 38.950  7.25570e+01 38.950  0.9778 
1 1 1 -11 15  18 f 0  3.21087e+00 1.02554e+00 5.06012e+01 188.110 -3.49909e+00 -4.98591e-01 0.00000e+00 0.00000e+00 5.01923e+01 188.110 4.08928e-01 8.110   0.8429 
1 1 1 -11 16  1  f 0  3.01280e+01 8.13354e-01 6.07148e+02 145.457 -4.28211e+01 2.94772e+01  0.00000e+00 0.00000e+00 5.23521e+02 145.457 8.36263e+01 325.457 0.9903 
1 1 1 -11 16  2  o 8  8.71217e+00 1.11506e+00 9.58273e+01 349.893 2.53043e+00  -4.51046e-01 0.00000e+00 0.00000e+00 1.59055e+02 349.893 6.32273e+01 349.893 0.7724 
1 1 1 -11 16  3  o 2  1.85647e+01 7.70470e-01 3.50765e+02 42.033  1.49099e+01  1.34407e+01  0.00000e+00 0.00000e+00 3.34219e+02 42.033  1.65461e+01 222.033 0.9748 
1 1 1 -11 16  4  o 1  1.96904e+01 7.99782e-01 2.59765e+02 216.351 -1.34149e+01 -9.87244e+00 0.00000e+00 0.00000e+00 4.62354e+02 216.351 2.02588e+02 216.351 0.9695 
1 1 1 -11 16  5  o 11 4.46038e+01 1.00521e+00 7.29333e+02 301.768 6.42860e+01  -1.03811e+02 0.00000e+00 0.00000e+00 9.49784e+02 301.768 2.20451e+02 301.768 0.9959 
1 1 1 -11 16  6  o 10 2.84478e+01 8.17594e-01 5.10034e+02 52.474  3.79834e+01  4.94548e+01  0.00000e+00 0.00000e+00 5.55812e+02 52.474  4.57782e+01 52.474  0.9919 
1 1 1 -11 16  7  o 2  1.43361e+01 1.10627e+00 2.27919e+02 86.823  9.07685e-01  1.63552e+01  0.00000e+00 0.00000e+00 2.96327e+02 86.823  6.84081e+01 86.823  0.9690 
1 1 1 -11 16  8  o 15 2.08461e+01 8.20559e-01 3.37333e+02 166.301 -4.13283e+01 1.00743e+01  0.00000e+00 0.00000e+00 4.39377e+02 166.301 1.02043e+02 166.301 0.9882 
1 1 1 -11 16  9  f 0  9.20560e+00 1.15487e+00 6.43441e+01 227.179 -2.60453e+00 -2.81060e+00 0.00000e+00 0.00000e+00 2.32739e+02 227.179 1.68395e+02 227.179 0.8567 
1 1 1 -11 16  10 o 3  1.33713e+01 9.09711e-01 2.65918e+02 339.194 2.81513e+01  -1.06971e+01 0.00000e+00 0.00000e+00 2.28822e+02 339.194 3.70960e+01 159.194 0.9833 
1 1 1 -11 16  11 o 18 9.96132e+00 9.84141e-01 1.92110e+02 73.841  5.24247e+00  1.80931e+01  0.00000e+00 0.00000e+00 1.72252e+02 73.841  1.98579e+01 253.841 0.9731 
1 1 1 -11 16  12 o 2  2.02686e+01 7.76422e-01 3.45376e+02 233.014 -5.26250e+01 -6.98720e+01 0.00000e+00 0.00000e+00 4.11272e+02 233.014 6.58959e+01 233.014 0.9943 
1 1 1 -11 16  13 o 2  6.23058e+00 1.23239e+00 1.16268e+02 118.598 -3.97209e+00 7.28593e+00  0.00000e+00 0.00000e+00 1.02818e+02 118.598 1.34505e+01 298.598 0.9377 
1 1 1 -11 16  14 o 11 5.45608e+00 1.14189e+00 1.36533e+02 66.803  3.62873e+00  8.46772e+00  0.00000e+00 0.00000e+00 5.63850e+01 66.803  8.01475e+01 246.803 0.9441 
1 1 1 -11 16  15 o 14 9.06793e+00 9.97817e-01 1.34461e+02 343.637 1.93446e+01  -5.67971e+00 0.00000e+00 0.00000e+00 1.96192e+02 343.637 6.17309e+01 343.637 0.9749 
1 1 1 -11 16  16 o 18 6.33984e+00 1.13633e+00 4.87459e+01 16.709  4.59815e+00  1.38033e+00  0.00000e+00 0.00000e+00 1.61667e+02 16.709  1.12921e+02 16.709  0.8886 
1 1 1 -11 16  17 o 7  4.89134e+00 1.13358e+00 7.38880e+01 8.171   6.16234e+00  8.84824e-01  0.00000e+00 0.00000e+00 9.31730e+01 8.171   1.92851e+01 8.171   0.9157 
1 1 1 -11 16  18 o 2  7.91375e+00 1.07936e+00 1.45914e+02 341.720 2.27910e+01  -7.52839e+00 0.00000e+00 0.00000e+00 1.42598e+02 341.720 3.31522e+00 161.720 0.9789 
1 1 1 -11 17  1  o 4  9.04663e+00 1.10097e+00 9.51199e+01 76.581  5.50182e-01  2.30596e+00  0.00000e+00 0.00000e+00 1.62043e+02 76.581  6.69233e+01 76.581  0.7502 
1 1 1 -11 17  2  o 10 2.78401e+01 7.87854e-01 4.79620e+02 156.625 -3.90851e+01 1.68937e+01  0.00000e+00 0.00000e+00 5.62317e+02 156.625 8.26970e+01 156.625 0.9882 
1 1 1 -11 17  3  o 12 1.54480e+01 7.97360e-01 3.47916e+02 141.683 -1.29457e+01 1.02302e+01  0.00000e+00 0.00000e+00 2.18795e+02 141.683 1.29121e+02 321.683 0.9692 
1 1 1 -11 17  4  o 13 1.79748e+01 7.86545e-01 4.00785e+02 78.382  4.72226e+00  2.29692e+01  0.00000e+00 0.00000e+00 2.64465e+02 78.382  1.36320e+02 258.382 0.9784 
1 1 1 -11 17  5  o 18 2.20623e+01 7.82227e-01 2.46148e+02 310.872 1.37052e+01  -1.58372e+01 0.00000e+00 0.00000e+00 5.67618e+02 310.872 3.21470e+02 310.872 0.9758 
1 1 1 -11 17  6  o 14 3.20517e+01 8.44220e-01 5.82474e+02 62.661  3.84127e+01  7.42995e+01  0.00000e+00 0.00000e+00 6.20830e+02 62.661  3.83562e+01 62.661  0.9940 
1 1 1 -11 17  7  o 8  2.17014e+01 9.64320e-01 2.56224e+02 92.808  -1.40242e+00 2.85942e+01  0.00000e+00 0.00000e+00 5.48297e+02 92.808  2.92073e+02 92.808  0.9824 
1 1 1 -11 17  8  o 8  1.75200e+01 8.45524e-01 1.82746e+02 330.980 1.68322e+01  -9.33795e+00 0.00000e+00 0.00000e+00 4.60424e+02 330.980 2.77678e+02 330.980 0.9737 
1 1 1 -11 17  9  f 0  7.80721e+00 1.24377e+00 4.98953e+01 52.105  1.58241e+00  2.03306e+00  0.00000e+00 0.00000e+00 1.77439e+02 52.105  1.27543e+02 52.105  0.7730 
1 1 1 -11 17  10 o 5  5.80700e+00 1.29577e+00 8.95626e+01 89.381  4.18452e-02  3.87510e+00  0.00000e+00 0.00000e+00 9.80384e+01 89.381  8.47575e+00 89.381  0.8586 
1 1 1 -11 17  11 o 5  5.71441e+00 1.23249e+00 1.55965e+02 256.133 -1.85393e+00 -7.51013e+00 0.00000e+00 0.00000e+00 4.44194e+01 256.133 1.11546e+02 76.133  0.9329 
1 1 1 -11 17  12 f 0  1.21419e+01 9.17733e-01 2.08312e+02 12.754  2.76778e+01  6.26496e+00  0.00000e+00 0.00000e+00 2.39445e+02 12.754  3.11326e+01 12.754  0.9822 
1 1 1 -11 17  13 o 10 5.95655e+00 1.20242e+00 8.73736e+01 211.355 -5.07535e+00 -3.09252e+00 0.00000e+00 0.00000e+00 1.16218e+02 211.355 2.88449e+01 211.355 0.9115 
1 1 1 -11 17  14 o 16 1.01700e+01 9.74158e-01 1.96884e+02 76.946  6.08951e+00  2.62633e+01  0.00000e+00 0.00000e+00 1.76868e+02 76.946  2.00165e+01 256.946 0.9813 
1 1 1 -11 17  15 o 7  7.77309e+00 1.10798e+00 6.49687e+01 11.773  7.62339e+00  1.58882e+00  0.00000e+00 0.00000e+00 2.06396e+02 11.773  1.41427e+02 11.773  0.9334 
1 1 1 -11 17  16 o 14 7.71664e+00 1.07459e+00 1.79317e+02 131.692 -1.48754e+01 1.67003e+01  0.00000e+00 0.00000e+00 1.02382e+02 131.692 7.69350e+01 311.692 0.9774 
1 1 1 -11 17  17 o 13 8.05381e+00 1.00356e+00 1.58963e+02 260.829 -3.85577e+00 -2.38839e+01 0.00000e+00 0.00000e+00 1.35137e+02 260.829 2.38259e+01 80.829  0.9791 
1 1 1 -11 17  18 o 6  6.31113e+00 1.14163e+00 5.89595e+01 144.823 -6.14641e+00 4.33210e+00  0.00000e+00 0.00000e+00 1.59827e+02 144.823 1.00868e+02 144.823 0.9309 
1 1 1 -11 18  1  f 0  2.69441e+01 7.79792e-01 5.71304e+02 136.872 -3.58918e+01 3.36196e+01  0.00000e+00 0.00000e+00 4.39218e+02 136.872 1.32086e+02 316.872 0.9898 
1 1 1 -11 18  2  o 8  1.47809e+01 8.14247e-01 2.77866e+02 14.237  1.26381e+01  3.20657e+00  0.00000e+00 0.00000e+00 2.59993e+02 14.237  1.78731e+01 194.237 0.9609 
1 1 1 -11 18  3  o 8  9.91677e+00 1.01984e+00 2.30475e+02 75.284  1.79599e+00  6.83803e+00  0.00000e+00 0.00000e+00 1.17202e+02 75.284  1.13272e+02 255.284 0.9263 
1 1 1 -11 18  4  o 19 2.41398e+01 7.71377e-01 3.95818e+02 210.253 -2.90691e+01 -1.69549e+01 0.00000e+00 0.00000e+00 5.03572e+02 210.253 1.07753e+02 210.253 0.9850 
1 1 1 -11 18  5  o 6  1.37996e+01 8.72619e-01 4.16440e+02 31.842  2.04342e+01  1.26905e+01  0.00000e+00 0.00000e+00 9.41815e+01 31.842  3.22258e+02 211.842 0.9790 
1 1 1 -11 18  6  o 12 1.53092e+01 8.24737e-01 2.43681e+02 286.805 4.83622e+00  -1.60138e+01 0.00000e+00 0.00000e+00 3.16949e+02 286.805 7.32673e+01 286.805 0.9696 
1 1 1 -11 18  7  o 9  2.18795e+01 7.95024e-01 3.08986e+02 283.784 8.52583e+00  -3.47535e+01 0.00000e+00 0.00000e+00 5.05029e+02 283.784 1.96043e+02 283.784 0.9859 
1 1 1 -11 18  8  o 15 2.09816e+01 7.93072e-01 4.66749e+02 102.834 -1.31866e+01 5.78823e+01  0.00000e+00 0.00000e+00 3.17598e+02 102.834 1.49151e+02 282.834 0.9915 
1 1 1 -11 18  9  o 16 1.78836e+01 8.38074e-01 3.32901e+02 10.614  4.31965e+01  8.09490e+00  0.00000e+00 0.00000e+00 3.32979e+02 10.614  7.79561e-02 10.614  0.9886 
1 1 1 -11 18  10 o 4  7.63576e+00 1.20856e+00 1.68047e+02 311.085 6.48289e+00  -7.43553e+00 0.00000e+00 0.00000e+00 1.04285e+02 311.085 6.37627e+01 131.084 0.9479 
1 1 1 -11 18  11 o 19 6.16726e+00 1.21433e+00 1.21339e+02 192.259 -6.38780e+00 -1.38797e+00 0.00000e+00 0.00000e+00 9.19113e+01 192.259 2.94278e+01 12.259  0.9200 
1 1 1 -11 18  12 o 1  5.53275e+00 1.16528e+00 5.44458e+01 135.632 -2.17778e+00 2.13029e+00  0.00000e+00 0.00000e+00 1.14502e+02 135.632 6.00560e+01 135.632 0.8134 
1 1 1 -11 18  13 o 1  3.38354e+00 1.04304e+00 6.35229e+01 355.727 2.64911e+00  -1.97924e-01 0.00000e+00 0.00000e+00 3.55659e+01 355.727 2.79571e+01 175.727 0.7810 
1 1 1 -11 18  14 o 14 9.54544e+00 9.93957e-01 1.99995e+02 143.118 -2.26579e+01 1.70010e+01  0.00000e+00 0.00000e+00 1.51115e+02 143.118 4.88800e+01 323.118 0.9822 
1 1 1 -11 18  15 o 11 3.96405e+00 1.08495e+00 9.88854e+01 308.163 3.59903e+00  -4.57960e+00 0.00000e+00 0.00000e+00 3.59604e+01 308.163 6.29250e+01 128.163 0.9095 
1 1 1 -11 18  16 o 19 5.92629e+00 1.17982e+00 9.19953e+01 254.529 -2.22396e+00 -8.03516e+00 0.00000e+00 0.00000e+00 1.15610e+02 254.529 2.36142e+01 254.529 0.9380 
1 1 1 -11 18  17 o 3  6.92457e+00 1.03491e+00 5.86879e+01 164.907 -7.63689e+00 2.05955e+00  0.00000e+00 0.00000e+00 1.82634e+02 164.907 1.23946e+02 164.907 0.9345 
1 1 1 -11 18  18 o 2  4.09821e+00 1.22311e+00 9.99824e+01 305.879 4.52215e+00  -6.25196e+00 0.00000e+00 0.00000e+00 4.23628e+01 305.879 5.76195e+01 125.879 0.9327 
1 1 1 -11 19  1  o 14 2.35386e+01 7.51986e-01 4.67675e+02 146.179 -2.92336e+01 1.95859e+01  0.00000e+00 0.00000e+00 4.11429e+02 146.179 5.62460e+01 326.179 0.9857 
1 1 1 -11 19  2  o 18 2.09994e+01 7.48119e-01 3.02694e+02 239.322 -1.00240e+01 -1.68974e+01 0.00000e+00 0.00000e+00 4.72030e+02 239.322 1.69337e+02 239.322 0.9742 
1 1 1 -11 19  3  o 9  3.03349e+01 8.07085e-01 3.12588e+02 83.474  3.40362e+00  2.97544e+01  0.00000e+00 0.00000e+00 8.16158e+02 83.474  5.03570e+02 83.474  0.9832 
1 1 1 -11 19  4  o 11 2.13099e+01 7.75824e-01 2.79819e+02 23.976  1.91401e+01  8.51207e+00  0.00000e+00 0.00000e+00 5.06684e+02 23.976  2.26865e+02 23.976  0.9758 
1 1 1 -11 19  5  o 17 1.72473e+01 8.00407e-01 2.63440e+02 151.042 -1.67683e+01 9.27857e+00  0.00000e+00 0.00000e+00 3.71178e+02 151.042 1.07738e+02 151.042 0.9736 
1 1 1 -11 19  6  o 13 1.46582e+01 8.60627e-01 2.89845e+02 319.113 1.51107e+01  -1.30833e+01 0.00000e+00 0.00000e+00 2.49695e+02 319.113 4.01498e+01 139.113 0.9747 
1 1 1 -11 19  7  o 4  6.15464e+00 1.26612e+00 5.09850e+01 250.365 -5.53930e-01 -1.55261e+00 0.00000e+00 0.00000e+00 9.54984e+01 250.365 4.45135e+01 250.365 0.6307 
1 1 1 -11 19  8  o 3  6.09612e+00 1.34136e+00 8.46154e+01 222.100 -2.21696e+00 -2.00319e+00 0.00000e+00 0.00000e+00 1.01330e+02 222.100 1.67151e+01 222.100 0.8091 
1 1 1 -11 19  9  o 2  1.01566e+01 1.23287e+00 9.99563e+01 294.795 3.02214e+00  -6.54194e+00 0.00000e+00 0.00000e+00 2.54943e+02 294.795 1.54987e+02 294.795 0.9278 
1 1 1 -11 19  10 o 17 1.59020e+01 7.83766e-01 3.04876e+02 78.845  8.20816e+00  4.16259e+01  0.00000e+00 0.00000e+00 2.86341e+02 78.845  1.85357e+01 258.845 0.9881 
1 1 1 -11 19  11 o 18 1.95952e+01 7.83661e-01 2.80101e+02 173.395 -5.85101e+01 6.77475e+00  0.00000e+00 0.00000e+00 4.50085e+02 173.395 1.69984e+02 173.395 0.9915 
1 1 1 -11 19  12 o 1  4.82707e+00 1.05579e+00 1.48751e+02 259.524 -1.50088e+00 -8.11679e+00 0.00000e+00 0.00000e+00 2.11019e+01 259.524 1.27649e+02 79.524  0.9373 
1 1 1 -11 19  13 o 15 6.36268e+00 1.14961e+00 7.13532e+01 51.993  3.27563e+00  4.19163e+00  0.00000e+00 0.00000e+00 1.43435e+02 51.993  7.20820e+01 51.993  0.9003 
1 1 1 -11 19  14 o 18 3.37086e+00 1.05561e+00 4.16216e+00 36.958  1.60600e-01  1.20838e-01  0.00000e+00 0.00000e+00 8.45954e+00 36.958  4.29738e+00 36.958  0.1000 
1 1 1 -11 19  15 o 8  6.24507e+00 1.14482e+00 9.25387e+01 61.718  3.92047e+00  7.28664e+00  0.00000e+00 0.00000e+00 1.26412e+02 61.718  3.38736e+01 61.718  0.9375 
1 1 1 -11 19  16 o 3  4.24271e+00 1.08342e+00 3.20176e+01 68.575  8.08596e-01  2.06066e+00  0.00000e+00 0.00000e+00 8.36373e+01 68.575  5.16196e+01 68.575  0.7299 
1 1 1 -11 19  17 o 2  3.80807e+00 1.05446e+00 3.06982e+01 26.671  2.00196e+00  1.00562e+00  0.00000e+00 0.00000e+00 7.34735e+01 26.671  4.27753e+01 26.671  0.7335 
1 1 1 -11 19  18 o 15 3.46812e+00 1.07977e+00 4.69625e+01 143.691 -3.08760e+00 2.26882e+00  0.00000e+00 0.00000e+00 6.36728e+01 143.691 1.67104e+01 143.691 0.8567 
1 1 1 -11 20  1  o 8  1.56499e+01 7.72035e-01 3.26428e+02 311.340 1.04163e+01  -1.18399e+01 0.00000e+00 0.00000e+00 2.47390e+02 311.340 7.90377e+01 131.340 0.9678 
1 1 1 -11 20  2  o 8  2.83340e+01 7.84529e-01 4.19249e+02 29.892  3.16659e+01  1.82030e+01  0.00000e+00 0.00000e+00 6.38894e+02 29.892  2.19645e+02 29.892  0.9862 
1 1 1 -11 20  3  o 11 3.67686e+01 8.76373e-01 5.30257e+02 260.273 -1.06634e+01 -6.22039e+01 0.00000e+00 0.00000e+00 8.50175e+02 260.273 3.19918e+02 260.273 0.9920 
1 1 1 -11 20  4  o 8  3.07722e+01 8.12935e-01 5.31242e+02 95.712  -5.54410e+00 5.54243e+01  0.00000e+00 0.00000e+00 6.22068e+02 95.712  9.08253e+01 95.712  0.9910 
1 1 1 -11 20  5  o 1  1.73642e+01 7.98438e-01 1.89084e+02 199.570 -1.30247e+01 -4.63025e+00 0.00000e+00 0.00000e+00 4.42956e+02 199.570 2.53872e+02 199.570 0.9631 
1 1 1 -11 20  6  o 13 2.33116e+01 7.86641e-01 3.80648e+02 324.658 3.43732e+01  -2.43753e+01 0.00000e+00 0.00000e+00 4.89166e+02 324.658 1.08518e+02 324.658 0.9881 
1 1 1 -11 20  7  o 8  1.88284e+01 8.26294e-01 2.75627e+02 310.018 1.92563e+01  -2.29340e+01 0.00000e+00 0.00000e+00 4.22835e+02 310.018 1.47208e+02 310.018 0.9832 
1 1 1 -11 20  8  f 0  1.80447e+01 8.11313e-01 3.12167e+02 334.257 3.35157e+01  -1.61607e+01 0.00000e+00 0.00000e+00 3.58872e+02 334.257 4.67048e+01 334.257 0.9865 
1 1 1 -11 20  9  o 11 1.14009e+01 9.77554e-01 1.99883e+02 349.702 1.71838e+01  -3.12204e+00 0.00000e+00 0.00000e+00 2.17010e+02 349.702 1.71277e+01 349.702 0.9709 
1 1 1 -11 20  10 o 6  6.07809e+00 1.27233e+00 7.83135e+01 332.791 3.32695e+00  -1.71048e+00 0.00000e+00 0.00000e+00 1.16692e+02 332.791 3.83786e+01 332.791 0.8528 
1 1 1 -11 20  11 o 1  9.56450e+00 1.00723e+00 2.89522e+02 295.325 1.17493e+01  -2.48282e+01 0.00000e+00 0.00000e+00 6.33256e+01 295.325 2.26197e+02 115.325 0.9816 
1 1 1 -11 20  12 f 0  8.02951e+00 1.07895e+00 1.02011e+02 231.376 -5.81062e+00 -7.27263e+00 0.00000e+00 0.00000e+00 1.82726e+02 231.376 8.07153e+01 231.376 0.9447 
1 1 1 -11 20  13 o 16 9.98522e+00 9.53050e-01 1.78776e+02 259.251 -4.22604e+00 -2.22605e+01 0.00000e+00 0.00000e+00 1.87249e+02 259.251 8.47269e+00 259.251 0.9777 
1 1 1 -11 20  14 o 13 7.35283e+00 1.12875e+00 1.22547e+02 151.726 -1.08932e+01 5.85897e+00  0.00000e+00 0.00000e+00 1.41412e+02 151.726 1.88647e+01 151.726 0.9587 
1 1 1 -11 20  15 o 12 7.67543e+00 1.03148e+00 1.47577e+02 172.924 -1.75796e+01 2.18207e+00  0.00000e+00 0.00000e+00 1.31233e+02 172.924 1.63437e+01 352.924 0.9714 
1 1 1 -11 20  16 o 3  4.87041e+00 1.15140e+00 1.14735e+02 352.594 8.97000e+00  -1.16594e+00 0.00000e+00 0.00000e+00 5.67783e+01 352.594 5.79567e+01 172.594 0.9430 
1 1 1 -11 20  17 o 9  3.62599e+00 9.95072e-01 2.98084e+01 105.214 -5.68836e-01 2.09165e+00  0.00000e+00 0.00000e+00 6.80144e+01 105.214 3.82060e+01 105.214 0.7235 
1 1 1 -11 20  18 o 6  3.21071e+00 1.05633e+00 3.31643e+01 142.148 -2.02113e+00 1.57071e+00  0.00000e+00 0.00000e+00 5.90470e+01 142.148 2.58828e+01 142.148 0.7713 
1 1 1 -11 21  1  o 14 1.24685e+01 8.79257e-01 3.77363e+02 103.819 -3.42659e+00 1.39308e+01  0.00000e+00 0.00000e+00 7.82394e+01 103.819 2.99124e+02 283.819 0.9645 
1 1 1 -11 21  2  o 1  2.54888e+01 7.49179e-01 6.33055e+02 192.813 -5.00741e+01 -1.13885e+01 0.00000e+00 0.00000e+00 3.22639e+02 192.813 3.10417e+02 12.813  0.9902 
1 1 1 -11 21  3  o 2  1.95432e+01 7.59332e-01 3.07624e+02 177.759 -1.96348e+01 7.68205e-01  0.00000e+00 0.00000e+00 4.12870e+02 177.759 1.05246e+02 177.759 0.9742 
1 1 1 -11 21  4  o 13 2.15540e+01 8.72433e-01 3.04968e+02 241.154 -1.07172e+01 -1.94572e+01 0.00000e+00 0.00000e+00 4.91593e+02 241.154 1.86626e+02 241.154 0.9772 
1 1 1 -11 21  5  o 16 2.27953e+01 7.89155e-01 4.74914e+02 187.013 -4.51539e+01 -5.55469e+00 0.00000e+00 0.00000e+00 3.77014e+02 187.013 9.78997e+01 7.013   0.9889 
1 1 1 -11 21  6  o 16 2.31483e+01 7.80278e-01 4.46151e+02 289.981 1.64114e+01  -4.51366e+01 0.00000e+00 0.00000e+00 4.18807e+02 289.981 2.73435e+01 109.981 0.9895 
1 1 1 -11 21  7  o 12 2.22002e+01 7.92843e-01 4.08769e+02 302.059 2.68920e+01  -4.29385e+01 0.00000e+00 0.00000e+00 4.20523e+02 302.059 1.17539e+01 302.059 0.9901 
1 1 1 -11 21  8  o 6  2.38492e+01 7.97833e-01 4.17690e+02 114.006 -2.77352e+01 6.22764e+01  0.00000e+00 0.00000e+00 4.74698e+02 114.006 5.70079e+01 114.006 0.9926 
1 1 1 -11 21  9  o 14 1.77510e+01 8.12357e-01 2.72361e+02 135.191 -2.60158e+01 2.58433e+01  0.00000e+00 0.00000e+00 3.86949e+02 135.191 1.14588e+02 135.191 0.9863 
1 1 1 -11 21  10 o 1  1.78556e+01 7.63990e-01 3.12531e+02 312.273 3.47822e+01  -3.82610e+01 0.00000e+00 0.00000e+00 3.52681e+02 312.273 4.01501e+01 312.273 0.9903 
1 1 1 -11 21  11 o 19 4.41260e+00 1.17369e+00 4.51460e+01 54.774  1.01205e+00  1.43328e+00  0.00000e+00 0.00000e+00 6.31485e+01 54.774  1.80025e+01 54.774  0.6531 
1 1 1 -11 21  12 o 2  5.68141e+00 1.21823e+00 1.16764e+02 106.732 -1.96372e+00 6.53207e+00  0.00000e+00 0.00000e+00 8.01784e+01 106.732 3.65854e+01 286.732 0.9235 
1 1 1 -11 21  13 o 11 3.81253e+00 1.11340e+00 6.41609e+01 62.274  1.33796e+00  2.54564e+00  0.00000e+00 0.00000e+00 5.02419e+01 62.274  1.39190e+01 242.274 0.8004 
1 1 1 -11 21  14 o 18 3.97852e+00 1.12804e+00 5.96153e+01 112.773 -1.18079e+00 2.81273e+00  0.00000e+00 0.00000e+00 6.15960e+01 112.773 1.98075e+00 112.773 0.8137 
1 1 1 -11 21  15 o 2  3.50411e+00 1.03826e+00 6.40254e+01 76.492  8.15460e-01  3.39467e+00  0.00000e+00 0.00000e+00 4.61273e+01 76.492  1.78981e+01 256.492 0.8406 
1 1 1 -11 21  16 o 7  1.21974e+01 7.75926e-01 1.83588e+02 339.123 4.33033e+01  -1.65157e+01 0.00000e+00 0.00000e+00 2.66951e+02 339.123 8.33630e+01 339.123 0.9892 
1 1 1 -11 21  17 o 12 4.44283e+00 1.07258e+00 1.23519e+02 155.971 -9.47500e+00 4.22431e+00  0.00000e+00 0.00000e+00 3.39474e+01 155.971 8.95712e+01 335.971 0.9505 
1 1 1 -11 21  18 o 3  7.87166e+00 1.87754e+00 8.30302e+01 301.799 3.93800e+00  -6.35146e+00 0.00000e+00 0.00000e+00 1.89667e+02 301.799 1.06636e+02 301.799 0.9305 
1 1 1 -11 22  1  o 1  1.46192e+01 8.04378e-01 3.49935e+02 163.558 -1.55454e+01 4.58758e+00  0.00000e+00 0.00000e+00 1.86520e+02 163.558 1.63414e+02 343.558 0.9686 
1 1 1 -11 22  2  o 13 2.39006e+01 7.44587e-01 3.90648e+02 252.859 -8.73885e+00 -2.83332e+01 0.00000e+00 0.00000e+00 4.98906e+02 252.859 1.08258e+02 252.859 0.9830 
1 1 1 -11 22  3  o 12 2.69951e+01 7.52183e-01 4.89736e+02 242.925 -2.12597e+01 -4.15892e+01 0.00000e+00 0.00000e+00 5.20777e+02 242.925 3.10412e+01 242.925 0.9892 
1 1 1 -11 22  4  o 10 1.98418e+01 7.38181e-01 2.33941e+02 147.857 -1.52685e+01 9.59379e+00  0.00000e+00 0.00000e+00 4.95279e+02 147.857 2.61338e+02 147.857 0.9719 
1 1 1 -11 22  5  o 3  4.61485e+01 1.03217e+00 6.76842e+02 174.560 -1.25965e+02 1.19952e+01  0.00000e+00 0.00000e+00 1.06013e+03 174.560 3.83291e+02 174.560 0.9960 
1 1 1 -11 22  6  o 10 2.46945e+01 9.39245e-01 3.58614e+02 306.858 2.40674e+01  -3.21037e+01 0.00000e+00 0.00000e+00 5.62132e+02 306.858 2.03518e+02 306.858 0.9875 
1 1 1 -11 22  7  o 19 8.10458e+00 1.14002e+00 1.41217e+02 182.040 -5.95162e+00 -2.11997e-01 0.00000e+00 0.00000e+00 1.37535e+02 182.040 3.68169e+00 2.040   0.9117 
1 1 1 -11 22  8  o 13 1.29751e+01 9.42120e-01 2.62927e+02 29.667  1.96198e+01  1.11761e+01  0.00000e+00 0.00000e+00 2.15192e+02 29.667  4.77349e+01 209.667 0.9776 
1 1 1 -11 22  9  o 1  1.29414e+01 9.05461e-01 1.66742e+02 251.307 -5.11917e+00 -1.51303e+01 0.00000e+00 0.00000e+00 3.05081e+02 251.307 1.38339e+02 251.307 0.9682 
1 1 1 -11 22  10 o 1  1.10996e+01 8.78296e-01 2.75640e+02 256.549 -6.46008e+00 -2.70094e+01 0.00000e+00 0.00000e+00 1.34324e+02 256.549 1.41316e+02 76.549  0.9818 
1 1 1 -11 22  11 o 8  9.90131e+00 9.73362e-01 2.36526e+02 102.545 -4.81683e+00 2.16467e+01  0.00000e+00 0.00000e+00 1.27054e+02 102.545 1.09472e+02 282.545 0.9772 
1 1 1 -11 22  12 o 11 4.96975e+00 1.19041e+00 5.55446e+01 223.610 -2.08000e+00 -1.98148e+00 0.00000e+00 0.00000e+00 9.37076e+01 223.610 3.81630e+01 223.610 0.8001 
1 1 1 -11 22  13 o 12 6.08288e+00 1.23123e+00 1.84213e+02 358.611 1.37608e+01  -3.33536e-01 0.00000e+00 0.00000e+00 3.53840e+01 358.611 1.48829e+02 178.611 0.9630 
1 1 1 -11 22  14 o 19 1.21226e+01 8.91717e-01 1.89594e+02 274.641 2.69915e+00  -3.32523e+01 0.00000e+00 0.00000e+00 2.57444e+02 274.641 6.78492e+01 274.641 0.9849 
1 1 1 -11 22  15 o 5  1.10982e+01 9.02481e-01 1.89201e+02 15.625  3.17753e+01  8.88671e+00  0.00000e+00 0.00000e+00 2.19446e+02 15.625  3.02454e+01 15.625  0.9847 
1 1 1 -11 22  16 o 16 4.75380e+00 1.06174e+00 4.52480e+01 352.361 3.64452e+00  -4.88787e-01 0.00000e+00 0.00000e+00 1.05606e+02 352.361 6.03582e+01 352.361 0.8498 
1 1 1 -11 22  17 o 11 3.38379e+00 9.53746e-01 5.95421e+01 145.922 -3.66466e+00 2.47911e+00  0.00000e+00 0.00000e+00 5.12419e+01 145.922 8.30024e+00 325.922 0.8781 
1 1 1 -11 22  18 o 4  5.72029e+00 1.68843e+00 4.76567e+01 344.548 3.50655e+00  -9.69260e-01 0.00000e+00 0.00000e+00 1.32937e+02 344.548 8.52805e+01 344.548 0.8480 
1 1 1 -11 23  1  o 15 2.49595e+01 7.44025e-01 4.17373e+02 294.524 1.37400e+01  -3.01158e+01 0.00000e+00 0.00000e+00 5.13722e+02 294.524 9.63492e+01 294.524 0.9848 
1 1 1 -11 23  2  o 12 2.49696e+01 7.40774e-01 4.59413e+02 0.110   3.76173e+01  7.20531e-02  0.00000e+00 0.00000e+00 4.73301e+02 0.110   1.38883e+01 0.110   0.9866 
1 1 1 -11 23  3  o 5  2.64088e+01 7.58521e-01 5.60702e+02 125.822 -3.05205e+01 4.22830e+01  0.00000e+00 0.00000e+00 4.28929e+02 125.822 1.31773e+02 305.822 0.9904 
1 1 1 -11 23  4  o 14 1.87660e+01 7.54047e-01 2.97558e+02 24.787  1.96179e+01  9.05940e+00  0.00000e+00 0.00000e+00 3.95426e+02 24.787  9.78680e+01 24.787  0.9766 
1 1 1 -11 23  5  o 9  2.21646e+01 7.62864e-01 5.46207e+02 186.244 -5.21703e+01 -5.70830e+00 0.00000e+00 0.00000e+00 2.83290e+02 186.244 2.62917e+02 6.244   0.9904 
1 1 1 -11 23  6  o 18 6.31283e+00 1.25331e+00 1.16227e+02 278.414 4.90133e-01  -3.31340e+00 0.00000e+00 0.00000e+00 8.22806e+01 278.414 3.39465e+01 98.414  0.8328 
1 1 1 -11 23  7  o 14 1.25343e+01 8.89783e-01 1.63409e+02 96.103  -1.20217e+00 1.12439e+01  0.00000e+00 0.00000e+00 2.88027e+02 96.103  1.24618e+02 96.103  0.9547 
1 1 1 -11 23  8  o 1  8.24292e+00 1.14348e+00 1.82618e+02 13.078  9.67471e+00  2.24747e+00  0.00000e+00 0.00000e+00 1.11984e+02 13.078  7.06344e+01 193.078 0.9482 
1 1 1 -11 23  9  o 12 1.56181e+01 7.98134e-01 2.72059e+02 272.132 1.30579e+00  -3.50771e+01 0.00000e+00 0.00000e+00 3.07596e+02 272.132 3.55371e+01 272.132 0.9857 
1 1 1 -11 23  10 o 6  8.43673e+00 1.01790e+00 1.11488e+02 167.071 -7.95374e+00 1.82585e+00  0.00000e+00 0.00000e+00 1.85736e+02 167.071 7.42482e+01 167.071 0.9366 
1 1 1 -11 23  11 o 3  1.00271e+01 9.71320e-01 1.23190e+02 143.024 -1.00715e+01 7.58281e+00  0.00000e+00 0.00000e+00 2.38315e+02 143.024 1.15125e+02 143.024 0.9595 
1 1 1 -11 23  12 o 1  1.14364e+01 8.81474e-01 1.87716e+02 338.987 2.53798e+01  -9.74895e+00 0.00000e+00 0.00000e+00 2.33550e+02 338.987 4.58336e+01 338.987 0.9814 
1 1 1 -11 23  13 o 2  4.94282e+00 1.22291e+00 1.04649e+02 22.652  5.88865e+00  2.45751e+00  0.00000e+00 0.00000e+00 6.54302e+01 22.652  3.92183e+01 202.652 0.9179 
1 1 1 -11 23  14 o 14 4.26019e+00 1.15778e+00 5.66075e+01 172.899 -3.28544e+00 4.09293e-01  0.00000e+00 0.00000e+00 7.58689e+01 172.899 1.92615e+01 172.899 0.8306 
1 1 1 -11 23  15 o 15 4.04906e+00 1.04203e+00 8.45878e+01 37.237  3.96351e+00  3.01254e+00  0.00000e+00 0.00000e+00 5.05883e+01 37.237  3.39995e+01 217.237 0.8929 
1 1 1 -11 23  16 o 19 3.09769e+00 9.75631e-01 3.90649e+01 139.407 -1.66227e+00 1.42438e+00  0.00000e+00 0.00000e+00 4.49630e+01 139.407 5.89810e+00 139.407 0.7265 
1 1 1 -11 23  17 o 18 5.53818e+00 9.54936e-01 7.03869e+01 269.184 -1.21718e-01 -8.54370e+00 0.00000e+00 0.00000e+00 1.23609e+02 269.184 5.32218e+01 269.184 0.9395 
1 1 1 -11 23  18 o 7  3.51794e+00 1.21722e+00 3.48801e+01 327.057 2.01360e+00  -1.30477e+00 0.00000e+00 0.00000e+00 6.38131e+01 327.057 2.89330e+01 327.057 0.7536 
1 1 1 -11 24  1  o 4  2.81512e+01 7.69820e-01 4.96260e+02 113.712 -1.83808e+01 4.18486e+01  0.00000e+00 0.00000e+00 5.58337e+02 113.712 6.20771e+01 113.712 0.9890 
1 1 1 -11 24  2  o 15 1.19104e+01 8.63864e-01 2.09920e+02 22.334  7.47402e+00  3.07045e+00  0.00000e+00 0.00000e+00 2.12084e+02 22.334  2.16333e+00 22.334  0.9359 
1 1 1 -11 24  3  o 17 2.81110e+01 8.53981e-01 3.84805e+02 169.744 -3.61196e+01 6.53570e+00  0.00000e+00 0.00000e+00 6.64205e+02 169.744 2.79401e+02 169.744 0.9863 
1 1 1 -11 24  4  o 11 1.98970e+01 9.09710e-01 3.01497e+02 254.376 -6.72437e+00 -2.40457e+01 0.00000e+00 0.00000e+00 4.35601e+02 254.376 1.34104e+02 254.376 0.9798 
1 1 1 -11 24  5  o 15 4.16692e+01 9.12546e-01 7.13336e+02 157.239 -1.21693e+02 5.10570e+01  0.00000e+00 0.00000e+00 8.55103e+02 157.239 1.41767e+02 157.239 0.9962 
1 1 1 -11 24  6  o 11 2.03619e+01 7.49494e-01 3.10126e+02 42.387  2.32546e+01  2.12249e+01  0.00000e+00 0.00000e+00 4.46313e+02 42.387  1.36187e+02 42.387  0.9840 
1 1 1 -11 24  7  o 6  1.80955e+01 7.63942e-01 3.30008e+02 246.556 -1.33836e+01 -3.08628e+01 0.00000e+00 0.00000e+00 3.42376e+02 246.556 1.23676e+01 246.556 0.9850 
1 1 1 -11 24  8  f 0  1.43102e+01 8.54555e-01 3.16338e+02 270.375 2.09931e-01  -3.21138e+01 0.00000e+00 0.00000e+00 2.14529e+02 270.375 1.01809e+02 90.375  0.9843 
1 1 1 -11 24  9  o 18 1.56474e+01 8.29742e-01 2.76240e+02 137.571 -2.60988e+01 2.38557e+01  0.00000e+00 0.00000e+00 3.04529e+02 137.571 2.82897e+01 137.571 0.9858 
1 1 1 -11 24  10 o 8  9.81377e+00 9.67540e-01 2.68948e+02 19.383  2.19862e+01  7.73504e+00  0.00000e+00 0.00000e+00 9.21768e+01 19.383  1.76771e+02 199.383 0.9783 
1 1 1 -11 24  11 f 0  3.40748e+00 1.02211e+00 6.95750e+01 285.377 6.28569e-01  -2.28564e+00 0.00000e+00 0.00000e+00 2.64652e+01 285.377 4.31098e+01 105.377 0.7501 
1 1 1 -11 24  12 o 13 3.53103e+00 1.04500e+00 5.49805e+01 194.784 -2.20921e+00 -5.83042e-01 0.00000e+00 0.00000e+00 4.30073e+01 194.784 1.19733e+01 14.784  0.7394 
1 1 1 -11 24  13 o 15 1.01018e+01 9.88549e-01 2.70501e+02 339.471 3.50783e+01  -1.31356e+01 0.00000e+00 0.00000e+00 1.03071e+02 339.471 1.67430e+02 159.471 0.9866 
1 1 1 -11 24  14 o 9  4.57652e+00 1.10815e+00 6.55840e+01 207.518 -3.56847e+00 -1.85904e+00 0.00000e+00 0.00000e+00 8.25195e+01 207.518 1.69355e+01 207.518 0.8644 
1 1 1 -11 24  15 o 1  7.10574e+00 1.10369e+00 1.31529e+02 327.359 1.19436e+01  -7.65042e+00 0.00000e+00 0.00000e+00 1.24592e+02 327.359 6.93675e+00 147.359 0.9641 
1 1 1 -11 24  16 o 16 4.34025e+00 1.10743e+00 6.61134e+01 271.642 1.38725e-01  -4.84035e+00 0.00000e+00 0.00000e+00 7.80408e+01 271.642 1.19275e+01 271.642 0.8896 
1 1 1 -11 24  17 o 1  5.61995e+00 8.82866e-01 9.58184e+01 88.525  3.29760e-01  1.28105e+01  0.00000e+00 0.00000e+00 1.05352e+02 88.525  9.53320e+00 88.525  0.9602 
1 1 1 -11 24  18 o 9  4.27683e+00 1.44502e+00 9.82600e+01 177.409 -6.72072e+00 3.04172e-01  0.00000e+00 0.00000e+00 4.85836e+01 177.409 4.96764e+01 357.409 0.9224 
1 1 1 -11 25  1  o 9  1.90154e+01 7.53591e-01 3.53762e+02 292.622 8.45728e+00  -2.02952e+01 0.00000e+00 0.00000e+00 3.49890e+02 292.622 3.87135e+00 112.622 0.9770 
1 1 1 -11 25  2  o 8  7.83139e+00 1.14725e+00 7.06285e+01 318.278 1.38710e+00  -1.23680e+00 0.00000e+00 0.00000e+00 1.28920e+02 318.278 5.82917e+01 318.278 0.6731 
1 1 1 -11 25  3  o 17 3.61101e+01 8.33947e-01 5.31867e+02 328.560 5.56046e+01  -3.39946e+01 0.00000e+00 0.00000e+00 8.23771e+02 328.560 2.91904e+02 328.560 0.9923 
1 1 1 -11 25  4  o 7  1.07051e+01 1.20605e+00 2.23882e+02 294.976 4.00423e+00  -8.59641e+00 0.00000e+00 0.00000e+00 1.58886e+02 294.976 6.49963e+01 114.976 0.9457 
1 1 1 -11 25  5  o 8  2.69116e+01 7.63651e-01 4.51550e+02 114.079 -2.24234e+01 5.01762e+01  0.00000e+00 0.00000e+00 5.55906e+02 114.079 1.04356e+02 114.079 0.9909 
1 1 1 -11 25  6  o 13 1.25449e+01 1.05764e+00 1.65344e+02 216.161 -8.48009e+00 -6.19767e+00 0.00000e+00 0.00000e+00 2.85105e+02 216.161 1.19762e+02 216.161 0.9511 
1 1 1 -11 25  7  o 11 9.12252e+00 9.87598e-01 1.49767e+02 247.359 -3.01939e+00 -7.23915e+00 0.00000e+00 0.00000e+00 1.71586e+02 247.359 2.18187e+01 247.359 0.9339 
1 1 1 -11 25  8  o 14 9.28690e+00 9.99283e-01 1.72200e+02 218.497 -8.62062e+00 -6.85643e+00 0.00000e+00 0.00000e+00 1.61499e+02 218.497 1.07009e+01 38.497  0.9535 
1 1 1 -11 25  9  o 14 1.68003e+01 7.87818e-01 2.15502e+02 102.010 -6.30781e+00 2.96495e+01  0.00000e+00 0.00000e+00 4.06503e+02 102.010 1.91001e+02 102.010 0.9834 
1 1 1 -11 25  10 o 4  1.09588e+01 8.67126e-01 1.73497e+02 232.356 -1.05607e+01 -1.36916e+01 0.00000e+00 0.00000e+00 2.26572e+02 232.356 5.30751e+01 232.356 0.9706 
1 1 1 -11 25  11 o 15 1.05227e+01 8.82910e-01 1.84968e+02 251.541 -6.78629e+00 -2.03309e+01 0.00000e+00 0.00000e+00 2.01037e+02 251.541 1.60696e+01 251.541 0.9764 
1 1 1 -11 25  12 o 6  6.88512e+00 1.14295e+00 1.90479e+02 77.672  3.16218e+00  1.44688e+01  0.00000e+00 0.00000e+00 5.90199e+01 77.672  1.31459e+02 257.672 0.9656 
1 1 1 -11 25  13 o 7  9.51250e+00 9.75731e-01 1.88689e+02 317.375 1.83299e+01  -1.68699e+01 0.00000e+00 0.00000e+00 1.60628e+02 317.375 2.80606e+01 137.375 0.9797 
1 1 1 -11 25  14 o 18 4.12598e+00 1.12696e+00 8.13112e+01 119.207 -2.16953e+00 3.88080e+00  0.00000e+00 0.00000e+00 5.44116e+01 119.207 2.68997e+01 299.207 0.8787 
1 1 1 -11 25  15 o 19 4.33263e+00 1.12228e+00 4.40794e+01 48.788  1.88542e+00  2.15277e+00  0.00000e+00 0.00000e+00 8.53733e+01 48.788  4.12940e+01 48.788  0.7992 
1 1 1 -11 25  16 o 17 4.45337e+00 1.07643e+00 8.26774e+01 5.161   6.31658e+00  5.70563e-01  0.00000e+00 0.00000e+00 6.98418e+01 5.161   1.28356e+01 185.161 0.9174 
1 1 1 -11 25  17 o 18 4.61693e+00 1.29620e+00 1.03427e+02 151.664 -7.14091e+00 3.85083e+00  0.00000e+00 0.00000e+00 5.77014e+01 151.664 4.57253e+01 331.664 0.9362 
1 1 1 -11 25  18 o 19 5.08972e+00 1.61985e+00 9.95011e+01 278.991 1.10552e+00  -6.98679e+00 0.00000e+00 0.00000e+00 7.59966e+01 278.991 2.35044e+01 98.991  0.9263 
1 1 1 -11 26  1  o 14 2.54247e+01 7.57356e-01 5.15524e+02 74.884  1.20556e+01  4.46307e+01  0.00000e+00 0.00000e+00 4.36923e+02 74.884  7.86005e+01 254.884 0.9891 
1 1 1 -11 26  2  o 6  2.34570e+01 7.37044e-01 4.09572e+02 254.220 -8.98062e+00 -3.17787e+01 0.00000e+00 0.00000e+00 4.64798e+02 254.220 5.52267e+01 254.220 0.9847 
1 1 1 -11 26  3  o 12 1.82626e+01 7.44349e-01 3.06896e+02 43.724  1.57169e+01  1.50318e+01  0.00000e+00 0.00000e+00 3.67911e+02 43.724  6.10147e+01 43.724  0.9767 
1 1 1 -11 26  4  o 18 1.87568e+01 7.24257e-01 4.42790e+02 172.365 -3.48813e+01 4.67582e+00  0.00000e+00 0.00000e+00 2.56173e+02 172.365 1.86616e+02 352.365 0.9857 
1 1 1 -11 26  5  o 13 1.94188e+01 7.44369e-01 3.86904e+02 82.587  4.63645e+00  3.56333e+01  0.00000e+00 0.00000e+00 3.36427e+02 82.587  5.04769e+01 262.586 0.9860 
1 1 1 -11 26  6  o 7  8.59992e+00 1.07346e+00 1.80512e+02 141.356 -6.10582e+00 4.88195e+00  0.00000e+00 0.00000e+00 1.22590e+02 141.356 5.79218e+01 321.356 0.9337 
1 1 1 -11 26  7  o 13 1.40030e+01 7.97476e-01 2.42867e+02 180.467 -2.06722e+01 -1.68669e-01 0.00000e+00 0.00000e+00 2.72353e+02 180.467 2.94859e+01 180.467 0.9755 
1 1 1 -11 26  8  o 7  7.44034e+00 1.09289e+00 9.68236e+01 236.069 -2.65487e+00 -3.94620e+00 0.00000e+00 0.00000e+00 1.51984e+02 236.069 5.51601e+01 236.069 0.8874 
1 1 1 -11 26  9  o 7  1.47729e+01 7.47908e-01 2.74705e+02 37.479  2.71742e+01  2.08358e+01  0.00000e+00 0.00000e+00 2.73271e+02 37.479  1.43425e+00 217.479 0.9853 
1 1 1 -11 26  10 o 7  1.14514e+01 9.10803e-01 1.59670e+02 335.775 1.64594e+01  -7.40559e+00 0.00000e+00 0.00000e+00 2.58894e+02 335.775 9.92245e+01 335.775 0.9719 
1 1 1 -11 26  11 o 10 1.23677e+01 8.46419e-01 2.02694e+02 333.771 2.50528e+01  -1.23432e+01 0.00000e+00 0.00000e+00 2.53537e+02 333.771 5.08427e+01 333.771 0.9819 
1 1 1 -11 26  12 o 19 3.78413e+00 1.08753e+00 3.03957e+01 232.410 -8.13006e-01 -1.05608e+00 0.00000e+00 0.00000e+00 4.79868e+01 232.410 1.75911e+01 232.410 0.5520 
1 1 1 -11 26  13 o 11 6.49759e+00 1.20337e+00 8.26061e+01 325.320 5.42059e+00  -3.75060e+00 0.00000e+00 0.00000e+00 1.41601e+02 325.320 5.89949e+01 325.320 0.9207 
1 1 1 -11 26  14 o 1  3.73315e+00 1.12039e+00 2.98862e+01 178.283 -1.58613e+00 4.75408e-02  0.00000e+00 0.00000e+00 5.63159e+01 178.283 2.64297e+01 178.283 0.6169 
1 1 1 -11 26  15 o 11 3.37200e+00 1.03772e+00 8.70762e+01 334.176 4.11972e+00  -1.99368e+00 0.00000e+00 0.00000e+00 2.41711e+01 334.176 6.29051e+01 154.176 0.8825 
1 1 1 -11 26  16 o 13 7.98929e+00 8.97959e-01 1.55068e+02 202.382 -2.33857e+01 -9.63052e+00 0.00000e+00 0.00000e+00 1.37218e+02 202.382 1.78503e+01 22.382  0.9800 
1 1 1 -11 26  17 o 1  4.22867e+00 1.17493e+00 3.45035e+01 199.792 -2.65646e+00 -9.55979e-01 0.00000e+00 0.00000e+00 9.09715e+01 199.792 5.64680e+01 199.792 0.7960 
1 1 1 -11 27  1  o 17 1.94544e+01 7.37426e-01 2.49521e+02 25.033  1.51203e+01  7.06122e+00  0.00000e+00 0.00000e+00 4.64802e+02 25.033  2.15280e+02 25.033  0.9696 
1 1 1 -11 27  2  o 18 1.38284e+01 8.13711e-01 1.48888e+02 314.020 4.86878e+00  -5.03830e+00 0.00000e+00 0.00000e+00 3.35581e+02 314.020 1.86692e+02 314.020 0.9256 
1 1 1 -11 27  3  o 5  3.98052e+01 8.80098e-01 5.88616e+02 313.042 6.09143e+01  -6.52257e+01 0.00000e+00 0.00000e+00 9.08664e+02 313.042 3.20048e+02 313.042 0.9944 
1 1 1 -11 27  4  o 19 1.82299e+01 8.67250e-01 2.77231e+02 154.913 -1.96085e+01 9.17963e+00  0.00000e+00 0.00000e+00 3.95805e+02 154.913 1.18574e+02 154.913 0.9766 
1 1 1 -11 27  5  o 13 8.27881e+00 1.08962e+00 2.21921e+02 58.210  4.37001e+00  7.05094e+00  0.00000e+00 0.00000e+00 7.13129e+01 58.210  1.50608e+02 238.210 0.9376 
1 1 1 -11 27  6  o 3  1.52374e+01 7.57170e-01 3.49638e+02 148.562 -2.65965e+01 1.62588e+01  0.00000e+00 0.00000e+00 2.16215e+02 148.562 1.33423e+02 328.562 0.9838 
1 1 1 -11 27  7  o 6  6.87291e+00 1.19195e+00 2.18095e+02 94.836  -7.03330e-01 8.31226e+00  0.00000e+00 0.00000e+00 2.50421e+01 94.836  1.93052e+02 274.836 0.9380 
1 1 1 -11 27  8  o 12 9.01352e+00 1.07562e+00 2.21135e+02 194.739 -1.27570e+01 -3.35604e+00 0.00000e+00 0.00000e+00 1.05361e+02 194.739 1.15774e+02 14.739  0.9613 
1 1 1 -11 27  9  o 9  1.04940e+01 8.72366e-01 2.21677e+02 356.778 1.99227e+01  -1.12165e+00 0.00000e+00 0.00000e+00 1.63332e+02 356.778 5.83443e+01 176.778 0.9746 
1 1 1 -11 27  10 o 6  8.04727e+00 1.03512e+00 1.05515e+02 71.964  2.44542e+00  7.50997e+00  0.00000e+00 0.00000e+00 1.77246e+02 71.964  7.17308e+01 71.964  0.9344 
1 1 1 -11 27  11 o 7  1.23265e+01 8.48376e-01 2.51364e+02 267.997 -1.26910e+00 -3.62874e+01 0.00000e+00 0.00000e+00 2.05259e+02 267.997 4.61048e+01 87.997  0.9861 
1 1 1 -11 27  12 o 13 9.22266e+00 9.68183e-01 1.48178e+02 327.360 1.45628e+01  -9.32768e+00 0.00000e+00 0.00000e+00 1.87716e+02 327.360 3.95382e+01 327.360 0.9706 
1 1 1 -11 27  13 o 17 5.02368e+00 1.11946e+00 1.36631e+02 86.875  4.77931e-01  8.75537e+00  0.00000e+00 0.00000e+00 4.05547e+01 86.875  9.60764e+01 266.875 0.9411 
1 1 1 -11 27  14 o 6  6.18349e+00 1.21567e+00 1.02601e+02 320.916 6.60653e+00  -5.36586e+00 0.00000e+00 0.00000e+00 1.14788e+02 320.916 1.21866e+01 320.916 0.9393 
1 1 1 -11 27  15 o 8  5.23210e+00 1.11191e+00 8.88375e+01 216.512 -5.82946e+00 -4.31554e+00 0.00000e+00 0.00000e+00 9.27045e+01 216.512 3.86698e+00 216.512 0.9283 
1 1 1 -11 27  16 o 16 4.41877e+00 1.08491e+00 5.04916e+01 26.377  3.42171e+00  1.69685e+00  0.00000e+00 0.00000e+00 9.07314e+01 26.377  4.02398e+01 26.377  0.8562 
1 1 1 -11 27  17 o 18 3.99830e+00 1.32832e+00 3.79019e+01 297.360 1.18281e+00  -2.28574e+00 0.00000e+00 0.00000e+00 7.72652e+01 297.360 3.93633e+01 297.360 0.7728 
1 1 1 -11 28  1  o 14 5.12164e+00 1.22110e+00 1.15209e+02 5.639   1.89707e+00  1.87306e-01  0.00000e+00 0.00000e+00 1.70165e+01 5.639   9.81926e+01 185.639 0.6818 
1 1 1 -11 28  2  o 17 7.49030e+00 1.17974e+00 1.60403e+02 171.220 -4.34254e+00 6.70698e-01  0.00000e+00 0.00000e+00 8.82544e+01 171.220 7.21481e+01 351.220 0.8771 
1 1 1 -11 28  3  o 18 2.05230e+01 7.34038e-01 3.86458e+02 91.481  -8.71668e-01 3.37187e+01  0.00000e+00 0.00000e+00 3.78228e+02 91.481  8.22992e+00 271.481 0.9851 
1 1 1 -11 28  4  o 19 1.87629e+01 7.35066e-01 3.46024e+02 318.345 2.10911e+01  -1.87620e+01 0.00000e+00 0.00000e+00 3.50538e+02 318.345 4.51338e+00 318.345 0.9821 
1 1 1 -11 28  5  o 4  2.02185e+01 7.26652e-01 4.02145e+02 41.160  2.86118e+01  2.50126e+01  0.00000e+00 0.00000e+00 3.51450e+02 41.160  5.06954e+01 221.160 0.9868 
1 1 1 -11 28  6  o 6  2.06062e+01 7.28849e-01 3.14381e+02 143.280 -2.93335e+01 2.18802e+01  0.00000e+00 0.00000e+00 4.52669e+02 143.280 1.38289e+02 143.280 0.9862 
1 1 1 -11 28  7  o 12 1.60888e+01 7.48589e-01 3.02102e+02 267.837 -1.22953e+00 -3.25508e+01 0.00000e+00 0.00000e+00 2.95249e+02 267.837 6.85303e+00 87.837  0.9845 
1 1 1 -11 28  8  o 17 2.06428e+01 7.45379e-01 3.61691e+02 140.257 -4.33228e+01 3.60218e+01  0.00000e+00 0.00000e+00 4.09149e+02 140.257 4.74576e+01 140.257 0.9911 
1 1 1 -11 28  9  o 9  1.09794e+01 8.68788e-01 2.68508e+02 55.049  1.44862e+01  2.07264e+01  0.00000e+00 0.00000e+00 1.36517e+02 55.049  1.31991e+02 235.049 0.9800 
1 1 1 -11 28  10 o 9  1.37960e+01 8.11994e-01 2.68179e+02 335.990 3.38197e+01  -1.50644e+01 0.00000e+00 0.00000e+00 2.43535e+02 335.990 2.46443e+01 155.990 0.9864 
1 1 1 -11 28  11 o 5  5.57142e+00 1.21786e+00 9.64155e+01 299.357 2.73733e+00  -4.86649e+00 0.00000e+00 0.00000e+00 9.30536e+01 299.357 3.36184e+00 119.357 0.9054 
1 1 1 -11 28  12 o 9  1.15323e+01 8.58312e-01 2.28799e+02 113.327 -1.32165e+01 3.06488e+01  0.00000e+00 0.00000e+00 1.97350e+02 113.327 3.14494e+01 293.327 0.9849 
1 1 1 -11 28  13 o 8  4.29249e+00 1.16196e+00 7.13294e+01 21.250  3.55937e+00  1.38415e+00  0.00000e+00 0.00000e+00 6.63933e+01 21.250  4.93610e+00 201.250 0.8562 
1 1 1 -11 28  14 o 1  3.16252e+00 1.00667e+00 8.25701e+01 173.340 -3.92592e+00 4.58417e-01  0.00000e+00 0.00000e+00 1.94193e+01 173.340 6.31508e+01 353.340 0.8617 
1 1 1 -11 28  15 o 2  3.40477e+00 1.02560e+00 7.65696e+01 88.094  1.42871e-01  4.29222e+00  0.00000e+00 0.00000e+00 3.46504e+01 88.094  4.19193e+01 268.093 0.8740 
1 1 1 -11 28  16 f 0  4.60785e+00 1.06816e+00 9.83960e+01 231.987 -4.82952e+00 -6.17867e+00 0.00000e+00 0.00000e+00 6.22186e+01 231.987 3.61774e+01 51.987  0.9339 
1 1 1 -11 28  17 o 1  3.48751e+00 1.20706e+00 4.35838e+01 311.240 1.89072e+00  -2.15674e+00 0.00000e+00 0.00000e+00 6.03682e+01 311.240 1.67844e+01 311.240 0.7997 
1 1 1 -11 29  1  o 3  1.18218e+01 8.89372e-01 7.87206e+01 320.853 2.75385e+00  -2.24174e+00 0.00000e+00 0.00000e+00 2.98952e+02 320.853 2.20231e+02 320.853 0.8437 
1 1 1 -11 29  2  o 1  8.24891e+00 1.66022e+00 9.39138e+01 79.871  4.93014e-01  2.75973e+00  0.00000e+00 0.00000e+00 1.54058e+02 79.871  6.01437e+01 79.871  0.7943 
1 1 1 -11 29  3  o 1  2.65112e+01 7.42806e-01 5.49719e+02 37.165  4.91471e+01  3.72568e+01  0.00000e+00 0.00000e+00 4.44823e+02 37.165  1.04896e+02 217.165 0.9919 
1 1 1 -11 29  4  o 17 1.89403e+01 7.31616e-01 3.30494e+02 222.464 -2.10020e+01 -1.92207e+01 0.00000e+00 0.00000e+00 3.72705e+02 222.464 4.22116e+01 222.464 0.9823 
1 1 1 -11 29  5  o 3  2.19822e+01 7.29373e-01 3.78375e+02 292.646 1.60513e+01  -3.84746e+01 0.00000e+00 0.00000e+00 4.41871e+02 292.646 6.34962e+01 292.646 0.9879 
1 1 1 -11 29  6  o 14 1.43932e+01 7.56527e-01 3.16533e+02 102.229 -5.41145e+00 2.49668e+01  0.00000e+00 0.00000e+00 2.15934e+02 102.229 1.00599e+02 282.229 0.9802 
1 1 1 -11 29  7  o 14 1.30356e+01 1.00525e+00 1.65522e+02 151.355 -1.23778e+01 6.76108e+00  0.00000e+00 0.00000e+00 3.08276e+02 151.355 1.42753e+02 151.355 0.9639 
1 1 1 -11 29  8  o 19 1.54221e+01 7.80833e-01 2.10808e+02 322.943 2.09838e+01  -1.58449e+01 0.00000e+00 0.00000e+00 3.59058e+02 322.943 1.48251e+02 322.943 0.9808 
1 1 1 -11 29  9  o 11 3.49365e+00 1.05512e+00 1.12071e+02 221.931 -2.35800e+00 -2.11800e+00 0.00000e+00 0.00000e+00 4.01064e+00 41.931  1.16082e+02 41.931  0.8218 
1 1 1 -11 29  10 o 8  4.93740e+00 1.16201e+00 7.65254e+01 243.942 -1.52741e+00 -3.12359e+00 0.00000e+00 0.00000e+00 7.93983e+01 243.942 2.87284e+00 243.942 0.8399 
1 1 1 -11 29  11 o 3  4.83742e+00 1.13010e+00 9.34878e+01 134.850 -3.44999e+00 3.46813e+00  0.00000e+00 0.00000e+00 6.83640e+01 134.850 2.51237e+01 314.850 0.8908 
1 1 1 -11 29  12 o 15 1.00493e+01 9.36844e-01 2.19736e+02 258.429 -5.41371e+00 -2.64415e+01 0.00000e+00 0.00000e+00 1.50224e+02 258.429 6.95126e+01 78.429  0.9813 
1 1 1 -11 29  13 o 7  6.37429e+00 1.16775e+00 9.80933e+01 126.459 -4.64061e+00 6.28078e+00  0.00000e+00 0.00000e+00 1.24895e+02 126.459 2.68012e+01 126.459 0.9336 
1 1 1 -11 29  14 o 8  3.16676e+00 9.99102e-01 6.38027e+01 106.025 -8.65077e-01 3.01189e+00  0.00000e+00 0.00000e+00 3.33055e+01 106.025 3.04971e+01 286.025 0.8194 
1 1 1 -11 29  15 o 12 8.20444e+00 1.07697e+00 1.19884e+02 219.815 -1.11445e+01 -9.29029e+00 0.00000e+00 0.00000e+00 1.75984e+02 219.815 5.60997e+01 219.815 0.9649 
1 1 1 -11 29  16 o 16 7.60739e+00 8.40975e-01 1.19180e+02 21.385  1.68447e+01  6.59626e+00  0.00000e+00 0.00000e+00 1.56780e+02 21.385  3.76004e+01 21.385  0.9720 
1 1 1 -11 29  17 o 2  5.87374e+00 1.66379e+00 3.37589e+01 113.619 -9.78540e-01 2.23773e+00  0.00000e+00 0.00000e+00 1.32294e+02 113.619 9.85348e+01 113.619 0.7586 
1 1 1 -11 30  1  f 0  1.49022e+01 7.89299e-01 1.75995e+02 46.626  7.63133e+00  8.07738e+00  0.00000e+00 0.00000e+00 3.62208e+02 46.626  1.86213e+02 46.626  0.9539 
1 1 1 -11 30  2  o 14 2.00071e+01 7.37476e-01 3.44308e+02 123.129 -1.60061e+01 2.45258e+01  0.00000e+00 0.00000e+00 3.99750e+02 123.129 5.54425e+01 123.129 0.9828 
1 1 1 -11 30  3  o 7  1.73770e+01 8.56736e-01 2.79274e+02 334.201 1.87543e+01  -9.06583e+00 0.00000e+00 0.00000e+00 3.61930e+02 334.201 8.26560e+01 334.201 0.9757 
1 1 1 -11 30  4  o 13 5.42965e+00 1.25250e+00 1.43918e+02 238.473 -1.79155e+00 -2.92042e+00 0.00000e+00 0.00000e+00 2.78721e+01 238.473 1.16046e+02 58.473  0.8372 
1 1 1 -11 30  5  o 5  1.41295e+01 7.86337e-01 3.26517e+02 53.384  1.36329e+01  1.83459e+01  0.00000e+00 0.00000e+00 1.95305e+02 53.384  1.31213e+02 233.384 0.9779 
1 1 1 -11 30  6  o 18 9.63673e+00 9.36299e-01 3.01677e+02 257.324 -3.49129e+00 -1.55222e+01 0.00000e+00 0.00000e+00 5.03675e+01 257.324 2.51310e+02 77.324  0.9680 
1 1 1 -11 30  7  o 12 1.38904e+01 7.79996e-01 2.39898e+02 65.444  9.50315e+00  2.07990e+01  0.00000e+00 0.00000e+00 2.72267e+02 65.444  3.23691e+01 65.444  0.9779 
1 1 1 -11 30  8  o 8  1.67524e+01 7.45064e-01 3.32270e+02 238.361 -2.37470e+01 -3.85407e+01 0.00000e+00 0.00000e+00 2.91813e+02 238.361 4.04567e+01 58.361  0.9889 
1 1 1 -11 30  9  o 2  1.14098e+01 8.04602e-01 1.51205e+02 13.103  1.46344e+01  3.40623e+00  0.00000e+00 0.00000e+00 2.63664e+02 13.103  1.12459e+02 13.103  0.9661 
1 1 1 -11 30  10 o 2  3.82067e+00 1.08804e+00 3.32276e+01 121.324 -6.06170e-01 9.96035e-01  0.00000e+00 0.00000e+00 3.88998e+01 121.324 5.67215e+00 121.324 0.5021 
1 1 1 -11 30  11 o 14 9.17886e+00 9.71023e-01 1.62571e+02 318.447 1.29329e+01  -1.14636e+01 0.00000e+00 0.00000e+00 1.72026e+02 318.447 9.45509e+00 318.447 0.9706 
1 1 1 -11 30  12 o 18 4.47100e+00 1.17041e+00 9.31014e+01 149.457 -4.05287e+00 2.39142e+00  0.00000e+00 0.00000e+00 5.55135e+01 149.457 3.75879e+01 329.457 0.8861 
1 1 1 -11 30  13 o 6  3.73129e+00 1.07385e+00 7.83008e+01 132.143 -2.57676e+00 2.84749e+00  0.00000e+00 0.00000e+00 4.15233e+01 132.143 3.67775e+01 312.143 0.8571 
1 1 1 -11 30  14 o 8  3.55697e+00 1.07295e+00 1.11989e+02 212.068 -5.00753e+00 -3.13727e+00 0.00000e+00 0.00000e+00 9.25808e+00 212.068 1.02731e+02 32.068  0.9109 
1 1 1 -11 30  15 o 2  9.35845e+00 9.71410e-01 2.16724e+02 227.601 -2.26337e+01 -2.47876e+01 0.00000e+00 0.00000e+00 1.27758e+02 227.601 8.89661e+01 47.601  0.9850 
1 1 1 -11 30  16 o 6  5.75986e+00 9.97068e-01 7.17090e+01 70.939  2.60294e+00  7.53336e+00  0.00000e+00 0.00000e+00 1.29267e+02 70.939  5.75582e+01 70.939  0.9350 
1 1 1 -11 30  17 o 15 6.65945e+00 1.70624e+00 1.31660e+02 12.202  1.06355e+01  2.29993e+00  0.00000e+00 0.00000e+00 1.04809e+02 12.202  2.68505e+01 192.202 0.9529 
1 1 1 -11 31  1  o 9  1.23133e+01 8.32136e-01 2.79912e+02 276.385 1.60980e+00  -1.43857e+01 0.00000e+00 0.00000e+00 1.69848e+02 276.385 1.10064e+02 96.385  0.9648 
1 1 1 -11 31  2  o 3  2.42830e+01 7.96308e-01 4.54139e+02 249.401 -1.63095e+01 -4.33936e+01 0.00000e+00 0.00000e+00 4.54723e+02 249.401 5.83395e-01 249.401 0.9892 
1 1 1 -11 31  3  o 2  1.46642e+01 7.65386e-01 2.85288e+02 343.096 1.73430e+01  -5.27034e+00 0.00000e+00 0.00000e+00 2.53730e+02 343.096 3.15580e+01 163.097 0.9720 
1 1 1 -11 31  4  o 5  1.08892e+01 8.32394e-01 1.35780e+02 245.670 -2.87304e+00 -6.35410e+00 0.00000e+00 0.00000e+00 2.44965e+02 245.670 1.09184e+02 245.670 0.9252 
1 1 1 -11 31  5  o 12 1.33465e+01 7.88366e-01 2.15735e+02 290.552 5.36636e+00  -1.43137e+01 0.00000e+00 0.00000e+00 2.71506e+02 290.552 5.57712e+01 290.552 0.9667 
1 1 1 -11 31  6  o 1  2.12731e+01 7.16099e-01 3.49929e+02 66.641  1.78668e+01  4.13694e+01  0.00000e+00 0.00000e+00 4.43839e+02 66.641  9.39103e+01 66.641  0.9888 
1 1 1 -11 31  7  f 0  1.47944e+01 7.65425e-01 2.92638e+02 208.098 -2.76858e+01 -1.47817e+01 0.00000e+00 0.00000e+00 2.56188e+02 208.098 3.64493e+01 28.098  0.9839 
1 1 1 -11 31  8  o 15 6.42079e+00 1.09924e+00 1.80885e+02 347.110 7.95597e+00  -1.82071e+00 0.00000e+00 0.00000e+00 4.56358e+01 347.110 1.35249e+02 167.110 0.9366 
1 1 1 -11 31  9  o 19 1.40771e+01 8.30090e-01 2.24893e+02 163.775 -2.76963e+01 8.05945e+00  0.00000e+00 0.00000e+00 2.95595e+02 163.775 7.07019e+01 163.775 0.9825 
1 1 1 -11 31  10 o 3  8.14536e+00 1.01289e+00 1.74940e+02 124.540 -7.61580e+00 1.10643e+01  0.00000e+00 0.00000e+00 1.19647e+02 124.540 5.52931e+01 304.540 0.9620 
1 1 1 -11 31  11 o 9  8.12541e+00 1.02723e+00 1.61127e+02 194.103 -1.36393e+01 -3.42672e+00 0.00000e+00 0.00000e+00 1.32950e+02 194.103 2.81766e+01 14.103  0.9638 
1 1 1 -11 31  12 o 12 1.42995e+01 7.95784e-01 2.78090e+02 116.658 -2.52608e+01 5.03163e+01  0.00000e+00 0.00000e+00 2.53502e+02 116.658 2.45883e+01 296.658 0.9911 
1 1 1 -11 31  13 o 3  3.26362e+00 1.01467e+00 4.91382e+01 307.671 1.37860e+00  -1.78559e+00 0.00000e+00 0.00000e+00 4.08068e+01 307.671 8.33138e+00 127.671 0.7356 
1 1 1 -11 31  14 o 18 6.27736e+00 1.19572e+00 1.96291e+02 107.520 -4.87998e+00 1.54581e+01  0.00000e+00 0.00000e+00 3.12269e+01 107.520 1.65064e+02 287.520 0.9686 
1 1 1 -11 31  15 o 17 7.33826e+00 1.09960e+00 8.54563e+01 87.130  4.79527e-01  9.56556e+00  0.00000e+00 0.00000e+00 1.74021e+02 87.130  8.85645e+01 87.130  0.9463 
1 1 1 -11 31  16 o 19 6.29678e+00 9.44035e-01 1.34410e+02 302.653 9.13937e+00  -1.42616e+01 0.00000e+00 0.00000e+00 9.35134e+01 302.653 4.08970e+01 122.653 0.9700 
1 1 1 -11 31  17 o 1  6.31712e+00 1.83611e+00 1.35718e+02 11.183  9.42926e+00  1.86416e+00  0.00000e+00 0.00000e+00 8.70647e+01 11.183  4.86530e+01 191.183 0.9465 
1 1 1 -11 32  1  o 5  1.46263e+01 7.95281e-01 2.28135e+02 359.025 1.40206e+01  -2.38633e-01 0.00000e+00 0.00000e+00 3.05424e+02 359.025 7.72897e+01 359.025 0.9637 
1 1 1 -11 32  2  o 2  1.09102e+01 9.00124e-01 1.53975e+02 251.233 -2.30503e+00 -6.78394e+00 0.00000e+00 0.00000e+00 2.28816e+02 251.233 7.48411e+01 251.233 0.9273 
1 1 1 -11 32  3  f 0  1.80378e+01 7.13791e-01 3.93228e+02 16.208  3.10423e+01  9.02362e+00  0.00000e+00 0.00000e+00 2.78191e+02 16.208  1.15038e+02 196.208 0.9844 
1 1 1 -11 32  4  o 8  2.25974e+01 7.20592e-01 4.77624e+02 166.913 -4.91848e+01 1.14340e+01  0.00000e+00 0.00000e+00 3.67780e+02 166.913 1.09844e+02 346.913 0.9900 
1 1 1 -11 32  5  o 5  1.28589e+01 7.84934e-01 2.59043e+02 359.584 1.94094e+01  -1.40842e-01 0.00000e+00 0.00000e+00 2.13838e+02 359.584 4.52047e+01 179.584 0.9739 
1 1 1 -11 32  6  o 1  1.42760e+01 7.62953e-01 2.59477e+02 242.507 -1.02402e+01 -1.96772e+01 0.00000e+00 0.00000e+00 2.66885e+02 242.507 7.40847e+00 242.507 0.9772 
1 1 1 -11 32  7  o 15 6.86081e+00 1.05864e+00 1.18932e+02 6.750   5.50021e+00  6.51012e-01  0.00000e+00 0.00000e+00 1.15025e+02 6.750   3.90669e+00 186.750 0.9045 
1 1 1 -11 32  8  f 0  2.21967e+01 6.90853e-01 3.38190e+02 42.942  4.65565e+01  4.33272e+01  0.00000e+00 0.00000e+00 4.91256e+02 42.942  1.53066e+02 42.942  0.9921 
1 1 1 -11 32  9  o 3  1.35856e+01 7.49808e-01 2.43456e+02 242.891 -1.41952e+01 -2.77293e+01 0.00000e+00 0.00000e+00 2.59485e+02 242.891 1.60290e+01 242.891 0.9838 
1 1 1 -11 32  10 o 9  9.98100e+00 8.48906e-01 1.42425e+02 60.255  7.40138e+00  1.29523e+01  0.00000e+00 0.00000e+00 2.19965e+02 60.255  7.75407e+01 60.255  0.9659 
1 1 1 -11 32  11 o 16 4.01065e+00 1.06154e+00 6.58138e+01 221.178 -2.10075e+00 -1.83763e+00 0.00000e+00 0.00000e+00 5.36518e+01 221.178 1.21620e+01 41.178  0.7933 
1 1 1 -11 32  12 o 13 8.26709e+00 1.02275e+00 1.74910e+02 334.737 1.66678e+01  -7.86572e+00 0.00000e+00 0.00000e+00 1.26630e+02 334.737 4.82798e+01 154.737 0.9725 
1 1 1 -11 32  13 o 6  7.60388e+00 1.09244e+00 7.72580e+01 346.740 7.70110e+00  -1.81483e+00 0.00000e+00 0.00000e+00 1.88933e+02 346.740 1.11675e+02 346.740 0.9345 
1 1 1 -11 32  14 o 3  7.35050e+00 1.12885e+00 1.14510e+02 34.436  1.01833e+01  6.98215e+00  0.00000e+00 0.00000e+00 1.49119e+02 34.436  3.46091e+01 34.436  0.9586 
1 1 1 -11 32  15 o 3  4.26316e+00 1.13655e+00 5.18241e+01 322.648 2.66184e+00  -2.03157e+00 0.00000e+00 0.00000e+00 8.08300e+01 322.648 2.90059e+01 322.648 0.8328 
1 1 1 -11 32  16 o 2  3.47416e+00 9.65864e-01 6.49294e+01 187.157 -4.37145e+00 -5.48938e-01 0.00000e+00 0.00000e+00 4.88199e+01 187.157 1.61094e+01 7.157   0.8775 
1 1 1 -11 32  17 o 13 6.23196e+00 2.98160e+00 2.13923e+02 36.446  5.57257e+00  4.11542e+00  0.00000e+00 0.00000e+00 7.88754e-01 36.446  2.13134e+02 216.446 0.9247 
1 1 1 -11 33  1  o 3  1.00739e+01 9.18642e-01 1.75379e+02 95.688  -7.44469e-01 7.47493e+00  0.00000e+00 0.00000e+00 1.79564e+02 95.688  4.18497e+00 95.688  0.9308 
1 1 1 -11 33  2  o 5  2.12846e+01 7.20908e-01 3.39242e+02 202.896 -2.89656e+01 -1.22335e+01 0.00000e+00 0.00000e+00 4.53078e+02 202.896 1.13836e+02 202.896 0.9840 
1 1 1 -11 33  3  o 9  1.22683e+01 7.86108e-01 1.22462e+02 274.547 5.66738e-01  -7.12650e+00 0.00000e+00 0.00000e+00 3.07605e+02 274.547 1.85143e+02 274.547 0.9272 
1 1 1 -11 33  4  o 17 1.03057e+01 8.89441e-01 2.60740e+02 173.518 -1.30579e+01 1.48372e+00  0.00000e+00 0.00000e+00 1.13530e+02 173.518 1.47210e+02 353.517 0.9612 
1 1 1 -11 33  5  o 5  2.72670e+01 7.69479e-01 4.82755e+02 285.281 1.94730e+01  -7.12741e+01 0.00000e+00 0.00000e+00 5.39779e+02 285.281 5.70245e+01 285.281 0.9932 
1 1 1 -11 33  6  o 18 1.58439e+01 7.34272e-01 2.44789e+02 149.400 -2.04825e+01 1.21133e+01  0.00000e+00 0.00000e+00 3.40267e+02 149.400 9.54774e+01 149.400 0.9788 
1 1 1 -11 33  7  o 6  6.17888e+00 1.02069e+00 1.08179e+02 322.902 3.64822e+00  -2.75896e+00 0.00000e+00 0.00000e+00 9.73634e+01 322.902 1.08160e+01 142.902 0.8825 
1 1 1 -11 33  8  o 3  6.96269e+00 1.01550e+00 1.68730e+02 283.483 2.15655e+00  -8.99413e+00 0.00000e+00 0.00000e+00 7.88888e+01 283.483 8.98416e+01 103.483 0.9443 
1 1 1 -11 33  9  o 7  7.56161e+00 1.03287e+00 1.74930e+02 40.516  8.68143e+00  7.41895e+00  0.00000e+00 0.00000e+00 9.68234e+01 40.516  7.81066e+01 220.516 0.9552 
1 1 1 -11 33  10 o 3  5.90883e+00 1.10817e+00 7.80647e+01 6.945   4.13192e+00  5.03327e-01  0.00000e+00 0.00000e+00 1.15046e+02 6.945   3.69816e+01 6.945   0.8695 
1 1 1 -11 33  11 o 2  1.08845e+01 9.20342e-01 1.96221e+02 31.348  2.22319e+01  1.35429e+01  0.00000e+00 0.00000e+00 2.04525e+02 31.348  8.30446e+00 31.348  0.9806 
1 1 1 -11 33  12 o 18 6.54156e+00 1.11807e+00 1.15709e+02 186.513 -8.95594e+00 -1.02247e+00 0.00000e+00 0.00000e+00 1.15585e+02 186.513 1.23140e-01 6.513   0.9428 
1 1 1 -11 33  13 o 19 7.69735e+00 1.10684e+00 1.07957e+02 72.930  3.07132e+00  1.00021e+01  0.00000e+00 0.00000e+00 1.66227e+02 72.930  5.82709e+01 72.930  0.9509 
1 1 1 -11 33  14 o 17 3.50816e+00 1.06866e+00 4.63490e+01 307.410 1.56372e+00  -2.04451e+00 0.00000e+00 0.00000e+00 5.50765e+01 307.410 8.72749e+00 307.410 0.7728 
1 1 1 -11 33  15 o 15 3.61776e+00 1.11226e+00 6.77036e+01 196.808 -3.65717e+00 -1.10475e+00 0.00000e+00 0.00000e+00 4.80290e+01 196.808 1.96745e+01 16.808  0.8562 
1 1 1 -11 33  16 o 15 4.07211e+00 1.05473e+00 8.12405e+01 120.352 -3.08008e+00 5.25985e+00  0.00000e+00 0.00000e+00 5.75928e+01 120.352 2.36477e+01 300.352 0.9138 
1 1 1 -11 33  17 o 9  4.23038e+00 2.15125e+00 6.38163e+01 289.122 7.90021e-01  -2.27861e+00 0.00000e+00 0.00000e+00 5.51800e+01 289.122 8.63626e+00 109.122 0.7550 
1 1 1 -11 34  1  o 12 4.56735e+00 1.19477e+00 7.68984e+01 44.967  1.05163e+00  1.05040e+00  0.00000e+00 0.00000e+00 2.55671e+01 44.967  5.13314e+01 224.966 0.5927 
1 1 1 -11 34  2  o 11 1.85349e+01 7.25684e-01 2.87701e+02 37.462  1.92476e+01  1.47492e+01  0.00000e+00 0.00000e+00 3.98826e+02 37.462  1.11125e+02 37.462  0.9792 
1 1 1 -11 34  3  o 14 1.85112e+01 8.25190e-01 2.02331e+02 245.527 -7.17606e+00 -1.57665e+01 0.00000e+00 0.00000e+00 4.76986e+02 245.527 2.74655e+02 245.527 0.9707 
1 1 1 -11 34  4  o 5  1.81107e+01 7.13580e-01 4.32792e+02 84.071  4.35797e+00  4.19633e+01  0.00000e+00 0.00000e+00 2.43285e+02 84.071  1.89507e+02 264.071 0.9881 
1 1 1 -11 34  5  o 7  8.72138e+00 9.41022e-01 2.22305e+02 183.802 -1.04951e+01 -6.97389e-01 0.00000e+00 0.00000e+00 9.08924e+01 183.802 1.31413e+02 3.802   0.9512 
1 1 1 -11 34  6  o 10 1.53650e+01 7.27183e-01 2.20573e+02 216.289 -1.83801e+01 -1.34962e+01 0.00000e+00 0.00000e+00 3.46205e+02 216.289 1.25633e+02 216.289 0.9778 
1 1 1 -11 34  7  o 11 4.51155e+00 1.13673e+00 8.74331e+01 55.561  1.45220e+00  2.11782e+00  0.00000e+00 0.00000e+00 4.38780e+01 55.561  4.35551e+01 235.561 0.7722 
1 1 1 -11 34  8  o 14 6.86615e+00 9.99890e-01 8.52629e+01 283.201 1.05497e+00  -4.49751e+00 0.00000e+00 0.00000e+00 1.43246e+02 283.201 5.79828e+01 283.201 0.8837 
1 1 1 -11 34  9  o 9  1.09562e+01 8.08199e-01 1.62146e+02 65.232  6.89164e+00  1.49369e+01  0.00000e+00 0.00000e+00 2.37319e+02 65.232  7.51729e+01 65.232  0.9691 
1 1 1 -11 34  10 o 7  1.22470e+01 8.16073e-01 1.68486e+02 226.294 -1.53676e+01 -1.60780e+01 0.00000e+00 0.00000e+00 2.81331e+02 226.294 1.12845e+02 226.294 0.9773 
1 1 1 -11 34  11 o 11 6.71491e+00 1.16536e+00 6.08492e+01 199.461 -4.05729e+00 -1.43366e+00 0.00000e+00 0.00000e+00 1.59546e+02 199.461 9.86967e+01 199.461 0.8742 
1 1 1 -11 34  12 o 18 3.67594e+00 1.08647e+00 9.73585e+01 237.611 -2.28502e+00 -3.60221e+00 0.00000e+00 0.00000e+00 2.29851e+01 237.611 7.43735e+01 57.611  0.8730 
1 1 1 -11 34  13 o 15 3.72463e+00 1.11704e+00 4.26162e+01 254.897 -5.72167e-01 -2.12004e+00 0.00000e+00 0.00000e+00 5.88679e+01 254.897 1.62517e+01 254.897 0.7275 
1 1 1 -11 34  14 o 15 9.68484e+00 1.29101e+00 1.47600e+02 250.357 -6.57759e+00 -1.84284e+01 0.00000e+00 0.00000e+00 2.05301e+02 250.357 5.77010e+01 250.357 0.9741 
1 1 1 -11 34  15 o 3  6.52005e+00 1.24889e+00 7.72324e+01 118.297 -3.44289e+00 6.39491e+00  0.00000e+00 0.00000e+00 1.48891e+02 118.297 7.16581e+01 118.297 0.9284 
1 1 1 -11 34  16 o 4  2.72037e+00 8.10260e-01 1.14808e+01 311.491 4.42289e-01  -5.00076e-01 0.00000e+00 0.00000e+00 2.06382e+01 311.491 9.15742e+00 311.491 0.3165 
1 1 1 -11 34  17 o 19 4.58917e+00 2.30119e+00 5.44061e+01 22.440  1.83293e+00  7.56964e-01  0.00000e+00 0.00000e+00 6.44032e+01 22.440  9.99709e+00 22.440  0.6950 
1 1 1 -11 35  1  o 6  1.69975e+01 8.34595e-01 3.27766e+02 287.713 8.02211e+00  -2.51163e+01 0.00000e+00 0.00000e+00 3.03182e+02 287.713 2.45843e+01 107.713 0.9808 
1 1 1 -11 35  2  o 3  1.54635e+01 7.44171e-01 2.59920e+02 318.375 1.43706e+01  -1.27699e+01 0.00000e+00 0.00000e+00 3.09558e+02 318.375 4.96388e+01 318.375 0.9736 
1 1 1 -11 35  3  o 12 8.10451e+00 9.96577e-01 1.25792e+02 159.973 -4.29629e+00 1.56605e+00  0.00000e+00 0.00000e+00 1.44556e+02 159.973 1.87641e+01 159.973 0.8824 
1 1 1 -11 35  4  o 9  1.90633e+01 7.19959e-01 3.52095e+02 95.326  -3.33900e+00 3.58183e+01  0.00000e+00 0.00000e+00 3.57984e+02 95.326  5.88881e+00 95.326  0.9860 
1 1 1 -11 35  5  o 16 1.59988e+01 7.44400e-01 2.32147e+02 296.585 9.40426e+00  -1.87919e+01 0.00000e+00 0.00000e+00 3.57260e+02 296.585 1.25113e+02 296.585 0.9759 
1 1 1 -11 35  6  o 7  1.79579e+01 7.20087e-01 3.36914e+02 158.792 -3.92319e+01 1.52236e+01  0.00000e+00 0.00000e+00 3.32371e+02 158.792 4.54293e+00 338.792 0.9880 
1 1 1 -11 35  7  o 14 3.97724e+00 1.09304e+00 1.45060e+02 241.640 -1.89536e+00 -3.51123e+00 0.00000e+00 0.00000e+00 1.56764e+01 61.640  1.60736e+02 61.640  0.8631 
1 1 1 -11 35  8  o 2  1.07393e+01 7.91547e-01 1.72201e+02 251.428 -5.16467e+00 -1.53712e+01 0.00000e+00 0.00000e+00 2.19514e+02 251.428 4.73123e+01 251.428 0.9687 
1 1 1 -11 35  9  o 10 9.05535e+00 8.61524e-01 1.28059e+02 184.566 -1.16027e+01 -9.26675e-01 0.00000e+00 0.00000e+00 1.97613e+02 184.566 6.95540e+01 184.566 0.9560 
1 1 1 -11 35  10 o 4  5.58089e+00 1.08997e+00 5.86786e+01 254.649 -8.43517e-01 -3.07272e+00 0.00000e+00 0.00000e+00 1.13904e+02 254.649 5.52251e+01 254.649 0.8229 
1 1 1 -11 35  11 o 13 1.80059e+01 7.46435e-01 3.37278e+02 320.126 6.22646e+01  -5.20127e+01 0.00000e+00 0.00000e+00 3.34475e+02 320.126 2.80299e+00 140.126 0.9938 
1 1 1 -11 35  12 o 13 1.08420e+01 1.13604e+00 1.34230e+02 222.443 -1.39160e+01 -1.27264e+01 0.00000e+00 0.00000e+00 2.61378e+02 222.443 1.27149e+02 222.443 0.9731 
1 1 1 -11 35  13 o 19 7.34011e+00 1.39573e+00 1.25406e+02 84.863  9.12273e-01  1.01468e+01  0.00000e+00 0.00000e+00 1.35629e+02 84.863  1.02235e+01 84.863  0.9496 
1 1 1 -11 35  14 o 16 4.42061e+00 1.27277e+00 4.57394e+01 303.325 1.46908e+00  -2.23431e+00 0.00000e+00 0.00000e+00 8.36733e+01 303.325 3.79339e+01 303.325 0.7827 
1 1 1 -11 35  15 o 3  1.15747e+01 1.01715e+00 2.15708e+02 54.223  2.44809e+01  3.39718e+01  0.00000e+00 0.00000e+00 2.11460e+02 54.223  4.24811e+00 234.223 0.9880 
1 1 1 -11 35  16 o 3  2.57899e+00 7.95612e-01 3.86664e+01 230.347 -1.38790e+00 -1.67455e+00 0.00000e+00 0.00000e+00 3.10329e+01 230.347 7.63347e+00 50.347  0.7245 
1 1 1 -11 35  17 o 4  4.76382e+00 2.35322e+00 5.35282e+01 290.142 6.72975e-01  -1.83480e+00 0.00000e+00 0.00000e+00 6.89303e+01 290.142 1.54021e+01 290.142 0.6901 
1 1 1 -11 36  1  o 9  7.96307e+00 1.10489e+00 1.23614e+02 203.406 -4.07285e+00 -1.76298e+00 0.00000e+00 0.00000e+00 1.41100e+02 203.406 1.74863e+01 203.406 0.8785 
1 1 1 -11 36  2  o 19 2.56322e+01 8.22560e-01 4.04500e+02 354.368 4.76807e+01  -4.70183e+00 0.00000e+00 0.00000e+00 5.54762e+02 354.368 1.50262e+02 354.368 0.9895 
1 1 1 -11 36  3  o 17 3.12623e+01 7.90035e-01 5.16094e+02 256.730 -1.83669e+01 -7.78814e+01 0.00000e+00 0.00000e+00 6.58163e+02 256.730 1.42069e+02 256.730 0.9937 
1 1 1 -11 36  4  o 2  2.53657e+01 7.20311e-01 4.30526e+02 65.433  2.67091e+01  5.84264e+01  0.00000e+00 0.00000e+00 5.20136e+02 65.433  8.96105e+01 65.433  0.9922 
1 1 1 -11 36  5  o 9  9.42103e+00 9.25958e-01 9.60113e+01 136.124 -3.79280e+00 3.64678e+00  0.00000e+00 0.00000e+00 2.23723e+02 136.124 1.27712e+02 136.124 0.8991 
1 1 1 -11 36  6  o 4  1.59518e+01 7.16837e-01 1.95770e+02 318.740 1.72142e+01  -1.51016e+01 0.00000e+00 0.00000e+00 3.92596e+02 318.740 1.96826e+02 318.740 0.9779 
1 1 1 -11 36  7  f 0  1.25753e+01 7.97220e-01 2.11650e+02 162.171 -2.03908e+01 6.55815e+00  0.00000e+00 0.00000e+00 2.51054e+02 162.171 3.94036e+01 162.171 0.9764 
1 1 1 -11 36  8  o 6  5.42942e+00 1.10029e+00 5.98114e+01 121.298 -1.34729e+00 2.21610e+00  0.00000e+00 0.00000e+00 9.85762e+01 121.298 3.87648e+01 121.298 0.7748 
1 1 1 -11 36  9  o 2  4.97333e+00 1.08556e+00 9.30427e+01 36.763  3.38413e+00  2.52829e+00  0.00000e+00 0.00000e+00 7.00141e+01 36.763  2.30286e+01 216.763 0.8716 
1 1 1 -11 36  10 o 13 4.83738e+00 1.24036e+00 5.47150e+01 6.151   2.50157e+00  2.69586e-01  0.00000e+00 0.00000e+00 8.46557e+01 6.151   2.99407e+01 6.151   0.7667 
1 1 1 -11 36  11 o 12 1.36329e+01 1.00994e+00 2.10852e+02 286.843 1.00162e+01  -3.30860e+01 0.00000e+00 0.00000e+00 2.93414e+02 286.843 8.25620e+01 286.843 0.9854 
1 1 1 -11 36  12 o 13 1.10990e+01 1.18786e+00 1.69161e+02 57.486  1.24520e+01  1.95353e+01  0.00000e+00 0.00000e+00 2.37890e+02 57.486  6.87290e+01 57.486  0.9782 
1 1 1 -11 36  13 o 14 4.43853e+00 1.27115e+00 4.71111e+01 46.799  1.69885e+00  1.80904e+00  0.00000e+00 0.00000e+00 7.97070e+01 46.799  3.25959e+01 46.799  0.7630 
1 1 1 -11 36  14 o 7  3.59402e+00 1.13634e+00 5.23575e+01 245.126 -1.16015e+00 -2.50234e+00 0.00000e+00 0.00000e+00 5.38840e+01 245.126 1.52659e+00 245.126 0.7904 
1 1 1 -11 36  15 o 3  8.35766e+00 1.18189e+00 1.86134e+02 190.149 -2.33680e+01 -4.18312e+00 0.00000e+00 0.00000e+00 1.19381e+02 190.149 6.67526e+01 10.149  0.9787 
1 1 1 -11 36  16 o 12 4.22928e+00 1.29593e+00 1.12772e+02 218.596 -5.69398e+00 -4.54475e+00 0.00000e+00 0.00000e+00 3.37093e+01 218.596 7.90624e+01 38.596  0.9286 
1 1 1 -11 36  17 o 12 4.97978e+00 2.44328e+00 6.02352e+01 134.619 -1.53160e+00 1.55213e+00  0.00000e+00 0.00000e+00 7.42870e+01 134.619 1.40519e+01 134.619 0.7253 
1 1 1 -11 37  1  o 10 1.09125e+01 9.68342e-01 2.49246e+02 181.882 -1.22692e+01 -4.03154e-01 0.00000e+00 0.00000e+00 1.46463e+02 181.882 1.02783e+02 1.882   0.9584 
1 1 1 -11 37  2  o 2  2.40356e+01 8.40435e-01 3.89990e+02 47.625  3.11729e+01  3.41685e+01  0.00000e+00 0.00000e+00 5.09087e+02 47.625  1.19098e+02 47.625  0.9891 
1 1 1 -11 37  3  o 1  3.21429e+01 9.06262e-01 5.26057e+02 240.981 -4.27287e+01 -7.70237e+01 0.00000e+00 0.00000e+00 6.81854e+02 240.981 1.55797e+02 240.981 0.9943 
1 1 1 -11 37  4  o 4  3.46100e+01 9.20365e-01 6.85613e+02 102.683 -2.84209e+01 1.26287e+02  0.00000e+00 0.00000e+00 6.16536e+02 102.683 6.90770e+01 282.683 0.9961 
1 1 1 -11 37  5  o 9  9.74507e+00 1.03442e+00 1.41749e+02 152.018 -7.05934e+00 3.75069e+00  0.00000e+00 0.00000e+00 2.02215e+02 152.018 6.04664e+01 152.018 0.9352 
1 1 1 -11 37  6  o 11 7.51258e+00 1.17362e+00 5.26609e+01 123.029 -1.40851e+00 2.16653e+00  0.00000e+00 0.00000e+00 1.66588e+02 123.029 1.13927e+02 123.029 0.7738 
1 1 1 -11 37  7  o 7  2.44812e+01 8.48580e-01 4.47005e+02 197.028 -7.86946e+01 -2.41010e+01 0.00000e+00 0.00000e+00 4.69862e+02 197.028 2.28565e+01 197.028 0.9939 
1 1 1 -11 37  8  o 7  1.13716e+01 9.64339e-01 1.84880e+02 354.170 1.74231e+01  -1.77904e+00 0.00000e+00 0.00000e+00 2.30826e+02 354.170 4.59468e+01 354.170 0.9710 
1 1 1 -11 37  9  o 12 1.55613e+01 8.71057e-01 2.65633e+02 65.120  1.78441e+01  3.84768e+01  0.00000e+00 0.00000e+00 3.12708e+02 65.120  4.70750e+01 65.120  0.9881 
1 1 1 -11 37  10 o 9  9.95629e+00 1.14867e+00 2.28078e+02 194.350 -2.27676e+01 -5.82454e+00 0.00000e+00 0.00000e+00 1.37960e+02 194.350 9.01185e+01 14.350  0.9785 
1 1 1 -11 37  11 o 6  5.21769e+00 1.28693e+00 1.47443e+02 225.501 -5.66431e+00 -5.76416e+00 0.00000e+00 0.00000e+00 3.58376e+01 225.501 1.11606e+02 45.501  0.9359 
1 1 1 -11 37  12 o 6  5.51894e+00 1.36127e+00 1.24741e+02 301.296 4.02126e+00  -6.61481e+00 0.00000e+00 0.00000e+00 6.82919e+01 301.296 5.64493e+01 121.296 0.9330 
1 1 1 -11 37  13 o 13 4.21613e+00 1.24730e+00 8.78310e+01 305.095 2.76825e+00  -3.93949e+00 0.00000e+00 0.00000e+00 5.24989e+01 305.095 3.53321e+01 125.095 0.8889 
1 1 1 -11 37  14 o 8  4.22382e+00 1.23485e+00 1.00697e+02 302.088 2.93646e+00  -4.68335e+00 0.00000e+00 0.00000e+00 4.21481e+01 302.088 5.85490e+01 122.088 0.9043 
1 1 1 -11 37  15 o 16 7.34222e+00 1.23863e+00 1.13361e+02 265.226 -1.05415e+00 -1.26224e+01 0.00000e+00 0.00000e+00 1.49790e+02 265.226 3.64290e+01 265.226 0.9597 
1 1 1 -11 37  16 f 0  7.35229e+00 1.23200e+00 8.51862e+01 191.348 -1.02757e+01 -2.06229e+00 0.00000e+00 0.00000e+00 1.75587e+02 191.348 9.04011e+01 191.348 0.9510 
1 1 1 -11 37  17 o 8  4.16723e+00 1.38333e+00 8.35178e+01 307.640 3.49218e+00  -4.52813e+00 0.00000e+00 0.00000e+00 5.73561e+01 307.640 2.61617e+01 127.640 0.9077 
1 1 1 -11 38  1  o 2  9.40533e+00 1.00077e+00 9.77059e+01 188.088 -4.36361e+00 -6.20104e-01 0.00000e+00 0.00000e+00 2.14557e+02 188.088 1.16851e+02 188.088 0.8775 
1 1 1 -11 38  2  o 11 1.86437e+01 8.01348e-01 3.93589e+02 156.317 -3.57081e+01 1.56622e+01  0.00000e+00 0.00000e+00 3.02290e+02 156.317 9.12992e+01 336.317 0.9871 
1 1 1 -11 38  3  o 11 1.30350e+01 8.89035e-01 2.46535e+02 264.150 -1.87332e+00 -1.82826e+01 0.00000e+00 0.00000e+00 2.32473e+02 264.150 1.40613e+01 84.150  0.9724 
1 1 1 -11 38  4  o 7  2.65122e+01 8.31541e-01 4.76481e+02 70.486  2.35535e+01  6.64612e+01  0.00000e+00 0.00000e+00 5.17649e+02 70.486  4.11687e+01 70.486  0.9929 
1 1 1 -11 38  5  o 6  2.07089e+01 9.19126e-01 2.72287e+02 6.946   3.62392e+01  4.41504e+00  0.00000e+00 0.00000e+00 4.98462e+02 6.946   2.26176e+02 6.946   0.9862 
1 1 1 -11 38  6  o 7  9.66363e+00 1.03018e+00 2.32350e+02 265.023 -1.33025e+00 -1.52767e+01 0.00000e+00 0.00000e+00 1.19969e+02 265.023 1.12380e+02 85.023  0.9668 
1 1 1 -11 38  7  o 11 1.56130e+01 8.31851e-01 1.87811e+02 235.538 -1.35997e+01 -1.98155e+01 0.00000e+00 0.00000e+00 3.88080e+02 235.538 2.00270e+02 235.538 0.9790 
1 1 1 -11 38  8  o 11 9.94973e+00 9.84496e-01 1.54228e+02 28.534  1.17258e+01  6.37557e+00  0.00000e+00 0.00000e+00 2.06000e+02 28.534  5.17713e+01 28.534  0.9618 
1 1 1 -11 38  9  o 3  4.08205e+00 1.12989e+00 3.52817e+01 103.573 -3.05656e-01 1.26608e+00  0.00000e+00 0.00000e+00 4.81345e+01 103.573 1.28528e+01 103.573 0.5434 
1 1 1 -11 38  10 o 3  7.69406e+00 1.25818e+00 2.01266e+02 233.496 -9.38525e+00 -1.26818e+01 0.00000e+00 0.00000e+00 7.84754e+01 233.496 1.22791e+02 53.496  0.9678 
1 1 1 -11 38  11 o 13 4.48133e+00 1.16297e+00 8.35055e+01 344.258 4.14725e+00  -1.16904e+00 0.00000e+00 0.00000e+00 6.35529e+01 344.258 1.99526e+01 164.258 0.8744 
1 1 1 -11 38  12 o 16 3.89422e+00 1.11432e+00 7.86572e+01 203.377 -3.62370e+00 -1.56642e+00 0.00000e+00 0.00000e+00 4.70987e+01 203.377 3.15585e+01 23.377  0.8615 
1 1 1 -11 38  13 o 6  3.75633e+00 1.13518e+00 2.81464e+01 37.105  1.11215e+00  8.41276e-01  0.00000e+00 0.00000e+00 5.18691e+01 37.105  2.37227e+01 37.105  0.5690 
1 1 1 -11 38  14 o 8  4.71969e+00 1.30134e+00 1.14537e+02 193.184 -7.03912e+00 -1.64895e+00 0.00000e+00 0.00000e+00 4.92396e+01 193.184 6.52974e+01 13.184  0.9280 
1 1 1 -11 38  15 o 17 6.50285e+00 1.22640e+00 1.15450e+02 59.910  5.74120e+00  9.90802e+00  0.00000e+00 0.00000e+00 1.16527e+02 59.910  1.07661e+00 59.910  0.9553 
1 1 1 -11 38  16 o 8  1.00954e+01 1.23222e+00 1.72883e+02 149.454 -2.51511e+01 1.48423e+01  0.00000e+00 0.00000e+00 1.97083e+02 149.454 2.42002e+01 149.454 0.9827 
1 1 1 -11 38  17 o 4  3.87195e+00 1.32296e+00 4.35045e+01 153.251 -2.81692e+00 1.41980e+00  0.00000e+00 0.00000e+00 7.48361e+01 153.251 3.13315e+01 153.251 0.8208 
1 1 1 -11 39  1  o 4  2.26600e+01 9.17920e-01 4.39575e+02 213.340 -4.33011e+01 -2.84863e+01 0.00000e+00 0.00000e+00 4.09331e+02 213.340 3.02443e+01 33.340  0.9903 
1 1 1 -11 39  2  o 3  3.15863e+01 9.08351e-01 5.46403e+02 10.014  9.70149e+01  1.71313e+01  0.00000e+00 0.00000e+00 6.41774e+02 10.014  9.53709e+01 10.014  0.9949 
1 1 1 -11 39  3  o 19 1.08995e+01 1.00161e+00 1.86535e+02 189.861 -1.07696e+01 -1.87210e+00 0.00000e+00 0.00000e+00 2.06005e+02 189.861 1.94704e+01 189.861 0.9531 
1 1 1 -11 39  4  f 0  1.83126e+01 8.27564e-01 4.41514e+02 44.835  3.40267e+01  3.38311e+01  0.00000e+00 0.00000e+00 2.42759e+02 44.835  1.98755e+02 224.835 0.9895 
1 1 1 -11 39  5  o 12 1.33242e+01 8.63715e-01 2.63934e+02 91.013  -4.20140e-01 2.37588e+01  0.00000e+00 0.00000e+00 2.28156e+02 91.013  3.57779e+01 271.013 0.9787 
1 1 1 -11 39  6  o 10 1.62190e+01 8.34207e-01 2.80197e+02 161.569 -3.02893e+01 1.00939e+01  0.00000e+00 0.00000e+00 3.21691e+02 161.569 4.14937e+01 161.569 0.9842 
1 1 1 -11 39  7  o 11 6.16186e+00 1.15253e+00 5.47550e+01 248.157 -9.46624e-01 -2.36163e+00 0.00000e+00 0.00000e+00 1.23930e+02 248.157 6.91749e+01 248.157 0.7697 
1 1 1 -11 39  8  o 19 1.61697e+01 8.68640e-01 2.90582e+02 301.737 2.25133e+01  -3.63990e+01 0.00000e+00 0.00000e+00 3.10888e+02 301.737 2.03065e+01 301.737 0.9882 
1 1 1 -11 39  9  o 17 4.65688e+00 1.22131e+00 9.69422e+01 228.598 -2.59978e+00 -2.94872e+00 0.00000e+00 0.00000e+00 5.38004e+01 228.598 4.31418e+01 48.599  0.8608 
1 1 1 -11 39  10 o 11 1.22126e+01 9.55728e-01 1.64146e+02 111.161 -8.43609e+00 2.17929e+01  0.00000e+00 0.00000e+00 2.84694e+02 111.161 1.20548e+02 111.161 0.9784 
1 1 1 -11 39  11 o 19 8.68066e+00 1.23551e+00 1.49735e+02 249.895 -4.75431e+00 -1.29886e+01 0.00000e+00 0.00000e+00 1.63995e+02 249.895 1.42605e+01 249.895 0.9631 
1 1 1 -11 39  12 o 6  7.85370e+00 1.32392e+00 1.32502e+02 216.072 -9.59071e+00 -6.98646e+00 0.00000e+00 0.00000e+00 1.49174e+02 216.072 1.66722e+01 216.072 0.9569 
1 1 1 -11 39  13 o 2  8.67485e+00 1.27288e+00 1.34411e+02 339.031 1.41065e+01  -5.40630e+00 0.00000e+00 0.00000e+00 1.79401e+02 339.031 4.49901e+01 339.031 0.9663 
1 1 1 -11 39  14 o 18 2.97730e+00 9.91121e-01 5.01128e+01 113.231 -9.43885e-01 2.19895e+00  0.00000e+00 0.00000e+00 3.36907e+01 113.231 1.64221e+01 293.231 0.7528 
1 1 1 -11 39  15 o 12 5.69811e+00 1.13378e+00 1.31465e+02 180.864 -1.24069e+01 -1.87195e-01 0.00000e+00 0.00000e+00 7.25340e+01 180.864 5.89310e+01 0.864   0.9588 
1 1 1 -11 39  16 o 13 6.97873e+00 1.20072e+00 9.59056e+01 118.785 -5.80779e+00 1.05708e+01  0.00000e+00 0.00000e+00 1.53278e+02 118.785 5.73724e+01 118.785 0.9576 
1 1 1 -11 39  17 o 12 4.08033e+00 1.35570e+00 5.73090e+01 250.144 -1.41675e+00 -3.92319e+00 0.00000e+00 0.00000e+00 7.48326e+01 250.144 1.75236e+01 250.144 0.8698 
1 1 1 -11 40  1  f 0  1.02858e+01 9.50408e-01 1.66257e+02 138.803 -7.27587e+00 6.36896e+00  0.00000e+00 0.00000e+00 2.02104e+02 138.803 3.58467e+01 138.803 0.9468 
1 1 1 -11 40  2  o 19 9.89353e+00 1.00571e+00 1.32547e+02 335.586 6.65869e+00  -3.02247e+00 0.00000e+00 0.00000e+00 2.14873e+02 335.586 8.23259e+01 335.586 0.9289 
1 1 1 -11 40  3  o 10 1.27847e+01 9.11081e-01 1.97370e+02 310.086 8.94790e+00  -1.06311e+01 0.00000e+00 0.00000e+00 2.67949e+02 310.086 7.05789e+01 310.086 0.9633 
1 1 1 -11 40  4  o 8  1.14591e+01 9.26227e-01 1.94602e+02 90.038  -8.77221e-03 1.32185e+01  0.00000e+00 0.00000e+00 2.21367e+02 90.038  2.67653e+01 90.038  0.9614 
1 1 1 -11 40  5  o 10 1.75072e+01 8.10785e-01 2.86616e+02 29.262  3.14801e+01  1.76381e+01  0.00000e+00 0.00000e+00 3.64723e+02 29.262  7.81074e+01 29.262  0.9860 
1 1 1 -11 40  6  f 0  4.56454e+00 1.15547e+00 1.85320e+02 292.512 2.19939e+00  -5.30673e+00 0.00000e+00 0.00000e+00 2.90298e+01 112.512 2.14350e+02 112.512 0.9082 
1 1 1 -11 40  7  o 12 9.24887e+00 9.88363e-01 1.78628e+02 42.694  1.00884e+01  9.30738e+00  0.00000e+00 0.00000e+00 1.56832e+02 42.694  2.17963e+01 222.694 0.9629 
1 1 1 -11 40  8  o 6  2.07135e+01 8.49002e-01 3.71117e+02 297.005 3.20020e+01  -6.27941e+01 0.00000e+00 0.00000e+00 4.02897e+02 297.005 3.17806e+01 297.005 0.9929 
1 1 1 -11 40  9  o 8  1.37411e+01 9.01301e-01 2.92760e+02 38.957  3.22313e+01  2.60603e+01  0.00000e+00 0.00000e+00 2.17626e+02 38.957  7.51343e+01 218.957 0.9879 
1 1 1 -11 40  10 o 18 6.88199e+00 1.22037e+00 1.98821e+02 210.457 -1.16458e+01 -6.84808e+00 0.00000e+00 0.00000e+00 4.99146e+01 210.457 1.48906e+02 30.457  0.9622 
1 1 1 -11 40  11 o 6  1.19382e+01 1.03124e+00 2.21670e+02 190.560 -3.14442e+01 -5.86165e+00 0.00000e+00 0.00000e+00 2.19194e+02 190.560 2.47668e+00 10.560  0.9842 
1 1 1 -11 40  12 o 13 4.12413e+00 1.18515e+00 6.35570e+01 23.387  2.97554e+00  1.28684e+00  0.00000e+00 0.00000e+00 6.41707e+01 23.387  6.13699e-01 23.387  0.8264 
1 1 1 -11 40  13 o 14 3.63205e+00 1.08520e+00 2.61509e+01 18.989  1.29886e+00  4.46961e-01  0.00000e+00 0.00000e+00 5.04327e+01 18.989  2.42818e+01 18.989  0.5633 
1 1 1 -11 40  14 o 5  5.08801e+00 1.23671e+00 1.01191e+02 144.367 -6.01585e+00 4.31213e+00  0.00000e+00 0.00000e+00 7.56615e+01 144.367 2.55297e+01 324.367 0.9298 
1 1 1 -11 40  15 o 1  6.19622e+00 1.00188e+00 9.89495e+01 334.523 1.05117e+01  -5.00876e+00 0.00000e+00 0.00000e+00 1.22217e+02 334.523 2.32678e+01 334.523 0.9560 
1 1 1 -11 40  16 o 10 4.85445e+00 1.26849e+00 9.54783e+01 88.969  1.44996e-01  8.05805e+00  0.00000e+00 0.00000e+00 7.38786e+01 88.969  2.15997e+01 268.969 0.9357 
1 1 1 -11 40  17 o 15 3.48704e+00 1.21550e+00 8.34789e+01 191.432 -5.58685e+00 -1.12971e+00 0.00000e+00 0.00000e+00 3.43225e+01 191.432 4.91564e+01 11.432  0.9074 
1 1 1 -11 41  1  o 16 8.59378e+00 1.02820e+00 2.36513e+02 320.599 8.40306e+00  -6.90258e+00 0.00000e+00 0.00000e+00 7.31888e+01 320.599 1.63324e+02 140.599 0.9528 
1 1 1 -11 41  2  o 4  1.30743e+01 8.60867e-01 2.08077e+02 343.948 1.44088e+01  -4.14589e+00 0.00000e+00 0.00000e+00 2.69365e+02 343.948 6.12885e+01 343.948 0.9661 
1 1 1 -11 41  3  o 2  8.01458e+00 1.14367e+00 1.46379e+02 312.390 4.39140e+00  -4.81083e+00 0.00000e+00 0.00000e+00 1.32076e+02 312.390 1.43026e+01 132.390 0.9197 
1 1 1 -11 41  4  o 14 1.99436e+01 7.97500e-01 2.94676e+02 346.117 3.79172e+01  -9.37156e+00 0.00000e+00 0.00000e+00 4.48562e+02 346.117 1.53886e+02 346.117 0.9871 
1 1 1 -11 41  5  f 0  2.83504e+01 8.49410e-01 3.91559e+02 118.646 -3.80981e+01 6.97447e+01  0.00000e+00 0.00000e+00 6.71249e+02 118.646 2.79689e+02 118.646 0.9937 
1 1 1 -11 41  6  o 9  1.59843e+01 7.90526e-01 2.99042e+02 322.110 3.03862e+01  -2.36465e+01 0.00000e+00 0.00000e+00 2.95644e+02 322.110 3.39755e+00 142.110 0.9869 
1 1 1 -11 41  7  o 19 7.09766e+00 1.14313e+00 1.26850e+02 87.169  3.50211e-01  7.08260e+00  0.00000e+00 0.00000e+00 1.20847e+02 87.169  6.00290e+00 267.169 0.9265 
1 1 1 -11 41  8  o 2  9.90642e+00 1.00790e+00 1.84272e+02 197.092 -1.66745e+01 -5.12712e+00 0.00000e+00 0.00000e+00 1.77673e+02 197.092 6.59811e+00 17.092  0.9709 
1 1 1 -11 41  9  o 16 3.92521e+00 1.11069e+00 4.46449e+01 345.820 1.53015e+00  -3.86608e-01 0.00000e+00 0.00000e+00 4.60933e+01 345.820 1.44847e+00 345.820 0.6149 
1 1 1 -11 41  10 o 9  8.45885e+00 1.14991e+00 1.02079e+02 291.747 3.51929e+00  -8.82251e+00 0.00000e+00 0.00000e+00 1.98389e+02 291.747 9.63102e+01 291.747 0.9458 
1 1 1 -11 41  11 o 5  1.13474e+01 1.07043e+00 1.58804e+02 186.552 -2.22982e+01 -2.56103e+00 0.00000e+00 0.00000e+00 2.57313e+02 186.552 9.85083e+01 186.552 0.9775 
1 1 1 -11 41  12 o 15 5.83446e+00 1.18472e+00 9.32450e+01 345.746 6.52278e+00  -1.65703e+00 0.00000e+00 0.00000e+00 1.08421e+02 345.746 1.51762e+01 345.746 0.9224 
1 1 1 -11 41  13 o 1  3.91729e+00 1.12822e+00 1.08114e+01 274.903 5.19667e-02  -6.05830e-01 0.00000e+00 0.00000e+00 3.18231e+01 274.903 2.10117e+01 274.903 0.2908 
1 1 1 -11 41  14 o 4  7.39873e+00 1.17144e+00 1.20984e+02 96.567  -1.42779e+00 1.24017e+01  0.00000e+00 0.00000e+00 1.44264e+02 96.567  2.32794e+01 96.567  0.9591 
1 1 1 -11 41  15 o 16 4.51558e+00 1.06338e+00 4.75307e+01 25.867  3.35444e+00  1.62647e+00  0.00000e+00 0.00000e+00 9.61214e+01 25.867  4.85908e+01 25.867  0.8522 
1 1 1 -11 41  16 o 6  3.52680e+00 1.12505e+00 1.64559e+01 231.374 -7.31199e-01 -9.15103e-01 0.00000e+00 0.00000e+00 4.97837e+01 231.374 3.33278e+01 231.374 0.5038 
1 1 1 -11 41  17 o 6  5.47108e+00 1.74659e+00 6.30136e+01 231.038 -2.72569e+00 -3.37054e+00 0.00000e+00 0.00000e+00 1.15242e+02 231.038 5.22288e+01 231.038 0.8753 
1 1 1 -11 42  1  o 15 1.74217e+01 8.03756e-01 3.52666e+02 123.023 -1.88087e+01 2.89375e+01  0.00000e+00 0.00000e+00 2.96550e+02 123.023 5.61153e+01 303.023 0.9854 
1 1 1 -11 42  2  o 12 1.91979e+01 8.83352e-01 3.49625e+02 338.420 3.44950e+01  -1.36435e+01 0.00000e+00 0.00000e+00 3.66143e+02 338.420 1.65175e+01 338.420 0.9864 
1 1 1 -11 42  3  o 10 1.32311e+01 8.33395e-01 2.88260e+02 77.282  5.07382e+00  2.24815e+01  0.00000e+00 0.00000e+00 2.00566e+02 77.282  8.76941e+01 257.282 0.9781 
1 1 1 -11 42  4  o 7  1.28920e+01 8.38039e-01 3.00301e+02 267.639 -1.08403e+00 -2.62868e+01 0.00000e+00 0.00000e+00 1.77023e+02 267.639 1.23277e+02 87.639  0.9808 
1 1 1 -11 42  5  o 1  2.18652e+01 8.23143e-01 4.19893e+02 108.340 -2.04042e+01 6.15525e+01  0.00000e+00 0.00000e+00 3.98525e+02 108.340 2.13671e+01 288.340 0.9923 
1 1 1 -11 42  6  o 5  6.39654e+00 1.13240e+00 1.07225e+02 343.041 4.56548e+00  -1.39220e+00 0.00000e+00 0.00000e+00 1.06836e+02 343.041 3.88495e-01 163.041 0.8878 
1 1 1 -11 42  7  o 12 7.79881e+00 1.06541e+00 1.40076e+02 38.437  6.90584e+00  5.48082e+00  0.00000e+00 0.00000e+00 1.36440e+02 38.437  3.63584e+00 218.437 0.9415 
1 1 1 -11 42  8  o 7  2.00018e+01 8.17767e-01 3.84488e+02 180.940 -7.81611e+01 -1.28201e+00 0.00000e+00 0.00000e+00 3.63293e+02 180.940 2.11953e+01 0.940   0.9936 
1 1 1 -11 42  9  o 17 2.67771e+01 9.09053e-01 4.40948e+02 322.843 9.81067e+01  -7.43505e+01 0.00000e+00 0.00000e+00 5.61532e+02 322.843 1.20585e+02 322.843 0.9959 
1 1 1 -11 42  10 o 12 3.35395e+00 1.01221e+00 2.05442e+01 195.195 -7.50004e-01 -2.03702e-01 0.00000e+00 0.00000e+00 2.50399e+01 195.195 4.49570e+00 195.195 0.3619 
1 1 1 -11 42  11 o 9  4.15182e+00 1.14086e+00 9.56128e+01 111.319 -1.69955e+00 4.35481e+00  0.00000e+00 0.00000e+00 4.22578e+01 111.319 5.33550e+01 291.319 0.8852 
1 1 1 -11 42  12 o 11 4.81898e+00 1.16095e+00 5.08033e+01 34.124  2.62768e+00  1.78066e+00  0.00000e+00 0.00000e+00 9.76328e+01 34.124  4.68295e+01 34.124  0.8221 
1 1 1 -11 42  13 o 6  4.11716e+00 1.17536e+00 9.20648e+01 194.970 -4.87610e+00 -1.30379e+00 0.00000e+00 0.00000e+00 4.57541e+01 194.970 4.63107e+01 14.970  0.8945 
1 1 1 -11 42  14 f 0  5.15725e+00 1.24688e+00 6.39840e+01 169.404 -4.51571e+00 8.44761e-01  0.00000e+00 0.00000e+00 1.06227e+02 169.404 4.22432e+01 169.404 0.8830 
1 1 1 -11 42  15 f 0  5.37102e+00 1.07895e+00 1.21889e+02 38.372  8.75478e+00  6.93206e+00  0.00000e+00 0.00000e+00 6.93934e+01 38.372  5.24959e+01 218.372 0.9541 
1 1 1 -11 42  16 o 6  4.58014e+00 1.28522e+00 9.28605e+00 283.181 1.71320e-01  -7.31521e-01 0.00000e+00 0.00000e+00 5.07103e+01 283.181 4.14242e+01 283.181 0.3514 
1 1 1 -11 43  1  o 14 1.63683e+01 8.18719e-01 2.68881e+02 322.815 2.08692e+01  -1.58318e+01 0.00000e+00 0.00000e+00 3.38112e+02 322.815 6.92311e+01 322.815 0.9807 
1 1 1 -11 43  2  o 1  6.87146e+00 1.19312e+00 1.83586e+02 232.631 -4.19130e+00 -5.48809e+00 0.00000e+00 0.00000e+00 5.64851e+01 232.631 1.27101e+02 52.631  0.9245 
1 1 1 -11 43  3  o 7  1.55139e+01 8.11031e-01 3.24705e+02 187.660 -3.31100e+01 -4.45286e+00 0.00000e+00 0.00000e+00 2.52413e+02 187.660 7.22916e+01 7.660   0.9849 
1 1 1 -11 43  4  o 15 1.40630e+01 1.11370e+00 1.87489e+02 259.071 -3.33061e+00 -1.72493e+01 0.00000e+00 0.00000e+00 3.27982e+02 259.071 1.40493e+02 259.071 0.9711 
1 1 1 -11 43  5  o 15 1.76402e+01 8.23897e-01 2.44607e+02 167.431 -3.12905e+01 6.97628e+00  0.00000e+00 0.00000e+00 4.10282e+02 167.431 1.65674e+02 167.431 0.9843 
1 1 1 -11 43  6  o 10 8.92008e+00 1.03361e+00 1.71391e+02 4.415   1.17920e+01  9.10528e-01  0.00000e+00 0.00000e+00 1.50250e+02 4.415   2.11415e+01 184.415 0.9567 
1 1 1 -11 43  7  o 8  1.23920e+01 9.02714e-01 8.30215e+01 114.318 -3.58998e+00 7.94421e+00  0.00000e+00 0.00000e+00 3.55981e+02 114.318 2.72959e+02 114.318 0.9408 
1 1 1 -11 43  8  o 11 8.70210e+00 1.08117e+00 1.89679e+02 266.121 -1.01929e+00 -1.50343e+01 0.00000e+00 0.00000e+00 1.26661e+02 266.121 6.30185e+01 86.121  0.9662 
1 1 1 -11 43  9  o 3  3.12555e+00 9.50502e-01 8.64593e+01 286.920 8.43471e-01  -2.77266e+00 0.00000e+00 0.00000e+00 7.77755e+00 286.920 7.86818e+01 106.920 0.8022 
1 1 1 -11 43  10 o 12 9.78704e+00 8.68122e-01 1.72569e+02 123.883 -1.19884e+01 1.78518e+01  0.00000e+00 0.00000e+00 1.86267e+02 123.883 1.36974e+01 123.883 0.9765 
1 1 1 -11 43  11 o 18 8.71758e+00 1.00183e+00 1.30983e+02 91.038  -2.56678e-01 1.41665e+01  0.00000e+00 0.00000e+00 1.84232e+02 91.038  5.32483e+01 91.038  0.9640 
1 1 1 -11 43  12 o 13 6.75586e+00 1.14486e+00 1.65504e+02 238.864 -7.13383e+00 -1.18091e+01 0.00000e+00 0.00000e+00 7.82480e+01 238.864 8.72558e+01 58.864  0.9630 
1 1 1 -11 43  13 o 7  4.36042e+00 1.17761e+00 3.99650e+01 18.976  2.34428e+00  8.06101e-01  0.00000e+00 0.00000e+00 8.44786e+01 18.976  4.45136e+01 18.976  0.7627 
1 1 1 -11 43  14 o 11 8.77733e+00 1.06343e+00 1.71473e+02 92.463  -1.02832e+00 2.39054e+01  0.00000e+00 0.00000e+00 1.49622e+02 92.463  2.18507e+01 272.463 0.9789 
1 1 1 -11 43  15 o 9  6.20081e+00 9.92137e-01 1.24331e+02 343.570 1.43167e+01  -4.22190e+00 0.00000e+00 0.00000e+00 9.92043e+01 343.570 2.51270e+01 163.570 0.9659 
1 1 1 -11 43  16 o 12 5.89421e+00 1.43680e+00 1.64105e+02 166.225 -1.37981e+01 3.38265e+00  0.00000e+00 0.00000e+00 4.76955e+01 166.225 1.16409e+02 346.225 0.9641 
1 1 1 -11 44  1  o 10 2.06414e+01 7.59467e-01 4.15141e+02 264.544 -4.99102e+00 -5.22558e+01 0.00000e+00 0.00000e+00 3.57797e+02 264.544 5.73435e+01 84.544  0.9904 
1 1 1 -11 44  2  o 11 1.49137e+01 7.35048e-01 2.41995e+02 131.785 -1.47578e+01 1.65145e+01  0.00000e+00 0.00000e+00 3.08686e+02 131.785 6.66917e+01 131.785 0.9772 
1 1 1 -11 44  3  o 2  7.95323e+00 9.72949e-01 1.30713e+02 213.016 -5.74604e+00 -3.73385e+00 0.00000e+00 0.00000e+00 1.46770e+02 213.016 1.60570e+01 213.016 0.9238 
1 1 1 -11 44  4  o 12 6.63717e+00 1.03872e+00 8.34758e+01 334.524 3.41497e+00  -1.62706e+00 0.00000e+00 0.00000e+00 1.30596e+02 334.524 4.71206e+01 334.524 0.8546 
1 1 1 -11 44  5  o 4  1.12043e+01 7.93559e-01 2.09446e+02 205.438 -1.70995e+01 -8.13340e+00 0.00000e+00 0.00000e+00 2.01793e+02 205.438 7.65330e+00 25.438  0.9732 
1 1 1 -11 44  6  o 19 1.05111e+01 7.24130e-01 2.05864e+02 319.544 1.39939e+01  -1.19332e+01 0.00000e+00 0.00000e+00 1.79310e+02 319.544 2.65536e+01 139.544 0.9724 
1 1 1 -11 44  7  o 15 1.60961e+01 7.68706e-01 3.12110e+02 88.940  8.59773e-01  4.64804e+01  0.00000e+00 0.00000e+00 2.87390e+02 88.940  2.47199e+01 268.940 0.9892 
1 1 1 -11 44  8  o 15 7.94493e+00 9.55868e-01 1.10654e+02 226.876 -5.79325e+00 -6.18559e+00 0.00000e+00 0.00000e+00 1.69991e+02 226.876 5.93368e+01 226.876 0.9390 
1 1 1 -11 44  9  o 14 1.17288e+01 8.27398e-01 2.33490e+02 96.942  -3.90760e+00 3.20926e+01  0.00000e+00 0.00000e+00 2.00433e+02 96.942  3.30570e+01 276.942 0.9844 
1 1 1 -11 44  10 o 10 9.48276e+00 8.96400e-01 2.77246e+02 299.094 1.61591e+01  -2.90397e+01 0.00000e+00 0.00000e+00 7.33725e+01 299.094 2.03874e+02 119.094 0.9848 
1 1 1 -11 44  11 o 19 3.97079e+00 1.00650e+00 5.83175e+01 299.138 1.56622e+00  -2.80961e+00 0.00000e+00 0.00000e+00 6.45098e+01 299.138 6.19232e+00 299.138 0.8248 
1 1 1 -11 44  12 o 5  4.85815e+00 1.13443e+00 6.51577e+01 296.621 1.94146e+00  -3.87342e+00 0.00000e+00 0.00000e+00 9.41165e+01 296.621 2.89588e+01 296.621 0.8752 
1 1 1 -11 44  13 o 7  6.02975e+00 1.21698e+00 8.66128e+01 311.479 4.97355e+00  -5.62571e+00 0.00000e+00 0.00000e+00 1.23380e+02 311.479 3.67670e+01 311.479 0.9308 
1 1 1 -11 44  14 o 19 4.55671e+00 1.21414e+00 8.48932e+01 334.359 5.09114e+00  -2.44375e+00 0.00000e+00 0.00000e+00 6.94591e+01 334.359 1.54341e+01 154.359 0.9065 
1 1 1 -11 44  15 o 15 4.95139e+00 1.05215e+00 3.46307e+01 338.293 2.92737e+00  -1.16534e+00 0.00000e+00 0.00000e+00 1.16985e+02 338.293 8.23540e+01 338.293 0.8205 
1 1 1 -11 44  16 f 0  5.09480e+00 1.25883e+00 9.92092e+01 352.223 8.96037e+00  -1.22370e+00 0.00000e+00 0.00000e+00 7.98262e+01 352.223 1.93830e+01 172.223 0.9430 
1 1 1 -11 45  1  o 15 1.16710e+01 9.57583e-01 1.79340e+02 216.776 -1.07680e+01 -8.04853e+00 0.00000e+00 0.00000e+00 2.45123e+02 216.776 6.57830e+01 216.776 0.9621 
1 1 1 -11 45  2  f 0  8.75749e+00 9.31121e-01 1.47818e+01 313.874 5.97987e-01  -6.21970e-01 0.00000e+00 0.00000e+00 1.16141e+02 313.874 1.01359e+02 313.874 0.3957 
1 1 1 -11 45  3  o 10 7.51544e+00 1.00503e+00 1.38365e+02 235.248 -4.06812e+00 -5.86370e+00 0.00000e+00 0.00000e+00 1.24714e+02 235.248 1.36514e+01 55.248  0.9270 
1 1 1 -11 45  4  o 17 9.50125e+00 8.64357e-01 2.19192e+02 284.648 3.68278e+00  -1.40903e+01 0.00000e+00 0.00000e+00 1.26807e+02 284.648 9.23851e+01 104.648 0.9650 
1 1 1 -11 45  5  o 12 9.23951e+00 8.91219e-01 1.72433e+02 97.248  -1.49731e+00 1.17736e+01  0.00000e+00 0.00000e+00 1.60959e+02 97.248  1.14733e+01 277.248 0.9569 
1 1 1 -11 45  6  o 17 7.60484e+00 9.22105e-01 2.16809e+02 262.495 -1.82119e+00 -1.38249e+01 0.00000e+00 0.00000e+00 5.92617e+01 262.495 1.57548e+02 82.495  0.9634 
1 1 1 -11 45  7  o 19 3.90580e+00 1.03902e+00 5.51364e+01 0.309   1.85985e+00  1.00189e-02  0.00000e+00 0.00000e+00 4.38784e+01 0.309   1.12580e+01 180.309 0.6734 
1 1 1 -11 45  8  o 15 9.28052e+00 8.51350e-01 1.80781e+02 152.456 -1.56241e+01 8.14860e+00  0.00000e+00 0.00000e+00 1.58239e+02 152.456 2.25414e+01 332.456 0.9712 
1 1 1 -11 45  9  o 8  1.16073e+01 8.34877e-01 1.69733e+02 278.248 3.46582e+00  -2.39094e+01 0.00000e+00 0.00000e+00 2.57316e+02 278.248 8.75839e+01 278.248 0.9791 
1 1 1 -11 45  10 o 15 9.64851e+00 9.07224e-01 1.77915e+02 348.201 2.18650e+01  -4.56746e+00 0.00000e+00 0.00000e+00 1.76078e+02 348.201 1.83667e+00 168.201 0.9774 
1 1 1 -11 45  11 o 3  3.15280e+00 9.80696e-01 5.88401e+01 8.275   2.52601e+00  3.67389e-01  0.00000e+00 0.00000e+00 3.22636e+01 8.275   2.65764e+01 188.275 0.7706 
1 1 1 -11 45  12 o 14 3.51613e+00 1.05847e+00 7.73797e+01 113.214 -1.43092e+00 3.33636e+00  0.00000e+00 0.00000e+00 3.42514e+01 113.214 4.31283e+01 293.214 0.8476 
1 1 1 -11 45  13 o 3  9.57452e+00 9.85416e-01 1.85245e+02 34.926  2.29134e+01  1.60001e+01  0.00000e+00 0.00000e+00 1.66472e+02 34.926  1.87725e+01 214.926 0.9819 
1 1 1 -11 45  14 o 18 2.95966e+00 9.71861e-01 5.49219e+01 132.080 -1.88357e+00 2.08603e+00  0.00000e+00 0.00000e+00 3.29839e+01 132.080 2.19380e+01 312.080 0.7949 
1 1 1 -11 45  15 o 15 6.79111e+00 9.60544e-01 1.17191e+02 72.942  4.60167e+00  1.49972e+01  0.00000e+00 0.00000e+00 1.27993e+02 72.942  1.08020e+01 72.942  0.9676 
1 1 1 -11 45  16 o 6  3.98811e+00 1.20598e+00 9.02949e+01 285.796 1.81774e+00  -6.42530e+00 0.00000e+00 0.00000e+00 4.66780e+01 285.796 4.36169e+01 105.796 0.9217 
1 1 1 -11 46  1  o 11 6.37722e+00 1.03632e+00 1.84468e+02 65.190  3.20270e+00  6.92799e+00  0.00000e+00 0.00000e+00 4.01857e+01 65.190  1.44282e+02 245.190 0.9320 
1 1 1 -11 46  2  o 5  6.29155e+00 1.14700e+00 1.10285e+02 50.230  2.93340e+00  3.52453e+00  0.00000e+00 0.00000e+00 9.95410e+01 50.230  1.07441e+01 230.230 0.8828 
1 1 1 -11 46  3  o 11 1.34105e+01 8.07442e-01 2.09568e+02 288.587 6.47325e+00  -1.92488e+01 0.00000e+00 0.00000e+00 2.84129e+02 288.587 7.45613e+01 288.587 0.9751 
1 1 1 -11 46  4  o 4  1.84271e+01 7.32630e-01 3.00388e+02 317.625 3.09753e+01  -2.82597e+01 0.00000e+00 0.00000e+00 3.86545e+02 317.625 8.61566e+01 317.625 0.9880 
1 1 1 -11 46  5  o 7  1.31343e+01 7.29220e-01 2.01873e+02 15.020  2.15280e+01  5.77644e+00  0.00000e+00 0.00000e+00 2.82101e+02 15.020  8.02275e+01 15.020  0.9773 
1 1 1 -11 46  6  o 13 1.80525e+01 7.15953e-01 3.34725e+02 164.391 -5.19110e+01 1.45028e+01  0.00000e+00 0.00000e+00 3.39055e+02 164.391 4.33047e+00 164.391 0.9907 
1 1 1 -11 46  7  o 2  6.30061e+00 1.13474e+00 1.18898e+02 35.469  5.55862e+00  3.96044e+00  0.00000e+00 0.00000e+00 1.00138e+02 35.469  1.87606e+01 215.469 0.9235 
1 1 1 -11 46  8  o 4  9.09490e+00 8.68169e-01 9.92311e+01 128.947 -5.57293e+00 6.89511e+00  0.00000e+00 0.00000e+00 2.22908e+02 128.947 1.23677e+02 128.947 0.9418 
1 1 1 -11 46  9  f 0  1.24656e+01 7.69752e-01 2.77390e+02 287.987 1.33802e+01  -4.12123e+01 0.00000e+00 0.00000e+00 1.85542e+02 287.987 9.18472e+01 107.987 0.9884 
1 1 1 -11 46  10 o 17 8.34868e+00 9.38585e-01 1.18726e+02 113.656 -4.86192e+00 1.10987e+01  0.00000e+00 0.00000e+00 1.81413e+02 113.656 6.26865e+01 113.656 0.9578 
1 1 1 -11 46  11 o 9  3.19940e+00 9.84527e-01 1.29471e+02 65.535  2.36747e+00  5.20327e+00  0.00000e+00 0.00000e+00 2.05843e+01 245.535 1.50056e+02 245.535 0.9077 
1 1 1 -11 46  12 o 11 4.30794e+00 1.13768e+00 7.81632e+01 146.333 -3.89160e+00 2.59210e+00  0.00000e+00 0.00000e+00 6.46638e+01 146.333 1.34994e+01 326.333 0.8853 
1 1 1 -11 46  13 o 4  4.55328e+00 1.11111e+00 1.06857e+02 247.826 -2.73361e+00 -6.70730e+00 0.00000e+00 0.00000e+00 5.12236e+01 247.826 5.56334e+01 67.826  0.9282 
1 1 1 -11 46  14 o 11 7.96444e+00 1.00442e+00 1.05715e+02 237.181 -7.83909e+00 -1.21550e+01 0.00000e+00 0.00000e+00 1.81344e+02 237.181 7.56282e+01 237.181 0.9648 
1 1 1 -11 46  15 o 13 1.01183e+01 8.18479e-01 1.69347e+02 274.603 2.92219e+00  -3.62924e+01 0.00000e+00 0.00000e+00 2.02931e+02 274.603 3.35838e+01 274.603 0.9862 
1 1 1 -11 46  16 o 13 4.25643e+00 1.28229e+00 2.62133e+01 284.648 5.00336e-01  -1.91420e+00 0.00000e+00 0.00000e+00 8.38753e+01 284.648 5.76620e+01 284.648 0.6942 
1 1 1 -11 47  1  o 1  1.15617e+01 7.89865e-01 2.36561e+02 120.490 -1.00219e+01 1.70203e+01  0.00000e+00 0.00000e+00 1.89190e+02 120.490 4.73709e+01 300.490 0.9743 
1 1 1 -11 47  2  o 4  2.05717e+01 7.60298e-01 3.75624e+02 238.129 -2.98113e+01 -4.79476e+01 0.00000e+00 0.00000e+00 3.94531e+02 238.129 1.89069e+01 238.129 0.9911 
1 1 1 -11 47  3  o 2  1.56662e+01 7.55035e-01 1.89057e+02 58.972  1.09302e+01  1.81706e+01  0.00000e+00 0.00000e+00 3.88240e+02 58.972  1.99183e+02 58.972  0.9761 
1 1 1 -11 47  4  o 7  7.31385e+00 1.15495e+00 1.54960e+02 30.816  7.08476e+00  4.22607e+00  0.00000e+00 0.00000e+00 1.03656e+02 30.816  5.13036e+01 210.816 0.9373 
1 1 1 -11 47  5  o 7  3.96877e+00 1.21131e+00 1.96286e+01 107.846 -1.76492e-01 5.48180e-01  0.00000e+00 0.00000e+00 2.17610e+01 107.846 2.13238e+00 107.846 0.2766 
1 1 1 -11 47  6  o 6  1.21501e+01 7.71954e-01 1.88953e+02 119.021 -9.78294e+00 1.76339e+01  0.00000e+00 0.00000e+00 2.57241e+02 119.021 6.82882e+01 119.021 0.9749 
1 1 1 -11 47  7  o 9  1.68957e+01 7.41405e-01 3.15045e+02 357.502 5.44577e+01  -2.37562e+00 0.00000e+00 0.00000e+00 3.15016e+02 357.502 2.86927e-02 177.502 0.9908 
1 1 1 -11 47  8  o 8  1.13335e+01 8.23278e-01 1.99437e+02 199.755 -2.28788e+01 -8.21671e+00 0.00000e+00 0.00000e+00 2.17891e+02 199.755 1.84540e+01 199.755 0.9792 
1 1 1 -11 47  9  o 3  3.42494e+00 9.70252e-01 1.73351e+01 239.207 -3.63191e-01 -6.09422e-01 0.00000e+00 0.00000e+00 2.56563e+01 239.207 8.32115e+00 239.207 0.3341 
1 1 1 -11 47  10 o 3  7.47501e+00 1.02948e+00 1.35304e+02 232.176 -7.50527e+00 -9.66732e+00 0.00000e+00 0.00000e+00 1.33513e+02 232.176 1.79135e+00 52.176  0.9582 
1 1 1 -11 47  11 o 11 3.53902e+00 1.00999e+00 6.58942e+01 91.296  -7.12811e-02 3.15177e+00  0.00000e+00 0.00000e+00 4.29861e+01 91.296  2.29081e+01 271.296 0.8207 
1 1 1 -11 47  12 o 13 3.29548e+00 1.00741e+00 8.07578e+01 78.786  7.31881e-01  3.69149e+00  0.00000e+00 0.00000e+00 2.45984e+01 78.786  5.61594e+01 258.786 0.8538 
1 1 1 -11 47  13 o 2  9.13913e+00 1.02552e+00 1.47162e+02 296.953 8.94508e+00  -1.75913e+01 0.00000e+00 0.00000e+00 1.85872e+02 296.953 3.87097e+01 296.953 0.9743 
1 1 1 -11 47  14 o 19 5.07688e+00 1.12359e+00 1.07462e+02 63.452  4.02403e+00  8.05422e+00  0.00000e+00 0.00000e+00 7.13126e+01 63.452  3.61494e+01 243.452 0.9427 
1 1 1 -11 47  15 o 3  2.90206e+00 9.05423e-01 2.88353e+01 84.271  1.69097e-01  1.68548e+00  0.00000e+00 0.00000e+00 4.05091e+01 84.271  1.16738e+01 84.271  0.6406 
1 1 1 -11 47  16 o 10 3.12605e+00 8.32886e-01 3.37819e+01 310.007 1.68679e+00  -2.00975e+00 0.00000e+00 0.00000e+00 5.67962e+01 310.007 2.30143e+01 310.007 0.7778 
1 1 1 -11 48  1  o 18 1.13723e+01 8.12446e-01 2.47362e+02 275.401 1.91064e+00  -2.02090e+01 0.00000e+00 0.00000e+00 1.71661e+02 275.401 7.57007e+01 95.401  0.9750 
1 1 1 -11 48  2  o 13 1.61752e+01 7.28302e-01 2.43134e+02 39.304  2.19284e+01  1.79507e+01  0.00000e+00 0.00000e+00 3.56905e+02 39.304  1.13771e+02 39.304  0.9822 
1 1 1 -11 48  3  o 9  2.66833e+01 7.97691e-01 4.58604e+02 179.645 -9.13771e+01 5.65357e-01  0.00000e+00 0.00000e+00 5.43059e+02 179.645 8.44551e+01 179.645 0.9945 
1 1 1 -11 48  4  o 6  1.45121e+01 7.23049e-01 2.54325e+02 45.661  1.99483e+01  2.04138e+01  0.00000e+00 0.00000e+00 2.83414e+02 45.661  2.90890e+01 45.661  0.9823 
1 1 1 -11 48  5  o 19 7.54131e+00 9.17361e-01 1.68902e+02 238.923 -5.57485e+00 -9.24976e+00 0.00000e+00 0.00000e+00 1.01863e+02 238.923 6.70398e+01 58.923  0.9525 
1 1 1 -11 48  6  o 3  4.82872e+00 1.17472e+00 9.53265e+01 289.951 1.29282e+00  -3.56154e+00 0.00000e+00 0.00000e+00 6.01543e+01 289.951 3.51722e+01 109.951 0.8549 
1 1 1 -11 48  7  o 18 5.04939e+00 1.06928e+00 9.98288e+01 322.829 3.83643e+00  -2.90898e+00 0.00000e+00 0.00000e+00 6.90838e+01 322.829 3.07450e+01 142.829 0.8889 
1 1 1 -11 48  8  o 12 3.27500e+00 9.87579e-01 1.13282e+02 323.860 3.17111e+00  -2.31580e+00 0.00000e+00 0.00000e+00 7.30480e+00 143.860 1.20587e+02 143.860 0.8606 
1 1 1 -11 48  9  o 6  1.37897e+01 7.79281e-01 2.52688e+02 226.342 -2.97793e+01 -3.12076e+01 0.00000e+00 0.00000e+00 2.59257e+02 226.342 6.56938e+00 226.342 0.9883 
1 1 1 -11 48  10 o 1  8.51638e+00 9.38106e-01 1.46240e+02 17.545  1.57707e+01  4.98600e+00  0.00000e+00 0.00000e+00 1.63517e+02 17.545  1.72771e+01 17.545  0.9693 
1 1 1 -11 48  11 o 19 3.09351e+00 9.49254e-01 7.05224e+01 304.438 1.73048e+00  -2.52369e+00 0.00000e+00 0.00000e+00 2.39042e+01 304.438 4.66182e+01 124.438 0.8143 
1 1 1 -11 48  12 o 19 6.87471e+00 1.13076e+00 8.29086e+01 86.143  5.40157e-01  8.01297e+00  0.00000e+00 0.00000e+00 1.57885e+02 86.143  7.49763e+01 86.143  0.9355 
1 1 1 -11 48  13 o 2  4.56748e+00 1.15540e+00 9.62059e+01 7.600   6.39214e+00  8.52838e-01  0.00000e+00 0.00000e+00 6.07317e+01 7.600   3.54742e+01 187.600 0.9188 
1 1 1 -11 48  14 f 0  3.15923e+00 9.71361e-01 1.33250e+02 222.212 -5.66104e+00 -5.13525e+00 0.00000e+00 0.00000e+00 2.32718e+01 42.212  1.56522e+02 42.212  0.9321 
1 1 1 -11 48  15 o 8  5.23913e+00 1.10195e+00 5.75269e+01 98.107  -7.85671e-01 5.51555e+00  0.00000e+00 0.00000e+00 1.19349e+02 98.107  6.18220e+01 98.107  0.9051 
1 1 1 -11 48  16 o 8  4.61442e+00 9.82673e-01 5.88961e+01 201.464 -5.69874e+00 -2.24062e+00 0.00000e+00 0.00000e+00 9.82365e+01 201.464 3.93404e+01 201.464 0.9142 
1 1 1 -11 49  1  o 15 1.17662e+01 9.23333e-01 2.37187e+02 220.465 -1.46300e+01 -1.24798e+01 0.00000e+00 0.00000e+00 1.95664e+02 220.465 4.15231e+01 40.465  0.9736 
1 1 1 -11 49  2  o 6  1.11299e+01 8.06714e-01 2.51667e+02 213.558 -1.74094e+01 -1.15482e+01 0.00000e+00 0.00000e+00 1.58452e+02 213.558 9.32149e+01 33.558  0.9758 
1 1 1 -11 49  3  o 12 2.00121e+01 7.37707e-01 3.79004e+02 34.648  5.09136e+01  3.51860e+01  0.00000e+00 0.00000e+00 3.70146e+02 34.648  8.85755e+00 214.648 0.9919 
1 1 1 -11 49  4  o 4  1.56689e+01 7.24250e-01 2.62354e+02 291.626 1.27304e+01  -3.21103e+01 0.00000e+00 0.00000e+00 3.20001e+02 291.626 5.76470e+01 291.626 0.9854 
1 1 1 -11 49  5  o 16 7.68737e+00 9.72680e-01 1.02960e+02 110.039 -2.25654e+00 6.18661e+00  0.00000e+00 0.00000e+00 1.63763e+02 110.039 6.08036e+01 110.039 0.9206 
1 1 1 -11 49  6  o 6  7.89436e+00 9.08489e-01 1.62170e+02 285.237 3.03071e+00  -1.11263e+01 0.00000e+00 0.00000e+00 1.21932e+02 285.237 4.02385e+01 105.237 0.9556 
1 1 1 -11 49  7  o 12 7.25018e+00 9.77462e-01 4.82841e+01 258.850 -6.47150e-01 -3.28341e+00 0.00000e+00 0.00000e+00 1.78878e+02 258.850 1.30594e+02 258.850 0.8327 
1 1 1 -11 49  8  o 16 7.54069e+00 9.80819e-01 1.84576e+02 23.738  1.41789e+01  6.23531e+00  0.00000e+00 0.00000e+00 8.96018e+01 23.738  9.49740e+01 203.738 0.9672 
1 1 1 -11 49  9  o 9  1.11266e+01 8.22791e-01 1.67004e+02 245.002 -1.01869e+01 -2.18477e+01 0.00000e+00 0.00000e+00 2.42127e+02 245.002 7.51234e+01 245.002 0.9790 
1 1 1 -11 49  10 o 15 8.38630e+00 9.30315e-01 1.15981e+02 86.381  7.99954e-01  1.26467e+01  0.00000e+00 0.00000e+00 1.85987e+02 86.381  7.00059e+01 86.381  0.9597 
1 1 1 -11 49  11 f 0  4.75169e+00 1.09394e+00 2.31656e+02 18.359  1.40746e+01  4.67084e+00  0.00000e+00 0.00000e+00 5.96811e+01 198.359 2.91337e+02 198.359 0.9657 
1 1 1 -11 49  12 o 12 4.65718e+00 1.16704e+00 1.69254e+02 107.755 -3.37210e+00 1.05310e+01  0.00000e+00 0.00000e+00 2.98763e+00 287.755 1.72241e+02 287.755 0.9537 
1 1 1 -11 49  13 o 19 4.17418e+00 1.06241e+00 1.10064e+02 196.281 -7.10645e+00 -2.07549e+00 0.00000e+00 0.00000e+00 3.50520e+01 196.281 7.50124e+01 16.281  0.9298 
1 1 1 -11 49  14 o 16 3.58234e+00 9.61298e-01 5.88487e+01 304.090 2.20319e+00  -3.25535e+00 0.00000e+00 0.00000e+00 5.63080e+01 304.090 2.54067e+00 124.090 0.8608 
1 1 1 -11 49  15 o 13 4.03849e+00 1.06798e+00 8.69491e+01 67.255  2.57399e+00  6.13993e+00  0.00000e+00 0.00000e+00 5.18386e+01 67.255  3.51105e+01 247.255 0.9215 
1 1 1 -11 49  16 o 7  3.30901e+00 9.73550e-01 9.27382e+01 267.370 -3.28176e-01 -7.14377e+00 0.00000e+00 0.00000e+00 2.15228e+01 267.370 7.12154e+01 87.370  0.9272 
1 1 1 -11 50  1  o 2  4.95578e+00 1.18680e+00 1.09265e+02 265.850 -2.83063e-01 -3.90096e+00 0.00000e+00 0.00000e+00 5.17503e+01 265.850 5.75146e+01 85.850  0.8600 
1 1 1 -11 50  2  o 18 1.31921e+01 8.95463e-01 1.47956e+02 202.797 -1.41344e+01 -5.94069e+00 0.00000e+00 0.00000e+00 3.33629e+02 202.797 1.85672e+02 202.797 0.9668 
1 1 1 -11 50  3  o 8  2.25715e+01 7.37382e-01 4.09972e+02 83.016  8.66897e+00  7.07714e+01  0.00000e+00 0.00000e+00 4.35791e+02 83.016  2.58189e+01 83.016  0.9930 
1 1 1 -11 50  4  o 3  9.38667e+00 8.93378e-01 1.87024e+02 307.894 8.77597e+00  -1.12758e+01 0.00000e+00 0.00000e+00 1.54338e+02 307.894 3.26861e+01 127.894 0.9643 
1 1 1 -11 50  5  o 19 3.70185e+00 1.01389e+00 6.28378e+01 0.823   1.90770e+00  2.74076e-02  0.00000e+00 0.00000e+00 3.23093e+01 0.823   3.05285e+01 180.823 0.6821 
1 1 1 -11 50  6  o 2  8.15595e+00 8.60111e-01 1.26365e+02 35.405  8.44366e+00  6.00176e+00  0.00000e+00 0.00000e+00 1.65523e+02 35.405  3.91574e+01 35.405  0.9504 
1 1 1 -11 50  7  o 6  3.05732e+00 9.03299e-01 9.81349e+01 304.114 1.73416e+00  -2.55998e+00 0.00000e+00 0.00000e+00 4.20866e+00 124.114 1.02344e+02 124.114 0.8166 
1 1 1 -11 50  8  o 5  6.48308e+00 1.01921e+00 1.54215e+02 41.021  8.57915e+00  7.46329e+00  0.00000e+00 0.00000e+00 7.85035e+01 41.021  7.57113e+01 221.021 0.9550 
1 1 1 -11 50  9  o 10 5.66882e+00 1.00342e+00 1.08073e+02 224.685 -5.25249e+00 -5.19510e+00 0.00000e+00 0.00000e+00 8.98263e+01 224.685 1.82466e+01 44.685  0.9296 
1 1 1 -11 50  10 o 8  3.76986e+00 1.02255e+00 9.33785e+01 100.027 -8.44874e-01 4.77842e+00  0.00000e+00 0.00000e+00 3.24679e+01 100.027 6.09106e+01 280.027 0.8898 
1 1 1 -11 50  11 o 12 4.74456e+00 1.09380e+00 7.40696e+01 306.428 2.64678e+00  -3.58632e+00 0.00000e+00 0.00000e+00 8.22250e+01 306.428 8.15531e+00 306.428 0.8791 
1 1 1 -11 50  12 o 12 3.48938e+00 1.04458e+00 4.52486e+01 327.167 1.90493e+00  -1.22920e+00 0.00000e+00 0.00000e+00 5.10252e+01 327.167 5.77659e+00 327.167 0.7371 
1 1 1 -11 50  13 o 3  3.76325e+00 1.10291e+00 6.55485e+01 72.929  1.05242e+00  3.42716e+00  0.00000e+00 0.00000e+00 5.33967e+01 72.929  1.21518e+01 252.929 0.8454 
1 1 1 -11 50  14 o 19 3.36545e+00 9.57787e-01 2.59347e+01 329.913 1.47868e+00  -8.56710e-01 0.00000e+00 0.00000e+00 5.49535e+01 329.913 2.90189e+01 329.913 0.6437 
1 1 1 -11 50  15 o 13 5.13981e+00 1.08691e+00 5.15436e+01 67.482  2.04958e+00  4.94368e+00  0.00000e+00 0.00000e+00 1.21130e+02 67.482  6.95862e+01 67.482  0.9009 
1 1 1 -11 50  16 o 4  6.95569e+00 9.45788e-01 1.45724e+02 317.936 1.95542e+01  -1.76460e+01 0.00000e+00 0.00000e+00 1.08320e+02 317.936 3.74036e+01 137.936 0.9808 
1 1 1 -11 51  1  o 9  5.69695e+00 1.52682e+00 7.85730e+01 344.919 2.64951e+00  -7.13958e-01 0.00000e+00 0.00000e+00 9.12413e+01 344.919 1.26684e+01 344.919 0.7891 
1 1 1 -11 51  2  o 15 1.05293e+01 8.20684e-01 1.89670e+02 119.888 -7.53156e+00 1.31040e+01  0.00000e+00 0.00000e+00 1.94461e+02 119.888 4.79029e+00 119.888 0.9663 
1 1 1 -11 51  3  o 18 1.42263e+01 7.31153e-01 3.55288e+02 345.143 4.15689e+01  -1.10275e+01 0.00000e+00 0.00000e+00 1.75201e+02 345.143 1.80087e+02 165.143 0.9883 
1 1 1 -11 51  4  o 18 1.39678e+01 8.42504e-01 1.95784e+02 253.464 -6.73474e+00 -2.26834e+01 0.00000e+00 0.00000e+00 3.19633e+02 253.464 1.23849e+02 253.464 0.9786 
1 1 1 -11 51  5  o 15 1.48874e+01 7.06329e-01 2.47919e+02 308.101 2.14303e+01  -2.73304e+01 0.00000e+00 0.00000e+00 3.04885e+02 308.101 5.69659e+01 308.101 0.9855 
1 1 1 -11 51  6  f 0  1.20126e+01 7.10878e-01 2.92565e+02 24.814  3.29279e+01  1.52249e+01  0.00000e+00 0.00000e+00 1.53426e+02 24.814  1.39139e+02 204.814 0.9861 
1 1 1 -11 51  7  o 16 9.11248e+00 7.92932e-01 1.58953e+02 188.922 -1.43634e+01 -2.25481e+00 0.00000e+00 0.00000e+00 1.71832e+02 188.922 1.28794e+01 188.922 0.9650 
1 1 1 -11 51  8  o 8  1.08997e+01 7.45865e-01 1.93958e+02 261.584 -3.91202e+00 -2.64402e+01 0.00000e+00 0.00000e+00 2.07957e+02 261.584 1.39984e+01 261.584 0.9811 
1 1 1 -11 51  9  o 6  7.19894e+00 9.46822e-01 1.57863e+02 348.027 1.42079e+01  -3.01294e+00 0.00000e+00 0.00000e+00 1.02963e+02 348.027 5.48998e+01 168.027 0.9649 
1 1 1 -11 51  10 o 8  4.93144e+00 1.12437e+00 8.59854e+01 347.406 5.28612e+00  -1.18102e+00 0.00000e+00 0.00000e+00 8.09031e+01 347.406 5.08233e+00 167.406 0.9022 
1 1 1 -11 51  11 f 0  3.73971e+00 1.05465e+00 2.71071e+01 141.969 -1.14462e+00 8.95278e-01  0.00000e+00 0.00000e+00 5.47716e+01 141.969 2.76645e+01 141.969 0.5843 
1 1 1 -11 51  12 o 4  6.95011e+00 1.12130e+00 1.77845e+02 31.107  1.55907e+01  9.40747e+00  0.00000e+00 0.00000e+00 7.50222e+01 31.107  1.02823e+02 211.107 0.9721 
1 1 1 -11 51  13 o 7  4.25902e+00 1.06518e+00 1.13604e+02 118.659 -3.62477e+00 6.63215e+00  0.00000e+00 0.00000e+00 3.46611e+01 118.659 7.89424e+01 298.659 0.9313 
1 1 1 -11 51  14 o 6  7.07864e+00 1.04304e+00 8.31733e+01 242.030 -4.85856e+00 -9.14925e+00 0.00000e+00 0.00000e+00 1.67997e+02 242.030 8.48236e+01 242.030 0.9504 
1 1 1 -11 51  15 o 1  8.54103e+00 9.68751e-01 1.61361e+02 187.317 -3.14737e+01 -4.04158e+00 0.00000e+00 0.00000e+00 1.52021e+02 187.317 9.34010e+00 7.317   0.9841 
1 1 1 -11 51  16 o 14 6.70501e+00 9.74949e-01 1.05058e+02 44.062  1.22672e+01  1.18720e+01  0.00000e+00 0.00000e+00 1.37156e+02 44.062  3.20985e+01 44.062  0.9703 
1 1 1 -11 52  1  o 5  8.35222e+00 1.16858e+00 1.58793e+02 244.060 -4.30943e+00 -8.85906e+00 0.00000e+00 0.00000e+00 1.40188e+02 244.060 1.86049e+01 64.060  0.9478 
1 1 1 -11 52  2  o 9  1.18875e+01 7.27340e-01 1.09718e+02 299.559 5.48317e+00  -9.66821e+00 0.00000e+00 0.00000e+00 3.18322e+02 299.559 2.08603e+02 299.559 0.9539 
1 1 1 -11 52  3  o 13 7.85737e+00 1.00426e+00 1.30481e+02 163.992 -8.14668e+00 2.33724e+00  0.00000e+00 0.00000e+00 1.47862e+02 163.992 1.73803e+01 163.992 0.9390 
1 1 1 -11 52  4  o 19 6.10999e+00 9.51810e-01 1.55437e+02 167.487 -7.75958e+00 1.72213e+00  0.00000e+00 0.00000e+00 5.98943e+01 167.487 9.55426e+01 347.487 0.9348 
1 1 1 -11 52  5  o 17 1.40702e+01 6.68810e-01 3.28032e+02 60.781  2.16894e+01  3.87789e+01  0.00000e+00 0.00000e+00 1.96041e+02 60.781  1.31991e+02 240.781 0.9887 
1 1 1 -11 52  6  o 3  1.35731e+01 6.74641e-01 2.33460e+02 260.244 -5.84861e+00 -3.40143e+01 0.00000e+00 0.00000e+00 2.70031e+02 260.244 3.65709e+01 260.244 0.9854 
1 1 1 -11 52  7  o 13 8.93437e+00 7.90851e-01 1.54640e+02 17.685  1.49905e+01  4.77977e+00  0.00000e+00 0.00000e+00 1.70544e+02 17.685  1.59041e+01 17.685  0.9677 
1 1 1 -11 52  8  o 15 1.28141e+01 7.11743e-01 2.58858e+02 31.718  3.73662e+01  2.30942e+01  0.00000e+00 0.00000e+00 2.17165e+02 31.718  4.16931e+01 211.718 0.9886 
1 1 1 -11 52  9  o 6  6.89891e+00 9.56149e-01 1.68653e+02 229.357 -9.18780e+00 -1.07033e+01 0.00000e+00 0.00000e+00 8.09935e+01 229.357 8.76590e+01 49.357  0.9639 
1 1 1 -11 52  10 o 7  5.13422e+00 1.07289e+00 1.63835e+02 80.012  1.92441e+00  1.09268e+01  0.00000e+00 0.00000e+00 1.98254e+01 80.012  1.44009e+02 260.012 0.9538 
1 1 1 -11 52  11 o 14 3.75965e+00 1.06403e+00 6.22936e+01 33.821  2.58888e+00  1.73447e+00  0.00000e+00 0.00000e+00 5.29523e+01 33.821  9.34138e+00 213.821 0.8182 
1 1 1 -11 52  12 o 12 3.91998e+00 1.09702e+00 6.87901e+01 319.650 3.19216e+00  -2.71194e+00 0.00000e+00 0.00000e+00 5.88872e+01 319.650 9.90290e+00 139.650 0.8704 
1 1 1 -11 52  13 o 9  4.04448e+00 1.06319e+00 1.11637e+02 180.289 -7.17154e+00 -3.61393e-02 0.00000e+00 0.00000e+00 2.85521e+01 180.289 8.30852e+01 0.289   0.9274 
1 1 1 -11 52  14 o 12 4.03439e+00 1.09758e+00 5.84033e+01 82.260  5.69276e-01  4.18837e+00  0.00000e+00 0.00000e+00 7.28728e+01 82.260  1.44695e+01 82.260  0.8717 
1 1 1 -11 52  15 o 3  3.53787e+00 1.03583e+00 6.61019e+01 241.730 -2.41704e+00 -4.49467e+00 0.00000e+00 0.00000e+00 5.20319e+01 241.730 1.40700e+01 61.731  0.8957 
1 1 1 -11 52  16 o 6  5.11418e+00 1.10955e+00 7.69457e+01 325.076 7.06259e+00  -4.93130e+00 0.00000e+00 0.00000e+00 1.02019e+02 325.076 2.50738e+01 325.076 0.9400 
1 1 1 -11 53  1  o 1  1.22007e+01 9.61857e-01 1.79826e+02 14.636  1.69770e+01  4.43370e+00  0.00000e+00 0.00000e+00 2.67577e+02 14.636  8.77511e+01 14.636  0.9711 
1 1 1 -11 53  2  o 9  6.72818e+00 1.04038e+00 8.13653e+01 65.907  1.82730e+00  4.08628e+00  0.00000e+00 0.00000e+00 1.42006e+02 65.907  6.06406e+01 65.907  0.8796 
1 1 1 -11 53  3  o 2  1.46998e+01 6.96478e-01 2.77262e+02 210.965 -3.13676e+01 -1.88212e+01 0.00000e+00 0.00000e+00 2.69583e+02 210.965 7.67957e+00 30.965  0.9862 
1 1 1 -11 53  4  o 15 1.94759e+01 6.36210e-01 3.34023e+02 82.300  8.35263e+00  6.17782e+01  0.00000e+00 0.00000e+00 3.94214e+02 82.300  6.01912e+01 82.300  0.9919 
1 1 1 -11 53  5  o 9  2.38096e+01 6.44779e-01 4.11571e+02 250.013 -3.58669e+01 -9.86151e+01 0.00000e+00 0.00000e+00 4.81008e+02 250.013 6.94365e+01 250.013 0.9952 
1 1 1 -11 53  6  o 12 6.24008e+00 9.29859e-01 1.04468e+02 55.583  3.57732e+00  5.22115e+00  0.00000e+00 0.00000e+00 1.10950e+02 55.583  6.48200e+00 55.583  0.9172 
1 1 1 -11 53  7  o 9  3.70247e+00 9.92519e-01 8.43230e+01 267.881 -1.27947e-01 -3.45740e+00 0.00000e+00 0.00000e+00 3.24953e+01 267.881 5.18277e+01 87.881  0.8390 
1 1 1 -11 53  8  o 15 5.96106e+00 9.96305e-01 1.54032e+02 132.122 -6.99573e+00 7.73639e+00  0.00000e+00 0.00000e+00 5.89212e+01 132.122 9.51105e+01 312.122 0.9508 
1 1 1 -11 53  9  o 17 4.27995e+00 9.92516e-01 6.46765e+01 216.837 -2.87007e+00 -2.14998e+00 0.00000e+00 0.00000e+00 7.11550e+01 216.837 6.47850e+00 216.837 0.8455 
1 1 1 -11 53  10 o 5  8.72286e+00 8.83473e-01 1.82908e+02 124.624 -1.30535e+01 1.89055e+01  0.00000e+00 0.00000e+00 1.36988e+02 124.624 4.59193e+01 304.624 0.9780 
1 1 1 -11 53  11 o 6  8.89524e+00 9.55009e-01 1.44414e+02 327.650 1.67308e+01  -1.05970e+01 0.00000e+00 0.00000e+00 1.80260e+02 327.650 3.58453e+01 327.650 0.9744 
1 1 1 -11 53  12 o 2  5.26240e+00 1.18607e+00 5.24728e+01 46.278  2.71397e+00  2.83782e+00  0.00000e+00 0.00000e+00 1.16982e+02 46.278  6.45093e+01 46.278  0.8606 
1 1 1 -11 53  13 o 6  3.43991e+00 1.00649e+00 6.69043e+01 220.886 -2.90068e+00 -2.51143e+00 0.00000e+00 0.00000e+00 4.32550e+01 220.886 2.36493e+01 40.886  0.8569 
1 1 1 -11 53  14 o 10 3.89587e+00 1.07466e+00 9.67353e+01 39.192  5.28047e+00  4.30548e+00  0.00000e+00 0.00000e+00 3.75288e+01 39.192  5.92065e+01 219.192 0.9234 
1 1 1 -11 53  15 o 7  4.11363e+00 1.11795e+00 4.65523e+01 78.958  6.92884e-01  3.55081e+00  0.00000e+00 0.00000e+00 8.33202e+01 78.958  3.67679e+01 78.958  0.8470 
1 1 1 -11 53  16 o 10 3.78273e+00 1.02585e+00 6.02701e+01 145.147 -4.74197e+00 3.30225e+00  0.00000e+00 0.00000e+00 6.76832e+01 145.147 7.41309e+00 145.147 0.9088 
1 1 1 -11 54  1  o 14 1.94760e+01 9.53808e-01 3.38018e+02 155.406 -5.01802e+01 2.29677e+01  0.00000e+00 0.00000e+00 3.90647e+02 155.406 5.26288e+01 155.406 0.9909 
1 1 1 -11 54  2  o 8  9.97343e+00 9.33652e-01 2.71743e+02 229.808 -1.47400e+01 -1.74477e+01 0.00000e+00 0.00000e+00 9.62899e+01 229.808 1.75453e+02 49.809  0.9779 
1 1 1 -11 54  3  o 8  8.02460e+00 1.00949e+00 1.66170e+02 352.160 1.08542e+01  -1.49454e+00 0.00000e+00 0.00000e+00 1.22313e+02 352.160 4.38571e+01 172.160 0.9532 
1 1 1 -11 54  4  o 9  6.34151e+00 9.52857e-01 5.29703e+01 94.513  -2.34468e-01 2.97072e+00  0.00000e+00 0.00000e+00 1.40267e+02 94.513  8.72967e+01 94.513  0.8085 
1 1 1 -11 54  5  o 16 6.79885e+00 8.93033e-01 9.94566e+01 19.522  6.22406e+00  2.20672e+00  0.00000e+00 0.00000e+00 1.36331e+02 19.522  3.68744e+01 19.522  0.9208 
1 1 1 -11 54  6  o 12 2.17513e+01 6.63420e-01 3.30722e+02 143.661 -6.04390e+01 4.44595e+01  0.00000e+00 0.00000e+00 4.82377e+02 143.661 1.51655e+02 143.661 0.9933 
1 1 1 -11 54  7  o 1  1.10746e+01 8.25150e-01 1.75930e+02 339.277 2.24544e+01  -8.49497e+00 0.00000e+00 0.00000e+00 2.31726e+02 339.277 5.57958e+01 339.277 0.9789 
1 1 1 -11 54  8  o 8  4.63562e+00 1.05367e+00 6.73320e+01 93.871  -2.47182e-01 3.65273e+00  0.00000e+00 0.00000e+00 8.05380e+01 93.871  1.32060e+01 93.871  0.8491 
1 1 1 -11 54  9  o 11 1.21407e+01 7.33336e-01 2.54523e+02 93.162  -2.41630e+00 4.37407e+01  0.00000e+00 0.00000e+00 1.95904e+02 93.162  5.86193e+01 273.162 0.9885 
1 1 1 -11 54  10 o 17 8.93760e+00 9.04161e-01 1.64102e+02 271.304 4.77755e-01  -2.09886e+01 0.00000e+00 0.00000e+00 1.62917e+02 271.304 1.18502e+00 91.304  0.9759 
1 1 1 -11 54  11 o 16 5.66264e+00 1.05006e+00 1.37094e+02 4.946   1.14676e+01  9.92489e-01  0.00000e+00 0.00000e+00 6.55537e+01 4.946   7.15401e+01 184.946 0.9555 
1 1 1 -11 54  12 o 15 4.58009e+00 1.12515e+00 1.10626e+02 75.668  1.73997e+00  6.81045e+00  0.00000e+00 0.00000e+00 4.80093e+01 75.668  6.26172e+01 255.668 0.9259 
1 1 1 -11 54  13 o 13 4.72679e+00 1.12866e+00 1.30859e+02 104.256 -2.41204e+00 9.49330e+00  0.00000e+00 0.00000e+00 3.64808e+01 104.256 9.43786e+01 284.256 0.9475 
1 1 1 -11 54  14 o 2  6.95664e+00 1.05813e+00 9.93690e+01 212.174 -1.07497e+01 -6.76275e+00 0.00000e+00 0.00000e+00 1.49793e+02 212.174 5.04237e+01 212.174 0.9598 
1 1 1 -11 54  15 o 13 4.06002e+00 1.12094e+00 5.68682e+01 34.071  3.83930e+00  2.59654e+00  0.00000e+00 0.00000e+00 7.69123e+01 34.071  2.00441e+01 34.071  0.8842 
1 1 1 -11 54  16 o 16 7.28618e+00 1.00277e+00 1.35698e+02 210.186 -2.28170e+01 -1.32723e+01 0.00000e+00 0.00000e+00 1.30276e+02 210.186 5.42175e+00 30.186  0.9809 
1 1 1 -11 55  1  o 1  1.21727e+01 8.75766e-01 2.04727e+02 290.442 7.45714e+00  -2.00067e+01 0.00000e+00 0.00000e+00 2.43915e+02 290.442 3.91875e+01 290.442 0.9763 
1 1 1 -11 55  2  o 19 3.27554e+00 9.80163e-01 1.56981e+02 118.157 -2.01260e+00 3.76032e+00  0.00000e+00 0.00000e+00 4.90877e+01 298.157 2.06069e+02 298.157 0.8730 
1 1 1 -11 55  3  o 7  1.03123e+01 7.28379e-01 1.91386e+02 241.257 -9.00353e+00 -1.64158e+01 0.00000e+00 0.00000e+00 1.86945e+02 241.257 4.44065e+00 61.257  0.9729 
1 1 1 -11 55  4  o 8  1.29889e+01 6.76412e-01 1.93774e+02 134.602 -1.87865e+01 1.90494e+01  0.00000e+00 0.00000e+00 2.86463e+02 134.602 9.26894e+01 134.602 0.9811 
1 1 1 -11 55  5  o 12 1.93805e+01 6.39800e-01 2.24287e+02 19.701  4.49832e+01  1.61074e+01  0.00000e+00 0.00000e+00 4.97848e+02 19.701  2.73561e+02 19.701  0.9895 
1 1 1 -11 55  6  o 15 1.09574e+01 7.49452e-01 2.11817e+02 346.308 2.48302e+01  -6.04921e+00 0.00000e+00 0.00000e+00 1.92337e+02 346.308 1.94794e+01 166.308 0.9802 
1 1 1 -11 55  7  o 9  5.43050e+00 1.00059e+00 1.61480e+02 214.342 -8.28110e+00 -5.65794e+00 0.00000e+00 0.00000e+00 3.22225e+01 214.342 1.29258e+02 34.342  0.9488 
1 1 1 -11 55  8  o 10 6.73925e+00 9.61709e-01 1.07953e+02 34.798  7.33718e+00  5.09918e+00  0.00000e+00 0.00000e+00 1.30571e+02 34.798  2.26177e+01 34.798  0.9423 
1 1 1 -11 55  9  o 12 3.17839e+00 9.40879e-01 3.11801e+01 261.818 -1.80002e-01 -1.25196e+00 0.00000e+00 0.00000e+00 3.23212e+01 261.818 1.14112e+00 261.818 0.5324 
1 1 1 -11 55  10 o 1  6.34157e+00 1.01697e+00 6.23703e+01 108.096 -1.72586e+00 5.28153e+00  0.00000e+00 0.00000e+00 1.52743e+02 108.096 9.03728e+01 108.096 0.9049 
1 1 1 -11 55  11 o 5  4.78460e+00 1.06737e+00 6.84357e+01 59.760  2.41029e+00  4.13472e+00  0.00000e+00 0.00000e+00 9.06966e+01 59.760  2.22609e+01 59.760  0.8882 
1 1 1 -11 55  12 o 7  5.06445e+00 1.15084e+00 7.84292e+01 154.035 -5.25894e+00 2.56098e+00  0.00000e+00 0.00000e+00 9.39439e+01 154.035 1.55147e+01 154.035 0.9100 
1 1 1 -11 55  13 o 18 6.39631e+00 1.06390e+00 1.50297e+02 145.018 -1.35422e+01 9.47609e+00  0.00000e+00 0.00000e+00 8.13165e+01 145.018 6.89808e+01 325.018 0.9693 
1 1 1 -11 55  14 o 19 7.54917e+00 1.03246e+00 1.07301e+02 338.618 1.38411e+01  -5.41923e+00 0.00000e+00 0.00000e+00 1.64724e+02 338.618 5.74237e+01 338.618 0.9658 
1 1 1 -11 55  15 o 8  3.91874e+00 1.09573e+00 5.98882e+01 52.639  2.96072e+00  3.87790e+00  0.00000e+00 0.00000e+00 7.01422e+01 52.639  1.02540e+01 52.639  0.8905 
1 1 1 -11 55  16 o 12 2.63889e+00 8.73727e-01 2.29798e+01 206.878 -1.50675e+00 -7.63682e-01 0.00000e+00 0.00000e+00 3.98202e+01 206.878 1.68403e+01 206.878 0.6396 
1 1 1 -11 56  1  o 14 6.56357e+00 1.16518e+00 1.61431e+02 21.525  8.06584e+00  3.18122e+00  0.00000e+00 0.00000e+00 7.15579e+01 21.525  8.98730e+01 201.525 0.9404 
1 1 1 -11 56  2  o 7  1.35365e+01 8.05202e-01 2.61429e+02 177.278 -3.28520e+01 1.56199e+00  0.00000e+00 0.00000e+00 2.41419e+02 177.278 2.00095e+01 357.278 0.9847 
1 1 1 -11 56  3  o 12 5.41876e+00 9.82978e-01 4.21899e+01 218.164 -1.58140e+00 -1.24283e+00 0.00000e+00 0.00000e+00 1.00747e+02 218.164 5.85567e+01 218.164 0.6996 
1 1 1 -11 56  4  o 12 6.63211e+00 9.00739e-01 6.95499e+01 231.182 -2.81885e+00 -3.50373e+00 0.00000e+00 0.00000e+00 1.50410e+02 231.182 8.08604e+01 231.182 0.8802 
1 1 1 -11 56  5  o 14 1.06897e+01 7.13507e-01 1.88024e+02 12.596  2.15246e+01  4.80974e+00  0.00000e+00 0.00000e+00 2.05222e+02 12.596  1.71984e+01 12.596  0.9771 
1 1 1 -11 56  6  o 8  4.78045e+00 9.89141e-01 8.69838e+01 89.299  5.37800e-02  4.39482e+00  0.00000e+00 0.00000e+00 7.07742e+01 89.299  1.62095e+01 269.299 0.8772 
1 1 1 -11 56  7  o 5  6.20584e+00 9.58394e-01 7.19943e+01 95.627  -5.26276e-01 5.34122e+00  0.00000e+00 0.00000e+00 1.38249e+02 95.627  6.62552e+01 95.627  0.9013 
1 1 1 -11 56  8  f 0  7.80185e+00 9.07186e-01 1.79980e+02 111.037 -6.25098e+00 1.62531e+01  0.00000e+00 0.00000e+00 1.04488e+02 111.037 7.54912e+01 291.037 0.9708 
1 1 1 -11 56  9  o 12 6.08362e+00 9.90689e-01 6.30516e+01 279.747 8.90219e-01  -5.18234e+00 0.00000e+00 0.00000e+00 1.42164e+02 279.747 7.91122e+01 279.747 0.8990 
1 1 1 -11 56  10 o 17 3.39866e+00 9.75468e-01 1.13229e+02 321.355 4.04654e+00  -3.23550e+00 0.00000e+00 0.00000e+00 1.09106e+00 321.355 1.12138e+02 141.355 0.8974 
1 1 1 -11 56  11 o 12 4.65485e+00 1.12766e+00 8.35688e+01 91.587  -1.54626e-01 5.58274e+00  0.00000e+00 0.00000e+00 7.42248e+01 91.587  9.34394e+00 271.587 0.9054 
1 1 1 -11 56  12 o 6  5.15412e+00 1.09731e+00 5.79151e+01 28.167  3.95321e+00  2.11677e+00  0.00000e+00 0.00000e+00 1.11684e+02 28.167  5.37690e+01 28.167  0.8799 
1 1 1 -11 56  13 o 16 3.79606e+00 9.97211e-01 6.16674e+01 71.634  1.31584e+00  3.96338e+00  0.00000e+00 0.00000e+00 6.16898e+01 71.634  2.24388e-02 71.634  0.8700 
1 1 1 -11 56  14 o 2  3.19751e+00 9.83416e-01 3.12486e+01 167.675 -1.97432e+00 4.31385e-01  0.00000e+00 0.00000e+00 5.23919e+01 167.675 2.11433e+01 167.675 0.7012 
1 1 1 -11 56  15 o 7  3.46071e+00 1.05075e+00 7.41040e+01 159.472 -5.01577e+00 1.87816e+00  0.00000e+00 0.00000e+00 4.20687e+01 159.472 3.20353e+01 339.471 0.9010 
1 1 1 -11 56  16 o 15 4.14912e+00 1.07539e+00 8.37311e+01 294.122 3.54535e+00  -7.91772e+00 0.00000e+00 0.00000e+00 6.14449e+01 294.122 2.22862e+01 114.122 0.9405 
1 1 1 -11 57  1  o 4  9.15217e+00 1.05591e+00 1.17271e+02 119.920 -4.59406e+00 7.98279e+00  0.00000e+00 0.00000e+00 2.08803e+02 119.920 9.15321e+01 119.920 0.9440 
1 1 1 -11 57  2  o 18 9.33611e+00 9.24476e-01 1.58840e+02 59.082  6.83143e+00  1.14066e+01  0.00000e+00 0.00000e+00 1.79802e+02 59.082  2.09617e+01 59.082  0.9616 
1 1 1 -11 57  3  o 8  9.51048e+00 7.69104e-01 1.02530e+02 265.862 -7.27401e-01 -1.00546e+01 0.00000e+00 0.00000e+00 2.37713e+02 265.862 1.35182e+02 265.862 0.9490 
1 1 1 -11 57  4  o 4  1.02177e+01 7.36412e-01 1.45785e+02 347.193 1.55490e+01  -3.53467e+00 0.00000e+00 0.00000e+00 2.26868e+02 347.193 8.10827e+01 347.193 0.9681 
1 1 1 -11 57  5  o 1  1.23717e+01 6.74529e-01 1.01769e+02 316.234 9.44772e+00  -9.04935e+00 0.00000e+00 0.00000e+00 3.45798e+02 316.234 2.44030e+02 316.234 0.9610 
1 1 1 -11 57  6  o 5  1.05268e+01 7.37075e-01 1.97039e+02 44.815  1.87466e+01  1.86261e+01  0.00000e+00 0.00000e+00 1.91372e+02 44.815  5.66728e+00 224.815 0.9809 
1 1 1 -11 57  7  f 0  3.42331e+00 9.46632e-01 1.01711e+02 15.964  3.88230e+00  1.11062e+00  0.00000e+00 0.00000e+00 9.57906e+00 15.964  9.21318e+01 195.964 0.8650 
1 1 1 -11 57  8  o 13 3.07978e+00 9.11888e-01 8.49355e+01 150.178 -2.89769e+00 1.66097e+00  0.00000e+00 0.00000e+00 1.13164e+01 150.178 7.36191e+01 330.178 0.8323 
1 1 1 -11 57  9  o 14 7.87773e+00 8.98480e-01 1.83480e+02 121.696 -1.09521e+01 1.77356e+01  0.00000e+00 0.00000e+00 1.04870e+02 121.696 7.86098e+01 301.696 0.9757 
1 1 1 -11 57  10 o 3  3.91776e+00 1.04390e+00 6.03764e+01 294.093 1.39194e+00  -3.11279e+00 0.00000e+00 0.00000e+00 6.24039e+01 294.093 2.02759e+00 294.093 0.8363 
1 1 1 -11 57  11 o 10 6.03798e+00 1.14393e+00 6.30437e+01 8.182   5.47758e+00  7.87555e-01  0.00000e+00 0.00000e+00 1.41393e+02 8.182   7.83496e+01 8.182   0.9045 
1 1 1 -11 57  12 o 10 4.98629e+00 1.09883e+00 4.94665e+01 89.944  3.51038e-03  3.59345e+00  0.00000e+00 0.00000e+00 1.08240e+02 89.944  5.87740e+01 89.944  0.8458 
1 1 1 -11 57  13 o 15 2.93671e+00 9.27409e-01 4.56777e+01 64.748  1.14611e+00  2.42993e+00  0.00000e+00 0.00000e+00 4.02952e+01 64.748  5.38242e+00 244.748 0.7839 
1 1 1 -11 57  14 o 9  3.83970e+00 1.04706e+00 3.07036e+01 154.844 -2.05654e+00 9.65793e-01  0.00000e+00 0.00000e+00 7.49583e+01 154.844 4.42547e+01 154.844 0.7378 
1 1 1 -11 57  15 o 4  2.69016e+00 8.95321e-01 5.15849e+01 248.282 -1.24227e+00 -3.11890e+00 0.00000e+00 0.00000e+00 3.19181e+01 248.282 1.96668e+01 68.282  0.8333 
1 1 1 -11 57  16 o 15 6.15665e+00 9.99287e-01 1.28448e+02 327.563 1.73219e+01  -1.10085e+01 0.00000e+00 0.00000e+00 9.49209e+01 327.563 3.35272e+01 147.563 0.9753 
1 1 1 -11 58  1  o 1  9.19543e+00 8.97123e-01 1.17984e+02 19.529  1.01692e+01  3.60685e+00  0.00000e+00 0.00000e+00 2.12503e+02 19.529  9.45187e+01 19.529  0.9525 
1 1 1 -11 58  2  o 5  3.57133e+00 1.01035e+00 1.09300e+02 227.613 -2.51078e+00 -2.75096e+00 0.00000e+00 0.00000e+00 5.45707e+00 227.613 1.03843e+02 47.614  0.8520 
1 1 1 -11 58  3  o 16 7.64298e+00 9.81400e-01 1.08995e+02 285.494 2.19964e+00  -7.93508e+00 0.00000e+00 0.00000e+00 1.60974e+02 285.494 5.19794e+01 285.494 0.9372 
1 1 1 -11 58  4  o 5  2.10016e+01 6.57005e-01 3.66592e+02 281.702 1.74248e+01  -8.41232e+01 0.00000e+00 0.00000e+00 4.19848e+02 281.702 5.32558e+01 281.702 0.9942 
1 1 1 -11 58  5  o 4  1.05920e+01 7.18364e-01 1.80000e+02 135.773 -1.51737e+01 1.47695e+01  0.00000e+00 0.00000e+00 2.09145e+02 135.773 2.91453e+01 135.773 0.9761 
1 1 1 -11 58  6  o 17 8.95097e+00 7.84848e-01 9.62035e+01 87.331  5.00319e-01  1.07340e+01  0.00000e+00 0.00000e+00 2.24375e+02 87.331  1.28171e+02 87.331  0.9523 
1 1 1 -11 58  7  o 12 8.13072e+00 8.61824e-01 1.80085e+02 12.598  1.82320e+01  4.07460e+00  0.00000e+00 0.00000e+00 1.17162e+02 12.598  6.29232e+01 192.598 0.9729 
1 1 1 -11 58  8  o 2  6.85775e+00 9.54835e-01 1.73467e+02 169.808 -1.54281e+01 2.77374e+00  0.00000e+00 0.00000e+00 7.56526e+01 169.808 9.78139e+01 349.808 0.9676 
1 1 1 -11 58  9  o 8  6.80961e+00 1.02944e+00 1.26699e+02 350.442 1.13936e+01  -1.91841e+00 0.00000e+00 0.00000e+00 1.17403e+02 350.442 9.29555e+00 170.442 0.9557 
1 1 1 -11 58  10 o 15 4.48216e+00 1.09682e+00 7.41400e+01 292.135 1.78308e+00  -4.38349e+00 0.00000e+00 0.00000e+00 7.47922e+01 292.135 6.52223e-01 292.135 0.8868 
1 1 1 -11 58  11 o 13 9.09700e+00 1.09912e+00 1.77124e+02 24.671  2.27229e+01  1.04374e+01  0.00000e+00 0.00000e+00 1.56493e+02 24.671  2.06305e+01 204.671 0.9798 
1 1 1 -11 58  12 o 7  1.04180e+01 8.51238e-01 1.36729e+02 213.330 -2.11112e+01 -1.38834e+01 0.00000e+00 0.00000e+00 2.44978e+02 213.330 1.08248e+02 213.330 0.9800 
1 1 1 -11 58  13 o 13 2.94778e+00 9.34049e-01 6.11975e+01 114.882 -1.43897e+00 3.10249e+00  0.00000e+00 0.00000e+00 3.09143e+01 114.882 3.02833e+01 294.882 0.8368 
1 1 1 -11 58  14 o 10 3.35799e+00 1.01511e+00 8.36256e+01 335.846 5.35429e+00  -2.40112e+00 0.00000e+00 0.00000e+00 3.03692e+01 335.846 5.32564e+01 155.846 0.9103 
1 1 1 -11 58  15 o 3  3.92288e+00 1.11979e+00 8.69451e+01 223.619 -5.59258e+00 -5.32932e+00 0.00000e+00 0.00000e+00 4.93475e+01 223.619 3.75976e+01 43.619  0.9328 
1 1 1 -11 59  1  o 15 5.46764e+00 1.22471e+00 8.10036e+01 186.775 -3.80747e+00 -4.52362e-01 0.00000e+00 0.00000e+00 9.57460e+01 186.775 1.47425e+01 186.775 0.8568 
1 1 1 -11 59  2  o 4  2.04028e+01 7.62013e-01 2.97171e+02 295.398 2.76814e+01  -5.83019e+01 0.00000e+00 0.00000e+00 4.66186e+02 295.398 1.69014e+02 295.398 0.9922 
1 1 1 -11 59  3  o 19 7.58562e+00 9.46097e-01 9.12701e+01 195.801 -6.44424e+00 -1.82372e+00 0.00000e+00 0.00000e+00 1.72295e+02 195.801 8.10246e+01 195.801 0.9220 
1 1 1 -11 59  4  o 2  1.09689e+01 7.05976e-01 1.87350e+02 287.761 6.46208e+00  -2.01745e+01 0.00000e+00 0.00000e+00 2.15873e+02 287.761 2.85232e+01 287.761 0.9761 
1 1 1 -11 59  5  o 13 6.02114e+00 9.46008e-01 1.30627e+02 152.383 -7.87324e+00 4.11892e+00  0.00000e+00 0.00000e+00 8.28095e+01 152.383 4.78177e+01 332.383 0.9419 
1 1 1 -11 59  6  o 5  6.63454e+00 9.14227e-01 1.31797e+02 23.276  9.02252e+00  3.88119e+00  0.00000e+00 0.00000e+00 1.04626e+02 23.276  2.71710e+01 203.276 0.9476 
1 1 1 -11 59  7  o 2  3.05105e+00 8.89692e-01 2.88015e+01 176.773 -1.15145e+00 6.49225e-02  0.00000e+00 0.00000e+00 2.82951e+01 176.773 5.06423e-01 356.773 0.4981 
1 1 1 -11 59  8  o 18 8.24295e+00 8.81419e-01 1.34280e+02 211.230 -1.24124e+01 -7.52609e+00 0.00000e+00 0.00000e+00 1.64293e+02 211.230 3.00131e+01 211.230 0.9649 
1 1 1 -11 59  9  o 18 1.25353e+01 7.66938e-01 2.02828e+02 78.627  7.66396e+00  3.81025e+01  0.00000e+00 0.00000e+00 2.61189e+02 78.627  5.83609e+01 78.627  0.9871 
1 1 1 -11 59  10 o 10 6.32949e+00 1.05212e+00 6.05732e+01 130.757 -3.45793e+00 4.01214e+00  0.00000e+00 0.00000e+00 1.52804e+02 130.757 9.22309e+01 130.757 0.8998 
1 1 1 -11 59  11 o 5  5.08890e+00 1.13735e+00 8.49471e+01 228.115 -4.15101e+00 -4.62886e+00 0.00000e+00 0.00000e+00 8.94262e+01 228.115 4.47904e+00 228.115 0.9156 
1 1 1 -11 59  12 o 19 3.56490e+00 1.00328e+00 8.47423e+01 72.605  1.48815e+00  4.75020e+00  0.00000e+00 0.00000e+00 3.42397e+01 72.605  5.05026e+01 252.605 0.8929 
1 1 1 -11 59  13 o 5  3.86625e+00 1.05858e+00 4.30286e+01 217.028 -2.29548e+00 -1.73152e+00 0.00000e+00 0.00000e+00 7.24975e+01 217.028 2.94689e+01 217.028 0.8003 
1 1 1 -11 59  14 o 13 6.58197e+00 1.14412e+00 8.11558e+01 147.895 -8.98736e+00 5.63876e+00  0.00000e+00 0.00000e+00 1.52405e+02 147.895 7.12491e+01 147.895 0.9516 
1 1 1 -11 59  15 o 19 7.07454e+00 1.15840e+00 6.48730e+01 51.377  6.11510e+00  7.65405e+00  0.00000e+00 0.00000e+00 1.84743e+02 51.377  1.19870e+02 51.377  0.9475 
1 1 1 -11 60  1  o 16 1.03102e+01 1.01606e+00 1.83222e+02 220.897 -1.34973e+01 -1.16907e+01 0.00000e+00 0.00000e+00 1.94644e+02 220.897 1.14220e+01 220.897 0.9716 
1 1 1 -11 60  2  o 16 4.51963e+00 1.09135e+00 1.71154e+02 277.045 8.70879e-01  -7.04654e+00 0.00000e+00 0.00000e+00 1.32580e+01 97.045  1.84412e+02 97.045  0.9266 
1 1 1 -11 60  3  o 18 5.66444e+00 1.06050e+00 3.92602e+01 94.415  -1.66493e-01 2.15659e+00  0.00000e+00 0.00000e+00 1.15009e+02 94.415  7.57488e+01 94.415  0.7228 
1 1 1 -11 60  4  o 1  1.08112e+01 7.20183e-01 1.47437e+02 222.434 -1.30634e+01 -1.19427e+01 0.00000e+00 0.00000e+00 2.47979e+02 222.434 1.00542e+02 222.434 0.9713 
1 1 1 -11 60  5  o 17 9.26745e+00 7.48577e-01 2.50048e+02 117.708 -1.36584e+01 2.60065e+01  0.00000e+00 0.00000e+00 9.26728e+01 117.708 1.57376e+02 297.708 0.9828 
1 1 1 -11 60  6  o 17 9.85331e+00 8.44914e-01 1.16917e+02 66.115  5.63664e+00  1.27285e+01  0.00000e+00 0.00000e+00 2.39983e+02 66.115  1.23066e+02 66.115  0.9634 
1 1 1 -11 60  7  o 19 5.58985e+00 9.89082e-01 7.35890e+01 188.236 -4.86903e+00 -7.04762e-01 0.00000e+00 0.00000e+00 1.13615e+02 188.236 4.00259e+01 188.236 0.8915 
1 1 1 -11 60  8  o 1  4.37741e+00 9.76648e-01 3.86877e+01 354.079 2.37747e+00  -2.46546e-01 0.00000e+00 0.00000e+00 8.49458e+01 354.079 4.62581e+01 354.079 0.7525 
1 1 1 -11 60  9  o 2  6.97616e+00 9.82627e-01 1.43044e+02 194.098 -1.38427e+01 -3.47657e+00 0.00000e+00 0.00000e+00 1.09200e+02 194.098 3.38441e+01 14.098  0.9643 
1 1 1 -11 60  10 o 12 8.92260e+00 8.79743e-01 1.09159e+02 274.884 1.34846e+00  -1.57789e+01 0.00000e+00 0.00000e+00 2.14334e+02 274.884 1.05175e+02 274.884 0.9679 
1 1 1 -11 60  11 o 10 1.06417e+01 9.91176e-01 1.88523e+02 74.159  8.20076e+00  2.89025e+01  0.00000e+00 0.00000e+00 2.02978e+02 74.159  1.44555e+01 74.159  0.9832 
1 1 1 -11 60  12 o 5  3.02464e+00 9.21496e-01 8.84825e+01 140.345 -3.67435e+00 3.04565e+00  0.00000e+00 0.00000e+00 1.18812e+01 140.345 7.66013e+01 320.345 0.8878 
1 1 1 -11 60  13 f 0  7.21717e+00 1.07525e+00 9.60629e+01 39.860  9.62073e+00  8.03274e+00  0.00000e+00 0.00000e+00 1.62368e+02 39.860  6.63054e+01 39.860  0.9592 
1 1 1 -11 60  14 o 4  3.15789e+00 9.42402e-01 8.05462e+01 222.427 -4.42803e+00 -4.04721e+00 0.00000e+00 0.00000e+00 2.68665e+01 222.427 5.36797e+01 42.427  0.9123 
1 1 1 -11 60  15 o 9  4.19324e+00 1.13709e+00 6.24218e+01 154.816 -5.06030e+00 2.37947e+00  0.00000e+00 0.00000e+00 7.89513e+01 154.816 1.65295e+01 154.816 0.9055 
1 1 1 -11 61  1  o 19 5.45855e+00 1.14743e+00 2.93397e+01 18.896  1.42568e+00  4.88017e-01  0.00000e+00 0.00000e+00 9.37372e+01 18.896  6.43975e+01 18.896  0.5978 
1 1 1 -11 61  2  o 9  3.22074e+00 9.74396e-01 9.11983e+01 346.485 2.71249e+00  -6.51968e-01 0.00000e+00 0.00000e+00 5.09603e+00 346.485 8.61023e+01 166.485 0.7932 
1 1 1 -11 61  3  o 15 1.01965e+01 8.49492e-01 2.03219e+02 21.810  2.05303e+01  8.21563e+00  0.00000e+00 0.00000e+00 1.72123e+02 21.810  3.10958e+01 201.810 0.9771 
1 1 1 -11 61  4  o 17 8.96394e+00 7.98392e-01 1.84032e+02 176.537 -1.96841e+01 1.19100e+00  0.00000e+00 0.00000e+00 1.44772e+02 176.537 3.92593e+01 356.538 0.9743 
1 1 1 -11 61  5  o 7  4.93269e+00 1.04278e+00 1.06059e+02 85.385  4.49670e-01  5.57044e+00  0.00000e+00 0.00000e+00 6.19682e+01 85.385  4.40910e+01 265.385 0.9055 
1 1 1 -11 61  6  o 1  8.13515e+00 7.93207e-01 1.29154e+02 208.410 -1.21261e+01 -6.55941e+00 0.00000e+00 0.00000e+00 1.65352e+02 208.410 3.61985e+01 208.410 0.9630 
1 1 1 -11 61  7  o 2  4.87463e+00 9.94155e-01 4.64956e+01 15.521  2.82809e+00  7.85440e-01  0.00000e+00 0.00000e+00 1.00907e+02 15.521  5.44110e+01 15.521  0.8051 
1 1 1 -11 61  8  o 7  7.27873e+00 8.99807e-01 8.92897e+01 258.401 -1.88442e+00 -9.18074e+00 0.00000e+00 0.00000e+00 1.68843e+02 258.401 7.95528e+01 258.401 0.9450 
1 1 1 -11 61  9  o 18 6.54424e+00 1.00452e+00 8.42708e+01 36.503  5.87965e+00  4.35117e+00  0.00000e+00 0.00000e+00 1.43627e+02 36.503  5.93560e+01 36.503  0.9289 
1 1 1 -11 61  10 o 6  1.02736e+01 8.96681e-01 1.99008e+02 86.877  1.83039e+00  3.35486e+01  0.00000e+00 0.00000e+00 1.79986e+02 86.877  1.90221e+01 266.877 0.9850 
1 1 1 -11 61  11 o 4  5.25248e+00 1.08739e+00 1.00878e+02 88.174  2.58693e-01  8.11444e+00  0.00000e+00 0.00000e+00 8.30902e+01 88.174  1.77881e+01 268.174 0.9362 
1 1 1 -11 61  12 o 15 2.92554e+00 9.30043e-01 1.88979e+01 241.408 -4.75995e-01 -8.73336e-01 0.00000e+00 0.00000e+00 2.96942e+01 241.408 1.07963e+01 241.408 0.4445 
1 1 1 -11 61  13 o 8  1.07081e+01 8.79328e-01 1.59698e+02 153.896 -3.20192e+01 1.56890e+01  0.00000e+00 0.00000e+00 2.34317e+02 153.896 7.46186e+01 153.896 0.9859 
1 1 1 -11 61  14 o 12 3.63566e+00 1.07808e+00 5.20203e+01 257.888 -8.26727e-01 -3.85250e+00 0.00000e+00 0.00000e+00 6.46897e+01 257.888 1.26694e+01 257.888 0.8612 
1 1 1 -11 61  15 o 6  5.62195e+00 1.22236e+00 1.14583e+02 169.629 -1.32944e+01 2.43300e+00  0.00000e+00 0.00000e+00 8.68046e+01 169.629 2.77780e+01 349.629 0.9623 
1 1 1 -11 62  1  o 12 9.82623e+00 9.80217e-01 1.89749e+02 89.211  2.42757e-01  1.76322e+01  0.00000e+00 0.00000e+00 1.70125e+02 89.211  1.96237e+01 269.211 0.9712 
1 1 1 -11 62  2  o 19 4.86234e+00 1.07382e+00 1.34908e+02 142.391 -5.10260e+00 3.93079e+00  0.00000e+00 0.00000e+00 3.34520e+01 142.391 1.01456e+02 322.391 0.9187 
1 1 1 -11 62  3  o 12 1.06013e+01 8.55932e-01 2.27647e+02 231.556 -1.66903e+01 -2.10249e+01 0.00000e+00 0.00000e+00 1.64157e+02 231.556 6.34899e+01 51.556  0.9812 
1 1 1 -11 62  4  o 6  4.32366e+00 1.11500e+00 1.00864e+02 111.932 -1.77573e+00 4.41014e+00  0.00000e+00 0.00000e+00 4.35524e+01 111.932 5.73120e+01 291.932 0.8874 
1 1 1 -11 62  5  o 1  1.13893e+01 6.84143e-01 2.10161e+02 41.145  2.40902e+01  2.10484e+01  0.00000e+00 0.00000e+00 2.11494e+02 41.145  1.33251e+00 41.145  0.9842 
1 1 1 -11 62  6  o 9  1.34628e+01 6.74052e-01 2.24821e+02 276.231 4.70398e+00  -4.30811e+01 0.00000e+00 0.00000e+00 2.75311e+02 276.231 5.04909e+01 276.231 0.9884 
1 1 1 -11 62  7  o 7  6.81529e+00 9.16344e-01 1.39692e+02 340.304 1.17646e+01  -4.21139e+00 0.00000e+00 0.00000e+00 1.05783e+02 340.304 3.39097e+01 160.304 0.9591 
1 1 1 -11 62  8  o 9  9.61668e+00 7.94668e-01 1.92490e+02 10.374  2.73345e+01  5.00378e+00  0.00000e+00 0.00000e+00 1.61775e+02 10.374  3.07154e+01 190.374 0.9818 
1 1 1 -11 62  9  o 2  1.80137e+01 7.27593e-01 2.54525e+02 144.774 -5.87190e+01 4.14618e+01  0.00000e+00 0.00000e+00 4.15983e+02 144.774 1.61459e+02 144.774 0.9930 
1 1 1 -11 62  10 o 10 4.87024e+00 1.09446e+00 7.18537e+01 356.268 4.87003e+00  -3.17618e-01 0.00000e+00 0.00000e+00 9.05515e+01 356.268 1.86978e+01 356.268 0.8905 
1 1 1 -11 62  11 o 15 5.36557e+00 1.05164e+00 1.28977e+02 106.819 -3.24840e+00 1.07462e+01  0.00000e+00 0.00000e+00 6.25630e+01 106.819 6.64141e+01 286.819 0.9544 
1 1 1 -11 62  12 o 9  9.82040e+00 8.47644e-01 1.70234e+02 345.647 3.18508e+01  -8.14981e+00 0.00000e+00 0.00000e+00 1.91052e+02 345.647 2.08179e+01 345.647 0.9847 
1 1 1 -11 62  13 o 11 3.92641e+00 1.09895e+00 5.40419e+01 127.463 -2.28158e+00 2.97737e+00  0.00000e+00 0.00000e+00 7.09730e+01 127.463 1.69310e+01 127.463 0.8532 
1 1 1 -11 62  14 f 0  3.37623e+00 1.02595e+00 3.33832e+01 184.018 -2.42035e+00 -1.69997e-01 0.00000e+00 0.00000e+00 6.18378e+01 184.018 2.84546e+01 184.018 0.7567 
1 1 1 -11 62  15 o 3  3.39714e+00 1.02564e+00 4.57004e+01 118.555 -1.83711e+00 3.37577e+00  0.00000e+00 0.00000e+00 6.26876e+01 118.555 1.69871e+01 118.555 0.8572 
1 1 1 -11 63  1  o 18 5.84972e+00 1.17560e+00 1.29066e+02 106.985 -2.16222e+00 7.07903e+00  0.00000e+00 0.00000e+00 7.59930e+01 106.985 5.30735e+01 286.985 0.9298 
1 1 1 -11 63  2  f 0  1.10677e+01 1.00571e+00 2.57969e+02 353.019 2.97784e+01  -3.64650e+00 0.00000e+00 0.00000e+00 1.52078e+02 353.019 1.05891e+02 173.019 0.9832 
1 1 1 -11 63  3  o 10 8.34622e+00 9.36667e-01 1.19107e+02 79.224  2.19372e+00  1.15260e+01  0.00000e+00 0.00000e+00 1.81504e+02 79.224  6.23969e+01 79.224  0.9564 
1 1 1 -11 63  4  o 2  9.26719e+00 8.67844e-01 1.97810e+02 273.607 1.32056e+00  -2.09509e+01 0.00000e+00 0.00000e+00 1.42552e+02 273.607 5.52578e+01 93.607  0.9759 
1 1 1 -11 63  5  o 10 1.14647e+01 6.96716e-01 2.56037e+02 110.230 -1.38319e+01 3.75336e+01  0.00000e+00 0.00000e+00 1.69708e+02 110.230 8.63285e+01 290.230 0.9874 
1 1 1 -11 63  6  o 3  1.28776e+01 6.72964e-01 1.68878e+02 245.450 -1.22548e+01 -2.68282e+01 0.00000e+00 0.00000e+00 3.06774e+02 245.450 1.37896e+02 245.450 0.9829 
1 1 1 -11 63  7  o 18 9.34124e+00 8.93358e-01 1.62364e+02 79.119  3.73150e+00  1.94120e+01  0.00000e+00 0.00000e+00 1.79385e+02 79.119  1.70206e+01 79.119  0.9744 
1 1 1 -11 63  8  o 5  6.61332e+00 9.63005e-01 1.09905e+02 130.907 -6.63254e+00 7.65486e+00  0.00000e+00 0.00000e+00 1.25599e+02 130.907 1.56945e+01 130.907 0.9493 
1 1 1 -11 63  9  o 1  5.11704e+00 1.09181e+00 1.08214e+02 124.022 -4.42115e+00 6.54908e+00  0.00000e+00 0.00000e+00 7.09780e+01 124.022 3.72364e+01 304.022 0.9344 
1 1 1 -11 63  10 o 4  7.03116e+00 1.05894e+00 1.28517e+02 218.413 -1.12752e+01 -8.94067e+00 0.00000e+00 0.00000e+00 1.25405e+02 218.413 3.11209e+00 38.413  0.9646 
1 1 1 -11 63  11 o 5  1.33856e+01 7.51935e-01 2.37037e+02 27.800  4.95051e+01  2.61013e+01  0.00000e+00 0.00000e+00 2.59071e+02 27.800  2.20334e+01 27.800  0.9910 
1 1 1 -11 63  12 o 2  3.40380e+00 1.00877e+00 7.26400e+01 48.541  2.95546e+00  3.34537e+00  0.00000e+00 0.00000e+00 3.91589e+01 48.541  3.34810e+01 228.541 0.8793 
1 1 1 -11 63  13 o 15 4.62005e+00 1.11583e+00 8.49529e+01 186.696 -7.13248e+00 -8.37346e-01 0.00000e+00 0.00000e+00 7.49274e+01 186.696 1.00255e+01 6.696   0.9275 
1 1 1 -11 63  14 o 3  8.57317e+00 1.06952e+00 1.23615e+02 106.770 -6.29413e+00 2.08862e+01  0.00000e+00 0.00000e+00 1.88439e+02 106.770 6.48242e+01 106.770 0.9768 
1 1 1 -11 63  15 o 19 3.22396e+00 1.02018e+00 6.48448e+01 160.702 -4.80473e+00 1.68239e+00  0.00000e+00 0.00000e+00 4.25869e+01 160.702 2.22579e+01 340.702 0.8954 
1 1 1 -11 64  1  o 9  1.19011e+01 8.96684e-01 2.52890e+02 88.825  7.11040e-01  3.46682e+01  0.00000e+00 0.00000e+00 1.89220e+02 88.825  6.36697e+01 268.825 0.9855 
1 1 1 -11 64  2  o 19 6.47579e+00 1.22745e+00 1.23721e+02 277.432 1.07297e+00  -8.22504e+00 0.00000e+00 0.00000e+00 1.05043e+02 277.432 1.86783e+01 97.432  0.9376 
1 1 1 -11 64  3  o 11 4.38429e+00 1.12294e+00 8.32389e+01 329.464 3.40763e+00  -2.01012e+00 0.00000e+00 0.00000e+00 5.90339e+01 329.464 2.42050e+01 149.464 0.8618 
1 1 1 -11 64  4  o 6  5.23510e+00 1.07083e+00 7.95472e+01 332.420 4.21379e+00  -2.20105e+00 0.00000e+00 0.00000e+00 9.52513e+01 332.420 1.57041e+01 332.420 0.8873 
1 1 1 -11 64  5  f 0  5.34132e+00 9.13986e-01 8.92505e+01 246.631 -2.37364e+00 -5.49332e+00 0.00000e+00 0.00000e+00 9.39406e+01 246.631 4.69013e+00 246.631 0.9121 
1 1 1 -11 64  6  o 9  6.73077e+00 9.09750e-01 1.82464e+02 42.656  1.21724e+01  1.12150e+01  0.00000e+00 0.00000e+00 6.26640e+01 42.656  1.19800e+02 222.656 0.9693 
1 1 1 -11 64  7  o 15 5.51793e+00 1.01088e+00 1.19036e+02 267.669 -3.62328e-01 -8.90033e+00 0.00000e+00 0.00000e+00 7.61119e+01 267.669 4.29245e+01 87.669  0.9421 
1 1 1 -11 64  8  o 6  1.42357e+01 6.94975e-01 2.41433e+02 26.654  5.04682e+01  2.53316e+01  0.00000e+00 0.00000e+00 2.87757e+02 26.654  4.63246e+01 26.654  0.9911 
1 1 1 -11 64  9  o 7  1.93085e+01 7.14629e-01 3.00701e+02 246.357 -4.13207e+01 -9.43876e+01 0.00000e+00 0.00000e+00 4.19287e+02 246.357 1.18586e+02 246.357 0.9951 
1 1 1 -11 64  10 o 5  7.96967e+00 1.14655e+00 1.85579e+02 41.093  1.59435e+01  1.39051e+01  0.00000e+00 0.00000e+00 1.05608e+02 41.093  7.99711e+01 221.093 0.9761 
1 1 1 -11 64  11 o 17 4.20847e+00 1.07609e+00 5.16346e+01 274.136 2.47172e-01  -3.41778e+00 0.00000e+00 0.00000e+00 8.01069e+01 274.136 2.84723e+01 274.136 0.8372 
1 1 1 -11 64  12 o 2  3.19354e+00 9.77433e-01 3.49861e+01 38.680  1.60699e+00  1.28652e+00  0.00000e+00 0.00000e+00 4.93607e+01 38.680  1.43746e+01 38.680  0.7072 
1 1 1 -11 64  13 o 19 4.87011e+00 1.19587e+00 9.05094e+01 36.295  6.43164e+00  4.72368e+00  0.00000e+00 0.00000e+00 7.93686e+01 36.295  1.11408e+01 216.295 0.9351 
1 1 1 -11 64  14 o 6  3.39238e+00 1.05145e+00 3.76559e+01 265.619 -2.07735e-01 -2.71164e+00 0.00000e+00 0.00000e+00 6.18011e+01 265.619 2.41452e+01 265.619 0.7869 
1 1 1 -11 64  15 o 18 6.76437e+00 1.22152e+00 8.84381e+01 47.053  8.80198e+00  9.45652e+00  0.00000e+00 0.00000e+00 1.53300e+02 47.053  6.48615e+01 47.053  0.9605 
1 1 1 -11 65  1  f 0  1.48183e+01 8.55128e-01 3.64516e+02 328.864 5.62617e+01  -3.39871e+01 0.00000e+00 0.00000e+00 1.89712e+02 328.864 1.74805e+02 148.864 0.9924 
1 1 1 -11 65  2  o 14 1.20439e+01 9.64564e-01 1.66471e+02 334.857 2.00433e+01  -9.40743e+00 0.00000e+00 0.00000e+00 2.76849e+02 334.857 1.10378e+02 334.857 0.9772 
1 1 1 -11 65  3  o 12 3.77830e+00 1.04436e+00 4.78680e+01 354.256 2.08187e+00  -2.09403e-01 0.00000e+00 0.00000e+00 5.34609e+01 354.256 5.59297e+00 354.256 0.7124 
1 1 1 -11 65  4  o 15 9.27498e+00 9.01617e-01 1.81948e+02 229.054 -1.39009e+01 -1.60215e+01 0.00000e+00 0.00000e+00 1.58668e+02 229.054 2.32799e+01 49.054  0.9761 
1 1 1 -11 65  5  o 3  8.89569e+00 8.12719e-01 2.47297e+02 57.349  1.53099e+01  2.38924e+01  0.00000e+00 0.00000e+00 8.11903e+01 57.349  1.66107e+02 237.349 0.9822 
1 1 1 -11 65  6  o 19 7.81917e+00 8.55306e-01 1.31850e+02 306.845 8.33530e+00  -1.11239e+01 0.00000e+00 0.00000e+00 1.51112e+02 306.845 1.92629e+01 306.845 0.9633 
1 1 1 -11 65  7  o 14 3.69600e+00 9.56815e-01 3.94893e+01 14.694  1.96449e+00  5.15136e-01  0.00000e+00 0.00000e+00 5.80056e+01 14.694  1.85163e+01 14.694  0.7028 
1 1 1 -11 65  8  o 10 4.64664e+00 1.03173e+00 8.36055e+01 196.071 -5.42671e+00 -1.56338e+00 0.00000e+00 0.00000e+00 7.43539e+01 196.071 9.25161e+00 16.071  0.9065 
1 1 1 -11 65  9  o 15 5.68283e+00 1.05531e+00 1.28088e+02 29.236  9.34560e+00  5.23070e+00  0.00000e+00 0.00000e+00 7.46177e+01 29.236  5.34703e+01 209.236 0.9521 
1 1 1 -11 65  10 o 6  7.01263e+00 9.44216e-01 1.10062e+02 260.494 -1.95853e+00 -1.16965e+01 0.00000e+00 0.00000e+00 1.41071e+02 260.494 3.10093e+01 260.494 0.9569 
1 1 1 -11 65  11 o 15 6.45967e+00 1.04877e+00 1.16090e+02 253.564 -3.44540e+00 -1.16798e+01 0.00000e+00 0.00000e+00 1.15268e+02 253.564 8.21465e-01 73.565  0.9580 
1 1 1 -11 65  12 o 15 3.84124e+00 1.00111e+00 8.33167e+01 290.043 1.97126e+00  -5.40328e+00 0.00000e+00 0.00000e+00 4.69739e+01 290.043 3.63429e+01 110.043 0.9083 
1 1 1 -11 65  13 o 18 5.31984e+00 1.20852e+00 1.08336e+02 74.852  2.75078e+00  1.01609e+01  0.00000e+00 0.00000e+00 8.04069e+01 74.852  2.79293e+01 254.852 0.9512 
1 1 1 -11 65  14 o 11 5.10852e+00 1.23739e+00 8.77508e+01 169.487 -8.93874e+00 1.65882e+00  0.00000e+00 0.00000e+00 9.17504e+01 169.487 3.99957e+00 169.487 0.9433 
1 1 1 -11 65  15 f 0  4.40655e+00 1.18783e+00 5.64923e+01 131.132 -3.57532e+00 4.09386e+00  0.00000e+00 0.00000e+00 9.14658e+01 131.132 3.49735e+01 131.132 0.9026 
1 1 1 -11 66  1  o 3  5.24782e+00 1.00739e+00 1.25409e+02 119.407 -3.50134e+00 6.21210e+00  0.00000e+00 0.00000e+00 5.78998e+01 119.407 6.75095e+01 299.407 0.9270 
1 1 1 -11 66  2  o 3  7.21982e+00 1.20713e+00 1.36996e+02 199.139 -1.00089e+01 -3.47345e+00 0.00000e+00 0.00000e+00 1.21751e+02 199.139 1.52447e+01 19.139  0.9516 
1 1 1 -11 66  3  o 2  4.30505e+00 1.11808e+00 9.00843e+01 54.231  2.44078e+00  3.38806e+00  0.00000e+00 0.00000e+00 5.08846e+01 54.231  3.91997e+01 234.231 0.8700 
1 1 1 -11 66  4  o 1  5.83190e+00 1.05788e+00 1.23034e+02 198.094 -8.02294e+00 -2.62136e+00 0.00000e+00 0.00000e+00 8.28969e+01 198.094 4.01375e+01 18.094  0.9387 
1 1 1 -11 66  5  o 16 6.32011e+00 1.02043e+00 8.85752e+01 320.707 5.26804e+00  -4.31076e+00 0.00000e+00 0.00000e+00 1.30769e+02 320.707 4.21934e+01 320.707 0.9233 
1 1 1 -11 66  6  o 17 3.23764e+00 9.42885e-01 1.01276e+02 37.232  3.75204e+00  2.85130e+00  0.00000e+00 0.00000e+00 6.49511e+00 37.232  9.47811e+01 217.232 0.8863 
1 1 1 -11 66  7  o 17 8.11332e+00 8.27325e-01 8.64239e+01 235.054 -5.96989e+00 -8.54307e+00 0.00000e+00 0.00000e+00 2.03051e+02 235.054 1.16627e+02 235.054 0.9507 
1 1 1 -11 66  8  o 5  6.35203e+00 1.03361e+00 7.70493e+01 329.708 5.71750e+00  -3.33991e+00 0.00000e+00 0.00000e+00 1.42308e+02 329.708 6.52583e+01 329.708 0.9210 
1 1 1 -11 66  9  o 16 8.32296e+00 9.11400e-01 1.22158e+02 259.640 -2.82387e+00 -1.54466e+01 0.00000e+00 0.00000e+00 1.79504e+02 259.640 5.73462e+01 259.640 0.9676 
1 1 1 -11 66  10 f 0  1.27271e+01 7.47916e-01 1.55633e+02 252.004 -1.14113e+01 -3.51283e+01 0.00000e+00 0.00000e+00 3.14114e+02 252.004 1.58480e+02 252.004 0.9864 
1 1 1 -11 66  11 o 12 3.62170e+00 9.21758e-01 7.02403e+01 75.866  1.12469e+00  4.46638e+00  0.00000e+00 0.00000e+00 4.93437e+01 75.866  2.08966e+01 255.866 0.8834 
1 1 1 -11 66  12 o 8  9.89884e+00 8.78225e-01 1.36436e+02 9.686   2.76540e+01  4.72008e+00  0.00000e+00 0.00000e+00 2.26497e+02 9.686   9.00609e+01 9.686   0.9820 
1 1 1 -11 66  13 o 12 5.94127e+00 1.20612e+00 1.33202e+02 216.031 -1.20944e+01 -8.79713e+00 0.00000e+00 0.00000e+00 8.08121e+01 216.031 5.23900e+01 36.031  0.9660 
1 1 1 -11 66  14 o 15 2.58008e+00 8.79702e-01 5.64891e+01 69.627  1.39883e+00  3.76687e+00  0.00000e+00 0.00000e+00 2.65548e+01 69.627  2.99343e+01 249.628 0.8642 
1 1 1 -11 66  15 o 14 4.15406e+00 1.12884e+00 5.28064e+01 63.702  2.38509e+00  4.82634e+00  0.00000e+00 0.00000e+00 8.64928e+01 63.702  3.36865e+01 63.702  0.9016 
1 1 1 -11 67  1  o 19 8.21392e+00 8.70930e-01 1.83226e+02 269.362 -2.00676e-01 -1.80181e+01 0.00000e+00 0.00000e+00 1.17526e+02 269.362 6.56994e+01 89.362  0.9718 
1 1 1 -11 67  2  o 17 6.16028e+00 1.18761e+00 1.09769e+02 61.720  3.53114e+00  6.56364e+00  0.00000e+00 0.00000e+00 1.06025e+02 61.720  3.74369e+00 241.720 0.9303 
1 1 1 -11 67  3  o 18 4.39586e+00 1.11392e+00 2.50419e+01 316.953 9.22269e-01  -8.61433e-01 0.00000e+00 0.00000e+00 6.28951e+01 316.953 3.78532e+01 316.953 0.5316 
1 1 1 -11 67  4  o 3  1.19585e+01 7.97178e-01 2.12579e+02 258.560 -6.54056e+00 -3.23219e+01 0.00000e+00 0.00000e+00 2.30289e+02 258.560 1.77108e+01 258.560 0.9847 
1 1 1 -11 67  5  o 2  1.09037e+01 8.20865e-01 1.80518e+02 36.027  2.18025e+01  1.58560e+01  0.00000e+00 0.00000e+00 2.21586e+02 36.027  4.10672e+01 36.027  0.9813 
1 1 1 -11 67  6  o 19 1.18650e+01 7.13560e-01 1.95836e+02 205.803 -3.26170e+01 -1.57699e+01 0.00000e+00 0.00000e+00 2.43526e+02 205.803 4.76899e+01 205.803 0.9861 
1 1 1 -11 67  7  o 2  1.05251e+01 7.66629e-01 2.10023e+02 28.173  3.10458e+01  1.66276e+01  0.00000e+00 0.00000e+00 1.79237e+02 28.173  3.07864e+01 208.173 0.9857 
1 1 1 -11 67  8  o 10 8.93995e+00 8.21155e-01 1.49557e+02 268.549 -5.27445e-01 -2.08193e+01 0.00000e+00 0.00000e+00 1.77425e+02 268.549 2.78677e+01 268.549 0.9757 
1 1 1 -11 67  9  o 13 6.39614e+00 1.05940e+00 8.66912e+01 354.559 8.44176e+00  -8.04118e-01 0.00000e+00 0.00000e+00 1.38247e+02 354.559 5.15559e+01 354.559 0.9390 
1 1 1 -11 67  10 o 17 3.59083e+00 1.00170e+00 6.58839e+01 113.401 -1.57245e+00 3.63355e+00  0.00000e+00 0.00000e+00 4.99098e+01 113.401 1.59741e+01 293.401 0.8619 
1 1 1 -11 67  11 o 12 2.24178e+00 7.63883e-01 3.04994e+01 245.569 -5.89666e-01 -1.29805e+00 0.00000e+00 0.00000e+00 1.78601e+01 245.569 1.26393e+01 65.569  0.5772 
1 1 1 -11 67  12 o 5  5.41914e+00 1.16581e+00 8.35446e+01 216.893 -6.14522e+00 -4.61275e+00 0.00000e+00 0.00000e+00 1.05083e+02 216.893 2.15383e+01 216.893 0.9325 
1 1 1 -11 67  13 o 2  3.55219e+00 1.04438e+00 7.12682e+01 313.233 3.47055e+00  -3.69147e+00 0.00000e+00 0.00000e+00 4.72530e+01 313.233 2.40152e+01 133.233 0.8949 
1 1 1 -11 67  14 o 14 5.04187e+00 1.20610e+00 1.30570e+02 67.427  5.07109e+00  1.21989e+01  0.00000e+00 0.00000e+00 4.99204e+01 67.427  8.06501e+01 247.427 0.9614 
1 1 1 -11 68  1  o 7  1.48803e+01 6.90804e-01 2.91660e+02 50.873  3.76310e+01  4.62608e+01  0.00000e+00 0.00000e+00 2.64142e+02 50.873  2.75180e+01 230.873 0.9916 
1 1 1 -11 68  2  o 5  7.76088e+00 1.19940e+00 2.08106e+02 168.847 -1.74196e+01 3.43446e+00  0.00000e+00 0.00000e+00 7.57293e+01 168.847 1.32377e+02 348.846 0.9714 
1 1 1 -11 68  3  o 8  1.00317e+01 9.94424e-01 2.04891e+02 309.013 1.54706e+01  -1.90956e+01 0.00000e+00 0.00000e+00 1.64804e+02 309.013 4.00866e+01 129.013 0.9794 
1 1 1 -11 68  4  o 10 5.05305e+00 1.03638e+00 1.02030e+02 82.688  8.32785e-01  6.49047e+00  0.00000e+00 0.00000e+00 7.27820e+01 82.688  2.92483e+01 262.688 0.9201 
1 1 1 -11 68  5  o 12 2.55436e+00 8.19883e-01 3.18218e+01 330.240 9.49551e-01  -5.42922e-01 0.00000e+00 0.00000e+00 1.41178e+01 330.240 1.77040e+01 150.240 0.4786 
1 1 1 -11 68  6  o 19 6.36770e+00 9.66382e-01 9.77729e+01 318.335 6.43773e+00  -5.72878e+00 0.00000e+00 0.00000e+00 1.26972e+02 318.335 2.91988e+01 318.335 0.9401 
1 1 1 -11 68  7  o 1  1.27955e+01 6.99598e-01 2.35434e+02 158.592 -4.27537e+01 1.67620e+01  0.00000e+00 0.00000e+00 2.39317e+02 158.592 3.88252e+00 158.592 0.9891 
1 1 1 -11 68  8  o 12 6.24581e+00 9.53158e-01 6.87513e+01 311.288 4.43817e+00  -5.05407e+00 0.00000e+00 0.00000e+00 1.47161e+02 311.288 7.84099e+01 311.288 0.9223 
1 1 1 -11 68  9  o 8  9.56165e+00 8.50639e-01 1.43246e+02 91.409  -5.72733e-01 2.32839e+01  0.00000e+00 0.00000e+00 2.07006e+02 91.409  6.37594e+01 91.409  0.9783 
1 1 1 -11 68  10 o 17 9.31778e+00 8.21926e-01 1.71468e+02 217.144 -2.29946e+01 -1.74186e+01 0.00000e+00 0.00000e+00 1.70973e+02 217.144 4.95562e-01 37.144  0.9825 
1 1 1 -11 68  11 o 8  4.46318e+00 1.06057e+00 9.26494e+01 154.665 -6.51611e+00 3.08505e+00  0.00000e+00 0.00000e+00 6.20763e+01 154.665 3.05731e+01 334.665 0.9278 
1 1 1 -11 68  12 o 5  1.04471e+01 9.04972e-01 1.76783e+02 318.535 2.80375e+01  -2.47747e+01 0.00000e+00 0.00000e+00 2.07880e+02 318.535 3.10974e+01 318.535 0.9865 
1 1 1 -11 68  13 o 6  4.40935e+00 1.17517e+00 5.19243e+01 73.889  1.20918e+00  4.18623e+00  0.00000e+00 0.00000e+00 9.20589e+01 73.889  4.01347e+01 73.889  0.8760 
1 1 1 -11 68  14 o 10 5.68180e+00 1.26862e+00 9.05876e+01 11.953  1.01056e+01  2.13938e+00  0.00000e+00 0.00000e+00 1.10429e+02 11.953  1.98416e+01 11.953  0.9503 
1 1 1 -11 69  1  o 4  1.00212e+01 7.79131e-01 1.83191e+02 262.116 -3.46520e+00 -2.50225e+01 0.00000e+00 0.00000e+00 1.86678e+02 262.116 3.48698e+00 262.116 0.9800 
1 1 1 -11 69  2  o 14 5.27547e+00 1.01473e+00 8.94189e+01 318.235 4.16712e+00  -3.72125e+00 0.00000e+00 0.00000e+00 9.03767e+01 318.235 9.57781e-01 318.235 0.9054 
1 1 1 -11 69  3  f 0  4.00233e+00 1.06873e+00 1.50317e+01 227.774 -4.80810e-01 -5.29778e-01 0.00000e+00 0.00000e+00 3.56518e+01 227.774 2.06201e+01 227.774 0.3366 
1 1 1 -11 69  4  o 8  8.18881e+00 8.46490e-01 1.43217e+02 194.301 -1.53890e+01 -3.92287e+00 0.00000e+00 0.00000e+00 1.54780e+02 194.301 1.15629e+01 194.301 0.9680 
1 1 1 -11 69  5  o 15 5.01612e+00 1.06739e+00 1.03165e+02 79.674  1.22183e+00  6.70592e+00  0.00000e+00 0.00000e+00 7.08470e+01 79.674  3.23179e+01 259.674 0.9234 
1 1 1 -11 69  6  o 11 6.39989e+00 9.93843e-01 1.70159e+02 130.184 -9.64285e+00 1.14172e+01  0.00000e+00 0.00000e+00 6.18987e+01 130.184 1.08260e+02 310.184 0.9659 
1 1 1 -11 69  7  o 4  4.27997e+00 1.02965e+00 9.88664e+01 307.632 3.50525e+00  -4.54643e+00 0.00000e+00 0.00000e+00 4.69137e+01 307.632 5.19527e+01 127.632 0.9081 
1 1 1 -11 69  8  o 16 7.34496e+00 9.70835e-01 1.41417e+02 325.074 1.34278e+01  -9.37632e+00 0.00000e+00 0.00000e+00 1.25280e+02 325.074 1.61367e+01 145.074 0.9690 
1 1 1 -11 69  9  o 14 7.67184e+00 8.53762e-01 1.29592e+02 24.465  1.45970e+01  6.64153e+00  0.00000e+00 0.00000e+00 1.48513e+02 24.465  1.89213e+01 24.465  0.9683 
1 1 1 -11 69  10 o 18 4.00065e+00 9.93895e-01 2.67489e+01 19.731  1.67053e+00  5.99166e-01  0.00000e+00 0.00000e+00 7.15635e+01 19.731  4.48145e+01 19.731  0.6571 
1 1 1 -11 69  11 o 17 2.50069e+00 8.32546e-01 4.08067e+01 335.046 1.87465e+00  -8.72336e-01 0.00000e+00 0.00000e+00 2.53891e+01 335.046 1.54176e+01 155.046 0.7086 
1 1 1 -11 69  12 o 11 3.02261e+00 9.46455e-01 2.16900e+01 259.664 -2.44580e-01 -1.34101e+00 0.00000e+00 0.00000e+00 4.15206e+01 259.664 1.98306e+01 259.664 0.5604 
1 1 1 -11 69  13 o 4  2.99393e+00 9.59371e-01 2.00538e+01 288.432 4.42130e-01  -1.32660e+00 0.00000e+00 0.00000e+00 4.35466e+01 288.432 2.34928e+01 288.432 0.5700 
1 1 1 -11 69  14 o 12 3.01478e+00 9.69513e-01 5.16988e+01 82.036  5.95531e-01  4.25703e+00  0.00000e+00 0.00000e+00 4.63909e+01 82.036  5.30790e+00 262.036 0.8741 
1 1 1 -11 70  1  o 2  5.59098e+00 1.01855e+00 7.06605e+01 142.475 -3.81873e+00 2.93286e+00  0.00000e+00 0.00000e+00 1.16478e+02 142.475 4.58172e+01 142.475 0.8889 
1 1 1 -11 70  2  o 7  3.98342e+00 1.00727e+00 5.20505e+01 106.977 -7.40787e-01 2.42642e+00  0.00000e+00 0.00000e+00 6.32271e+01 106.977 1.11766e+01 106.977 0.7690 
1 1 1 -11 70  3  f 0  5.42674e+00 1.13646e+00 7.57165e+01 171.214 -4.80042e+00 7.41978e-01  0.00000e+00 0.00000e+00 1.05935e+02 171.214 3.02186e+01 171.214 0.8900 
1 1 1 -11 70  4  o 5  3.73614e+00 1.10632e+00 6.63629e+01 252.503 -9.82776e-01 -3.11751e+00 0.00000e+00 0.00000e+00 4.99204e+01 252.503 1.64424e+01 72.503  0.8280 
1 1 1 -11 70  5  o 1  4.49788e+00 1.07833e+00 5.26160e+01 154.435 -2.79082e+00 1.33502e+00  0.00000e+00 0.00000e+00 8.53552e+01 154.435 3.27392e+01 154.435 0.8167 
1 1 1 -11 70  6  o 3  3.02032e+00 8.97853e-01 3.40290e+01 25.510  1.38615e+00  6.61455e-01  0.00000e+00 0.00000e+00 3.45374e+01 25.510  5.08341e-01 25.510  0.6049 
1 1 1 -11 70  7  o 1  4.44748e+00 9.66141e-01 9.61403e+01 49.308  4.27375e+00  4.97010e+00  0.00000e+00 0.00000e+00 5.73288e+01 49.308  3.88116e+01 229.308 0.9202 
1 1 1 -11 70  8  o 15 3.60988e+00 1.01526e+00 3.33385e+01 264.878 -1.69086e-01 -1.88626e+00 0.00000e+00 0.00000e+00 5.85674e+01 264.878 2.52289e+01 264.878 0.6795 
1 1 1 -11 70  9  o 5  8.48638e+00 8.38433e-01 9.54228e+01 123.188 -7.87459e+00 1.20391e+01  0.00000e+00 0.00000e+00 2.10972e+02 123.188 1.15549e+02 123.188 0.9646 
1 1 1 -11 70  10 o 15 7.59813e+00 9.01632e-01 1.20877e+02 105.144 -4.33189e+00 1.60056e+01  0.00000e+00 0.00000e+00 1.54522e+02 105.144 3.36457e+01 105.144 0.9694 
1 1 1 -11 70  11 o 18 4.20722e+00 1.09410e+00 8.07946e+01 151.723 -5.05078e+00 2.71697e+00  0.00000e+00 0.00000e+00 6.18970e+01 151.723 1.88976e+01 331.723 0.9080 
1 1 1 -11 70  12 o 10 7.69371e+00 1.07102e+00 1.32616e+02 274.657 1.65648e+00  -2.03342e+01 0.00000e+00 0.00000e+00 1.47295e+02 274.657 1.46790e+01 274.657 0.9752 
1 1 1 -11 70  13 o 12 6.16939e+00 1.15738e+00 7.05809e+01 211.545 -7.23023e+00 -4.43854e+00 0.00000e+00 0.00000e+00 1.45302e+02 211.545 7.47212e+01 211.545 0.9391 
1 1 1 -11 70  14 o 3  3.07704e+00 9.96979e-01 8.43840e+01 0.931   7.01737e+00  1.13994e-01  0.00000e+00 0.00000e+00 2.16262e+01 0.931   6.27578e+01 180.931 0.9257 
1 1 1 -11 71  1  o 5  6.34186e+00 9.38465e-01 6.94690e+01 141.259 -4.47428e+00 3.58977e+00  0.00000e+00 0.00000e+00 1.47333e+02 141.259 7.78639e+01 141.259 0.9081 
1 1 1 -11 71  2  o 1  3.73019e+00 9.17573e-01 5.21317e+01 184.789 -2.54441e+00 -2.13172e-01 0.00000e+00 0.00000e+00 5.60373e+01 184.789 3.90558e+00 184.789 0.7707 
1 1 1 -11 71  3  o 6  5.95522e+00 1.16709e+00 8.99641e+01 99.670  -1.03142e+00 6.05293e+00  0.00000e+00 0.00000e+00 1.14829e+02 99.670  2.48651e+01 99.670  0.9145 
1 1 1 -11 71  4  o 9  4.78941e+00 1.17501e+00 7.13770e+01 179.843 -4.27295e+00 1.16766e-02  0.00000e+00 0.00000e+00 8.57965e+01 179.843 1.44194e+01 179.843 0.8733 
1 1 1 -11 71  5  o 2  4.35321e+00 1.02720e+00 1.13538e+02 8.139   6.59044e+00  9.42555e-01  0.00000e+00 0.00000e+00 3.71042e+01 8.139   7.64341e+01 188.139 0.9215 
1 1 1 -11 71  6  o 3  1.10159e+01 8.27039e-01 1.82197e+02 47.973  2.17906e+01  2.41779e+01  0.00000e+00 0.00000e+00 2.24760e+02 47.973  4.25636e+01 47.973  0.9845 
1 1 1 -11 71  7  o 8  4.71849e+00 1.03088e+00 7.45645e+01 268.273 -1.58909e-01 -5.27170e+00 0.00000e+00 0.00000e+00 8.45407e+01 268.273 9.97620e+00 268.273 0.8994 
1 1 1 -11 71  8  o 1  5.20936e+00 1.06284e+00 8.96248e+01 136.048 -5.33804e+00 5.14624e+00  0.00000e+00 0.00000e+00 9.18290e+01 136.048 2.20417e+00 136.048 0.9299 
1 1 1 -11 71  9  o 18 9.04427e+00 8.21513e-01 1.77707e+02 340.249 2.82228e+01  -1.01335e+01 0.00000e+00 0.00000e+00 1.55059e+02 340.249 2.26480e+01 160.249 0.9832 
1 1 1 -11 71  10 o 19 3.88934e+00 1.05178e+00 7.29387e+01 331.275 4.31606e+00  -2.36542e+00 0.00000e+00 0.00000e+00 5.66902e+01 331.275 1.62485e+01 151.275 0.8915 
1 1 1 -11 71  11 o 7  4.60286e+00 1.11630e+00 5.54562e+01 304.020 2.50516e+00  -3.71122e+00 0.00000e+00 0.00000e+00 9.57477e+01 304.020 4.02915e+01 304.020 0.8797 
1 1 1 -11 71  12 f 0  4.44944e+00 1.15909e+00 7.60849e+01 113.925 -2.69230e+00 6.06822e+00  0.00000e+00 0.00000e+00 7.68145e+01 113.925 7.29597e-01 113.925 0.9213 
1 1 1 -11 71  13 f 0  4.14894e+00 1.05669e+00 2.34601e+01 336.406 2.14461e+00  -9.36711e-01 0.00000e+00 0.00000e+00 9.19193e+01 336.406 6.84592e+01 336.406 0.7464 
1 1 1 -11 71  14 o 10 3.49067e+00 1.07507e+00 8.48880e+01 98.497  -1.05636e+00 7.07121e+00  0.00000e+00 0.00000e+00 3.55350e+01 98.497  4.93531e+01 278.496 0.9272 
1 1 1 -11 72  1  o 13 5.81922e+00 9.87749e-01 1.18334e+02 97.652  -1.14715e+00 8.53877e+00  0.00000e+00 0.00000e+00 8.75670e+01 97.652  3.07668e+01 277.652 0.9400 
1 1 1 -11 72  2  f 0  1.38064e+01 6.81759e-01 1.54344e+02 72.945  1.01544e+01  3.31006e+01  0.00000e+00 0.00000e+00 3.57495e+02 72.945  2.03151e+02 72.945  0.9855 
1 1 1 -11 72  3  o 13 6.96170e+00 1.18632e+00 1.68439e+02 229.952 -9.32114e+00 -1.10894e+01 0.00000e+00 0.00000e+00 8.41003e+01 229.952 8.43385e+01 49.951  0.9648 
1 1 1 -11 72  4  o 19 7.81265e+00 1.07718e+00 1.08315e+02 313.845 7.66243e+00  -7.97776e+00 0.00000e+00 0.00000e+00 1.71626e+02 313.845 6.33113e+01 313.845 0.9537 
1 1 1 -11 72  5  o 15 7.55127e+00 1.05776e+00 1.83764e+02 282.989 4.28726e+00  -1.85857e+01 0.00000e+00 0.00000e+00 9.22184e+01 282.989 9.15452e+01 102.989 0.9734 
1 1 1 -11 72  6  o 7  5.13298e+00 1.07353e+00 6.40790e+01 42.721  3.49100e+00  3.22373e+00  0.00000e+00 0.00000e+00 1.06787e+02 42.721  4.27080e+01 42.721  0.8873 
1 1 1 -11 72  7  o 3  2.66578e+00 8.57416e-01 4.83049e+01 147.442 -1.82343e+00 1.16425e+00  0.00000e+00 0.00000e+00 2.39285e+01 147.442 2.43764e+01 327.442 0.7229 
1 1 1 -11 72  8  o 8  9.21342e+00 7.92463e-01 1.62532e+02 156.220 -2.45748e+01 1.08285e+01  0.00000e+00 0.00000e+00 1.76034e+02 156.220 1.35020e+01 156.220 0.9812 
1 1 1 -11 72  9  o 7  1.28275e+01 7.02843e-01 2.09536e+02 3.298   5.16146e+01  2.97412e+00  0.00000e+00 0.00000e+00 2.65741e+02 3.298   5.62058e+01 3.298   0.9903 
1 1 1 -11 72  10 o 13 1.14563e+01 7.76528e-01 1.98565e+02 126.268 -2.76139e+01 3.76358e+01  0.00000e+00 0.00000e+00 2.25023e+02 126.268 2.64585e+01 126.268 0.9892 
1 1 1 -11 72  11 o 19 2.88867e+00 8.96032e-01 2.48558e+01 327.113 1.21859e+00  -7.87945e-01 0.00000e+00 0.00000e+00 3.81104e+01 327.113 1.32547e+01 327.113 0.5838 
1 1 1 -11 72  12 o 18 4.48796e+00 1.09352e+00 3.54529e+01 31.318  2.62076e+00  1.59456e+00  0.00000e+00 0.00000e+00 1.00933e+02 31.318  6.54804e+01 31.318  0.8149 
1 1 1 -11 72  13 f 0  3.66327e+00 1.07803e+00 5.88886e+01 153.502 -4.43662e+00 2.21178e+00  0.00000e+00 0.00000e+00 6.28782e+01 153.502 3.98956e+00 153.502 0.8924 
1 1 1 -11 72  14 o 7  4.43010e+00 1.21435e+00 9.86114e+01 232.765 -5.94712e+00 -7.82521e+00 0.00000e+00 0.00000e+00 5.75702e+01 232.765 4.10412e+01 52.765  0.9477 
1 1 1 -11 73  1  o 9  3.61742e+00 1.00963e+00 1.89120e+01 20.885  8.68399e-01  3.31347e-01  0.00000e+00 0.00000e+00 3.83778e+01 20.885  1.94658e+01 20.885  0.4208 
1 1 1 -11 73  2  o 16 4.08899e+00 1.00359e+00 4.50374e+01 233.981 -1.48425e+00 -2.04147e+00 0.00000e+00 0.00000e+00 7.30140e+01 233.981 2.79766e+01 233.981 0.7676 
1 1 1 -11 73  3  o 9  6.41353e+00 1.02550e+00 1.11441e+02 333.992 8.63298e+00  -4.21212e+00 0.00000e+00 0.00000e+00 1.16726e+02 333.992 5.28535e+00 333.992 0.9464 
1 1 1 -11 73  4  o 19 1.35567e+01 9.01147e-01 2.43030e+02 126.795 -2.83514e+01 3.79046e+01  0.00000e+00 0.00000e+00 2.60821e+02 126.795 1.77909e+01 126.795 0.9894 
1 1 1 -11 73  5  o 6  1.03094e+01 8.62654e-01 1.56268e+02 267.896 -9.42485e-01 -2.56509e+01 0.00000e+00 0.00000e+00 2.23111e+02 267.896 6.68429e+01 267.896 0.9803 
1 1 1 -11 73  6  o 3  4.07199e+00 1.05771e+00 6.96203e+01 274.489 3.05654e-01  -3.89368e+00 0.00000e+00 0.00000e+00 6.17011e+01 274.489 7.91924e+00 94.488  0.8598 
1 1 1 -11 73  7  o 2  1.03760e+01 9.19094e-01 1.77038e+02 0.664   3.05851e+01  3.54551e-01  0.00000e+00 0.00000e+00 2.05416e+02 0.664   2.83785e+01 0.664   0.9835 
1 1 1 -11 73  8  o 2  3.92636e+00 9.53833e-01 4.75850e+01 126.684 -1.85823e+00 2.49449e+00  0.00000e+00 0.00000e+00 7.26509e+01 126.684 2.50659e+01 126.684 0.8178 
1 1 1 -11 73  9  o 5  4.50687e+00 1.00110e+00 8.27207e+01 346.598 5.98634e+00  -1.42642e+00 0.00000e+00 0.00000e+00 7.14873e+01 346.598 1.12334e+01 166.597 0.9147 
1 1 1 -11 73  10 f 0  3.13163e+00 9.60841e-01 2.95224e+01 273.005 9.47754e-02  -1.80534e+00 0.00000e+00 0.00000e+00 4.81310e+01 273.005 1.86085e+01 273.005 0.6636 
1 1 1 -11 73  11 o 6  2.60836e+00 8.56438e-01 2.49544e+01 327.492 1.14846e+00  -7.31875e-01 0.00000e+00 0.00000e+00 2.95787e+01 327.492 4.62426e+00 327.492 0.5601 
1 1 1 -11 73  12 o 2  4.55788e+00 1.14541e+00 7.93819e+01 202.692 -6.56629e+00 -2.74564e+00 0.00000e+00 0.00000e+00 7.81265e+01 202.692 1.25541e+00 22.692  0.9268 
1 1 1 -11 73  13 o 15 3.62985e+00 1.06759e+00 1.63864e+01 160.404 -1.27383e+00 4.53486e-01  0.00000e+00 0.00000e+00 5.89629e+01 160.404 4.25764e+01 160.404 0.5574 
1 1 1 -11 73  14 o 3  2.81795e+00 9.33809e-01 6.13951e+01 42.300  3.94123e+00  3.58624e+00  0.00000e+00 0.00000e+00 3.29852e+01 42.300  2.84099e+01 222.300 0.9005 
1 1 1 -11 74  1  o 9  1.90461e+01 6.81126e-01 3.61750e+02 19.666  1.02490e+02  3.66286e+01  0.00000e+00 0.00000e+00 3.51556e+02 19.666  1.01937e+01 199.666 0.9954 
1 1 1 -11 74  2  o 6  1.19426e+01 7.08039e-01 1.94805e+02 153.734 -3.25503e+01 1.60636e+01  0.00000e+00 0.00000e+00 2.48063e+02 153.734 5.32572e+01 153.734 0.9861 
1 1 1 -11 74  3  o 11 6.21134e+00 9.37762e-01 4.02287e+01 31.576  3.00682e+00  1.84809e+00  0.00000e+00 0.00000e+00 1.56470e+02 31.576  1.16241e+02 31.576  0.8426 
1 1 1 -11 74  4  o 11 8.86977e+00 1.11202e+00 1.72786e+02 165.173 -1.86369e+01 4.93352e+00  0.00000e+00 0.00000e+00 1.51583e+02 165.173 2.12034e+01 345.173 0.9737 
1 1 1 -11 74  5  o 4  1.23621e+01 9.20743e-01 1.95339e+02 330.080 2.99898e+01  -1.72589e+01 0.00000e+00 0.00000e+00 2.61866e+02 330.080 6.65268e+01 330.080 0.9854 
1 1 1 -11 74  6  o 15 1.23675e+01 8.35926e-01 1.91145e+02 202.524 -3.63262e+01 -1.50650e+01 0.00000e+00 0.00000e+00 2.66717e+02 202.524 7.55719e+01 202.524 0.9872 
1 1 1 -11 74  7  o 7  1.42445e+01 8.10574e-01 2.08243e+02 69.787  1.89396e+01  5.14392e+01  0.00000e+00 0.00000e+00 3.20605e+02 69.787  1.12362e+02 69.787  0.9908 
1 1 1 -11 74  8  o 3  3.93713e+00 9.84362e-01 7.90467e+01 158.783 -4.66907e+00 1.81256e+00  0.00000e+00 0.00000e+00 5.26589e+01 158.783 2.63878e+01 338.783 0.8936 
1 1 1 -11 74  9  o 11 3.70361e+00 1.01451e+00 5.98842e+01 332.415 3.30608e+00  -1.72728e+00 0.00000e+00 0.00000e+00 5.81691e+01 332.415 1.71510e+00 152.415 0.8523 
1 1 1 -11 74  10 o 16 4.14349e+00 1.07106e+00 7.29846e+01 65.029  2.19060e+00  4.70406e+00  0.00000e+00 0.00000e+00 6.59697e+01 65.029  7.01489e+00 245.029 0.8976 
1 1 1 -11 74  11 o 19 4.03786e+00 9.79596e-01 8.67185e+01 156.077 -6.48949e+00 2.87889e+00  0.00000e+00 0.00000e+00 5.29221e+01 156.077 3.37964e+01 336.077 0.9266 
1 1 1 -11 74  12 o 1  3.75503e+00 1.09091e+00 4.94463e+01 300.474 1.96458e+00  -3.33867e+00 0.00000e+00 0.00000e+00 7.07266e+01 300.474 2.12803e+01 300.474 0.8585 
1 1 1 -11 74  13 o 18 6.69739e+00 1.21894e+00 1.23400e+02 51.450  1.06330e+01  1.33437e+01  0.00000e+00 0.00000e+00 1.18546e+02 51.450  4.85348e+00 231.450 0.9702 
1 1 1 -11 75  1  o 1  6.11107e+00 9.97779e-01 1.29298e+02 203.404 -9.92189e+00 -4.29433e+00 0.00000e+00 0.00000e+00 8.96783e+01 203.404 3.96201e+01 23.404  0.9526 
1 1 1 -11 75  2  o 17 3.75353e+00 1.04552e+00 6.82206e+01 167.457 -3.33816e+00 7.42705e-01  0.00000e+00 0.00000e+00 4.98701e+01 167.457 1.83505e+01 347.457 0.8368 
1 1 1 -11 75  3  o 1  3.19977e+00 8.95115e-01 4.55375e+01 72.899  6.41411e-01  2.08477e+00  0.00000e+00 0.00000e+00 4.16769e+01 72.899  3.86061e+00 252.899 0.7254 
1 1 1 -11 75  4  o 6  3.14892e+00 9.83932e-01 5.75872e+01 291.488 9.90933e-01  -2.51723e+00 0.00000e+00 0.00000e+00 3.53027e+01 291.488 2.22844e+01 111.488 0.7856 
1 1 1 -11 75  5  o 6  1.36156e+01 9.04042e-01 2.13546e+02 263.015 -5.28471e+00 -4.31317e+01 0.00000e+00 0.00000e+00 2.91439e+02 263.015 7.78930e+01 263.015 0.9884 
1 1 1 -11 75  6  o 19 1.24056e+01 8.14025e-01 1.68167e+02 59.635  1.71361e+01  2.92484e+01  0.00000e+00 0.00000e+00 2.90053e+02 59.635  1.21885e+02 59.635  0.9851 
1 1 1 -11 75  7  o 17 1.18109e+01 7.69645e-01 1.58906e+02 239.846 -1.71094e+01 -2.94513e+01 0.00000e+00 0.00000e+00 2.77010e+02 239.846 1.18104e+02 239.846 0.9852 
1 1 1 -11 75  8  o 4  3.81491e+00 9.86830e-01 3.84788e+01 151.538 -2.00712e+00 1.08804e+00  0.00000e+00 0.00000e+00 6.70675e+01 151.538 2.85887e+01 151.538 0.7392 
1 1 1 -11 75  9  o 8  2.79352e+00 8.53975e-01 1.78521e+01 130.416 -6.38695e-01 7.50030e-01  0.00000e+00 0.00000e+00 2.82230e+01 130.416 1.03709e+01 130.416 0.4411 
1 1 1 -11 75  10 o 7  2.89263e+00 9.00594e-01 6.82629e+01 159.730 -3.82270e+00 1.41179e+00  0.00000e+00 0.00000e+00 2.53477e+01 159.730 4.29152e+01 339.730 0.8663 
1 1 1 -11 75  11 o 2  4.06617e+00 1.10588e+00 8.90329e+01 287.650 2.18250e+00  -6.85953e+00 0.00000e+00 0.00000e+00 5.17186e+01 287.650 3.73143e+01 107.649 0.9277 
1 1 1 -11 75  12 o 15 2.50136e+00 8.46107e-01 3.62330e+01 138.871 -1.72023e+00 1.50220e+00  0.00000e+00 0.00000e+00 3.26893e+01 138.871 3.54367e+00 318.871 0.7393 
1 1 1 -11 75  13 o 7  4.76274e+00 1.19957e+00 5.99167e+01 153.957 -5.29111e+00 2.58550e+00  0.00000e+00 0.00000e+00 1.01530e+02 153.957 4.16136e+01 153.957 0.9106 
1 1 1 -11 76  1  o 12 2.88725e+00 8.27482e-01 6.04446e+01 237.102 -1.46805e+00 -2.26939e+00 0.00000e+00 0.00000e+00 2.48366e+01 237.102 3.56080e+01 57.102  0.7854 
1 1 1 -11 76  2  o 7  3.16534e+00 9.39586e-01 6.39486e+01 123.125 -1.51854e+00 2.32720e+00  0.00000e+00 0.00000e+00 3.03100e+01 123.125 3.36387e+01 303.125 0.7922 
1 1 1 -11 76  3  o 7  3.17622e+00 9.34365e-01 5.86564e+01 239.797 -1.43741e+00 -2.46944e+00 0.00000e+00 0.00000e+00 3.66634e+01 239.797 2.19930e+01 59.797  0.7989 
1 1 1 -11 76  4  o 8  5.81316e+00 1.19627e+00 1.43535e+02 66.804  4.41124e+00  1.02942e+01  0.00000e+00 0.00000e+00 6.47196e+01 66.804  7.88157e+01 246.804 0.9543 
1 1 1 -11 76  5  f 0  7.47352e+00 1.17428e+00 9.06954e+01 355.684 9.27694e+00  -7.00166e-01 0.00000e+00 0.00000e+00 1.74149e+02 355.684 8.34531e+01 355.684 0.9446 
1 1 1 -11 76  6  f 0  6.88765e+00 9.92299e-01 1.09762e+02 122.234 -6.70087e+00 1.06268e+01  0.00000e+00 0.00000e+00 1.37929e+02 122.234 2.81674e+01 122.234 0.9593 
1 1 1 -11 76  7  o 2  4.41031e+00 1.00710e+00 8.80685e+01 284.298 1.54615e+00  -6.06659e+00 0.00000e+00 0.00000e+00 6.32788e+01 284.298 2.47897e+01 104.298 0.9162 
1 1 1 -11 76  8  o 12 3.19295e+00 9.11931e-01 6.48458e+01 63.865  1.59121e+00  3.24304e+00  0.00000e+00 0.00000e+00 3.63278e+01 63.865  2.85180e+01 243.865 0.8468 
1 1 1 -11 76  9  o 6  5.59767e+00 1.05371e+00 8.50864e+01 246.667 -3.30646e+00 -7.66544e+00 0.00000e+00 0.00000e+00 1.11215e+02 246.667 2.61284e+01 246.667 0.9380 
1 1 1 -11 76  10 o 9  4.78068e+00 1.09305e+00 8.55681e+01 14.129  7.10514e+00  1.78847e+00  0.00000e+00 0.00000e+00 8.02984e+01 14.129  5.26971e+00 194.129 0.9290 
1 1 1 -11 76  11 o 6  4.33179e+00 1.20191e+00 5.99745e+01 253.231 -1.42168e+00 -4.71811e+00 0.00000e+00 0.00000e+00 8.41218e+01 253.231 2.41473e+01 253.231 0.8917 
1 1 1 -11 76  12 o 12 6.56112e+00 1.19266e+00 1.21187e+02 17.434  1.60434e+01  5.03826e+00  0.00000e+00 0.00000e+00 1.15916e+02 17.434  5.27096e+00 197.434 0.9698 
1 1 1 -11 76  13 o 17 3.97001e+00 1.13547e+00 6.32985e+01 47.254  4.01011e+00  4.33877e+00  0.00000e+00 0.00000e+00 7.12940e+01 47.254  7.99554e+00 47.254  0.9109 
1 1 1 -11 77  1  o 14 6.93527e+00 1.07886e+00 1.08396e+02 205.826 -9.57960e+00 -4.63628e+00 0.00000e+00 0.00000e+00 1.39809e+02 205.826 3.14125e+01 205.826 0.9518 
1 1 1 -11 77  2  o 14 6.01282e+00 9.85372e-01 9.98097e+01 60.180  4.14877e+00  7.23841e+00  0.00000e+00 0.00000e+00 1.12151e+02 60.180  1.23410e+01 60.180  0.9380 
1 1 1 -11 77  3  o 10 1.07459e+01 7.48287e-01 1.91829e+02 139.052 -2.67949e+01 2.32502e+01  0.00000e+00 0.00000e+00 2.06046e+02 139.052 1.42175e+01 139.052 0.9858 
1 1 1 -11 77  4  o 4  6.90487e+00 9.46427e-01 1.32607e+02 139.481 -1.09567e+01 9.36411e+00  0.00000e+00 0.00000e+00 1.17403e+02 139.481 1.52042e+01 319.481 0.9647 
1 1 1 -11 77  5  o 3  7.85881e+00 1.15124e+00 1.57146e+02 253.032 -4.87283e+00 -1.59704e+01 0.00000e+00 0.00000e+00 1.28649e+02 253.032 2.84978e+01 73.032  0.9696 
1 1 1 -11 77  6  o 2  4.91247e+00 1.23432e+00 9.80979e+01 72.912  1.91885e+00  6.24186e+00  0.00000e+00 0.00000e+00 7.12611e+01 72.912  2.68368e+01 252.912 0.9199 
1 1 1 -11 77  7  o 8  8.52368e+00 8.83403e-01 1.76765e+02 336.284 2.48470e+01  -1.09151e+01 0.00000e+00 0.00000e+00 1.36481e+02 336.284 4.02848e+01 156.284 0.9814 
1 1 1 -11 77  8  o 15 9.87410e+00 8.80550e-01 2.17655e+02 149.193 -3.37775e+01 2.01413e+01  0.00000e+00 0.00000e+00 1.47036e+02 149.193 7.06190e+01 329.193 0.9872 
1 1 1 -11 77  9  o 17 4.01798e+00 1.06448e+00 8.87294e+01 341.136 5.86135e+00  -2.00268e+00 0.00000e+00 0.00000e+00 4.87256e+01 341.136 4.00038e+01 161.136 0.9153 
1 1 1 -11 77  10 o 4  8.22048e+00 9.24488e-01 8.11982e+01 113.825 -5.38960e+00 1.22054e+01  0.00000e+00 0.00000e+00 2.14006e+02 113.825 1.32808e+02 113.825 0.9618 
1 1 1 -11 77  11 o 13 2.82778e+00 9.07112e-01 4.51952e+01 184.808 -2.83127e+00 -2.38137e-01 0.00000e+00 0.00000e+00 3.89209e+01 184.808 6.27424e+00 4.808   0.7975 
1 1 1 -11 77  12 o 3  3.61610e+00 1.04232e+00 7.20639e+01 138.499 -4.63523e+00 4.10099e+00  0.00000e+00 0.00000e+00 5.12309e+01 138.499 2.08330e+01 318.499 0.9152 
1 1 1 -11 77  13 f 0  3.55882e+00 1.08811e+00 4.61296e+01 328.858 3.37794e+00  -2.04105e+00 0.00000e+00 0.00000e+00 6.79470e+01 328.858 2.18175e+01 328.858 0.8614 
1 1 1 -11 78  1  o 11 6.80108e+00 1.05847e+00 1.28345e+02 157.843 -1.17840e+01 4.79859e+00  0.00000e+00 0.00000e+00 1.17069e+02 157.843 1.12760e+01 337.843 0.9599 
1 1 1 -11 78  2  o 2  1.07504e+01 7.59150e-01 2.19121e+02 58.779  2.08869e+01  3.44594e+01  0.00000e+00 0.00000e+00 1.79763e+02 58.779  3.93578e+01 238.779 0.9875 
1 1 1 -11 78  3  o 1  4.23274e+00 1.07296e+00 7.57503e+01 355.551 4.68103e+00  -3.64217e-01 0.00000e+00 0.00000e+00 6.50414e+01 355.551 1.07089e+01 175.551 0.8858 
1 1 1 -11 78  4  o 9  8.60360e+00 8.60608e-01 1.39901e+02 80.424  3.36021e+00  1.99186e+01  0.00000e+00 0.00000e+00 1.74863e+02 80.424  3.49621e+01 80.424  0.9749 
1 1 1 -11 78  5  o 12 6.64870e+00 1.26568e+00 9.99334e+01 24.235  8.44420e+00  3.80124e+00  0.00000e+00 0.00000e+00 1.35515e+02 24.235  3.55816e+01 24.235  0.9444 
1 1 1 -11 78  6  o 10 1.02113e+01 1.09606e+00 1.73803e+02 48.469  1.65996e+01  1.87422e+01  0.00000e+00 0.00000e+00 2.01094e+02 48.469  2.72909e+01 48.469  0.9798 
1 1 1 -11 78  7  o 8  1.71600e+01 7.39599e-01 2.65188e+02 292.522 3.09327e+01  -7.45955e+01 0.00000e+00 0.00000e+00 3.73267e+02 292.522 1.08079e+02 292.522 0.9938 
1 1 1 -11 78  8  o 9  9.11748e+00 9.03224e-01 1.04451e+02 281.347 3.58990e+00  -1.78892e+01 0.00000e+00 0.00000e+00 2.27105e+02 281.347 1.22654e+02 281.347 0.9722 
1 1 1 -11 78  9  o 10 3.86976e+00 1.04581e+00 4.91648e+01 78.674  6.51560e-01  3.25304e+00  0.00000e+00 0.00000e+00 7.10019e+01 78.674  2.18371e+01 78.674  0.8310 
1 1 1 -11 78  10 o 14 4.96499e+00 1.08274e+00 4.19571e+01 358.141 3.90796e+00  -1.26818e-01 0.00000e+00 0.00000e+00 1.17435e+02 358.141 7.54783e+01 358.141 0.8600 
1 1 1 -11 78  11 o 4  3.66755e+00 1.04971e+00 8.66173e+01 116.320 -2.97319e+00 6.01047e+00  0.00000e+00 0.00000e+00 3.94908e+01 116.320 4.71264e+01 296.320 0.9221 
1 1 1 -11 78  12 o 9  3.37837e+00 1.01447e+00 7.34246e+01 255.809 -1.45012e+00 -5.73454e+00 0.00000e+00 0.00000e+00 4.12139e+01 255.809 3.22108e+01 75.809  0.9110 
1 1 1 -11 78  13 o 2  4.20071e+00 1.08926e+00 9.49332e+01 32.641  8.27365e+00  5.29962e+00  0.00000e+00 0.00000e+00 5.31640e+01 32.641  4.17692e+01 212.641 0.9477 
1 1 1 -11 79  1  o 5  8.08552e+00 9.86366e-01 1.73755e+02 127.914 -1.32987e+01 1.70741e+01  0.00000e+00 0.00000e+00 1.23036e+02 127.914 5.07183e+01 307.914 0.9766 
1 1 1 -11 79  2  o 13 4.32030e+00 1.02636e+00 1.13801e+02 8.823   7.30589e+00  1.13406e+00  0.00000e+00 0.00000e+00 3.70791e+01 8.823   7.67223e+01 188.823 0.9297 
1 1 1 -11 79  3  o 19 1.25474e+01 7.14806e-01 2.03349e+02 61.117  2.23101e+01  4.04425e+01  0.00000e+00 0.00000e+00 2.62587e+02 61.117  5.92375e+01 61.117  0.9891 
1 1 1 -11 79  4  o 15 6.87899e+00 9.62191e-01 1.51799e+02 339.493 1.58876e+01  -5.94246e+00 0.00000e+00 0.00000e+00 9.85616e+01 339.493 5.32372e+01 159.493 0.9701 
1 1 1 -11 79  5  o 8  6.37472e+00 1.21829e+00 1.41026e+02 34.240  1.01711e+01  6.92278e+00  0.00000e+00 0.00000e+00 8.80419e+01 34.240  5.29839e+01 214.240 0.9585 
1 1 1 -11 79  6  o 18 1.44804e+01 9.56422e-01 2.00027e+02 257.755 -1.00595e+01 -4.63497e+01 0.00000e+00 0.00000e+00 3.36690e+02 257.755 1.36663e+02 257.755 0.9894 
1 1 1 -11 79  7  o 16 5.08543e+00 1.07379e+00 7.79543e+01 93.344  -3.64870e-01 6.24421e+00  0.00000e+00 0.00000e+00 9.64344e+01 93.344  1.84801e+01 93.344  0.9161 
1 1 1 -11 79  8  o 2  8.86534e+00 9.46454e-01 1.75818e+02 25.737  2.59016e+01  1.24861e+01  0.00000e+00 0.00000e+00 1.49900e+02 25.737  2.59184e+01 205.737 0.9825 
1 1 1 -11 79  9  o 4  8.56594e+00 8.98273e-01 1.56184e+02 113.335 -1.08533e+01 2.51588e+01  0.00000e+00 0.00000e+00 1.57951e+02 113.335 1.76734e+00 113.335 0.9816 
1 1 1 -11 79  10 o 13 9.91752e+00 8.94136e-01 1.41686e+02 203.237 -3.04621e+01 -1.30793e+01 0.00000e+00 0.00000e+00 2.22836e+02 203.237 8.11501e+01 203.237 0.9848 
1 1 1 -11 79  11 o 14 4.22209e+00 1.09162e+00 7.96675e+01 50.225  4.34673e+00  5.22168e+00  0.00000e+00 0.00000e+00 6.56455e+01 50.225  1.40220e+01 230.225 0.9232 
1 1 1 -11 79  12 o 2  2.28240e+00 7.87327e-01 1.58816e+01 231.851 -6.92569e-01 -8.81720e-01 0.00000e+00 0.00000e+00 2.55695e+01 231.851 9.68790e+00 231.851 0.4877 
1 1 1 -11 79  13 o 10 4.01918e+00 1.18189e+00 5.68619e+01 289.825 1.70976e+00  -4.74241e+00 0.00000e+00 0.00000e+00 7.68327e+01 289.825 1.99708e+01 289.825 0.8943 
1 1 1 -11 80  1  o 11 4.32682e+00 1.02836e+00 7.46248e+01 37.281  3.92352e+00  2.98688e+00  0.00000e+00 0.00000e+00 7.03659e+01 37.281  4.25889e+00 217.281 0.8918 
1 1 1 -11 80  2  o 11 1.33303e+01 6.96293e-01 2.27094e+02 4.725   5.50598e+01  4.55113e+00  0.00000e+00 0.00000e+00 2.69002e+02 4.725   4.19084e+01 4.725   0.9909 
1 1 1 -11 80  3  o 1  3.63917e+00 9.81104e-01 4.80983e+01 152.330 -2.49161e+00 1.30643e+00  0.00000e+00 0.00000e+00 6.05191e+01 152.330 1.24208e+01 152.330 0.7952 
1 1 1 -11 80  4  o 10 5.76934e+00 1.03456e+00 6.50764e+01 167.894 -5.63063e+00 1.20776e+00  0.00000e+00 0.00000e+00 1.31517e+02 167.894 6.64404e+01 167.894 0.9084 
1 1 1 -11 80  5  o 11 5.43653e+00 1.07999e+00 9.82640e+01 286.319 2.13672e+00  -7.29804e+00 0.00000e+00 0.00000e+00 9.15993e+01 286.319 6.66480e+00 106.319 0.9317 
1 1 1 -11 80  6  o 15 5.16662e+00 1.17183e+00 5.38027e+01 198.300 -3.67942e+00 -1.21687e+00 0.00000e+00 0.00000e+00 1.12336e+02 198.300 5.85333e+01 198.300 0.8586 
1 1 1 -11 80  7  o 5  4.37862e+00 1.23583e+00 5.70572e+01 53.567  2.15740e+00  2.92270e+00  0.00000e+00 0.00000e+00 8.18531e+01 53.567  2.47959e+01 53.567  0.8477 
1 1 1 -11 80  8  o 9  7.24703e+00 1.08912e+00 1.14693e+02 258.978 -2.83357e+00 -1.45484e+01 0.00000e+00 0.00000e+00 1.46957e+02 258.978 3.22641e+01 258.978 0.9657 
1 1 1 -11 80  9  o 13 5.21260e+00 1.11520e+00 1.20417e+02 208.893 -9.51497e+00 -5.25096e+00 0.00000e+00 0.00000e+00 6.51013e+01 208.893 5.53157e+01 28.893  0.9528 
1 1 1 -11 80  10 o 4  4.85579e+00 1.06990e+00 9.59128e+01 81.756  1.41686e+00  9.77924e+00  0.00000e+00 0.00000e+00 7.58496e+01 81.756  2.00633e+01 261.756 0.9480 
1 1 1 -11 80  11 o 11 2.86936e+00 9.06107e-01 4.90062e+01 35.592  2.82327e+00  2.02069e+00  0.00000e+00 0.00000e+00 4.07936e+01 35.592  8.21262e+00 215.592 0.8396 
1 1 1 -11 80  12 o 1  3.11622e+00 9.75465e-01 2.54413e+01 138.223 -1.50028e+00 1.34033e+00  0.00000e+00 0.00000e+00 5.57386e+01 138.223 3.02973e+01 138.223 0.6997 
1 1 1 -11 81  1  o 15 5.02613e+00 1.09492e+00 7.71960e+01 49.979  3.74430e+00  4.45890e+00  0.00000e+00 0.00000e+00 9.45432e+01 49.979  1.73472e+01 49.979  0.9095 
1 1 1 -11 81  2  o 4  8.46079e+00 8.68599e-01 1.11961e+02 293.689 6.51984e+00  -1.48607e+01 0.00000e+00 0.00000e+00 1.95782e+02 293.689 8.38205e+01 293.689 0.9687 
1 1 1 -11 81  3  o 13 4.20953e+00 1.04733e+00 7.66166e+01 120.686 -2.64053e+00 4.44961e+00  0.00000e+00 0.00000e+00 6.51236e+01 120.686 1.14930e+01 300.686 0.8973 
1 1 1 -11 81  4  o 5  3.99991e+00 1.04677e+00 8.16808e+01 80.687  8.19071e-01  4.99456e+00  0.00000e+00 0.00000e+00 5.25399e+01 80.687  2.91409e+01 260.687 0.8948 
1 1 1 -11 81  5  o 7  2.76140e+00 8.57270e-01 8.02051e+01 251.702 -1.20476e+00 -3.64339e+00 0.00000e+00 0.00000e+00 8.47610e+00 251.702 7.17290e+01 71.702  0.8570 
1 1 1 -11 81  6  o 17 6.47428e+00 1.23607e+00 7.33356e+01 151.801 -5.95012e+00 3.19026e+00  0.00000e+00 0.00000e+00 1.50345e+02 151.801 7.70089e+01 151.801 0.9226 
1 1 1 -11 81  7  o 5  8.36534e+00 1.17731e+00 1.17249e+02 18.468  1.47862e+01  4.93836e+00  0.00000e+00 0.00000e+00 1.85522e+02 18.468  6.82736e+01 18.468  0.9674 
1 1 1 -11 81  8  o 4  6.65796e+00 1.08541e+00 9.61640e+01 190.801 -1.06776e+01 -2.03701e+00 0.00000e+00 0.00000e+00 1.40973e+02 190.801 4.48095e+01 190.801 0.9528 
1 1 1 -11 81  9  o 3  4.08070e+00 1.09624e+00 6.12225e+01 7.597   4.60050e+00  6.13580e-01  0.00000e+00 0.00000e+00 7.35432e+01 7.597   1.23207e+01 7.597   0.8843 
1 1 1 -11 81  10 o 11 3.60014e+00 1.00514e+00 6.96543e+01 51.993  3.41988e+00  4.37618e+00  0.00000e+00 0.00000e+00 5.18700e+01 51.993  1.77843e+01 231.993 0.9048 
1 1 1 -11 81  11 o 5  8.31111e+00 1.03075e+00 9.01970e+01 258.899 -3.46787e+00 -1.76736e+01 0.00000e+00 0.00000e+00 2.10798e+02 258.899 1.20601e+02 258.899 0.9718 
1 1 1 -11 81  12 o 7  3.34892e+00 1.04133e+00 3.12965e+01 195.123 -2.52358e+00 -6.82027e-01 0.00000e+00 0.00000e+00 6.55448e+01 195.123 3.42483e+01 195.123 0.7769 
1 1 1 -11 82  1  o 13 5.75155e+00 1.03122e+00 7.91394e+01 58.690  3.83426e+00  6.30372e+00  0.00000e+00 0.00000e+00 1.21667e+02 58.690  4.25280e+01 58.690  0.9295 
1 1 1 -11 82  2  o 14 7.06805e+00 1.00652e+00 1.76527e+02 252.390 -5.88394e+00 -1.85375e+01 0.00000e+00 0.00000e+00 8.18958e+01 252.390 9.46314e+01 72.390  0.9739 
1 1 1 -11 82  3  o 17 9.61437e+00 8.86374e-01 1.59838e+02 96.362  -2.90028e+00 2.60137e+01  0.00000e+00 0.00000e+00 1.93915e+02 96.362  3.40763e+01 96.362  0.9807 
1 1 1 -11 82  4  f 0  5.85712e+00 1.01307e+00 1.19852e+02 313.393 7.74026e+00  -8.18700e+00 0.00000e+00 0.00000e+00 8.97667e+01 313.393 3.00854e+01 133.393 0.9545 
1 1 1 -11 82  5  o 15 5.20665e+00 1.02556e+00 6.58718e+01 158.793 -4.86385e+00 1.88720e+00  0.00000e+00 0.00000e+00 1.09342e+02 158.793 4.34697e+01 158.793 0.8982 
1 1 1 -11 82  6  o 11 5.28818e+00 1.27727e+00 5.67667e+01 259.514 -7.73177e-01 -4.17745e+00 0.00000e+00 0.00000e+00 1.15954e+02 259.514 5.91873e+01 259.514 0.8724 
1 1 1 -11 82  7  o 9  4.94608e+00 1.25719e+00 9.75381e+01 288.420 2.31417e+00  -6.94840e+00 0.00000e+00 0.00000e+00 7.43341e+01 288.420 2.32041e+01 108.420 0.9290 
1 1 1 -11 82  8  o 2  3.30958e+00 9.96359e-01 6.14734e+01 179.620 -3.89108e+00 2.57961e-02  0.00000e+00 0.00000e+00 4.47980e+01 179.620 1.66754e+01 359.620 0.8592 
1 1 1 -11 82  9  o 1  2.54781e+00 8.42534e-01 5.45160e+01 154.701 -3.00300e+00 1.41945e+00  0.00000e+00 0.00000e+00 2.45531e+01 154.701 2.99628e+01 334.701 0.8312 
1 1 1 -11 82  10 o 9  5.08862e+00 1.05746e+00 9.20546e+01 257.252 -2.16700e+00 -9.57834e+00 0.00000e+00 0.00000e+00 8.78006e+01 257.252 4.25392e+00 77.252  0.9476 
1 1 1 -11 82  11 o 3  1.14609e+01 9.31125e-01 1.59258e+02 31.710  3.99316e+01  2.46714e+01  0.00000e+00 0.00000e+00 2.63174e+02 31.710  1.03915e+02 31.710  0.9893 
1 1 1 -11 82  12 o 17 2.70765e+00 8.98909e-01 3.18562e+01 136.781 -1.96191e+00 1.84359e+00  0.00000e+00 0.00000e+00 4.71814e+01 136.781 1.53252e+01 136.781 0.7844 
1 1 1 -11 83  1  o 9  1.24181e+01 7.56447e-01 1.76282e+02 256.236 -9.52383e+00 -3.88796e+01 0.00000e+00 0.00000e+00 2.84178e+02 256.236 1.07896e+02 256.236 0.9874 
1 1 1 -11 83  2  o 4  3.25554e+00 9.60001e-01 5.87965e+01 298.126 1.37627e+00  -2.57474e+00 0.00000e+00 0.00000e+00 3.94232e+01 298.126 1.93734e+01 118.126 0.8039 
1 1 1 -11 83  3  o 3  4.73691e+00 1.05019e+00 7.88590e+01 90.843  -8.62216e-02 5.86167e+00  0.00000e+00 0.00000e+00 8.28582e+01 90.843  3.99921e+00 90.843  0.9102 
1 1 1 -11 83  4  o 14 5.07738e+00 9.78463e-01 8.55798e+01 72.395  2.23204e+00  7.03437e+00  0.00000e+00 0.00000e+00 9.13359e+01 72.395  5.75614e+00 72.395  0.9295 
1 1 1 -11 83  5  o 8  3.57661e+00 9.43486e-01 6.93908e+01 197.014 -4.06254e+00 -1.24312e+00 0.00000e+00 0.00000e+00 4.74921e+01 197.014 2.18987e+01 17.014  0.8724 
1 1 1 -11 83  6  o 13 3.24968e+00 9.46866e-01 3.25616e+01 325.266 1.61912e+00  -1.12255e+00 0.00000e+00 0.00000e+00 5.17069e+01 325.266 1.91453e+01 325.266 0.6928 
1 1 1 -11 83  7  o 15 3.74270e+00 1.14990e+00 5.53567e+01 104.613 -8.54949e-01 3.27913e+00  0.00000e+00 0.00000e+00 6.15261e+01 104.613 6.16938e+00 104.613 0.8351 
1 1 1 -11 83  8  o 4  3.46527e+00 1.07459e+00 4.27789e+01 184.173 -2.63592e+00 -1.92332e-01 0.00000e+00 0.00000e+00 5.81712e+01 184.173 1.53923e+01 184.173 0.7797 
1 1 1 -11 83  9  o 7  5.21492e+00 1.12804e+00 7.03038e+01 325.563 6.08857e+00  -4.17463e+00 0.00000e+00 0.00000e+00 1.10647e+02 325.563 4.03431e+01 325.563 0.9296 
1 1 1 -11 83  10 o 1  7.59652e+00 1.06772e+00 1.56983e+02 310.199 1.58454e+01  -1.87513e+01 0.00000e+00 0.00000e+00 1.20456e+02 310.199 3.65275e+01 130.199 0.9794 
1 1 1 -11 83  11 o 10 7.90929e+00 1.11342e+00 1.25803e+02 104.210 -5.57033e+00 2.19980e+01  0.00000e+00 0.00000e+00 1.62244e+02 104.210 3.64415e+01 104.210 0.9777 
1 1 1 -11 83  12 o 10 4.26542e+00 1.16041e+00 6.32392e+01 198.028 -6.21075e+00 -2.02137e+00 0.00000e+00 0.00000e+00 8.27492e+01 198.028 1.95101e+01 198.028 0.9199 
1 1 1 -11 84  1  o 12 4.01723e+00 1.05752e+00 7.20615e+01 224.285 -3.23789e+00 -3.15808e+00 0.00000e+00 0.00000e+00 6.08117e+01 224.285 1.12497e+01 44.285  0.8810 
1 1 1 -11 84  2  f 0  9.07106e+00 8.79011e-01 1.10008e+02 48.408  1.13521e+01  1.27898e+01  0.00000e+00 0.00000e+00 2.20261e+02 48.408  1.10254e+02 48.408  0.9703 
1 1 1 -11 84  3  o 15 9.59072e+00 9.30357e-01 1.32004e+02 107.836 -6.78670e+00 2.10919e+01  0.00000e+00 0.00000e+00 2.19445e+02 107.836 8.74413e+01 107.836 0.9772 
1 1 1 -11 84  4  f 0  3.73830e+00 9.50076e-01 1.09595e+02 262.715 -8.70659e-01 -6.81109e+00 0.00000e+00 0.00000e+00 1.98565e+01 262.715 8.97387e+01 82.715  0.9240 
1 1 1 -11 84  5  o 2  8.04451e+00 8.15888e-01 1.37005e+02 296.244 9.26225e+00  -1.87866e+01 0.00000e+00 0.00000e+00 1.56975e+02 296.244 1.99695e+01 296.244 0.9758 
1 1 1 -11 84  6  o 15 1.33915e+01 7.04069e-01 2.29708e+02 105.103 -1.76016e+01 6.52215e+01  0.00000e+00 0.00000e+00 2.67682e+02 105.103 3.79739e+01 105.103 0.9926 
1 1 1 -11 84  7  o 8  3.78824e+00 1.12572e+00 6.00781e+01 239.483 -2.03026e+00 -3.44443e+00 0.00000e+00 0.00000e+00 6.22196e+01 239.483 2.14150e+00 239.483 0.8635 
1 1 1 -11 84  8  o 1  7.04902e+00 1.39186e+00 8.82710e+01 181.775 -9.20446e+00 -2.85250e-01 0.00000e+00 0.00000e+00 1.60309e+02 181.775 7.20379e+01 181.775 0.9440 
1 1 1 -11 84  9  o 9  5.77006e+00 1.18785e+00 1.36667e+02 73.258  4.06391e+00  1.35098e+01  0.00000e+00 0.00000e+00 7.08892e+01 73.258  6.57774e+01 253.258 0.9639 
1 1 1 -11 84  10 o 16 3.52283e+00 1.05044e+00 2.26177e+01 100.916 -3.29457e-01 1.70826e+00  0.00000e+00 0.00000e+00 6.27574e+01 100.916 4.01397e+01 100.916 0.6501 
1 1 1 -11 84  11 o 9  3.81463e+00 1.07844e+00 5.25618e+01 130.352 -2.99648e+00 3.52680e+00  0.00000e+00 0.00000e+00 7.30139e+01 130.352 2.04521e+01 130.352 0.8840 
1 1 1 -11 84  12 o 14 3.27920e+00 1.00057e+00 4.44101e+01 93.797  -2.68605e-01 4.04729e+00  0.00000e+00 0.00000e+00 6.11809e+01 93.797  1.67708e+01 93.797  0.8656 
1 1 1 -11 85  1  o 5  9.45696e+00 9.07089e-01 1.79493e+02 38.921  2.34456e+01  1.89324e+01  0.00000e+00 0.00000e+00 1.69530e+02 38.921  9.96338e+00 218.921 0.9833 
1 1 1 -11 85  2  o 9  3.93975e+00 1.05128e+00 4.03255e+01 171.090 -2.35408e+00 3.69055e-01  0.00000e+00 0.00000e+00 7.07635e+01 171.090 3.04380e+01 171.090 0.7516 
1 1 1 -11 85  3  o 3  7.63769e+00 8.83143e-01 1.02707e+02 261.200 -2.09260e+00 -1.35176e+01 0.00000e+00 0.00000e+00 1.72972e+02 261.200 7.02652e+01 261.200 0.9627 
1 1 1 -11 85  4  o 18 1.14923e+01 7.19989e-01 2.14092e+02 96.862  -5.80384e+00 4.82260e+01  0.00000e+00 0.00000e+00 2.12041e+02 96.862  2.05050e+00 276.862 0.9897 
1 1 1 -11 85  5  o 5  2.68853e+00 8.40296e-01 6.79342e+01 327.953 3.08517e+00  -1.93134e+00 0.00000e+00 0.00000e+00 1.74345e+01 327.953 5.04997e+01 147.953 0.8481 
1 1 1 -11 85  6  o 10 4.35982e+00 1.01602e+00 3.94613e+01 171.839 -3.05891e+00 4.38642e-01  0.00000e+00 0.00000e+00 9.37060e+01 171.839 5.42447e+01 171.839 0.8164 
1 1 1 -11 85  7  o 11 5.91214e+00 1.24878e+00 9.71347e+01 138.431 -6.86251e+00 6.08627e+00  0.00000e+00 0.00000e+00 1.11443e+02 138.431 1.43079e+01 138.431 0.9438 
1 1 1 -11 85  8  o 4  3.74267e+00 1.13522e+00 3.70219e+01 115.353 -1.12732e+00 2.37915e+00  0.00000e+00 0.00000e+00 7.18203e+01 115.353 3.47983e+01 115.353 0.7787 
1 1 1 -11 85  9  o 9  4.04743e+00 1.07378e+00 4.07121e+01 120.206 -1.71674e+00 2.94891e+00  0.00000e+00 0.00000e+00 8.55914e+01 120.206 4.48792e+01 120.206 0.8364 
1 1 1 -11 85  10 o 1  5.43757e+00 1.21677e+00 1.22986e+02 226.921 -9.23726e+00 -9.87856e+00 0.00000e+00 0.00000e+00 7.20415e+01 226.921 5.09446e+01 46.921  0.9623 
1 1 1 -11 85  11 o 12 3.33551e+00 1.01676e+00 2.47510e+01 105.615 -5.67752e-01 2.03142e+00  0.00000e+00 0.00000e+00 6.40338e+01 105.615 3.92828e+01 105.615 0.7149 
1 1 1 -11 85  12 o 7  2.35573e+00 8.04705e-01 3.39387e+01 41.995  2.19980e+00  1.98035e+00  0.00000e+00 0.00000e+00 3.67584e+01 41.995  2.81966e+00 41.995  0.8070 
1 1 1 -11 86  1  o 2  4.41737e+00 1.02566e+00 7.58199e+01 353.275 5.32637e+00  -6.28016e-01 0.00000e+00 0.00000e+00 7.35640e+01 353.275 2.25587e+00 173.275 0.9012 
1 1 1 -11 86  2  o 1  6.31678e+00 1.04998e+00 1.38457e+02 244.095 -6.12874e+00 -1.26188e+01 0.00000e+00 0.00000e+00 8.98521e+01 244.095 4.86046e+01 64.095  0.9637 
1 1 1 -11 86  3  o 3  3.72131e+00 9.91039e-01 7.11969e+01 56.132  2.48871e+00  3.70812e+00  0.00000e+00 0.00000e+00 5.14571e+01 56.132  1.97398e+01 236.132 0.8793 
1 1 1 -11 86  4  f 0  3.75473e+00 9.72916e-01 1.24804e+01 112.758 -3.17702e-01 7.57355e-01  0.00000e+00 0.00000e+00 4.08969e+01 112.758 2.84165e+01 112.758 0.3795 
1 1 1 -11 86  5  o 4  5.65501e+00 9.64847e-01 3.51574e+01 288.822 1.19408e+00  -3.50311e+00 0.00000e+00 0.00000e+00 1.44970e+02 288.822 1.09813e+02 288.822 0.8510 
1 1 1 -11 86  6  o 16 2.54618e+00 8.31511e-01 7.56021e+01 288.691 1.33744e+00  -3.95328e+00 0.00000e+00 0.00000e+00 7.23954e+00 288.691 6.83626e+01 108.691 0.8699 
1 1 1 -11 86  7  o 17 3.11952e+00 9.56724e-01 5.55629e+01 130.277 -2.19129e+00 2.58602e+00  0.00000e+00 0.00000e+00 4.17959e+01 130.277 1.37671e+01 310.277 0.8351 
1 1 1 -11 86  8  o 2  5.10303e+00 1.30781e+00 1.01589e+02 76.324  2.11861e+00  8.70704e+00  0.00000e+00 0.00000e+00 7.79771e+01 76.324  2.36122e+01 256.324 0.9424 
1 1 1 -11 86  9  o 14 4.93724e+00 1.18209e+00 1.15880e+02 331.810 9.45668e+00  -5.06840e+00 0.00000e+00 0.00000e+00 5.94833e+01 331.810 5.63964e+01 151.810 0.9522 
1 1 1 -11 86  10 o 9  3.00319e+00 9.64954e-01 4.03158e+01 237.824 -1.60717e+00 -2.55455e+00 0.00000e+00 0.00000e+00 5.04775e+01 237.824 1.01617e+01 237.824 0.8113 
1 1 1 -11 86  11 o 7  2.86241e+00 9.25233e-01 6.90570e+01 48.578  3.97181e+00  4.50171e+00  0.00000e+00 0.00000e+00 2.81585e+01 48.578  4.08985e+01 228.578 0.9124 
1 1 1 -11 87  1  o 4  1.13895e+01 8.23297e-01 1.49413e+02 40.066  2.42873e+01  2.04268e+01  0.00000e+00 0.00000e+00 2.71099e+02 40.066  1.21686e+02 40.066  0.9841 
1 1 1 -11 87  2  o 6  1.41678e+01 6.83235e-01 1.95070e+02 225.519 -3.96459e+01 -4.03712e+01 0.00000e+00 0.00000e+00 3.31461e+02 225.519 1.36392e+02 225.519 0.9911 
1 1 1 -11 87  3  o 12 3.15437e+00 9.34460e-01 3.63436e+01 234.746 -1.18858e+00 -1.68154e+00 0.00000e+00 0.00000e+00 4.72608e+01 234.746 1.09172e+01 234.746 0.7073 
1 1 1 -11 87  4  o 16 3.29107e+00 9.08017e-01 8.06395e+01 142.004 -3.95795e+00 3.09179e+00  0.00000e+00 0.00000e+00 2.95340e+01 142.004 5.11055e+01 322.004 0.8939 
1 1 1 -11 87  5  o 19 1.36204e+01 8.56552e-01 2.50352e+02 250.933 -2.22172e+01 -6.42809e+01 0.00000e+00 0.00000e+00 2.55603e+02 250.933 5.25084e+00 250.933 0.9926 
1 1 1 -11 87  6  o 5  1.37756e+01 7.05031e-01 2.28061e+02 103.920 -1.76924e+01 7.13865e+01  0.00000e+00 0.00000e+00 2.83547e+02 103.920 5.54857e+01 103.920 0.9932 
1 1 1 -11 87  7  o 19 1.21000e+01 7.48606e-01 1.87264e+02 10.400  5.32520e+01  9.77313e+00  0.00000e+00 0.00000e+00 2.60627e+02 10.400  7.33621e+01 10.400  0.9907 
1 1 1 -11 87  8  f 0  8.34946e+00 1.32552e+00 1.28315e+02 3.405   1.71450e+01  1.02016e+00  0.00000e+00 0.00000e+00 1.74146e+02 3.405   4.58309e+01 3.405   0.9704 
1 1 1 -11 87  9  o 1  3.39448e+00 1.10136e+00 5.87126e+01 157.972 -3.86491e+00 1.56374e+00  0.00000e+00 0.00000e+00 5.13862e+01 157.972 7.32641e+00 337.972 0.8697 
1 1 1 -11 87  10 o 16 3.08991e+00 9.75980e-01 6.37404e+01 148.937 -4.37720e+00 2.63662e+00  0.00000e+00 0.00000e+00 3.93867e+01 148.937 2.43537e+01 328.937 0.8959 
1 1 1 -11 87  11 o 14 4.54325e+00 1.11773e+00 5.49316e+01 160.326 -5.95067e+00 2.12758e+00  0.00000e+00 0.00000e+00 1.00118e+02 160.326 4.51867e+01 160.326 0.9171 
1 1 1 -11 88  1  o 3  4.43320e+00 1.07775e+00 1.01052e+02 282.864 1.70155e+00  -7.45055e+00 0.00000e+00 0.00000e+00 5.39338e+01 282.864 4.71178e+01 102.865 0.9321 
1 1 1 -11 88  2  o 19 9.84074e+00 7.46649e-01 1.36089e+02 249.320 -9.98602e+00 -2.64548e+01 0.00000e+00 0.00000e+00 2.26237e+02 249.320 9.01483e+01 249.320 0.9822 
1 1 1 -11 88  3  o 12 6.68143e+00 9.73006e-01 1.07009e+02 48.741  8.55351e+00  9.75015e+00  0.00000e+00 0.00000e+00 1.33462e+02 48.741  2.64537e+01 48.741  0.9606 
1 1 1 -11 88  4  o 7  3.61820e+00 9.67016e-01 5.55846e+01 10.252  3.85187e+00  6.96640e-01  0.00000e+00 0.00000e+00 6.09383e+01 10.252  5.35373e+00 10.252  0.8601 
1 1 1 -11 88  5  o 9  2.71419e+00 8.52897e-01 6.40624e+01 12.073  3.62992e+00  7.76377e-01  0.00000e+00 0.00000e+00 2.24021e+01 12.073  4.16603e+01 192.073 0.8515 
1 1 1 -11 88  6  o 18 2.84575e+00 8.82157e-01 5.29398e+01 102.494 -6.71389e-01 3.02993e+00  0.00000e+00 0.00000e+00 3.40165e+01 102.494 1.89234e+01 282.494 0.8173 
1 1 1 -11 88  7  o 10 3.76273e+00 1.03405e+00 7.30486e+01 222.664 -4.26022e+00 -3.92623e+00 0.00000e+00 0.00000e+00 5.47161e+01 222.664 1.83325e+01 42.664  0.9090 
1 1 1 -11 88  8  o 13 3.82246e+00 1.16624e+00 5.35319e+01 37.541  3.10922e+00  2.38934e+00  0.00000e+00 0.00000e+00 6.92107e+01 37.541  1.56788e+01 37.541  0.8604 
1 1 1 -11 88  9  o 17 4.01308e+00 1.16630e+00 1.04856e+02 230.077 -5.72377e+00 -6.83993e+00 0.00000e+00 0.00000e+00 3.61120e+01 230.077 6.87435e+01 50.077  0.9421 
1 1 1 -11 88  10 o 6  5.30559e+00 1.24018e+00 5.85869e+01 232.053 -4.05628e+00 -5.20165e+00 0.00000e+00 0.00000e+00 1.23359e+02 232.053 6.47717e+01 232.053 0.9207 
1 1 1 -11 88  11 o 15 2.28101e+00 7.90220e-01 3.68015e+01 308.621 1.81299e+00  -2.26942e+00 0.00000e+00 0.00000e+00 3.13188e+01 308.621 5.48271e+00 128.621 0.8027 
1 1 1 -11 89  1  o 9  3.14502e+00 8.67167e-01 5.52853e+01 185.612 -3.44158e+00 -3.38193e-01 0.00000e+00 0.00000e+00 4.36486e+01 185.612 1.16367e+01 5.612   0.8389 
1 1 1 -11 89  2  o 17 6.14413e+00 9.80695e-01 8.58997e+01 335.231 8.82917e+00  -4.07385e+00 0.00000e+00 0.00000e+00 1.32192e+02 335.231 4.62919e+01 335.231 0.9471 
1 1 1 -11 89  3  o 9  9.67537e+00 8.11186e-01 1.67000e+02 88.130  1.14181e+00  3.49651e+01  0.00000e+00 0.00000e+00 1.90187e+02 88.130  2.31878e+01 88.130  0.9856 
1 1 1 -11 89  4  o 18 7.07080e+00 9.61792e-01 1.25350e+02 183.171 -1.75351e+01 -9.71580e-01 0.00000e+00 0.00000e+00 1.31674e+02 183.171 6.32327e+00 183.171 0.9711 
1 1 1 -11 89  5  o 5  4.07444e+00 1.00354e+00 1.05771e+02 198.482 -7.81297e+00 -2.61151e+00 0.00000e+00 0.00000e+00 3.70595e+01 198.482 6.87110e+01 18.482  0.9372 
1 1 1 -11 89  6  o 19 8.12584e+00 9.11514e-01 1.80988e+02 335.492 2.85421e+01  -1.30121e+01 0.00000e+00 0.00000e+00 1.17841e+02 335.492 6.31471e+01 155.492 0.9839 
1 1 1 -11 89  7  o 7  8.39897e+00 9.09756e-01 1.27791e+02 188.939 -2.57031e+01 -4.04279e+00 0.00000e+00 0.00000e+00 1.79776e+02 188.939 5.19847e+01 188.939 0.9806 
1 1 1 -11 89  8  o 8  8.63081e+00 1.05692e+00 1.75882e+02 357.379 3.15065e+01  -1.44227e+00 0.00000e+00 0.00000e+00 1.40993e+02 357.379 3.48887e+01 177.379 0.9840 
1 1 1 -11 89  9  o 15 2.92277e+00 9.72847e-01 2.35383e+01 142.441 -1.35060e+00 1.03856e+00  0.00000e+00 0.00000e+00 4.64718e+01 142.441 2.29335e+01 142.441 0.6426 
1 1 1 -11 89  10 o 16 3.54932e+00 1.05962e+00 3.21068e+01 291.176 1.01843e+00  -2.62886e+00 0.00000e+00 0.00000e+00 7.30541e+01 291.176 4.09473e+01 291.176 0.7957 
1 1 1 -11 89  11 o 14 4.51366e+00 1.23348e+00 6.44663e+01 74.950  1.74608e+00  6.49378e+00  0.00000e+00 0.00000e+00 9.03833e+01 74.950  2.59170e+01 74.950  0.9223 
1 1 1 -11 90  1  o 6  1.21066e+01 7.13973e-01 1.61787e+02 335.133 3.87574e+01  -1.79637e+01 0.00000e+00 0.00000e+00 2.86739e+02 335.133 1.24953e+02 335.133 0.9882 
1 1 1 -11 90  2  f 0  7.26772e+00 9.09303e-01 1.35037e+02 146.713 -1.58175e+01 1.03850e+01  0.00000e+00 0.00000e+00 1.29985e+02 146.713 5.05158e+00 326.713 0.9732 
1 1 1 -11 90  3  o 6  3.72802e+00 1.00624e+00 7.10935e+01 316.859 3.71153e+00  -3.47821e+00 0.00000e+00 0.00000e+00 5.39014e+01 316.859 1.71921e+01 136.859 0.8954 
1 1 1 -11 90  4  o 7  5.45256e+00 1.00422e+00 9.07078e+01 28.319  8.33160e+00  4.48974e+00  0.00000e+00 0.00000e+00 1.02240e+02 28.319  1.15322e+01 28.319  0.9456 
1 1 1 -11 90  5  o 15 3.69430e+00 1.00544e+00 9.77179e+01 288.461 2.15822e+00  -6.46480e+00 0.00000e+00 0.00000e+00 2.98526e+01 288.461 6.78653e+01 108.461 0.9234 
1 1 1 -11 90  6  o 4  2.43672e+00 8.03473e-01 6.11028e+01 254.077 -1.03365e+00 -3.62322e+00 0.00000e+00 0.00000e+00 1.66518e+01 254.077 4.44510e+01 74.077  0.8540 
1 1 1 -11 90  7  o 3  4.39205e+00 1.01766e+00 1.10992e+02 337.970 9.89394e+00  -4.00338e+00 0.00000e+00 0.00000e+00 4.51042e+01 337.970 6.58882e+01 157.970 0.9519 
1 1 1 -11 90  8  o 16 7.25398e+00 1.02726e+00 9.43234e+01 171.828 -1.50851e+01 2.16622e+00  0.00000e+00 0.00000e+00 1.67228e+02 171.828 7.29044e+01 171.828 0.9666 
1 1 1 -11 90  9  o 1  3.28854e+00 1.06649e+00 4.37253e+01 280.319 6.13712e-01  -3.37068e+00 0.00000e+00 0.00000e+00 5.88670e+01 280.319 1.51417e+01 280.319 0.8371 
1 1 1 -11 90  10 o 17 2.44216e+00 8.41782e-01 7.51342e+01 122.109 -3.07915e+00 4.90685e+00  0.00000e+00 0.00000e+00 7.50968e+00 122.109 6.76246e+01 302.109 0.9090 
1 1 1 -11 90  11 o 17 7.12218e+00 1.32232e+00 1.23533e+02 220.638 -1.41733e+01 -1.21645e+01 0.00000e+00 0.00000e+00 1.34131e+02 220.638 1.05980e+01 220.638 0.9729 
1 1 1 -11 91  1  o 2  8.31656e+00 8.82922e-01 1.94228e+02 134.506 -2.37127e+01 2.41248e+01  0.00000e+00 0.00000e+00 1.12837e+02 134.506 8.13916e+01 314.506 0.9851 
1 1 1 -11 91  2  o 10 3.43402e+00 9.46751e-01 2.75098e+01 269.324 -2.22813e-02 -1.88935e+00 0.00000e+00 0.00000e+00 5.98057e+01 269.324 3.22959e+01 269.324 0.6788 
1 1 1 -11 91  3  o 7  7.62396e+00 9.17696e-01 1.03758e+02 296.381 7.15151e+00  -1.44188e+01 0.00000e+00 0.00000e+00 1.72653e+02 296.381 6.88948e+01 296.381 0.9684 
1 1 1 -11 91  4  o 10 3.18977e+00 9.42491e-01 4.34354e+01 33.803  2.27583e+00  1.52368e+00  0.00000e+00 0.00000e+00 5.06824e+01 33.803  7.24703e+00 33.803  0.7887 
1 1 1 -11 91  5  o 18 4.25190e+00 1.08249e+00 9.10405e+01 275.302 7.09660e-01  -7.64659e+00 0.00000e+00 0.00000e+00 5.71793e+01 275.302 3.38612e+01 95.302  0.9324 
1 1 1 -11 91  6  o 8  3.04155e+00 9.27015e-01 4.27379e+01 300.017 1.55436e+00  -2.69040e+00 0.00000e+00 0.00000e+00 5.01618e+01 300.017 7.42390e+00 300.017 0.8176 
1 1 1 -11 91  7  o 16 5.58790e+00 1.14260e+00 1.08680e+02 210.323 -1.04604e+01 -6.11831e+00 0.00000e+00 0.00000e+00 9.10932e+01 210.323 1.75870e+01 30.323  0.9578 
1 1 1 -11 91  8  o 4  3.78860e+00 1.02657e+00 4.05758e+01 332.643 3.28983e+00  -1.70215e+00 0.00000e+00 0.00000e+00 7.96716e+01 332.643 3.90958e+01 332.643 0.8511 
1 1 1 -11 91  9  o 10 4.03264e+00 1.20251e+00 8.30383e+01 162.049 -6.54964e+00 2.12191e+00  0.00000e+00 0.00000e+00 5.58185e+01 162.049 2.72198e+01 342.049 0.9242 
1 1 1 -11 91  10 o 9  3.66020e+00 1.15891e+00 2.93382e+01 117.117 -1.10404e+00 2.15591e+00  0.00000e+00 0.00000e+00 7.36842e+01 117.117 4.43460e+01 117.117 0.7563 
1 1 1 -11 92  1  o 2  5.28524e+00 1.07392e+00 9.11689e+01 8.617   8.66270e+00  1.31281e+00  0.00000e+00 0.00000e+00 9.52040e+01 8.617   4.03509e+00 8.617   0.9411 
1 1 1 -11 92  2  o 15 3.24468e+00 9.45859e-01 7.37424e+01 123.512 -2.58321e+00 3.90096e+00  0.00000e+00 0.00000e+00 3.38428e+01 123.512 3.98997e+01 303.512 0.8854 
1 1 1 -11 92  3  o 14 5.01465e+00 1.06023e+00 1.16033e+02 309.002 6.65735e+00  -8.22059e+00 0.00000e+00 0.00000e+00 6.25533e+01 309.002 5.34796e+01 129.002 0.9515 
1 1 1 -11 92  4  o 8  6.15104e+00 1.02939e+00 7.23363e+01 241.369 -4.16763e+00 -7.63407e+00 0.00000e+00 0.00000e+00 1.44076e+02 241.369 7.17398e+01 241.369 0.9406 
1 1 1 -11 92  5  o 12 7.46274e+00 9.41004e-01 1.08299e+02 113.814 -7.69268e+00 1.74302e+01  0.00000e+00 0.00000e+00 1.63215e+02 113.814 5.49155e+01 113.814 0.9734 
1 1 1 -11 92  6  o 19 9.46188e+00 8.52849e-01 1.61804e+02 236.899 -2.09469e+01 -3.21316e+01 0.00000e+00 0.00000e+00 1.86940e+02 236.899 2.51361e+01 236.899 0.9869 
1 1 1 -11 92  7  o 5  3.24966e+00 9.61988e-01 8.33664e+01 192.076 -6.24625e+00 -1.33640e+00 0.00000e+00 0.00000e+00 2.79549e+01 192.076 5.54115e+01 12.077  0.9180 
1 1 1 -11 92  8  o 2  5.58876e+00 1.12708e+00 1.11584e+02 69.554  5.00942e+00  1.34372e+01  0.00000e+00 0.00000e+00 8.93799e+01 69.554  2.22043e+01 249.554 0.9645 
1 1 1 -11 92  9  o 12 3.09985e+00 1.01859e+00 4.30124e+01 162.752 -3.24384e+00 1.00713e+00  0.00000e+00 0.00000e+00 5.34565e+01 162.752 1.04441e+01 162.752 0.8355 
1 1 1 -11 92  10 o 16 3.30708e+00 1.08679e+00 5.78387e+01 320.225 3.92592e+00  -3.26801e+00 0.00000e+00 0.00000e+00 5.23961e+01 320.225 5.44256e+00 140.225 0.8958 
1 1 1 -11 93  1  o 5  7.39342e+00 8.86898e-01 8.61066e+01 46.028  9.07403e+00  9.40551e+00  0.00000e+00 0.00000e+00 1.80045e+02 46.028  9.39382e+01 46.028  0.9609 
1 1 1 -11 93  2  o 7  9.02246e+00 9.40684e-01 1.31137e+02 231.668 -1.53342e+01 -1.93943e+01 0.00000e+00 0.00000e+00 1.99773e+02 231.668 6.86356e+01 231.668 0.9796 
1 1 1 -11 93  3  o 4  5.22043e+00 1.00702e+00 1.05729e+02 296.371 4.87295e+00  -9.82883e+00 0.00000e+00 0.00000e+00 8.04862e+01 296.371 2.52432e+01 116.371 0.9533 
1 1 1 -11 93  4  o 19 4.18243e+00 1.04296e+00 7.23871e+01 192.230 -6.19215e+00 -1.34223e+00 0.00000e+00 0.00000e+00 7.10756e+01 192.230 1.31151e+00 12.230  0.9173 
1 1 1 -11 93  5  o 10 2.26075e+00 7.65634e-01 2.76669e+01 281.948 3.19784e-01  -1.51124e+00 0.00000e+00 0.00000e+00 2.36110e+01 281.948 4.05591e+00 101.948 0.6070 
1 1 1 -11 93  6  o 14 7.34493e+00 9.59429e-01 6.91557e+01 14.860  1.14365e+01  3.03447e+00  0.00000e+00 0.00000e+00 1.93235e+02 14.860  1.24079e+02 14.860  0.9568 
1 1 1 -11 93  7  f 0  7.62692e+00 9.37242e-01 9.20236e+01 156.230 -1.68214e+01 7.40871e+00  0.00000e+00 0.00000e+00 1.84663e+02 156.230 9.26398e+01 156.230 0.9724 
1 1 1 -11 93  8  o 14 3.72219e+00 1.03541e+00 5.91114e+01 207.136 -5.05778e+00 -2.59227e+00 0.00000e+00 0.00000e+00 6.67445e+01 207.136 7.63310e+00 207.136 0.9071 
1 1 1 -11 93  9  o 1  2.95473e+00 9.32662e-01 7.39374e+01 66.675  2.49482e+00  5.78599e+00  0.00000e+00 0.00000e+00 2.69352e+01 66.675  4.70023e+01 246.675 0.9168 
1 1 1 -11 93  10 o 19 3.14820e+00 1.04197e+00 4.68518e+01 76.346  1.02417e+00  4.21613e+00  0.00000e+00 0.00000e+00 5.56667e+01 76.346  8.81488e+00 76.346  0.8754 
1 1 1 -11 94  1  o 15 2.36744e+00 7.77878e-01 3.18570e+01 297.697 8.21402e-01  -1.56472e+00 0.00000e+00 0.00000e+00 2.62714e+01 297.697 5.58561e+00 117.697 0.6556 
1 1 1 -11 94  2  o 1  4.33820e+00 1.09198e+00 7.97549e+01 66.402  2.72571e+00  6.23944e+00  0.00000e+00 0.00000e+00 7.01818e+01 66.402  9.57308e+00 246.402 0.9233 
1 1 1 -11 94  3  o 5  2.61683e+00 8.36322e-01 3.49839e+01 240.934 -1.09735e+00 -1.97428e+00 0.00000e+00 0.00000e+00 3.70666e+01 240.934 2.08267e+00 240.934 0.7360 
1 1 1 -11 94  4  o 15 3.69858e+00 9.94970e-01 1.30716e+02 135.036 -7.72443e+00 7.71461e+00  0.00000e+00 0.00000e+00 1.06175e+00 135.036 1.29654e+02 315.036 0.9530 
1 1 1 -11 94  5  o 16 9.48674e+00 8.54951e-01 1.14766e+02 10.607  2.64698e+01  4.95702e+00  0.00000e+00 0.00000e+00 2.32997e+02 10.607  1.18231e+02 10.607  0.9813 
1 1 1 -11 94  6  o 6  5.83814e+00 9.72346e-01 1.29064e+02 159.778 -1.65233e+01 6.08653e+00  0.00000e+00 0.00000e+00 8.25863e+01 159.778 4.64773e+01 339.778 0.9712 
1 1 1 -11 94  7  o 16 2.35832e+00 7.79275e-01 5.31063e+01 215.805 -2.98310e+00 -2.15184e+00 0.00000e+00 0.00000e+00 2.16505e+01 215.805 3.14558e+01 35.805  0.8499 
1 1 1 -11 94  8  o 6  2.52482e+00 8.40422e-01 4.17468e+01 49.790  2.14930e+00  2.54249e+00  0.00000e+00 0.00000e+00 3.64998e+01 49.790  5.24702e+00 229.790 0.8317 
1 1 1 -11 94  9  o 10 3.46824e+00 9.81734e-01 4.25671e+01 134.515 -2.77672e+00 2.82414e+00  0.00000e+00 0.00000e+00 6.87295e+01 134.515 2.61624e+01 134.515 0.8620 
1 1 1 -11 95  1  o 5  3.90949e+00 1.04992e+00 4.97153e+01 149.863 -3.61814e+00 2.10045e+00  0.00000e+00 0.00000e+00 7.76684e+01 149.863 2.79531e+01 149.863 0.8702 
1 1 1 -11 95  2  o 14 3.86290e+00 1.04140e+00 7.82455e+01 294.111 2.67436e+00  -5.97564e+00 0.00000e+00 0.00000e+00 5.47612e+01 294.111 2.34843e+01 114.111 0.9201 
1 1 1 -11 95  3  o 11 2.66662e+00 8.23534e-01 3.57340e+01 226.903 -1.54431e+00 -1.65046e+00 0.00000e+00 0.00000e+00 3.76886e+01 226.903 1.95461e+00 226.903 0.7362 
1 1 1 -11 95  4  f 0  5.38548e+00 1.04580e+00 7.62186e+01 330.778 7.59741e+00  -4.24984e+00 0.00000e+00 0.00000e+00 1.13124e+02 330.778 3.69058e+01 330.778 0.9407 
1 1 1 -11 95  5  o 4  1.07851e+01 8.00308e-01 1.39255e+02 117.738 -1.78160e+01 3.38792e+01  0.00000e+00 0.00000e+00 2.58252e+02 117.738 1.18998e+02 117.738 0.9869 
1 1 1 -11 95  6  o 12 3.42393e+00 9.71964e-01 2.41498e+01 299.253 1.02481e+00  -1.82970e+00 0.00000e+00 0.00000e+00 6.69691e+01 299.253 4.28193e+01 299.253 0.7131 
1 1 1 -11 95  7  o 14 3.91805e+00 9.44282e-01 4.96704e+01 13.625  5.05802e+00  1.22598e+00  0.00000e+00 0.00000e+00 8.15119e+01 13.625  3.18415e+01 13.625  0.8979 
1 1 1 -11 95  8  o 16 5.25947e+00 1.14323e+00 8.35278e+01 322.381 7.92765e+00  -6.10922e+00 0.00000e+00 0.00000e+00 1.02347e+02 322.381 1.88197e+01 322.381 0.9486 
1 1 1 -11 95  9  o 19 2.38886e+00 8.10128e-01 6.29109e+01 58.713  2.81914e+00  4.63906e+00  0.00000e+00 0.00000e+00 1.73260e+01 58.713  4.55849e+01 238.713 0.9025 
1 1 1 -11 96  1  o 11 4.81733e+00 1.11040e+00 6.89374e+01 62.685  2.89915e+00  5.61344e+00  0.00000e+00 0.00000e+00 9.64251e+01 62.685  2.74877e+01 62.685  0.9170 
1 1 1 -11 96  2  o 13 2.95209e+00 9.45327e-01 5.58168e+01 173.476 -3.53799e+00 4.04579e-01  0.00000e+00 0.00000e+00 3.74236e+01 173.476 1.83932e+01 353.476 0.8442 
1 1 1 -11 96  3  o 2  4.49688e+00 1.00523e+00 8.97075e+01 65.350  3.68874e+00  8.03834e+00  0.00000e+00 0.00000e+00 6.86191e+01 65.350  2.10884e+01 245.350 0.9416 
1 1 1 -11 96  4  o 6  9.89968e+00 8.36360e-01 1.84365e+02 349.406 4.45357e+01  -8.32959e+00 0.00000e+00 0.00000e+00 1.81436e+02 349.406 2.92874e+00 169.406 0.9889 
1 1 1 -11 96  5  o 9  1.27518e+01 7.73905e-01 1.72683e+02 156.152 -6.30899e+01 2.78889e+01  0.00000e+00 0.00000e+00 2.99986e+02 156.152 1.27303e+02 156.152 0.9927 
1 1 1 -11 96  6  o 12 5.83249e+00 9.97416e-01 1.18167e+02 48.287  1.11075e+01  1.24613e+01  0.00000e+00 0.00000e+00 9.28186e+01 48.287  2.53481e+01 228.287 0.9696 
1 1 1 -11 96  7  o 11 3.61203e+00 8.95615e-01 7.87077e+01 131.897 -5.17983e+00 5.77354e+00  0.00000e+00 0.00000e+00 4.69359e+01 131.897 3.17719e+01 311.897 0.9331 
1 1 1 -11 96  8  o 16 3.08087e+00 9.64850e-01 2.58467e+01 336.196 2.17100e+00  -9.57696e-01 0.00000e+00 0.00000e+00 6.02617e+01 336.196 3.44150e+01 336.196 0.7504 
1 1 1 -11 96  9  o 11 2.75044e+00 8.88545e-01 5.01863e+01 167.481 -4.72943e+00 1.05010e+00  0.00000e+00 0.00000e+00 4.08606e+01 167.481 9.32573e+00 347.481 0.8897 
1 1 1 -11 97  1  o 19 4.54905e+00 1.08656e+00 8.10747e+01 91.190  -1.56931e-01 7.55206e+00  0.00000e+00 0.00000e+00 7.74560e+01 91.190  3.61867e+00 271.190 0.9312 
1 1 1 -11 97  2  o 8  5.38827e+00 1.06552e+00 6.74043e+01 328.197 6.58581e+00  -4.08391e+00 0.00000e+00 0.00000e+00 1.20637e+02 328.197 5.32329e+01 328.197 0.9330 
1 1 1 -11 97  3  o 7  7.94549e+00 9.10853e-01 1.06397e+02 248.018 -7.40557e+00 -1.83457e+01 0.00000e+00 0.00000e+00 1.83000e+02 248.018 7.66034e+01 248.018 0.9744 
1 1 1 -11 97  4  o 8  5.23545e+00 1.09381e+00 7.30878e+01 2.672   8.04601e+00  3.75571e-01  0.00000e+00 0.00000e+00 1.09909e+02 2.672   3.68207e+01 2.672   0.9357 
1 1 1 -11 97  5  o 10 3.47146e+00 9.95159e-01 9.11290e+01 102.381 -1.61510e+00 7.35725e+00  0.00000e+00 0.00000e+00 2.95195e+01 102.381 6.16095e+01 282.381 0.9310 
1 1 1 -11 97  6  o 17 6.07764e+00 1.07892e+00 1.28276e+02 356.377 1.83133e+01  -1.15945e+00 0.00000e+00 0.00000e+00 9.21510e+01 356.377 3.61255e+01 176.377 0.9724 
1 1 1 -11 97  7  o 7  3.75015e+00 1.01219e+00 7.65964e+01 214.184 -6.15580e+00 -4.18091e+00 0.00000e+00 0.00000e+00 5.34035e+01 214.184 2.31930e+01 34.184  0.9302 
1 1 1 -11 97  8  o 18 3.90487e+00 1.07879e+00 7.21218e+01 247.873 -2.72426e+00 -6.70016e+00 0.00000e+00 0.00000e+00 6.28126e+01 247.873 9.30923e+00 67.874  0.9280 
1 1 1 -11 98  1  o 3  5.94063e+00 1.05727e+00 9.14812e+01 299.938 5.75489e+00  -9.99280e+00 0.00000e+00 0.00000e+00 1.20905e+02 299.938 2.94235e+01 299.938 0.9556 
1 1 1 -11 98  2  o 14 6.08468e+00 1.06631e+00 1.15069e+02 122.132 -7.83411e+00 1.24734e+01  0.00000e+00 0.00000e+00 1.04587e+02 122.132 1.04825e+01 302.132 0.9654 
1 1 1 -11 98  3  o 13 8.37378e+00 8.92194e-01 1.29223e+02 301.110 1.39625e+01  -2.31363e+01 0.00000e+00 0.00000e+00 1.77860e+02 301.110 4.86378e+01 301.110 0.9813 
1 1 1 -11 98  4  o 2  3.39410e+00 9.95010e-01 5.26820e+01 218.906 -3.45252e+00 -2.78648e+00 0.00000e+00 0.00000e+00 5.86644e+01 218.906 5.98247e+00 218.906 0.8784 
1 1 1 -11 98  5  o 5  2.87349e+00 8.65356e-01 3.52953e+01 17.685  2.85985e+00  9.11850e-01  0.00000e+00 0.00000e+00 5.15769e+01 17.685  1.62816e+01 17.685  0.8101 
1 1 1 -11 98  6  o 10 3.80644e+00 1.02177e+00 5.07080e+01 28.605  4.46667e+00  2.43586e+00  0.00000e+00 0.00000e+00 7.63826e+01 28.605  2.56745e+01 28.605  0.8954 
1 1 1 -11 98  7  o 15 3.88139e+00 1.06891e+00 6.51189e+01 72.909  1.86751e+00  6.07379e+00  0.00000e+00 0.00000e+00 6.75698e+01 72.909  2.45085e+00 72.909  0.9175 
1 1 1 -11 98  8  o 5  2.68149e+00 8.53288e-01 5.69985e+01 117.514 -2.47516e+00 4.75197e+00  0.00000e+00 0.00000e+00 3.29444e+01 117.514 2.40541e+01 297.514 0.9011 
1 1 1 -11 99  1  o 8  4.44361e+00 1.03713e+00 1.90113e+01 347.885 2.02288e+00  -4.34212e-01 0.00000e+00 0.00000e+00 9.87887e+01 347.885 7.97775e+01 347.885 0.7088 
1 1 1 -11 99  2  f 0  3.05303e+00 9.04949e-01 3.55567e+01 270.487 2.56091e-02  -3.01021e+00 0.00000e+00 0.00000e+00 5.69731e+01 270.487 2.14165e+01 270.487 0.8107 
1 1 1 -11 99  3  o 16 4.04438e+00 1.01500e+00 1.00981e+02 53.820  5.64299e+00  7.71572e+00  0.00000e+00 0.00000e+00 4.19807e+01 53.820  5.90002e+01 233.820 0.9462 
1 1 1 -11 99  4  o 8  2.76653e+00 8.79666e-01 6.01196e+01 215.856 -3.93847e+00 -2.84634e+00 0.00000e+00 0.00000e+00 3.18100e+01 215.856 2.83096e+01 35.856  0.8900 
1 1 1 -11 99  5  o 11 3.42054e+00 9.43674e-01 6.75335e+01 291.756 2.23945e+00  -5.61160e+00 0.00000e+00 0.00000e+00 4.89802e+01 291.756 1.85533e+01 111.756 0.9130 
1 1 1 -11 99  6  o 15 3.01763e+00 8.71597e-01 4.37389e+01 121.440 -2.04383e+00 3.34309e+00  0.00000e+00 0.00000e+00 5.30422e+01 121.440 9.30326e+00 121.440 0.8603 
1 1 1 -11 99  7  o 10 2.85630e+00 8.99337e-01 6.37213e+01 131.675 -3.51545e+00 3.94916e+00  0.00000e+00 0.00000e+00 3.19935e+01 131.675 3.17278e+01 311.675 0.8996 
1 1 1 -11 99  8  o 7  3.02237e+00 9.39623e-01 2.89617e+01 79.140  5.31494e-01  2.77034e+00  0.00000e+00 0.00000e+00 6.05489e+01 79.140  3.15872e+01 79.140  0.7958 
1 1 1 -11 100 1  o 17 3.56033e+00 9.84750e-01 8.25637e+01 249.517 -2.47133e+00 -6.61586e+00 0.00000e+00 0.00000e+00 4.07426e+01 249.517 4.18212e+01 69.517  0.9262 
1 1 1 -11 100 2  o 9  3.49110e+00 9.99732e-01 5.78872e+01 84.154  4.97913e-01  4.86301e+00  0.00000e+00 0.00000e+00 5.83259e+01 84.154  4.38699e-01 84.154  0.8907 
1 1 1 -11 100 3  o 19 3.87937e+00 1.02801e+00 3.47516e+01 98.347  -4.95130e-01 3.37471e+00  0.00000e+00 0.00000e+00 8.64242e+01 98.347  5.16727e+01 98.347  0.8363 
1 1 1 -11 100 4  o 4  6.74602e+00 1.09960e+00 9.53014e+01 293.459 6.19906e+00  -1.42849e+01 0.00000e+00 0.00000e+00 1.48271e+02 293.459 5.29700e+01 293.459 0.9673 
1 1 1 -11 100 5  o 15 4.17552e+00 1.04873e+00 7.58745e+01 196.276 -7.53078e+00 -2.19879e+00 0.00000e+00 0.00000e+00 6.95719e+01 196.276 6.30256e+00 16.276  0.9339 
1 1 1 -11 100 6  f 0  2.75664e+00 8.26423e-01 6.20592e+01 355.369 5.45923e+00  -4.42223e-01 0.00000e+00 0.00000e+00 3.07531e+01 355.369 3.13061e+01 175.369 0.9034 
1 1 1 -11 100 7  o 9  7.29629e+00 1.02996e+00 1.21120e+02 148.814 -2.17851e+01 1.31865e+01  0.00000e+00 0.00000e+00 1.45191e+02 148.814 2.40710e+01 148.814 0.9802 
1 1 1 -11 100 8  o 16 4.75798e+00 1.17625e+00 1.06147e+02 356.189 1.29453e+01  -8.62289e-01 0.00000e+00 0.00000e+00 6.39058e+01 356.189 4.22415e+01 176.189 0.9607 
1 1 1 -11 101 1  o 10 4.05324e+00 1.01485e+00 4.66622e+01 110.169 -1.63325e+00 4.44655e+00  0.00000e+00 0.00000e+00 8.77191e+01 110.169 4.10569e+01 110.169 0.8869 
1 1 1 -11 101 2  o 16 2.82663e+00 8.86637e-01 6.66933e+01 123.047 -2.90352e+00 4.46308e+00  0.00000e+00 0.00000e+00 2.83959e+01 123.047 3.82974e+01 303.047 0.9004 
1 1 1 -11 101 3  o 18 3.36013e+00 9.58344e-01 6.66737e+01 10.226  6.14525e+00  1.10857e+00  0.00000e+00 0.00000e+00 4.82524e+01 10.226  1.84213e+01 190.226 0.9160 
1 1 1 -11 101 4  o 18 3.61168e+00 1.01807e+00 4.42340e+01 103.389 -9.77817e-01 4.10780e+00  0.00000e+00 0.00000e+00 7.32265e+01 103.389 2.89925e+01 103.389 0.8716 
1 1 1 -11 101 5  o 11 2.34424e+00 7.83181e-01 4.52361e+01 128.658 -2.33003e+00 2.91268e+00  0.00000e+00 0.00000e+00 2.92631e+01 128.658 1.59730e+01 308.658 0.8523 
1 1 1 -11 101 6  o 11 3.03943e+00 9.15991e-01 4.83462e+01 173.276 -4.43701e+00 5.23148e-01  0.00000e+00 0.00000e+00 5.12399e+01 173.276 2.89369e+00 173.276 0.8794 
1 1 1 -11 101 7  o 18 4.48230e+00 1.12783e+00 9.24064e+01 102.403 -2.32534e+00 1.05731e+01  0.00000e+00 0.00000e+00 6.65556e+01 102.403 2.58508e+01 282.404 0.9526 
1 1 1 -11 102 1  o 10 3.03668e+00 9.27532e-01 4.81278e+01 337.863 3.59208e+00  -1.46127e+00 0.00000e+00 0.00000e+00 4.93169e+01 337.863 1.18905e+00 337.863 0.8587 
1 1 1 -11 102 2  o 19 7.66966e+00 9.75490e-01 1.34323e+02 100.900 -5.38121e+00 2.79454e+01  0.00000e+00 0.00000e+00 1.47071e+02 100.900 1.27481e+01 100.900 0.9823 
1 1 1 -11 102 3  o 4  5.38951e+00 1.07489e+00 5.42195e+01 345.666 6.83597e+00  -1.74672e+00 0.00000e+00 0.00000e+00 1.32108e+02 345.666 7.78886e+01 345.666 0.9261 
1 1 1 -11 102 4  o 1  9.44602e+00 9.05674e-01 1.53961e+02 225.726 -3.14656e+01 -3.22736e+01 0.00000e+00 0.00000e+00 1.94487e+02 225.726 4.05261e+01 225.726 0.9888 
1 1 1 -11 102 5  o 7  3.10136e+00 9.43012e-01 1.23217e+01 156.737 -9.78658e-01 4.20732e-01  0.00000e+00 0.00000e+00 4.19047e+01 156.737 2.95830e+01 156.737 0.4690 
1 1 1 -11 102 6  o 5  2.75497e+00 8.25656e-01 5.89486e+01 86.065  4.02847e-01  5.85635e+00  0.00000e+00 0.00000e+00 3.44649e+01 86.065  2.44837e+01 266.065 0.9103 
1 1 1 -11 102 7  o 10 3.50127e+00 9.82453e-01 4.74551e+01 57.316  2.88161e+00  4.49139e+00  0.00000e+00 0.00000e+00 6.99057e+01 57.316  2.24505e+01 57.316  0.9006 
1 1 1 -11 103 1  o 7  5.93293e+00 1.07807e+00 7.72699e+01 316.536 8.00268e+00  -7.58476e+00 0.00000e+00 0.00000e+00 1.34085e+02 316.536 5.68156e+01 316.536 0.9535 
1 1 1 -11 103 2  o 18 4.10810e+00 1.04083e+00 9.22661e+01 86.092  6.50593e-01  9.52335e+00  0.00000e+00 0.00000e+00 5.28613e+01 86.092  3.94048e+01 266.092 0.9461 
1 1 1 -11 103 3  o 6  2.59610e+00 8.13476e-01 4.15258e+01 118.927 -1.77809e+00 3.21740e+00  0.00000e+00 0.00000e+00 4.08049e+01 118.927 7.20929e-01 298.927 0.8498 
1 1 1 -11 103 4  o 18 3.35211e+00 9.72486e-01 5.55724e+01 295.560 2.37298e+00  -4.96164e+00 0.00000e+00 0.00000e+00 5.74171e+01 295.560 1.84476e+00 295.560 0.9038 
1 1 1 -11 103 5  o 3  3.60309e+00 1.02257e+00 8.64307e+01 3.451   8.89794e+00  5.36582e-01  0.00000e+00 0.00000e+00 4.00746e+01 3.451   4.63561e+01 183.451 0.9421 
1 1 1 -11 103 6  f 0  4.02898e+00 1.07360e+00 6.08314e+01 152.884 -5.90131e+00 3.02195e+00  0.00000e+00 0.00000e+00 7.73714e+01 152.884 1.65400e+01 152.884 0.9212 
1 1 1 -11 104 1  o 11 3.99351e+00 1.03977e+00 8.42796e+01 282.066 1.82176e+00  -8.52216e+00 0.00000e+00 0.00000e+00 5.60404e+01 282.066 2.82392e+01 102.066 0.9407 
1 1 1 -11 104 2  o 15 3.00224e+00 9.07892e-01 7.81095e+01 276.094 7.35323e-01  -6.88690e+00 0.00000e+00 0.00000e+00 2.55252e+01 276.094 5.25843e+01 96.094  0.9247 
1 1 1 -11 104 3  o 5  3.03564e+00 9.31015e-01 8.75802e+01 213.326 -6.26598e+00 -4.12014e+00 0.00000e+00 0.00000e+00 1.78269e+01 213.326 6.97533e+01 33.327  0.9307 
1 1 1 -11 104 4  o 13 3.72358e+00 1.00067e+00 9.18447e+01 128.681 -6.26874e+00 7.82999e+00  0.00000e+00 0.00000e+00 3.98698e+01 128.681 5.19748e+01 308.681 0.9488 
1 1 1 -11 104 5  o 9  3.68920e+00 1.01672e+00 3.68500e+01 243.903 -1.76918e+00 -3.61178e+00 0.00000e+00 0.00000e+00 8.19534e+01 243.903 4.51034e+01 243.903 0.8644 
1 1 1 -11 104 6  o 4  2.42450e+00 8.02646e-01 2.67890e+01 325.728 2.13117e+00  -1.45225e+00 0.00000e+00 0.00000e+00 4.30095e+01 325.728 1.62205e+01 325.728 0.7733 
1 1 1 -11 105 1  o 5  4.07206e+00 1.04052e+00 9.81168e+01 285.574 2.71437e+00  -9.73852e+00 0.00000e+00 0.00000e+00 4.62042e+01 285.574 5.19125e+01 105.575 0.9492 
1 1 1 -11 105 2  o 19 3.52845e+00 9.95046e-01 4.30707e+01 156.127 -3.89189e+00 1.72242e+00  0.00000e+00 0.00000e+00 7.18453e+01 156.127 2.87746e+01 156.127 0.8727 
1 1 1 -11 105 3  o 2  3.78242e+00 1.01490e+00 6.21684e+01 52.145  4.16464e+00  5.35830e+00  0.00000e+00 0.00000e+00 6.80524e+01 52.145  5.88394e+00 52.145  0.9231 
1 1 1 -11 105 4  o 2  3.39346e+00 9.41953e-01 4.56183e+01 152.646 -4.53620e+00 2.34669e+00  0.00000e+00 0.00000e+00 6.76875e+01 152.646 2.20692e+01 152.646 0.8958 
1 1 1 -11 105 5  o 4  3.41049e+00 9.16056e-01 5.77938e+01 213.681 -5.49396e+00 -3.66133e+00 0.00000e+00 0.00000e+00 5.91735e+01 213.681 1.37969e+00 213.681 0.9208 
1 1 1 -11 106 1  o 6  2.20489e+00 7.32541e-01 4.66064e+01 253.296 -1.18467e+00 -3.94764e+00 0.00000e+00 0.00000e+00 2.48381e+01 253.296 2.17683e+01 73.296  0.8680 
1 1 1 -11 106 2  o 13 4.74761e+00 1.12439e+00 1.17264e+02 195.399 -1.39289e+01 -3.83631e+00 0.00000e+00 0.00000e+00 5.36191e+01 195.399 6.36446e+01 15.399  0.9647 
1 1 1 -11 106 3  o 19 6.06020e+00 1.11032e+00 9.72679e+01 43.298  1.14333e+01  1.07736e+01  0.00000e+00 0.00000e+00 1.21382e+02 43.298  2.41137e+01 43.298  0.9676 
1 1 1 -11 106 4  o 7  2.72872e+00 8.65803e-01 3.81230e+01 57.362  1.99136e+00  3.10927e+00  0.00000e+00 0.00000e+00 4.83590e+01 57.362  1.02360e+01 57.362  0.8506 
1 1 1 -11 106 5  o 13 2.48181e+00 8.11399e-01 2.81142e+01 176.558 -2.75721e+00 1.65822e-01  0.00000e+00 0.00000e+00 4.49591e+01 176.558 1.68448e+01 176.558 0.7907 
1 1 1 -11 107 1  o 4  2.44165e+00 8.12950e-01 7.75576e+01 193.447 -6.85012e+00 -1.63782e+00 0.00000e+00 0.00000e+00 6.81797e+00 193.447 7.07396e+01 13.447  0.9260 
1 1 1 -11 107 2  o 17 6.24484e+00 1.08145e+00 9.06095e+01 13.405  1.47558e+01  3.51667e+00  0.00000e+00 0.00000e+00 1.34496e+02 13.405  4.38868e+01 13.405  0.9665 
1 1 1 -11 107 3  o 8  3.73721e+00 1.02428e+00 6.95747e+01 190.539 -7.56844e+00 -1.40813e+00 0.00000e+00 0.00000e+00 6.03413e+01 190.539 9.23339e+00 10.539  0.9326 
1 1 1 -11 107 4  o 10 2.75024e+00 8.76975e-01 2.43147e+01 35.433  1.99497e+00  1.41948e+00  0.00000e+00 0.00000e+00 5.34722e+01 35.433  2.91576e+01 35.433  0.7593 
1 1 1 -11 107 5  o 6  3.83442e+00 1.08019e+00 6.77443e+01 173.971 -7.49295e+00 7.91337e-01  0.00000e+00 0.00000e+00 6.51492e+01 173.971 2.59511e+00 353.971 0.9311 
1 1 1 -11 108 1  o 3  2.96725e+00 9.14061e-01 3.42013e+01 172.330 -3.49944e+00 4.71260e-01  0.00000e+00 0.00000e+00 5.90854e+01 172.330 2.48841e+01 172.330 0.8427 
1 1 1 -11 108 2  o 1  2.38722e+00 7.93664e-01 3.44894e+01 260.437 -5.48729e-01 -3.25705e+00 0.00000e+00 0.00000e+00 3.94001e+01 260.437 4.91073e+00 260.437 0.8301 
1 1 1 -11 108 3  o 19 4.60098e+00 1.10022e+00 9.94685e+01 174.817 -1.29060e+01 1.17065e+00  0.00000e+00 0.00000e+00 6.52311e+01 174.817 3.42374e+01 354.817 0.9606 
1 1 1 -11 108 4  o 2  2.88856e+00 8.46451e-01 2.49496e+01 253.676 -7.76489e-01 -2.65135e+00 0.00000e+00 0.00000e+00 6.01158e+01 253.676 3.51663e+01 253.676 0.7908 
1 1 1 -11 109 1  o 1  2.01395e+00 6.90337e-01 1.53358e+01 291.285 5.17520e-01  -1.32838e+00 0.00000e+00 0.00000e+00 2.80190e+01 291.285 1.26832e+01 291.285 0.5772 
1 1 1 -11 109 2  o 19 2.73196e+00 8.38243e-01 5.20372e+01 308.319 3.23761e+00  -4.09676e+00 0.00000e+00 0.00000e+00 3.94400e+01 308.319 1.25973e+01 128.319 0.8983 
1 1 1 -11 109 3  o 1  2.70875e+00 8.86673e-01 5.83359e+01 193.608 -5.60514e+00 -1.35682e+00 0.00000e+00 0.00000e+00 3.33493e+01 193.608 2.49866e+01 13.608  0.9086 
1 1 1 -11 109 4  o 17 2.86661e+00 8.95736e-01 2.96415e+01 154.446 -2.79528e+00 1.33653e+00  0.00000e+00 0.00000e+00 5.75498e+01 154.446 2.79083e+01 154.446 0.8170 
1 1 1 -11 110 1  o 4  2.53472e+00 8.11253e-01 6.95048e+01 256.102 -1.81223e+00 -7.32391e+00 0.00000e+00 0.00000e+00 1.84949e+01 256.102 5.10099e+01 76.102  0.9312 
1 1 1 -11 110 2  o 15 2.26357e+00 7.59828e-01 2.36785e+01 116.762 -1.03996e+00 2.06214e+00  0.00000e+00 0.00000e+00 3.89599e+01 116.762 1.52815e+01 116.762 0.7426 
1 1 1 -11 110 3  o 17 3.04702e+00 9.45703e-01 6.83962e+01 72.612  2.30788e+00  7.36976e+00  0.00000e+00 0.00000e+00 3.74572e+01 72.612  3.09390e+01 252.612 0.9328 
1 1 1 -11 111 1  o 7  2.10935e+00 7.24721e-01 5.02993e+01 327.519 4.22892e+00  -2.69211e+00 0.00000e+00 0.00000e+00 1.99641e+01 327.519 3.03352e+01 147.519 0.8937 
1 1 1 -11 111 2  o 16 2.72791e+00 8.71337e-01 5.66141e+01 206.817 -5.39667e+00 -2.72810e+00 0.00000e+00 0.00000e+00 3.61766e+01 206.817 2.04375e+01 26.817  0.9131 
1 1 1 -11 111 3  o 9  2.86694e+00 9.33350e-01 4.29913e+01 197.837 -4.79007e+00 -1.54138e+00 0.00000e+00 0.00000e+00 5.24463e+01 197.837 9.45503e+00 197.837 0.8941 
1 1 1 -11 112 1  o 19 2.81817e+00 9.04472e-01 2.97408e+01 182.033 -2.99728e+00 -1.06399e-01 0.00000e+00 0.00000e+00 5.53094e+01 182.033 2.55686e+01 182.033 0.8099 
1 1 1 -11 112 2  o 2  2.72292e+00 8.76827e-01 2.85354e+01 218.731 -2.14276e+00 -1.71856e+00 0.00000e+00 0.00000e+00 5.15122e+01 218.731 2.29768e+01 218.731 0.7894 
1 1 1 -10 0   1  o 1  2.64094e+01 9.91488e-01 4.60233e+02 180.000 -1.27314e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.39325e+02 180.000 7.90913e+01 180.000 1.0000 
1 1 1 -10 0   2  o 1  1.57521e+01 9.71686e-01 1.85008e+02 0.000   3.04845e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.08216e+02 0.000   2.23207e+02 0.000   0.9955 
1 1 1 -10 0   3  f 0  3.80936e+01 1.21338e+00 8.16103e+02 0.000   3.33872e+01  0.00000e+00  0.00000e+00 0.00000e+00 6.24171e+02 0.000   1.91932e+02 180.000 1.0000 
1 1 1 -10 0   4  o 19 1.70921e+01 1.01247e+00 3.93923e+02 180.000 -8.19580e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.51911e+02 180.000 1.42012e+02 0.000   1.0000 
1 1 1 -10 0   5  o 3  1.67538e+01 1.05555e+00 2.59224e+02 180.000 -5.63324e+00 -0.00000e+00 0.00000e+00 0.00000e+00 3.73382e+02 180.000 1.14158e+02 180.000 1.0000 
1 1 1 -10 0   6  f 0  5.42881e+01 1.60567e+00 9.45468e+02 180.000 -7.04167e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.10293e+03 180.000 1.57461e+02 180.000 1.0000 
1 1 1 -10 0   7  o 3  2.73566e+01 1.09739e+00 3.22268e+02 180.000 -1.43396e+01 -0.00000e+00 0.00000e+00 0.00000e+00 7.09123e+02 180.000 3.86856e+02 180.000 1.0000 
1 1 1 -10 0   8  o 7  8.70117e+00 1.93660e+00 2.18304e+02 0.000   3.61919e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.08992e+02 0.000   1.09312e+02 180.000 0.9986 
1 1 1 -10 0   9  o 10 2.24777e+01 1.07841e+00 4.13570e+02 0.000   2.47126e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.32371e+02 0.000   1.88008e+01 0.000   1.0000 
1 1 1 -10 0   10 o 9  1.42801e+01 1.17495e+00 2.27429e+02 0.000   1.10220e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.09468e+02 0.000   8.20392e+01 0.000   1.0000 
1 1 1 -10 0   11 f 0  6.69934e+00 1.86544e+00 8.33660e+01 0.000   1.96506e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.58556e+02 0.000   7.51905e+01 0.000   0.9615 
1 1 1 -10 0   12 o 2  6.20556e+00 1.73372e+00 1.40945e+02 180.000 -3.83202e+00 -0.00000e+00 0.00000e+00 0.00000e+00 9.16497e+01 180.000 4.92951e+01 0.000   0.9991 
1 1 1 -10 0   13 o 9  3.29758e+00 1.73168e+00 1.72613e+01 0.000   2.94440e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.81066e+01 0.000   8.45267e-01 0.000   0.2862 
1 1 1 -10 0   14 o 8  2.09787e+00 1.37548e+00 2.26728e+01 180.000 -3.10623e-01 -0.00000e+00 0.00000e+00 0.00000e+00 9.61194e-01 180.000 2.17116e+01 0.000   0.3010 
1 1 1 -10 0   15 o 4  1.21103e+01 9.94646e-01 2.26615e+02 180.000 -2.08485e+01 0.00000e+00  0.00000e+00 0.00000e+00 2.26056e+02 180.000 5.59092e-01 0.000   1.0000 
1 1 1 -10 0   16 o 6  2.80884e+00 1.67547e+00 1.33261e+02 0.000   2.61449e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.95295e+01 180.000 1.62791e+02 180.000 0.9893 
1 1 1 -10 0   17 o 17 3.39745e+00 1.85271e+00 7.71646e+01 180.000 -1.89748e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.39083e+01 180.000 3.32563e+01 0.000   0.9560 
1 1 1 -10 0   18 o 15 2.63322e+00 1.71766e+00 6.86250e+01 180.000 -1.53157e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.06329e+01 180.000 4.79921e+01 0.000   0.9107 
1 1 1 -10 0   19 o 6  2.33641e+00 1.65846e+00 1.94920e+01 0.000   4.63157e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.80754e+01 0.000   1.41664e+00 180.000 0.4327 
1 1 1 -10 1   1  o 17 1.92317e+01 6.54964e-01 3.50029e+02 17.074  1.35134e+01  4.15046e+00  0.00000e+00 0.00000e+00 3.51625e+02 17.074  1.59521e+00 17.074  0.9640 
1 1 1 -10 1   2  o 4  4.37887e+01 9.40950e-01 7.70365e+02 205.129 -6.28617e+01 -2.94848e+01 0.00000e+00 0.00000e+00 8.74177e+02 205.129 1.03811e+02 205.129 0.9928 
1 1 1 -10 1   3  o 3  7.11250e+00 1.04895e+00 2.12071e+02 353.285 3.17048e+00  -3.73270e-01 0.00000e+00 0.00000e+00 9.31588e+00 353.285 2.02755e+02 173.285 0.8233 
1 1 1 -10 1   4  o 11 1.22621e+01 7.66597e-01 1.40602e+02 107.694 -1.27121e+00 3.98475e+00  0.00000e+00 0.00000e+00 2.62583e+02 107.694 1.21981e+02 107.694 0.8702 
1 1 1 -10 1   5  o 12 4.29966e+01 9.45263e-01 8.39242e+02 357.118 9.19725e+01  -4.62934e+00 0.00000e+00 0.00000e+00 7.75462e+02 357.118 6.37792e+01 177.118 0.9946 
1 1 1 -10 1   6  o 14 3.92484e+01 9.02710e-01 6.90431e+02 226.403 -5.25590e+01 -5.51989e+01 0.00000e+00 0.00000e+00 7.80740e+02 226.403 9.03095e+01 226.403 0.9934 
1 1 1 -10 1   7  o 14 3.21031e+01 8.19743e-01 5.37969e+02 65.362  2.33203e+01  5.08460e+01  0.00000e+00 0.00000e+00 6.61505e+02 65.362  1.23537e+02 65.362  0.9910 
1 1 1 -10 1   8  o 14 7.98632e+00 1.22303e+00 2.01245e+02 316.338 4.55444e+00  -4.34655e+00 0.00000e+00 0.00000e+00 7.45408e+01 316.338 1.26704e+02 136.338 0.9167 
1 1 1 -10 1   9  o 16 1.41310e+01 8.56235e-01 3.03995e+02 216.983 -1.79709e+01 -1.35338e+01 0.00000e+00 0.00000e+00 2.15862e+02 216.983 8.81325e+01 36.983  0.9775 
1 1 1 -10 1   10 o 10 1.58796e+01 8.06369e-01 3.11832e+02 66.897  1.32555e+01  3.10726e+01  0.00000e+00 0.00000e+00 2.76298e+02 66.897  3.55338e+01 246.897 0.9851 
1 1 1 -10 1   11 o 2  7.47502e+00 1.09680e+00 1.67944e+02 52.261  5.81979e+00  7.51943e+00  0.00000e+00 0.00000e+00 9.76038e+01 52.261  7.03404e+01 232.261 0.9459 
1 1 1 -10 1   12 o 17 1.93936e+01 6.61408e-01 3.15564e+02 305.917 3.81346e+01  -5.26485e+01 0.00000e+00 0.00000e+00 4.06402e+02 305.917 9.08374e+01 305.917 0.9923 
1 1 1 -10 1   13 o 13 9.85218e+00 7.92397e-01 1.80052e+02 49.494  1.43429e+01  1.67899e+01  0.00000e+00 0.00000e+00 1.80680e+02 49.494  6.27905e-01 49.494  0.9771 
1 1 1 -10 1   14 o 13 4.51772e+00 1.02989e+00 9.36132e+01 96.063  -5.67526e-01 5.34300e+00  0.00000e+00 0.00000e+00 5.87951e+01 96.063  3.48181e+01 276.063 0.9014 
1 1 1 -10 1   15 o 12 7.96088e+00 8.96062e-01 1.06040e+02 116.222 -5.21093e+00 1.05796e+01  0.00000e+00 0.00000e+00 1.78619e+02 116.222 7.25789e+01 116.222 0.9566 
1 1 1 -10 1   16 o 4  3.07955e+00 9.55045e-01 4.12726e+01 203.697 -1.86478e+00 -8.18476e-01 0.00000e+00 0.00000e+00 3.96184e+01 203.697 1.65423e+00 23.697  0.7037 
1 1 1 -10 1   17 o 19 7.94162e+00 1.06136e+00 1.53593e+02 31.222  1.79566e+01  1.08842e+01  0.00000e+00 0.00000e+00 1.35300e+02 31.222  1.82933e+01 211.222 0.9759 
1 1 1 -10 1   18 o 13 4.78216e+00 1.26733e+00 9.67727e+01 27.841  6.66129e+00  3.51820e+00  0.00000e+00 0.00000e+00 6.89497e+01 27.841  2.78229e+01 207.841 0.9310 
1 1 1 -10 1   19 o 15 5.47122e+00 1.50844e+00 7.97864e+01 79.256  1.23497e+00  6.50882e+00  0.00000e+00 0.00000e+00 1.07500e+02 79.256  2.77137e+01 79.256  0.9211 
1 1 1 -10 2   1  o 10 3.09584e+01 7.54385e-01 6.99606e+02 258.648 -8.90145e+00 -4.43375e+01 0.00000e+00 0.00000e+00 4.59090e+02 258.648 2.40516e+02 78.648  0.9889 
1 1 1 -10 2   2  o 14 1.76509e+01 6.57923e-01 2.60183e+02 240.725 -4.70438e+00 -8.39169e+00 0.00000e+00 0.00000e+00 3.71824e+02 240.725 1.11641e+02 240.725 0.9465 
1 1 1 -10 2   3  o 9  3.69778e+01 8.40771e-01 5.69790e+02 23.892  4.14164e+01  1.83465e+01  0.00000e+00 0.00000e+00 8.12771e+02 23.892  2.42981e+02 23.892  0.9889 
1 1 1 -10 2   4  o 10 2.20063e+01 7.06129e-01 4.48180e+02 30.351  2.07287e+01  1.21375e+01  0.00000e+00 0.00000e+00 3.65838e+02 30.351  8.23414e+01 210.351 0.9790 
1 1 1 -10 2   5  o 16 2.35261e+01 7.32479e-01 4.12098e+02 210.731 -2.16377e+01 -1.28636e+01 0.00000e+00 0.00000e+00 4.58411e+02 210.731 4.63127e+01 210.731 0.9799 
1 1 1 -10 2   6  o 7  2.97753e+01 7.83084e-01 6.09164e+02 163.453 -4.94241e+01 1.46844e+01  0.00000e+00 0.00000e+00 5.03362e+02 163.453 1.05802e+02 343.453 0.9903 
1 1 1 -10 2   7  o 4  7.82206e+00 1.28361e+00 1.75757e+02 198.401 -3.98708e+00 -1.32642e+00 0.00000e+00 0.00000e+00 8.10633e+01 198.401 9.46936e+01 18.401  0.8709 
1 1 1 -10 2   8  o 1  1.03978e+01 1.02825e+00 8.11230e+01 339.081 3.18905e+00  -1.21902e+00 0.00000e+00 0.00000e+00 2.46511e+02 339.081 1.65388e+02 339.081 0.8365 
1 1 1 -10 2   9  o 3  9.24646e+00 1.05081e+00 2.39706e+02 6.901   1.11155e+01  1.34525e+00  0.00000e+00 0.00000e+00 9.23554e+01 6.901   1.47351e+02 186.901 0.9542 
1 1 1 -10 2   10 o 15 2.26958e+01 7.71482e-01 4.23324e+02 321.779 5.18545e+01  -4.08360e+01 0.00000e+00 0.00000e+00 4.23488e+02 321.779 1.64278e-01 321.779 0.9924 
1 1 1 -10 2   11 o 12 5.02070e+00 1.15326e+00 7.07243e+01 242.200 -1.23193e+00 -2.33659e+00 0.00000e+00 0.00000e+00 7.62733e+01 242.200 5.54893e+00 242.200 0.7795 
1 1 1 -10 2   12 o 11 8.16051e+00 8.53376e-01 1.80516e+02 132.303 -9.95418e+00 1.09381e+01  0.00000e+00 0.00000e+00 1.15100e+02 132.303 6.54164e+01 312.303 0.9656 
1 1 1 -10 2   13 o 13 9.81333e+00 7.72084e-01 1.50351e+02 276.232 2.00851e+00  -1.83932e+01 0.00000e+00 0.00000e+00 2.07303e+02 276.232 5.69517e+01 276.232 0.9726 
1 1 1 -10 2   14 o 15 3.13212e+00 9.39259e-01 1.07054e+01 142.228 -3.51634e-01 2.72479e-01  0.00000e+00 0.00000e+00 1.47440e+01 142.228 4.03860e+00 142.228 0.2171 
1 1 1 -10 2   15 o 18 4.52073e+00 1.03644e+00 5.87897e+01 194.533 -3.35617e+00 -8.70056e-01 0.00000e+00 0.00000e+00 8.30456e+01 194.533 2.42559e+01 194.533 0.8394 
1 1 1 -10 2   16 o 15 6.27727e+00 1.07825e+00 1.29779e+02 261.179 -1.86206e+00 -1.19990e+01 0.00000e+00 0.00000e+00 9.46739e+01 261.179 3.51054e+01 81.179  0.9579 
1 1 1 -10 2   17 o 16 6.10011e+00 1.18578e+00 8.62477e+01 63.765  3.67385e+00  7.45474e+00  0.00000e+00 0.00000e+00 1.26984e+02 63.765  4.07360e+01 63.765  0.9378 
1 1 1 -10 2   18 o 19 1.01568e+01 1.03999e+00 1.18800e+02 41.342  1.75318e+01  1.54247e+01  0.00000e+00 0.00000e+00 2.51059e+02 41.342  1.32259e+02 41.342  0.9783 
1 1 1 -10 2   19 o 17 2.99800e+00 1.04312e+00 5.37398e+01 98.401  -5.37051e-01 3.63626e+00  0.00000e+00 0.00000e+00 4.09401e+01 98.401  1.27997e+01 278.401 0.8498 
1 1 1 -10 3   1  f 0  2.20388e+01 6.66264e-01 1.05644e+02 233.323 -2.91715e+00 -3.91690e+00 0.00000e+00 0.00000e+00 6.37242e+02 233.323 5.31598e+02 233.323 0.8906 
1 1 1 -10 3   2  o 17 4.54381e+01 9.66862e-01 7.05900e+02 147.836 -5.57527e+01 3.50609e+01  0.00000e+00 0.00000e+00 9.99892e+02 147.836 2.93992e+02 147.836 0.9924 
1 1 1 -10 3   3  o 5  1.95584e+01 6.78023e-01 3.87232e+02 131.428 -1.08800e+01 1.23288e+01  0.00000e+00 0.00000e+00 3.29388e+02 131.428 5.78439e+01 311.428 0.9691 
1 1 1 -10 3   4  o 16 2.12499e+01 7.02654e-01 2.36053e+02 5.046   1.21684e+01  1.07446e+00  0.00000e+00 0.00000e+00 5.33274e+02 5.046   2.97221e+02 5.046   0.9582 
1 1 1 -10 3   5  o 1  3.61309e+01 8.45710e-01 6.53083e+02 152.588 -5.39064e+01 2.79565e+01  0.00000e+00 0.00000e+00 6.99915e+02 152.588 4.68317e+01 152.588 0.9917 
1 1 1 -10 3   6  o 12 2.36842e+01 7.38064e-01 3.74647e+02 27.077  2.25346e+01  1.15201e+01  0.00000e+00 0.00000e+00 5.01156e+02 27.077  1.26509e+02 27.077  0.9800 
1 1 1 -10 3   7  o 11 3.02643e+01 7.98235e-01 6.42560e+02 209.661 -5.48279e+01 -3.12244e+01 0.00000e+00 0.00000e+00 4.89367e+02 209.661 1.53194e+02 29.661  0.9920 
1 1 1 -10 3   8  o 19 1.26678e+01 9.11376e-01 1.86780e+02 92.855  -4.85302e-01 9.73062e+00  0.00000e+00 0.00000e+00 2.65205e+02 92.855  7.84249e+01 92.855  0.9472 
1 1 1 -10 3   9  o 6  1.64722e+01 7.85736e-01 2.69638e+02 161.605 -2.23181e+01 7.42189e+00  0.00000e+00 0.00000e+00 3.36954e+02 161.605 6.73161e+01 161.605 0.9785 
1 1 1 -10 3   10 o 17 1.34735e+01 8.25768e-01 2.13282e+02 348.293 1.91134e+01  -3.96051e+00 0.00000e+00 0.00000e+00 2.80130e+02 348.293 6.68480e+01 348.293 0.9740 
1 1 1 -10 3   11 o 5  3.31661e+00 1.02470e+00 6.29439e+01 242.044 -7.57508e-01 -1.42732e+00 0.00000e+00 0.00000e+00 1.47222e+01 242.044 4.82217e+01 62.044  0.6235 
1 1 1 -10 3   12 o 4  6.79310e+00 1.01366e+00 1.21404e+02 303.823 4.36222e+00  -6.51060e+00 0.00000e+00 0.00000e+00 1.16585e+02 303.823 4.81940e+00 123.823 0.9338 
1 1 1 -10 3   13 o 18 4.25022e+00 1.05223e+00 1.16634e+02 150.067 -4.80919e+00 2.76912e+00  0.00000e+00 0.00000e+00 2.74602e+01 150.067 8.91742e+01 330.067 0.9047 
1 1 1 -10 3   14 o 7  5.26900e+00 1.03208e+00 1.11366e+02 144.565 -6.06684e+00 4.31700e+00  0.00000e+00 0.00000e+00 7.20695e+01 144.565 3.92970e+01 324.565 0.9302 
1 1 1 -10 3   15 o 17 9.85649e+00 7.69693e-01 1.43617e+02 36.312  1.68588e+01  1.23896e+01  0.00000e+00 0.00000e+00 2.15887e+02 36.312  7.22699e+01 36.312  0.9758 
1 1 1 -10 3   16 o 12 5.35442e+00 1.06262e+00 8.60973e+01 44.171  4.97433e+00  4.83239e+00  0.00000e+00 0.00000e+00 9.87421e+01 44.171  1.26448e+01 44.171  0.9248 
1 1 1 -10 3   17 o 6  8.61725e+00 1.02661e+00 1.26380e+02 97.437  -2.48415e+00 1.90294e+01  0.00000e+00 0.00000e+00 1.86347e+02 97.437  5.99670e+01 97.437  0.9736 
1 1 1 -10 3   18 o 1  7.13671e+00 1.28141e+00 1.47111e+02 256.643 -4.09803e+00 -1.72599e+01 0.00000e+00 0.00000e+00 1.10922e+02 256.643 3.61882e+01 76.643  0.9714 
1 1 1 -10 3   19 o 19 6.70002e+00 1.41824e+00 8.74845e+01 18.984  9.08750e+00  3.12628e+00  0.00000e+00 0.00000e+00 1.48177e+02 18.984  6.06924e+01 18.984  0.9464 
1 1 1 -10 4   1  o 3  2.87535e+01 7.27214e-01 5.59792e+02 336.936 3.09458e+01  -1.31763e+01 0.00000e+00 0.00000e+00 5.12161e+02 336.936 4.76306e+01 156.936 0.9850 
1 1 1 -10 4   2  o 16 1.45164e+01 6.80323e-01 3.62872e+02 216.915 -8.80557e+00 -6.61506e+00 0.00000e+00 0.00000e+00 1.60713e+02 216.915 2.02159e+02 36.915  0.9535 
1 1 1 -10 4   3  o 12 4.77256e+00 1.15433e+00 5.29099e+01 31.649  4.50377e-01  2.77600e-01  0.00000e+00 0.00000e+00 6.77378e+00 211.649 5.96836e+01 211.649 0.2557 
1 1 1 -10 4   4  o 17 3.11620e+01 7.71179e-01 5.19934e+02 120.377 -1.98524e+01 3.38687e+01  0.00000e+00 0.00000e+00 6.42414e+02 120.377 1.22480e+02 120.377 0.9872 
1 1 1 -10 4   5  o 2  4.16982e+01 9.24462e-01 6.14295e+02 55.281  3.72830e+01  5.38058e+01  0.00000e+00 0.00000e+00 9.48114e+02 55.281  3.33819e+02 55.281  0.9923 
1 1 1 -10 4   6  o 15 2.67357e+01 7.60352e-01 5.42795e+02 289.724 1.39382e+01  -3.88772e+01 0.00000e+00 0.00000e+00 4.53686e+02 289.724 8.91093e+01 109.724 0.9878 
1 1 1 -10 4   7  o 3  2.46551e+01 7.70363e-01 5.06308e+02 197.080 -3.88055e+01 -1.19231e+01 0.00000e+00 0.00000e+00 4.11692e+02 197.080 9.46160e+01 17.080  0.9876 
1 1 1 -10 4   8  o 6  2.65973e+01 7.76328e-01 4.96774e+02 45.851  3.85632e+01  3.97257e+01  0.00000e+00 0.00000e+00 4.96015e+02 45.851  7.58495e-01 225.851 0.9909 
1 1 1 -10 4   9  o 9  1.02918e+01 1.02553e+00 1.57124e+02 195.508 -7.90659e+00 -2.19384e+00 0.00000e+00 0.00000e+00 2.05763e+02 195.508 4.86396e+01 195.508 0.9369 
1 1 1 -10 4   10 o 13 3.12403e+01 8.36940e-01 5.00701e+02 289.269 3.49703e+01  -1.00035e+02 0.00000e+00 0.00000e+00 6.68278e+02 289.269 1.67576e+02 289.269 0.9953 
1 1 1 -10 4   11 o 15 5.58219e+00 1.07143e+00 6.42286e+01 56.242  1.52009e+00  2.27429e+00  0.00000e+00 0.00000e+00 1.01054e+02 56.242  3.68249e+01 56.242  0.7884 
1 1 1 -10 4   12 o 11 7.87537e+00 9.58138e-01 2.17322e+02 82.827  2.07083e+00  1.64538e+01  0.00000e+00 0.00000e+00 6.90794e+01 82.827  1.48242e+02 262.827 0.9694 
1 1 1 -10 4   13 o 12 2.99671e+00 8.87881e-01 2.50396e+01 246.060 -3.65222e-01 -8.22636e-01 0.00000e+00 0.00000e+00 2.09852e+01 246.060 4.05440e+00 66.060  0.4099 
1 1 1 -10 4   14 o 5  3.77300e+00 9.96150e-01 9.57281e+01 101.311 -9.14610e-01 4.57276e+00  0.00000e+00 0.00000e+00 2.92339e+01 101.311 6.64942e+01 281.311 0.8849 
1 1 1 -10 4   15 o 4  1.20523e+01 7.09461e-01 2.15806e+02 264.758 -3.60037e+00 -3.92397e+01 0.00000e+00 0.00000e+00 2.28931e+02 264.758 1.31251e+01 264.758 0.9872 
1 1 1 -10 4   16 o 11 4.69879e+00 1.10632e+00 1.43595e+02 88.982  1.75653e-01  9.88429e+00  0.00000e+00 0.00000e+00 2.26769e+01 88.982  1.20918e+02 268.982 0.9480 
1 1 1 -10 4   17 o 4  3.07679e+00 9.79796e-01 7.36242e+01 260.214 -6.99976e-01 -4.05824e+00 0.00000e+00 0.00000e+00 2.59146e+01 260.214 4.77095e+01 80.214  0.8679 
1 1 1 -10 4   18 o 3  9.18024e+00 1.15377e+00 1.66870e+02 293.783 1.15680e+01  -2.62489e+01 0.00000e+00 0.00000e+00 1.68810e+02 293.783 1.93951e+00 293.783 0.9824 
1 1 1 -10 4   19 o 5  4.47848e+00 1.31289e+00 7.17429e+01 131.189 -3.80209e+00 4.34472e+00  0.00000e+00 0.00000e+00 7.94938e+01 131.189 7.75098e+00 131.189 0.9087 
1 1 1 -10 5   1  o 12 3.39282e+01 7.88041e-01 6.51053e+02 28.153  4.05247e+01  2.16863e+01  0.00000e+00 0.00000e+00 6.18990e+02 28.153  3.20628e+01 208.153 0.9891 
1 1 1 -10 5   2  o 5  1.80639e+01 6.53172e-01 3.01372e+02 277.810 1.54816e+00  -1.12866e+01 0.00000e+00 0.00000e+00 3.51242e+02 277.810 4.98693e+01 277.810 0.9550 
1 1 1 -10 5   3  o 4  1.44613e+01 7.11280e-01 3.00645e+02 135.252 -6.68475e+00 6.62614e+00  0.00000e+00 0.00000e+00 2.16186e+02 135.252 8.44592e+01 315.252 0.9453 
1 1 1 -10 5   4  o 11 1.65063e+01 8.09595e-01 3.01478e+02 243.672 -5.26647e+00 -1.06426e+01 0.00000e+00 0.00000e+00 2.95330e+02 243.672 6.14757e+00 63.672  0.9569 
1 1 1 -10 5   5  o 11 1.98957e+01 7.14244e-01 4.04787e+02 359.339 2.09214e+01  -2.41363e-01 0.00000e+00 0.00000e+00 3.28268e+02 359.339 7.65180e+01 179.339 0.9758 
1 1 1 -10 5   6  o 9  1.92340e+01 7.48760e-01 3.37836e+02 202.702 -1.70669e+01 -7.13989e+00 0.00000e+00 0.00000e+00 3.67980e+02 202.702 3.01444e+01 202.702 0.9726 
1 1 1 -10 5   7  o 6  3.43085e+01 8.46933e-01 5.73065e+02 241.401 -3.03617e+01 -5.56893e+01 0.00000e+00 0.00000e+00 7.10144e+02 241.401 1.37078e+02 241.401 0.9921 
1 1 1 -10 5   8  o 1  1.63815e+01 7.94491e-01 2.80407e+02 290.468 6.71241e+00  -1.79838e+01 0.00000e+00 0.00000e+00 3.20357e+02 290.468 3.99494e+01 290.468 0.9736 
1 1 1 -10 5   9  f 0  1.03893e+01 9.89256e-01 1.69489e+02 355.026 8.96010e+00  -7.79719e-01 0.00000e+00 0.00000e+00 1.99073e+02 355.026 2.95842e+01 355.026 0.9427 
1 1 1 -10 5   10 o 10 1.13559e+01 9.17594e-01 1.12980e+02 267.553 -3.64439e-01 -8.52750e+00 0.00000e+00 0.00000e+00 2.88108e+02 267.553 1.75128e+02 267.553 0.9395 
1 1 1 -10 5   11 o 16 5.50499e+00 1.16865e+00 8.66775e+01 131.771 -2.35103e+00 2.63220e+00  0.00000e+00 0.00000e+00 8.75347e+01 131.771 8.57126e-01 131.771 0.8426 
1 1 1 -10 5   12 o 18 1.65043e+01 7.21362e-01 3.51671e+02 59.033  3.11828e+01  5.19642e+01  0.00000e+00 0.00000e+00 2.62368e+02 59.033  8.93037e+01 239.033 0.9917 
1 1 1 -10 5   13 o 2  1.12867e+01 7.33522e-01 1.27323e+02 284.646 4.61732e+00  -1.76674e+01 0.00000e+00 0.00000e+00 2.83863e+02 284.646 1.56540e+02 284.646 0.9722 
1 1 1 -10 5   14 o 9  3.88895e+00 1.00997e+00 9.86805e+01 293.301 1.94665e+00  -4.51975e+00 0.00000e+00 0.00000e+00 3.10777e+01 293.301 6.76028e+01 113.301 0.8915 
1 1 1 -10 5   15 o 10 6.82740e+00 9.26219e-01 1.04003e+02 346.604 9.50828e+00  -2.26441e+00 0.00000e+00 0.00000e+00 1.37759e+02 346.604 3.37554e+01 346.604 0.9474 
1 1 1 -10 5   16 o 2  4.02992e+00 1.02579e+00 7.92548e+01 168.212 -4.80572e+00 1.00291e+00  0.00000e+00 0.00000e+00 5.48097e+01 168.212 2.44452e+01 348.212 0.8912 
1 1 1 -10 5   17 o 3  4.94663e+00 1.15482e+00 9.25370e+01 54.596  4.27853e+00  6.01968e+00  0.00000e+00 0.00000e+00 7.88655e+01 54.596  1.36715e+01 234.596 0.9296 
1 1 1 -10 5   18 o 14 8.70533e+00 1.13288e+00 1.02463e+02 206.803 -1.51576e+01 -7.65769e+00 0.00000e+00 0.00000e+00 2.11857e+02 206.803 1.09394e+02 206.803 0.9701 
1 1 1 -10 5   19 o 6  3.57901e+00 1.16309e+00 5.32316e+01 111.061 -1.40394e+00 3.64571e+00  0.00000e+00 0.00000e+00 6.11313e+01 111.061 7.89973e+00 111.061 0.8598 
1 1 1 -10 6   1  o 13 3.06287e+01 7.47753e-01 6.59630e+02 266.356 -2.68050e+00 -4.20942e+01 0.00000e+00 0.00000e+00 4.85740e+02 266.356 1.73890e+02 86.356  0.9881 
1 1 1 -10 6   2  o 6  2.76087e+01 7.20463e-01 4.30454e+02 40.606  1.87998e+01  1.61168e+01  0.00000e+00 0.00000e+00 5.92618e+02 40.606  1.62165e+02 40.606  0.9796 
1 1 1 -10 6   3  o 5  4.60517e+01 9.81222e-01 8.85723e+02 247.854 -3.34898e+01 -8.22872e+01 0.00000e+00 0.00000e+00 8.45522e+02 247.854 4.02008e+01 67.854  0.9944 
1 1 1 -10 6   4  o 11 3.46952e+01 8.20381e-01 5.40963e+02 64.658  1.91446e+01  4.04239e+01  0.00000e+00 0.00000e+00 7.55209e+02 64.658  2.14245e+02 64.658  0.9888 
1 1 1 -10 6   5  o 16 2.30963e+01 7.14769e-01 4.03180e+02 4.880   2.40948e+01  2.05731e+00  0.00000e+00 0.00000e+00 4.50664e+02 4.880   4.74839e+01 4.880   0.9791 
1 1 1 -10 6   6  o 3  3.35904e+01 8.15983e-01 5.13242e+02 268.996 -8.54642e-01 -4.87688e+01 0.00000e+00 0.00000e+00 7.41068e+02 268.996 2.27826e+02 268.996 0.9897 
1 1 1 -10 6   7  o 7  1.35070e+01 8.79409e-01 2.42333e+02 178.955 -1.05161e+01 1.91792e-01  0.00000e+00 0.00000e+00 2.42032e+02 178.955 3.00753e-01 358.955 0.9512 
1 1 1 -10 6   8  o 1  8.51214e+00 1.18346e+00 8.69526e+01 205.215 -2.71785e+00 -1.27980e+00 0.00000e+00 0.00000e+00 1.72850e+02 205.215 8.58977e+01 205.215 0.8103 
1 1 1 -10 6   9  o 6  2.14927e+01 7.54132e-01 3.65864e+02 39.893  3.20618e+01  2.68014e+01  0.00000e+00 0.00000e+00 4.33229e+02 39.893  6.73656e+01 39.893  0.9880 
1 1 1 -10 6   10 o 10 1.17380e+01 8.96921e-01 1.77850e+02 260.891 -2.20811e+00 -1.37720e+01 0.00000e+00 0.00000e+00 2.47321e+02 260.891 6.94716e+01 260.891 0.9635 
1 1 1 -10 6   11 f 0  8.75552e+00 9.47662e-01 1.84643e+02 111.256 -4.63411e+00 1.19132e+01  0.00000e+00 0.00000e+00 1.31047e+02 111.256 5.35953e+01 291.255 0.9601 
1 1 1 -10 6   12 o 12 1.67536e+01 7.04513e-01 2.53969e+02 266.162 -2.98637e+00 -4.45199e+01 0.00000e+00 0.00000e+00 3.67458e+02 266.162 1.13489e+02 266.162 0.9887 
1 1 1 -10 6   13 o 15 2.17880e+01 6.97485e-01 3.69841e+02 339.492 9.70697e+01  -3.63092e+01 0.00000e+00 0.00000e+00 4.42633e+02 339.492 7.27917e+01 339.492 0.9952 
1 1 1 -10 6   14 o 19 6.51173e+00 9.32758e-01 1.59649e+02 103.243 -3.16723e+00 1.34584e+01  0.00000e+00 0.00000e+00 7.50682e+01 103.243 8.45807e+01 283.243 0.9631 
1 1 1 -10 6   15 o 5  6.28028e+00 9.98180e-01 1.22050e+02 162.790 -9.72955e+00 3.01375e+00  0.00000e+00 0.00000e+00 1.00849e+02 162.790 2.12010e+01 342.789 0.9496 
1 1 1 -10 6   16 o 15 3.70156e+00 1.00264e+00 4.24015e+01 5.466   2.43373e+00  2.32893e-01  0.00000e+00 0.00000e+00 6.24477e+01 5.466   2.00463e+01 5.466   0.7589 
1 1 1 -10 6   17 o 18 3.22576e+00 1.01688e+00 7.64287e+01 251.708 -1.37171e+00 -4.14956e+00 0.00000e+00 0.00000e+00 2.89461e+01 251.708 4.74826e+01 71.708  0.8764 
1 1 1 -10 6   18 o 8  4.31343e+00 1.03338e+00 3.03449e+01 130.780 -1.76191e+00 2.04260e+00  0.00000e+00 0.00000e+00 9.56606e+01 130.780 6.53156e+01 130.780 0.7849 
1 1 1 -10 6   19 o 13 3.35173e+00 1.10802e+00 7.03935e+01 46.766  3.47923e+00  3.70057e+00  0.00000e+00 0.00000e+00 4.11087e+01 46.766  2.92849e+01 226.766 0.8952 
1 1 1 -10 7   1  o 19 1.41697e+01 6.84057e-01 2.25046e+02 41.798  4.97698e+00  4.44968e+00  0.00000e+00 0.00000e+00 2.69246e+02 41.798  4.41999e+01 41.798  0.9217 
1 1 1 -10 7   2  o 11 7.82317e+00 9.33683e-01 2.70816e+02 40.806  3.29310e+00  2.84315e+00  0.00000e+00 0.00000e+00 1.16504e+01 220.806 2.82467e+02 220.806 0.8758 
1 1 1 -10 7   3  o 9  3.55415e+01 8.20788e-01 7.26467e+02 85.480  4.48191e+00  5.66970e+01  0.00000e+00 0.00000e+00 6.05359e+02 85.480  1.21108e+02 265.480 0.9912 
1 1 1 -10 7   4  o 5  3.85727e+00 1.13134e+00 5.29739e+01 68.554  1.73211e-01  4.40930e-01  0.00000e+00 0.00000e+00 1.93868e+01 248.554 7.23607e+01 248.554 0.2305 
1 1 1 -10 7   5  o 14 2.01581e+01 7.08277e-01 4.31593e+02 14.157  2.30723e+01  5.81988e+00  0.00000e+00 0.00000e+00 3.13354e+02 14.157  1.18239e+02 194.157 0.9788 
1 1 1 -10 7   6  o 18 3.15909e+01 8.01891e-01 6.08257e+02 132.161 -3.65073e+01 4.03168e+01  0.00000e+00 0.00000e+00 5.72638e+02 132.161 3.56189e+01 312.161 0.9908 
1 1 1 -10 7   7  o 18 1.98179e+01 7.61883e-01 2.75465e+02 312.664 1.30130e+01  -1.41199e+01 0.00000e+00 0.00000e+00 4.51932e+02 312.664 1.76467e+02 312.664 0.9736 
1 1 1 -10 7   8  o 13 1.32163e+01 8.70477e-01 2.80430e+02 20.360  1.48233e+01  5.50090e+00  0.00000e+00 0.00000e+00 2.01378e+02 20.360  7.90521e+01 200.360 0.9678 
1 1 1 -10 7   9  o 10 1.72990e+01 7.84742e-01 1.81004e+02 232.966 -1.09685e+01 -1.45378e+01 0.00000e+00 0.00000e+00 4.51861e+02 232.966 2.70857e+02 232.966 0.9721 
1 1 1 -10 7   10 o 3  1.39727e+01 8.46593e-01 2.55401e+02 94.412  -1.85386e+00 2.40259e+01  0.00000e+00 0.00000e+00 2.58886e+02 94.412  3.48500e+00 94.412  0.9790 
1 1 1 -10 7   11 o 4  1.39178e+01 7.64649e-01 2.81220e+02 344.658 3.17488e+01  -8.71061e+00 0.00000e+00 0.00000e+00 2.33474e+02 344.658 4.77468e+01 164.658 0.9847 
1 1 1 -10 7   12 o 3  9.29381e+00 8.45722e-01 1.74247e+02 80.547  2.63346e+00  1.58173e+01  0.00000e+00 0.00000e+00 1.63351e+02 80.547  1.08956e+01 260.547 0.9683 
1 1 1 -10 7   13 o 5  1.34628e+01 6.69781e-01 2.07671e+02 180.635 -3.62751e+01 -4.02283e-01 0.00000e+00 0.00000e+00 2.89784e+02 180.635 8.21132e+01 180.635 0.9861 
1 1 1 -10 7   14 o 10 7.96431e+00 8.55322e-01 1.75711e+02 341.977 1.83255e+01  -5.96243e+00 0.00000e+00 0.00000e+00 1.14511e+02 341.977 6.11998e+01 161.977 0.9737 
1 1 1 -10 7   15 o 8  2.70341e+00 8.62743e-01 6.98834e+01 315.746 1.91760e+00  -1.86830e+00 0.00000e+00 0.00000e+00 9.23144e+00 315.746 6.06519e+01 135.746 0.7830 
1 1 1 -10 7   16 o 19 8.82113e+00 8.59972e-01 1.52178e+02 156.169 -2.12034e+01 9.36555e+00  0.00000e+00 0.00000e+00 1.69897e+02 156.169 1.77193e+01 156.169 0.9782 
1 1 1 -10 7   17 o 10 1.01329e+01 8.77352e-01 1.93708e+02 305.172 2.19535e+01  -3.11533e+01 0.00000e+00 0.00000e+00 1.78991e+02 305.172 1.47176e+01 125.172 0.9868 
1 1 1 -10 7   18 o 13 6.79692e+00 1.17116e+00 9.27914e+01 157.189 -1.07289e+01 4.51243e+00  0.00000e+00 0.00000e+00 1.49055e+02 157.189 5.62640e+01 157.189 0.9560 
1 1 1 -10 7   19 o 11 3.15512e+00 1.06569e+00 6.14471e+01 61.039  2.09773e+00  3.79042e+00  0.00000e+00 0.00000e+00 4.11669e+01 61.039  2.02802e+01 241.039 0.8752 
1 1 1 -10 8   1  o 8  4.71079e+01 9.96287e-01 7.44064e+02 11.627  7.03494e+01  1.44758e+01  0.00000e+00 0.00000e+00 1.02629e+03 11.627  2.82225e+02 11.627  0.9930 
1 1 1 -10 8   2  o 5  2.87804e+01 7.29398e-01 4.96262e+02 213.627 -2.58483e+01 -1.71911e+01 0.00000e+00 0.00000e+00 5.74719e+02 213.627 7.84568e+01 213.627 0.9838 
1 1 1 -10 8   3  o 10 3.00327e+01 7.61475e-01 4.82773e+02 297.597 1.48408e+01  -2.83914e+01 0.00000e+00 0.00000e+00 6.34763e+02 297.597 1.51990e+02 297.597 0.9843 
1 1 1 -10 8   4  o 17 2.44698e+01 8.14810e-01 2.55258e+02 140.180 -1.14231e+01 9.52412e+00  0.00000e+00 0.00000e+00 6.37620e+02 140.180 3.82362e+02 140.180 0.9658 
1 1 1 -10 8   5  o 5  1.72461e+01 7.49607e-01 3.22012e+02 247.778 -5.72285e+00 -1.40084e+01 0.00000e+00 0.00000e+00 3.07245e+02 247.778 1.47671e+01 67.778  0.9664 
1 1 1 -10 8   6  o 16 8.07118e+00 1.13458e+00 9.55078e+01 231.533 -1.31105e+00 -1.65017e+00 0.00000e+00 0.00000e+00 1.22121e+02 231.533 2.66132e+01 231.533 0.7147 
1 1 1 -10 8   7  o 2  4.10019e+01 9.34490e-01 7.26233e+02 75.174  2.62678e+01  9.92381e+01  0.00000e+00 0.00000e+00 8.11928e+02 75.174  8.56946e+01 75.174  0.9951 
1 1 1 -10 8   8  o 14 2.75143e+01 7.80215e-01 4.14068e+02 86.909  2.65102e+00  4.90863e+01  0.00000e+00 0.00000e+00 6.11689e+02 86.909  1.97621e+02 86.909  0.9898 
1 1 1 -10 8   9  o 10 1.18899e+01 9.13286e-01 2.23719e+02 161.163 -1.42912e+01 4.87544e+00  0.00000e+00 0.00000e+00 2.08635e+02 161.163 1.50847e+01 341.163 0.9663 
1 1 1 -10 8   10 o 18 7.09029e+00 1.18820e+00 1.27658e+02 167.374 -5.47781e+00 1.22703e+00  0.00000e+00 0.00000e+00 1.13815e+02 167.374 1.38432e+01 347.374 0.9059 
1 1 1 -10 8   11 o 1  1.31209e+01 7.66433e-01 2.39307e+02 335.224 2.39562e+01  -1.10571e+01 0.00000e+00 0.00000e+00 2.44018e+02 335.224 4.71059e+00 335.224 0.9809 
1 1 1 -10 8   12 o 5  1.49948e+01 7.21609e-01 3.51276e+02 175.641 -5.39279e+01 4.11021e+00  0.00000e+00 0.00000e+00 2.06006e+02 175.641 1.45270e+02 355.641 0.9907 
1 1 1 -10 8   13 o 15 7.85211e+00 8.57404e-01 1.56281e+02 290.421 5.18778e+00  -1.39336e+01 0.00000e+00 0.00000e+00 1.27863e+02 290.421 2.84182e+01 110.421 0.9658 
1 1 1 -10 8   14 o 13 7.48578e+00 8.66907e-01 1.14533e+02 125.046 -6.74322e+00 9.61392e+00  0.00000e+00 0.00000e+00 1.53406e+02 125.046 3.88720e+01 125.046 0.9564 
1 1 1 -10 8   15 o 8  1.18699e+01 7.14745e-01 2.43127e+02 107.404 -1.47435e+01 4.70364e+01  0.00000e+00 0.00000e+00 1.95994e+02 107.404 4.71333e+01 287.404 0.9898 
1 1 1 -10 8   16 o 7  6.39282e+00 1.00187e+00 9.55144e+01 234.080 -5.69838e+00 -7.86618e+00 0.00000e+00 0.00000e+00 1.30460e+02 234.080 3.49458e+01 234.080 0.9470 
1 1 1 -10 8   17 o 16 6.98769e+00 1.11077e+00 7.48688e+01 199.527 -8.15148e+00 -2.89087e+00 0.00000e+00 0.00000e+00 1.70025e+02 199.527 9.51564e+01 199.527 0.9403 
1 1 1 -10 8   18 o 9  3.64861e+00 1.16671e+00 4.14397e+01 177.748 -2.79740e+00 1.09985e-01  0.00000e+00 0.00000e+00 6.63799e+01 177.748 2.49402e+01 177.748 0.7940 
1 1 1 -10 8   19 o 1  4.27703e+00 1.28888e+00 1.61688e+01 316.059 9.28196e-01  -8.94492e-01 0.00000e+00 0.00000e+00 6.95780e+01 316.059 5.34093e+01 316.059 0.5395 
1 1 1 -10 9   1  o 10 1.60877e+01 6.55886e-01 3.13133e+02 205.687 -9.49993e+00 -4.56937e+00 0.00000e+00 0.00000e+00 2.66057e+02 205.687 4.70758e+01 25.687  0.9513 
1 1 1 -10 9   2  o 1  5.05186e+01 1.05528e+00 7.86699e+02 18.457  7.99407e+01  2.66815e+01  0.00000e+00 0.00000e+00 1.11283e+03 18.457  3.26128e+02 18.457  0.9940 
1 1 1 -10 9   3  o 14 2.89579e+01 7.45298e-01 4.81735e+02 220.088 -2.35839e+01 -1.98513e+01 0.00000e+00 0.00000e+00 5.95101e+02 220.088 1.13365e+02 220.088 0.9836 
1 1 1 -10 9   4  o 19 1.93776e+01 6.91006e-01 2.43343e+02 297.083 5.15124e+00  -1.00736e+01 0.00000e+00 0.00000e+00 4.55625e+02 297.083 2.12282e+02 297.083 0.9547 
1 1 1 -10 9   5  f 0  3.84932e+01 8.76633e-01 6.48777e+02 199.355 -6.34831e+01 -2.23002e+01 0.00000e+00 0.00000e+00 7.93720e+02 199.355 1.44943e+02 199.355 0.9925 
1 1 1 -10 9   6  o 15 3.31447e+01 8.10084e-01 5.81138e+02 18.761  5.79273e+01  1.96756e+01  0.00000e+00 0.00000e+00 6.59076e+02 18.761  7.79385e+01 18.761  0.9918 
1 1 1 -10 9   7  o 4  2.05712e+01 7.56399e-01 4.21986e+02 193.672 -2.96305e+01 -7.20765e+00 0.00000e+00 0.00000e+00 3.40675e+02 193.672 8.13108e+01 13.672  0.9835 
1 1 1 -10 9   8  o 15 1.00359e+01 1.04408e+00 1.06139e+02 80.708  7.13691e-01  4.36186e+00  0.00000e+00 0.00000e+00 2.25720e+02 80.708  1.19581e+02 80.708  0.8779 
1 1 1 -10 9   9  o 19 5.87175e+00 1.30997e+00 9.98531e+01 307.828 1.86419e+00  -2.40089e+00 0.00000e+00 0.00000e+00 7.97568e+01 307.828 2.00964e+01 127.828 0.8129 
1 1 1 -10 9   10 o 15 8.68540e+00 1.10964e+00 2.52774e+02 349.569 1.43739e+01  -2.64613e+00 0.00000e+00 0.00000e+00 6.23636e+01 349.569 1.90410e+02 169.569 0.9652 
1 1 1 -10 9   11 o 15 6.57488e+00 1.09090e+00 9.07506e+01 224.851 -3.24399e+00 -3.22719e+00 0.00000e+00 0.00000e+00 1.27155e+02 224.851 3.64048e+01 224.851 0.8825 
1 1 1 -10 9   12 f 0  8.65544e+00 8.65337e-01 1.07243e+02 79.183  1.71257e+00  8.96302e+00  0.00000e+00 0.00000e+00 1.99101e+02 79.183  9.18581e+01 79.183  0.9435 
1 1 1 -10 9   13 o 16 4.70357e+00 1.03661e+00 1.48412e+02 214.800 -6.44645e+00 -4.48045e+00 0.00000e+00 0.00000e+00 1.61845e+01 214.800 1.32228e+02 34.800  0.9340 
1 1 1 -10 9   14 o 19 3.56697e+00 9.76869e-01 8.22568e+01 109.679 -1.28604e+00 3.59595e+00  0.00000e+00 0.00000e+00 3.20322e+01 109.679 5.02246e+01 289.679 0.8562 
1 1 1 -10 9   15 o 12 3.28546e+00 9.72934e-01 9.67600e+01 248.098 -1.77754e+00 -4.42142e+00 0.00000e+00 0.00000e+00 1.22362e+01 248.098 8.45239e+01 68.098  0.8876 
1 1 1 -10 9   16 o 2  1.08024e+01 7.41235e-01 1.39831e+02 30.966  2.38059e+01  1.42847e+01  0.00000e+00 0.00000e+00 2.56033e+02 30.966  1.16203e+02 30.966  0.9818 
1 1 1 -10 9   17 o 3  3.86155e+00 1.08419e+00 4.39717e+01 244.758 -1.21853e+00 -2.58461e+00 0.00000e+00 0.00000e+00 7.10065e+01 244.758 2.70348e+01 244.758 0.7989 
1 1 1 -10 9   18 o 12 3.94821e+00 1.16454e+00 2.82980e+01 81.819  2.94811e-01  2.05064e+00  0.00000e+00 0.00000e+00 7.59128e+01 81.819  4.76148e+01 81.819  0.7092 
1 1 1 -10 10  1  o 12 3.01067e+01 7.40273e-01 6.12234e+02 258.920 -7.36982e+00 -3.76341e+01 0.00000e+00 0.00000e+00 5.12150e+02 258.920 1.00084e+02 78.920  0.9869 
1 1 1 -10 10  2  o 14 2.96406e+01 7.46255e-01 5.09939e+02 74.345  8.83607e+00  3.15303e+01  0.00000e+00 0.00000e+00 5.93952e+02 74.345  8.40133e+01 74.345  0.9846 
1 1 1 -10 10  3  o 11 2.62640e+01 7.12322e-01 4.94366e+02 159.551 -2.69105e+01 1.00339e+01  0.00000e+00 0.00000e+00 4.81066e+02 159.551 1.32994e+01 339.551 0.9824 
1 1 1 -10 10  4  o 14 1.18182e+01 7.89313e-01 2.80398e+02 180.548 -7.89219e+00 -7.55204e-02 0.00000e+00 0.00000e+00 1.36771e+02 180.548 1.43627e+02 0.548   0.9343 
1 1 1 -10 10  5  o 4  1.64774e+01 9.27189e-01 2.18465e+02 124.427 -5.45368e+00 7.95692e+00  0.00000e+00 0.00000e+00 3.70447e+02 124.427 1.51981e+02 124.427 0.9467 
1 1 1 -10 10  6  o 11 3.80737e+01 8.73645e-01 6.83238e+02 117.795 -3.82419e+01 7.25478e+01  0.00000e+00 0.00000e+00 7.44376e+02 117.795 6.11383e+01 117.795 0.9939 
1 1 1 -10 10  7  o 13 6.57865e+00 1.30305e+00 1.55354e+02 196.860 -3.19435e+00 -9.68089e-01 0.00000e+00 0.00000e+00 5.10160e+01 196.860 1.04338e+02 16.860  0.8322 
1 1 1 -10 10  8  o 19 6.36493e+00 1.34367e+00 9.74802e+01 346.970 2.37357e+00  -5.49280e-01 0.00000e+00 0.00000e+00 8.42077e+01 346.970 1.32725e+01 166.970 0.7579 
1 1 1 -10 10  9  o 19 1.08340e+01 9.47657e-01 1.86052e+02 255.254 -2.88814e+00 -1.09729e+01 0.00000e+00 0.00000e+00 2.03224e+02 255.254 1.71725e+01 255.254 0.9549 
1 1 1 -10 10  10 o 7  7.62961e+00 1.13620e+00 1.68858e+02 17.423  8.11635e+00  2.54715e+00  0.00000e+00 0.00000e+00 1.00531e+02 17.423  6.83275e+01 197.423 0.9392 
1 1 1 -10 10  11 o 17 5.52242e+00 1.12445e+00 1.17901e+02 194.760 -4.77421e+00 -1.25783e+00 0.00000e+00 0.00000e+00 6.70666e+01 194.760 5.08339e+01 14.760  0.8919 
1 1 1 -10 10  12 o 4  7.15706e+00 1.00647e+00 1.51500e+02 181.258 -1.01560e+01 -2.23098e-01 0.00000e+00 0.00000e+00 1.03396e+02 181.258 4.81041e+01 1.258   0.9494 
1 1 1 -10 10  13 o 16 1.02472e+01 7.51286e-01 1.45172e+02 77.123  4.17568e+00  1.82663e+01  0.00000e+00 0.00000e+00 2.28378e+02 77.123  8.32063e+01 77.123  0.9729 
1 1 1 -10 10  14 o 15 1.03217e+01 7.34798e-01 1.16875e+02 173.136 -1.69406e+01 2.03914e+00  0.00000e+00 0.00000e+00 2.57888e+02 173.136 1.41013e+02 173.136 0.9702 
1 1 1 -10 10  15 o 2  1.38054e+01 6.75723e-01 3.09517e+02 19.719  6.98588e+01  2.50399e+01  0.00000e+00 0.00000e+00 2.02955e+02 19.719  1.06562e+02 199.719 0.9932 
1 1 1 -10 10  16 o 4  2.74002e+00 8.62515e-01 8.05853e+01 145.900 -3.14895e+00 2.13201e+00  0.00000e+00 0.00000e+00 6.90254e+00 145.900 7.36828e+01 325.900 0.8555 
1 1 1 -10 10  17 o 18 4.59552e+00 1.16320e+00 6.32774e+01 277.231 5.83212e-01  -4.59680e+00 0.00000e+00 0.00000e+00 8.81550e+01 277.231 2.48776e+01 277.231 0.8841 
1 1 1 -10 10  18 o 8  4.14126e+00 1.23712e+00 6.71024e+01 135.063 -3.51188e+00 3.50417e+00  0.00000e+00 0.00000e+00 7.04459e+01 135.063 3.34356e+00 135.063 0.8925 
1 1 1 -10 11  1  o 18 1.03279e+01 7.52685e-01 2.64234e+02 272.417 2.49816e-01  -5.91798e+00 0.00000e+00 0.00000e+00 9.18717e+01 272.417 1.72363e+02 92.417  0.9111 
1 1 1 -10 11  2  o 3  2.60523e+01 7.03194e-01 4.45006e+02 57.374  1.35588e+01  2.11800e+01  0.00000e+00 0.00000e+00 5.20591e+02 57.374  7.55846e+01 57.374  0.9799 
1 1 1 -10 11  3  o 5  1.70292e+01 6.88260e-01 3.07354e+02 342.342 1.22110e+01  -3.88713e+00 0.00000e+00 0.00000e+00 3.10741e+02 342.342 3.38721e+00 342.342 0.9602 
1 1 1 -10 11  4  o 18 2.42985e+01 7.08261e-01 4.96368e+02 152.772 -2.86333e+01 1.47334e+01  0.00000e+00 0.00000e+00 4.07243e+02 152.772 8.91251e+01 332.772 0.9843 
1 1 1 -10 11  5  o 7  2.77063e+01 7.55007e-01 4.18982e+02 338.503 2.93494e+01  -1.15592e+01 0.00000e+00 0.00000e+00 6.10314e+02 338.503 1.91331e+02 338.503 0.9840 
1 1 1 -10 11  6  o 15 3.46448e+01 8.27594e-01 6.26342e+02 254.213 -1.86770e+01 -6.60612e+01 0.00000e+00 0.00000e+00 6.71105e+02 254.213 4.47631e+01 254.213 0.9927 
1 1 1 -10 11  7  o 11 5.14494e+00 1.32231e+00 2.29654e+02 58.223  2.02361e+00  3.26663e+00  0.00000e+00 0.00000e+00 6.34099e+01 238.223 2.93064e+02 238.223 0.8572 
1 1 1 -10 11  8  o 6  1.65405e+01 7.95476e-01 2.68390e+02 92.780  -9.69487e-01 1.99641e+01  0.00000e+00 0.00000e+00 3.38786e+02 92.780  7.03958e+01 92.780  0.9747 
1 1 1 -10 11  9  o 12 1.44942e+01 8.56801e-01 4.20484e+02 246.214 -1.40682e+01 -3.19175e+01 0.00000e+00 0.00000e+00 1.17031e+02 246.214 3.03454e+02 66.214  0.9856 
1 1 1 -10 11  10 o 5  2.25643e+01 7.80365e-01 4.31785e+02 79.962  1.22382e+01  6.91414e+01  0.00000e+00 0.00000e+00 4.10375e+02 79.962  2.14097e+01 259.962 0.9929 
1 1 1 -10 11  11 o 1  9.53986e+00 9.29751e-01 1.88594e+02 28.008  1.27624e+01  6.78816e+00  0.00000e+00 0.00000e+00 1.57025e+02 28.008  3.15690e+01 208.008 0.9648 
1 1 1 -10 11  12 o 15 1.02012e+01 8.47859e-01 1.83276e+02 249.661 -6.41585e+00 -1.73077e+01 0.00000e+00 0.00000e+00 1.88863e+02 249.661 5.58732e+00 249.661 0.9725 
1 1 1 -10 11  13 o 9  7.88237e+00 8.62670e-01 1.55964e+02 160.798 -1.40228e+01 4.88388e+00  0.00000e+00 0.00000e+00 1.29239e+02 160.798 2.67242e+01 340.798 0.9657 
1 1 1 -10 11  14 o 7  8.88130e+00 8.26501e-01 2.16279e+02 334.794 2.36747e+01  -1.11433e+01 0.00000e+00 0.00000e+00 1.09653e+02 334.794 1.06626e+02 154.794 0.9807 
1 1 1 -10 11  15 o 11 4.05748e+00 1.01502e+00 5.86453e+01 124.086 -1.95175e+00 2.88424e+00  0.00000e+00 0.00000e+00 6.87596e+01 124.086 1.01143e+01 124.086 0.8402 
1 1 1 -10 11  16 o 2  6.45565e+00 9.94400e-01 1.19143e+02 238.162 -6.47490e+00 -1.04276e+01 0.00000e+00 0.00000e+00 1.11763e+02 238.162 7.38009e+00 58.162  0.9584 
1 1 1 -10 11  17 o 10 7.01502e+00 1.05877e+00 1.52288e+02 295.403 7.83922e+00  -1.65073e+01 0.00000e+00 0.00000e+00 1.01901e+02 295.403 5.03867e+01 115.403 0.9722 
1 1 1 -10 11  18 f 0  4.08949e+00 1.21989e+00 7.26083e+01 117.027 -2.44234e+00 4.78777e+00  0.00000e+00 0.00000e+00 6.45758e+01 117.027 8.03256e+00 297.027 0.9014 
1 1 1 -10 12  1  o 16 2.55372e+01 7.02566e-01 4.42392e+02 101.297 -4.81107e+00 2.40836e+01  0.00000e+00 0.00000e+00 5.04078e+02 101.297 6.16852e+01 101.297 0.9794 
1 1 1 -10 12  2  o 1  2.04761e+01 6.73656e-01 4.67127e+02 77.708  4.41849e+00  2.02781e+01  0.00000e+00 0.00000e+00 2.88432e+02 77.708  1.78695e+02 257.708 0.9756 
1 1 1 -10 12  3  o 10 1.71095e+01 6.89739e-01 3.11110e+02 344.274 1.25256e+01  -3.52697e+00 0.00000e+00 0.00000e+00 3.10282e+02 344.274 8.27906e-01 164.274 0.9608 
1 1 1 -10 12  4  o 7  2.55388e+01 7.12748e-01 4.55583e+02 354.717 3.08876e+01  -2.85587e+00 0.00000e+00 0.00000e+00 4.93539e+02 354.717 3.79565e+01 354.717 0.9837 
1 1 1 -10 12  5  o 2  2.00107e+01 7.10489e-01 3.11243e+02 23.812  1.59137e+01  7.02282e+00  0.00000e+00 0.00000e+00 4.22161e+02 23.812  1.10918e+02 23.812  0.9708 
1 1 1 -10 12  6  f 0  4.28755e+01 9.46243e-01 7.04499e+02 164.179 -9.06885e+01 2.56976e+01  0.00000e+00 0.00000e+00 9.04354e+02 164.179 1.99855e+02 164.179 0.9947 
1 1 1 -10 12  7  f 0  3.20198e+01 9.70635e-01 5.82231e+02 69.070  2.22180e+01  5.80910e+01  0.00000e+00 0.00000e+00 6.14992e+02 69.070  3.27613e+01 69.070  0.9919 
1 1 1 -10 12  8  o 1  2.35347e+01 7.59259e-01 4.55450e+02 212.664 -4.07720e+01 -2.61391e+01 0.00000e+00 0.00000e+00 4.21714e+02 212.664 3.37361e+01 32.664  0.9896 
1 1 1 -10 12  9  o 18 9.26540e+00 1.10842e+00 1.04585e+02 150.977 -4.44262e+00 2.46491e+00  0.00000e+00 0.00000e+00 2.07515e+02 150.977 1.02930e+02 150.977 0.8952 
1 1 1 -10 12  10 o 14 9.49897e+00 1.05402e+00 1.33220e+02 338.447 7.93480e+00  -3.13415e+00 0.00000e+00 0.00000e+00 2.02218e+02 338.447 6.89982e+01 338.447 0.9394 
1 1 1 -10 12  11 o 14 1.90642e+01 7.04215e-01 2.56574e+02 51.136  2.74886e+01  3.41110e+01  0.00000e+00 0.00000e+00 4.51086e+02 51.136  1.94512e+02 51.136  0.9885 
1 1 1 -10 12  12 o 14 6.71752e+00 1.09712e+00 6.40205e+01 44.846  2.87608e+00  2.86066e+00  0.00000e+00 0.00000e+00 1.54100e+02 44.846  9.00796e+01 44.846  0.8657 
1 1 1 -10 12  13 o 6  5.21453e+00 1.08107e+00 1.69554e+02 321.138 7.22116e+00  -5.81889e+00 0.00000e+00 0.00000e+00 1.49571e+01 321.138 1.54597e+02 141.138 0.9444 
1 1 1 -10 12  14 o 11 6.90889e+00 9.46155e-01 1.17103e+02 113.564 -4.17817e+00 9.57986e+00  0.00000e+00 0.00000e+00 1.28728e+02 113.564 1.16244e+01 113.564 0.9509 
1 1 1 -10 12  15 f 0  4.70585e+00 9.31986e-01 3.33749e+01 47.347  1.51571e+00  1.64525e+00  0.00000e+00 0.00000e+00 9.55510e+01 47.347  6.21761e+01 47.347  0.7331 
1 1 1 -10 12  16 o 14 4.51404e+00 1.07192e+00 6.26007e+01 316.959 2.95315e+00  -2.75778e+00 0.00000e+00 0.00000e+00 8.31358e+01 316.959 2.05351e+01 316.959 0.8651 
1 1 1 -10 12  17 o 19 4.97777e+00 1.10131e+00 1.00437e+02 187.879 -8.39450e+00 -1.16174e+00 0.00000e+00 0.00000e+00 7.37604e+01 187.879 2.66769e+01 7.879   0.9390 
1 1 1 -10 12  18 o 19 5.97537e+00 1.25200e+00 1.36743e+02 31.078  1.23326e+01  7.43300e+00  0.00000e+00 0.00000e+00 7.77562e+01 31.078  5.89864e+01 211.078 0.9646 
1 1 1 -10 13  1  o 7  2.72581e+01 7.17120e-01 7.17824e+02 276.978 5.15546e+00  -4.21201e+01 0.00000e+00 0.00000e+00 3.01390e+02 276.978 4.16434e+02 96.978  0.9881 
1 1 1 -10 13  2  o 17 8.96964e+00 8.64364e-01 1.70284e+02 228.905 -2.20490e+00 -2.52800e+00 0.00000e+00 0.00000e+00 1.12345e+02 228.905 5.79390e+01 48.905  0.8331 
1 1 1 -10 13  3  o 18 1.91395e+01 1.02339e+00 2.99396e+02 144.783 -1.11335e+01 7.85869e+00  0.00000e+00 0.00000e+00 3.97006e+02 144.783 9.76105e+01 144.783 0.9626 
1 1 1 -10 13  4  o 14 4.20476e+01 9.21299e-01 6.83199e+02 122.891 -4.08395e+01 6.31504e+01  0.00000e+00 0.00000e+00 8.94625e+02 122.891 2.11426e+02 122.891 0.9933 
1 1 1 -10 13  5  o 18 2.10990e+01 1.05910e+00 3.43475e+02 256.629 -4.52791e+00 -1.90486e+01 0.00000e+00 0.00000e+00 4.32422e+02 256.629 8.89468e+01 256.629 0.9741 
1 1 1 -10 13  6  o 17 1.17316e+01 8.51579e-01 2.79089e+02 206.205 -8.96774e+00 -4.41364e+00 0.00000e+00 0.00000e+00 1.40704e+02 206.205 1.38386e+02 26.205  0.9486 
1 1 1 -10 13  7  o 4  1.88694e+01 7.72802e-01 1.84015e+02 260.546 -1.94283e+00 -1.16669e+01 0.00000e+00 0.00000e+00 4.96466e+02 260.546 3.12451e+02 260.546 0.9567 
1 1 1 -10 13  8  f 0  7.18133e+00 1.24412e+00 2.07846e+01 122.575 -3.34967e-01 5.24272e-01  0.00000e+00 0.00000e+00 5.95216e+01 122.575 3.87370e+01 122.575 0.2969 
1 1 1 -10 13  9  o 10 1.66057e+01 8.16248e-01 2.90880e+02 112.850 -1.03981e+01 2.46759e+01  0.00000e+00 0.00000e+00 3.22143e+02 112.850 3.12624e+01 112.850 0.9811 
1 1 1 -10 13  10 o 15 9.01263e+00 1.06389e+00 2.23514e+02 260.335 -2.28829e+00 -1.34360e+01 0.00000e+00 0.00000e+00 1.02586e+02 260.335 1.20928e+02 80.335  0.9626 
1 1 1 -10 13  11 o 18 1.63253e+01 7.25583e-01 2.97009e+02 147.119 -3.62443e+01 2.34308e+01  0.00000e+00 0.00000e+00 3.08856e+02 147.119 1.18471e+01 147.119 0.9883 
1 1 1 -10 13  12 o 12 8.93756e+00 9.19267e-01 2.33207e+02 12.797  2.04572e+01  4.64676e+00  0.00000e+00 0.00000e+00 9.39341e+01 12.797  1.39273e+02 192.797 0.9759 
1 1 1 -10 13  13 o 8  7.80406e+00 9.62834e-01 9.28091e+01 127.997 -4.90736e+00 6.28171e+00  0.00000e+00 0.00000e+00 1.80559e+02 127.997 8.77495e+01 127.997 0.9350 
1 1 1 -10 13  14 o 13 3.10462e+00 8.85908e-01 6.97855e+01 82.081  3.90072e-01  2.80444e+00  0.00000e+00 0.00000e+00 2.27680e+01 82.081  4.70174e+01 262.081 0.7967 
1 1 1 -10 13  15 o 16 6.40156e+00 9.69916e-01 4.41987e+01 108.756 -1.27062e+00 3.74174e+00  0.00000e+00 0.00000e+00 1.61928e+02 108.756 1.17729e+02 108.756 0.8616 
1 1 1 -10 13  16 o 14 4.34097e+00 9.97072e-01 6.73108e+01 117.102 -1.98407e+00 3.87692e+00  0.00000e+00 0.00000e+00 7.45905e+01 117.102 7.27972e+00 117.102 0.8759 
1 1 1 -10 13  17 o 8  3.26162e+00 9.34805e-01 8.33134e+01 339.431 4.82686e+00  -1.81134e+00 0.00000e+00 0.00000e+00 2.57022e+01 339.431 5.76112e+01 159.431 0.8969 
1 1 1 -10 13  18 o 2  3.20884e+00 1.03777e+00 2.67613e+01 357.360 1.80057e+00  -8.30194e-02 0.00000e+00 0.00000e+00 5.23492e+01 357.360 2.55879e+01 357.360 0.6625 
1 1 1 -10 14  1  o 9  2.25121e+01 6.76111e-01 3.71651e+02 354.366 1.80702e+01  -1.78269e+00 0.00000e+00 0.00000e+00 4.56371e+02 354.366 8.47201e+01 354.366 0.9721 
1 1 1 -10 14  2  o 8  3.62536e+01 8.29270e-01 5.41126e+02 72.522  1.29532e+01  4.11372e+01  0.00000e+00 0.00000e+00 8.13983e+02 72.522  2.72856e+02 72.522  0.9883 
1 1 1 -10 14  3  o 14 2.68108e+01 7.20114e-01 4.66259e+02 173.516 -3.02087e+01 3.43316e+00  0.00000e+00 0.00000e+00 5.30344e+02 173.516 6.40848e+01 173.516 0.9834 
1 1 1 -10 14  4  o 7  1.96653e+01 8.15117e-01 1.43580e+02 36.061  5.90140e+00  4.29724e+00  0.00000e+00 0.00000e+00 5.46345e+02 36.061  4.02764e+02 36.061  0.9287 
1 1 1 -10 14  5  o 15 1.06558e+01 8.95142e-01 1.54590e+02 241.315 -2.16894e+00 -3.96411e+00 0.00000e+00 0.00000e+00 1.99745e+02 241.315 4.51550e+01 241.315 0.8809 
1 1 1 -10 14  6  o 19 2.84793e+01 9.13219e-01 5.14753e+02 149.910 -3.84279e+01 2.22672e+01  0.00000e+00 0.00000e+00 5.47372e+02 149.910 3.26186e+01 149.910 0.9887 
1 1 1 -10 14  7  f 0  1.34158e+01 8.60142e-01 1.74138e+02 74.237  2.13962e+00  7.58016e+00  0.00000e+00 0.00000e+00 2.98240e+02 74.237  1.24102e+02 74.237  0.9342 
1 1 1 -10 14  8  o 11 1.05950e+01 1.21847e+00 2.04312e+02 19.684  8.52617e+00  3.05018e+00  0.00000e+00 0.00000e+00 1.71964e+02 19.684  3.23480e+01 199.684 0.9431 
1 1 1 -10 14  9  o 18 6.93933e+00 1.24424e+00 1.00699e+02 80.794  5.66813e-01  3.49731e+00  0.00000e+00 0.00000e+00 1.19481e+02 80.794  1.87811e+01 80.794  0.8433 
1 1 1 -10 14  10 o 7  5.97740e+00 1.20707e+00 1.03648e+02 197.893 -3.82753e+00 -1.23573e+00 0.00000e+00 0.00000e+00 9.05541e+01 197.893 1.30934e+01 17.893  0.8644 
1 1 1 -10 14  11 o 17 1.20491e+01 7.87494e-01 2.04519e+02 36.963  1.72362e+01  1.29709e+01  0.00000e+00 0.00000e+00 2.37290e+02 36.963  3.27714e+01 36.963  0.9765 
1 1 1 -10 14  12 o 14 7.68405e+00 1.01352e+00 8.85260e+01 92.969  -3.42644e-01 6.60563e+00  0.00000e+00 0.00000e+00 1.76898e+02 92.969  8.83717e+01 92.969  0.9210 
1 1 1 -10 14  13 o 9  9.74800e+00 8.74550e-01 2.24268e+02 156.139 -2.27506e+01 1.00632e+01  0.00000e+00 0.00000e+00 1.33505e+02 156.139 9.07632e+01 336.139 0.9797 
1 1 1 -10 14  14 o 17 3.43276e+00 9.54416e-01 8.46187e+01 219.005 -2.86026e+00 -2.31664e+00 0.00000e+00 0.00000e+00 2.45606e+01 219.005 6.00581e+01 39.005  0.8500 
1 1 1 -10 14  15 o 12 8.23814e+00 8.34522e-01 1.23423e+02 5.504   1.50864e+01  1.45385e+00  0.00000e+00 0.00000e+00 1.74091e+02 5.504   5.06677e+01 5.504   0.9664 
1 1 1 -10 14  16 o 3  1.11549e+01 7.09630e-01 1.76734e+02 277.537 4.45910e+00  -3.37036e+01 0.00000e+00 0.00000e+00 2.33380e+02 277.537 5.66453e+01 277.537 0.9852 
1 1 1 -10 14  17 o 6  3.45775e+00 9.91561e-01 7.61662e+01 40.648  3.64784e+00  3.13188e+00  0.00000e+00 0.00000e+00 3.83513e+01 40.648  3.78149e+01 220.648 0.8887 
1 1 1 -10 14  18 o 1  5.57266e+00 1.33305e+00 8.35008e+01 236.607 -4.33705e+00 -6.57934e+00 0.00000e+00 0.00000e+00 1.10220e+02 236.607 2.67196e+01 236.607 0.9342 
1 1 1 -10 15  1  o 10 2.47117e+01 6.93817e-01 5.15010e+02 255.244 -7.19952e+00 -2.73344e+01 0.00000e+00 0.00000e+00 4.03313e+02 255.244 1.11696e+02 75.244  0.9821 
1 1 1 -10 15  2  o 16 2.42946e+01 6.82858e-01 6.22487e+02 337.377 3.09260e+01  -1.28879e+01 0.00000e+00 0.00000e+00 2.82474e+02 337.377 3.40013e+02 157.377 0.9850 
1 1 1 -10 15  3  o 13 3.01151e+01 7.49159e-01 4.73081e+02 196.795 -3.26636e+01 -9.85856e+00 0.00000e+00 0.00000e+00 6.48375e+02 196.795 1.75294e+02 196.795 0.9852 
1 1 1 -10 15  4  f 0  8.49721e+00 9.67701e-01 2.12372e+02 257.476 -9.97486e-01 -4.49053e+00 0.00000e+00 0.00000e+00 7.11089e+01 257.476 1.41264e+02 77.476  0.8832 
1 1 1 -10 15  5  o 4  3.16911e+01 7.83335e-01 6.36069e+02 20.810  5.63302e+01  2.14089e+01  0.00000e+00 0.00000e+00 5.50244e+02 20.810  8.58244e+01 200.810 0.9917 
1 1 1 -10 15  6  o 13 1.00313e+01 1.21848e+00 1.82085e+02 162.099 -5.06994e+00 1.63768e+00  0.00000e+00 0.00000e+00 1.58637e+02 162.099 2.34483e+01 342.099 0.9005 
1 1 1 -10 15  7  o 1  6.31168e+00 1.27509e+00 1.04405e+02 83.614  2.63085e-01  2.35060e+00  0.00000e+00 0.00000e+00 7.38954e+01 83.614  3.05092e+01 263.614 0.7495 
1 1 1 -10 15  8  o 9  2.88778e+01 7.93520e-01 5.27075e+02 229.666 -4.66557e+01 -5.49490e+01 0.00000e+00 0.00000e+00 5.52827e+02 229.666 2.57525e+01 229.666 0.9930 
1 1 1 -10 15  9  o 5  2.59260e+01 7.94417e-01 5.11352e+02 174.055 -7.39096e+01 7.69703e+00  0.00000e+00 0.00000e+00 4.57476e+02 174.055 5.38764e+01 354.055 0.9932 
1 1 1 -10 15  10 o 6  6.19014e+00 1.15083e+00 1.95513e+02 6.703   7.92457e+00  9.31371e-01  0.00000e+00 0.00000e+00 2.20397e+01 6.703   1.73474e+02 186.703 0.9351 
1 1 1 -10 15  11 o 8  5.92969e+00 1.11874e+00 1.11922e+02 175.318 -5.24540e+00 4.29627e-01  0.00000e+00 0.00000e+00 8.82643e+01 175.318 2.36573e+01 355.318 0.8991 
1 1 1 -10 15  12 o 16 1.23045e+01 7.63284e-01 1.78588e+02 295.515 9.68050e+00  -2.02820e+01 0.00000e+00 0.00000e+00 2.72510e+02 295.515 9.39222e+01 295.515 0.9775 
1 1 1 -10 15  13 o 17 9.58990e+00 8.61481e-01 2.03339e+02 127.469 -1.48105e+01 1.93229e+01  0.00000e+00 0.00000e+00 1.48456e+02 127.469 5.48829e+01 307.469 0.9792 
1 1 1 -10 15  14 o 3  1.17303e+01 7.23406e-01 1.79813e+02 325.455 2.42273e+01  -1.66792e+01 0.00000e+00 0.00000e+00 2.51556e+02 325.455 7.17427e+01 325.455 0.9829 
1 1 1 -10 15  15 o 19 6.47676e+00 9.62146e-01 1.05155e+02 249.027 -3.74545e+00 -9.77116e+00 0.00000e+00 0.00000e+00 1.24992e+02 249.027 1.98369e+01 249.027 0.9509 
1 1 1 -10 15  16 o 14 3.74233e+00 9.46555e-01 9.98596e+01 339.802 5.85552e+00  -2.15422e+00 0.00000e+00 0.00000e+00 2.80510e+01 339.802 7.18086e+01 159.802 0.9159 
1 1 1 -10 15  17 o 19 9.30310e+00 8.01169e-01 1.12522e+02 168.850 -2.11965e+01 4.17772e+00  0.00000e+00 0.00000e+00 2.26030e+02 168.850 1.13508e+02 168.850 0.9766 
1 1 1 -10 15  18 o 9  6.01034e+00 1.20095e+00 1.39295e+02 0.088   1.58422e+01  2.44250e-02  0.00000e+00 0.00000e+00 7.71687e+01 0.088   6.21263e+01 180.088 0.9679 
1 1 1 -10 16  1  o 3  1.11202e+01 7.25969e-01 2.92216e+02 47.114  4.89400e+00  5.26919e+00  0.00000e+00 0.00000e+00 9.80620e+01 47.114  1.94154e+02 227.114 0.9276 
1 1 1 -10 16  2  o 1  6.93637e+00 9.89661e-01 8.99669e+01 16.690  1.42882e+00  4.28385e-01  0.00000e+00 0.00000e+00 6.58615e+01 16.690  2.41054e+01 196.690 0.5941 
1 1 1 -10 16  3  o 1  1.18113e+01 7.39944e-01 1.77249e+02 337.282 4.62121e+00  -1.93481e+00 0.00000e+00 0.00000e+00 2.21673e+02 337.282 4.44234e+01 337.282 0.8936 
1 1 1 -10 16  4  o 1  1.38455e+01 8.45704e-01 3.20879e+02 86.898  6.18765e-01  1.14181e+01  0.00000e+00 0.00000e+00 1.78678e+02 86.898  1.42201e+02 266.898 0.9552 
1 1 1 -10 16  5  o 1  1.73185e+01 7.15668e-01 3.62625e+02 54.265  1.10075e+01  1.52988e+01  0.00000e+00 0.00000e+00 2.73505e+02 54.265  8.91204e+01 234.265 0.9731 
1 1 1 -10 16  6  o 8  3.48694e+01 8.37311e-01 6.31003e+02 162.655 -6.60786e+01 2.06377e+01  0.00000e+00 0.00000e+00 6.74692e+02 162.655 4.36897e+01 162.655 0.9928 
1 1 1 -10 16  7  f 0  1.67198e+01 7.64356e-01 3.08031e+02 287.968 6.12584e+00  -1.88895e+01 0.00000e+00 0.00000e+00 3.06036e+02 287.968 1.99537e+00 107.968 0.9745 
1 1 1 -10 16  8  o 7  1.81432e+01 9.27344e-01 3.42030e+02 59.330  1.46719e+01  2.47402e+01  0.00000e+00 0.00000e+00 3.29188e+02 59.330  1.28426e+01 239.330 0.9825 
1 1 1 -10 16  9  o 8  1.81892e+01 7.72455e-01 2.78478e+02 30.797  2.44485e+01  1.45724e+01  0.00000e+00 0.00000e+00 3.93692e+02 30.797  1.15214e+02 30.797  0.9823 
1 1 1 -10 16  10 o 14 2.06854e+01 7.08766e-01 3.72198e+02 253.476 -1.57844e+01 -5.32047e+01 0.00000e+00 0.00000e+00 3.98214e+02 253.476 2.60157e+01 253.476 0.9909 
1 1 1 -10 16  11 o 3  1.30170e+01 7.51910e-01 1.69215e+02 11.537  1.90439e+01  3.88716e+00  0.00000e+00 0.00000e+00 3.06767e+02 11.537  1.37552e+02 11.537  0.9739 
1 1 1 -10 16  12 o 15 1.07879e+01 8.24019e-01 1.54392e+02 12.211  1.63320e+01  3.53438e+00  0.00000e+00 0.00000e+00 2.37896e+02 12.211  8.35045e+01 12.211  0.9696 
1 1 1 -10 16  13 o 9  1.38589e+01 7.20555e-01 2.17983e+02 158.526 -3.70007e+01 1.45555e+01  0.00000e+00 0.00000e+00 2.94600e+02 158.526 7.66169e+01 158.526 0.9873 
1 1 1 -10 16  14 o 8  4.83469e+00 9.63452e-01 4.57467e+01 59.075  1.61367e+00  2.69359e+00  0.00000e+00 0.00000e+00 1.02547e+02 59.075  5.68001e+01 59.075  0.8198 
1 1 1 -10 16  15 o 11 7.21406e+00 9.06274e-01 8.16447e+01 271.280 2.08309e-01  -9.32068e+00 0.00000e+00 0.00000e+00 1.73019e+02 271.280 9.13742e+01 271.280 0.9447 
1 1 1 -10 16  16 o 11 3.49175e+00 9.48739e-01 4.87270e+01 94.220  -2.08622e-01 2.82715e+00  0.00000e+00 0.00000e+00 5.51175e+01 94.220  6.39055e+00 94.220  0.7970 
1 1 1 -10 16  17 o 12 4.79998e+00 1.01629e+00 6.14709e+01 236.058 -3.09572e+00 -4.59960e+00 0.00000e+00 0.00000e+00 1.00334e+02 236.058 3.88629e+01 236.058 0.9046 
1 1 1 -10 16  18 o 9  4.01134e+00 1.33694e+00 6.83656e+01 148.076 -3.92544e+00 2.44564e+00  0.00000e+00 0.00000e+00 6.35582e+01 148.076 4.80740e+00 328.076 0.8839 
1 1 1 -10 17  1  o 12 1.04060e+01 7.62429e-01 7.46129e+01 313.494 1.30277e+00  -1.37312e+00 0.00000e+00 0.00000e+00 1.92849e+02 313.494 1.18236e+02 313.494 0.6794 
1 1 1 -10 17  2  o 9  3.35858e+01 9.31271e-01 6.42501e+02 231.289 -3.23578e+01 -4.03729e+01 0.00000e+00 0.00000e+00 6.15205e+02 231.289 2.72960e+01 51.289  0.9903 
1 1 1 -10 17  3  o 19 9.74625e+00 1.06370e+00 1.67491e+02 101.982 -8.77710e-01 4.13551e+00  0.00000e+00 0.00000e+00 1.53612e+02 101.982 1.38789e+01 281.982 0.8717 
1 1 1 -10 17  4  o 16 2.36662e+01 6.91758e-01 5.45149e+02 139.456 -2.68570e+01 2.29740e+01  0.00000e+00 0.00000e+00 3.35998e+02 139.456 2.09151e+02 319.456 0.9857 
1 1 1 -10 17  5  o 4  3.77118e+01 8.61201e-01 6.87662e+02 339.692 7.19130e+01  -2.66125e+01 0.00000e+00 0.00000e+00 7.26454e+02 339.692 3.87923e+01 339.692 0.9935 
1 1 1 -10 17  6  o 10 2.14859e+01 7.24189e-01 4.09495e+02 94.696  -2.28597e+00 2.78260e+01  0.00000e+00 0.00000e+00 3.86242e+02 94.696  2.32529e+01 274.696 0.9819 
1 1 1 -10 17  7  o 3  1.60236e+01 7.67144e-01 3.41895e+02 354.075 2.09713e+01  -2.17628e+00 0.00000e+00 0.00000e+00 2.47485e+02 354.075 9.44093e+01 174.075 0.9760 
1 1 1 -10 17  8  o 11 2.15348e+01 7.66145e-01 4.08201e+02 75.800  1.00199e+01  3.95987e+01  0.00000e+00 0.00000e+00 3.92691e+02 75.800  1.55101e+01 255.800 0.9877 
1 1 1 -10 17  9  o 1  1.16800e+01 8.96563e-01 2.73187e+02 251.157 -5.65968e+00 -1.65849e+01 0.00000e+00 0.00000e+00 1.53484e+02 251.157 1.19703e+02 71.157  0.9710 
1 1 1 -10 17  10 o 10 3.26040e+00 1.01029e+00 6.14377e+01 354.114 1.34013e+00  -1.38146e-01 0.00000e+00 0.00000e+00 6.69608e+00 354.114 5.47417e+01 174.115 0.5560 
1 1 1 -10 17  11 o 5  1.52165e+01 7.09299e-01 1.76423e+02 252.617 -7.14328e+00 -2.28184e+01 0.00000e+00 0.00000e+00 3.82779e+02 252.617 2.06356e+02 252.617 0.9789 
1 1 1 -10 17  12 o 18 6.14294e+00 1.06420e+00 1.21728e+02 183.551 -6.89297e+00 -4.27719e-01 0.00000e+00 0.00000e+00 9.12441e+01 183.551 3.04838e+01 3.551   0.9245 
1 1 1 -10 17  13 o 18 8.80046e+00 8.97619e-01 1.94468e+02 57.164  1.13988e+01  1.76631e+01  0.00000e+00 0.00000e+00 1.27243e+02 57.164  6.72256e+01 237.164 0.9759 
1 1 1 -10 17  14 o 6  3.38532e+00 9.18943e-01 7.37436e+01 36.566  2.91016e+00  2.15858e+00  0.00000e+00 0.00000e+00 3.35683e+01 36.566  4.01752e+01 216.566 0.8473 
1 1 1 -10 17  15 o 12 4.68160e+00 9.82722e-01 1.83188e+02 255.874 -3.17513e+00 -1.26166e+01 0.00000e+00 0.00000e+00 1.51280e+01 75.874  1.98316e+02 75.874  0.9608 
1 1 1 -10 17  16 o 4  6.62955e+00 8.53529e-01 1.45209e+02 345.687 1.64037e+01  -4.18524e+00 0.00000e+00 0.00000e+00 9.47420e+01 345.687 5.04674e+01 165.687 0.9700 
1 1 1 -10 17  17 o 7  8.21352e+00 1.06049e+00 1.34402e+02 153.218 -1.79284e+01 9.04900e+00  0.00000e+00 0.00000e+00 1.63922e+02 153.218 2.95200e+01 153.218 0.9748 
1 1 1 -10 17  18 o 12 3.72587e+00 1.25988e+00 3.91953e+01 334.640 2.38221e+00  -1.12913e+00 0.00000e+00 0.00000e+00 6.87993e+01 334.640 2.96040e+01 334.640 0.7790 
1 1 1 -10 18  1  o 6  1.85482e+01 6.53733e-01 3.73906e+02 196.129 -1.63221e+01 -4.72014e+00 0.00000e+00 0.00000e+00 3.06831e+02 196.129 6.70748e+01 16.129  0.9701 
1 1 1 -10 18  2  o 14 2.82120e+01 8.66265e-01 6.29462e+02 302.226 2.25106e+01  -3.57099e+01 0.00000e+00 0.00000e+00 4.24605e+02 302.226 2.04858e+02 122.226 0.9881 
1 1 1 -10 18  3  o 5  1.63478e+01 7.92306e-01 2.94810e+02 230.856 -8.06464e+00 -9.90796e+00 0.00000e+00 0.00000e+00 2.98309e+02 230.856 3.49925e+00 230.856 0.9600 
1 1 1 -10 18  4  o 4  1.52708e+01 6.95824e-01 2.17975e+02 304.913 5.20969e+00  -7.46418e+00 0.00000e+00 0.00000e+00 3.26115e+02 304.913 1.08141e+02 304.913 0.9434 
1 1 1 -10 18  5  o 13 2.20721e+01 7.09238e-01 4.66354e+02 186.350 -2.92362e+01 -3.25380e+00 0.00000e+00 0.00000e+00 3.52430e+02 186.350 1.13924e+02 6.351   0.9829 
1 1 1 -10 18  6  o 3  6.38631e+00 1.19670e+00 2.01020e+02 325.652 3.18385e+00  -2.17575e+00 0.00000e+00 0.00000e+00 5.58031e+00 325.652 1.95440e+02 145.652 0.8578 
1 1 1 -10 18  7  o 2  1.01201e+01 9.88134e-01 1.34398e+02 14.699  5.39455e+00  1.41518e+00  0.00000e+00 0.00000e+00 2.10840e+02 14.699  7.64415e+01 14.699  0.9052 
1 1 1 -10 18  8  o 18 1.70392e+01 7.90145e-01 3.02718e+02 294.971 1.00655e+01  -2.16142e+01 0.00000e+00 0.00000e+00 3.25251e+02 294.971 2.25325e+01 294.971 0.9788 
1 1 1 -10 18  9  o 9  1.76137e+01 8.22354e-01 2.98058e+02 347.964 3.04131e+01  -6.48419e+00 0.00000e+00 0.00000e+00 3.53791e+02 347.964 5.57335e+01 347.964 0.9838 
1 1 1 -10 18  10 o 11 2.05991e+01 6.88078e-01 3.99087e+02 52.114  3.64167e+01  4.68035e+01  0.00000e+00 0.00000e+00 3.68491e+02 52.114  3.05958e+01 232.114 0.9915 
1 1 1 -10 18  11 o 4  2.21585e+01 6.92800e-01 4.21872e+02 268.443 -2.27097e+00 -8.35667e+01 0.00000e+00 0.00000e+00 4.05005e+02 268.443 1.68669e+01 88.443  0.9940 
1 1 1 -10 18  12 o 4  6.56805e+00 1.11582e+00 1.45734e+02 167.193 -8.86922e+00 2.01617e+00  0.00000e+00 0.00000e+00 8.66066e+01 167.193 5.91274e+01 347.193 0.9433 
1 1 1 -10 18  13 o 15 2.03766e+01 7.54095e-01 3.63117e+02 79.656  1.65590e+01  9.07245e+01  0.00000e+00 0.00000e+00 3.95969e+02 79.656  3.28526e+01 79.656  0.9946 
1 1 1 -10 18  14 o 18 6.22026e+00 9.95347e-01 1.39316e+02 19.231  1.14171e+01  3.98275e+00  0.00000e+00 0.00000e+00 8.35459e+01 19.231  5.57705e+01 199.231 0.9577 
1 1 1 -10 18  15 o 13 4.05709e+00 1.00886e+00 4.92812e+01 286.526 8.03898e-01  -2.70935e+00 0.00000e+00 0.00000e+00 7.14172e+01 286.526 2.21360e+01 286.526 0.7963 
1 1 1 -10 18  16 o 3  3.97355e+00 9.24221e-01 1.32011e+02 131.743 -5.81845e+00 6.52065e+00  0.00000e+00 0.00000e+00 7.48974e+00 131.743 1.24521e+02 311.743 0.9409 
1 1 1 -10 18  17 o 12 3.65078e+00 1.10901e+00 7.24909e+01 222.286 -3.29473e+00 -2.99651e+00 0.00000e+00 0.00000e+00 4.70684e+01 222.286 2.54226e+01 42.286  0.8790 
1 1 1 -10 18  18 o 16 3.98984e+00 1.33116e+00 3.46226e+01 295.197 9.99117e-01  -2.12355e+00 0.00000e+00 0.00000e+00 7.63001e+01 295.197 4.16775e+01 295.197 0.7473 
1 1 1 -10 19  1  o 2  2.36493e+01 6.67006e-01 4.84888e+02 204.479 -2.54905e+01 -1.16052e+01 0.00000e+00 0.00000e+00 3.93640e+02 204.479 9.12476e+01 24.479  0.9820 
1 1 1 -10 19  2  o 1  1.16759e+01 7.41196e-01 1.51458e+02 146.910 -3.54803e+00 2.31209e+00  0.00000e+00 0.00000e+00 2.33504e+02 146.910 8.20461e+01 146.910 0.8720 
1 1 1 -10 19  3  o 1  1.48306e+01 6.81297e-01 2.84185e+02 79.272  2.09301e+00  1.10477e+01  0.00000e+00 0.00000e+00 2.50732e+02 79.272  3.34532e+01 259.272 0.9544 
1 1 1 -10 19  4  o 12 1.99247e+01 6.79122e-01 3.44475e+02 7.912   1.85839e+01  2.58280e+00  0.00000e+00 0.00000e+00 3.87681e+02 7.912   4.32055e+01 7.912   0.9730 
1 1 1 -10 19  5  o 12 2.14282e+01 7.86077e-01 4.40568e+02 240.569 -1.31468e+01 -2.33020e+01 0.00000e+00 0.00000e+00 3.52896e+02 240.569 8.76715e+01 60.569  0.9811 
1 1 1 -10 19  6  o 10 2.23623e+01 7.17050e-01 4.55934e+02 32.820  2.80429e+01  1.80861e+01  0.00000e+00 0.00000e+00 3.74688e+02 32.820  8.12459e+01 212.820 0.9849 
1 1 1 -10 19  7  o 3  8.00841e+00 1.33754e+00 2.58446e+02 82.675  1.01634e+00  7.90611e+00  0.00000e+00 0.00000e+00 2.37179e+01 82.675  2.34728e+02 262.675 0.9350 
1 1 1 -10 19  8  o 6  1.96771e+01 7.75837e-01 4.17089e+02 296.415 1.68751e+01  -3.39721e+01 0.00000e+00 0.00000e+00 3.13937e+02 296.415 1.03152e+02 116.415 0.9867 
1 1 1 -10 19  9  o 6  4.03121e+01 9.44103e-01 7.68998e+02 48.091  1.19580e+02  1.33231e+02  0.00000e+00 0.00000e+00 7.43139e+02 48.091  2.58596e+01 228.091 0.9972 
1 1 1 -10 19  10 o 2  9.28634e+00 9.19756e-01 1.40112e+02 227.425 -6.36765e+00 -6.93089e+00 0.00000e+00 0.00000e+00 1.89764e+02 227.425 4.96512e+01 227.425 0.9453 
1 1 1 -10 19  11 o 17 1.57476e+01 7.27366e-01 2.35156e+02 210.145 -2.83743e+01 -1.64779e+01 0.00000e+00 0.00000e+00 3.46926e+02 210.145 1.11770e+02 210.145 0.9846 
1 1 1 -10 19  12 o 9  1.16649e+01 7.90949e-01 2.20178e+02 100.504 -4.99572e+00 2.69441e+01  0.00000e+00 0.00000e+00 2.09179e+02 100.504 1.09985e+01 280.504 0.9816 
1 1 1 -10 19  13 o 12 1.75235e+01 6.93966e-01 2.64684e+02 351.317 5.82756e+01  -8.89956e+00 0.00000e+00 0.00000e+00 3.86058e+02 351.317 1.21373e+02 351.317 0.9915 
1 1 1 -10 19  14 o 18 1.56131e+01 6.27916e-01 2.63572e+02 188.833 -6.54797e+01 -1.01757e+01 0.00000e+00 0.00000e+00 3.16068e+02 188.833 5.24963e+01 188.833 0.9924 
1 1 1 -10 19  15 o 6  4.62369e+00 9.92527e-01 7.34659e+01 254.959 -1.25585e+00 -4.67343e+00 0.00000e+00 0.00000e+00 8.01915e+01 254.959 6.72565e+00 254.959 0.8895 
1 1 1 -10 19  16 o 11 7.86718e+00 7.55177e-01 1.14208e+02 188.610 -1.62186e+01 -2.45579e+00 0.00000e+00 0.00000e+00 1.70224e+02 188.610 5.60160e+01 188.610 0.9690 
1 1 1 -10 19  17 o 13 5.85939e+00 1.03190e+00 1.01056e+02 189.160 -1.03654e+01 -1.67134e+00 0.00000e+00 0.00000e+00 1.06577e+02 189.160 5.52096e+00 189.160 0.9511 
1 1 1 -10 19  18 o 5  4.66941e+00 1.48654e+00 1.21216e+02 107.392 -2.39114e+00 7.63409e+00  0.00000e+00 0.00000e+00 4.12474e+01 107.392 7.99682e+01 287.392 0.9352 
1 1 1 -10 20  1  o 2  4.59526e+01 9.38037e-01 7.31018e+02 257.672 -1.69383e+01 -7.75031e+01 0.00000e+00 0.00000e+00 9.96277e+02 257.672 2.65260e+02 257.672 0.9937 
1 1 1 -10 20  2  o 14 3.42465e+01 7.66184e-01 7.19308e+02 84.993  5.13120e+00  5.85663e+01  0.00000e+00 0.00000e+00 5.64459e+02 84.993  1.54849e+02 264.993 0.9915 
1 1 1 -10 20  3  o 17 2.61197e+01 7.12600e-01 4.54455e+02 294.737 1.29345e+01  -2.80734e+01 0.00000e+00 0.00000e+00 5.16456e+02 294.737 6.20006e+01 294.737 0.9837 
1 1 1 -10 20  4  o 18 8.00755e+00 1.01866e+00 6.55180e+01 230.391 -9.08298e-01 -1.09759e+00 0.00000e+00 0.00000e+00 1.08955e+02 230.391 4.34368e+01 230.391 0.5770 
1 1 1 -10 20  5  o 1  6.25784e+00 1.12615e+00 1.91631e+02 55.066  2.10294e+00  3.01065e+00  0.00000e+00 0.00000e+00 9.02127e+00 55.066  1.82610e+02 235.066 0.8496 
1 1 1 -10 20  6  o 12 3.32188e+01 8.17551e-01 5.47251e+02 10.905  5.77564e+01  1.11277e+01  0.00000e+00 0.00000e+00 6.94775e+02 10.905  1.47524e+02 10.905  0.9915 
1 1 1 -10 20  7  o 3  1.61120e+01 7.58763e-01 1.38987e+02 36.546  7.57525e+00  5.61477e+00  0.00000e+00 0.00000e+00 4.34975e+02 36.546  2.95987e+02 36.546  0.9454 
1 1 1 -10 20  8  o 17 2.11438e+01 7.55073e-01 4.05651e+02 12.005  4.17412e+01  8.87589e+00  0.00000e+00 0.00000e+00 3.81003e+02 12.005  2.46484e+01 192.005 0.9882 
1 1 1 -10 20  9  o 3  1.37014e+01 7.69202e-01 1.55920e+02 262.747 -1.64316e+00 -1.29114e+01 0.00000e+00 0.00000e+00 3.39231e+02 262.747 1.83311e+02 262.747 0.9608 
1 1 1 -10 20  10 o 11 2.22612e+01 7.11938e-01 3.38694e+02 287.428 1.70998e+01  -5.44718e+01 0.00000e+00 0.00000e+00 4.90455e+02 287.428 1.51761e+02 287.428 0.9912 
1 1 1 -10 20  11 o 6  1.74302e+01 7.13212e-01 3.90829e+02 62.827  2.92013e+01  5.68853e+01  0.00000e+00 0.00000e+00 2.58323e+02 62.827  1.32507e+02 242.827 0.9921 
1 1 1 -10 20  12 o 1  1.05156e+01 8.03421e-01 2.76494e+02 297.437 1.33937e+01  -2.57985e+01 0.00000e+00 0.00000e+00 1.10960e+02 297.437 1.65533e+02 117.437 0.9826 
1 1 1 -10 20  13 o 17 1.40111e+01 7.12300e-01 2.08252e+02 233.667 -2.33547e+01 -3.17549e+01 0.00000e+00 0.00000e+00 3.09800e+02 233.667 1.01548e+02 233.667 0.9872 
1 1 1 -10 20  14 o 18 6.55371e+00 9.70188e-01 1.59228e+02 155.388 -1.31073e+01 6.00418e+00  0.00000e+00 0.00000e+00 7.72628e+01 155.388 8.19651e+01 335.388 0.9647 
1 1 1 -10 20  15 o 15 3.88483e+00 9.94481e-01 7.93887e+01 326.431 3.93112e+00  -2.60874e+00 0.00000e+00 0.00000e+00 4.92558e+01 326.431 3.01328e+01 146.431 0.8864 
1 1 1 -10 20  16 o 5  1.01067e+01 6.21495e-01 1.50692e+02 196.106 -3.03149e+01 -8.75323e+00 0.00000e+00 0.00000e+00 2.20345e+02 196.106 6.96526e+01 196.106 0.9840 
1 1 1 -10 20  17 o 11 1.10652e+01 1.74974e+00 2.00396e+02 78.040  4.89043e+00  2.30860e+01  0.00000e+00 0.00000e+00 2.03011e+02 78.040  2.61493e+00 78.040  0.9786 
1 1 1 -10 20  18 o 3  4.58111e+00 1.46765e+00 2.70838e+01 179.918 -1.77865e+00 2.55514e-03  0.00000e+00 0.00000e+00 8.50288e+01 179.918 5.79450e+01 179.918 0.6579 
1 1 1 -10 21  1  o 16 2.26490e+01 6.64655e-01 4.58904e+02 153.065 -2.22795e+01 1.13202e+01  0.00000e+00 0.00000e+00 3.80488e+02 153.065 7.84162e+01 333.065 0.9798 
1 1 1 -10 21  2  o 12 1.25284e+01 6.92066e-01 3.18973e+02 22.802  9.84113e+00  4.13715e+00  0.00000e+00 0.00000e+00 1.31926e+02 22.802  1.87048e+02 202.802 0.9519 
1 1 1 -10 21  3  o 7  2.75693e+01 6.93204e-01 5.74036e+02 22.762  3.79989e+01  1.59436e+01  0.00000e+00 0.00000e+00 4.54977e+02 22.762  1.19059e+02 202.762 0.9878 
1 1 1 -10 21  4  o 17 2.43413e+01 6.72107e-01 4.24049e+02 335.650 2.62754e+01  -1.18914e+01 0.00000e+00 0.00000e+00 4.79064e+02 335.650 5.50149e+01 335.650 0.9825 
1 1 1 -10 21  5  o 17 1.52980e+01 6.93143e-01 2.03307e+02 215.605 -8.09472e+00 -5.79630e+00 0.00000e+00 0.00000e+00 3.44185e+02 215.605 1.40878e+02 215.605 0.9484 
1 1 1 -10 21  6  o 11 2.88068e+01 7.64622e-01 5.67350e+02 330.675 5.00527e+01  -2.81166e+01 0.00000e+00 0.00000e+00 5.09429e+02 330.675 5.79208e+01 150.675 0.9913 
1 1 1 -10 21  7  o 17 5.57341e+00 1.26185e+00 1.80196e+02 227.926 -2.61705e+00 -2.89902e+00 0.00000e+00 0.00000e+00 3.60245e-01 227.926 1.79836e+02 47.926  0.8598 
1 1 1 -10 21  8  o 15 1.47286e+01 8.03536e-01 2.88776e+02 248.327 -7.74179e+00 -1.94806e+01 0.00000e+00 0.00000e+00 2.52312e+02 248.327 3.64638e+01 68.327  0.9758 
1 1 1 -10 21  9  o 14 6.62081e+00 1.14418e+00 1.52855e+02 48.076  3.80038e+00  4.23201e+00  0.00000e+00 0.00000e+00 7.30616e+01 48.076  7.97935e+01 228.076 0.9072 
1 1 1 -10 21  10 o 12 7.12853e+00 1.03575e+00 8.68253e+01 112.027 -1.74908e+00 4.32327e+00  0.00000e+00 0.00000e+00 1.50212e+02 112.027 6.33867e+01 112.027 0.8850 
1 1 1 -10 21  11 o 1  1.86545e+01 6.98560e-01 2.98461e+02 69.935  1.79696e+01  4.91968e+01  0.00000e+00 0.00000e+00 3.95030e+02 69.935  9.65690e+01 69.935  0.9904 
1 1 1 -10 21  12 o 2  1.39718e+01 7.09132e-01 2.21931e+02 307.748 1.94704e+01  -2.51484e+01 0.00000e+00 0.00000e+00 2.93627e+02 307.748 7.16967e+01 307.748 0.9842 
1 1 1 -10 21  13 o 5  4.02255e+00 1.02619e+00 3.34192e+01 170.655 -1.57307e+00 2.58880e-01  0.00000e+00 0.00000e+00 5.97672e+01 170.655 2.63480e+01 170.655 0.6186 
1 1 1 -10 21  14 f 0  1.06158e+01 7.17755e-01 1.82672e+02 45.962  2.10697e+01  2.17898e+01  0.00000e+00 0.00000e+00 2.07800e+02 45.962  2.51277e+01 45.962  0.9834 
1 1 1 -10 21  15 o 2  3.21928e+00 8.41074e-01 9.30752e+01 312.841 3.38659e+00  -3.65191e+00 0.00000e+00 0.00000e+00 1.43087e+01 312.841 7.87665e+01 132.841 0.8929 
1 1 1 -10 21  16 o 7  8.25312e+00 6.53325e-01 1.60462e+02 82.657  3.44890e+00  2.67636e+01  0.00000e+00 0.00000e+00 1.41668e+02 82.657  1.87934e+01 262.657 0.9813 
1 1 1 -10 21  17 o 19 6.32651e+00 1.66842e+00 1.16718e+02 75.330  2.10497e+00  8.04078e+00  0.00000e+00 0.00000e+00 1.04296e+02 75.330  1.24228e+01 255.330 0.9378 
1 1 1 -10 21  18 o 3  4.19472e+00 1.38352e+00 4.61315e+01 82.411  4.12235e-01  3.09424e+00  0.00000e+00 0.00000e+00 8.15984e+01 82.411  3.54669e+01 82.411  0.8186 
1 1 1 -10 22  1  o 16 1.44870e+01 7.62729e-01 2.73947e+02 274.301 7.91692e-01  -1.05257e+01 0.00000e+00 0.00000e+00 2.47361e+02 274.301 2.65858e+01 94.301  0.9514 
1 1 1 -10 22  2  o 19 5.50685e+00 1.07924e+00 2.66685e+02 83.452  4.31542e-01  3.75959e+00  0.00000e+00 0.00000e+00 8.87531e+01 263.452 3.55438e+02 263.452 0.8547 
1 1 1 -10 22  3  o 19 3.50991e+01 1.04104e+00 3.80948e+02 40.358  2.70544e+01  2.29905e+01  0.00000e+00 0.00000e+00 9.26411e+02 40.358  5.45463e+02 40.358  0.9858 
1 1 1 -10 22  4  o 2  2.24978e+01 8.52320e-01 3.50234e+02 171.353 -2.31240e+01 3.51655e+00  0.00000e+00 0.00000e+00 4.80928e+02 171.353 1.30694e+02 171.353 0.9784 
1 1 1 -10 22  5  o 17 4.27314e+01 8.94938e-01 7.15227e+02 317.914 6.89258e+01  -6.22488e+01 0.00000e+00 0.00000e+00 8.88531e+02 317.914 1.73304e+02 317.914 0.9946 
1 1 1 -10 22  6  o 5  3.70674e+01 8.31891e-01 6.67201e+02 8.127   8.51861e+01  1.21649e+01  0.00000e+00 0.00000e+00 7.22351e+02 8.127   5.51495e+01 8.127   0.9942 
1 1 1 -10 22  7  o 3  7.78614e+00 1.04039e+00 7.90560e+01 107.925 -7.87713e-01 2.43517e+00  0.00000e+00 0.00000e+00 1.47212e+02 107.925 6.81560e+01 107.925 0.7713 
1 1 1 -10 22  8  o 2  1.00933e+01 9.72638e-01 1.40158e+02 311.779 4.83845e+00  -5.41542e+00 0.00000e+00 0.00000e+00 2.12572e+02 311.779 7.24146e+01 311.779 0.9283 
1 1 1 -10 22  9  o 15 5.33510e+00 1.08986e+00 1.64586e+02 5.560   5.41908e+00  5.27527e-01  0.00000e+00 0.00000e+00 1.65556e+01 5.560   1.48030e+02 185.560 0.9028 
1 1 1 -10 22  10 o 1  4.49947e+00 1.04386e+00 7.15489e+01 320.096 1.85291e+00  -1.54949e+00 0.00000e+00 0.00000e+00 5.61689e+01 320.096 1.53799e+01 140.096 0.7555 
1 1 1 -10 22  11 o 1  1.49925e+01 7.14537e-01 2.13695e+02 316.669 2.21015e+01  -2.08498e+01 0.00000e+00 0.00000e+00 3.39685e+02 316.669 1.25989e+02 316.669 0.9834 
1 1 1 -10 22  12 o 18 1.17021e+01 7.64323e-01 1.91692e+02 342.540 2.34039e+01  -7.36127e+00 0.00000e+00 0.00000e+00 2.38007e+02 342.540 4.63145e+01 342.540 0.9794 
1 1 1 -10 22  13 o 14 1.53368e+01 6.78281e-01 2.64433e+02 160.250 -5.24493e+01 1.88312e+01  0.00000e+00 0.00000e+00 3.04726e+02 160.250 4.02931e+01 160.250 0.9910 
1 1 1 -10 22  14 o 1  1.14321e+01 7.41153e-01 1.83881e+02 58.760  1.68541e+01  2.77861e+01  0.00000e+00 0.00000e+00 2.37072e+02 58.760  5.31913e+01 58.760  0.9845 
1 1 1 -10 22  15 o 4  2.34215e+00 7.67938e-01 5.82662e+01 284.756 5.97664e-01  -2.26916e+00 0.00000e+00 0.00000e+00 7.10726e+00 284.756 5.11589e+01 104.756 0.7472 
1 1 1 -10 22  16 o 14 1.02527e+01 5.58518e-01 1.95047e+02 119.838 -1.91399e+01 3.33688e+01  0.00000e+00 0.00000e+00 1.82411e+02 119.838 1.26353e+01 299.838 0.9869 
1 1 1 -10 22  17 o 10 6.34126e+00 1.65956e+00 9.04212e+01 177.802 -6.77147e+00 2.59882e-01  0.00000e+00 0.00000e+00 1.27596e+02 177.802 3.71748e+01 177.802 0.9229 
1 1 1 -10 22  18 o 10 3.67068e+00 1.23533e+00 8.57909e+01 16.292  5.51488e+00  1.61180e+00  0.00000e+00 0.00000e+00 3.82126e+01 16.292  4.75784e+01 196.292 0.9082 
1 1 1 -10 23  1  o 10 8.91286e+00 8.53399e-01 1.70702e+02 56.849  2.19194e+00  3.35594e+00  0.00000e+00 0.00000e+00 1.20495e+02 56.849  5.02069e+01 236.849 0.8638 
1 1 1 -10 23  2  o 17 1.62768e+01 6.33007e-01 1.57979e+02 120.329 -3.39878e+00 5.80945e+00  0.00000e+00 0.00000e+00 4.09573e+02 120.329 2.51594e+02 120.329 0.9224 
1 1 1 -10 23  3  o 15 6.23566e+00 1.05098e+00 1.30429e+02 47.173  1.46388e+00  1.57933e+00  0.00000e+00 0.00000e+00 3.95332e+01 47.173  9.08959e+01 227.173 0.7214 
1 1 1 -10 23  4  o 2  1.14876e+01 7.49286e-01 2.07068e+02 155.709 -6.47865e+00 2.92398e+00  0.00000e+00 0.00000e+00 1.94896e+02 155.709 1.21723e+01 335.709 0.9267 
1 1 1 -10 23  5  o 14 3.82238e+00 1.05803e+00 6.47322e+01 73.060  2.14681e-01  7.04811e-01  0.00000e+00 0.00000e+00 1.49069e+01 253.060 7.96391e+01 253.060 0.3455 
1 1 1 -10 23  6  o 16 1.37591e+01 7.42353e-01 1.50572e+02 306.640 4.22679e+00  -5.68307e+00 0.00000e+00 0.00000e+00 3.30051e+02 306.640 1.79478e+02 306.640 0.9264 
1 1 1 -10 23  7  o 19 9.82432e+00 8.81987e-01 2.40762e+02 241.184 -4.84659e+00 -8.81014e+00 0.00000e+00 0.00000e+00 1.10446e+02 241.184 1.30316e+02 61.184  0.9489 
1 1 1 -10 23  8  o 19 8.11906e+00 1.06297e+00 8.85314e+01 228.841 -2.38119e+00 -2.72396e+00 0.00000e+00 0.00000e+00 1.70338e+02 228.841 8.18069e+01 228.841 0.8470 
1 1 1 -10 23  9  o 4  1.46676e+01 7.28508e-01 1.94093e+02 289.029 6.22053e+00  -1.80362e+01 0.00000e+00 0.00000e+00 3.42860e+02 289.029 1.48767e+02 289.029 0.9734 
1 1 1 -10 23  10 o 14 1.13014e+01 8.66490e-01 1.96640e+02 293.124 6.51861e+00  -1.52650e+01 0.00000e+00 0.00000e+00 2.14959e+02 293.124 1.83192e+01 293.124 0.9694 
1 1 1 -10 23  11 o 6  1.46152e+01 6.99574e-01 2.63242e+02 72.129  1.12270e+01  3.48199e+01  0.00000e+00 0.00000e+00 2.77732e+02 72.129  1.44906e+01 72.129  0.9862 
1 1 1 -10 23  12 o 8  8.12800e+00 9.05051e-01 1.76790e+02 310.652 9.75551e+00  -1.13610e+01 0.00000e+00 0.00000e+00 1.17569e+02 310.652 5.92213e+01 130.652 0.9660 
1 1 1 -10 23  13 o 7  3.92800e+00 9.96152e-01 7.09741e+01 295.110 1.42873e+00  -3.04866e+00 0.00000e+00 0.00000e+00 5.16725e+01 295.110 1.93017e+01 115.110 0.8338 
1 1 1 -10 23  14 o 19 8.51051e+00 8.34175e-01 2.00485e+02 32.728  2.11331e+01  1.35818e+01  0.00000e+00 0.00000e+00 1.11407e+02 32.728  8.90779e+01 212.728 0.9799 
1 1 1 -10 23  15 o 12 2.94914e+00 8.34209e-01 4.55531e+01 210.631 -1.91991e+00 -1.13684e+00 0.00000e+00 0.00000e+00 3.51158e+01 210.631 1.04373e+01 30.631  0.7323 
1 1 1 -10 23  16 f 0  4.82876e+00 7.65244e-01 7.55571e+01 320.450 4.92122e+00  -4.06394e+00 0.00000e+00 0.00000e+00 8.97777e+01 320.450 1.42206e+01 320.450 0.9179 
1 1 1 -10 23  17 o 6  4.53783e+00 1.43111e+00 7.06807e+01 142.135 -3.54090e+00 2.75303e+00  0.00000e+00 0.00000e+00 7.80467e+01 142.135 7.36597e+00 142.135 0.8799 
1 1 1 -10 23  18 o 12 4.52472e+00 1.46251e+00 8.47841e+01 335.439 5.23656e+00  -2.39318e+00 0.00000e+00 0.00000e+00 6.80956e+01 335.439 1.66885e+01 155.439 0.9084 
1 1 1 -10 24  1  o 7  1.49540e+01 6.66400e-01 2.79888e+02 160.612 -1.03176e+01 3.63103e+00  0.00000e+00 0.00000e+00 2.59144e+02 160.612 2.07441e+01 340.612 0.9531 
1 1 1 -10 24  2  o 10 9.47549e+00 7.91619e-01 1.11116e+02 351.301 2.83212e+00  -4.33340e-01 0.00000e+00 0.00000e+00 1.75241e+02 351.301 6.41256e+01 351.301 0.7995 
1 1 1 -10 24  3  o 12 1.28923e+01 6.90243e-01 1.74879e+02 9.114   6.22712e+00  9.99011e-01  0.00000e+00 0.00000e+00 2.71691e+02 9.114   9.68123e+01 9.114   0.9169 
1 1 1 -10 24  4  o 12 9.83262e+00 8.47912e-01 1.05538e+02 145.311 -2.40971e+00 1.66790e+00  0.00000e+00 0.00000e+00 1.93205e+02 145.311 8.76665e+01 145.311 0.8047 
1 1 1 -10 24  5  f 0  1.73988e+01 8.58281e-01 1.77639e+02 180.315 -9.69779e+00 -5.33976e-02 0.00000e+00 0.00000e+00 4.43992e+02 180.315 2.66354e+02 180.315 0.9469 
1 1 1 -10 24  6  f 0  2.81134e+01 7.17892e-01 5.11872e+02 342.173 4.68445e+01  -1.50645e+01 0.00000e+00 0.00000e+00 5.37236e+02 342.173 2.53639e+01 342.173 0.9898 
1 1 1 -10 24  7  o 1  1.29724e+01 7.73338e-01 2.33115e+02 53.663  8.08332e+00  1.09892e+01  0.00000e+00 0.00000e+00 2.37313e+02 53.663  4.19817e+00 53.663  0.9626 
1 1 1 -10 24  8  o 1  1.74355e+01 7.12255e-01 3.85251e+02 265.530 -3.07739e+00 -3.93675e+01 0.00000e+00 0.00000e+00 2.62649e+02 265.530 1.22601e+02 85.530  0.9873 
1 1 1 -10 24  9  o 1  1.61226e+01 7.01837e-01 2.78435e+02 40.001  2.39340e+01  2.00838e+01  0.00000e+00 0.00000e+00 3.18069e+02 40.001  3.96342e+01 40.001  0.9839 
1 1 1 -10 24  10 o 2  1.62490e+01 7.00589e-01 2.22143e+02 6.224   2.77590e+01  3.02734e+00  0.00000e+00 0.00000e+00 3.77264e+02 6.224   1.55121e+02 6.224   0.9819 
1 1 1 -10 24  11 o 8  3.81081e+00 1.07344e+00 1.01221e+02 229.611 -2.12798e+00 -2.50131e+00 0.00000e+00 0.00000e+00 1.73342e+01 229.611 8.38869e+01 49.611  0.8290 
1 1 1 -10 24  12 o 16 7.86266e+00 9.15440e-01 1.27023e+02 191.363 -1.06342e+01 -2.13706e+00 0.00000e+00 0.00000e+00 1.53792e+02 191.363 2.67687e+01 191.363 0.9527 
1 1 1 -10 24  13 o 14 6.09883e+00 1.02607e+00 1.75643e+02 68.504  4.83155e+00  1.22679e+01  0.00000e+00 0.00000e+00 4.38798e+01 68.504  1.31763e+02 248.504 0.9613 
1 1 1 -10 24  14 o 8  8.93396e+00 8.30292e-01 2.18749e+02 357.606 2.87718e+01  -1.20270e+00 0.00000e+00 0.00000e+00 1.09506e+02 357.606 1.09243e+02 177.606 0.9825 
1 1 1 -10 24  15 o 15 8.65966e+00 6.72662e-01 1.53972e+02 145.486 -2.02179e+01 1.39027e+01  0.00000e+00 0.00000e+00 1.62800e+02 145.486 8.82842e+00 145.486 0.9794 
1 1 1 -10 24  16 o 7  9.31942e+00 7.56785e-01 1.18840e+02 77.897  4.33476e+00  2.02150e+01  0.00000e+00 0.00000e+00 2.20251e+02 77.897  1.01410e+02 77.897  0.9755 
1 1 1 -10 24  17 o 19 3.85927e+00 1.28755e+00 1.12207e+01 189.401 -6.60523e-01 -1.09363e-01 0.00000e+00 0.00000e+00 3.43894e+01 189.401 2.31687e+01 189.401 0.3173 
1 1 1 -10 24  18 o 14 4.42040e+00 1.41933e+00 9.59063e+01 105.424 -1.75176e+00 6.34945e+00  0.00000e+00 0.00000e+00 5.54425e+01 105.424 4.04637e+01 285.424 0.9206 
1 1 1 -10 25  1  o 4  2.07095e+01 6.56469e-01 2.91227e+02 43.342  1.20632e+01  1.13847e+01  0.00000e+00 0.00000e+00 4.67939e+02 43.342  1.76712e+02 43.342  0.9694 
1 1 1 -10 25  2  f 0  1.72023e+01 6.51806e-01 2.84553e+02 267.253 -6.43690e-01 -1.34167e+01 0.00000e+00 0.00000e+00 3.40956e+02 267.253 5.64028e+01 267.253 0.9620 
1 1 1 -10 25  3  f 0  1.48743e+01 6.57923e-01 3.69004e+02 63.409  6.87221e+00  1.37287e+01  0.00000e+00 0.00000e+00 1.74274e+02 63.409  1.94730e+02 243.409 0.9669 
1 1 1 -10 25  4  o 4  1.55137e+01 1.02262e+00 3.55722e+02 78.737  3.34779e+00  1.68104e+01  0.00000e+00 0.00000e+00 2.12619e+02 78.737  1.43103e+02 258.737 0.9704 
1 1 1 -10 25  5  f 0  1.82236e+01 6.90799e-01 3.39948e+02 282.458 4.24644e+00  -1.92204e+01 0.00000e+00 0.00000e+00 3.29884e+02 282.458 1.00643e+01 102.458 0.9743 
1 1 1 -10 25  6  o 3  1.84157e+01 6.87957e-01 3.19630e+02 66.344  9.18304e+00  2.09629e+01  0.00000e+00 0.00000e+00 3.59293e+02 66.344  3.96625e+01 66.344  0.9779 
1 1 1 -10 25  7  o 1  1.15304e+01 8.06915e-01 1.30094e+02 341.353 6.36594e+00  -2.14825e+00 0.00000e+00 0.00000e+00 2.70479e+02 341.353 1.40385e+02 341.353 0.9222 
1 1 1 -10 25  8  f 0  1.19545e+01 8.11166e-01 1.26894e+02 291.053 3.03044e+00  -7.87288e+00 0.00000e+00 0.00000e+00 2.95464e+02 291.053 1.68570e+02 291.053 0.9387 
1 1 1 -10 25  9  o 8  3.48019e+00 1.03528e+00 3.52514e+01 16.797  7.58528e-01  2.28976e-01  0.00000e+00 0.00000e+00 1.29083e+01 16.797  2.23431e+01 196.797 0.3680 
1 1 1 -10 25  10 o 15 1.03515e+01 8.23505e-01 1.64739e+02 279.657 2.34178e+00  -1.37615e+01 0.00000e+00 0.00000e+00 2.09919e+02 279.657 4.51805e+01 279.657 0.9635 
1 1 1 -10 25  11 o 4  7.13347e+00 9.99395e-01 1.18532e+02 4.462   7.34581e+00  5.73283e-01  0.00000e+00 0.00000e+00 1.30268e+02 4.462   1.17363e+01 4.462   0.9294 
1 1 1 -10 25  12 o 12 1.32064e+01 7.17244e-01 2.34115e+02 112.579 -1.37804e+01 3.31402e+01  0.00000e+00 0.00000e+00 2.53975e+02 112.579 1.98602e+01 112.579 0.9860 
1 1 1 -10 25  13 o 13 7.29668e+00 9.37670e-01 1.21727e+02 12.739  1.10979e+01  2.50901e+00  0.00000e+00 0.00000e+00 1.39172e+02 12.739  1.74452e+01 12.739  0.9550 
1 1 1 -10 25  14 o 19 6.92789e+00 9.59395e-01 1.28428e+02 179.652 -1.23892e+01 7.53058e-02  0.00000e+00 0.00000e+00 1.19954e+02 179.652 8.47435e+00 359.652 0.9588 
1 1 1 -10 25  15 o 10 8.67022e+00 6.41663e-01 1.83044e+02 63.961  1.29879e+01  2.65837e+01  0.00000e+00 0.00000e+00 1.35242e+02 63.961  4.78020e+01 243.961 0.9830 
1 1 1 -10 25  16 o 4  1.10543e+01 6.50637e-01 1.85329e+02 261.842 -5.71594e+00 -3.98746e+01 0.00000e+00 0.00000e+00 2.21807e+02 261.842 3.64780e+01 261.842 0.9875 
1 1 1 -10 25  17 o 15 6.04620e+00 1.66428e+00 8.06934e+01 308.367 3.54436e+00  -4.47713e+00 0.00000e+00 0.00000e+00 1.23685e+02 308.367 4.29918e+01 308.367 0.9076 
1 1 1 -10 25  18 o 3  4.04597e+00 1.35477e+00 4.43010e+01 156.955 -2.75280e+00 1.17103e+00  0.00000e+00 0.00000e+00 7.74794e+01 156.955 3.31784e+01 156.955 0.8094 
1 1 1 -10 26  1  o 2  3.33179e+01 7.61361e-01 5.25955e+02 103.725 -1.13231e+01 4.63602e+01  0.00000e+00 0.00000e+00 7.20640e+02 103.725 1.94685e+02 103.725 0.9895 
1 1 1 -10 26  2  o 13 2.66524e+01 6.85754e-01 4.62326e+02 75.691  8.53100e+00  3.34466e+01  0.00000e+00 0.00000e+00 5.30293e+02 75.691  6.79675e+01 75.691  0.9854 
1 1 1 -10 26  3  o 4  1.02255e+01 7.77953e-01 1.93791e+02 171.274 -5.85123e+00 8.98046e-01  0.00000e+00 0.00000e+00 1.58124e+02 171.274 3.56673e+01 351.274 0.9111 
1 1 1 -10 26  4  o 7  2.67341e+01 6.91028e-01 5.70386e+02 53.203  2.92631e+01  3.91218e+01  0.00000e+00 0.00000e+00 4.28456e+02 53.203  1.41930e+02 233.203 0.9897 
1 1 1 -10 26  5  o 16 1.79307e+01 7.51237e-01 2.55548e+02 170.087 -1.47241e+01 2.57313e+00  0.00000e+00 0.00000e+00 3.97851e+02 170.087 1.42303e+02 170.087 0.9659 
1 1 1 -10 26  6  o 13 2.41930e+01 1.02929e+00 3.30743e+02 285.102 8.50336e+00  -3.15098e+01 0.00000e+00 0.00000e+00 5.67177e+02 285.102 2.36434e+02 285.102 0.9846 
1 1 1 -10 26  7  o 6  8.42158e+00 9.80663e-01 8.99759e+01 311.952 2.32887e+00  -2.59084e+00 0.00000e+00 0.00000e+00 1.76563e+02 311.952 8.65867e+01 311.952 0.8402 
1 1 1 -10 26  8  o 19 9.68710e+00 8.40709e-01 1.71282e+02 83.931  9.68005e-01  9.10451e+00  0.00000e+00 0.00000e+00 1.72760e+02 83.931  1.47816e+00 83.931  0.9437 
1 1 1 -10 26  9  f 0  1.26343e+01 7.28938e-01 3.62154e+02 310.689 2.17349e+01  -2.52787e+01 0.00000e+00 0.00000e+00 1.05712e+02 310.689 2.56442e+02 130.689 0.9849 
1 1 1 -10 26  10 o 13 9.70967e+00 7.98420e-01 1.70880e+02 332.738 1.23031e+01  -6.33978e+00 0.00000e+00 0.00000e+00 1.80408e+02 332.738 9.52756e+00 332.738 0.9632 
1 1 1 -10 26  11 o 7  2.04716e+01 6.75742e-01 3.37183e+02 99.950  -1.26275e+01 7.19821e+01  0.00000e+00 0.00000e+00 4.25708e+02 99.950  8.85259e+01 99.950  0.9931 
1 1 1 -10 26  12 o 11 1.56902e+01 6.87392e-01 3.26674e+02 36.405  5.10261e+01  3.76264e+01  0.00000e+00 0.00000e+00 2.56769e+02 36.405  6.99048e+01 216.405 0.9921 
1 1 1 -10 26  13 o 19 9.89160e+00 7.82099e-01 1.85812e+02 188.483 -2.36490e+01 -3.52734e+00 0.00000e+00 0.00000e+00 1.76684e+02 188.483 9.12844e+00 8.483   0.9789 
1 1 1 -10 26  14 o 2  8.81051e+00 8.28303e-01 1.93790e+02 6.042   2.51486e+01  2.66176e+00  0.00000e+00 0.00000e+00 1.29076e+02 6.042   6.47140e+01 186.042 0.9800 
1 1 1 -10 26  15 o 18 4.57710e+00 9.33687e-01 1.67640e+02 61.054  5.66037e+00  1.02343e+01  0.00000e+00 0.00000e+00 4.19140e+00 241.054 1.71832e+02 241.054 0.9562 
1 1 1 -10 26  16 o 13 1.36177e+01 1.38717e+00 2.38633e+02 255.502 -1.04585e+01 -4.04456e+01 0.00000e+00 0.00000e+00 2.63108e+02 255.502 2.44749e+01 255.502 0.9880 
1 1 1 -10 26  17 o 16 5.56071e+00 1.59287e+00 8.82065e+01 109.153 -1.99135e+00 5.73339e+00  0.00000e+00 0.00000e+00 1.00952e+02 109.153 1.27457e+01 109.153 0.9134 
1 1 1 -10 26  18 o 14 3.60532e+00 1.23671e+00 4.73329e+01 29.865  2.72641e+00  1.56554e+00  0.00000e+00 0.00000e+00 6.26153e+01 29.865  1.52824e+01 29.865  0.8201 
1 1 1 -10 27  1  o 4  2.11139e+01 6.55313e-01 3.53643e+02 250.198 -7.10363e+00 -1.97284e+01 0.00000e+00 0.00000e+00 4.25412e+02 250.198 7.17692e+01 250.198 0.9759 
1 1 1 -10 27  2  o 15 3.59742e+01 7.87081e-01 6.14236e+02 185.156 -6.10100e+01 -5.50472e+00 0.00000e+00 0.00000e+00 7.34157e+02 185.156 1.19922e+02 185.156 0.9918 
1 1 1 -10 27  3  o 14 3.83280e+01 8.22279e-01 4.29573e+02 136.379 -3.37995e+01 3.22110e+01  0.00000e+00 0.00000e+00 1.00253e+03 136.379 5.72952e+02 136.379 0.9892 
1 1 1 -10 27  4  o 15 5.32710e+00 1.12667e+00 1.50047e+02 268.273 -7.12897e-02 -2.36469e+00 0.00000e+00 0.00000e+00 6.81080e-01 268.273 1.49366e+02 88.273  0.7496 
1 1 1 -10 27  5  o 6  1.75428e+01 6.75374e-01 3.88813e+02 207.894 -2.13849e+01 -1.13197e+01 0.00000e+00 0.00000e+00 2.59116e+02 207.894 1.29696e+02 27.894  0.9791 
1 1 1 -10 27  6  o 2  1.26184e+01 7.56080e-01 2.61633e+02 322.001 1.09935e+01  -8.58868e+00 0.00000e+00 0.00000e+00 1.96630e+02 322.001 6.50030e+01 142.001 0.9635 
1 1 1 -10 27  7  o 5  9.94221e+00 8.44326e-01 2.64829e+02 319.536 9.20493e+00  -7.85178e+00 0.00000e+00 0.00000e+00 9.38094e+01 319.536 1.71020e+02 139.536 0.9577 
1 1 1 -10 27  8  o 15 1.04700e+01 1.10040e+00 2.67005e+02 288.821 4.76349e+00  -1.39756e+01 0.00000e+00 0.00000e+00 1.13414e+02 288.821 1.53591e+02 108.821 0.9655 
1 1 1 -10 27  9  o 15 2.64675e+01 6.82383e-01 3.94833e+02 164.969 -7.46177e+01 2.00370e+01  0.00000e+00 0.00000e+00 5.93805e+02 164.969 1.98972e+02 164.969 0.9935 
1 1 1 -10 27  10 o 7  2.85035e+00 8.79077e-01 3.22801e+01 220.736 -5.68387e-01 -4.89519e-01 0.00000e+00 0.00000e+00 5.29121e+00 220.736 2.69889e+01 40.736  0.3509 
1 1 1 -10 27  11 o 6  3.95538e+00 1.05345e+00 7.49345e+01 135.310 -1.94453e+00 1.92357e+00  0.00000e+00 0.00000e+00 4.20610e+01 135.310 3.28735e+01 315.310 0.7883 
1 1 1 -10 27  12 o 19 5.83007e+00 1.01914e+00 9.30821e+01 175.707 -6.15086e+00 4.61700e-01  0.00000e+00 0.00000e+00 1.06829e+02 175.707 1.37468e+01 175.707 0.9149 
1 1 1 -10 27  13 o 6  1.25916e+01 7.15203e-01 2.62605e+02 191.925 -4.46901e+01 -9.43823e+00 0.00000e+00 0.00000e+00 2.03581e+02 191.925 5.90233e+01 11.925  0.9890 
1 1 1 -10 27  14 o 13 8.24935e+00 8.68456e-01 1.23577e+02 141.532 -1.16108e+01 9.22495e+00  0.00000e+00 0.00000e+00 1.74275e+02 141.532 5.06986e+01 141.532 0.9657 
1 1 1 -10 27  15 o 10 9.85926e+00 6.18279e-01 2.07195e+02 327.206 3.03615e+01  -1.95619e+01 0.00000e+00 0.00000e+00 1.55832e+02 327.206 5.13627e+01 147.206 0.9861 
1 1 1 -10 27  16 o 8  9.04881e+00 1.68609e+00 1.27530e+02 165.491 -1.18792e+01 3.07419e+00  0.00000e+00 0.00000e+00 1.95853e+02 165.491 6.83228e+01 165.491 0.9583 
1 1 1 -10 27  17 o 15 4.06179e+00 1.33085e+00 8.31734e+01 266.943 -2.70434e-01 -5.06405e+00 0.00000e+00 0.00000e+00 5.22014e+01 266.943 3.09720e+01 86.943  0.8950 
1 1 1 -10 27  18 f 0  5.86421e+00 1.73490e+00 9.04024e+01 90.352  -3.91092e-02 6.36220e+00  0.00000e+00 0.00000e+00 1.09693e+02 90.352  1.92908e+01 90.352  0.9176 
1 1 1 -10 28  1  o 9  7.18071e+00 9.80433e-01 2.55792e+02 281.191 9.71080e-01  -4.90837e+00 0.00000e+00 0.00000e+00 1.32283e+01 101.191 2.69021e+02 101.191 0.8935 
1 1 1 -10 28  2  o 5  1.58085e+01 6.55539e-01 2.18084e+02 258.268 -2.11677e+00 -1.01927e+01 0.00000e+00 0.00000e+00 3.49845e+02 258.268 1.31761e+02 258.268 0.9507 
1 1 1 -10 28  3  o 9  3.98413e+01 8.40862e-01 6.58046e+02 69.149  2.63342e+01  6.91385e+01  0.00000e+00 0.00000e+00 8.36483e+02 69.149  1.78437e+02 69.149  0.9932 
1 1 1 -10 28  4  o 6  1.47764e+01 1.17643e+00 2.74942e+02 325.175 9.78188e+00  -6.80499e+00 0.00000e+00 0.00000e+00 2.58849e+02 325.175 1.60930e+01 145.175 0.9571 
1 1 1 -10 28  5  o 17 1.45556e+01 6.97866e-01 2.81503e+02 133.495 -9.95229e+00 1.04895e+01  0.00000e+00 0.00000e+00 2.48185e+02 133.495 3.33178e+01 313.495 0.9648 
1 1 1 -10 28  6  o 15 2.84862e+01 7.27541e-01 4.61977e+02 148.543 -4.74176e+01 2.90087e+01  0.00000e+00 0.00000e+00 6.02006e+02 148.543 1.40029e+02 148.543 0.9910 
1 1 1 -10 28  7  o 9  1.29917e+01 7.39040e-01 2.23509e+02 350.819 1.33236e+01  -2.15345e+00 0.00000e+00 0.00000e+00 2.47285e+02 350.819 2.37754e+01 350.819 0.9622 
1 1 1 -10 28  8  o 16 1.75842e+01 8.49290e-01 3.27506e+02 320.414 2.45898e+01  -2.03323e+01 0.00000e+00 0.00000e+00 3.23714e+02 320.414 3.79146e+00 140.414 0.9842 
1 1 1 -10 28  9  o 6  9.58888e+00 8.29921e-01 1.86540e+02 138.334 -9.56447e+00 8.51140e+00  0.00000e+00 0.00000e+00 1.59568e+02 138.334 2.69721e+01 318.334 0.9601 
1 1 1 -10 28  10 o 2  1.72460e+01 6.74570e-01 3.30199e+02 247.588 -1.95683e+01 -4.74479e+01 0.00000e+00 0.00000e+00 3.11172e+02 247.588 1.90278e+01 67.588  0.9902 
1 1 1 -10 28  11 o 9  1.95254e+01 6.68996e-01 2.68714e+02 59.122  2.80159e+01  4.68515e+01  0.00000e+00 0.00000e+00 4.57096e+02 59.122  1.88382e+02 59.122  0.9908 
1 1 1 -10 28  12 o 16 3.41926e+00 9.72902e-01 3.74378e+01 318.050 1.10238e+00  -9.90863e-01 0.00000e+00 0.00000e+00 3.83855e+01 318.050 9.47761e-01 318.050 0.5917 
1 1 1 -10 28  13 o 18 1.32120e+01 7.23426e-01 2.32546e+02 79.811  7.47405e+00  4.15843e+01  0.00000e+00 0.00000e+00 2.56128e+02 79.811  2.35815e+01 79.811  0.9881 
1 1 1 -10 28  14 o 6  9.37385e+00 7.63792e-01 1.68501e+02 229.067 -1.64665e+01 -1.89871e+01 0.00000e+00 0.00000e+00 1.74913e+02 229.067 6.41200e+00 229.067 0.9799 
1 1 1 -10 28  15 o 7  4.41571e+00 8.87472e-01 6.45661e+01 67.189  1.86827e+00  4.44200e+00  0.00000e+00 0.00000e+00 8.20103e+01 67.189  1.74443e+01 67.189  0.8890 
1 1 1 -10 28  16 o 7  3.78387e+00 1.24399e+00 1.09921e+02 56.061  3.31836e+00  4.93090e+00  0.00000e+00 0.00000e+00 1.86825e+01 56.061  9.12382e+01 236.060 0.9115 
1 1 1 -10 28  17 o 4  7.04275e+00 1.76562e+00 1.21766e+02 190.113 -9.10940e+00 -1.62471e+00 0.00000e+00 0.00000e+00 1.25872e+02 190.113 4.10600e+00 190.113 0.9443 
1 1 1 -10 29  1  o 15 2.67430e+01 7.82139e-01 5.05575e+02 82.302  5.41284e+00  4.00447e+01  0.00000e+00 0.00000e+00 4.92852e+02 82.302  1.27227e+01 262.302 0.9875 
1 1 1 -10 29  2  o 6  2.80161e+01 6.94264e-01 4.38625e+02 107.515 -1.06034e+01 3.35993e+01  0.00000e+00 0.00000e+00 6.04865e+02 107.515 1.66240e+02 107.515 0.9857 
1 1 1 -10 29  3  o 6  9.50560e+00 7.83149e-01 9.48134e+01 333.881 2.57430e+00  -1.26218e+00 0.00000e+00 0.00000e+00 1.92248e+02 333.881 9.74348e+01 333.881 0.7997 
1 1 1 -10 29  4  o 16 1.86733e+01 6.60885e-01 3.17057e+02 209.532 -1.64381e+01 -9.31221e+00 0.00000e+00 0.00000e+00 3.68796e+02 209.532 5.17390e+01 209.532 0.9732 
1 1 1 -10 29  5  o 1  3.08746e+01 7.35363e-01 7.57026e+02 100.404 -1.44394e+01 7.86419e+01  0.00000e+00 0.00000e+00 4.00144e+02 100.404 3.56882e+02 280.404 0.9937 
1 1 1 -10 29  6  o 7  1.81128e+01 7.79908e-01 4.09250e+02 165.086 -3.09566e+01 8.24516e+00  0.00000e+00 0.00000e+00 2.62655e+02 165.086 1.46596e+02 345.086 0.9843 
1 1 1 -10 29  7  o 17 2.44930e+01 8.05879e-01 5.32382e+02 321.504 5.03878e+01  -4.00748e+01 0.00000e+00 0.00000e+00 3.82792e+02 321.504 1.49590e+02 141.504 0.9922 
1 1 1 -10 29  8  o 6  2.08900e+01 6.48469e-01 2.84025e+02 303.787 2.01010e+01  -3.00415e+01 0.00000e+00 0.00000e+00 4.91028e+02 303.787 2.07003e+02 303.787 0.9861 
1 1 1 -10 29  9  o 2  6.91736e+00 1.00781e+00 2.06987e+02 168.177 -9.43594e+00 1.97523e+00  0.00000e+00 0.00000e+00 3.91644e+01 168.177 1.67823e+02 348.177 0.9466 
1 1 1 -10 29  10 o 7  2.52023e+01 6.84193e-01 4.95445e+02 210.782 -9.63373e+01 -5.73868e+01 0.00000e+00 0.00000e+00 4.46777e+02 210.782 4.86685e+01 30.782  0.9955 
1 1 1 -10 29  11 o 8  7.89414e+00 8.64929e-01 1.17659e+02 72.864  2.80716e+00  9.10433e+00  0.00000e+00 0.00000e+00 1.62488e+02 72.864  4.48295e+01 72.864  0.9460 
1 1 1 -10 29  12 o 12 3.66623e+00 1.06507e+00 8.57841e+01 241.695 -1.65603e+00 -3.07499e+00 0.00000e+00 0.00000e+00 2.97189e+01 241.695 5.60652e+01 61.695  0.8407 
1 1 1 -10 29  13 o 10 1.80258e+01 6.52694e-01 3.22715e+02 206.685 -7.77324e+01 -3.90700e+01 0.00000e+00 0.00000e+00 3.48099e+02 206.685 2.53839e+01 206.685 0.9942 
1 1 1 -10 29  14 o 2  3.47341e+00 9.81036e-01 4.58664e+01 190.161 -2.23975e+00 -4.01436e-01 0.00000e+00 0.00000e+00 4.99886e+01 190.161 4.12224e+00 190.161 0.7382 
1 1 1 -10 29  15 o 16 3.96313e+00 8.89058e-01 5.45527e+01 62.300  1.77348e+00  3.37801e+00  0.00000e+00 0.00000e+00 7.21099e+01 62.300  1.75572e+01 62.300  0.8560 
1 1 1 -10 29  16 o 12 4.59601e+00 1.39204e+00 2.78860e+01 326.536 1.39890e+00  -9.24636e-01 0.00000e+00 0.00000e+00 8.12580e+01 326.536 5.33721e+01 326.536 0.6369 
1 1 1 -10 29  17 o 11 5.78076e+00 1.60335e+00 4.92934e+01 165.218 -3.36043e+00 8.86758e-01  0.00000e+00 0.00000e+00 1.31462e+02 165.218 8.21691e+01 165.218 0.8398 
1 1 1 -10 30  1  o 3  3.13779e+01 7.35378e-01 5.18446e+02 240.138 -2.31483e+01 -4.03177e+01 0.00000e+00 0.00000e+00 6.54868e+02 240.138 1.36422e+02 240.138 0.9892 
1 1 1 -10 30  2  o 5  1.00428e+01 7.51796e-01 8.12153e+01 297.435 1.06887e+00  -2.05897e+00 0.00000e+00 0.00000e+00 2.01058e+02 297.435 1.19842e+02 297.435 0.7439 
1 1 1 -10 30  3  o 6  1.98238e+01 6.37248e-01 4.09395e+02 229.200 -1.65027e+01 -1.91186e+01 0.00000e+00 0.00000e+00 3.24220e+02 229.200 8.51746e+01 49.200  0.9800 
1 1 1 -10 30  4  o 10 1.89148e+01 6.61273e-01 4.14845e+02 330.431 2.24662e+01  -1.27466e+01 0.00000e+00 0.00000e+00 2.85020e+02 330.431 1.29826e+02 150.431 0.9804 
1 1 1 -10 30  5  o 15 2.17029e+01 6.63085e-01 4.04784e+02 296.921 1.55299e+01  -3.05838e+01 0.00000e+00 0.00000e+00 4.01683e+02 296.921 3.10093e+00 116.921 0.9853 
1 1 1 -10 30  6  o 16 1.90724e+01 6.65804e-01 3.25897e+02 137.632 -2.00632e+01 1.82997e+01  0.00000e+00 0.00000e+00 3.79495e+02 137.632 5.35973e+01 137.632 0.9814 
1 1 1 -10 30  7  o 14 8.76722e+00 9.30361e-01 1.38722e+02 270.275 3.01972e-02  -6.29830e+00 0.00000e+00 0.00000e+00 1.63930e+02 270.275 2.52079e+01 270.275 0.9168 
1 1 1 -10 30  8  o 2  1.04367e+01 7.76539e-01 2.49566e+02 38.318  1.24344e+01  9.82651e+00  0.00000e+00 0.00000e+00 1.30496e+02 38.318  1.19070e+02 218.318 0.9679 
1 1 1 -10 30  9  o 16 8.76147e+00 8.46934e-01 2.10540e+02 209.901 -1.17835e+01 -6.77614e+00 0.00000e+00 0.00000e+00 1.06433e+02 209.901 1.04107e+02 29.901  0.9625 
1 1 1 -10 30  10 o 11 5.23975e+00 1.09743e+00 1.87073e+02 132.033 -5.23451e+00 5.80669e+00  0.00000e+00 0.00000e+00 3.36639e+00 312.033 1.90439e+02 312.033 0.9337 
1 1 1 -10 30  11 o 2  4.00453e+00 1.02987e+00 5.22000e+01 175.569 -1.95325e+00 1.51367e-01  0.00000e+00 0.00000e+00 5.15921e+01 175.569 6.07905e-01 355.569 0.6909 
1 1 1 -10 30  12 o 10 5.91312e+00 1.09045e+00 9.48782e+01 333.089 5.22614e+00  -2.65262e+00 0.00000e+00 0.00000e+00 1.06779e+02 333.089 1.19013e+01 333.089 0.9101 
1 1 1 -10 30  13 o 18 3.12789e+00 9.52665e-01 7.98163e+01 36.404  2.59086e+00  1.91044e+00  0.00000e+00 0.00000e+00 1.67594e+01 36.404  6.30570e+01 216.404 0.8250 
1 1 1 -10 30  14 o 13 6.38394e+00 9.14609e-01 1.71474e+02 147.457 -1.27738e+01 8.15111e+00  0.00000e+00 0.00000e+00 5.91497e+01 147.457 1.12324e+02 327.457 0.9664 
1 1 1 -10 30  15 o 1  1.00604e+01 5.89894e-01 1.54912e+02 7.607   3.18694e+01  4.25629e+00  0.00000e+00 0.00000e+00 2.14784e+02 7.607   5.98716e+01 7.607   0.9843 
1 1 1 -10 30  16 o 2  3.38949e+00 1.14223e+00 4.14892e+01 14.998  2.13057e+00  5.70797e-01  0.00000e+00 0.00000e+00 5.06106e+01 14.998  9.12134e+00 14.998  0.7288 
1 1 1 -10 30  17 o 13 4.95672e+00 1.50866e+00 6.79084e+01 177.690 -4.39152e+00 1.77125e-01  0.00000e+00 0.00000e+00 9.39615e+01 177.690 2.60531e+01 177.690 0.8772 
1 1 1 -10 31  1  o 7  1.91581e+01 6.59672e-01 4.01163e+02 38.299  1.72729e+01  1.36410e+01  0.00000e+00 0.00000e+00 3.06341e+02 38.299  9.48225e+01 218.299 0.9770 
1 1 1 -10 31  2  o 2  1.56367e+01 6.73422e-01 3.31842e+02 0.279   1.66681e+01  8.11298e-02  0.00000e+00 0.00000e+00 2.40906e+02 0.279   9.09360e+01 180.279 0.9695 
1 1 1 -10 31  3  o 8  1.79987e+01 6.45172e-01 3.54040e+02 295.004 8.35068e+00  -1.79049e+01 0.00000e+00 0.00000e+00 3.08142e+02 295.004 4.58986e+01 115.004 0.9744 
1 1 1 -10 31  4  o 1  1.03808e+01 1.38251e+00 1.27580e+02 115.476 -1.84295e+00 3.86794e+00  0.00000e+00 0.00000e+00 2.14647e+02 115.476 8.70670e+01 115.476 0.8736 
1 1 1 -10 31  5  o 1  2.43767e+01 6.82553e-01 3.53654e+02 186.521 -3.32808e+01 -3.80442e+00 0.00000e+00 0.00000e+00 5.51766e+02 186.521 1.98113e+02 186.521 0.9850 
1 1 1 -10 31  6  o 8  1.36129e+01 8.93152e-01 1.56471e+02 160.123 -8.88014e+00 3.21060e+00  0.00000e+00 0.00000e+00 3.28520e+02 160.123 1.72049e+02 160.123 0.9455 
1 1 1 -10 31  7  o 14 1.14079e+01 9.67146e-01 9.39498e+01 220.273 -4.19427e+00 -3.55354e+00 0.00000e+00 0.00000e+00 2.94247e+02 220.273 2.00297e+02 220.273 0.9038 
1 1 1 -10 31  8  o 7  8.31978e+00 8.61430e-01 2.72525e+02 240.162 -6.73902e+00 -1.17488e+01 0.00000e+00 0.00000e+00 2.86776e+01 240.162 2.43847e+02 60.162  0.9623 
1 1 1 -10 31  9  o 14 1.18088e+01 7.07056e-01 2.04531e+02 196.668 -1.75399e+01 -5.25138e+00 0.00000e+00 0.00000e+00 2.27008e+02 196.668 2.24772e+01 196.668 0.9723 
1 1 1 -10 31  10 o 4  3.50542e+00 9.91108e-01 7.94735e+01 35.227  1.87640e+00  1.32499e+00  0.00000e+00 0.00000e+00 1.80579e+01 35.227  6.14156e+01 215.227 0.7410 
1 1 1 -10 31  11 o 3  9.94340e+00 7.79233e-01 1.81066e+02 186.142 -1.81972e+01 -1.95836e+00 0.00000e+00 0.00000e+00 1.81563e+02 186.142 4.96636e-01 186.142 0.9723 
1 1 1 -10 31  12 o 11 6.65248e+00 9.70496e-01 1.21033e+02 161.765 -8.38342e+00 2.76201e+00  0.00000e+00 0.00000e+00 1.13643e+02 161.765 7.39037e+00 341.765 0.9415 
1 1 1 -10 31  13 o 16 5.32080e+00 1.05484e+00 5.79348e+01 220.299 -2.88533e+00 -2.44688e+00 0.00000e+00 0.00000e+00 1.12243e+02 220.299 5.43084e+01 220.299 0.8546 
1 1 1 -10 31  14 o 18 2.77079e+00 8.72853e-01 5.02044e+01 248.745 -7.97144e-01 -2.04936e+00 0.00000e+00 0.00000e+00 2.51794e+01 248.745 2.50250e+01 68.745  0.7279 
1 1 1 -10 31  15 o 6  3.16374e+00 8.76803e-01 1.40675e+02 38.970  5.79002e+00  4.68372e+00  0.00000e+00 0.00000e+00 3.08162e+01 218.970 1.71491e+02 218.970 0.9302 
1 1 1 -10 31  16 o 18 5.44834e+00 1.42332e+00 9.98391e+01 20.662  6.58620e+00  2.48370e+00  0.00000e+00 0.00000e+00 8.82335e+01 20.662  1.16056e+01 200.662 0.9260 
1 1 1 -10 31  17 o 14 6.20801e+00 1.60781e+00 5.50822e+01 319.099 3.24608e+00  -2.81191e+00 0.00000e+00 0.00000e+00 1.46895e+02 319.099 9.18123e+01 319.099 0.8740 
1 1 1 -10 32  1  o 10 1.82627e+01 6.60692e-01 3.02416e+02 182.487 -1.77384e+01 -7.70527e-01 0.00000e+00 0.00000e+00 3.68101e+02 182.487 6.56852e+01 182.487 0.9714 
1 1 1 -10 32  2  o 6  3.98181e+01 8.41718e-01 6.46740e+02 263.330 -9.14482e+00 -7.81987e+01 0.00000e+00 0.00000e+00 8.47874e+02 263.330 2.01134e+02 263.330 0.9936 
1 1 1 -10 32  3  o 15 1.56912e+01 6.60872e-01 3.30339e+02 145.233 -1.35885e+01 9.43267e+00  0.00000e+00 0.00000e+00 2.43898e+02 145.233 8.64408e+01 325.233 0.9693 
1 1 1 -10 32  4  o 10 3.21783e+01 7.51579e-01 6.79040e+02 119.648 -3.79627e+01 6.66950e+01  0.00000e+00 0.00000e+00 5.27191e+02 119.648 1.51849e+02 299.648 0.9935 
1 1 1 -10 32  5  o 17 1.48235e+01 6.81484e-01 2.44833e+02 249.360 -5.45723e+00 -1.44877e+01 0.00000e+00 0.00000e+00 2.95750e+02 249.360 5.09170e+01 249.360 0.9671 
1 1 1 -10 32  6  o 16 1.20830e+01 7.16054e-01 2.06057e+02 201.183 -1.11169e+01 -4.30813e+00 0.00000e+00 0.00000e+00 2.29685e+02 201.183 2.36279e+01 201.183 0.9571 
1 1 1 -10 32  7  o 11 4.18484e+00 1.01170e+00 5.08092e+01 29.915  1.02440e+00  5.89425e-01  0.00000e+00 0.00000e+00 2.90917e+01 29.915  2.17174e+01 209.915 0.5071 
1 1 1 -10 32  8  o 5  1.19349e+01 6.91797e-01 2.48759e+02 281.312 3.92956e+00  -1.96437e+01 0.00000e+00 0.00000e+00 1.88839e+02 281.312 5.99203e+01 101.312 0.9747 
1 1 1 -10 32  9  o 3  1.81633e+01 7.44798e-01 4.00403e+02 74.639  1.56497e+01  5.69688e+01  0.00000e+00 0.00000e+00 2.76405e+02 74.639  1.23998e+02 254.639 0.9915 
1 1 1 -10 32  10 o 9  4.27250e+00 1.01890e+00 7.26636e+01 160.075 -2.50609e+00 9.08410e-01  0.00000e+00 0.00000e+00 5.27573e+01 160.075 1.99064e+01 340.075 0.7819 
1 1 1 -10 32  11 o 9  6.78771e+00 9.47220e-01 1.09091e+02 145.123 -6.15205e+00 4.28806e+00  0.00000e+00 0.00000e+00 1.27848e+02 145.123 1.87564e+01 145.123 0.9307 
1 1 1 -10 32  12 o 4  1.02003e+01 7.59476e-01 1.32672e+02 258.754 -3.42369e+00 -1.72181e+01 0.00000e+00 0.00000e+00 2.38424e+02 258.754 1.05752e+02 258.754 0.9711 
1 1 1 -10 32  13 o 3  3.40400e+00 9.12387e-01 9.26533e+01 75.003  1.05354e+00  3.93261e+00  0.00000e+00 0.00000e+00 1.76837e+01 75.003  7.49696e+01 255.003 0.8662 
1 1 1 -10 32  14 o 14 4.61601e+00 9.03286e-01 3.47413e+01 14.885  2.23878e+00  5.95073e-01  0.00000e+00 0.00000e+00 9.35240e+01 14.885  5.87827e+01 14.885  0.7435 
1 1 1 -10 32  15 o 14 7.76445e+00 5.54419e-01 1.04342e+02 20.177  1.52416e+01  5.60075e+00  0.00000e+00 0.00000e+00 1.76406e+02 20.177  7.20633e+01 20.177  0.9687 
1 1 1 -10 32  16 o 1  6.78884e+00 1.61502e+00 1.23441e+02 344.566 9.42228e+00  -2.60134e+00 0.00000e+00 0.00000e+00 1.16304e+02 344.566 7.13659e+00 164.566 0.9474 
1 1 1 -10 32  17 o 10 6.11713e+00 1.70838e+00 1.05471e+02 176.595 -7.50554e+00 4.46567e-01  0.00000e+00 0.00000e+00 1.06497e+02 176.595 1.02625e+00 176.595 0.9309 
1 1 1 -10 33  1  o 19 2.93968e+01 7.21941e-01 4.54014e+02 293.629 1.65288e+01  -3.77807e+01 0.00000e+00 0.00000e+00 6.43399e+02 293.629 1.89385e+02 293.629 0.9878 
1 1 1 -10 33  2  o 19 2.79998e+01 7.03460e-01 6.08995e+02 32.529  4.58738e+01  2.92571e+01  0.00000e+00 0.00000e+00 4.38887e+02 32.529  1.70108e+02 212.529 0.9908 
1 1 1 -10 33  3  o 3  2.20344e+01 6.56506e-01 3.87699e+02 276.935 3.39621e+00  -2.79207e+01 0.00000e+00 0.00000e+00 4.29226e+02 276.935 4.15271e+01 276.935 0.9821 
1 1 1 -10 33  4  o 9  3.41278e+01 7.69951e-01 6.71471e+02 267.047 -4.02540e+00 -7.80298e+01 0.00000e+00 0.00000e+00 6.07871e+02 267.047 6.36002e+01 87.047  0.9936 
1 1 1 -10 33  5  o 6  2.22738e+01 6.64053e-01 3.24545e+02 256.825 -7.01108e+00 -2.99503e+01 0.00000e+00 0.00000e+00 5.01489e+02 256.825 1.76945e+02 256.825 0.9836 
1 1 1 -10 33  6  o 2  1.01592e+01 7.69378e-01 2.00220e+02 213.813 -7.85385e+00 -5.26024e+00 0.00000e+00 0.00000e+00 1.61683e+02 213.813 3.85372e+01 33.813  0.9455 
1 1 1 -10 33  7  o 5  1.64581e+01 6.26057e-01 3.80884e+02 125.301 -2.06913e+01 2.92220e+01  0.00000e+00 0.00000e+00 2.29976e+02 125.301 1.50908e+02 305.301 0.9859 
1 1 1 -10 33  8  o 1  1.03569e+01 7.69158e-01 1.89906e+02 266.450 -8.36503e-01 -1.34821e+01 0.00000e+00 0.00000e+00 1.84942e+02 266.450 4.96415e+00 86.450  0.9622 
1 1 1 -10 33  9  o 1  2.18012e+01 6.46878e-01 4.10327e+02 66.793  2.76204e+01  6.44228e+01  0.00000e+00 0.00000e+00 4.03062e+02 66.793  7.26509e+00 246.793 0.9928 
1 1 1 -10 33  10 o 6  3.85867e+00 1.00358e+00 5.77449e+01 294.751 8.03342e-01  -1.74248e+00 0.00000e+00 0.00000e+00 4.13349e+01 294.751 1.64100e+01 114.751 0.6840 
1 1 1 -10 33  11 o 3  5.77834e+00 9.38695e-01 8.64764e+01 288.430 1.51257e+00  -4.53903e+00 0.00000e+00 0.00000e+00 1.05982e+02 288.430 1.95058e+01 288.430 0.8881 
1 1 1 -10 33  12 o 15 7.89476e+00 8.81419e-01 1.63909e+02 86.033  1.06369e+00  1.53397e+01  0.00000e+00 0.00000e+00 1.22051e+02 86.033  4.18587e+01 266.033 0.9669 
1 1 1 -10 33  13 o 15 2.76612e+00 8.79626e-01 3.66915e+01 268.464 -4.02619e-02 -1.50171e+00 0.00000e+00 0.00000e+00 2.50658e+01 268.464 1.16256e+01 88.464  0.5967 
1 1 1 -10 33  14 o 14 7.84164e+00 8.15050e-01 1.11187e+02 84.249  1.31350e+00  1.30426e+01  0.00000e+00 0.00000e+00 1.70455e+02 84.249  5.92680e+01 84.249  0.9611 
1 1 1 -10 33  15 o 6  1.55067e+01 4.75311e-01 2.64747e+02 293.823 3.14541e+01  -7.12398e+01 0.00000e+00 0.00000e+00 3.10282e+02 293.823 4.55355e+01 293.823 0.9936 
1 1 1 -10 33  16 o 19 3.72741e+00 1.22150e+00 6.47560e+01 348.449 3.61991e+00  -7.39803e-01 0.00000e+00 0.00000e+00 5.34272e+01 348.449 1.13289e+01 168.449 0.8507 
1 1 1 -10 33  17 o 12 5.12307e+00 1.55712e+00 4.16120e+01 186.672 -2.87065e+00 -3.35811e-01 0.00000e+00 0.00000e+00 1.11225e+02 186.672 6.96130e+01 186.672 0.8015 
1 1 1 -10 34  1  o 9  2.50065e+01 7.86771e-01 4.61917e+02 347.618 3.57129e+01  -7.83988e+00 0.00000e+00 0.00000e+00 4.70030e+02 347.618 8.11363e+00 347.618 0.9862 
1 1 1 -10 34  2  o 11 3.04684e+01 7.30419e-01 6.37371e+02 209.650 -5.35107e+01 -3.04600e+01 0.00000e+00 0.00000e+00 5.04033e+02 209.650 1.33338e+02 29.650  0.9918 
1 1 1 -10 34  3  o 13 2.93455e+01 7.10805e-01 5.78100e+02 72.395  1.81467e+01  5.71881e+01  0.00000e+00 0.00000e+00 5.20388e+02 72.395  5.77130e+01 252.395 0.9916 
1 1 1 -10 34  4  o 12 5.30590e+01 1.04641e+00 9.44068e+02 298.505 8.90087e+01  -1.63902e+02 0.00000e+00 0.00000e+00 1.05224e+03 298.505 1.08172e+02 298.505 0.9973 
1 1 1 -10 34  5  o 14 1.30134e+01 1.07199e+00 2.03927e+02 294.758 4.59975e+00  -9.97373e+00 0.00000e+00 0.00000e+00 2.63780e+02 294.758 5.98523e+01 294.758 0.9533 
1 1 1 -10 34  6  o 3  3.56998e+01 7.92116e-01 5.00787e+02 147.316 -6.94493e+01 4.45584e+01  0.00000e+00 0.00000e+00 8.35927e+02 147.316 3.35140e+02 147.316 0.9939 
1 1 1 -10 34  7  o 7  1.49973e+01 6.39801e-01 3.15964e+02 199.862 -2.55873e+01 -9.24322e+00 0.00000e+00 0.00000e+00 2.38089e+02 199.862 7.78748e+01 19.862  0.9814 
1 1 1 -10 34  8  o 8  8.49154e+00 8.45176e-01 1.65965e+02 73.317  2.87817e+00  9.60380e+00  0.00000e+00 0.00000e+00 1.37027e+02 73.317  2.89371e+01 253.317 0.9487 
1 1 1 -10 34  9  o 3  1.10031e+01 6.96687e-01 1.20329e+02 292.410 4.26368e+00  -1.03392e+01 0.00000e+00 0.00000e+00 2.74171e+02 292.410 1.53843e+02 292.410 0.9542 
1 1 1 -10 34  10 o 17 8.75219e+00 7.88026e-01 2.39716e+02 101.529 -3.89604e+00 1.91006e+01  0.00000e+00 0.00000e+00 8.02831e+01 101.529 1.59433e+02 281.529 0.9740 
1 1 1 -10 34  11 o 7  1.78752e+01 6.75952e-01 2.95834e+02 276.072 6.28497e+00  -5.90858e+01 0.00000e+00 0.00000e+00 3.68801e+02 276.072 7.29676e+01 276.072 0.9915 
1 1 1 -10 34  12 o 12 1.63328e+01 6.68011e-01 2.90923e+02 125.288 -3.76619e+01 5.32162e+01  0.00000e+00 0.00000e+00 3.16149e+02 125.288 2.52259e+01 125.288 0.9923 
1 1 1 -10 34  13 o 18 1.09975e+01 7.67160e-01 1.87439e+02 253.416 -8.95419e+00 -3.00669e+01 0.00000e+00 0.00000e+00 2.17405e+02 253.416 2.99664e+01 253.416 0.9839 
1 1 1 -10 34  14 o 8  8.19082e+00 8.42748e-01 1.53871e+02 268.451 -5.57345e-01 -2.06097e+01 0.00000e+00 0.00000e+00 1.44684e+02 268.451 9.18630e+00 88.451  0.9754 
1 1 1 -10 34  15 o 5  6.89446e+00 5.73660e-01 1.39012e+02 220.738 -1.47288e+01 -1.26856e+01 0.00000e+00 0.00000e+00 1.11579e+02 220.738 2.74336e+01 40.738  0.9739 
1 1 1 -10 34  16 o 6  5.10810e+00 1.47793e+00 9.20297e+01 65.800  2.49920e+00  5.56094e+00  0.00000e+00 0.00000e+00 8.19421e+01 65.800  1.00876e+01 245.800 0.9138 
1 1 1 -10 34  17 o 13 3.49153e+00 1.24351e+00 2.16854e+01 253.721 -3.69276e-01 -1.26453e+00 0.00000e+00 0.00000e+00 4.94758e+01 253.721 2.77905e+01 253.721 0.5476 
1 1 1 -10 35  1  f 0  1.69304e+01 1.16223e+00 4.37659e+02 87.319  1.08168e+00  2.31020e+01  0.00000e+00 0.00000e+00 1.88069e+02 87.319  2.49590e+02 267.319 0.9781 
1 1 1 -10 35  2  o 3  5.22906e+00 1.08647e+00 1.11325e+02 321.011 1.42241e+00  -1.15139e+00 0.00000e+00 0.00000e+00 2.05511e+01 321.011 9.07740e+01 141.011 0.6678 
1 1 1 -10 35  3  o 9  2.11894e+01 6.56346e-01 3.52134e+02 333.575 2.30741e+01  -1.14665e+01 0.00000e+00 0.00000e+00 4.31989e+02 333.575 7.98553e+01 333.575 0.9804 
1 1 1 -10 35  4  o 14 1.57119e+01 6.71254e-01 2.60827e+02 245.166 -7.36854e+00 -1.59224e+01 0.00000e+00 0.00000e+00 3.14712e+02 245.166 5.38849e+01 245.166 0.9711 
1 1 1 -10 35  5  o 14 2.49549e+01 6.79924e-01 5.19034e+02 208.146 -5.22226e+01 -2.79385e+01 0.00000e+00 0.00000e+00 4.13700e+02 208.146 1.05334e+02 28.146  0.9915 
1 1 1 -10 35  6  o 11 1.85030e+01 6.59146e-01 3.52928e+02 307.108 1.98358e+01  -2.62200e+01 0.00000e+00 0.00000e+00 3.33369e+02 307.108 1.95589e+01 127.108 0.9847 
1 1 1 -10 35  7  f 0  2.48206e+01 6.47493e-01 5.15460e+02 170.659 -7.22113e+01 1.18786e+01  0.00000e+00 0.00000e+00 4.12345e+02 170.659 1.03115e+02 350.659 0.9931 
1 1 1 -10 35  8  o 11 3.80651e+00 1.04946e+00 7.02643e+01 118.758 -8.74273e-01 1.59303e+00  0.00000e+00 0.00000e+00 2.49785e+01 118.758 4.52858e+01 298.758 0.6653 
1 1 1 -10 35  9  o 19 7.99104e+00 8.18989e-01 1.26548e+02 270.082 1.18966e-02  -8.27541e+00 0.00000e+00 0.00000e+00 1.54915e+02 270.082 2.83665e+01 270.082 0.9375 
1 1 1 -10 35  10 o 6  2.82919e+00 8.73854e-01 8.39110e+01 132.475 -1.45411e+00 1.58825e+00  0.00000e+00 0.00000e+00 7.30206e+00 312.475 9.12131e+01 312.475 0.7214 
1 1 1 -10 35  11 o 4  5.52466e+00 1.03641e+00 1.98113e+02 200.680 -1.01630e+01 -3.83626e+00 0.00000e+00 0.00000e+00 7.42600e-01 20.680  1.98856e+02 20.680  0.9528 
1 1 1 -10 35  12 o 7  1.43839e+01 6.78586e-01 2.75319e+02 339.751 5.10614e+01  -1.88369e+01 0.00000e+00 0.00000e+00 2.58440e+02 339.751 1.68790e+01 159.751 0.9908 
1 1 1 -10 35  13 o 16 4.01495e+00 1.02846e+00 6.20819e+01 305.886 1.95926e+00  -2.70804e+00 0.00000e+00 0.00000e+00 6.29492e+01 305.886 8.67387e-01 305.886 0.8324 
1 1 1 -10 35  14 o 13 3.20853e+00 8.78464e-01 4.58846e+01 217.238 -1.77090e+00 -1.34607e+00 0.00000e+00 0.00000e+00 4.17974e+01 217.238 4.08720e+00 37.238  0.7314 
1 1 1 -10 35  15 o 1  1.06601e+01 5.01026e-01 1.93783e+02 192.775 -4.20160e+01 -9.52682e+00 0.00000e+00 0.00000e+00 1.99366e+02 192.775 5.58340e+00 192.775 0.9883 
1 1 1 -10 35  16 f 0  7.40223e+00 1.98825e+00 1.81836e+02 325.585 1.00810e+01  -6.90651e+00 0.00000e+00 0.00000e+00 8.24744e+01 325.585 9.93611e+01 145.585 0.9582 
1 1 1 -10 35  17 o 11 4.34799e+00 2.17653e+00 1.17598e+02 290.307 1.53324e+00  -4.14334e+00 0.00000e+00 0.00000e+00 2.44433e+01 290.307 9.31550e+01 110.307 0.8779 
1 1 1 -10 36  1  o 9  2.83150e+01 8.23397e-01 5.36279e+02 263.689 -5.40555e+00 -4.88749e+01 0.00000e+00 0.00000e+00 5.22562e+02 263.689 1.37171e+01 83.689  0.9898 
1 1 1 -10 36  2  f 0  2.84488e+01 7.09809e-01 6.18253e+02 71.574  1.96428e+01  5.89575e+01  0.00000e+00 0.00000e+00 4.47369e+02 71.574  1.70883e+02 251.573 0.9919 
1 1 1 -10 36  3  o 3  1.58459e+01 6.75599e-01 2.69983e+02 322.991 1.17403e+01  -8.84972e+00 0.00000e+00 0.00000e+00 3.07354e+02 322.991 3.73713e+01 322.991 0.9654 
1 1 1 -10 36  4  o 10 1.31437e+01 7.12463e-01 2.59347e+02 212.980 -1.21287e+01 -7.87037e+00 0.00000e+00 0.00000e+00 2.18946e+02 212.980 4.04008e+01 32.980  0.9648 
1 1 1 -10 36  5  o 17 2.50779e+01 8.14021e-01 3.84855e+02 202.326 -3.99766e+01 -1.64171e+01 0.00000e+00 0.00000e+00 5.49399e+02 202.326 1.64545e+02 202.326 0.9884 
1 1 1 -10 36  6  o 19 9.33863e+00 8.18337e-01 1.76029e+02 318.033 6.44619e+00  -5.79751e+00 0.00000e+00 0.00000e+00 1.54755e+02 318.033 2.12740e+01 138.033 0.9404 
1 1 1 -10 36  7  o 14 1.64164e+01 8.68346e-01 2.84550e+02 158.825 -2.55383e+01 9.89268e+00  0.00000e+00 0.00000e+00 3.21892e+02 158.825 3.73422e+01 158.825 0.9816 
1 1 1 -10 36  8  o 11 1.02675e+01 7.45640e-01 1.98178e+02 333.384 1.32535e+01  -6.64147e+00 0.00000e+00 0.00000e+00 1.74648e+02 333.384 2.35308e+01 153.384 0.9657 
1 1 1 -10 36  9  o 2  5.74525e+00 9.87223e-01 6.54789e+01 303.128 1.62568e+00  -2.49114e+00 0.00000e+00 0.00000e+00 1.08937e+02 303.128 4.34581e+01 303.128 0.8081 
1 1 1 -10 36  10 o 6  7.87724e+00 8.25538e-01 1.41463e+02 131.994 -7.55762e+00 8.39533e+00  0.00000e+00 0.00000e+00 1.40771e+02 131.994 6.92398e-01 311.994 0.9547 
1 1 1 -10 36  11 o 13 8.15756e+00 8.45586e-01 1.17182e+02 272.013 3.73647e-01  -1.06322e+01 0.00000e+00 0.00000e+00 1.73909e+02 272.013 5.67270e+01 272.013 0.9518 
1 1 1 -10 36  12 o 8  1.07657e+01 7.62440e-01 1.85321e+02 58.528  1.38648e+01  2.26503e+01  0.00000e+00 0.00000e+00 2.10191e+02 58.528  2.48692e+01 58.528  0.9810 
1 1 1 -10 36  13 o 5  1.05567e+01 7.76718e-01 2.16353e+02 217.010 -2.77647e+01 -2.09300e+01 0.00000e+00 0.00000e+00 1.72815e+02 217.010 4.35379e+01 37.010  0.9855 
1 1 1 -10 36  14 o 15 9.83354e+00 7.28070e-01 1.43224e+02 97.215  -3.11297e+00 2.45911e+01  0.00000e+00 0.00000e+00 2.16674e+02 97.215  7.34503e+01 97.215  0.9796 
1 1 1 -10 36  15 o 8  6.36839e+00 6.31603e-01 8.43956e+01 335.112 9.45431e+00  -4.38614e+00 0.00000e+00 0.00000e+00 1.41520e+02 335.112 5.71248e+01 335.112 0.9507 
1 1 1 -10 36  16 o 3  6.62956e+00 2.94124e+00 5.76036e+01 210.359 -1.68817e+00 -9.88818e-01 0.00000e+00 0.00000e+00 1.12969e+02 210.359 5.53656e+01 210.359 0.6905 
1 1 1 -10 36  17 o 5  5.51403e+00 2.65322e+00 1.65590e+02 322.608 4.62098e+00  -3.53197e+00 0.00000e+00 0.00000e+00 2.09963e+01 322.608 1.44594e+02 142.608 0.9094 
1 1 1 -10 37  1  o 15 2.12389e+01 6.82877e-01 3.65800e+02 328.258 2.33831e+01  -1.44651e+01 0.00000e+00 0.00000e+00 4.21825e+02 328.258 5.60249e+01 328.258 0.9816 
1 1 1 -10 37  2  o 10 2.11043e+01 7.59373e-01 2.01637e+02 231.922 -8.96922e+00 -1.14478e+01 0.00000e+00 0.00000e+00 5.67332e+02 231.922 3.65695e+02 231.922 0.9650 
1 1 1 -10 37  3  o 4  1.89824e+01 6.52259e-01 3.42073e+02 77.165  5.62865e+00  2.47039e+01  0.00000e+00 0.00000e+00 3.59999e+02 77.165  1.79263e+01 77.165  0.9801 
1 1 1 -10 37  4  o 1  7.87598e+00 9.42400e-01 8.43743e+01 198.120 -2.59015e+00 -8.47598e-01 0.00000e+00 0.00000e+00 1.49524e+02 198.120 6.51501e+01 198.120 0.7874 
1 1 1 -10 37  5  o 7  1.06712e+01 7.32376e-01 1.73059e+02 27.808  7.79542e+00  4.11147e+00  0.00000e+00 0.00000e+00 2.05571e+02 27.808  3.25125e+01 27.808  0.9414 
1 1 1 -10 37  6  o 16 2.49484e+01 6.36790e-01 4.75301e+02 235.736 -3.97289e+01 -5.83186e+01 0.00000e+00 0.00000e+00 4.57602e+02 235.736 1.76992e+01 55.736  0.9929 
1 1 1 -10 37  7  o 3  1.17749e+01 6.99099e-01 3.04301e+02 297.258 1.01034e+01  -1.96104e+01 0.00000e+00 0.00000e+00 1.28637e+02 297.258 1.75664e+02 117.258 0.9771 
1 1 1 -10 37  8  f 0  8.27188e+00 8.17864e-01 1.86152e+02 143.062 -8.65620e+00 6.50814e+00  0.00000e+00 0.00000e+00 1.10133e+02 143.062 7.60197e+01 323.062 0.9526 
1 1 1 -10 37  9  o 18 1.17355e+01 6.72885e-01 2.19003e+02 173.948 -2.30218e+01 2.44072e+00  0.00000e+00 0.00000e+00 2.12201e+02 173.948 6.80184e+00 353.948 0.9782 
1 1 1 -10 37  10 o 10 1.15619e+01 6.87748e-01 2.61434e+02 277.788 4.24646e+00  -3.10479e+01 0.00000e+00 0.00000e+00 1.65470e+02 277.788 9.59637e+01 97.788  0.9839 
1 1 1 -10 37  11 o 9  1.32814e+01 6.85509e-01 2.26431e+02 24.060  3.39853e+01  1.51739e+01  0.00000e+00 0.00000e+00 2.64726e+02 24.060  3.82949e+01 24.060  0.9865 
1 1 1 -10 37  12 o 16 7.27317e+00 8.94008e-01 1.14936e+02 207.187 -9.71364e+00 -4.98937e+00 0.00000e+00 0.00000e+00 1.44632e+02 207.187 2.96952e+01 207.187 0.9531 
1 1 1 -10 37  13 o 18 5.21793e+00 1.09428e+00 1.12429e+02 276.361 8.40524e-01  -7.53921e+00 0.00000e+00 0.00000e+00 6.93758e+01 276.361 4.30534e+01 96.361  0.9315 
1 1 1 -10 37  14 o 18 2.90363e+00 9.33644e-01 6.17402e+01 118.295 -1.33962e+00 2.48843e+00  0.00000e+00 0.00000e+00 2.46303e+01 118.295 3.71100e+01 298.295 0.7963 
1 1 1 -10 37  15 o 5  3.82592e+00 9.97780e-01 6.43247e+01 342.867 3.94145e+00  -1.21503e+00 0.00000e+00 0.00000e+00 5.95944e+01 342.867 4.73026e+00 162.867 0.8681 
1 1 1 -10 37  16 o 10 5.43722e+00 2.55951e+00 9.06605e+01 227.822 -2.08679e+00 -2.30316e+00 0.00000e+00 0.00000e+00 7.49825e+01 227.822 1.56780e+01 47.822  0.8177 
1 1 1 -10 37  17 o 4  6.18381e+00 2.91903e+00 1.24839e+02 288.674 1.34051e+00  -3.96628e+00 0.00000e+00 0.00000e+00 7.54021e+01 288.674 4.94369e+01 108.674 0.8703 
1 1 1 -10 38  1  o 6  3.46678e+01 1.02823e+00 3.57684e+02 316.866 2.99758e+01  -2.80844e+01 0.00000e+00 0.00000e+00 9.35804e+02 316.866 5.78120e+02 316.866 0.9878 
1 1 1 -10 38  2  o 8  1.10382e+01 7.45200e-01 8.38243e+01 41.579  2.68115e+00  2.37872e+00  0.00000e+00 0.00000e+00 2.68487e+02 41.579  1.84662e+02 41.579  0.8454 
1 1 1 -10 38  3  o 13 1.19932e+01 7.18800e-01 2.29372e+02 116.589 -5.23371e+00 1.04563e+01  0.00000e+00 0.00000e+00 2.03372e+02 116.589 2.60002e+01 296.589 0.9562 
1 1 1 -10 38  4  o 7  6.25327e+00 1.03831e+00 1.02115e+02 144.950 -2.17187e+00 1.52359e+00  0.00000e+00 0.00000e+00 8.19770e+01 144.950 2.01382e+01 324.950 0.7807 
1 1 1 -10 38  5  o 11 1.15016e+01 7.13024e-01 1.56718e+02 348.214 8.23952e+00  -1.71921e+00 0.00000e+00 0.00000e+00 2.50095e+02 348.214 9.33772e+01 348.214 0.9386 
1 1 1 -10 38  6  o 16 2.43625e+01 6.36742e-01 4.54916e+02 201.217 -5.89872e+01 -2.28997e+01 0.00000e+00 0.00000e+00 4.55233e+02 201.217 3.17465e-01 201.217 0.9921 
1 1 1 -10 38  7  o 15 1.29408e+01 6.51843e-01 1.78973e+02 346.035 1.52818e+01  -3.80026e+00 0.00000e+00 0.00000e+00 2.92230e+02 346.035 1.13257e+02 346.035 0.9677 
1 1 1 -10 38  8  o 14 5.90667e+00 9.68883e-01 2.19127e+02 48.373  6.13796e+00  6.90678e+00  0.00000e+00 0.00000e+00 9.45124e+00 228.373 2.28578e+02 228.373 0.9442 
1 1 1 -10 38  9  o 6  1.17256e+01 6.93547e-01 1.76421e+02 247.886 -6.96983e+00 -1.71530e+01 0.00000e+00 0.00000e+00 2.51930e+02 247.886 7.55086e+01 247.886 0.9726 
1 1 1 -10 38  10 o 11 5.93167e+00 9.10567e-01 1.00336e+02 72.874  1.77124e+00  5.74821e+00  0.00000e+00 0.00000e+00 1.02784e+02 72.874  2.44731e+00 72.874  0.9126 
1 1 1 -10 38  11 o 3  1.01245e+01 7.41972e-01 2.01943e+02 50.309  1.65538e+01  1.99453e+01  0.00000e+00 0.00000e+00 1.70171e+02 50.309  3.17720e+01 230.309 0.9805 
1 1 1 -10 38  12 o 12 5.58119e+00 9.44612e-01 5.41363e+01 126.613 -2.19350e+00 2.95211e+00  0.00000e+00 0.00000e+00 1.23467e+02 126.613 6.93304e+01 126.613 0.8499 
1 1 1 -10 38  13 o 2  4.77768e+00 1.18027e+00 9.27771e+01 110.180 -1.89581e+00 5.15825e+00  0.00000e+00 0.00000e+00 6.87023e+01 110.180 2.40749e+01 290.180 0.9037 
1 1 1 -10 38  14 o 2  4.85468e+00 1.21945e+00 6.09943e+01 299.429 1.97544e+00  -3.50171e+00 0.00000e+00 0.00000e+00 9.57364e+01 299.429 3.47421e+01 299.429 0.8643 
1 1 1 -10 38  15 o 7  9.37516e+00 7.96156e-01 1.89833e+02 203.396 -2.81516e+01 -1.21801e+01 0.00000e+00 0.00000e+00 1.54157e+02 203.396 3.56762e+01 23.396  0.9836 
1 1 1 -10 38  16 o 14 4.62269e+00 2.25278e+00 1.06158e+01 29.128  3.25928e-01  1.81621e-01  0.00000e+00 0.00000e+00 2.09661e+01 29.128  1.03503e+01 29.128  0.1834 
1 1 1 -10 38  17 o 14 5.07570e+00 2.48853e+00 7.76908e+01 240.252 -1.35073e+00 -2.36348e+00 0.00000e+00 0.00000e+00 7.09444e+01 240.252 6.74641e+00 60.252  0.7872 
1 1 1 -10 39  1  o 8  3.82131e+00 1.03467e+00 1.18457e+02 311.119 1.11036e+00  -1.27199e+00 0.00000e+00 0.00000e+00 2.61748e+01 131.119 1.44632e+02 131.119 0.6394 
1 1 1 -10 39  2  o 10 1.13131e+01 7.23733e-01 1.37270e+02 236.684 -3.63225e+00 -5.52612e+00 0.00000e+00 0.00000e+00 2.56045e+02 236.684 1.18775e+02 236.684 0.9209 
1 1 1 -10 39  3  o 7  2.02932e+01 7.42964e-01 2.72736e+02 322.234 1.84536e+01  -1.42965e+01 0.00000e+00 0.00000e+00 4.76343e+02 322.234 2.03607e+02 322.234 0.9783 
1 1 1 -10 39  4  f 0  5.40904e+00 1.01775e+00 9.23488e+01 166.358 -2.10970e+00 5.12035e-01  0.00000e+00 0.00000e+00 5.53042e+01 166.358 3.70446e+01 346.358 0.7239 
1 1 1 -10 39  5  o 17 1.45119e+01 6.69740e-01 1.98900e+02 8.510   1.43652e+01  2.14952e+00  0.00000e+00 0.00000e+00 3.28754e+02 8.510   1.29854e+02 8.510   0.9649 
1 1 1 -10 39  6  o 7  1.25267e+01 6.99909e-01 1.52859e+02 219.110 -8.46001e+00 -6.87776e+00 0.00000e+00 0.00000e+00 2.96631e+02 219.110 1.43772e+02 219.110 0.9530 
1 1 1 -10 39  7  o 1  3.94098e+00 1.01275e+00 1.24064e+02 118.760 -1.53020e+00 2.78802e+00  0.00000e+00 0.00000e+00 2.11320e+00 298.760 1.26178e+02 298.760 0.8225 
1 1 1 -10 39  8  o 1  1.11634e+01 6.94779e-01 2.28295e+02 81.049  3.25757e+00  2.06809e+01  0.00000e+00 0.00000e+00 1.81197e+02 81.049  4.70977e+01 261.048 0.9758 
1 1 1 -10 39  9  o 13 9.73333e+00 7.49368e-01 1.96452e+02 156.617 -1.54818e+01 6.69419e+00  0.00000e+00 0.00000e+00 1.58087e+02 156.617 3.83645e+01 336.617 0.9699 
1 1 1 -10 39  10 o 7  4.42983e+00 1.02080e+00 1.24110e+02 234.275 -3.01894e+00 -4.19746e+00 0.00000e+00 0.00000e+00 2.50064e+01 234.275 9.91035e+01 54.275  0.8972 
1 1 1 -10 39  11 o 11 1.05623e+01 7.40493e-01 2.31226e+02 316.429 2.23842e+01  -2.12948e+01 0.00000e+00 0.00000e+00 1.58190e+02 316.429 7.30360e+01 136.429 0.9837 
1 1 1 -10 39  12 o 10 9.96934e+00 9.71771e-01 1.06597e+02 157.437 -1.21806e+01 5.06093e+00  0.00000e+00 0.00000e+00 2.52201e+02 157.437 1.45604e+02 157.437 0.9613 
1 1 1 -10 39  13 o 11 1.07075e+01 9.47813e-01 1.73239e+02 176.444 -2.59329e+01 1.61168e+00  0.00000e+00 0.00000e+00 2.19384e+02 176.444 4.61449e+01 176.444 0.9806 
1 1 1 -10 39  14 o 8  4.47739e+00 9.81387e-01 9.82400e+01 308.013 4.23532e+00  -5.41847e+00 0.00000e+00 0.00000e+00 5.62999e+01 308.013 4.19400e+01 128.013 0.9241 
1 1 1 -10 39  15 o 7  6.02694e+00 6.82934e-01 8.39860e+01 359.423 9.81062e+00  -9.87800e-02 0.00000e+00 0.00000e+00 1.29040e+02 359.423 4.50540e+01 359.423 0.9476 
1 1 1 -10 39  16 o 12 4.76046e+00 2.33578e+00 6.31799e+01 45.396  1.56477e+00  1.58658e+00  0.00000e+00 0.00000e+00 6.66138e+01 45.396  3.43385e+00 45.396  0.7319 
1 1 1 -10 39  17 o 3  4.07511e+00 1.94717e+00 6.54437e+01 95.596  -2.68331e-01 2.73857e+00  0.00000e+00 0.00000e+00 5.42806e+01 95.596  1.11631e+01 275.596 0.7898 
1 1 1 -10 40  1  o 2  8.98082e+00 1.13840e+00 9.97418e+01 69.700  1.24470e+00  3.36493e+00  0.00000e+00 0.00000e+00 1.87043e+02 69.700  8.73011e+01 69.700  0.8456 
1 1 1 -10 40  2  f 0  7.98142e+00 8.67830e-01 1.88966e+02 25.570  5.66012e+00  2.70821e+00  0.00000e+00 0.00000e+00 8.71289e+01 25.570  1.01837e+02 205.570 0.9164 
1 1 1 -10 40  3  o 19 1.79064e+01 6.64150e-01 2.58124e+02 346.961 1.97175e+01  -4.56614e+00 0.00000e+00 0.00000e+00 4.00505e+02 346.961 1.42381e+02 346.961 0.9750 
1 1 1 -10 40  4  o 13 2.20234e+01 6.54370e-01 4.58279e+02 117.135 -2.22002e+01 4.33179e+01  0.00000e+00 0.00000e+00 3.63486e+02 117.135 9.47932e+01 297.135 0.9897 
1 1 1 -10 40  5  o 19 1.28707e+01 6.56790e-01 2.30903e+02 134.605 -1.12771e+01 1.14336e+01  0.00000e+00 0.00000e+00 2.38680e+02 134.605 7.77702e+00 134.605 0.9683 
1 1 1 -10 40  6  o 9  1.83265e+01 6.10444e-01 2.92450e+02 31.247  2.81393e+01  1.70733e+01  0.00000e+00 0.00000e+00 3.86967e+02 31.247  9.45174e+01 31.247  0.9847 
1 1 1 -10 40  7  o 7  1.39810e+01 6.39799e-01 2.77571e+02 176.633 -2.87238e+01 1.69005e+00  0.00000e+00 0.00000e+00 2.39161e+02 176.633 3.84094e+01 356.633 0.9825 
1 1 1 -10 40  8  o 6  9.93521e+00 7.02473e-01 1.29133e+02 268.070 -3.34655e-01 -9.93263e+00 0.00000e+00 0.00000e+00 2.24982e+02 268.070 9.58496e+01 268.070 0.9483 
1 1 1 -10 40  9  o 9  9.91005e+00 7.27280e-01 1.45718e+02 240.530 -6.64260e+00 -1.17552e+01 0.00000e+00 0.00000e+00 2.12368e+02 240.530 6.66502e+01 240.530 0.9622 
1 1 1 -10 40  10 o 11 1.11067e+01 7.28764e-01 2.35851e+02 134.115 -1.88028e+01 1.93929e+01  0.00000e+00 0.00000e+00 1.73032e+02 134.115 6.28188e+01 314.115 0.9813 
1 1 1 -10 40  11 o 18 1.02991e+01 9.42602e-01 1.97089e+02 294.350 9.28757e+00  -2.05217e+01 0.00000e+00 0.00000e+00 1.80214e+02 294.350 1.68754e+01 114.350 0.9775 
1 1 1 -10 40  12 o 6  4.26454e+00 1.10888e+00 1.14899e+02 158.918 -5.58153e+00 2.15166e+00  0.00000e+00 0.00000e+00 3.07058e+01 158.918 8.41934e+01 338.919 0.9121 
1 1 1 -10 40  13 o 18 8.11460e+00 1.13122e+00 1.77643e+02 13.077  1.85085e+01  4.29909e+00  0.00000e+00 0.00000e+00 1.17674e+02 13.077  5.99688e+01 193.077 0.9733 
1 1 1 -10 40  14 o 1  1.04878e+01 7.22694e-01 2.00715e+02 125.871 -2.08497e+01 2.88336e+01  0.00000e+00 0.00000e+00 1.85410e+02 125.871 1.53045e+01 305.871 0.9858 
1 1 1 -10 40  15 o 9  3.30315e+00 8.67377e-01 6.48900e+01 313.440 2.63606e+00  -2.78367e+00 0.00000e+00 0.00000e+00 4.06669e+01 313.440 2.42231e+01 133.440 0.8568 
1 1 1 -10 40  16 o 1  5.26975e+00 2.29044e+00 1.04165e+02 130.028 -2.68420e+00 3.19572e+00  0.00000e+00 0.00000e+00 6.65744e+01 130.028 3.75905e+01 310.028 0.8699 
1 1 1 -10 40  17 o 17 5.10926e+00 1.61223e+00 1.19151e+02 307.793 4.96119e+00  -6.39763e+00 0.00000e+00 0.00000e+00 5.87267e+01 307.793 6.04247e+01 127.793 0.9360 
1 1 1 -10 41  1  o 7  1.51734e+01 6.70257e-01 3.73215e+02 272.876 1.20963e+00  -2.40770e+01 0.00000e+00 0.00000e+00 1.87741e+02 272.876 1.85474e+02 92.876  0.9790 
1 1 1 -10 41  2  o 10 6.49671e+00 9.89676e-01 7.36300e+01 304.401 1.13509e+00  -1.65769e+00 0.00000e+00 0.00000e+00 9.78304e+01 304.401 2.42004e+01 304.401 0.6993 
1 1 1 -10 41  3  o 8  7.28704e+00 9.38821e-01 2.15864e+02 49.821  4.47295e+00  5.29702e+00  0.00000e+00 0.00000e+00 3.83375e+01 49.821  1.77527e+02 229.821 0.9248 
1 1 1 -10 41  4  o 12 2.49770e+01 6.80664e-01 4.40798e+02 196.101 -4.96200e+01 -1.43234e+01 0.00000e+00 0.00000e+00 4.91635e+02 196.101 5.08368e+01 196.101 0.9903 
1 1 1 -10 41  5  o 5  8.19297e+00 8.46791e-01 8.18380e+01 271.798 1.20975e-01  -3.85337e+00 0.00000e+00 0.00000e+00 1.82899e+02 271.798 1.01061e+02 271.798 0.8577 
1 1 1 -10 41  6  o 18 1.00396e+01 7.40383e-01 2.31718e+02 73.019  4.16587e+00  1.36419e+01  0.00000e+00 0.00000e+00 1.32723e+02 73.019  9.89954e+01 253.019 0.9643 
1 1 1 -10 41  7  o 9  7.88858e+00 9.68078e-01 9.22350e+01 6.648   5.01256e+00  5.84271e-01  0.00000e+00 0.00000e+00 1.73174e+02 6.648   8.09389e+01 6.648   0.8945 
1 1 1 -10 41  8  o 16 1.55092e+01 6.30341e-01 1.99766e+02 223.089 -1.93639e+01 -1.81133e+01 0.00000e+00 0.00000e+00 3.72011e+02 223.089 1.72245e+02 223.089 0.9810 
1 1 1 -10 41  9  o 12 1.19433e+01 8.39056e-01 2.47641e+02 43.536  1.96563e+01  1.86768e+01  0.00000e+00 0.00000e+00 1.92455e+02 43.536  5.51864e+01 223.536 0.9814 
1 1 1 -10 41  10 o 2  1.28671e+01 8.16902e-01 2.05337e+02 84.035  2.90521e+00  2.78031e+01  0.00000e+00 0.00000e+00 2.68608e+02 84.035  6.32715e+01 84.035  0.9819 
1 1 1 -10 41  11 o 9  8.13186e+00 1.04716e+00 1.62792e+02 294.157 6.24436e+00  -1.39221e+01 0.00000e+00 0.00000e+00 1.31762e+02 294.157 3.10302e+01 114.157 0.9667 
1 1 1 -10 41  12 o 4  3.27460e+00 1.00916e+00 8.06932e+01 47.366  2.24642e+00  2.44008e+00  0.00000e+00 0.00000e+00 2.11528e+01 47.366  5.95404e+01 227.366 0.8309 
1 1 1 -10 41  13 o 2  9.83611e+00 1.00494e+00 1.77580e+02 87.124  1.16201e+00  2.31286e+01  0.00000e+00 0.00000e+00 1.82130e+02 87.124  4.55032e+00 87.124  0.9782 
1 1 1 -10 41  14 o 7  3.91855e+00 9.95667e-01 8.25120e+01 233.986 -3.01783e+00 -4.15151e+00 0.00000e+00 0.00000e+00 4.86463e+01 233.986 3.38657e+01 53.986  0.8964 
1 1 1 -10 41  15 o 10 3.36989e+00 8.79904e-01 3.59760e+01 157.103 -2.01255e+00 8.50019e-01  0.00000e+00 0.00000e+00 5.52482e+01 157.103 1.92722e+01 157.103 0.7259 
1 1 1 -10 41  16 o 8  6.33258e+00 1.79654e+00 1.06419e+02 92.049  -2.57263e-01 7.18981e+00  0.00000e+00 0.00000e+00 1.12357e+02 92.049  5.93771e+00 92.049  0.9276 
1 1 1 -10 41  17 o 10 4.38425e+00 1.47213e+00 9.98510e+01 333.257 5.91676e+00  -2.98136e+00 0.00000e+00 0.00000e+00 5.03338e+01 333.257 4.95172e+01 153.257 0.9211 
1 1 1 -10 42  1  o 9  1.23903e+01 7.79657e-01 1.05175e+02 226.199 -3.89918e+00 -4.06590e+00 0.00000e+00 0.00000e+00 3.18792e+02 226.199 2.13617e+02 226.199 0.9063 
1 1 1 -10 42  2  o 14 1.29900e+01 6.74159e-01 2.08874e+02 57.767  6.62687e+00  1.05100e+01  0.00000e+00 0.00000e+00 2.61184e+02 57.767  5.23096e+01 57.767  0.9589 
1 1 1 -10 42  3  o 12 1.56285e+01 6.55862e-01 3.23766e+02 204.749 -2.21777e+01 -1.02235e+01 0.00000e+00 0.00000e+00 2.53502e+02 204.749 7.02638e+01 24.749  0.9793 
1 1 1 -10 42  4  o 4  5.38300e+00 1.39050e+00 1.10090e+02 182.038 -2.61291e+00 -9.29662e-02 0.00000e+00 0.00000e+00 4.75495e+01 182.038 6.25407e+01 2.038   0.7769 
1 1 1 -10 42  5  o 7  2.79825e+01 6.56642e-01 5.27354e+02 68.862  3.02828e+01  7.83257e+01  0.00000e+00 0.00000e+00 5.20414e+02 68.862  6.94063e+00 248.862 0.9940 
1 1 1 -10 42  6  o 19 9.34109e+00 7.81412e-01 1.91096e+02 7.695   1.17767e+01  1.59133e+00  0.00000e+00 0.00000e+00 1.45375e+02 7.695   4.57206e+01 187.695 0.9570 
1 1 1 -10 42  7  o 4  6.74266e+00 1.10502e+00 1.76770e+02 5.971   7.78370e+00  8.14168e-01  0.00000e+00 0.00000e+00 6.00214e+01 5.971   1.16749e+02 185.971 0.9337 
1 1 1 -10 42  8  o 2  1.50763e+01 7.55476e-01 2.47437e+02 59.907  1.57534e+01  2.71842e+01  0.00000e+00 0.00000e+00 3.10013e+02 59.907  6.25751e+01 59.907  0.9840 
1 1 1 -10 42  9  o 10 1.11798e+01 8.34256e-01 2.39361e+02 338.767 2.29079e+01  -8.90042e+00 0.00000e+00 0.00000e+00 1.71739e+02 338.767 6.76214e+01 158.767 0.9794 
1 1 1 -10 42  10 o 12 1.17663e+01 8.52499e-01 2.17358e+02 146.540 -2.09765e+01 1.38628e+01  0.00000e+00 0.00000e+00 2.15089e+02 146.540 2.26920e+00 326.540 0.9799 
1 1 1 -10 42  11 o 12 6.44635e+00 1.07781e+00 1.22133e+02 272.567 3.86153e-01  -8.61171e+00 0.00000e+00 0.00000e+00 1.04921e+02 272.567 1.72117e+01 92.567  0.9401 
1 1 1 -10 42  12 o 2  4.45326e+00 1.09840e+00 5.95475e+01 6.975   3.11698e+00  3.81357e-01  0.00000e+00 0.00000e+00 7.70938e+01 6.975   1.75463e+01 6.975   0.8198 
1 1 1 -10 42  13 o 4  4.44147e+00 1.16959e+00 1.24442e+02 354.154 7.37319e+00  -7.54939e-01 0.00000e+00 0.00000e+00 2.99461e+01 354.154 9.44959e+01 174.154 0.9299 
1 1 1 -10 42  14 o 13 4.75202e+00 8.57729e-01 1.19575e+02 177.453 -1.01926e+01 4.53475e-01  0.00000e+00 0.00000e+00 4.89161e+01 177.453 7.06590e+01 357.452 0.9497 
1 1 1 -10 42  15 o 16 3.28151e+00 7.64220e-01 2.49460e+01 253.223 -4.61791e-01 -1.53179e+00 0.00000e+00 0.00000e+00 5.09030e+01 253.223 2.59570e+01 253.223 0.6199 
1 1 1 -10 42  16 o 4  4.49136e+00 1.45803e+00 6.18698e+01 255.866 -9.14608e-01 -3.63219e+00 0.00000e+00 0.00000e+00 8.07900e+01 255.866 1.89202e+01 255.866 0.8530 
1 1 1 -10 42  17 o 5  4.74028e+00 1.57728e+00 2.38530e+01 267.678 -6.22492e-02 -1.53529e+00 0.00000e+00 0.00000e+00 8.27977e+01 267.678 5.89446e+01 267.678 0.6050 
1 1 1 -10 43  1  o 19 1.76676e+01 7.38520e-01 3.19299e+02 90.204  -9.11006e-02 2.55938e+01  0.00000e+00 0.00000e+00 3.34535e+02 90.204  1.52356e+01 90.204  0.9803 
1 1 1 -10 43  2  o 4  1.93968e+01 7.87872e-01 3.79015e+02 344.012 3.35778e+01  -9.62034e+00 0.00000e+00 0.00000e+00 3.42348e+02 344.012 3.66676e+01 164.012 0.9856 
1 1 1 -10 43  3  o 2  2.69090e+01 7.87498e-01 5.40322e+02 354.437 6.70140e+01  -6.52730e+00 0.00000e+00 0.00000e+00 4.66934e+02 354.437 7.33877e+01 174.437 0.9925 
1 1 1 -10 43  4  o 10 1.31799e+01 7.70738e-01 2.92779e+02 65.931  8.36510e+00  1.87277e+01  0.00000e+00 0.00000e+00 1.91702e+02 65.931  1.01076e+02 245.931 0.9753 
1 1 1 -10 43  5  o 18 1.10045e+01 8.28671e-01 1.52234e+02 172.639 -9.25961e+00 1.19612e+00  0.00000e+00 0.00000e+00 2.39374e+02 172.639 8.71397e+01 172.639 0.9448 
1 1 1 -10 43  6  o 3  1.27056e+01 7.78078e-01 1.54653e+02 221.330 -1.01358e+01 -8.91402e+00 0.00000e+00 0.00000e+00 3.05469e+02 221.330 1.50816e+02 221.330 0.9622 
1 1 1 -10 43  7  o 12 1.04621e+01 8.40549e-01 1.65763e+02 92.942  -6.56726e-01 1.27770e+01  0.00000e+00 0.00000e+00 2.11972e+02 92.942  4.62086e+01 92.942  0.9601 
1 1 1 -10 43  8  o 3  6.38968e+00 1.04085e+00 9.48090e+01 232.294 -3.01803e+00 -3.90410e+00 0.00000e+00 0.00000e+00 1.19310e+02 232.294 2.45009e+01 232.294 0.8918 
1 1 1 -10 43  9  o 12 1.37659e+01 7.93648e-01 2.31256e+02 345.741 3.15980e+01  -8.03032e+00 0.00000e+00 0.00000e+00 2.77519e+02 345.741 4.62628e+01 345.741 0.9845 
1 1 1 -10 43  10 o 18 3.65299e+00 1.04514e+00 8.38906e+01 358.568 3.03053e+00  -7.57742e-02 0.00000e+00 0.00000e+00 2.73891e+01 358.568 5.65015e+01 178.568 0.8123 
1 1 1 -10 43  11 o 12 5.57363e+00 1.15150e+00 1.34885e+02 179.756 -8.41252e+00 3.58667e-02  0.00000e+00 0.00000e+00 6.10862e+01 179.756 7.37993e+01 359.756 0.9385 
1 1 1 -10 43  12 o 13 9.94058e+00 9.66856e-01 2.00125e+02 353.366 2.79976e+01  -3.25630e+00 0.00000e+00 0.00000e+00 1.65210e+02 353.366 3.49155e+01 173.366 0.9821 
1 1 1 -10 43  13 f 0  1.02632e+01 9.78121e-01 2.27406e+02 151.879 -2.86380e+01 1.53048e+01  0.00000e+00 0.00000e+00 1.50258e+02 151.879 7.71485e+01 331.879 0.9845 
1 1 1 -10 43  14 o 5  5.97792e+00 8.77062e-01 1.51533e+02 52.315  9.26284e+00  1.19914e+01  0.00000e+00 0.00000e+00 6.41422e+01 52.315  8.73903e+01 232.315 0.9664 
1 1 1 -10 43  15 o 5  5.18086e+00 8.28027e-01 1.16456e+02 229.443 -7.51134e+00 -8.77696e+00 0.00000e+00 0.00000e+00 6.81488e+01 229.443 4.83067e+01 49.443  0.9557 
1 1 1 -10 43  16 o 9  4.54793e+00 1.45275e+00 5.89703e+01 122.165 -1.94441e+00 3.09184e+00  0.00000e+00 0.00000e+00 8.47437e+01 122.165 2.57734e+01 122.165 0.8487 
1 1 1 -10 44  1  o 16 1.63278e+01 8.15280e-01 2.17472e+02 106.322 -4.71781e+00 1.61108e+01  0.00000e+00 0.00000e+00 3.80225e+02 106.322 1.62753e+02 106.322 0.9697 
1 1 1 -10 44  2  o 6  2.10785e+01 8.16408e-01 1.99219e+02 31.898  1.64743e+01  1.02536e+01  0.00000e+00 0.00000e+00 5.75289e+02 31.898  3.76070e+02 31.898  0.9739 
1 1 1 -10 44  3  o 9  2.90041e+01 8.79516e-01 4.08681e+02 24.868  5.25479e+01  2.43558e+01  0.00000e+00 0.00000e+00 6.75536e+02 24.868  2.66855e+02 24.868  0.9913 
1 1 1 -10 44  4  o 10 2.31978e+01 7.54885e-01 4.00695e+02 281.209 1.05547e+01  -5.32597e+01 0.00000e+00 0.00000e+00 4.65430e+02 281.209 6.47352e+01 281.209 0.9907 
1 1 1 -10 44  5  o 2  1.87762e+01 7.48054e-01 4.97251e+02 71.367  1.79104e+01  5.31197e+01  0.00000e+00 0.00000e+00 2.03520e+02 71.367  2.93730e+02 251.367 0.9910 
1 1 1 -10 44  6  o 13 1.43984e+01 7.70292e-01 2.03420e+02 68.264  7.85410e+00  1.97004e+01  0.00000e+00 0.00000e+00 3.25487e+02 68.264  1.22067e+02 68.264  0.9761 
1 1 1 -10 44  7  o 19 7.55782e+00 9.87522e-01 2.59844e+02 171.316 -1.48350e+01 2.26591e+00  0.00000e+00 0.00000e+00 1.47052e+01 171.316 2.45139e+02 351.316 0.9661 
1 1 1 -10 44  8  o 13 9.55384e+00 8.85703e-01 2.05118e+02 316.184 1.20452e+01  -1.15574e+01 0.00000e+00 0.00000e+00 1.42892e+02 316.184 6.22262e+01 136.184 0.9696 
1 1 1 -10 44  9  o 7  3.95447e+00 1.05938e+00 7.90303e+01 143.113 -2.30060e+00 1.72654e+00  0.00000e+00 0.00000e+00 3.97756e+01 143.113 3.92547e+01 323.113 0.8004 
1 1 1 -10 44  10 o 2  6.02622e+00 1.13812e+00 9.03146e+01 98.182  -7.68627e-01 5.34609e+00  0.00000e+00 0.00000e+00 1.13493e+02 98.182  2.31784e+01 98.182  0.9019 
1 1 1 -10 44  11 o 10 6.18758e+00 1.14343e+00 1.25564e+02 263.094 -1.05383e+00 -8.70033e+00 0.00000e+00 0.00000e+00 9.25604e+01 263.094 3.30039e+01 83.094  0.9411 
1 1 1 -10 44  12 o 8  6.03455e+00 1.11984e+00 1.19982e+02 87.184  4.54850e-01  9.24868e+00  0.00000e+00 0.00000e+00 9.32499e+01 87.184  2.67320e+01 267.184 0.9444 
1 1 1 -10 44  13 o 6  2.99878e+00 8.66420e-01 5.26695e+01 193.500 -2.48364e+00 -5.96250e-01 0.00000e+00 0.00000e+00 3.37145e+01 193.500 1.89550e+01 13.500  0.7708 
1 1 1 -10 44  14 o 1  3.15272e+00 8.95824e-01 9.92631e+01 215.236 -4.31924e+00 -3.05091e+00 0.00000e+00 0.00000e+00 6.61296e+00 215.236 9.26501e+01 35.236  0.8997 
1 1 1 -10 44  15 o 8  8.88386e+00 6.44543e-01 1.47524e+02 162.258 -2.78470e+01 8.90972e+00  0.00000e+00 0.00000e+00 1.77950e+02 162.258 3.04263e+01 162.258 0.9827 
1 1 1 -10 44  16 o 17 4.32999e+00 1.43190e+00 9.38261e+01 157.638 -5.39505e+00 2.21954e+00  0.00000e+00 0.00000e+00 5.28196e+01 157.638 4.10064e+01 337.638 0.9097 
1 1 1 -10 45  1  o 18 2.85056e+01 7.96348e-01 4.20853e+02 61.286  2.66626e+01  4.86725e+01  0.00000e+00 0.00000e+00 6.45311e+02 61.286  2.24458e+02 61.286  0.9909 
1 1 1 -10 45  2  o 12 3.88020e+01 9.08720e-01 5.80083e+02 210.233 -9.47386e+01 -5.52130e+01 0.00000e+00 0.00000e+00 8.77029e+02 210.233 2.96946e+02 210.233 0.9954 
1 1 1 -10 45  3  o 6  2.79495e+01 7.82076e-01 4.38494e+02 7.868   6.44450e+01  8.90595e+00  0.00000e+00 0.00000e+00 6.07179e+02 7.868   1.68685e+02 7.868   0.9923 
1 1 1 -10 45  4  o 7  2.50504e+01 7.44033e-01 3.86797e+02 275.517 5.22883e+00  -5.41342e+01 0.00000e+00 0.00000e+00 5.48400e+02 275.517 1.61603e+02 275.517 0.9908 
1 1 1 -10 45  5  o 19 1.52649e+01 8.95912e-01 2.01540e+02 209.297 -1.59588e+01 -8.95469e+00 0.00000e+00 0.00000e+00 3.57330e+02 209.297 1.55790e+02 209.297 0.9723 
1 1 1 -10 45  6  o 12 1.42318e+01 7.55970e-01 2.81075e+02 54.665  1.68682e+01  2.37928e+01  0.00000e+00 0.00000e+00 2.45166e+02 54.665  3.59090e+01 234.665 0.9827 
1 1 1 -10 45  7  o 2  1.27302e+01 7.39258e-01 3.17347e+02 240.567 -1.52685e+01 -2.70609e+01 0.00000e+00 0.00000e+00 1.53507e+02 240.567 1.63841e+02 60.567  0.9838 
1 1 1 -10 45  8  o 19 1.08225e+01 8.37042e-01 1.46929e+02 297.129 6.25174e+00  -1.22019e+01 0.00000e+00 0.00000e+00 2.44496e+02 297.129 9.75674e+01 297.129 0.9628 
1 1 1 -10 45  9  o 15 1.13884e+01 8.32759e-01 2.09732e+02 0.777   2.47637e+01  3.35666e-01  0.00000e+00 0.00000e+00 2.08958e+02 0.777   7.73649e-01 180.777 0.9796 
1 1 1 -10 45  10 o 2  8.67341e+00 9.73270e-01 1.69441e+02 29.790  1.47918e+01  8.46793e+00  0.00000e+00 0.00000e+00 1.46065e+02 29.790  2.33770e+01 209.790 0.9702 
1 1 1 -10 45  11 o 15 1.01192e+01 9.22443e-01 1.95545e+02 191.508 -2.50288e+01 -5.09594e+00 0.00000e+00 0.00000e+00 1.75965e+02 191.508 1.95802e+01 11.508  0.9802 
1 1 1 -10 45  12 o 2  1.07557e+01 8.14859e-01 1.81536e+02 107.863 -8.96806e+00 2.78268e+01  0.00000e+00 0.00000e+00 2.13921e+02 107.863 3.23850e+01 107.863 0.9827 
1 1 1 -10 45  13 o 9  4.60818e+00 9.77498e-01 1.36445e+02 233.066 -5.42879e+00 -7.22166e+00 0.00000e+00 0.00000e+00 2.59288e+01 233.066 1.10516e+02 53.066  0.9429 
1 1 1 -10 45  14 o 8  1.23400e+01 6.62514e-01 2.41742e+02 35.115  4.29605e+01  3.02095e+01  0.00000e+00 0.00000e+00 2.14419e+02 35.115  2.73231e+01 215.115 0.9904 
1 1 1 -10 45  15 o 9  3.73706e+00 9.48676e-01 5.33504e+01 206.844 -3.27672e+00 -1.65838e+00 0.00000e+00 0.00000e+00 6.50026e+01 206.844 1.16521e+01 206.844 0.8496 
1 1 1 -10 45  16 f 0  3.71816e+00 1.25678e+00 2.03575e+01 281.436 2.46499e-01  -1.21856e+00 0.00000e+00 0.00000e+00 5.24411e+01 281.436 3.20836e+01 281.436 0.5260 
1 1 1 -10 46  1  o 7  1.11396e+01 8.62037e-01 2.73033e+02 222.621 -1.09651e+01 -1.00905e+01 0.00000e+00 0.00000e+00 1.33003e+02 222.621 1.40029e+02 42.621  0.9658 
1 1 1 -10 46  2  o 18 1.85900e+01 7.27096e-01 2.80897e+02 304.645 1.59140e+01  -2.30303e+01 0.00000e+00 0.00000e+00 4.07680e+02 304.645 1.26783e+02 304.645 0.9820 
1 1 1 -10 46  3  f 0  2.69062e+01 7.64328e-01 4.63835e+02 62.356  3.37782e+01  6.44910e+01  0.00000e+00 0.00000e+00 5.43518e+02 62.356  7.96826e+01 62.356  0.9931 
1 1 1 -10 46  4  o 11 1.95307e+01 7.20120e-01 3.08550e+02 294.059 1.39290e+01  -3.11976e+01 0.00000e+00 0.00000e+00 4.16439e+02 294.059 1.07889e+02 294.059 0.9853 
1 1 1 -10 46  5  o 10 8.45490e+00 8.89865e-01 1.51534e+02 187.403 -8.25589e+00 -1.07265e+00 0.00000e+00 0.00000e+00 1.47018e+02 187.403 4.51607e+00 7.403   0.9379 
1 1 1 -10 46  6  f 0  1.21145e+01 7.88449e-01 1.25032e+02 33.430  8.97272e+00  5.92321e+00  0.00000e+00 0.00000e+00 3.09006e+02 33.430  1.83974e+02 33.430  0.9523 
1 1 1 -10 46  7  o 17 1.40767e+01 7.26271e-01 2.37217e+02 113.866 -1.13269e+01 2.56011e+01  0.00000e+00 0.00000e+00 2.82424e+02 113.866 4.52080e+01 113.866 0.9820 
1 1 1 -10 46  8  o 11 1.23923e+01 7.88371e-01 1.87996e+02 184.504 -2.13573e+01 -1.68223e+00 0.00000e+00 0.00000e+00 2.66462e+02 184.504 7.84662e+01 184.504 0.9764 
1 1 1 -10 46  9  o 13 1.48481e+01 7.91190e-01 2.31216e+02 268.596 -8.53032e-01 -3.48024e+01 0.00000e+00 0.00000e+00 3.17904e+02 268.596 8.66877e+01 268.596 0.9855 
1 1 1 -10 46  10 o 4  6.69824e+00 9.34475e-01 1.47208e+02 350.762 1.14381e+01  -1.86039e+00 0.00000e+00 0.00000e+00 9.28085e+01 350.762 5.43991e+01 170.762 0.9558 
1 1 1 -10 46  11 o 17 3.26160e+00 9.09394e-01 6.66014e+01 98.869  -4.14002e-01 2.65323e+00  0.00000e+00 0.00000e+00 2.91284e+01 98.869  3.74730e+01 278.869 0.7837 
1 1 1 -10 46  12 o 5  5.30341e+00 1.10641e+00 1.05163e+02 29.658  6.22753e+00  3.54613e+00  0.00000e+00 0.00000e+00 7.88131e+01 29.658  2.63502e+01 209.658 0.9273 
1 1 1 -10 46  13 o 3  6.85440e+00 8.36736e-01 7.57443e+01 255.295 -2.19652e+00 -8.36945e+00 0.00000e+00 0.00000e+00 1.65078e+02 255.295 8.93340e+01 255.295 0.9403 
1 1 1 -10 46  14 o 6  1.08574e+01 7.08822e-01 1.66095e+02 92.835  -1.66958e+00 3.37140e+01  0.00000e+00 0.00000e+00 2.33040e+02 92.835  6.69449e+01 92.835  0.9851 
1 1 1 -10 46  15 o 16 7.24501e+00 8.14809e-01 1.32003e+02 248.790 -7.09035e+00 -1.82707e+01 0.00000e+00 0.00000e+00 1.31041e+02 248.790 9.62205e-01 68.790  0.9741 
1 1 1 -10 46  16 o 11 4.87429e+00 1.52337e+00 5.89362e+01 55.388  2.27119e+00  3.29076e+00  0.00000e+00 0.00000e+00 9.77151e+01 55.388  3.87789e+01 55.388  0.8635 
1 1 1 -10 47  1  o 5  9.89978e+00 9.26357e-01 1.82472e+02 335.331 8.50282e+00  -3.90533e+00 0.00000e+00 0.00000e+00 1.70522e+02 335.331 1.19494e+01 155.331 0.9449 
1 1 1 -10 47  2  o 11 1.31424e+01 7.75726e-01 2.00398e+02 22.472  1.41885e+01  5.86898e+00  0.00000e+00 0.00000e+00 2.78848e+02 22.472  7.84504e+01 22.472  0.9669 
1 1 1 -10 47  3  f 0  1.49901e+01 7.26725e-01 2.88015e+02 219.951 -1.86274e+01 -1.56033e+01 0.00000e+00 0.00000e+00 2.65275e+02 219.951 2.27401e+01 39.951  0.9792 
1 1 1 -10 47  4  o 19 6.94093e+00 9.87956e-01 2.95759e+02 6.142   1.16906e+01  1.25803e+00  0.00000e+00 0.00000e+00 4.56646e+01 186.142 3.41423e+02 186.142 0.9565 
1 1 1 -10 47  5  o 6  8.57218e+00 8.83785e-01 1.11976e+02 47.316  4.36339e+00  4.73116e+00  0.00000e+00 0.00000e+00 1.84475e+02 47.316  7.24992e+01 47.316  0.9186 
1 1 1 -10 47  6  o 12 6.96398e+00 9.79986e-01 6.42208e+01 344.818 3.07748e+00  -8.35112e-01 0.00000e+00 0.00000e+00 1.51387e+02 344.818 8.71665e+01 344.818 0.8230 
1 1 1 -10 47  7  o 15 1.81252e+01 7.27832e-01 3.73864e+02 182.856 -5.73586e+01 -2.86141e+00 0.00000e+00 0.00000e+00 3.01462e+02 182.856 7.24029e+01 2.856   0.9913 
1 1 1 -10 47  8  o 3  9.24771e+00 9.39761e-01 1.57795e+02 240.341 -6.41822e+00 -1.12711e+01 0.00000e+00 0.00000e+00 1.75837e+02 240.341 1.80413e+01 240.341 0.9606 
1 1 1 -10 47  9  o 13 6.92611e+00 8.89894e-01 1.41558e+02 20.955  9.46345e+00  3.62420e+00  0.00000e+00 0.00000e+00 1.05139e+02 20.955  3.64192e+01 200.955 0.9493 
1 1 1 -10 47  10 o 11 9.61504e+00 8.77904e-01 1.68648e+02 322.421 1.46255e+01  -1.12547e+01 0.00000e+00 0.00000e+00 1.81856e+02 322.421 1.32078e+01 322.421 0.9725 
1 1 1 -10 47  11 o 3  7.26636e+00 9.44914e-01 1.12062e+02 194.373 -9.90936e+00 -2.53925e+00 0.00000e+00 0.00000e+00 1.46363e+02 194.373 3.43010e+01 194.373 0.9498 
1 1 1 -10 47  12 o 2  7.74603e+00 9.04140e-01 1.33497e+02 84.717  1.36174e+00  1.47278e+01  0.00000e+00 0.00000e+00 1.46257e+02 84.717  1.27601e+01 84.717  0.9656 
1 1 1 -10 47  13 o 13 6.38391e+00 9.02408e-01 1.30019e+02 120.474 -6.74584e+00 1.14641e+01  0.00000e+00 0.00000e+00 9.93340e+01 120.474 3.06850e+01 300.474 0.9616 
1 1 1 -10 47  14 o 13 4.99718e+00 1.00727e+00 8.05585e+01 357.825 6.70723e+00  -2.54692e-01 0.00000e+00 0.00000e+00 9.13929e+01 357.825 1.08344e+01 357.825 0.9222 
1 1 1 -10 47  15 o 12 4.37019e+00 9.96980e-01 6.41549e+01 260.417 -8.88935e-01 -5.26541e+00 0.00000e+00 0.00000e+00 8.25335e+01 260.417 1.83786e+01 260.417 0.9007 
1 1 1 -10 47  16 o 11 5.80118e+00 1.67272e+00 1.21977e+02 111.204 -3.21374e+00 8.28394e+00  0.00000e+00 0.00000e+00 8.13791e+01 111.204 4.05975e+01 291.204 0.9419 
1 1 1 -10 48  1  f 0  8.41703e+00 9.63485e-01 2.58436e+02 188.828 -1.20780e+01 -1.87593e+00 0.00000e+00 0.00000e+00 4.58493e+01 188.828 2.12587e+02 8.829   0.9582 
1 1 1 -10 48  2  o 17 1.29262e+01 7.56259e-01 1.86167e+02 305.970 7.92952e+00  -1.09259e+01 0.00000e+00 0.00000e+00 2.82871e+02 305.970 9.67046e+01 305.970 0.9622 
1 1 1 -10 48  3  o 16 1.30419e+01 1.21886e+00 1.80621e+02 34.188  1.00127e+01  6.80148e+00  0.00000e+00 0.00000e+00 2.90156e+02 34.188  1.09535e+02 34.188  0.9578 
1 1 1 -10 48  4  o 5  1.68803e+01 7.84160e-01 1.84239e+02 336.586 1.73169e+01  -7.49887e+00 0.00000e+00 0.00000e+00 4.34495e+02 336.586 2.50256e+02 336.586 0.9731 
1 1 1 -10 48  5  o 2  1.85172e+01 7.17185e-01 3.10065e+02 122.787 -2.27018e+01 3.52435e+01  0.00000e+00 0.00000e+00 3.78572e+02 122.787 6.85069e+01 122.787 0.9880 
1 1 1 -10 48  6  o 19 1.05834e+01 7.93258e-01 1.36224e+02 325.825 9.59395e+00  -6.51383e+00 0.00000e+00 0.00000e+00 2.44277e+02 325.825 1.08053e+02 325.825 0.9559 
1 1 1 -10 48  7  o 15 6.18637e+00 1.19281e+00 1.66555e+02 38.474  6.24198e+00  4.96052e+00  0.00000e+00 0.00000e+00 5.08358e+01 38.474  1.15719e+02 218.474 0.9350 
1 1 1 -10 48  8  o 7  6.42779e+00 8.98020e-01 1.06807e+02 82.536  8.02746e-01  6.12691e+00  0.00000e+00 0.00000e+00 1.14057e+02 82.536  7.25042e+00 82.536  0.9151 
1 1 1 -10 48  9  o 15 8.99219e+00 8.05899e-01 1.70794e+02 121.664 -8.04726e+00 1.30479e+01  0.00000e+00 0.00000e+00 1.55360e+02 121.664 1.54331e+01 301.664 0.9668 
1 1 1 -10 48  10 o 14 3.74878e+00 9.47515e-01 7.14061e+01 24.861  2.92529e+00  1.35546e+00  0.00000e+00 0.00000e+00 4.45455e+01 24.861  2.68606e+01 204.861 0.8253 
1 1 1 -10 48  11 o 1  1.16204e+01 7.87673e-01 1.81642e+02 288.040 9.26828e+00  -2.84568e+01 0.00000e+00 0.00000e+00 2.46092e+02 288.040 6.44508e+01 288.040 0.9831 
1 1 1 -10 48  12 o 10 4.27498e+00 1.05626e+00 6.35814e+01 73.018  1.05120e+00  3.44226e+00  0.00000e+00 0.00000e+00 7.16944e+01 73.018  8.11304e+00 73.018  0.8461 
1 1 1 -10 48  13 o 13 5.00176e+00 9.68883e-01 5.81780e+01 254.560 -1.22072e+00 -4.41977e+00 0.00000e+00 0.00000e+00 1.06761e+02 254.560 4.85831e+01 254.560 0.8828 
1 1 1 -10 48  14 o 1  8.22552e+00 8.03517e-01 1.03624e+02 9.065   1.44600e+01  2.30710e+00  0.00000e+00 0.00000e+00 1.92590e+02 9.065   8.89661e+01 9.065   0.9652 
1 1 1 -10 48  15 o 17 7.80347e+00 8.13980e-01 1.22037e+02 143.322 -1.56184e+01 1.16325e+01  0.00000e+00 0.00000e+00 1.61161e+02 143.322 3.91246e+01 143.322 0.9740 
1 1 1 -10 48  16 o 17 3.99319e+00 1.29397e+00 3.07176e+01 120.112 -1.07637e+00 1.85591e+00  0.00000e+00 0.00000e+00 7.63069e+01 120.112 4.55893e+01 120.112 0.7203 
1 1 1 -10 49  1  o 17 5.23408e+00 1.01732e+00 5.57438e+01 276.033 1.65284e-01  -1.56383e+00 0.00000e+00 0.00000e+00 6.54043e+01 276.033 9.66049e+00 276.033 0.6136 
1 1 1 -10 49  2  o 2  1.79426e+01 7.21285e-01 2.39592e+02 264.933 -2.15441e+00 -2.42972e+01 0.00000e+00 0.00000e+00 4.22924e+02 264.933 1.83332e+02 264.933 0.9793 
1 1 1 -10 49  3  o 17 2.60064e+01 7.57456e-01 3.60274e+02 122.353 -3.00112e+01 4.73765e+01  0.00000e+00 0.00000e+00 6.10987e+02 122.353 2.50712e+02 122.353 0.9910 
1 1 1 -10 49  4  o 7  3.05131e+01 8.05197e-01 5.11865e+02 338.909 9.95857e+01  -3.84086e+01 0.00000e+00 0.00000e+00 6.31899e+02 338.909 1.20034e+02 338.909 0.9953 
1 1 1 -10 49  5  o 5  2.40999e+01 7.43457e-01 4.19000e+02 104.450 -1.83801e+01 7.13269e+01  0.00000e+00 0.00000e+00 4.81840e+02 104.450 6.28400e+01 104.450 0.9932 
1 1 1 -10 49  6  o 10 9.10275e+00 7.37558e-01 1.67730e+02 341.248 1.11227e+01  -3.77608e+00 0.00000e+00 0.00000e+00 1.59692e+02 341.248 8.03795e+00 161.248 0.9564 
1 1 1 -10 49  7  o 8  1.62538e+01 6.70185e-01 2.52573e+02 342.146 3.51446e+01  -1.13201e+01 0.00000e+00 0.00000e+00 3.49882e+02 342.146 9.73093e+01 342.146 0.9864 
1 1 1 -10 49  8  o 15 2.24051e+01 6.87712e-01 4.29187e+02 135.074 -7.17690e+01 7.15835e+01  0.00000e+00 0.00000e+00 4.07863e+02 135.074 2.13242e+01 315.074 0.9951 
1 1 1 -10 49  9  o 3  1.26694e+01 7.02116e-01 1.91160e+02 301.868 1.42364e+01  -2.29000e+01 0.00000e+00 0.00000e+00 2.75182e+02 301.868 8.40219e+01 301.868 0.9813 
1 1 1 -10 49  10 o 2  1.36249e+01 7.15116e-01 2.51425e+02 260.372 -7.23706e+00 -4.26603e+01 0.00000e+00 0.00000e+00 2.53218e+02 260.372 1.79285e+00 260.372 0.9884 
1 1 1 -10 49  11 o 15 7.73277e+00 9.64427e-01 1.56214e+02 65.355  6.45300e+00  1.40653e+01  0.00000e+00 0.00000e+00 1.23746e+02 65.355  3.24672e+01 245.355 0.9671 
1 1 1 -10 49  12 o 15 4.12366e+00 9.55584e-01 7.03629e+01 294.961 1.77251e+00  -3.80787e+00 0.00000e+00 0.00000e+00 6.39129e+01 294.961 6.45003e+00 114.961 0.8708 
1 1 1 -10 49  13 o 3  6.36832e+00 9.25069e-01 1.49893e+02 71.647  4.59829e+00  1.38612e+01  0.00000e+00 0.00000e+00 7.96695e+01 71.647  7.02231e+01 251.647 0.9651 
1 1 1 -10 49  14 o 8  9.70889e+00 7.37524e-01 2.12602e+02 195.837 -3.74383e+01 -1.06199e+01 0.00000e+00 0.00000e+00 1.44895e+02 195.837 6.77074e+01 15.837  0.9871 
1 1 1 -10 49  15 o 8  1.35997e+01 6.89962e-01 1.84211e+02 349.315 5.36587e+01  -1.01243e+01 0.00000e+00 0.00000e+00 3.17798e+02 349.315 1.33587e+02 349.315 0.9908 
1 1 1 -10 49  16 o 17 4.27795e+00 1.38110e+00 3.33168e+01 303.202 1.27138e+00  -1.94273e+00 0.00000e+00 0.00000e+00 8.51230e+01 303.202 5.18062e+01 303.202 0.7441 
1 1 1 -10 50  1  o 13 1.34795e+01 9.21188e-01 2.48735e+02 28.084  1.72373e+01  9.19773e+00  0.00000e+00 0.00000e+00 2.46512e+02 28.084  2.22238e+00 208.084 0.9741 
1 1 1 -10 50  2  o 9  1.10183e+01 8.52377e-01 1.41372e+02 115.406 -3.93652e+00 8.28809e+00  0.00000e+00 0.00000e+00 2.50685e+02 115.406 1.09313e+02 115.406 0.9438 
1 1 1 -10 50  3  o 11 6.38481e+00 9.21942e-01 1.72462e+02 154.521 -6.42731e+00 3.06277e+00  0.00000e+00 0.00000e+00 5.05141e+01 154.521 1.21948e+02 334.521 0.9268 
1 1 1 -10 50  4  o 18 5.59576e+00 9.12274e-01 1.42562e+02 331.691 4.92428e+00  -2.65249e+00 0.00000e+00 0.00000e+00 4.82474e+01 331.691 9.43150e+01 151.691 0.9055 
1 1 1 -10 50  5  o 16 5.33352e+00 1.02357e+00 6.53922e+01 80.841  3.91512e-01  2.42834e+00  0.00000e+00 0.00000e+00 8.72511e+01 80.841  2.18589e+01 80.841  0.7605 
1 1 1 -10 50  6  o 16 1.39071e+01 6.55869e-01 2.80971e+02 280.852 6.26120e+00  -3.26619e+01 0.00000e+00 0.00000e+00 2.34052e+02 280.852 4.69192e+01 100.852 0.9848 
1 1 1 -10 50  7  o 7  1.34766e+01 8.93978e-01 2.12967e+02 57.445  1.38043e+01  2.16222e+01  0.00000e+00 0.00000e+00 2.83417e+02 57.445  7.04495e+01 57.445  0.9803 
1 1 1 -10 50  8  o 2  1.19261e+01 7.27289e-01 1.65501e+02 201.842 -1.96394e+01 -7.87202e+00 0.00000e+00 0.00000e+00 2.71496e+02 201.842 1.05995e+02 201.842 0.9761 
1 1 1 -10 50  9  o 5  1.82081e+01 7.79974e-01 2.59870e+02 106.567 -1.62013e+01 5.44597e+01  0.00000e+00 0.00000e+00 4.17003e+02 106.567 1.57133e+02 106.567 0.9912 
1 1 1 -10 50  10 o 12 6.12069e+00 9.27709e-01 5.56176e+01 49.686  2.72921e+00  3.21659e+00  0.00000e+00 0.00000e+00 1.44231e+02 49.686  8.86132e+01 49.686  0.8714 
1 1 1 -10 50  11 o 8  2.94957e+00 9.11565e-01 6.67746e+01 248.754 -9.21078e-01 -2.36903e+00 0.00000e+00 0.00000e+00 1.81760e+01 248.754 4.85986e+01 68.754  0.7695 
1 1 1 -10 50  12 o 7  3.79939e+00 9.68374e-01 9.88669e+01 24.889  5.12327e+00  2.37699e+00  0.00000e+00 0.00000e+00 2.99062e+01 24.889  6.89607e+01 204.889 0.9065 
1 1 1 -10 50  13 o 7  5.65599e+00 9.63490e-01 8.94827e+01 223.977 -5.89089e+00 -5.68426e+00 0.00000e+00 0.00000e+00 1.08383e+02 223.977 1.89004e+01 223.977 0.9368 
1 1 1 -10 50  14 o 4  8.09869e+00 8.30150e-01 1.00725e+02 245.159 -6.25763e+00 -1.35175e+01 0.00000e+00 0.00000e+00 1.91025e+02 245.159 9.02997e+01 245.159 0.9658 
1 1 1 -10 50  15 o 9  2.15883e+00 7.36406e-01 4.92700e+01 139.171 -1.85045e+00 1.59890e+00  0.00000e+00 0.00000e+00 1.17629e+01 139.171 3.75071e+01 319.171 0.7589 
1 1 1 -10 50  16 o 11 5.52758e+00 1.61832e+00 1.16355e+02 167.265 -8.35433e+00 1.88810e+00  0.00000e+00 0.00000e+00 7.68687e+01 167.265 3.94866e+01 347.265 0.9397 
1 1 1 -10 51  1  o 17 3.03725e+01 9.08260e-01 4.71879e+02 250.296 -2.87197e+01 -8.01924e+01 0.00000e+00 0.00000e+00 6.66837e+02 250.296 1.94957e+02 250.296 0.9941 
1 1 1 -10 51  2  o 4  1.37252e+01 7.12935e-01 2.15784e+02 57.250  9.84658e+00  1.53083e+01  0.00000e+00 0.00000e+00 2.87171e+02 57.250  7.13877e+01 57.250  0.9721 
1 1 1 -10 51  3  o 19 1.13517e+01 7.02074e-01 2.24683e+02 248.311 -6.56972e+00 -1.65184e+01 0.00000e+00 0.00000e+00 1.90774e+02 248.311 3.39088e+01 68.311  0.9715 
1 1 1 -10 51  4  o 8  9.11068e+00 7.62670e-01 2.08809e+02 265.233 -1.15064e+00 -1.37974e+01 0.00000e+00 0.00000e+00 1.21586e+02 265.233 8.72226e+01 85.233  0.9632 
1 1 1 -10 51  5  f 0  7.22179e+00 8.78532e-01 1.91487e+02 56.114  6.07449e+00  9.04451e+00  0.00000e+00 0.00000e+00 6.74480e+01 56.114  1.24039e+02 236.114 0.9529 
1 1 1 -10 51  6  f 0  1.04038e+01 8.15530e-01 2.14826e+02 59.989  9.26823e+00  1.60457e+01  0.00000e+00 0.00000e+00 1.65626e+02 59.989  4.91997e+01 239.989 0.9726 
1 1 1 -10 51  7  o 5  1.06822e+01 7.30907e-01 1.75879e+02 324.158 1.43910e+01  -1.03953e+01 0.00000e+00 0.00000e+00 2.13954e+02 324.158 3.80751e+01 324.158 0.9714 
1 1 1 -10 51  8  o 2  1.30512e+01 6.78066e-01 2.71786e+02 97.882  -5.09616e+00 3.68119e+01  0.00000e+00 0.00000e+00 2.11456e+02 97.882  6.03300e+01 277.882 0.9865 
1 1 1 -10 51  9  o 7  1.01727e+01 7.50869e-01 1.48469e+02 182.928 -1.90792e+01 -9.75929e-01 0.00000e+00 0.00000e+00 2.22890e+02 182.928 7.44212e+01 182.928 0.9735 
1 1 1 -10 51  10 o 17 3.52831e+00 9.66182e-01 1.26096e+02 260.669 -8.82926e-01 -5.37360e+00 0.00000e+00 0.00000e+00 6.76254e+00 80.669  1.32859e+02 80.669  0.9028 
1 1 1 -10 51  11 o 8  8.57762e+00 8.63907e-01 1.82619e+02 71.911  7.08381e+00  2.16872e+01  0.00000e+00 0.00000e+00 1.31279e+02 71.911  5.13402e+01 251.911 0.9778 
1 1 1 -10 51  12 o 2  5.26171e+00 9.57741e-01 6.44633e+01 189.202 -4.70661e+00 -7.62444e-01 0.00000e+00 0.00000e+00 1.10149e+02 189.202 4.56855e+01 189.202 0.8877 
1 1 1 -10 51  13 o 10 9.67982e+00 7.25106e-01 1.15722e+02 278.542 3.01684e+00  -2.00847e+01 0.00000e+00 0.00000e+00 2.36706e+02 278.542 1.20984e+02 278.542 0.9751 
1 1 1 -10 51  14 o 15 5.58491e+00 9.73716e-01 7.36985e+01 119.928 -3.49217e+00 6.06628e+00  0.00000e+00 0.00000e+00 1.19073e+02 119.928 4.53744e+01 119.928 0.9255 
1 1 1 -10 51  15 o 14 1.26034e+01 7.29834e-01 2.26557e+02 209.941 -5.69309e+01 -3.27904e+01 0.00000e+00 0.00000e+00 2.39278e+02 209.941 1.27216e+01 209.941 0.9924 
1 1 1 -10 51  16 o 10 4.30312e+00 1.38356e+00 7.78740e+01 295.013 2.26869e+00  -4.86237e+00 0.00000e+00 0.00000e+00 6.63728e+01 295.013 1.15012e+01 115.013 0.9012 
1 1 1 -10 52  1  o 3  1.56401e+01 6.94986e-01 3.24234e+02 102.852 -7.62709e+00 3.34295e+01  0.00000e+00 0.00000e+00 2.56863e+02 102.852 6.73708e+01 282.852 0.9853 
1 1 1 -10 52  2  o 9  9.82923e+00 7.83688e-01 1.83436e+02 286.078 3.42839e+00  -1.18954e+01 0.00000e+00 0.00000e+00 1.71732e+02 286.078 1.17034e+01 106.078 0.9587 
1 1 1 -10 52  3  o 3  2.89831e+01 7.12815e-01 4.25733e+02 170.841 -8.91549e+01 1.43750e+01  0.00000e+00 0.00000e+00 6.59964e+02 170.841 2.34231e+02 170.841 0.9944 
1 1 1 -10 52  4  o 6  2.89262e+01 7.14612e-01 5.01686e+02 351.920 1.03379e+02  -1.46761e+01 0.00000e+00 0.00000e+00 5.82031e+02 351.920 8.03443e+01 351.920 0.9952 
1 1 1 -10 52  5  o 1  7.65871e+00 1.16943e+00 1.18904e+02 63.733  2.77125e+00  5.61532e+00  0.00000e+00 0.00000e+00 1.45086e+02 63.733  2.61814e+01 63.733  0.9162 
1 1 1 -10 52  6  o 1  9.61627e+00 7.26782e-01 1.39264e+02 359.457 1.19127e+01  -1.12910e-01 0.00000e+00 0.00000e+00 2.06712e+02 359.457 6.74482e+01 359.457 0.9571 
1 1 1 -10 52  7  o 13 7.04944e+00 9.07427e-01 1.22536e+02 331.154 6.79917e+00  -3.74501e+00 0.00000e+00 0.00000e+00 1.24559e+02 331.154 2.02303e+00 331.154 0.9332 
1 1 1 -10 52  8  f 0  3.04448e+00 8.51531e-01 1.40885e+02 32.697  3.78043e+00  2.42668e+00  0.00000e+00 0.00000e+00 4.03248e+01 212.697 1.81209e+02 212.697 0.8801 
1 1 1 -10 52  9  o 19 5.13351e+00 1.02188e+00 1.53712e+02 123.479 -4.92820e+00 7.45149e+00  0.00000e+00 0.00000e+00 2.76547e+01 123.479 1.26057e+02 303.479 0.9422 
1 1 1 -10 52  10 o 5  2.38213e+00 7.84633e-01 6.26355e+01 139.940 -1.48587e+00 1.24945e+00  0.00000e+00 0.00000e+00 1.25290e+00 319.940 6.38884e+01 319.940 0.6879 
1 1 1 -10 52  11 o 7  4.01044e+00 1.02280e+00 9.44452e+01 21.867  4.75556e+00  1.90852e+00  0.00000e+00 0.00000e+00 4.00436e+01 21.867  5.44015e+01 201.867 0.8962 
1 1 1 -10 52  12 o 19 8.66815e+00 7.61965e-01 9.93601e+01 264.316 -1.45379e+00 -1.46055e+01 0.00000e+00 0.00000e+00 2.13398e+02 264.316 1.14038e+02 264.316 0.9653 
1 1 1 -10 52  13 o 3  2.71153e+00 8.51768e-01 6.86907e+01 354.247 3.21302e+00  -3.23679e-01 0.00000e+00 0.00000e+00 1.48879e+01 354.247 5.38027e+01 174.247 0.8256 
1 1 1 -10 52  14 o 19 8.29839e+00 8.40084e-01 1.21246e+02 147.922 -1.59271e+01 9.98265e+00  0.00000e+00 0.00000e+00 1.79842e+02 147.922 5.85955e+01 147.922 0.9730 
1 1 1 -10 52  15 o 14 2.91842e+00 9.11685e-01 6.72566e+01 85.962  2.76017e-01  3.90950e+00  0.00000e+00 0.00000e+00 2.62485e+01 85.962  4.10081e+01 265.962 0.8603 
1 1 1 -10 52  16 o 18 2.66675e+00 9.27781e-01 6.78423e+01 25.474  3.90718e+00  1.86145e+00  0.00000e+00 0.00000e+00 1.89422e+01 25.474  4.89000e+01 205.474 0.8750 
1 1 1 -10 53  1  o 2  1.02259e+01 7.62494e-01 2.26695e+02 229.258 -1.04149e+01 -1.20905e+01 0.00000e+00 0.00000e+00 1.46571e+02 229.258 8.01237e+01 49.258  0.9681 
1 1 1 -10 53  2  o 1  1.72849e+01 7.00951e-01 2.71611e+02 144.649 -2.81115e+01 1.99413e+01  0.00000e+00 0.00000e+00 3.70241e+02 144.649 9.86304e+01 144.649 0.9854 
1 1 1 -10 53  3  o 13 1.01840e+01 7.20375e-01 1.85070e+02 200.620 -1.29404e+01 -4.86905e+00 0.00000e+00 0.00000e+00 1.84350e+02 200.620 7.19644e-01 20.620  0.9631 
1 1 1 -10 53  4  f 0  9.64579e+00 7.54022e-01 1.28994e+02 9.732   9.21603e+00  1.58054e+00  0.00000e+00 0.00000e+00 2.14075e+02 9.732   8.50810e+01 9.732   0.9449 
1 1 1 -10 53  5  o 16 8.70443e+00 7.36611e-01 1.22081e+02 300.240 4.47489e+00  -7.67614e+00 0.00000e+00 0.00000e+00 1.86318e+02 300.240 6.42370e+01 300.240 0.9419 
1 1 1 -10 53  6  o 14 8.86286e+00 7.37955e-01 2.02631e+02 112.324 -6.03981e+00 1.47086e+01  0.00000e+00 0.00000e+00 1.19845e+02 112.324 8.27855e+01 292.325 0.9680 
1 1 1 -10 53  7  o 6  3.10829e+01 9.10703e-01 4.91144e+02 258.699 -2.94855e+01 -1.47550e+02 0.00000e+00 0.00000e+00 6.72344e+02 258.699 1.81200e+02 258.699 0.9967 
1 1 1 -10 53  8  o 15 1.08190e+01 7.30088e-01 2.44379e+02 72.082  8.29923e+00  2.56667e+01  0.00000e+00 0.00000e+00 1.54001e+02 72.082  9.03782e+01 252.082 0.9813 
1 1 1 -10 53  9  o 12 1.41596e+01 6.83264e-01 2.14578e+02 171.256 -3.65136e+01 5.61629e+00  0.00000e+00 0.00000e+00 3.09028e+02 171.256 9.44507e+01 171.256 0.9864 
1 1 1 -10 53  10 o 17 7.48106e+00 8.34052e-01 1.90844e+02 95.979  -1.96035e+00 1.87188e+01  0.00000e+00 0.00000e+00 8.17968e+01 95.979  1.09047e+02 275.979 0.9731 
1 1 1 -10 53  11 o 5  3.42297e+00 9.81631e-01 4.89407e+01 357.441 2.29394e+00  -1.02532e-01 0.00000e+00 0.00000e+00 4.59429e+01 357.441 2.99779e+00 177.441 0.7409 
1 1 1 -10 53  12 o 2  5.89272e+00 9.11195e-01 1.43654e+02 60.861  6.12425e+00  1.09857e+01  0.00000e+00 0.00000e+00 6.76274e+01 60.861  7.60263e+01 240.861 0.9594 
1 1 1 -10 53  13 f 0  1.12064e+01 6.92332e-01 1.64162e+02 117.410 -1.47295e+01 2.84043e+01  0.00000e+00 0.00000e+00 2.47570e+02 117.410 8.34088e+01 117.410 0.9842 
1 1 1 -10 53  14 o 1  4.54331e+00 1.05410e+00 6.11837e+01 229.920 -3.09717e+00 -3.68061e+00 0.00000e+00 0.00000e+00 8.93676e+01 229.920 2.81839e+01 229.920 0.8888 
1 1 1 -10 53  15 o 7  3.12345e+00 9.32875e-01 1.98267e+01 141.830 -9.66632e-01 7.59850e-01  0.00000e+00 0.00000e+00 4.08636e+01 141.830 2.10369e+01 141.830 0.5218 
1 1 1 -10 53  16 f 0  4.09397e+00 1.23975e+00 3.86614e+01 348.382 2.77088e+00  -5.69670e-01 0.00000e+00 0.00000e+00 8.25912e+01 348.382 4.39298e+01 348.382 0.7965 
1 1 1 -10 54  1  o 17 8.64062e+00 8.05861e-01 1.31191e+02 43.219  5.96840e+00  5.60845e+00  0.00000e+00 0.00000e+00 1.73952e+02 43.219  4.27614e+01 43.219  0.9368 
1 1 1 -10 54  2  o 16 1.18426e+01 7.14995e-01 1.66649e+02 192.184 -1.41752e+01 -3.06062e+00 0.00000e+00 0.00000e+00 2.63896e+02 192.184 9.72472e+01 192.184 0.9649 
1 1 1 -10 54  3  o 13 1.00289e+01 7.13317e-01 1.05265e+02 313.617 5.53573e+00  -5.80958e+00 0.00000e+00 0.00000e+00 2.48022e+02 313.617 1.42757e+02 313.617 0.9354 
1 1 1 -10 54  4  o 13 1.10024e+01 6.83895e-01 1.74667e+02 301.749 7.88210e+00  -1.27376e+01 0.00000e+00 0.00000e+00 2.25335e+02 301.749 5.06674e+01 301.749 0.9660 
1 1 1 -10 54  5  o 12 2.20369e+01 6.63441e-01 3.60889e+02 69.094  2.57029e+01  6.72873e+01  0.00000e+00 0.00000e+00 4.62124e+02 69.094  1.01235e+02 69.094  0.9930 
1 1 1 -10 54  6  o 13 7.69928e+00 7.94575e-01 1.67098e+02 212.328 -9.98461e+00 -6.31886e+00 0.00000e+00 0.00000e+00 1.09724e+02 212.328 5.73740e+01 32.328  0.9567 
1 1 1 -10 54  7  o 19 1.48445e+01 6.67097e-01 2.79747e+02 38.297  3.39253e+01  2.67895e+01  0.00000e+00 0.00000e+00 2.71196e+02 38.297  8.55098e+00 218.297 0.9884 
1 1 1 -10 54  8  o 16 9.17172e+00 7.98468e-01 2.29662e+02 140.432 -1.84088e+01 1.52115e+01  0.00000e+00 0.00000e+00 1.07168e+02 140.432 1.22494e+02 320.432 0.9788 
1 1 1 -10 54  9  o 4  8.30959e+00 7.86384e-01 1.48136e+02 334.516 1.42672e+01  -6.80017e+00 0.00000e+00 0.00000e+00 1.53323e+02 334.516 5.18684e+00 334.516 0.9678 
1 1 1 -10 54  10 o 17 8.81091e+00 7.65153e-01 1.43633e+02 91.374  -4.34606e-01 1.81130e+01  0.00000e+00 0.00000e+00 1.77075e+02 91.374  3.34412e+01 91.374  0.9720 
1 1 1 -10 54  11 o 17 5.05353e+00 9.29172e-01 1.04617e+02 269.690 -4.03947e-02 -7.46722e+00 0.00000e+00 0.00000e+00 7.12715e+01 269.690 3.33456e+01 89.690  0.9304 
1 1 1 -10 54  12 o 12 1.24064e+01 6.70720e-01 2.53087e+02 111.066 -2.03271e+01 5.27733e+01  0.00000e+00 0.00000e+00 2.06386e+02 111.066 4.67009e+01 291.066 0.9911 
1 1 1 -10 54  13 o 14 3.28588e+00 9.51634e-01 2.85818e+01 219.552 -1.20370e+00 -9.94099e-01 0.00000e+00 0.00000e+00 4.63376e+01 219.552 1.77558e+01 219.552 0.6109 
1 1 1 -10 54  14 o 19 5.84654e+00 1.03573e+00 7.37839e+01 134.627 -5.26791e+00 5.33693e+00  0.00000e+00 0.00000e+00 1.29061e+02 134.627 5.52770e+01 134.627 0.9307 
1 1 1 -10 54  15 f 0  8.41269e+00 9.34808e-01 1.23500e+02 314.608 1.52691e+01  -1.54795e+01 0.00000e+00 0.00000e+00 1.82412e+02 314.608 5.89119e+01 314.608 0.9767 
1 1 1 -10 54  16 o 4  4.23937e+00 1.22971e+00 7.35955e+01 110.822 -2.03240e+00 5.34415e+00  0.00000e+00 0.00000e+00 6.94791e+01 110.822 4.11633e+00 290.822 0.9077 
1 1 1 -10 55  1  o 3  1.12823e+01 7.26529e-01 2.44365e+02 69.065  7.08636e+00  1.85234e+01  0.00000e+00 0.00000e+00 1.70022e+02 69.065  7.43422e+01 249.065 0.9745 
1 1 1 -10 55  2  o 6  9.82687e+00 7.60102e-01 1.99801e+02 73.753  3.91448e+00  1.34322e+01  0.00000e+00 0.00000e+00 1.56922e+02 73.753  4.28792e+01 253.753 0.9636 
1 1 1 -10 55  3  o 5  1.23886e+01 8.42177e-01 2.52030e+02 170.793 -2.45186e+01 3.97437e+00  0.00000e+00 0.00000e+00 2.04941e+02 170.793 4.70891e+01 350.793 0.9797 
1 1 1 -10 55  4  o 7  6.93236e+00 8.65651e-01 9.79869e+01 273.538 3.39893e-01  -5.49739e+00 0.00000e+00 0.00000e+00 1.37820e+02 273.538 3.98327e+01 273.538 0.9040 
1 1 1 -10 55  5  o 19 4.33316e+00 9.62265e-01 1.22907e+02 87.474  1.95718e-01  4.43688e+00  0.00000e+00 0.00000e+00 2.02503e+01 87.474  1.02656e+02 267.474 0.8786 
1 1 1 -10 55  6  o 9  1.22281e+01 6.73475e-01 2.09658e+02 296.938 1.11218e+01  -2.18860e+01 0.00000e+00 0.00000e+00 2.40364e+02 296.938 3.07056e+01 296.938 0.9794 
1 1 1 -10 55  7  o 5  1.17612e+01 6.51698e-01 2.18719e+02 134.756 -1.91164e+01 1.92799e+01  0.00000e+00 0.00000e+00 2.14654e+02 134.756 4.06485e+00 314.756 0.9814 
1 1 1 -10 55  8  o 6  3.98584e+00 9.10998e-01 3.23565e+01 154.533 -1.33111e+00 6.33963e-01  0.00000e+00 0.00000e+00 5.58216e+01 154.533 2.34651e+01 154.533 0.5897 
1 1 1 -10 55  9  o 12 7.75438e+00 7.94248e-01 8.17857e+01 286.200 2.31860e+00  -7.98048e+00 0.00000e+00 0.00000e+00 1.90747e+02 286.200 1.08962e+02 286.200 0.9378 
1 1 1 -10 55  10 o 8  4.43148e+00 1.03200e+00 8.02195e+01 5.040   4.39466e+00  3.87605e-01  0.00000e+00 0.00000e+00 6.54075e+01 5.040   1.48120e+01 185.040 0.8777 
1 1 1 -10 55  11 o 1  5.41420e+00 8.49423e-01 5.11763e+01 295.374 1.81546e+00  -3.82780e+00 0.00000e+00 0.00000e+00 1.25417e+02 295.374 7.42404e+01 295.374 0.8720 
1 1 1 -10 55  12 o 6  5.45025e+00 9.40840e-01 1.24920e+02 336.339 9.98990e+00  -4.37714e+00 0.00000e+00 0.00000e+00 6.91377e+01 336.339 5.57819e+01 156.339 0.9530 
1 1 1 -10 55  13 o 19 9.13951e+00 8.30324e-01 1.71359e+02 18.364  2.75710e+01  9.15243e+00  0.00000e+00 0.00000e+00 1.63786e+02 18.364  7.57282e+00 198.364 0.9826 
1 1 1 -10 55  14 o 2  3.88225e+00 1.03347e+00 3.95401e+01 13.575  2.64718e+00  6.39215e-01  0.00000e+00 0.00000e+00 7.43743e+01 13.575  3.48342e+01 13.575  0.7872 
1 1 1 -10 55  15 o 2  7.65947e+00 1.01049e+00 1.16116e+02 103.910 -4.48857e+00 1.81244e+01  0.00000e+00 0.00000e+00 1.61258e+02 103.910 4.51427e+01 103.910 0.9728 
1 1 1 -10 55  16 o 2  5.14714e+00 1.45570e+00 9.05958e+01 285.876 2.11813e+00  -7.44759e+00 0.00000e+00 0.00000e+00 8.79221e+01 285.876 2.67373e+00 105.876 0.9330 
1 1 1 -10 56  1  o 4  5.99086e+00 1.22122e+00 9.77480e+01 182.981 -3.89250e+00 -2.02729e-01 0.00000e+00 0.00000e+00 9.62972e+01 182.981 1.45076e+00 2.981   0.8595 
1 1 1 -10 56  2  o 7  1.54373e+01 6.61099e-01 2.42686e+02 309.543 1.97915e+01  -2.39723e+01 0.00000e+00 0.00000e+00 3.29368e+02 309.543 8.66816e+01 309.543 0.9838 
1 1 1 -10 56  3  o 11 1.68514e+01 8.33493e-01 3.55177e+02 358.338 4.50631e+01  -1.30771e+00 0.00000e+00 0.00000e+00 2.72144e+02 358.338 8.30324e+01 178.338 0.9888 
1 1 1 -10 56  4  o 8  1.52209e+01 6.47424e-01 2.91370e+02 186.097 -3.80580e+01 -4.06512e+00 0.00000e+00 0.00000e+00 2.73760e+02 186.097 1.76104e+01 6.097   0.9868 
1 1 1 -10 56  5  o 11 4.77926e+00 9.80475e-01 6.53623e+01 152.373 -2.29075e+00 1.19895e+00  0.00000e+00 0.00000e+00 7.37156e+01 152.373 8.35328e+00 152.373 0.7740 
1 1 1 -10 56  6  o 3  8.86463e+00 7.27920e-01 2.27216e+02 38.649  1.64412e+01  1.31480e+01  0.00000e+00 0.00000e+00 9.78196e+01 38.649  1.29396e+02 218.649 0.9760 
1 1 1 -10 56  7  o 4  5.85749e+00 8.48925e-01 7.40518e+01 189.583 -4.48430e+00 -7.57130e-01 0.00000e+00 0.00000e+00 1.19829e+02 189.583 4.57774e+01 189.583 0.8817 
1 1 1 -10 56  8  o 7  7.58797e+00 8.00335e-01 1.44997e+02 10.517  1.34278e+01  2.49282e+00  0.00000e+00 0.00000e+00 1.28984e+02 10.517  1.60131e+01 190.517 0.9627 
1 1 1 -10 56  9  o 7  3.72388e+00 9.09839e-01 3.35244e+01 348.876 1.53744e+00  -3.02307e-01 0.00000e+00 0.00000e+00 5.19100e+01 348.876 1.83855e+01 348.876 0.6122 
1 1 1 -10 56  10 o 14 3.84287e+00 9.35926e-01 9.79626e+01 37.094  4.32393e+00  3.26951e+00  0.00000e+00 0.00000e+00 3.18456e+01 37.094  6.61170e+01 217.094 0.9023 
1 1 1 -10 56  11 o 17 3.54749e+00 9.71179e-01 5.24778e+01 267.851 -9.41003e-02 -2.50720e+00 0.00000e+00 0.00000e+00 4.91400e+01 267.851 3.33780e+00 87.851  0.7660 
1 1 1 -10 56  12 o 16 7.85317e+00 8.37767e-01 1.56414e+02 75.581  4.89715e+00  1.90468e+01  0.00000e+00 0.00000e+00 1.29389e+02 75.581  2.70253e+01 255.581 0.9742 
1 1 1 -10 56  13 o 6  3.70049e+00 9.71647e-01 3.82023e+01 150.112 -1.92089e+00 1.10402e+00  0.00000e+00 0.00000e+00 6.26159e+01 150.112 2.44136e+01 150.112 0.7302 
1 1 1 -10 56  14 o 5  2.85745e+00 9.07463e-01 5.58527e+01 89.224  4.16838e-02  3.07841e+00  0.00000e+00 0.00000e+00 3.10022e+01 89.224  2.48505e+01 269.224 0.8156 
1 1 1 -10 56  15 o 18 3.96289e+00 1.08897e+00 8.13821e+01 155.979 -5.93598e+00 2.64554e+00  0.00000e+00 0.00000e+00 5.42332e+01 155.979 2.71489e+01 335.978 0.9195 
1 1 1 -10 56  16 o 3  4.15251e+00 1.19571e+00 9.63076e+01 0.044   8.25176e+00  6.29197e-03  0.00000e+00 0.00000e+00 4.83549e+01 0.044   4.79527e+01 180.044 0.9373 
1 1 1 -10 57  1  o 5  1.92717e+01 9.63276e-01 3.19625e+02 354.179 4.48044e+01  -4.56783e+00 0.00000e+00 0.00000e+00 3.98430e+02 354.179 7.88044e+01 354.179 0.9888 
1 1 1 -10 57  2  o 9  2.02122e+01 6.57174e-01 3.24785e+02 143.285 -4.11884e+01 3.07182e+01  0.00000e+00 0.00000e+00 4.28994e+02 143.285 1.04209e+02 143.285 0.9902 
1 1 1 -10 57  3  o 5  5.60860e+00 9.19578e-01 1.07163e+02 191.823 -4.69404e+00 -9.82596e-01 0.00000e+00 0.00000e+00 8.03928e+01 191.823 2.67704e+01 11.823  0.8884 
1 1 1 -10 57  4  o 19 1.22238e+01 6.19541e-01 1.87663e+02 218.186 -1.64469e+01 -1.29361e+01 0.00000e+00 0.00000e+00 2.61039e+02 218.186 7.33757e+01 218.186 0.9758 
1 1 1 -10 57  5  o 5  1.05546e+01 6.52751e-01 1.10231e+02 15.631  1.06606e+01  2.98278e+00  0.00000e+00 0.00000e+00 2.68170e+02 15.631  1.57939e+02 15.631  0.9537 
1 1 1 -10 57  6  o 6  4.70801e+00 8.91953e-01 1.04407e+02 276.163 5.14813e-01  -4.76723e+00 0.00000e+00 0.00000e+00 5.27088e+01 276.163 5.16982e+01 96.163  0.8884 
1 1 1 -10 57  7  o 10 5.29588e+00 8.73538e-01 1.30372e+02 195.301 -6.50745e+00 -1.78037e+00 0.00000e+00 0.00000e+00 5.30165e+01 195.301 7.73557e+01 15.301  0.9226 
1 1 1 -10 57  8  o 16 3.92093e+00 9.50942e-01 1.42066e+02 145.674 -5.09354e+00 3.47791e+00  0.00000e+00 0.00000e+00 7.53943e+00 325.674 1.49606e+02 325.674 0.9149 
1 1 1 -10 57  9  o 13 6.37903e+00 9.16054e-01 1.65340e+02 112.385 -5.19693e+00 1.26177e+01  0.00000e+00 0.00000e+00 6.47333e+01 112.385 1.00607e+02 292.386 0.9626 
1 1 1 -10 57  10 o 11 4.40035e+00 9.98799e-01 1.08780e+02 250.906 -2.13364e+00 -6.16378e+00 0.00000e+00 0.00000e+00 4.27145e+01 250.906 6.60656e+01 70.906  0.9198 
1 1 1 -10 57  11 o 3  3.55435e+00 8.14122e-01 1.08637e+02 86.660  3.66111e-01  6.27341e+00  0.00000e+00 0.00000e+00 1.31752e+01 86.660  9.54620e+01 266.660 0.9166 
1 1 1 -10 57  12 f 0  1.53358e+01 6.53912e-01 1.65580e+02 220.844 -3.66105e+01 -3.16506e+01 0.00000e+00 0.00000e+00 4.01264e+02 220.844 2.35684e+02 220.844 0.9896 
1 1 1 -10 57  13 f 0  3.33806e+00 8.98240e-01 9.37049e+01 271.887 1.77630e-01  -5.39051e+00 0.00000e+00 0.00000e+00 1.85939e+01 271.887 7.51111e+01 91.887  0.9018 
1 1 1 -10 57  14 o 3  4.19667e+00 1.05133e+00 1.03849e+02 336.241 6.92978e+00  -3.05049e+00 0.00000e+00 0.00000e+00 4.17958e+01 336.241 6.20532e+01 156.241 0.9314 
1 1 1 -10 57  15 o 11 4.69446e+00 1.00523e+00 7.30961e+01 73.622  2.15850e+00  7.34458e+00  0.00000e+00 0.00000e+00 8.97514e+01 73.622  1.66553e+01 73.622  0.9322 
1 1 1 -10 57  16 o 1  4.44413e+00 1.28724e+00 4.79987e+01 289.844 1.33016e+00  -3.68576e+00 0.00000e+00 0.00000e+00 9.40859e+01 289.844 4.60873e+01 289.844 0.8603 
1 1 1 -10 58  1  o 9  8.98413e+00 8.42376e-01 1.58684e+02 213.028 -9.76188e+00 -6.34628e+00 0.00000e+00 0.00000e+00 1.64908e+02 213.028 6.22412e+00 213.028 0.9560 
1 1 1 -10 58  2  o 19 8.91918e+00 7.01782e-01 1.31248e+02 120.491 -5.00648e+00 8.50240e+00  0.00000e+00 0.00000e+00 1.87106e+02 120.491 5.58585e+01 120.491 0.9479 
1 1 1 -10 58  3  o 10 4.15300e+00 9.66495e-01 1.08678e+02 250.725 -1.24392e+00 -3.55702e+00 0.00000e+00 0.00000e+00 2.47966e+01 250.725 8.38814e+01 70.725  0.8540 
1 1 1 -10 58  4  o 10 1.07040e+01 6.43357e-01 1.83257e+02 1.219   1.77555e+01  3.77947e-01  0.00000e+00 0.00000e+00 2.07835e+02 1.219   2.45782e+01 1.219   0.9714 
1 1 1 -10 58  5  o 5  5.78070e+00 8.81924e-01 1.56397e+02 57.858  4.35976e+00  6.93869e+00  0.00000e+00 0.00000e+00 4.71522e+01 57.858  1.09245e+02 237.858 0.9368 
1 1 1 -10 58  6  o 6  1.56603e+01 6.03467e-01 2.38364e+02 180.660 -4.13302e+01 -4.76281e-01 0.00000e+00 0.00000e+00 3.42651e+02 180.660 1.04287e+02 180.660 0.9878 
1 1 1 -10 58  7  f 0  5.65816e+00 8.76113e-01 1.16077e+02 148.126 -6.15134e+00 3.82499e+00  0.00000e+00 0.00000e+00 8.10084e+01 148.126 3.50687e+01 328.126 0.9282 
1 1 1 -10 58  8  o 14 4.63456e+00 9.28526e-01 1.02561e+02 76.736  1.32435e+00  5.61821e+00  0.00000e+00 0.00000e+00 5.53444e+01 76.736  4.72167e+01 256.736 0.9087 
1 1 1 -10 58  9  o 11 8.01976e+00 8.33846e-01 9.13648e+01 336.415 8.85536e+00  -3.86597e+00 0.00000e+00 0.00000e+00 1.93067e+02 336.415 1.01702e+02 336.415 0.9467 
1 1 1 -10 58  10 o 14 1.51944e+01 7.21030e-01 2.91282e+02 104.904 -1.77524e+01 6.67000e+01  0.00000e+00 0.00000e+00 2.73228e+02 104.904 1.80537e+01 284.904 0.9927 
1 1 1 -10 58  11 o 15 1.55699e+01 6.24296e-01 2.73611e+02 305.192 4.45827e+01  -6.32195e+01 0.00000e+00 0.00000e+00 3.04702e+02 305.192 3.10919e+01 305.192 0.9935 
1 1 1 -10 58  12 o 2  5.98179e+00 1.00516e+00 8.78655e+01 152.856 -7.28348e+00 3.73422e+00  0.00000e+00 0.00000e+00 1.21392e+02 152.856 3.35264e+01 152.856 0.9368 
1 1 1 -10 58  13 o 14 8.56056e+00 8.64305e-01 1.19759e+02 264.432 -1.80955e+00 -1.85622e+01 0.00000e+00 0.00000e+00 1.90872e+02 264.432 7.11130e+01 264.432 0.9728 
1 1 1 -10 58  14 o 10 5.07481e+00 1.12371e+00 1.30182e+02 78.397  2.33525e+00  1.13738e+01  0.00000e+00 0.00000e+00 5.05449e+01 78.397  7.96367e+01 258.397 0.9559 
1 1 1 -10 58  15 o 2  2.74672e+00 8.78844e-01 2.48156e+01 351.890 1.53345e+00  -2.18502e-01 0.00000e+00 0.00000e+00 3.73200e+01 351.890 1.25044e+01 351.890 0.6080 
1 1 1 -10 58  16 o 5  2.93616e+00 9.50349e-01 8.66820e+01 270.846 1.02556e-01  -6.94268e+00 0.00000e+00 0.00000e+00 1.42218e+01 270.846 7.24603e+01 90.846  0.9249 
1 1 1 -10 59  1  o 13 4.63609e+00 9.96148e-01 2.63962e+01 152.150 -8.55001e-01 4.51747e-01  0.00000e+00 0.00000e+00 4.94954e+01 152.150 2.30991e+01 152.150 0.4346 
1 1 1 -10 59  2  o 15 5.71960e+00 9.12395e-01 1.21197e+02 75.707  1.45232e+00  5.70053e+00  0.00000e+00 0.00000e+00 7.48700e+01 75.707  4.63269e+01 255.707 0.9105 
1 1 1 -10 59  3  o 2  7.97707e+00 7.57139e-01 1.92361e+02 52.448  8.25106e+00  1.07328e+01  0.00000e+00 0.00000e+00 9.64977e+01 52.448  9.58634e+01 232.448 0.9623 
1 1 1 -10 59  4  o 10 1.08084e+01 7.48732e-01 1.77512e+02 282.943 3.99530e+00  -1.73842e+01 0.00000e+00 0.00000e+00 2.17379e+02 282.943 3.98672e+01 282.943 0.9716 
1 1 1 -10 59  5  o 14 6.90140e+00 7.82358e-01 1.67583e+02 226.074 -8.24371e+00 -8.55885e+00 0.00000e+00 0.00000e+00 8.06067e+01 226.074 8.69768e+01 46.074  0.9570 
1 1 1 -10 59  6  o 11 1.20220e+01 6.25490e-01 2.20643e+02 214.782 -2.44492e+01 -1.69812e+01 0.00000e+00 0.00000e+00 2.23161e+02 214.782 2.51788e+00 214.782 0.9831 
1 1 1 -10 59  7  o 12 8.19888e+00 7.28291e-01 1.00942e+02 232.357 -6.17283e+00 -8.00330e+00 0.00000e+00 0.00000e+00 1.91058e+02 232.357 9.01156e+01 232.357 0.9492 
1 1 1 -10 59  8  o 8  1.30686e+01 6.45903e-01 2.10325e+02 75.991  8.59334e+00  3.44426e+01  0.00000e+00 0.00000e+00 2.72663e+02 75.991  6.23378e+01 75.991  0.9858 
1 1 1 -10 59  9  o 9  4.38443e+00 9.98863e-01 3.96588e+01 69.994  7.66916e-01  2.10640e+00  0.00000e+00 0.00000e+00 8.08339e+01 69.994  4.11750e+01 69.994  0.7337 
1 1 1 -10 59  10 f 0  9.80655e+00 6.71454e-01 1.84678e+02 24.259  2.62158e+01  1.18141e+01  0.00000e+00 0.00000e+00 1.75830e+02 24.259  8.84870e+00 204.259 0.9825 
1 1 1 -10 59  11 o 10 4.94017e+00 9.38015e-01 1.25242e+02 263.272 -1.06274e+00 -9.00921e+00 0.00000e+00 0.00000e+00 4.89221e+01 263.272 7.63200e+01 83.272  0.9432 
1 1 1 -10 59  12 o 5  8.52237e+00 7.82367e-01 1.57737e+02 147.109 -2.03044e+01 1.31310e+01  0.00000e+00 0.00000e+00 1.53822e+02 147.109 3.91509e+00 327.109 0.9791 
1 1 1 -10 59  13 o 18 3.79357e+00 1.03247e+00 8.36070e+01 111.385 -1.92144e+00 4.90675e+00  0.00000e+00 0.00000e+00 4.36228e+01 111.385 3.99842e+01 291.385 0.8993 
1 1 1 -10 59  14 o 9  6.93414e+00 1.09792e+00 1.19921e+02 210.508 -1.27946e+01 -7.53907e+00 0.00000e+00 0.00000e+00 1.29513e+02 210.508 9.59205e+00 210.508 0.9657 
1 1 1 -10 59  15 f 0  3.67089e+00 1.05276e+00 5.82616e+01 280.046 7.93343e-01  -4.47801e+00 0.00000e+00 0.00000e+00 6.21460e+01 280.046 3.88443e+00 280.046 0.8817 
1 1 1 -10 59  16 o 1  5.66319e+00 1.20642e+00 1.06505e+02 6.492   1.25185e+01  1.42450e+00  0.00000e+00 0.00000e+00 9.53561e+01 6.492   1.11488e+01 186.492 0.9595 
1 1 1 -10 60  1  o 7  8.40385e+00 8.93713e-01 1.76198e+02 331.304 1.10682e+01  -6.05869e+00 0.00000e+00 0.00000e+00 1.27495e+02 331.304 4.87031e+01 151.304 0.9595 
1 1 1 -10 60  2  o 18 1.13960e+01 7.83410e-01 2.08435e+02 149.744 -1.79841e+01 1.04904e+01  0.00000e+00 0.00000e+00 2.10116e+02 149.744 1.68147e+00 149.744 0.9757 
1 1 1 -10 60  3  o 19 1.38985e+01 6.20839e-01 2.46645e+02 347.019 3.21153e+01  -7.40317e+00 0.00000e+00 0.00000e+00 2.68257e+02 347.019 2.16124e+01 347.019 0.9847 
1 1 1 -10 60  4  o 13 8.08324e+00 9.04565e-01 1.47690e+02 245.096 -4.52735e+00 -9.75174e+00 0.00000e+00 0.00000e+00 1.41735e+02 245.096 5.95496e+00 65.096  0.9523 
1 1 1 -10 60  5  o 9  6.16801e+00 8.50960e-01 1.43707e+02 199.525 -8.62375e+00 -3.05811e+00 0.00000e+00 0.00000e+00 7.49927e+01 199.525 6.87140e+01 19.525  0.9437 
1 1 1 -10 60  6  o 15 8.45610e+00 7.28465e-01 2.37244e+02 59.202  1.04931e+01  1.76036e+01  0.00000e+00 0.00000e+00 7.24036e+01 59.202  1.64841e+02 239.202 0.9753 
1 1 1 -10 60  7  o 15 2.95062e+00 7.88939e-01 6.62231e+01 42.760  1.78566e+00  1.65125e+00  0.00000e+00 0.00000e+00 1.76185e+01 42.760  4.86046e+01 222.760 0.7574 
1 1 1 -10 60  8  o 13 1.25154e+01 6.43308e-01 2.47636e+02 29.868  3.73998e+01  2.14781e+01  0.00000e+00 0.00000e+00 2.16016e+02 29.868  3.16192e+01 209.868 0.9883 
1 1 1 -10 60  9  o 14 1.49634e+01 6.47707e-01 1.88378e+02 159.392 -3.78855e+01 1.42462e+01  0.00000e+00 0.00000e+00 3.65022e+02 159.392 1.76644e+02 159.392 0.9876 
1 1 1 -10 60  10 o 1  2.91609e+00 8.33255e-01 6.68119e+01 48.427  1.91248e+00  2.15616e+00  0.00000e+00 0.00000e+00 2.05623e+01 48.427  4.62495e+01 228.427 0.8009 
1 1 1 -10 60  11 o 12 1.09221e+01 6.83880e-01 2.00045e+02 186.563 -3.89626e+01 -4.48271e+00 0.00000e+00 0.00000e+00 2.02912e+02 186.563 2.86713e+00 186.563 0.9872 
1 1 1 -10 60  12 o 3  3.48593e+00 9.67413e-01 1.22869e+02 103.241 -1.61814e+00 6.87696e+00  0.00000e+00 0.00000e+00 2.32985e+00 283.241 1.25199e+02 283.241 0.9262 
1 1 1 -10 60  13 o 12 4.19755e+00 1.06045e+00 1.11194e+02 258.893 -1.48644e+00 -7.57187e+00 0.00000e+00 0.00000e+00 3.48011e+01 258.893 7.63924e+01 78.893  0.9328 
1 1 1 -10 60  14 o 6  1.07197e+01 8.40209e-01 1.81838e+02 334.238 3.67459e+01  -1.77336e+01 0.00000e+00 0.00000e+00 2.12471e+02 334.238 3.06332e+01 334.238 0.9877 
1 1 1 -10 60  15 o 18 6.26374e+00 1.20272e+00 1.14882e+02 301.403 6.96702e+00  -1.14125e+01 0.00000e+00 0.00000e+00 1.09207e+02 301.403 5.67554e+00 121.403 0.9618 
1 1 1 -10 60  16 o 5  5.87532e+00 1.19481e+00 1.11190e+02 174.555 -1.43413e+01 1.36701e+00  0.00000e+00 0.00000e+00 9.93305e+01 174.555 1.18592e+01 354.555 0.9646 
1 1 1 -10 61  1  o 19 1.10983e+01 7.83468e-01 1.91785e+02 163.244 -1.78556e+01 5.37597e+00  0.00000e+00 0.00000e+00 2.14766e+02 163.244 2.29810e+01 163.244 0.9728 
1 1 1 -10 61  2  o 19 6.48008e+00 1.03766e+00 1.89887e+02 349.029 1.03239e+01  -2.00126e+00 0.00000e+00 0.00000e+00 4.21023e+01 349.029 1.47785e+02 169.029 0.9512 
1 1 1 -10 61  3  o 12 5.75796e+00 8.99950e-01 7.80979e+01 156.353 -3.71214e+00 1.62544e+00  0.00000e+00 0.00000e+00 1.09365e+02 156.353 3.12674e+01 156.353 0.8655 
1 1 1 -10 61  4  o 12 9.29914e+00 6.82200e-01 2.05376e+02 209.617 -1.75622e+01 -9.98361e+00 0.00000e+00 0.00000e+00 1.35442e+02 209.617 6.99345e+01 29.617  0.9749 
1 1 1 -10 61  5  o 2  2.03338e+01 6.37530e-01 4.15602e+02 70.866  2.93372e+01  8.45584e+01  0.00000e+00 0.00000e+00 3.44010e+02 70.866  7.15926e+01 250.866 0.9944 
1 1 1 -10 61  6  f 0  1.16882e+01 6.19420e-01 2.05354e+02 230.669 -1.82370e+01 -2.22565e+01 0.00000e+00 0.00000e+00 2.25726e+02 230.669 2.03720e+01 230.669 0.9825 
1 1 1 -10 61  7  o 7  3.21652e+00 8.82682e-01 8.36501e+01 95.801  -3.08900e-01 3.04067e+00  0.00000e+00 0.00000e+00 1.45679e+01 95.801  6.90822e+01 275.801 0.8141 
1 1 1 -10 61  8  o 12 8.13486e+00 7.58566e-01 1.21928e+02 71.092  4.44538e+00  1.29777e+01  0.00000e+00 0.00000e+00 1.71615e+02 71.092  4.96869e+01 71.092  0.9628 
1 1 1 -10 61  9  o 2  4.44800e+00 9.71373e-01 1.00166e+02 180.891 -6.29868e+00 -9.79719e-02 0.00000e+00 0.00000e+00 5.25198e+01 180.891 4.76460e+01 0.891   0.9168 
1 1 1 -10 61  10 o 16 3.48246e+00 8.95334e-01 1.11620e+02 353.666 5.40465e+00  -5.99903e-01 0.00000e+00 0.00000e+00 5.96252e+00 353.666 1.05657e+02 173.666 0.9026 
1 1 1 -10 61  11 o 6  5.45992e+00 9.47321e-01 1.00354e+02 321.070 6.80249e+00  -5.49469e+00 0.00000e+00 0.00000e+00 9.16207e+01 321.070 8.73360e+00 141.070 0.9410 
1 1 1 -10 61  12 f 0  5.52359e+00 1.03638e+00 1.67319e+02 11.215  1.41341e+01  2.80245e+00  0.00000e+00 0.00000e+00 3.15659e+01 11.215  1.35753e+02 191.215 0.9647 
1 1 1 -10 61  13 o 12 2.89378e+00 9.05564e-01 6.59844e+01 71.037  1.17509e+00  3.41989e+00  0.00000e+00 0.00000e+00 2.53900e+01 71.037  4.05943e+01 251.037 0.8469 
1 1 1 -10 61  14 o 14 1.21878e+01 7.96016e-01 1.67887e+02 120.018 -2.22475e+01 3.85065e+01  0.00000e+00 0.00000e+00 2.80815e+02 120.018 1.12928e+02 120.018 0.9887 
1 1 1 -10 61  15 o 18 3.61278e+00 1.08234e+00 7.63130e+01 326.574 4.68384e+00  -3.09150e+00 0.00000e+00 0.00000e+00 4.53954e+01 326.574 3.09176e+01 146.574 0.9059 
1 1 1 -10 62  1  o 18 8.20254e+00 9.46090e-01 1.71782e+02 171.059 -1.23840e+01 1.94828e+00  0.00000e+00 0.00000e+00 1.24455e+02 171.059 4.73268e+01 351.059 0.9592 
1 1 1 -10 62  2  o 6  1.65364e+01 8.25429e-01 2.59933e+02 331.099 3.46704e+01  -1.91401e+01 0.00000e+00 0.00000e+00 3.54439e+02 331.099 9.45065e+01 331.099 0.9873 
1 1 1 -10 62  3  o 1  6.37248e+00 8.51743e-01 1.42271e+02 258.571 -1.81056e+00 -8.95611e+00 0.00000e+00 0.00000e+00 8.38758e+01 258.571 5.83953e+01 78.571  0.9436 
1 1 1 -10 62  4  o 7  1.24382e+01 6.28250e-01 2.75532e+02 38.874  2.94287e+01  2.37237e+01  0.00000e+00 0.00000e+00 1.85754e+02 38.874  8.97779e+01 218.874 0.9867 
1 1 1 -10 62  5  o 12 4.35633e+00 9.59095e-01 7.13467e+01 345.809 3.03844e+00  -7.68319e-01 0.00000e+00 0.00000e+00 6.27358e+01 345.809 8.61090e+00 165.809 0.8194 
1 1 1 -10 62  6  o 10 7.82903e+00 7.75078e-01 2.14901e+02 257.476 -4.38626e+00 -1.97468e+01 0.00000e+00 0.00000e+00 7.15925e+01 257.476 1.43308e+02 77.477  0.9750 
1 1 1 -10 62  7  o 8  7.37159e+00 7.68565e-01 1.07551e+02 245.447 -4.25979e+00 -9.32449e+00 0.00000e+00 0.00000e+00 1.55058e+02 245.447 4.75075e+01 245.447 0.9499 
1 1 1 -10 62  8  o 12 5.19795e+00 9.23618e-01 9.96241e+01 316.636 4.78080e+00  -4.51532e+00 0.00000e+00 0.00000e+00 7.96592e+01 316.636 1.99649e+01 136.636 0.9205 
1 1 1 -10 62  9  o 2  3.76524e+00 9.21534e-01 7.31330e+01 113.478 -1.55286e+00 3.57503e+00  0.00000e+00 0.00000e+00 4.80164e+01 113.478 2.51166e+01 293.478 0.8595 
1 1 1 -10 62  10 f 0  5.41937e+00 8.71513e-01 3.17460e+01 130.030 -1.75057e+00 2.08401e+00  0.00000e+00 0.00000e+00 1.27787e+02 130.030 9.60410e+01 130.030 0.7871 
1 1 1 -10 62  11 o 10 1.42145e+01 7.83455e-01 2.55930e+02 84.201  6.04126e+00  5.94823e+01  0.00000e+00 0.00000e+00 2.70675e+02 84.201  1.47449e+01 84.201  0.9916 
1 1 1 -10 62  12 o 3  3.68381e+00 9.91921e-01 8.51485e+01 63.552  2.34843e+00  4.72091e+00  0.00000e+00 0.00000e+00 3.84919e+01 63.552  4.66567e+01 243.552 0.8993 
1 1 1 -10 62  13 o 5  7.46492e+00 9.56961e-01 1.05925e+02 210.686 -1.27019e+01 -7.53776e+00 0.00000e+00 0.00000e+00 1.62746e+02 210.686 5.68215e+01 210.686 0.9655 
1 1 1 -10 62  14 o 2  9.86658e+00 9.07502e-01 1.28415e+02 254.972 -7.01735e+00 -2.61390e+01 0.00000e+00 0.00000e+00 2.32069e+02 254.972 1.03655e+02 254.972 0.9813 
1 1 1 -10 62  15 o 11 3.75743e+00 1.10234e+00 2.69607e+01 206.956 -1.84150e+00 -9.36496e-01 0.00000e+00 0.00000e+00 7.19977e+01 206.956 4.50371e+01 206.956 0.7083 
1 1 1 -10 63  1  o 8  6.60661e+00 9.75699e-01 1.54454e+02 13.762  8.72857e+00  2.13781e+00  0.00000e+00 0.00000e+00 7.99640e+01 13.762  7.44902e+01 193.762 0.9426 
1 1 1 -10 63  2  o 16 7.61188e+00 1.01825e+00 1.10946e+02 110.727 -2.84421e+00 7.51642e+00  0.00000e+00 0.00000e+00 1.56986e+02 110.727 4.60395e+01 110.727 0.9355 
1 1 1 -10 63  3  o 5  1.62201e+01 6.89859e-01 2.75549e+02 117.075 -2.10996e+01 4.12771e+01  0.00000e+00 0.00000e+00 3.27768e+02 117.075 5.22189e+01 117.075 0.9892 
1 1 1 -10 63  4  o 19 7.20701e+00 9.21272e-01 1.39866e+02 176.421 -9.79407e+00 6.12505e-01  0.00000e+00 0.00000e+00 1.16781e+02 176.421 2.30850e+01 356.421 0.9476 
1 1 1 -10 63  5  o 10 2.55942e+01 6.39848e-01 4.03376e+02 283.872 2.81026e+01  -1.13798e+02 0.00000e+00 0.00000e+00 5.53701e+02 283.872 1.50325e+02 283.872 0.9957 
1 1 1 -10 63  6  o 17 1.60233e+01 6.08028e-01 2.26929e+02 102.900 -1.07400e+01 4.68941e+01  0.00000e+00 0.00000e+00 3.68099e+02 102.900 1.41170e+02 102.900 0.9896 
1 1 1 -10 63  7  o 3  1.86011e+01 6.15107e-01 2.93163e+02 298.684 3.65628e+01  -6.68285e+01 0.00000e+00 0.00000e+00 3.99729e+02 298.684 1.06565e+02 298.684 0.9934 
1 1 1 -10 63  8  o 10 9.14042e+00 7.39144e-01 1.74917e+02 84.738  2.12223e+00  2.30428e+01  0.00000e+00 0.00000e+00 1.60044e+02 84.738  1.48723e+01 264.738 0.9781 
1 1 1 -10 63  9  o 18 1.10128e+01 6.53280e-01 1.62423e+02 326.786 2.38055e+01  -1.55859e+01 0.00000e+00 0.00000e+00 2.42478e+02 326.786 8.00546e+01 326.786 0.9823 
1 1 1 -10 63  10 o 6  2.80970e+00 8.36926e-01 1.12504e+01 20.582  4.40493e-01  1.65413e-01  0.00000e+00 0.00000e+00 1.28077e+01 20.582  1.55734e+00 20.582  0.2290 
1 1 1 -10 63  11 o 4  3.10951e+00 9.03944e-01 8.43269e+01 215.043 -3.75610e+00 -2.63423e+00 0.00000e+00 0.00000e+00 1.82201e+01 215.043 6.61068e+01 35.043  0.8829 
1 1 1 -10 63  12 f 0  3.75902e+00 9.96057e-01 7.04543e+00 5.876   4.29043e-01  4.41530e-02  0.00000e+00 0.00000e+00 2.25202e+01 5.876   1.54748e+01 5.876   0.2108 
1 1 1 -10 63  13 o 14 5.06055e+00 1.11410e+00 4.78433e+01 98.572  -6.05008e-01 4.01373e+00  0.00000e+00 0.00000e+00 1.15442e+02 98.572  6.75991e+01 98.572  0.8658 
1 1 1 -10 63  14 o 19 6.34833e+00 1.15319e+00 1.45793e+02 254.188 -4.71906e+00 -1.66637e+01 0.00000e+00 0.00000e+00 8.35896e+01 254.188 6.22033e+01 74.188  0.9707 
1 1 1 -10 63  15 o 16 4.76958e+00 1.21604e+00 1.18177e+02 40.705  8.84203e+00  7.60681e+00  0.00000e+00 0.00000e+00 5.13564e+01 40.705  6.68206e+01 220.705 0.9561 
1 1 1 -10 64  1  o 16 1.31233e+01 8.21720e-01 1.81734e+02 250.986 -7.77195e+00 -2.25536e+01 0.00000e+00 0.00000e+00 3.01715e+02 250.986 1.19981e+02 250.986 0.9788 
1 1 1 -10 64  2  o 7  1.57448e+01 8.31536e-01 2.81257e+02 166.699 -4.28920e+01 1.01397e+01  0.00000e+00 0.00000e+00 3.04271e+02 166.699 2.30140e+01 166.699 0.9886 
1 1 1 -10 64  3  o 18 5.13615e+00 9.52007e-01 1.20553e+02 38.285  4.68993e+00  3.70186e+00  0.00000e+00 0.00000e+00 5.55515e+01 38.285  6.50013e+01 218.285 0.9120 
1 1 1 -10 64  4  f 0  6.71072e+00 8.34214e-01 1.09187e+02 291.989 2.72270e+00  -6.74247e+00 0.00000e+00 0.00000e+00 1.24918e+02 291.989 1.57315e+01 291.989 0.9284 
1 1 1 -10 64  5  o 8  1.04508e+01 6.56588e-01 1.04332e+02 332.601 1.14598e+01  -5.93988e+00 0.00000e+00 0.00000e+00 2.72555e+02 332.601 1.68223e+02 332.601 0.9604 
1 1 1 -10 64  6  f 0  8.21769e+00 7.11365e-01 1.72503e+02 71.006  5.56489e+00  1.61673e+01  0.00000e+00 0.00000e+00 1.26673e+02 71.006  4.58301e+01 251.006 0.9703 
1 1 1 -10 64  7  o 15 3.46380e+00 9.17587e-01 6.45543e+01 102.960 -6.27154e-01 2.72516e+00  0.00000e+00 0.00000e+00 3.85191e+01 102.960 2.60352e+01 282.960 0.7937 
1 1 1 -10 64  8  o 4  1.20181e+01 6.70784e-01 1.63057e+02 237.265 -1.50953e+01 -2.34820e+01 0.00000e+00 0.00000e+00 2.78983e+02 237.265 1.15926e+02 237.265 0.9819 
1 1 1 -10 64  9  o 8  4.45879e+00 8.53175e-01 5.04541e+01 257.521 -7.12266e-01 -3.21844e+00 0.00000e+00 0.00000e+00 8.79954e+01 257.521 3.75413e+01 257.521 0.8297 
1 1 1 -10 64  10 f 0  5.93207e+00 8.99111e-01 1.25218e+02 126.595 -6.62430e+00 8.92118e+00  0.00000e+00 0.00000e+00 8.63361e+01 126.595 3.88816e+01 306.595 0.9539 
1 1 1 -10 64  11 o 5  1.58228e+01 6.58795e-01 2.18371e+02 7.675   6.39951e+01  8.62456e+00  0.00000e+00 0.00000e+00 3.67982e+02 7.675   1.49610e+02 7.675   0.9922 
1 1 1 -10 64  12 o 13 1.17580e+01 7.54447e-01 1.63336e+02 84.775  3.32689e+00  3.63806e+01  0.00000e+00 0.00000e+00 2.69270e+02 84.775  1.05934e+02 84.775  0.9862 
1 1 1 -10 64  13 o 9  1.14237e+01 7.91104e-01 1.89805e+02 267.928 -1.61071e+00 -4.45198e+01 0.00000e+00 0.00000e+00 2.31074e+02 267.928 4.12691e+01 267.928 0.9887 
1 1 1 -10 64  14 o 16 2.99823e+00 9.55846e-01 6.83875e+01 62.229  2.22196e+00  4.21953e+00  0.00000e+00 0.00000e+00 3.06711e+01 62.229  3.77164e+01 242.229 0.8877 
1 1 1 -10 64  15 o 14 3.38987e+00 1.05676e+00 7.12939e+01 245.106 -2.38450e+00 -5.13847e+00 0.00000e+00 0.00000e+00 4.29642e+01 245.106 2.83297e+01 65.106  0.9068 
1 1 1 -10 65  1  o 10 9.06575e+00 9.96736e-01 1.45941e+02 115.476 -5.58299e+00 1.17176e+01  0.00000e+00 0.00000e+00 1.81785e+02 115.476 3.58447e+01 115.476 0.9607 
1 1 1 -10 65  2  f 0  5.39769e+00 1.12532e+00 1.41740e+02 160.293 -6.52327e+00 2.33659e+00  0.00000e+00 0.00000e+00 4.59934e+01 160.293 9.57463e+01 340.293 0.9247 
1 1 1 -10 65  3  o 9  1.75494e+01 6.92400e-01 3.08679e+02 323.441 4.79530e+01  -3.55601e+01 0.00000e+00 0.00000e+00 3.45460e+02 323.441 3.67803e+01 323.441 0.9916 
1 1 1 -10 65  4  o 5  1.30195e+01 6.34250e-01 2.12824e+02 171.702 -3.11728e+01 4.54641e+00  0.00000e+00 0.00000e+00 2.68455e+02 171.702 5.56307e+01 171.702 0.9840 
1 1 1 -10 65  5  f 0  1.17107e+01 6.29563e-01 1.33291e+02 34.564  1.69371e+01  1.16685e+01  0.00000e+00 0.00000e+00 2.95525e+02 34.564  1.62234e+02 34.564  0.9754 
1 1 1 -10 65  6  o 3  7.85681e+00 7.23423e-01 1.28910e+02 139.337 -9.69239e+00 8.32597e+00  0.00000e+00 0.00000e+00 1.54051e+02 139.337 2.51409e+01 139.337 0.9600 
1 1 1 -10 65  7  o 1  4.90884e+00 9.66042e-01 1.28756e+02 272.827 3.76351e-01  -7.62046e+00 0.00000e+00 0.00000e+00 4.27260e+01 272.827 8.60300e+01 92.827  0.9320 
1 1 1 -10 65  8  o 2  7.26588e+00 8.45265e-01 1.07965e+02 217.706 -9.34189e+00 -7.22181e+00 0.00000e+00 0.00000e+00 1.52363e+02 217.706 4.43980e+01 217.706 0.9567 
1 1 1 -10 65  9  o 1  1.21482e+01 6.31780e-01 1.87794e+02 301.742 2.02117e+01  -3.26718e+01 0.00000e+00 0.00000e+00 2.60803e+02 301.742 7.30088e+01 301.742 0.9869 
1 1 1 -10 65  10 o 5  8.83502e+00 7.30833e-01 1.41332e+02 14.093  2.12160e+01  5.32644e+00  0.00000e+00 0.00000e+00 1.81285e+02 14.093  3.99535e+01 14.093  0.9769 
1 1 1 -10 65  11 o 6  4.38048e+00 9.48429e-01 6.07808e+01 15.612  3.92730e+00  1.09744e+00  0.00000e+00 0.00000e+00 8.09464e+01 15.612  2.01657e+01 15.612  0.8664 
1 1 1 -10 65  12 o 9  3.60368e+00 1.01783e+00 3.79739e+01 161.621 -2.17826e+00 7.23741e-01  0.00000e+00 0.00000e+00 6.15996e+01 161.621 2.36257e+01 161.621 0.7408 
1 1 1 -10 65  13 o 9  4.81225e+00 1.08828e+00 7.74060e+01 151.942 -5.88285e+00 3.13567e+00  0.00000e+00 0.00000e+00 8.78268e+01 151.942 1.04208e+01 151.942 0.9216 
1 1 1 -10 65  14 o 3  5.62634e+00 1.19304e+00 1.06026e+02 151.176 -9.97597e+00 5.48982e+00  0.00000e+00 0.00000e+00 9.39186e+01 151.176 1.21077e+01 331.176 0.9550 
1 1 1 -10 65  15 o 14 2.74211e+00 9.14808e-01 2.95100e+01 291.942 7.88567e-01  -1.95745e+00 0.00000e+00 0.00000e+00 4.33603e+01 291.942 1.38502e+01 291.942 0.7151 
1 1 1 -10 66  1  o 15 9.30728e+00 9.49246e-01 1.93759e+02 199.540 -1.72509e+01 -6.12227e+00 0.00000e+00 0.00000e+00 1.46706e+02 199.540 4.70528e+01 19.540  0.9723 
1 1 1 -10 66  2  o 11 5.70191e+00 1.05347e+00 9.87996e+01 39.895  4.21223e+00  3.52134e+00  0.00000e+00 0.00000e+00 9.49550e+01 39.895  3.84459e+00 219.895 0.9036 
1 1 1 -10 66  3  o 13 5.42396e+00 1.00030e+00 8.64489e+01 316.871 3.45506e+00  -3.23649e+00 0.00000e+00 0.00000e+00 9.43329e+01 316.871 7.88406e+00 316.871 0.8868 
1 1 1 -10 66  4  o 6  1.33456e+01 6.38831e-01 1.87322e+02 356.792 3.14151e+01  -1.76058e+00 0.00000e+00 0.00000e+00 3.05914e+02 356.792 1.18593e+02 356.792 0.9840 
1 1 1 -10 66  5  o 8  1.21611e+01 6.26248e-01 2.19007e+02 107.308 -9.82410e+00 3.15256e+01  0.00000e+00 0.00000e+00 2.30493e+02 107.308 1.14869e+01 107.308 0.9847 
1 1 1 -10 66  6  o 16 4.08557e+00 9.15512e-01 9.98123e+01 16.875  4.86398e+00  1.47547e+00  0.00000e+00 0.00000e+00 3.73774e+01 16.875  6.24349e+01 196.875 0.8953 
1 1 1 -10 66  7  o 13 7.59675e+00 7.92448e-01 1.73708e+02 110.888 -6.30139e+00 1.65117e+01  0.00000e+00 0.00000e+00 1.02821e+02 110.888 7.08862e+01 290.888 0.9713 
1 1 1 -10 66  8  o 6  1.11664e+01 6.35710e-01 2.37190e+02 272.823 2.10984e+00  -4.27803e+01 0.00000e+00 0.00000e+00 1.76025e+02 272.823 6.11649e+01 92.823  0.9883 
1 1 1 -10 66  9  o 6  6.16687e+00 8.49092e-01 1.13905e+02 135.156 -7.10574e+00 7.06706e+00  0.00000e+00 0.00000e+00 1.04968e+02 135.156 8.93663e+00 315.156 0.9487 
1 1 1 -10 66  10 o 1  2.81555e+00 8.47198e-01 1.25325e+02 33.431  4.96487e+00  3.27760e+00  0.00000e+00 0.00000e+00 2.94035e+01 213.431 1.54728e+02 213.431 0.9116 
1 1 1 -10 66  11 f 0  5.06229e+00 1.02268e+00 6.61101e+01 161.819 -5.06498e+00 1.66339e+00  0.00000e+00 0.00000e+00 1.04090e+02 161.819 3.79796e+01 161.819 0.9005 
1 1 1 -10 66  12 o 18 7.75237e+00 9.51965e-01 1.38283e+02 5.960   1.97656e+01  2.06333e+00  0.00000e+00 0.00000e+00 1.43458e+02 5.960   5.17461e+00 5.960   0.9745 
1 1 1 -10 66  13 o 11 7.63273e+00 9.89271e-01 7.23681e+01 349.403 1.04715e+01  -1.95910e+00 0.00000e+00 0.00000e+00 1.98258e+02 349.403 1.25889e+02 349.403 0.9518 
1 1 1 -10 66  14 o 6  6.61183e+00 1.15214e+00 8.29707e+01 269.979 -4.01505e-03 -1.07350e+01 0.00000e+00 0.00000e+00 1.51263e+02 269.979 6.82926e+01 269.979 0.9522 
1 1 1 -10 66  15 o 17 5.53860e+00 1.28268e+00 1.15551e+02 75.700  3.13187e+00  1.22871e+01  0.00000e+00 0.00000e+00 8.19530e+01 75.700  3.35981e+01 255.700 0.9597 
1 1 1 -10 67  1  o 5  1.08123e+01 8.78193e-01 2.47894e+02 78.282  5.32282e+00  2.56634e+01  0.00000e+00 0.00000e+00 1.50989e+02 78.282  9.69052e+01 258.282 0.9807 
1 1 1 -10 67  2  o 15 5.08116e+00 1.00889e+00 6.70101e+01 355.197 3.41363e+00  -2.86808e-01 0.00000e+00 0.00000e+00 9.29137e+01 355.197 2.59035e+01 355.197 0.8371 
1 1 1 -10 67  3  o 4  4.76748e+00 9.94967e-01 1.03387e+02 237.923 -2.75967e+00 -4.40318e+00 0.00000e+00 0.00000e+00 5.74413e+01 237.923 4.59458e+01 57.923  0.8977 
1 1 1 -10 67  4  o 11 5.29434e+00 9.54209e-01 6.56983e+01 90.510  -3.62094e-02 4.06464e+00  0.00000e+00 0.00000e+00 1.06475e+02 90.510  4.07762e+01 90.510  0.8660 
1 1 1 -10 67  5  o 3  1.11475e+01 6.40089e-01 2.48443e+02 97.959  -5.19261e+00 3.71401e+01  0.00000e+00 0.00000e+00 1.64284e+02 97.959  8.41592e+01 277.959 0.9866 
1 1 1 -10 67  6  o 1  6.36093e+00 8.36105e-01 1.46732e+02 75.936  3.04251e+00  1.21446e+01  0.00000e+00 0.00000e+00 8.20714e+01 75.936  6.46602e+01 255.935 0.9592 
1 1 1 -10 67  7  o 12 5.01049e+00 9.44235e-01 3.94067e+01 8.993   2.52397e+00  3.99432e-01  0.00000e+00 0.00000e+00 1.05324e+02 8.993   6.59169e+01 8.993   0.7709 
1 1 1 -10 67  8  o 7  3.72856e+00 8.86735e-01 1.23953e+02 123.748 -3.68806e+00 5.52003e+00  0.00000e+00 0.00000e+00 4.64581e+00 123.748 1.19307e+02 303.748 0.9213 
1 1 1 -10 67  9  o 12 4.01818e+00 8.07192e-01 9.98830e+01 124.190 -3.40757e+00 5.01595e+00  0.00000e+00 0.00000e+00 3.73869e+01 124.190 6.24961e+01 304.190 0.9133 
1 1 1 -10 67  10 o 6  4.92283e+00 9.95237e-01 7.42643e+01 280.447 1.05439e+00  -5.71847e+00 0.00000e+00 0.00000e+00 9.30170e+01 280.447 1.87527e+01 280.447 0.9094 
1 1 1 -10 67  11 o 17 3.39190e+00 9.24784e-01 7.22100e+01 305.652 2.50314e+00  -3.48964e+00 0.00000e+00 0.00000e+00 3.84444e+01 305.652 3.37656e+01 125.652 0.8740 
1 1 1 -10 67  12 o 8  2.77151e+00 8.78199e-01 5.10478e+01 47.750  1.83236e+00  2.01728e+00  0.00000e+00 0.00000e+00 3.03251e+01 47.750  2.07227e+01 227.750 0.7874 
1 1 1 -10 67  13 o 14 4.77802e+00 1.12533e+00 4.25705e+01 21.217  3.28470e+00  1.27520e+00  0.00000e+00 0.00000e+00 1.07319e+02 21.217  6.47489e+01 21.217  0.8423 
1 1 1 -10 67  14 o 2  3.39781e+00 1.01543e+00 4.98651e+01 203.629 -3.45440e+00 -1.51127e+00 0.00000e+00 0.00000e+00 5.80815e+01 203.629 8.21647e+00 203.629 0.8541 
1 1 1 -10 67  15 o 7  2.98442e+00 9.68946e-01 5.29853e+01 103.576 -1.02428e+00 4.24176e+00  0.00000e+00 0.00000e+00 4.41567e+01 103.576 8.82853e+00 283.576 0.8762 
1 1 1 -10 68  1  o 16 1.19109e+01 8.31326e-01 2.07657e+02 249.696 -9.63254e+00 -2.60344e+01 0.00000e+00 0.00000e+00 2.32159e+02 249.696 2.45020e+01 249.696 0.9818 
1 1 1 -10 68  2  o 4  4.85592e+00 1.07458e+00 1.17021e+02 77.638  1.24165e+00  5.66515e+00  0.00000e+00 0.00000e+00 4.89288e+01 77.638  6.80922e+01 257.638 0.9091 
1 1 1 -10 68  3  o 12 1.47860e+01 7.05436e-01 2.66450e+02 344.006 4.87345e+01  -1.39686e+01 0.00000e+00 0.00000e+00 2.83551e+02 344.006 1.71002e+01 344.006 0.9901 
1 1 1 -10 68  4  o 18 1.73913e+01 6.94565e-01 2.95126e+02 146.896 -5.21895e+01 3.40272e+01  0.00000e+00 0.00000e+00 3.52597e+02 146.896 5.74704e+01 146.896 0.9919 
1 1 1 -10 68  5  o 4  1.00043e+01 7.43360e-01 1.96064e+02 333.631 2.35003e+01  -1.16500e+01 0.00000e+00 0.00000e+00 1.72082e+02 333.631 2.39820e+01 153.631 0.9807 
1 1 1 -10 68  6  o 2  1.06716e+01 6.82640e-01 2.13549e+02 77.215  6.80333e+00  2.99806e+01  0.00000e+00 0.00000e+00 1.80004e+02 77.215  3.35453e+01 257.215 0.9836 
1 1 1 -10 68  7  o 9  8.09365e+00 8.03377e-01 1.34691e+02 336.457 1.53513e+01  -6.68874e+00 0.00000e+00 0.00000e+00 1.59327e+02 336.457 2.46359e+01 336.457 0.9697 
1 1 1 -10 68  8  o 16 1.07133e+01 6.37040e-01 2.24353e+02 167.166 -3.77268e+01 8.59489e+00  0.00000e+00 0.00000e+00 1.71442e+02 167.166 5.29114e+01 347.166 0.9870 
1 1 1 -10 68  9  o 1  1.01398e+01 6.85237e-01 1.44782e+02 78.968  4.64675e+00  2.38340e+01  0.00000e+00 0.00000e+00 2.26521e+02 78.968  8.17395e+01 78.968  0.9792 
1 1 1 -10 68  10 o 10 3.04734e+00 8.93789e-01 6.20128e+01 359.556 3.32430e+00  -2.57467e-02 0.00000e+00 0.00000e+00 3.26382e+01 359.556 2.93745e+01 179.556 0.8314 
1 1 1 -10 68  11 o 17 7.61128e+00 9.16451e-01 1.27134e+02 239.948 -8.28189e+00 -1.43145e+01 0.00000e+00 0.00000e+00 1.48199e+02 239.948 2.10648e+01 239.948 0.9693 
1 1 1 -10 68  12 o 14 3.11820e+00 1.02148e+00 7.47830e+01 15.331  4.21202e+00  1.15475e+00  0.00000e+00 0.00000e+00 2.70828e+01 15.331  4.77003e+01 195.331 0.8763 
1 1 1 -10 68  13 o 4  3.44430e+00 1.03061e+00 7.66267e+01 279.485 8.49180e-01  -5.08265e+00 0.00000e+00 0.00000e+00 3.83922e+01 279.485 3.82344e+01 99.485  0.8968 
1 1 1 -10 68  14 o 3  2.92847e+00 9.53117e-01 4.51287e+01 345.264 2.88756e+00  -7.59467e-01 0.00000e+00 0.00000e+00 4.29726e+01 345.264 2.15608e+00 165.264 0.8089 
1 1 1 -10 68  15 o 1  3.76542e+00 1.12035e+00 5.10657e+01 105.574 -1.14489e+00 4.10776e+00  0.00000e+00 0.00000e+00 7.10251e+01 105.574 1.99594e+01 105.574 0.8730 
1 1 1 -10 69  1  o 2  3.17665e+00 9.67727e-01 1.18018e+01 163.572 -4.02131e-01 1.18570e-01  0.00000e+00 0.00000e+00 1.27030e+01 163.572 9.01197e-01 163.572 0.2051 
1 1 1 -10 69  2  o 8  6.55995e+00 1.01421e+00 1.25329e+02 159.943 -8.80506e+00 3.21461e+00  0.00000e+00 0.00000e+00 1.07670e+02 159.943 1.76588e+01 339.943 0.9451 
1 1 1 -10 69  3  f 0  1.35092e+01 7.20547e-01 2.44325e+02 340.701 3.97198e+01  -1.39090e+01 0.00000e+00 0.00000e+00 2.57053e+02 340.701 1.27274e+01 340.701 0.9880 
1 1 1 -10 69  4  o 1  5.75743e+00 1.02500e+00 1.58446e+02 84.844  9.54091e-01  1.05743e+01  0.00000e+00 0.00000e+00 4.72408e+01 84.844  1.11205e+02 264.844 0.9517 
1 1 1 -10 69  5  o 14 7.01339e+00 7.83887e-01 1.14946e+02 318.011 7.92038e+00  -7.12889e+00 0.00000e+00 0.00000e+00 1.35488e+02 318.011 2.05421e+01 318.011 0.9519 
1 1 1 -10 69  6  o 9  9.18727e+00 7.08619e-01 1.80385e+02 119.879 -1.21009e+01 2.10623e+01  0.00000e+00 0.00000e+00 1.56847e+02 119.879 2.35375e+01 299.879 0.9792 
1 1 1 -10 69  7  o 6  1.16616e+01 6.15786e-01 1.25140e+02 5.155   2.35143e+01  2.12153e+00  0.00000e+00 0.00000e+00 3.02310e+02 5.155   1.77169e+02 5.155   0.9786 
1 1 1 -10 69  8  o 7  7.38954e+00 7.27511e-01 7.76272e+01 203.596 -8.49700e+00 -3.71156e+00 0.00000e+00 0.00000e+00 1.83552e+02 203.596 1.05925e+02 203.596 0.9444 
1 1 1 -10 69  9  o 18 4.12624e+00 9.79246e-01 3.34357e+01 99.999  -3.69387e-01 2.09507e+00  0.00000e+00 0.00000e+00 7.72781e+01 99.999  4.38424e+01 99.999  0.7176 
1 1 1 -10 69  10 o 10 4.20274e+00 9.96798e-01 8.22912e+01 251.587 -1.74319e+00 -5.23615e+00 0.00000e+00 0.00000e+00 5.96488e+01 251.587 2.26424e+01 71.587  0.9042 
1 1 1 -10 69  11 o 18 6.22371e+00 1.02729e+00 8.41216e+01 163.120 -8.13260e+00 2.46775e+00  0.00000e+00 0.00000e+00 1.33985e+02 163.120 4.98639e+01 163.120 0.9392 
1 1 1 -10 69  12 o 19 3.64357e+00 1.03354e+00 6.65910e+01 260.039 -7.43147e-01 -4.23135e+00 0.00000e+00 0.00000e+00 5.21051e+01 260.039 1.44859e+01 80.039  0.8740 
1 1 1 -10 69  13 o 14 5.04173e+00 1.19691e+00 7.49712e+01 88.401  1.90644e-01  6.82838e+00  0.00000e+00 0.00000e+00 9.83871e+01 88.401  2.34159e+01 88.401  0.9236 
1 1 1 -10 69  14 o 11 2.76974e+00 9.08346e-01 7.09219e+01 254.910 -1.25997e+00 -4.67288e+00 0.00000e+00 0.00000e+00 2.06894e+01 254.910 5.02325e+01 74.910  0.8895 
1 1 1 -10 69  15 o 2  2.91014e+00 9.56141e-01 5.41698e+01 205.235 -3.85954e+00 -1.81902e+00 0.00000e+00 0.00000e+00 4.01803e+01 205.235 1.39895e+01 25.235  0.8730 
1 1 1 -10 70  1  o 4  3.28509e+00 9.76893e-01 3.77380e+01 156.540 -1.31446e+00 5.70458e-01  0.00000e+00 0.00000e+00 3.37832e+01 156.540 3.95482e+00 336.540 0.5791 
1 1 1 -10 70  2  o 9  8.28868e+00 9.30558e-01 1.48448e+02 353.752 1.36657e+01  -1.49609e+00 0.00000e+00 0.00000e+00 1.51460e+02 353.752 3.01180e+00 353.752 0.9629 
1 1 1 -10 70  3  o 12 3.81390e+00 1.00283e+00 1.17584e+02 223.876 -3.80391e+00 -3.65748e+00 0.00000e+00 0.00000e+00 1.12451e+01 223.876 1.06339e+02 43.876  0.8994 
1 1 1 -10 70  4  o 1  1.16616e+01 7.28261e-01 1.66656e+02 231.601 -1.62220e+01 -2.04681e+01 0.00000e+00 0.00000e+00 2.62570e+02 231.601 9.59142e+01 231.601 0.9807 
1 1 1 -10 70  5  o 3  2.79535e+00 8.50010e-01 6.34880e+01 107.777 -6.87081e-01 2.14298e+00  0.00000e+00 0.00000e+00 1.35623e+01 107.777 4.99258e+01 287.777 0.7349 
1 1 1 -10 70  6  o 6  6.23209e+00 8.86438e-01 1.59557e+02 337.654 1.20275e+01  -4.94399e+00 0.00000e+00 0.00000e+00 6.48477e+01 337.654 9.47097e+01 157.654 0.9607 
1 1 1 -10 70  7  o 18 8.86359e+00 6.81546e-01 1.39709e+02 81.472  2.88953e+00  1.92699e+01  0.00000e+00 0.00000e+00 1.83593e+02 81.472  4.38842e+01 81.472  0.9740 
1 1 1 -10 70  8  o 19 9.69374e+00 6.60360e-01 1.70785e+02 8.611   2.86436e+01  4.33738e+00  0.00000e+00 0.00000e+00 1.85609e+02 8.611   1.48239e+01 8.611   0.9826 
1 1 1 -10 70  9  o 3  1.97675e+01 6.30658e-01 2.86095e+02 156.346 -9.71804e+01 4.25669e+01  0.00000e+00 0.00000e+00 4.49374e+02 156.346 1.63279e+02 156.346 0.9953 
1 1 1 -10 70  10 o 5  6.86791e+00 9.02195e-01 1.15237e+02 341.420 1.17608e+01  -3.95324e+00 0.00000e+00 0.00000e+00 1.30687e+02 341.420 1.54505e+01 341.420 0.9588 
1 1 1 -10 70  11 o 15 3.42491e+00 9.92592e-01 7.73350e+01 218.053 -3.55596e+00 -2.78351e+00 0.00000e+00 0.00000e+00 3.52063e+01 218.053 4.21287e+01 38.053  0.8808 
1 1 1 -10 70  12 o 2  3.54960e+00 1.00520e+00 1.96165e+01 274.193 9.76040e-02  -1.33120e+00 0.00000e+00 0.00000e+00 5.34744e+01 274.193 3.38579e+01 274.193 0.5526 
1 1 1 -10 70  13 o 13 5.94084e+00 1.10479e+00 1.36731e+02 262.093 -2.29452e+00 -1.65212e+01 0.00000e+00 0.00000e+00 7.76645e+01 262.093 5.90667e+01 82.093  0.9695 
1 1 1 -10 70  14 o 12 4.54695e+00 1.17260e+00 7.78214e+01 34.698  6.26601e+00  4.33841e+00  0.00000e+00 0.00000e+00 7.97023e+01 34.698  1.88087e+00 34.698  0.9319 
1 1 1 -10 70  15 o 12 3.82544e+00 1.10358e+00 6.51928e+01 154.956 -5.69850e+00 2.66262e+00  0.00000e+00 0.00000e+00 6.50000e+01 154.956 1.92800e-01 334.956 0.9166 
1 1 1 -10 71  1  o 13 5.73489e+00 8.89052e-01 1.26119e+02 37.653  7.08268e+00  5.46492e+00  0.00000e+00 0.00000e+00 7.70117e+01 37.653  4.91070e+01 217.653 0.9423 
1 1 1 -10 71  2  o 13 7.41091e+00 1.00673e+00 9.10229e+01 125.013 -4.54477e+00 6.48737e+00  0.00000e+00 0.00000e+00 1.69180e+02 125.013 7.81567e+01 125.013 0.9346 
1 1 1 -10 71  3  o 12 7.99674e+00 9.63131e-01 1.22873e+02 254.449 -3.22124e+00 -1.15754e+01 0.00000e+00 0.00000e+00 1.64611e+02 254.449 4.17373e+01 254.449 0.9574 
1 1 1 -10 71  4  o 3  8.51486e+00 8.46488e-01 1.48186e+02 286.538 4.79829e+00  -1.61598e+01 0.00000e+00 0.00000e+00 1.61708e+02 286.538 1.35213e+01 286.538 0.9699 
1 1 1 -10 71  5  f 0  1.12531e+01 7.49743e-01 2.10451e+02 39.335  2.64319e+01  2.16611e+01  0.00000e+00 0.00000e+00 2.05315e+02 39.335  5.13535e+00 219.335 0.9853 
1 1 1 -10 71  6  o 5  8.54239e+00 7.75568e-01 1.49754e+02 11.237  1.95105e+01  3.87612e+00  0.00000e+00 0.00000e+00 1.62194e+02 11.237  1.24397e+01 11.237  0.9745 
1 1 1 -10 71  7  o 3  6.84959e+00 7.83094e-01 6.01785e+01 220.141 -4.77743e+00 -4.02886e+00 0.00000e+00 0.00000e+00 1.74759e+02 220.141 1.14580e+02 220.141 0.9161 
1 1 1 -10 71  8  o 8  5.42069e+00 8.92593e-01 1.09440e+02 358.825 9.46622e+00  -1.94091e-01 0.00000e+00 0.00000e+00 8.23192e+01 358.825 2.71204e+01 178.825 0.9456 
1 1 1 -10 71  9  o 17 1.10620e+01 7.90691e-01 2.10393e+02 223.347 -3.02072e+01 -2.85125e+01 0.00000e+00 0.00000e+00 1.98044e+02 223.347 1.23495e+01 43.347  0.9879 
1 1 1 -10 71  10 o 15 9.70192e+00 7.58589e-01 1.85203e+02 104.816 -8.37902e+00 3.16772e+01  0.00000e+00 0.00000e+00 1.71481e+02 104.816 1.37222e+01 284.816 0.9846 
1 1 1 -10 71  11 o 19 1.44732e+01 6.89899e-01 2.38466e+02 242.427 -3.47938e+01 -6.66319e+01 0.00000e+00 0.00000e+00 2.97776e+02 242.427 5.93103e+01 242.427 0.9933 
1 1 1 -10 71  12 o 18 7.80645e+00 1.00543e+00 1.19073e+02 164.119 -1.70737e+01 4.85731e+00  0.00000e+00 0.00000e+00 1.63467e+02 164.119 4.43944e+01 164.119 0.9714 
1 1 1 -10 71  13 o 4  7.10957e+00 1.12156e+00 1.18065e+02 37.314  1.35377e+01  1.03182e+01  0.00000e+00 0.00000e+00 1.38623e+02 37.314  2.05577e+01 37.314  0.9702 
1 1 1 -10 71  14 o 14 3.35413e+00 1.01783e+00 1.18937e+02 190.084 -9.15991e+00 -1.62900e+00 0.00000e+00 0.00000e+00 1.17021e+00 10.084  1.20107e+02 10.084  0.9446 
1 1 1 -10 71  15 o 4  2.74481e+00 9.14089e-01 3.91006e+01 348.482 3.08502e+00  -6.28665e-01 0.00000e+00 0.00000e+00 4.44893e+01 348.482 5.38868e+00 348.482 0.8204 
1 1 1 -10 72  1  o 11 2.92717e+00 8.56913e-01 3.15762e+01 353.465 1.10286e+00  -1.26338e-01 0.00000e+00 0.00000e+00 2.16698e+01 353.465 9.90637e+00 173.465 0.4840 
1 1 1 -10 72  2  o 11 6.73069e+00 1.03604e+00 7.12371e+01 237.961 -3.00832e+00 -4.80695e+00 0.00000e+00 0.00000e+00 1.58047e+02 237.961 8.68099e+01 237.961 0.9069 
1 1 1 -10 72  3  o 12 3.81371e+00 9.88082e-01 7.60829e+01 54.037  2.06767e+00  2.84981e+00  0.00000e+00 0.00000e+00 4.44933e+01 54.037  3.15896e+01 234.037 0.8422 
1 1 1 -10 72  4  o 12 1.03356e+01 7.71367e-01 1.77124e+02 175.915 -2.38577e+01 1.70380e+00  0.00000e+00 0.00000e+00 2.02451e+02 175.915 2.53276e+01 175.915 0.9789 
1 1 1 -10 72  5  o 11 8.01273e+00 8.52242e-01 1.62136e+02 284.448 4.36992e+00  -1.69612e+01 0.00000e+00 0.00000e+00 1.29574e+02 284.448 3.25618e+01 104.448 0.9710 
1 1 1 -10 72  6  o 8  7.75239e+00 7.33655e-01 1.19104e+02 238.060 -7.58920e+00 -1.21736e+01 0.00000e+00 0.00000e+00 1.61023e+02 238.060 4.19180e+01 238.060 0.9645 
1 1 1 -10 72  7  o 8  8.09999e+00 7.13494e-01 1.46148e+02 320.311 1.48213e+01  -1.23002e+01 0.00000e+00 0.00000e+00 1.49092e+02 320.311 2.94387e+00 320.311 0.9737 
1 1 1 -10 72  8  o 18 8.98068e+00 7.09752e-01 1.85386e+02 150.076 -2.35826e+01 1.35735e+01  0.00000e+00 0.00000e+00 1.44282e+02 150.076 4.11035e+01 330.076 0.9814 
1 1 1 -10 72  9  o 17 9.31004e+00 7.50608e-01 1.55844e+02 112.842 -1.07406e+01 2.54979e+01  0.00000e+00 0.00000e+00 1.85706e+02 112.842 2.98619e+01 112.842 0.9818 
1 1 1 -10 72  10 o 19 4.54268e+00 1.00341e+00 8.79748e+01 272.331 2.50241e-01  -6.14826e+00 0.00000e+00 0.00000e+00 6.71398e+01 272.331 2.08350e+01 92.331  0.9147 
1 1 1 -10 72  11 o 13 4.42917e+00 1.00541e+00 8.87562e+01 240.180 -3.46669e+00 -6.04830e+00 0.00000e+00 0.00000e+00 6.40643e+01 240.180 2.46919e+01 60.180  0.9252 
1 1 1 -10 72  12 o 7  7.91346e+00 9.87170e-01 1.10665e+02 101.217 -3.22656e+00 1.62695e+01  0.00000e+00 0.00000e+00 1.75090e+02 101.217 6.44243e+01 101.217 0.9694 
1 1 1 -10 72  13 o 11 4.47841e+00 1.15899e+00 6.41494e+01 150.336 -4.85576e+00 2.76568e+00  0.00000e+00 0.00000e+00 8.67255e+01 150.336 2.25761e+01 150.336 0.9054 
1 1 1 -10 72  14 o 11 7.34566e+00 1.24192e+00 1.08996e+02 306.799 9.88164e+00  -1.32096e+01 0.00000e+00 0.00000e+00 1.55576e+02 306.799 4.65799e+01 306.799 0.9692 
1 1 1 -10 72  15 o 15 5.33466e+00 1.28121e+00 1.16954e+02 142.494 -9.92400e+00 7.61657e+00  0.00000e+00 0.00000e+00 7.29507e+01 142.494 4.40031e+01 322.494 0.9592 
1 1 1 -10 73  1  o 8  4.62634e+00 1.05158e+00 1.25425e+02 335.325 6.21960e+00  -2.85735e+00 0.00000e+00 0.00000e+00 3.51468e+01 335.325 9.02780e+01 155.325 0.9238 
1 1 1 -10 73  2  o 5  2.45392e+00 8.12186e-01 3.59418e+01 179.567 -1.19604e+00 9.03967e-03  0.00000e+00 0.00000e+00 1.12017e+01 179.567 2.47401e+01 359.567 0.5116 
1 1 1 -10 73  3  o 13 5.58502e+00 1.13322e+00 1.83373e+02 219.436 -8.84932e+00 -7.27825e+00 0.00000e+00 0.00000e+00 1.68847e+01 219.436 1.66488e+02 39.436  0.9553 
1 1 1 -10 73  4  o 6  4.41182e+00 1.01562e+00 6.92380e+01 23.570  3.58267e+00  1.56302e+00  0.00000e+00 0.00000e+00 7.30693e+01 23.570  3.83123e+00 23.570  0.8599 
1 1 1 -10 73  5  o 12 8.80495e+00 8.02990e-01 1.52142e+02 345.014 1.98799e+01  -5.32140e+00 0.00000e+00 0.00000e+00 1.69789e+02 345.014 1.76477e+01 345.014 0.9754 
1 1 1 -10 73  6  o 3  1.19584e+01 6.03549e-01 1.92271e+02 263.258 -4.40321e+00 -3.72473e+01 0.00000e+00 0.00000e+00 2.49645e+02 263.258 5.73742e+01 263.258 0.9866 
1 1 1 -10 73  7  o 17 1.53187e+01 6.09948e-01 2.43642e+02 138.930 -5.03065e+01 4.38386e+01  0.00000e+00 0.00000e+00 3.25383e+02 138.930 8.17404e+01 138.930 0.9925 
1 1 1 -10 73  8  o 9  5.65898e+00 9.50650e-01 8.83413e+01 343.839 7.49631e+00  -2.17234e+00 0.00000e+00 0.00000e+00 1.09213e+02 343.839 2.08719e+01 343.839 0.9335 
1 1 1 -10 73  9  o 17 1.00251e+01 7.50154e-01 1.57281e+02 148.103 -2.45059e+01 1.52517e+01  0.00000e+00 0.00000e+00 2.10717e+02 148.103 5.34363e+01 148.103 0.9825 
1 1 1 -10 73  10 o 18 2.81291e+00 8.60403e-01 5.68134e+01 348.603 2.81570e+00  -5.67567e-01 0.00000e+00 0.00000e+00 2.71864e+01 348.603 2.96269e+01 168.603 0.8001 
1 1 1 -10 73  11 f 0  4.98777e+00 1.03596e+00 1.38877e+02 154.761 -1.16097e+01 5.47275e+00  0.00000e+00 0.00000e+00 3.96930e+01 154.761 9.91837e+01 334.761 0.9602 
1 1 1 -10 73  12 o 5  4.02900e+00 1.05207e+00 9.20782e+01 297.860 3.32827e+00  -6.29659e+00 0.00000e+00 0.00000e+00 4.70031e+01 297.860 4.50751e+01 117.860 0.9269 
1 1 1 -10 73  13 o 18 4.22988e+00 1.11005e+00 4.68786e+01 100.218 -7.22203e-01 4.00675e+00  0.00000e+00 0.00000e+00 8.94213e+01 100.218 4.25427e+01 100.218 0.8662 
1 1 1 -10 73  14 o 4  2.77032e+00 9.17883e-01 5.00858e+01 271.356 8.99430e-02  -3.79944e+00 0.00000e+00 0.00000e+00 3.79592e+01 271.356 1.21266e+01 91.356  0.8554 
1 1 1 -10 74  1  o 8  3.36374e+00 9.56096e-01 3.14727e+01 118.298 -6.09351e-01 1.13180e+00  0.00000e+00 0.00000e+00 3.65648e+01 118.298 5.09211e+00 118.298 0.5384 
1 1 1 -10 74  2  o 4  3.13344e+00 8.91551e-01 3.11562e+01 60.632  5.96621e-01  1.06023e+00  0.00000e+00 0.00000e+00 2.97733e+01 60.632  1.38288e+00 240.632 0.5179 
1 1 1 -10 74  3  o 18 4.05735e+00 1.05701e+00 8.27800e+01 222.976 -3.08320e+00 -2.87267e+00 0.00000e+00 0.00000e+00 4.98767e+01 222.976 3.29033e+01 42.976  0.8713 
1 1 1 -10 74  4  o 11 3.05570e+00 9.02987e-01 5.94680e+01 310.887 1.54406e+00  -1.78332e+00 0.00000e+00 0.00000e+00 2.63349e+01 310.887 3.31331e+01 130.887 0.7487 
1 1 1 -10 74  5  o 11 7.66529e+00 9.47769e-01 8.71144e+01 257.868 -1.97454e+00 -9.18510e+00 0.00000e+00 0.00000e+00 1.84412e+02 257.868 9.72973e+01 257.868 0.9452 
1 1 1 -10 74  6  o 15 5.66761e+00 9.17303e-01 1.13634e+02 115.243 -3.90388e+00 8.27986e+00  0.00000e+00 0.00000e+00 8.66636e+01 115.243 2.69705e+01 295.243 0.9437 
1 1 1 -10 74  7  o 12 4.04856e+00 9.42723e-01 8.55213e+01 200.801 -5.02808e+00 -1.91010e+00 0.00000e+00 0.00000e+00 5.10494e+01 200.801 3.44719e+01 20.801  0.9015 
1 1 1 -10 74  8  o 13 8.12447e+00 7.65242e-01 1.57495e+02 8.660   2.10066e+01  3.19945e+00  0.00000e+00 0.00000e+00 1.39023e+02 8.660   1.84718e+01 188.660 0.9762 
1 1 1 -10 74  9  o 6  4.28723e+00 9.98685e-01 1.04122e+02 117.069 -3.28846e+00 6.43487e+00  0.00000e+00 0.00000e+00 4.44852e+01 117.069 5.96369e+01 297.069 0.9280 
1 1 1 -10 74  10 o 13 5.85924e+00 1.05642e+00 9.51360e+01 239.175 -4.61227e+00 -7.72956e+00 0.00000e+00 0.00000e+00 1.10980e+02 239.175 1.58438e+01 239.175 0.9427 
1 1 1 -10 74  11 o 16 5.31520e+00 1.05387e+00 5.68168e+01 15.326  5.05425e+00  1.38511e+00  0.00000e+00 0.00000e+00 1.21244e+02 15.326  6.44273e+01 15.326  0.8987 
1 1 1 -10 74  12 o 5  4.67653e+00 1.15081e+00 1.17057e+02 26.115  9.22431e+00  4.52193e+00  0.00000e+00 0.00000e+00 4.83736e+01 26.115  6.86831e+01 206.115 0.9500 
1 1 1 -10 74  13 o 4  3.39195e+00 9.89655e-01 8.25462e+01 195.523 -6.04963e+00 -1.68036e+00 0.00000e+00 0.00000e+00 3.30734e+01 195.523 4.94729e+01 15.523  0.9165 
1 1 1 -10 74  14 o 7  4.58991e+00 1.23389e+00 5.04421e+01 206.716 -4.13312e+00 -2.08018e+00 0.00000e+00 0.00000e+00 1.00273e+02 206.716 4.98306e+01 206.716 0.8839 
1 1 1 -10 75  1  o 12 7.65103e+00 9.10228e-01 1.21107e+02 246.714 -4.93496e+00 -1.14667e+01 0.00000e+00 0.00000e+00 1.54486e+02 246.714 3.33788e+01 246.714 0.9591 
1 1 1 -10 75  2  o 7  1.16302e+01 6.73333e-01 2.19557e+02 136.190 -2.73917e+01 2.62770e+01  0.00000e+00 0.00000e+00 2.11240e+02 136.190 8.31703e+00 316.190 0.9867 
1 1 1 -10 75  3  o 10 4.81545e+00 1.05550e+00 1.12701e+02 226.604 -4.51532e+00 -4.77541e+00 0.00000e+00 0.00000e+00 5.35888e+01 226.604 5.91122e+01 46.604  0.9204 
1 1 1 -10 75  4  o 11 3.92373e+00 1.03172e+00 7.80578e+01 323.348 3.29624e+00  -2.45261e+00 0.00000e+00 0.00000e+00 4.95799e+01 323.348 2.84779e+01 143.348 0.8676 
1 1 1 -10 75  5  o 17 3.67845e+00 8.86873e-01 3.56299e+01 159.861 -1.77859e+00 6.52230e-01  0.00000e+00 0.00000e+00 5.80464e+01 159.861 2.24165e+01 159.861 0.6796 
1 1 1 -10 75  6  o 19 8.71263e+00 7.68221e-01 1.77239e+02 309.956 1.46781e+01  -1.75202e+01 0.00000e+00 0.00000e+00 1.41761e+02 309.956 3.54788e+01 129.956 0.9779 
1 1 1 -10 75  7  o 4  7.13071e+00 8.07159e-01 9.93672e+01 106.806 -3.20332e+00 1.06061e+01  0.00000e+00 0.00000e+00 1.55067e+02 106.806 5.57001e+01 106.806 0.9537 
1 1 1 -10 75  8  o 16 4.05389e+00 9.57743e-01 4.28446e+01 60.889  1.43248e+00  2.57252e+00  0.00000e+00 0.00000e+00 7.92602e+01 60.889  3.64156e+01 60.889  0.8058 
1 1 1 -10 75  9  o 19 9.01038e+00 7.53687e-01 1.28625e+02 173.471 -2.10410e+01 2.40789e+00  0.00000e+00 0.00000e+00 1.99828e+02 173.471 7.12030e+01 173.471 0.9761 
1 1 1 -10 75  10 o 13 1.06941e+01 7.47820e-01 1.22329e+02 18.309  2.48948e+01  8.23762e+00  0.00000e+00 0.00000e+00 2.68971e+02 18.309  1.46642e+02 18.309  0.9807 
1 1 1 -10 75  11 o 7  3.90754e+00 1.01103e+00 8.63130e+01 218.159 -5.05853e+00 -3.97484e+00 0.00000e+00 0.00000e+00 4.74661e+01 218.159 3.88469e+01 38.159  0.9186 
1 1 1 -10 75  12 o 3  4.68237e+00 1.08507e+00 7.41765e+01 169.881 -7.14216e+00 1.27464e+00  0.00000e+00 0.00000e+00 8.76383e+01 169.881 1.34617e+01 169.881 0.9283 
1 1 1 -10 75  13 o 16 3.66493e+00 1.07116e+00 7.76198e+01 160.651 -5.75629e+00 2.02139e+00  0.00000e+00 0.00000e+00 4.69269e+01 160.651 3.06929e+01 340.651 0.9139 
1 1 1 -10 75  14 o 6  5.21280e+00 1.26214e+00 9.36316e+01 258.625 -1.94297e+00 -9.65814e+00 0.00000e+00 0.00000e+00 8.98631e+01 258.625 3.76846e+00 78.625  0.9478 
1 1 1 -10 76  1  f 0  5.33724e+00 1.03330e+00 6.59355e+01 133.872 -3.02900e+00 3.15069e+00  0.00000e+00 0.00000e+00 1.09706e+02 133.872 4.37705e+01 133.872 0.8764 
1 1 1 -10 76  2  o 17 8.78966e+00 7.22048e-01 1.23148e+02 301.443 7.89798e+00  -1.29174e+01 0.00000e+00 0.00000e+00 1.95652e+02 301.443 7.25033e+01 301.443 0.9664 
1 1 1 -10 76  3  o 17 6.32198e+00 1.08234e+00 1.40041e+02 70.431  3.95570e+00  1.11277e+01  0.00000e+00 0.00000e+00 8.68255e+01 70.431  5.32159e+01 250.431 0.9567 
1 1 1 -10 76  4  o 7  3.19487e+00 9.48910e-01 9.76332e+01 273.799 2.90292e-01  -4.37158e+00 0.00000e+00 0.00000e+00 7.37037e+00 273.799 9.02629e+01 93.799  0.8767 
1 1 1 -10 76  5  f 0  2.31304e+00 7.55006e-01 6.87097e+01 24.268  2.22051e+00  1.00110e+00  0.00000e+00 0.00000e+00 3.04369e+00 204.268 7.17534e+01 204.268 0.7578 
1 1 1 -10 76  6  o 1  2.78953e+00 8.43141e-01 5.17094e+01 57.734  1.14513e+00  1.81379e+00  0.00000e+00 0.00000e+00 2.34977e+01 57.734  2.82118e+01 237.734 0.7202 
1 1 1 -10 76  7  o 2  7.81561e+00 7.42848e-01 1.09587e+02 116.555 -6.66068e+00 1.33270e+01  0.00000e+00 0.00000e+00 1.72762e+02 116.555 6.31751e+01 116.555 0.9658 
1 1 1 -10 76  8  o 15 3.78390e+00 9.34841e-01 7.77953e+01 297.442 2.19843e+00  -4.23353e+00 0.00000e+00 0.00000e+00 4.77461e+01 297.442 3.00492e+01 117.442 0.8878 
1 1 1 -10 76  9  o 18 7.73062e+00 8.35061e-01 8.98227e+01 328.233 9.96915e+00  -6.17315e+00 0.00000e+00 0.00000e+00 1.86224e+02 328.233 9.64009e+01 328.233 0.9564 
1 1 1 -10 76  10 o 9  3.62412e+00 9.92976e-01 7.35561e+01 273.219 2.67901e-01  -4.76266e+00 0.00000e+00 0.00000e+00 4.64546e+01 273.219 2.71015e+01 93.220  0.8878 
1 1 1 -10 76  11 o 9  6.94241e+00 9.63981e-01 1.13932e+02 74.437  4.16870e+00  1.49684e+01  0.00000e+00 0.00000e+00 1.36288e+02 74.437  2.23562e+01 74.437  0.9673 
1 1 1 -10 76  12 o 1  4.59420e+00 1.07965e+00 5.06042e+01 165.114 -4.72184e+00 1.25519e+00  0.00000e+00 0.00000e+00 1.01700e+02 165.114 5.10954e+01 165.114 0.8907 
1 1 1 -10 76  13 o 9  5.01820e+00 1.18623e+00 8.17763e+01 187.264 -8.47118e+00 -1.07984e+00 0.00000e+00 0.00000e+00 9.34974e+01 187.264 1.17211e+01 187.264 0.9395 
1 1 1 -10 76  14 f 0  3.11466e+00 1.01650e+00 3.37766e+01 54.242  1.69721e+00  2.35685e+00  0.00000e+00 0.00000e+00 5.90529e+01 54.242  2.52763e+01 54.242  0.8027 
1 1 1 -10 77  1  o 2  7.07115e+00 8.81592e-01 1.41017e+02 84.141  1.50744e+00  1.46893e+01  0.00000e+00 0.00000e+00 1.15295e+02 84.141  2.57219e+01 264.141 0.9655 
1 1 1 -10 77  2  o 10 3.99881e+00 9.48359e-01 9.09288e+01 13.222  4.95502e+00  1.16419e+00  0.00000e+00 0.00000e+00 4.34292e+01 13.222  4.74996e+01 193.222 0.8954 
1 1 1 -10 77  3  o 19 8.41180e+00 1.07111e+00 1.47938e+02 334.954 1.48792e+01  -6.95279e+00 0.00000e+00 0.00000e+00 1.57766e+02 334.954 9.82733e+00 334.954 0.9691 
1 1 1 -10 77  4  o 7  6.61683e+00 1.06683e+00 1.42340e+02 222.512 -9.15211e+00 -8.38980e+00 0.00000e+00 0.00000e+00 9.54484e+01 222.512 4.68913e+01 42.512  0.9588 
1 1 1 -10 77  5  o 11 1.14454e+01 7.46855e-01 1.34778e+02 115.697 -9.99241e+00 2.07652e+01  0.00000e+00 0.00000e+00 2.84490e+02 115.697 1.49712e+02 115.697 0.9781 
1 1 1 -10 77  6  o 9  3.46031e+00 8.98510e-01 7.88310e+01 307.733 2.50067e+00  -3.23163e+00 0.00000e+00 0.00000e+00 3.34196e+01 307.733 4.54114e+01 127.733 0.8668 
1 1 1 -10 77  7  o 3  2.71100e+00 8.27330e-01 2.98711e+01 202.024 -1.20903e+00 -4.89065e-01 0.00000e+00 0.00000e+00 2.52678e+01 202.024 4.60331e+00 22.024  0.5439 
1 1 1 -10 77  8  o 8  9.72209e+00 7.23916e-01 1.99936e+02 19.462  3.14318e+01  1.11069e+01  0.00000e+00 0.00000e+00 1.57832e+02 19.462  4.21037e+01 199.462 0.9849 
1 1 1 -10 77  9  o 2  9.97910e+00 7.96588e-01 1.41592e+02 210.052 -2.27665e+01 -1.31720e+01 0.00000e+00 0.00000e+00 2.23774e+02 210.052 8.21815e+01 210.052 0.9808 
1 1 1 -10 77  10 f 0  7.48759e+00 9.22129e-01 7.38686e+01 18.873  1.05130e+01  3.59384e+00  0.00000e+00 0.00000e+00 1.92488e+02 18.873  1.18619e+02 18.873  0.9539 
1 1 1 -10 77  11 o 4  2.89043e+00 9.12063e-01 5.13273e+01 259.480 -5.45687e-01 -2.93866e+00 0.00000e+00 0.00000e+00 3.58035e+01 259.480 1.55239e+01 79.480  0.8092 
1 1 1 -10 77  12 o 18 3.78456e+00 1.06696e+00 9.09888e+01 282.072 1.51317e+00  -7.07511e+00 0.00000e+00 0.00000e+00 3.97153e+01 282.072 5.12735e+01 102.072 0.9281 
1 1 1 -10 77  13 o 18 4.85474e+00 1.16156e+00 1.03083e+02 87.613  4.35294e-01  1.04438e+01  0.00000e+00 0.00000e+00 6.85043e+01 87.613  3.45784e+01 267.613 0.9509 
1 1 1 -10 77  14 o 9  3.29324e+00 1.05497e+00 1.16508e+02 154.493 -9.37562e+00 4.47339e+00  0.00000e+00 0.00000e+00 2.91700e-01 334.493 1.16799e+02 334.493 0.9506 
1 1 1 -10 78  1  o 12 5.50949e+00 9.19740e-01 1.07099e+02 15.567  8.11199e+00  2.25980e+00  0.00000e+00 0.00000e+00 8.69969e+01 15.567  2.01020e+01 195.566 0.9386 
1 1 1 -10 78  2  o 11 1.23532e+01 6.63210e-01 2.11959e+02 304.633 2.36296e+01  -3.42102e+01 0.00000e+00 0.00000e+00 2.45869e+02 304.633 3.39098e+01 304.633 0.9879 
1 1 1 -10 78  3  o 10 7.28114e+00 9.64047e-01 1.37968e+02 146.425 -1.16414e+01 7.72724e+00  0.00000e+00 0.00000e+00 1.25077e+02 146.425 1.28920e+01 326.425 0.9635 
1 1 1 -10 78  4  o 14 3.37085e+00 9.74582e-01 8.61243e+01 237.873 -2.21641e+00 -3.52951e+00 0.00000e+00 0.00000e+00 2.37250e+01 237.873 6.23993e+01 57.873  0.8697 
1 1 1 -10 78  5  o 11 8.56844e+00 9.95809e-01 1.61478e+02 291.663 7.04554e+00  -1.77377e+01 0.00000e+00 0.00000e+00 1.50855e+02 291.663 1.06233e+01 111.663 0.9734 
1 1 1 -10 78  6  o 16 9.93624e+00 7.22792e-01 1.69726e+02 264.195 -3.00108e+00 -2.95216e+01 0.00000e+00 0.00000e+00 1.95752e+02 264.195 2.60262e+01 264.195 0.9830 
1 1 1 -10 78  7  o 9  5.00322e+00 9.86284e-01 8.57378e+01 32.558  6.02117e+00  3.84441e+00  0.00000e+00 0.00000e+00 8.76889e+01 32.558  1.95113e+00 32.558  0.9271 
1 1 1 -10 78  8  o 12 6.90542e+00 8.77777e-01 1.06361e+02 321.067 9.77470e+00  -7.89648e+00 0.00000e+00 0.00000e+00 1.41112e+02 321.067 3.47513e+01 321.067 0.9593 
1 1 1 -10 78  9  o 17 1.14391e+01 7.23927e-01 1.54316e+02 277.833 4.80756e+00  -3.49463e+01 0.00000e+00 0.00000e+00 2.66517e+02 277.833 1.12201e+02 277.833 0.9857 
1 1 1 -10 78  10 o 10 8.11208e+00 9.39688e-01 1.10113e+02 125.850 -9.86357e+00 1.36512e+01  0.00000e+00 0.00000e+00 1.83226e+02 125.850 7.31133e+01 125.850 0.9698 
1 1 1 -10 78  11 o 14 7.77225e+00 9.60629e-01 1.15513e+02 337.204 1.70139e+01  -7.15069e+00 0.00000e+00 0.00000e+00 1.66018e+02 337.204 5.05047e+01 337.204 0.9725 
1 1 1 -10 78  12 o 14 3.27397e+00 9.99780e-01 4.81725e+01 331.101 3.11108e+00  -1.71732e+00 0.00000e+00 0.00000e+00 5.46158e+01 331.101 6.44325e+00 331.101 0.8439 
1 1 1 -10 78  13 o 13 7.17714e+00 1.15563e+00 1.22193e+02 90.729  -2.44648e-01 1.92194e+01  0.00000e+00 0.00000e+00 1.37488e+02 90.729  1.52956e+01 90.729  0.9736 
1 1 1 -10 78  14 o 11 3.44582e+00 9.78382e-01 5.40270e+01 136.130 -3.60844e+00 3.46882e+00  0.00000e+00 0.00000e+00 6.02482e+01 136.130 6.22113e+00 136.130 0.8935 
1 1 1 -10 79  1  o 13 1.16401e+01 7.14585e-01 1.95594e+02 20.907  3.32349e+01  1.26961e+01  0.00000e+00 0.00000e+00 2.35028e+02 20.907  3.94342e+01 20.907  0.9858 
1 1 1 -10 79  2  o 18 1.06278e+01 6.91860e-01 2.20493e+02 291.127 1.33019e+01  -3.44247e+01 0.00000e+00 0.00000e+00 1.72688e+02 291.127 4.78047e+01 111.127 0.9864 
1 1 1 -10 79  3  o 2  1.13810e+01 7.81890e-01 1.99091e+02 233.152 -2.14764e+01 -2.86576e+01 0.00000e+00 0.00000e+00 2.21543e+02 233.152 2.24525e+01 233.152 0.9859 
1 1 1 -10 79  4  o 9  7.28608e+00 1.05488e+00 1.29480e+02 16.445  1.29696e+01  3.82831e+00  0.00000e+00 0.00000e+00 1.33186e+02 16.445  3.70635e+00 16.445  0.9623 
1 1 1 -10 79  5  o 12 7.72663e+00 1.02397e+00 9.25797e+01 197.854 -9.55341e+00 -3.07723e+00 0.00000e+00 0.00000e+00 1.81877e+02 197.854 8.92977e+01 197.854 0.9488 
1 1 1 -10 79  6  o 12 9.05136e+00 7.76277e-01 1.80210e+02 14.473  2.76301e+01  7.13155e+00  0.00000e+00 0.00000e+00 1.52417e+02 14.473  2.77925e+01 194.473 0.9823 
1 1 1 -10 79  7  o 10 6.72385e+00 9.15538e-01 1.31538e+02 259.194 -2.77590e+00 -1.45432e+01 0.00000e+00 0.00000e+00 1.11160e+02 259.194 2.03784e+01 79.194  0.9656 
1 1 1 -10 79  8  o 5  4.79428e+00 9.83208e-01 7.23232e+01 155.254 -4.90577e+00 2.26116e+00  0.00000e+00 0.00000e+00 8.91757e+01 155.254 1.68524e+01 155.254 0.9019 
1 1 1 -10 79  9  o 17 6.98817e+00 9.19188e-01 5.01224e+01 21.945  6.15196e+00  2.47867e+00  0.00000e+00 0.00000e+00 1.90081e+02 21.945  1.39959e+02 21.945  0.9212 
1 1 1 -10 79  10 o 11 3.92249e+00 1.03684e+00 5.71865e+01 116.887 -1.89962e+00 3.74650e+00  0.00000e+00 0.00000e+00 7.01434e+01 116.887 1.29569e+01 116.887 0.8708 
1 1 1 -10 79  11 o 13 6.19604e+00 1.10688e+00 8.02622e+01 241.356 -4.73600e+00 -8.67052e+00 0.00000e+00 0.00000e+00 1.38459e+02 241.356 5.81964e+01 241.356 0.9480 
1 1 1 -10 79  12 o 10 3.92377e+00 1.10119e+00 7.90757e+01 5.847   6.30617e+00  6.45769e-01  0.00000e+00 0.00000e+00 5.48107e+01 5.847   2.42650e+01 185.847 0.9173 
1 1 1 -10 79  13 o 16 4.19186e+00 1.15246e+00 6.18043e+01 128.036 -3.44101e+00 4.39862e+00  0.00000e+00 0.00000e+00 7.92023e+01 128.036 1.73980e+01 128.036 0.9054 
1 1 1 -10 80  1  o 18 4.04863e+00 9.84404e-01 5.77290e+01 30.424  2.88172e+00  1.69230e+00  0.00000e+00 0.00000e+00 6.87086e+01 30.424  1.09797e+01 30.424  0.8324 
1 1 1 -10 80  2  o 13 9.36334e+00 7.48981e-01 1.07839e+02 344.511 1.56006e+01  -4.32311e+00 0.00000e+00 0.00000e+00 2.32255e+02 344.511 1.24416e+02 344.511 0.9686 
1 1 1 -10 80  3  o 17 5.90287e+00 8.80588e-01 8.86865e+01 170.794 -8.14995e+00 1.32085e+00  0.00000e+00 0.00000e+00 1.18678e+02 170.794 2.99915e+01 170.794 0.9373 
1 1 1 -10 80  4  o 16 8.83925e+00 8.39565e-01 1.17030e+02 16.989  1.62419e+01  4.96235e+00  0.00000e+00 0.00000e+00 2.04146e+02 16.989  8.71168e+01 16.989  0.9701 
1 1 1 -10 80  5  o 10 9.77382e+00 9.42675e-01 1.55259e+02 204.841 -2.16211e+01 -1.00091e+01 0.00000e+00 0.00000e+00 2.02812e+02 204.841 4.75537e+01 204.841 0.9788 
1 1 1 -10 80  6  o 11 1.11586e+01 6.97216e-01 1.55456e+02 320.013 2.48451e+01  -2.08377e+01 0.00000e+00 0.00000e+00 2.55415e+02 320.013 9.99587e+01 320.013 0.9845 
1 1 1 -10 80  7  o 1  6.89927e+00 8.83261e-01 1.15997e+02 308.712 8.67503e+00  -1.08234e+01 0.00000e+00 0.00000e+00 1.32369e+02 308.712 1.63719e+01 308.712 0.9633 
1 1 1 -10 80  8  o 2  1.06115e+01 7.81334e-01 1.60185e+02 92.839  -1.58195e+00 3.18963e+01  0.00000e+00 0.00000e+00 2.29797e+02 92.839  6.96111e+01 92.839  0.9842 
1 1 1 -10 80  9  f 0  5.74683e+00 9.76206e-01 8.19258e+01 232.715 -5.26788e+00 -6.91875e+00 0.00000e+00 0.00000e+00 1.19731e+02 232.715 3.78055e+01 232.715 0.9406 
1 1 1 -10 80  10 o 18 2.97515e+00 9.11784e-01 6.91811e+01 36.222  3.38322e+00  2.47810e+00  0.00000e+00 0.00000e+00 2.73493e+01 36.222  4.18317e+01 216.222 0.8706 
1 1 1 -10 80  11 o 4  5.65360e+00 1.22791e+00 1.17922e+02 91.715  -3.70160e-01 1.23641e+01  0.00000e+00 0.00000e+00 8.38657e+01 91.715  3.40565e+01 271.715 0.9587 
1 1 1 -10 80  12 o 14 4.60363e+00 1.14352e+00 1.13293e+02 246.489 -4.60906e+00 -1.05948e+01 0.00000e+00 0.00000e+00 5.03260e+01 246.489 6.29666e+01 66.489  0.9557 
1 1 1 -10 80  13 o 11 3.30832e+00 9.55103e-01 5.73195e+01 37.870  4.05954e+00  3.15685e+00  0.00000e+00 0.00000e+00 5.28614e+01 37.870  4.45809e+00 217.870 0.8966 
1 1 1 -10 81  1  f 0  6.29428e+00 1.01516e+00 6.81347e+01 100.109 -1.10441e+00 6.19456e+00  0.00000e+00 0.00000e+00 1.48287e+02 100.109 8.01528e+01 100.109 0.9167 
1 1 1 -10 81  2  o 16 5.26122e+00 9.87867e-01 7.31917e+01 227.603 -3.86306e+00 -4.23108e+00 0.00000e+00 0.00000e+00 1.05897e+02 227.603 3.27052e+01 227.603 0.9079 
1 1 1 -10 81  3  o 10 7.05737e+00 8.16276e-01 1.02564e+02 16.104  1.15611e+01  3.33771e+00  0.00000e+00 0.00000e+00 1.50639e+02 16.104  4.80751e+01 16.104  0.9575 
1 1 1 -10 81  4  o 4  4.13938e+00 9.15242e-01 8.41388e+01 147.495 -4.70074e+00 2.99532e+00  0.00000e+00 0.00000e+00 5.61715e+01 147.495 2.79674e+01 327.495 0.9052 
1 1 1 -10 81  5  o 1  8.87470e+00 1.02441e+00 1.69980e+02 244.815 -9.32694e+00 -1.98341e+01 0.00000e+00 0.00000e+00 1.54458e+02 244.815 1.55222e+01 64.815  0.9769 
1 1 1 -10 81  6  o 18 7.20124e+00 1.18420e+00 9.65632e+01 10.689  9.54994e+00  1.80266e+00  0.00000e+00 0.00000e+00 1.58465e+02 10.689  6.19014e+01 10.689  0.9471 
1 1 1 -10 81  7  o 3  1.21989e+01 7.24407e-01 1.84455e+02 136.674 -3.22287e+01 3.03987e+01  0.00000e+00 0.00000e+00 2.66173e+02 136.674 8.17184e+01 136.674 0.9886 
1 1 1 -10 81  8  o 10 7.13145e+00 1.03102e+00 1.21453e+02 117.914 -6.75038e+00 1.27418e+01  0.00000e+00 0.00000e+00 1.35373e+02 117.914 1.39208e+01 117.914 0.9647 
1 1 1 -10 81  9  o 8  4.58439e+00 9.99521e-01 1.35422e+02 210.350 -9.72499e+00 -5.69422e+00 0.00000e+00 0.00000e+00 2.77925e+01 210.350 1.07629e+02 30.350  0.9545 
1 1 1 -10 81  10 o 16 3.91336e+00 9.73381e-01 8.95075e+01 294.270 2.77945e+00  -6.16438e+00 0.00000e+00 0.00000e+00 4.50465e+01 294.270 4.44610e+01 114.270 0.9228 
1 1 1 -10 81  11 o 11 3.26081e+00 9.71191e-01 9.41024e+01 65.069  2.73686e+00  5.88783e+00  0.00000e+00 0.00000e+00 1.74876e+01 65.069  7.66148e+01 245.069 0.9194 
1 1 1 -10 81  12 o 7  3.00670e+00 9.43883e-01 5.35502e+01 292.491 1.53413e+00  -3.70543e+00 0.00000e+00 0.00000e+00 4.30289e+01 292.491 1.05213e+01 112.491 0.8639 
1 1 1 -10 81  13 o 5  3.16622e+00 1.00896e+00 4.71096e+01 352.309 3.83726e+00  -5.18201e-01 0.00000e+00 0.00000e+00 5.38274e+01 352.309 6.71777e+00 352.309 0.8584 
1 1 1 -10 82  1  o 12 4.90819e+00 9.58451e-01 6.33512e+01 81.060  7.45082e-01  4.73647e+00  0.00000e+00 0.00000e+00 1.00169e+02 81.060  3.68176e+01 81.060  0.8884 
1 1 1 -10 82  2  o 10 3.72142e+00 8.45774e-01 1.07909e+02 34.644  5.40505e+00  3.73488e+00  0.00000e+00 0.00000e+00 2.04744e+01 34.644  8.74351e+01 214.644 0.9204 
1 1 1 -10 82  3  o 12 1.28775e+01 6.16282e-01 2.39020e+02 197.914 -5.43599e+01 -1.75723e+01 0.00000e+00 0.00000e+00 2.39153e+02 197.914 1.32895e-01 197.914 0.9912 
1 1 1 -10 82  4  o 17 3.55670e+00 9.25862e-01 4.56706e+01 290.709 9.29071e-01  -2.45752e+00 0.00000e+00 0.00000e+00 5.79475e+01 290.709 1.22769e+01 290.709 0.7782 
1 1 1 -10 82  5  o 16 4.16129e+00 1.09041e+00 1.23471e+02 154.003 -7.21106e+00 3.51657e+00  0.00000e+00 0.00000e+00 2.21636e+01 154.003 1.01307e+02 334.003 0.9354 
1 1 1 -10 82  6  o 8  9.64557e+00 1.04599e+00 1.55017e+02 356.423 2.16492e+01  -1.35329e+00 0.00000e+00 0.00000e+00 1.97175e+02 356.423 4.21586e+01 356.423 0.9767 
1 1 1 -10 82  7  o 15 1.93441e+01 7.15383e-01 2.72761e+02 218.936 -7.35888e+01 -5.94555e+01 0.00000e+00 0.00000e+00 4.46021e+02 218.936 1.73260e+02 218.936 0.9947 
1 1 1 -10 82  8  o 15 8.13175e+00 9.28813e-01 1.87433e+02 252.067 -8.83422e+00 -2.72982e+01 0.00000e+00 0.00000e+00 1.10736e+02 252.067 7.66966e+01 72.067  0.9824 
1 1 1 -10 82  9  o 1  5.73376e+00 1.04621e+00 9.84160e+01 119.907 -4.90093e+00 8.52063e+00  0.00000e+00 0.00000e+00 1.04205e+02 119.907 5.78862e+00 119.907 0.9477 
1 1 1 -10 82  10 o 7  3.85864e+00 1.02699e+00 8.17265e+01 47.875  4.13766e+00  4.57530e+00  0.00000e+00 0.00000e+00 4.97854e+01 47.875  3.19411e+01 227.875 0.9149 
1 1 1 -10 82  11 o 9  7.41607e+00 1.05086e+00 1.11793e+02 59.121  8.96761e+00  1.49960e+01  0.00000e+00 0.00000e+00 1.56167e+02 59.121  4.43739e+01 59.121  0.9709 
1 1 1 -10 82  12 o 9  5.29144e+00 1.28652e+00 8.36299e+01 239.774 -4.15671e+00 -7.13452e+00 0.00000e+00 0.00000e+00 1.00739e+02 239.774 1.71093e+01 239.774 0.9373 
1 1 1 -10 82  13 o 17 2.82293e+00 9.41587e-01 6.74648e+01 9.843   5.35661e+00  9.29354e-01  0.00000e+00 0.00000e+00 2.71405e+01 9.843   4.03243e+01 189.843 0.9026 
1 1 1 -10 83  1  o 4  4.09580e+00 9.34866e-01 3.28189e+01 280.107 3.73778e-01  -2.09697e+00 0.00000e+00 0.00000e+00 7.74405e+01 280.107 4.46216e+01 280.107 0.7180 
1 1 1 -10 83  2  o 3  4.24695e+00 9.19924e-01 7.45713e+01 68.734  1.83305e+00  4.70969e+00  0.00000e+00 0.00000e+00 6.78074e+01 68.734  6.76388e+00 248.734 0.8946 
1 1 1 -10 83  3  o 15 4.81080e+00 9.53626e-01 7.78525e+01 134.767 -4.20145e+00 4.23572e+00  0.00000e+00 0.00000e+00 8.64407e+01 134.767 8.58821e+00 134.767 0.9118 
1 1 1 -10 83  4  o 1  4.42830e+00 9.41475e-01 6.83765e+01 52.170  3.05058e+00  3.92850e+00  0.00000e+00 0.00000e+00 7.96021e+01 52.170  1.12256e+01 52.170  0.8928 
1 1 1 -10 83  5  o 5  7.20185e+00 9.22117e-01 9.53493e+01 222.440 -8.27363e+00 -7.56552e+00 0.00000e+00 0.00000e+00 1.61724e+02 222.440 6.63748e+01 222.440 0.9543 
1 1 1 -10 83  6  o 11 4.33144e+00 1.08505e+00 1.01163e+02 314.068 4.61467e+00  -4.76722e+00 0.00000e+00 0.00000e+00 4.79790e+01 314.068 5.31837e+01 134.068 0.9212 
1 1 1 -10 83  7  f 0  1.07123e+01 7.91158e-01 1.67331e+02 240.061 -1.66925e+01 -2.89835e+01 0.00000e+00 0.00000e+00 2.26717e+02 240.061 5.93858e+01 240.061 0.9849 
1 1 1 -10 83  8  o 5  1.26306e+01 7.80053e-01 2.23119e+02 73.871  1.64115e+01  5.67526e+01  0.00000e+00 0.00000e+00 2.44187e+02 73.871  2.10677e+01 73.871  0.9915 
1 1 1 -10 83  9  o 15 2.93030e+00 8.44495e-01 7.19957e+01 0.823   4.47514e+00  6.42730e-02  0.00000e+00 0.00000e+00 2.40961e+01 0.823   4.78997e+01 180.823 0.8796 
1 1 1 -10 83  10 o 17 4.88198e+00 1.11397e+00 1.01824e+02 165.244 -9.49014e+00 2.49960e+00  0.00000e+00 0.00000e+00 7.04721e+01 165.244 3.13516e+01 345.244 0.9476 
1 1 1 -10 83  11 o 1  5.96114e+00 1.05523e+00 7.00687e+01 339.745 8.14825e+00  -3.00689e+00 0.00000e+00 0.00000e+00 1.38528e+02 339.745 6.84597e+01 339.745 0.9405 
1 1 1 -10 83  12 o 13 4.12615e+00 1.07584e+00 5.78892e+01 67.200  2.18517e+00  5.19843e+00  0.00000e+00 0.00000e+00 8.10956e+01 67.200  2.32064e+01 67.200  0.9064 
1 1 1 -10 83  13 o 7  3.38904e+00 1.01963e+00 4.62639e+01 328.724 3.46114e+00  -2.10242e+00 0.00000e+00 0.00000e+00 6.26070e+01 328.724 1.63430e+01 328.724 0.8654 
1 1 1 -10 84  1  o 4  8.82655e+00 7.06807e-01 1.15815e+02 87.376  8.49736e-01  1.85419e+01  0.00000e+00 0.00000e+00 2.06000e+02 87.376  9.01844e+01 87.376  0.9727 
1 1 1 -10 84  2  o 6  5.05199e+00 9.15519e-01 9.49658e+01 87.096  3.95238e-01  7.79175e+00  0.00000e+00 0.00000e+00 8.17262e+01 87.096  1.32396e+01 267.096 0.9335 
1 1 1 -10 84  3  o 13 4.63474e+00 9.06237e-01 8.10524e+01 330.302 5.04645e+00  -2.87823e+00 0.00000e+00 0.00000e+00 7.67521e+01 330.302 4.30029e+00 150.302 0.9093 
1 1 1 -10 84  4  o 9  4.17273e+00 9.49374e-01 4.08827e+01 135.138 -1.94725e+00 1.93791e+00  0.00000e+00 0.00000e+00 8.23840e+01 135.138 4.15012e+01 135.138 0.7894 
1 1 1 -10 84  5  o 1  3.85088e+00 8.76906e-01 1.21056e+02 355.200 7.38612e+00  -6.20212e-01 0.00000e+00 0.00000e+00 1.28519e+01 355.200 1.08204e+02 175.200 0.9299 
1 1 1 -10 84  6  o 9  7.04773e+00 1.18883e+00 1.01563e+02 276.076 1.04444e+00  -9.81173e+00 0.00000e+00 0.00000e+00 1.48075e+02 276.076 4.65121e+01 276.076 0.9479 
1 1 1 -10 84  7  o 18 3.91978e+00 1.01302e+00 5.49829e+01 101.919 -7.48516e-01 3.54610e+00  0.00000e+00 0.00000e+00 6.90329e+01 101.919 1.40500e+01 101.919 0.8473 
1 1 1 -10 84  8  o 17 6.75781e+00 1.08586e+00 1.24175e+02 162.803 -1.43160e+01 4.43070e+00  0.00000e+00 0.00000e+00 1.19373e+02 162.803 4.80187e+00 342.803 0.9660 
1 1 1 -10 84  9  o 10 5.59751e+00 1.15366e+00 1.12879e+02 246.980 -4.15701e+00 -9.78376e+00 0.00000e+00 0.00000e+00 8.56824e+01 246.980 2.71966e+01 66.980  0.9517 
1 1 1 -10 84  10 o 14 1.19597e+01 7.81158e-01 1.60278e+02 81.208  7.87304e+00  5.09015e+01  0.00000e+00 0.00000e+00 2.80701e+02 81.208  1.20423e+02 81.208  0.9902 
1 1 1 -10 84  11 o 16 6.01192e+00 1.08883e+00 1.08436e+02 67.986  5.16264e+00  1.27687e+01  0.00000e+00 0.00000e+00 1.06909e+02 67.986  1.52651e+00 247.986 0.9630 
1 1 1 -10 84  12 o 5  5.75454e+00 1.09211e+00 9.47927e+01 241.938 -5.84190e+00 -1.09586e+01 0.00000e+00 0.00000e+00 1.10222e+02 241.938 1.54292e+01 241.938 0.9589 
1 1 1 -10 84  13 o 9  2.37413e+00 8.14266e-01 8.77780e+00 174.255 -7.45151e-01 7.49736e-02  0.00000e+00 0.00000e+00 2.20993e+01 174.255 1.33215e+01 174.255 0.3504 
1 1 1 -10 85  1  o 10 7.28465e+00 8.43158e-01 1.20866e+02 283.960 3.69133e+00  -1.48488e+01 0.00000e+00 0.00000e+00 1.43051e+02 283.960 2.21850e+01 283.960 0.9667 
1 1 1 -10 85  2  o 19 1.19708e+01 6.49255e-01 1.71533e+02 119.770 -1.95264e+01 3.41367e+01  0.00000e+00 0.00000e+00 2.71115e+02 119.770 9.95820e+01 119.770 0.9872 
1 1 1 -10 85  3  o 3  7.65570e+00 7.48198e-01 9.76362e+01 286.433 4.04025e+00  -1.36985e+01 0.00000e+00 0.00000e+00 1.78739e+02 286.433 8.11029e+01 286.433 0.9643 
1 1 1 -10 85  4  o 15 7.42851e+00 7.81842e-01 8.66026e+01 130.467 -6.98245e+00 8.18492e+00  0.00000e+00 0.00000e+00 1.78070e+02 130.467 9.14672e+01 130.467 0.9523 
1 1 1 -10 85  5  o 9  7.15229e+00 7.91482e-01 1.53566e+02 230.795 -1.24473e+01 -1.52591e+01 0.00000e+00 0.00000e+00 1.06960e+02 230.795 4.66057e+01 50.795  0.9743 
1 1 1 -10 85  6  o 19 5.85153e+00 1.22257e+00 7.59541e+01 91.953  -2.17132e-01 6.36713e+00  0.00000e+00 0.00000e+00 1.24680e+02 91.953  4.87260e+01 91.953  0.9178 
1 1 1 -10 85  7  o 16 3.43146e+00 1.06869e+00 3.27843e+01 289.447 6.41159e-01  -1.81590e+00 0.00000e+00 0.00000e+00 5.49873e+01 289.447 2.22030e+01 289.447 0.6852 
1 1 1 -10 85  8  o 19 7.41166e+00 9.82010e-01 6.91153e+01 128.798 -5.83762e+00 7.26104e+00  0.00000e+00 0.00000e+00 1.92038e+02 128.798 1.22923e+02 128.798 0.9447 
1 1 1 -10 85  9  o 3  4.56879e+00 1.13360e+00 9.28059e+01 54.699  4.42005e+00  6.24247e+00  0.00000e+00 0.00000e+00 6.58886e+01 54.699  2.69173e+01 234.699 0.9321 
1 1 1 -10 85  10 o 10 5.29469e+00 1.10436e+00 7.72480e+01 204.113 -7.60414e+00 -3.40361e+00 0.00000e+00 0.00000e+00 1.07619e+02 204.113 3.03707e+01 204.113 0.9379 
1 1 1 -10 85  11 o 1  2.93607e+00 9.17710e-01 3.70306e+01 145.848 -2.39546e+00 1.62501e+00  0.00000e+00 0.00000e+00 5.05241e+01 145.848 1.34935e+01 145.848 0.8019 
1 1 1 -10 85  12 o 7  4.03016e+00 1.10658e+00 6.02747e+01 348.032 5.56171e+00  -1.17895e+00 0.00000e+00 0.00000e+00 7.55364e+01 348.032 1.52617e+01 348.032 0.9072 
1 1 1 -10 86  1  o 15 7.00973e+00 8.40624e-01 1.13051e+02 129.480 -8.62614e+00 1.04717e+01  0.00000e+00 0.00000e+00 1.39707e+02 129.480 2.66553e+01 129.480 0.9624 
1 1 1 -10 86  2  o 9  3.88661e+00 9.10046e-01 5.41688e+01 346.740 3.37222e+00  -7.94659e-01 0.00000e+00 0.00000e+00 6.79778e+01 346.740 1.38090e+01 346.740 0.8392 
1 1 1 -10 86  3  o 17 9.23751e+00 7.02313e-01 1.92466e+02 92.108  -1.22627e+00 3.33166e+01  0.00000e+00 0.00000e+00 1.48043e+02 92.108  4.44232e+01 272.108 0.9849 
1 1 1 -10 86  4  o 11 1.22445e+01 6.58943e-01 2.01721e+02 288.546 1.50849e+01  -4.49649e+01 0.00000e+00 0.00000e+00 2.51421e+02 288.546 4.96995e+01 288.546 0.9894 
1 1 1 -10 86  5  o 16 2.82897e+00 8.42225e-01 5.63608e+01 160.843 -2.53394e+00 8.80263e-01  0.00000e+00 0.00000e+00 2.64860e+01 160.843 2.98748e+01 340.843 0.7835 
1 1 1 -10 86  6  f 0  3.83637e+00 1.03564e+00 1.26341e+02 193.094 -7.83116e+00 -1.82148e+00 0.00000e+00 0.00000e+00 7.71967e+00 193.094 1.18622e+02 13.094  0.9356 
1 1 1 -10 86  7  o 8  4.40859e+00 1.13429e+00 9.03626e+01 263.087 -7.93298e-01 -6.54315e+00 0.00000e+00 0.00000e+00 6.11176e+01 263.087 2.92450e+01 83.087  0.9207 
1 1 1 -10 86  8  f 0  1.01802e+01 8.88364e-01 1.86676e+02 118.651 -1.89006e+01 3.45936e+01  0.00000e+00 0.00000e+00 1.88089e+02 118.651 1.41284e+00 118.651 0.9872 
1 1 1 -10 86  9  o 18 4.97521e+00 1.11550e+00 6.93888e+01 159.585 -6.24087e+00 2.32276e+00  0.00000e+00 0.00000e+00 1.01414e+02 159.585 3.20256e+01 159.585 0.9215 
1 1 1 -10 86  10 o 7  2.57849e+00 8.52982e-01 8.08052e+01 317.659 3.91651e+00  -3.56892e+00 0.00000e+00 0.00000e+00 5.55285e+00 317.659 7.52523e+01 137.659 0.8999 
1 1 1 -10 86  11 o 9  3.71591e+00 1.04896e+00 8.58023e+01 30.292  6.36228e+00  3.71659e+00  0.00000e+00 0.00000e+00 4.26026e+01 30.292  4.31997e+01 210.292 0.9294 
1 1 1 -10 86  12 o 6  5.26731e+00 1.18802e+00 6.21884e+01 130.982 -4.96359e+00 5.71356e+00  0.00000e+00 0.00000e+00 1.20007e+02 130.982 5.78182e+01 130.982 0.9314 
1 1 1 -10 87  1  o 13 7.46247e+00 8.26262e-01 1.37204e+02 348.114 1.64008e+01  -3.45196e+00 0.00000e+00 0.00000e+00 1.33851e+02 348.114 3.35343e+00 168.114 0.9697 
1 1 1 -10 87  2  o 2  1.39922e+01 6.48573e-01 2.48509e+02 178.440 -6.17447e+01 1.68165e+00  0.00000e+00 0.00000e+00 2.71089e+02 178.440 2.25800e+01 178.440 0.9919 
1 1 1 -10 87  3  o 4  9.98073e+00 7.26036e-01 1.83254e+02 325.822 2.81263e+01  -1.90991e+01 0.00000e+00 0.00000e+00 1.84674e+02 325.822 1.42047e+00 325.822 0.9852 
1 1 1 -10 87  4  o 4  4.01856e+00 9.34303e-01 4.90026e+01 165.015 -3.04997e+00 8.16372e-01  0.00000e+00 0.00000e+00 7.43695e+01 165.015 2.53669e+01 165.015 0.8210 
1 1 1 -10 87  5  o 8  4.62379e+00 9.86867e-01 1.10857e+02 91.499  -2.23129e-01 8.52794e+00  0.00000e+00 0.00000e+00 5.14657e+01 91.499  5.93916e+01 271.499 0.9394 
1 1 1 -10 87  6  o 15 3.05559e+00 9.07688e-01 1.46899e+01 269.986 -2.09226e-04 -8.55947e-01 0.00000e+00 0.00000e+00 3.01560e+01 269.986 1.54661e+01 269.986 0.3930 
1 1 1 -10 87  7  f 0  1.11714e+01 1.04191e+00 2.03277e+02 31.012  3.42655e+01  2.05988e+01  0.00000e+00 0.00000e+00 2.08307e+02 31.012  5.02996e+00 31.012  0.9874 
1 1 1 -10 87  8  o 8  4.33666e+00 1.20362e+00 5.83703e+01 35.610  3.36985e+00  2.41346e+00  0.00000e+00 0.00000e+00 8.21020e+01 35.610  2.37316e+01 35.610  0.8689 
1 1 1 -10 87  9  f 0  2.95598e+00 8.53964e-01 1.38084e+01 281.830 2.11340e-01  -1.00900e+00 0.00000e+00 0.00000e+00 3.65316e+01 281.830 2.27232e+01 281.830 0.4572 
1 1 1 -10 87  10 o 6  7.01428e+00 1.09028e+00 7.39126e+01 204.077 -9.75576e+00 -4.35925e+00 0.00000e+00 0.00000e+00 1.74554e+02 204.077 1.00641e+02 204.077 0.9520 
1 1 1 -10 87  11 o 16 5.22344e+00 1.13391e+00 5.79960e+01 52.108  4.15868e+00  5.34366e+00  0.00000e+00 0.00000e+00 1.21189e+02 52.108  6.31930e+01 52.108  0.9229 
1 1 1 -10 87  12 o 6  2.73060e+00 8.99851e-01 2.11088e+01 237.538 -9.86891e-01 -1.55136e+00 0.00000e+00 0.00000e+00 4.67604e+01 237.538 2.56517e+01 237.538 0.6694 
1 1 1 -10 88  1  o 5  6.16618e+00 8.95940e-01 1.04487e+02 175.637 -1.08993e+01 8.31659e-01  0.00000e+00 0.00000e+00 1.15599e+02 175.637 1.11118e+01 175.637 0.9531 
1 1 1 -10 88  2  o 6  7.15632e+00 8.90521e-01 1.14445e+02 54.992  7.98561e+00  1.14013e+01  0.00000e+00 0.00000e+00 1.43609e+02 54.992  2.91637e+01 54.992  0.9634 
1 1 1 -10 88  3  o 5  1.02012e+01 7.04796e-01 1.57530e+02 46.048  2.01630e+01  2.09146e+01  0.00000e+00 0.00000e+00 2.17462e+02 46.048  5.99314e+01 46.048  0.9826 
1 1 1 -10 88  4  o 3  8.79408e+00 7.55382e-01 1.54373e+02 229.788 -1.67141e+01 -1.97704e+01 0.00000e+00 0.00000e+00 1.67991e+02 229.788 1.36181e+01 229.788 0.9805 
1 1 1 -10 88  5  o 17 4.00629e+00 9.74463e-01 5.71920e+01 43.124  2.92946e+00  2.74362e+00  0.00000e+00 0.00000e+00 7.21369e+01 43.124  1.49450e+01 43.124  0.8640 
1 1 1 -10 88  6  o 2  3.41000e+00 9.02475e-01 3.50415e+01 218.060 -1.82337e+00 -1.42763e+00 0.00000e+00 0.00000e+00 5.95958e+01 218.060 2.45543e+01 218.060 0.7434 
1 1 1 -10 88  7  o 3  4.43474e+00 1.22137e+00 4.29752e+01 167.237 -3.01899e+00 6.83850e-01  0.00000e+00 0.00000e+00 9.21493e+01 167.237 4.91741e+01 167.237 0.8168 
1 1 1 -10 88  8  o 12 4.38967e+00 1.18073e+00 5.55246e+01 119.204 -2.07179e+00 3.70642e+00  0.00000e+00 0.00000e+00 8.72014e+01 119.204 3.16768e+01 119.204 0.8724 
1 1 1 -10 88  9  o 8  7.85264e+00 1.06520e+00 1.30825e+02 77.575  4.34924e+00  1.97411e+01  0.00000e+00 0.00000e+00 1.54256e+02 77.575  2.34311e+01 77.575  0.9749 
1 1 1 -10 88  10 o 8  3.90214e+00 1.08576e+00 6.56476e+01 245.836 -2.45190e+00 -5.46480e+00 0.00000e+00 0.00000e+00 6.67681e+01 245.836 1.12054e+00 245.836 0.9122 
1 1 1 -10 88  11 o 6  3.44900e+00 1.01408e+00 2.63972e+01 199.354 -2.10155e+00 -7.38176e-01 0.00000e+00 0.00000e+00 6.73977e+01 199.354 4.10005e+01 199.354 0.7318 
1 1 1 -10 88  12 o 13 2.84266e+00 9.33376e-01 3.77919e+01 289.471 1.13112e+00  -3.19928e+00 0.00000e+00 0.00000e+00 5.03532e+01 289.471 1.25613e+01 289.471 0.8353 
1 1 1 -10 89  1  o 18 4.58873e+00 9.81179e-01 7.65152e+01 149.653 -4.73232e+00 2.77059e+00  0.00000e+00 0.00000e+00 7.87079e+01 149.653 2.19267e+00 149.653 0.9035 
1 1 1 -10 89  2  o 6  1.78610e+01 6.91700e-01 2.38635e+02 248.820 -2.79659e+01 -7.21752e+01 0.00000e+00 0.00000e+00 4.25411e+02 248.820 1.86775e+02 248.820 0.9935 
1 1 1 -10 89  3  o 13 2.78109e+00 8.45161e-01 5.35493e+01 205.307 -2.44289e+00 -1.15510e+00 0.00000e+00 0.00000e+00 2.81336e+01 205.307 2.54156e+01 25.307  0.7853 
1 1 1 -10 89  4  o 4  2.13390e+00 7.18859e-01 5.28802e+01 78.513  4.50764e-01  2.21821e+00  0.00000e+00 0.00000e+00 5.87353e+00 78.513  4.70067e+01 258.513 0.7366 
1 1 1 -10 89  5  o 6  2.73981e+00 8.59820e-01 3.85428e+01 114.258 -8.46873e-01 1.87925e+00  0.00000e+00 0.00000e+00 3.38690e+01 114.258 4.67380e+00 294.258 0.7076 
1 1 1 -10 89  6  o 15 2.76423e+00 8.37532e-01 4.81074e+01 59.880  1.34524e+00  2.31881e+00  0.00000e+00 0.00000e+00 3.27087e+01 59.880  1.53987e+01 239.880 0.7833 
1 1 1 -10 89  7  o 4  7.98308e+00 9.56006e-01 1.53882e+02 10.313  2.34329e+01  4.26379e+00  0.00000e+00 0.00000e+00 1.37524e+02 10.313  1.63575e+01 190.313 0.9788 
1 1 1 -10 89  8  o 9  4.88171e+00 1.28564e+00 7.94726e+01 245.631 -2.74550e+00 -6.06125e+00 0.00000e+00 0.00000e+00 8.81433e+01 245.631 8.67070e+00 245.631 0.9215 
1 1 1 -10 89  9  o 14 3.82782e+00 1.06723e+00 8.54303e+01 67.675  2.64624e+00  6.44425e+00  0.00000e+00 0.00000e+00 4.64061e+01 67.675  3.90241e+01 247.675 0.9252 
1 1 1 -10 89  10 o 16 3.33446e+00 1.02769e+00 2.57216e+01 15.610  1.90954e+00  5.33516e-01  0.00000e+00 0.00000e+00 6.04560e+01 15.610  3.47343e+01 15.610  0.6949 
1 1 1 -10 89  11 o 16 3.67495e+00 1.06647e+00 5.59522e+01 244.185 -2.20088e+00 -4.54960e+00 0.00000e+00 0.00000e+00 6.61933e+01 244.185 1.02411e+01 244.185 0.8946 
1 1 1 -10 89  12 o 4  3.18672e+00 9.78724e-01 5.13107e+01 41.757  3.86143e+00  3.44735e+00  0.00000e+00 0.00000e+00 5.48096e+01 41.757  3.49885e+00 41.757  0.8973 
1 1 1 -10 90  1  o 12 3.21554e+00 9.20357e-01 2.18467e+01 42.334  9.01677e-01  8.21437e-01  0.00000e+00 0.00000e+00 4.06021e+01 42.334  1.87554e+01 42.334  0.5189 
1 1 1 -10 90  2  o 9  3.60027e+00 9.78861e-01 3.81899e+01 147.372 -1.93770e+00 1.24054e+00  0.00000e+00 0.00000e+00 6.16817e+01 147.372 2.34918e+01 147.372 0.7415 
1 1 1 -10 90  3  o 14 9.53566e+00 7.13520e-01 1.92639e+02 115.565 -1.59500e+01 3.33432e+01  0.00000e+00 0.00000e+00 1.59053e+02 115.565 3.35861e+01 295.565 0.9864 
1 1 1 -10 90  4  o 10 5.88207e+00 9.01596e-01 7.37375e+01 156.049 -7.59349e+00 3.37299e+00  0.00000e+00 0.00000e+00 1.32379e+02 156.049 5.86411e+01 156.049 0.9377 
1 1 1 -10 90  5  o 17 4.33551e+00 9.47291e-01 6.27890e+01 271.891 1.77333e-01  -5.37171e+00 0.00000e+00 0.00000e+00 8.31476e+01 271.891 2.03586e+01 271.891 0.9014 
1 1 1 -10 90  6  o 17 3.41982e+00 9.50816e-01 5.13591e+01 185.457 -3.48284e+00 -3.32752e-01 0.00000e+00 0.00000e+00 5.59661e+01 185.457 4.60698e+00 185.457 0.8410 
1 1 1 -10 90  7  o 18 3.58720e+00 9.96854e-01 6.94976e+01 312.003 3.34034e+00  -3.70947e+00 0.00000e+00 0.00000e+00 4.99665e+01 312.003 1.95311e+01 132.003 0.8932 
1 1 1 -10 90  8  o 2  4.35191e+00 1.11344e+00 2.60936e+01 284.718 5.89664e-01  -2.24484e+00 0.00000e+00 0.00000e+00 9.45320e+01 284.718 6.84384e+01 284.718 0.7440 
1 1 1 -10 90  9  o 19 4.45339e+00 1.23873e+00 7.18635e+01 81.415  8.69821e-01  5.76154e+00  0.00000e+00 0.00000e+00 7.88995e+01 81.415  7.03602e+00 81.415  0.9096 
1 1 1 -10 90  10 o 4  3.09927e+00 9.63823e-01 3.18216e+01 32.788  2.23107e+00  1.43719e+00  0.00000e+00 0.00000e+00 5.81501e+01 32.788  2.63284e+01 32.788  0.7807 
1 1 1 -10 90  11 o 17 3.37857e+00 9.42523e-01 4.36964e+01 120.501 -2.13955e+00 3.63213e+00  0.00000e+00 0.00000e+00 6.56472e+01 120.501 2.19508e+01 120.501 0.8713 
1 1 1 -10 90  12 o 7  3.63683e+00 1.06378e+00 8.65992e+01 226.005 -5.98348e+00 -6.19707e+00 0.00000e+00 0.00000e+00 4.02433e+01 226.005 4.63559e+01 46.005  0.9400 
1 1 1 -10 91  1  o 1  6.60927e+00 9.21907e-01 1.20784e+02 217.755 -1.12562e+01 -8.71710e+00 0.00000e+00 0.00000e+00 1.17692e+02 217.755 3.09202e+00 37.755  0.9642 
1 1 1 -10 91  2  o 3  2.32145e+00 7.67973e-01 3.55331e+01 78.015  3.40278e-01  1.60297e+00  0.00000e+00 0.00000e+00 1.90467e+01 78.015  1.64864e+01 258.015 0.6286 
1 1 1 -10 91  3  o 13 4.54242e+00 9.61803e-01 9.46048e+01 151.408 -6.94988e+00 3.78797e+00  0.00000e+00 0.00000e+00 6.40791e+01 151.408 3.05257e+01 331.408 0.9345 
1 1 1 -10 91  4  o 14 9.59247e+00 8.41509e-01 1.23001e+02 337.773 2.20261e+01  -9.00088e+00 0.00000e+00 0.00000e+00 2.27749e+02 337.773 1.04748e+02 337.773 0.9788 
1 1 1 -10 91  5  o 15 3.81380e+00 9.54593e-01 5.51876e+01 352.798 3.87351e+00  -4.89451e-01 0.00000e+00 0.00000e+00 6.72240e+01 352.798 1.20365e+01 352.798 0.8597 
1 1 1 -10 91  6  o 8  7.09142e+00 9.13646e-01 1.24760e+02 336.853 1.62428e+01  -6.94393e+00 0.00000e+00 0.00000e+00 1.32191e+02 336.853 7.43137e+00 336.853 0.9713 
1 1 1 -10 91  7  o 14 6.58847e+00 9.77281e-01 1.39450e+02 258.498 -3.94745e+00 -1.93995e+01 0.00000e+00 0.00000e+00 9.98563e+01 258.498 3.95938e+01 78.498  0.9744 
1 1 1 -10 91  8  o 14 5.75095e+00 1.27919e+00 1.15436e+02 23.475  1.07104e+01  4.65150e+00  0.00000e+00 0.00000e+00 8.93639e+01 23.475  2.60725e+01 203.475 0.9562 
1 1 1 -10 91  9  o 19 2.91401e+00 9.68409e-01 1.32454e+01 99.538  -1.67109e-01 9.94590e-01  0.00000e+00 0.00000e+00 3.54830e+01 99.538  2.22376e+01 99.538  0.4494 
1 1 1 -10 91  10 o 11 2.92484e+00 9.41076e-01 5.82939e+01 26.009  4.34384e+00  2.11950e+00  0.00000e+00 0.00000e+00 3.84029e+01 26.009  1.98911e+01 206.009 0.8894 
1 1 1 -10 91  11 o 9  2.85861e+00 9.43562e-01 3.23576e+01 204.166 -2.35004e+00 -1.05447e+00 0.00000e+00 0.00000e+00 4.96972e+01 204.166 1.73396e+01 204.166 0.7730 
1 1 1 -10 92  1  o 11 1.63396e+01 6.47317e-01 1.91015e+02 29.794  6.04160e+01  3.45916e+01  0.00000e+00 0.00000e+00 4.15871e+02 29.794  2.24856e+02 29.794  0.9928 
1 1 1 -10 92  2  f 0  1.15383e+01 7.68291e-01 1.36946e+02 168.029 -3.19179e+01 6.76731e+00  0.00000e+00 0.00000e+00 2.87845e+02 168.029 1.50900e+02 168.029 0.9846 
1 1 1 -10 92  3  o 6  3.94369e+00 9.72150e-01 3.30824e+01 290.905 8.61906e-01  -2.25653e+00 0.00000e+00 0.00000e+00 7.82654e+01 290.905 4.51830e+01 290.905 0.7555 
1 1 1 -10 92  4  o 5  8.03633e+00 8.87427e-01 1.61225e+02 356.676 2.52674e+01  -1.46744e+00 0.00000e+00 0.00000e+00 1.32936e+02 356.676 2.82889e+01 176.676 0.9800 
1 1 1 -10 92  5  o 16 7.22452e+00 8.38130e-01 1.18134e+02 267.809 -6.95804e-01 -1.81898e+01 0.00000e+00 0.00000e+00 1.44000e+02 267.809 2.58660e+01 267.809 0.9721 
1 1 1 -10 92  6  o 3  4.19580e+00 9.69434e-01 8.19297e+01 116.754 -3.16274e+00 6.27371e+00  0.00000e+00 0.00000e+00 6.29504e+01 116.754 1.89793e+01 296.754 0.9258 
1 1 1 -10 92  7  o 8  4.17763e+00 1.03519e+00 5.37348e+01 166.424 -4.75012e+00 1.14710e+00  0.00000e+00 0.00000e+00 8.49327e+01 166.424 3.11979e+01 166.424 0.8907 
1 1 1 -10 92  8  o 11 5.57012e+00 1.21174e+00 7.43376e+01 236.164 -4.34024e+00 -6.47466e+00 0.00000e+00 0.00000e+00 1.19262e+02 236.164 4.49247e+01 236.164 0.9335 
1 1 1 -10 92  9  o 10 4.34285e+00 1.24114e+00 7.75347e+01 67.116  2.50592e+00  5.93685e+00  0.00000e+00 0.00000e+00 7.08938e+01 67.116  6.64094e+00 247.116 0.9187 
1 1 1 -10 92  10 o 10 4.41794e+00 1.15921e+00 5.94189e+01 195.029 -5.64697e+00 -1.51614e+00 0.00000e+00 0.00000e+00 8.99766e+01 195.029 3.05577e+01 195.029 0.9099 
1 1 1 -10 92  11 o 16 4.17708e+00 1.16617e+00 8.60804e+01 304.616 5.01270e+00  -7.26196e+00 0.00000e+00 0.00000e+00 5.99220e+01 304.616 2.61584e+01 124.616 0.9415 
1 1 1 -10 93  1  f 0  8.47760e+00 8.54807e-01 1.45481e+02 142.091 -1.94578e+01 1.51521e+01  0.00000e+00 0.00000e+00 1.65103e+02 142.091 1.96218e+01 142.091 0.9795 
1 1 1 -10 93  2  o 7  6.78600e+00 8.91974e-01 9.75385e+01 357.221 1.35624e+01  -6.58309e-01 0.00000e+00 0.00000e+00 1.46619e+02 357.221 4.90808e+01 357.221 0.9624 
1 1 1 -10 93  3  o 1  4.71190e+00 9.52718e-01 7.50488e+01 252.911 -1.94464e+00 -6.32538e+00 0.00000e+00 0.00000e+00 8.70929e+01 252.911 1.20441e+01 252.911 0.9210 
1 1 1 -10 93  4  o 5  7.74329e+00 9.12938e-01 1.02615e+02 69.005  5.82487e+00  1.51781e+01  0.00000e+00 0.00000e+00 1.77480e+02 69.005  7.48659e+01 69.005  0.9687 
1 1 1 -10 93  5  o 3  4.02180e+00 1.01669e+00 3.94002e+01 86.977  1.55149e-01  2.93742e+00  0.00000e+00 0.00000e+00 8.14926e+01 86.977  4.20925e+01 86.977  0.8056 
1 1 1 -10 93  6  f 0  1.14211e+01 7.52611e-01 1.73046e+02 190.308 -4.96552e+01 -9.03143e+00 0.00000e+00 0.00000e+00 2.48571e+02 190.308 7.55249e+01 190.308 0.9900 
1 1 1 -10 93  7  o 9  5.64970e+00 1.07394e+00 1.26850e+02 298.492 6.68529e+00  -1.23166e+01 0.00000e+00 0.00000e+00 7.59869e+01 298.492 5.08634e+01 118.493 0.9636 
1 1 1 -10 93  8  o 18 5.34463e+00 1.09834e+00 1.36343e+02 250.311 -5.02373e+00 -1.40393e+01 0.00000e+00 0.00000e+00 5.58201e+01 250.311 8.05225e+01 70.311  0.9659 
1 1 1 -10 93  9  o 5  3.04639e+00 9.90890e-01 2.28875e+01 162.004 -1.73872e+00 5.64815e-01  0.00000e+00 0.00000e+00 5.27315e+01 162.004 2.98440e+01 162.004 0.6674 
1 1 1 -10 93  10 o 19 2.77678e+00 9.29676e-01 3.72729e+01 72.853  9.22234e-01  2.98913e+00  0.00000e+00 0.00000e+00 4.72256e+01 72.853  9.95269e+00 72.853  0.8190 
1 1 1 -10 93  11 o 19 6.29553e+00 1.28432e+00 1.17206e+02 339.366 1.55384e+01  -5.85086e+00 0.00000e+00 0.00000e+00 1.09305e+02 339.366 7.90089e+00 159.366 0.9694 
1 1 1 -10 94  1  o 8  1.48899e+01 6.53179e-01 2.02292e+02 46.128  4.66214e+01  4.84946e+01  0.00000e+00 0.00000e+00 3.50327e+02 46.128  1.48035e+02 46.128  0.9925 
1 1 1 -10 94  2  o 18 1.05710e+01 7.79216e-01 2.00588e+02 200.222 -4.12533e+01 -1.51966e+01 0.00000e+00 0.00000e+00 1.89973e+02 200.222 1.06155e+01 20.222  0.9886 
1 1 1 -10 94  3  o 8  1.04754e+01 7.38459e-01 1.58507e+02 328.643 3.23109e+01  -1.96892e+01 0.00000e+00 0.00000e+00 2.27577e+02 328.643 6.90701e+01 328.643 0.9867 
1 1 1 -10 94  4  o 17 1.21026e+01 7.92310e-01 2.24547e+02 130.395 -3.81049e+01 4.47812e+01  0.00000e+00 0.00000e+00 2.23388e+02 130.395 1.15891e+00 310.395 0.9915 
1 1 1 -10 94  5  o 11 2.57333e+00 8.27826e-01 5.86485e+01 248.625 -1.24308e+00 -3.17609e+00 0.00000e+00 0.00000e+00 2.16347e+01 248.625 3.70138e+01 68.625  0.8363 
1 1 1 -10 94  6  o 9  7.41083e+00 8.96950e-01 1.35254e+02 2.810   2.44414e+01  1.19953e+00  0.00000e+00 0.00000e+00 1.35298e+02 2.810   4.43136e-02 2.810   0.9793 
1 1 1 -10 94  7  o 10 4.71089e+00 1.07230e+00 5.16221e+01 203.606 -4.61412e+00 -2.01648e+00 0.00000e+00 0.00000e+00 1.05283e+02 203.606 5.36607e+01 203.606 0.8942 
1 1 1 -10 94  8  o 5  4.87600e+00 1.07362e+00 8.18905e+01 146.012 -7.64888e+00 5.15689e+00  0.00000e+00 0.00000e+00 8.94350e+01 146.012 7.54453e+00 146.012 0.9441 
1 1 1 -10 94  9  o 17 4.02498e+00 1.11091e+00 6.26060e+01 12.181  5.89952e+00  1.27352e+00  0.00000e+00 0.00000e+00 7.40137e+01 12.181  1.14077e+01 12.181  0.9129 
1 1 1 -10 94  10 o 5  5.27056e+00 1.25788e+00 7.33042e+01 64.895  3.58896e+00  7.65995e+00  0.00000e+00 0.00000e+00 1.10505e+02 64.895  3.72005e+01 64.895  0.9389 
1 1 1 -10 94  11 o 9  3.30482e+00 1.01606e+00 2.52261e+01 82.317  3.20744e-01  2.37744e+00  0.00000e+00 0.00000e+00 6.71801e+01 82.317  4.19541e+01 82.317  0.7535 
1 1 1 -10 95  1  o 9  6.47381e+00 9.52822e-01 1.11652e+02 291.503 5.22934e+00  -1.32733e+01 0.00000e+00 0.00000e+00 1.21716e+02 291.503 1.00642e+01 291.503 0.9643 
1 1 1 -10 95  2  o 7  3.14328e+00 9.37502e-01 2.76236e+01 246.324 -6.94725e-01 -1.58444e+00 0.00000e+00 0.00000e+00 4.84912e+01 246.324 2.08676e+01 246.324 0.6481 
1 1 1 -10 95  3  o 19 3.45081e+00 9.66138e-01 7.55196e+01 273.332 2.91649e-01  -5.00977e+00 0.00000e+00 0.00000e+00 3.96614e+01 273.332 3.58583e+01 93.332  0.8938 
1 1 1 -10 95  4  o 5  3.86255e+00 1.01002e+00 4.99118e+01 35.047  3.12947e+00  2.19511e+00  0.00000e+00 0.00000e+00 7.35315e+01 35.047  2.36197e+01 35.047  0.8563 
1 1 1 -10 95  5  o 1  3.23464e+00 9.33207e-01 4.86613e+01 285.636 9.70287e-01  -3.46671e+00 0.00000e+00 0.00000e+00 5.34167e+01 285.636 4.75537e+00 285.636 0.8462 
1 1 1 -10 95  6  o 12 4.23373e+00 9.98139e-01 4.82896e+01 29.662  3.68438e+00  2.09826e+00  0.00000e+00 0.00000e+00 8.93204e+01 29.662  4.10307e+01 29.662  0.8722 
1 1 1 -10 95  7  o 5  1.07277e+01 8.21967e-01 1.84094e+02 189.798 -4.99862e+01 -8.63232e+00 0.00000e+00 0.00000e+00 2.11428e+02 189.798 2.73337e+01 189.798 0.9901 
1 1 1 -10 95  8  o 8  4.24055e+00 9.33719e-01 5.26058e+01 343.503 5.48647e+00  -1.62485e+00 0.00000e+00 0.00000e+00 9.06228e+01 343.503 3.80169e+01 343.503 0.9078 
1 1 1 -10 95  9  o 10 3.36229e+00 1.02075e+00 2.52058e+01 98.254  -3.09683e-01 2.13470e+00  0.00000e+00 0.00000e+00 6.50248e+01 98.254  3.98190e+01 98.254  0.7219 
1 1 1 -10 95  10 o 14 3.12812e+00 1.00907e+00 4.79203e+01 298.942 2.00145e+00  -3.61930e+00 0.00000e+00 0.00000e+00 5.29729e+01 298.942 5.05261e+00 298.942 0.8685 
1 1 1 -10 96  1  o 2  4.08036e+00 9.99370e-01 4.11342e+01 60.226  1.56758e+00  2.73999e+00  0.00000e+00 0.00000e+00 8.40549e+01 60.226  4.29207e+01 60.226  0.8209 
1 1 1 -10 96  2  o 16 5.53231e+00 9.41538e-01 4.63635e+01 309.834 3.24939e+00  -3.89530e+00 0.00000e+00 0.00000e+00 1.38603e+02 309.834 9.22398e+01 309.834 0.8950 
1 1 1 -10 96  3  o 10 6.08134e+00 9.48130e-01 8.50827e+01 269.969 -5.77484e-03 -1.07391e+01 0.00000e+00 0.00000e+00 1.31113e+02 269.969 4.60308e+01 269.969 0.9522 
1 1 1 -10 96  4  o 14 5.96398e+00 9.89164e-01 9.54447e+01 58.688  6.31401e+00  1.03798e+01  0.00000e+00 0.00000e+00 1.17713e+02 58.688  2.22679e+01 58.688  0.9579 
1 1 1 -10 96  5  o 1  2.89343e+00 8.93090e-01 4.44932e+01 88.292  9.42929e-02  3.16245e+00  0.00000e+00 0.00000e+00 4.41225e+01 88.292  3.70676e-01 268.292 0.8214 
1 1 1 -10 96  6  o 12 3.03369e+00 8.99253e-01 1.97214e+01 67.580  5.59491e-01  1.35611e+00  0.00000e+00 0.00000e+00 4.67249e+01 67.580  2.70035e+01 67.580  0.5879 
1 1 1 -10 96  7  o 15 2.97194e+00 8.89477e-01 7.58774e+01 172.388 -6.28847e+00 8.40418e-01  0.00000e+00 0.00000e+00 2.56235e+01 172.388 5.02539e+01 352.388 0.9174 
1 1 1 -10 96  8  o 15 2.86026e+00 9.00256e-01 3.32141e+01 61.726  1.25418e+00  2.33183e+00  0.00000e+00 0.00000e+00 4.97870e+01 61.726  1.65729e+01 61.726  0.7802 
1 1 1 -10 96  9  f 0  3.16774e+00 9.64726e-01 3.57545e+01 315.972 2.37247e+00  -2.29334e+00 0.00000e+00 0.00000e+00 6.19423e+01 315.972 2.61878e+01 315.972 0.8299 
1 1 1 -10 96  10 o 14 2.67611e+00 9.15167e-01 9.50990e+00 238.510 -4.34747e-01 -7.09726e-01 0.00000e+00 0.00000e+00 2.86243e+01 238.510 1.91144e+01 238.510 0.3838 
1 1 1 -10 97  1  o 5  6.74793e+00 9.41997e-01 1.29753e+02 324.628 1.48794e+01  -1.05634e+01 0.00000e+00 0.00000e+00 1.15363e+02 324.628 1.43896e+01 144.628 0.9722 
1 1 1 -10 97  2  o 8  8.82839e+00 8.04518e-01 1.70851e+02 98.989  -5.42104e+00 3.42702e+01  0.00000e+00 0.00000e+00 1.54056e+02 98.989  1.67950e+01 278.989 0.9855 
1 1 1 -10 97  3  o 12 5.43274e+00 9.71330e-01 1.21820e+02 208.609 -1.25733e+01 -6.85762e+00 0.00000e+00 0.00000e+00 7.37395e+01 208.609 4.80802e+01 28.609  0.9644 
1 1 1 -10 97  4  o 13 5.10584e+00 1.03439e+00 8.12808e+01 153.144 -8.06153e+00 4.08199e+00  0.00000e+00 0.00000e+00 9.83022e+01 153.144 1.70214e+01 153.144 0.9429 
1 1 1 -10 97  5  o 13 4.64904e+00 1.00805e+00 8.44112e+01 17.565  8.25587e+00  2.61330e+00  0.00000e+00 0.00000e+00 7.85485e+01 17.565  5.86273e+00 197.565 0.9404 
1 1 1 -10 97  6  o 2  4.88410e+00 1.03822e+00 6.79142e+01 192.080 -6.98498e+00 -1.49490e+00 0.00000e+00 0.00000e+00 1.00747e+02 192.080 3.28326e+01 192.080 0.9271 
1 1 1 -10 97  7  o 16 7.43925e+00 9.64794e-01 1.06752e+02 351.718 1.92027e+01  -2.79533e+00 0.00000e+00 0.00000e+00 1.62894e+02 351.718 5.61418e+01 351.718 0.9739 
1 1 1 -10 97  8  o 19 2.24370e+00 7.62137e-01 3.62017e+01 25.001  2.26214e+00  1.05492e+00  0.00000e+00 0.00000e+00 2.75897e+01 25.001  8.61198e+00 205.001 0.7646 
1 1 1 -10 97  9  o 1  2.86980e+00 8.98236e-01 4.21898e+01 208.839 -3.39078e+00 -1.86708e+00 0.00000e+00 0.00000e+00 4.93284e+01 208.839 7.13865e+00 208.839 0.8584 
1 1 1 -10 98  1  o 10 3.76000e+00 9.33693e-01 7.53819e+01 98.655  -9.75635e-01 6.40965e+00  0.00000e+00 0.00000e+00 5.37280e+01 98.655  2.16539e+01 278.655 0.9193 
1 1 1 -10 98  2  o 19 3.71901e+00 9.78550e-01 5.64666e+01 134.967 -3.27087e+00 3.27465e+00  0.00000e+00 0.00000e+00 6.62733e+01 134.967 9.80671e+00 134.967 0.8840 
1 1 1 -10 98  3  o 17 4.35105e+00 9.97735e-01 6.10934e+01 318.671 4.50129e+00  -3.95853e+00 0.00000e+00 0.00000e+00 8.70184e+01 318.671 2.59250e+01 318.671 0.9123 
1 1 1 -10 98  4  o 17 4.38276e+00 1.04340e+00 7.90591e+01 149.339 -6.39245e+00 3.78962e+00  0.00000e+00 0.00000e+00 7.29469e+01 149.339 6.11219e+00 329.339 0.9301 
1 1 1 -10 98  5  o 5  5.03520e+00 1.04813e+00 1.04740e+02 355.876 1.10204e+01  -7.94594e-01 0.00000e+00 0.00000e+00 7.41963e+01 355.876 3.05438e+01 175.876 0.9536 
1 1 1 -10 98  6  f 0  6.21852e+00 1.02582e+00 5.50369e+01 68.205  3.14418e+00  7.86282e+00  0.00000e+00 0.00000e+00 1.62393e+02 68.205  1.07357e+02 68.205  0.9390 
1 1 1 -10 98  7  o 8  6.76037e+00 9.94356e-01 1.18955e+02 79.040  3.90379e+00  2.01590e+01  0.00000e+00 0.00000e+00 1.26384e+02 79.040  7.42879e+00 79.040  0.9753 
1 1 1 -10 98  8  o 6  3.84628e+00 1.01108e+00 2.13142e+01 307.687 1.30004e+00  -1.68285e+00 0.00000e+00 0.00000e+00 8.12807e+01 307.687 5.99665e+01 307.687 0.7175 
1 1 1 -10 98  9  o 18 5.58578e+00 1.18293e+00 8.48428e+01 93.353  -6.39679e-01 1.09174e+01  0.00000e+00 0.00000e+00 1.12899e+02 93.353  2.80563e+01 93.353  0.9531 
1 1 1 -10 99  1  o 15 4.99271e+00 9.84767e-01 9.05237e+01 199.287 -9.72023e+00 -3.40158e+00 0.00000e+00 0.00000e+00 8.66224e+01 199.287 3.90135e+00 19.287  0.9501 
1 1 1 -10 99  2  o 9  7.91676e+00 8.80160e-01 1.25356e+02 39.819  1.73255e+01  1.44448e+01  0.00000e+00 0.00000e+00 1.63509e+02 39.819  3.81534e+01 39.819  0.9776 
1 1 1 -10 99  3  o 3  1.00189e+01 7.49035e-01 1.49998e+02 178.714 -4.08279e+01 9.16482e-01  0.00000e+00 0.00000e+00 2.19142e+02 178.714 6.91446e+01 178.714 0.9877 
1 1 1 -10 99  4  o 2  4.85550e+00 1.05855e+00 1.13380e+02 29.038  1.03222e+01  5.73068e+00  0.00000e+00 0.00000e+00 5.97931e+01 29.038  5.35868e+01 209.038 0.9567 
1 1 1 -10 99  5  o 12 9.12689e+00 8.20480e-01 1.50367e+02 301.013 1.87324e+01  -3.11595e+01 0.00000e+00 0.00000e+00 1.84952e+02 301.013 3.45853e+01 301.013 0.9862 
1 1 1 -10 99  6  o 10 2.99243e+00 9.16050e-01 6.61965e+01 111.743 -1.87030e+00 4.68952e+00  0.00000e+00 0.00000e+00 3.34532e+01 111.743 3.27433e+01 291.743 0.8945 
1 1 1 -10 99  7  o 9  2.95383e+00 9.05022e-01 1.76779e+01 355.876 1.41001e+00  -1.01655e-01 0.00000e+00 0.00000e+00 4.53979e+01 355.876 2.77199e+01 355.876 0.5741 
1 1 1 -10 99  8  o 19 6.89038e+00 1.05017e+00 1.08438e+02 273.352 1.11967e+00  -1.91144e+01 0.00000e+00 0.00000e+00 1.40872e+02 273.352 3.24339e+01 273.352 0.9735 
1 1 1 -10 99  9  o 13 2.98392e+00 9.34329e-01 5.60004e+01 115.209 -2.37086e+00 5.03630e+00  0.00000e+00 0.00000e+00 4.42782e+01 115.209 1.17223e+01 295.209 0.9050 
1 1 1 -10 100 1  o 7  9.37288e+00 8.27164e-01 1.55196e+02 94.701  -3.04785e+00 3.70645e+01  0.00000e+00 0.00000e+00 1.89985e+02 94.701  3.47891e+01 94.701  0.9865 
1 1 1 -10 100 2  o 17 5.18215e+00 9.99578e-01 8.71609e+01 320.935 7.71994e+00  -6.26606e+00 0.00000e+00 0.00000e+00 9.62103e+01 320.935 9.04942e+00 320.935 0.9483 
1 1 1 -10 100 3  o 14 3.54943e+00 9.81215e-01 5.59535e+01 263.819 -4.89266e-01 -4.51747e+00 0.00000e+00 0.00000e+00 6.07461e+01 263.819 4.79259e+00 263.819 0.8816 
1 1 1 -10 100 4  f 0  2.56848e+00 8.35541e-01 1.22572e+01 132.424 -5.39071e-01 5.89868e-01  0.00000e+00 0.00000e+00 2.32308e+01 132.424 1.09737e+01 132.424 0.3707 
1 1 1 -10 100 5  o 6  3.02246e+00 9.15144e-01 2.40653e+01 328.482 1.65536e+00  -1.01510e+00 0.00000e+00 0.00000e+00 5.33830e+01 328.482 2.93177e+01 328.482 0.6880 
1 1 1 -10 100 6  o 15 5.82749e+00 1.03830e+00 8.71616e+01 99.324  -2.01479e+00 1.22713e+01  0.00000e+00 0.00000e+00 1.20814e+02 99.324  3.36523e+01 99.324  0.9589 
1 1 1 -10 100 7  o 5  3.36515e+00 9.94071e-01 5.28081e+01 312.293 3.12048e+00  -3.43022e+00 0.00000e+00 0.00000e+00 5.78479e+01 312.293 5.03981e+00 312.293 0.8842 
1 1 1 -10 100 8  o 10 2.72155e+00 8.68986e-01 4.29261e+01 197.472 -3.33337e+00 -1.04924e+00 0.00000e+00 0.00000e+00 4.20997e+01 197.472 8.26438e-01 17.472  0.8408 
1 1 1 -10 100 9  o 3  2.20048e+00 7.55088e-01 2.54310e+01 351.532 2.11561e+00  -3.14967e-01 0.00000e+00 0.00000e+00 3.33272e+01 351.532 7.89626e+00 351.532 0.7193 
1 1 1 -10 101 1  o 16 3.06227e+00 9.28948e-01 4.85709e+01 94.199  -2.51283e-01 3.42297e+00  0.00000e+00 0.00000e+00 4.71466e+01 94.199  1.42425e+00 274.199 0.8375 
1 1 1 -10 101 2  o 11 7.15494e+00 9.61028e-01 9.55693e+01 93.487  -9.34181e-01 1.53289e+01  0.00000e+00 0.00000e+00 1.62498e+02 93.487  6.69289e+01 93.487  0.9669 
1 1 1 -10 101 3  o 17 7.47191e+00 8.89073e-01 1.27143e+02 0.505   2.38052e+01  2.09719e-01  0.00000e+00 0.00000e+00 1.45521e+02 0.505   1.83785e+01 0.505   0.9788 
1 1 1 -10 101 4  o 1  6.51779e+00 9.82106e-01 1.12658e+02 207.111 -1.64254e+01 -8.40913e+00 0.00000e+00 0.00000e+00 1.23523e+02 207.111 1.08649e+01 207.111 0.9725 
1 1 1 -10 101 5  o 11 5.01248e+00 1.05965e+00 8.28467e+01 336.899 9.37735e+00  -4.00000e+00 0.00000e+00 0.00000e+00 9.43897e+01 336.899 1.15430e+01 336.899 0.9496 
1 1 1 -10 101 6  o 14 2.73967e+00 8.40671e-01 5.78064e+01 72.608  1.35750e+00  4.33400e+00  0.00000e+00 0.00000e+00 3.20551e+01 72.608  2.57512e+01 252.608 0.8815 
1 1 1 -10 101 7  o 18 3.10956e+00 9.40564e-01 6.83190e+01 305.370 3.51901e+00  -4.95718e+00 0.00000e+00 0.00000e+00 3.72964e+01 305.370 3.10226e+01 125.370 0.9136 
1 1 1 -10 101 8  o 15 3.16332e+00 9.48308e-01 5.89867e+01 153.237 -5.25783e+00 2.65162e+00  0.00000e+00 0.00000e+00 4.80120e+01 153.237 1.09747e+01 333.237 0.9106 
1 1 1 -10 102 1  o 15 7.16709e+00 9.40537e-01 1.32465e+02 316.822 1.66070e+01  -1.55827e+01 0.00000e+00 0.00000e+00 1.29017e+02 316.822 3.44757e+00 136.823 0.9778 
1 1 1 -10 102 2  o 16 3.31432e+00 9.36573e-01 6.31592e+01 6.576   5.60144e+00  6.45765e-01  0.00000e+00 0.00000e+00 4.88689e+01 6.576   1.42903e+01 186.576 0.9063 
1 1 1 -10 102 3  o 7  6.29270e+00 9.71037e-01 1.22811e+02 170.813 -1.93598e+01 3.13095e+00  0.00000e+00 0.00000e+00 1.05678e+02 170.813 1.71332e+01 350.813 0.9742 
1 1 1 -10 102 4  o 7  7.08728e+00 9.32462e-01 1.13274e+02 218.789 -1.60630e+01 -1.29099e+01 0.00000e+00 0.00000e+00 1.44241e+02 218.789 3.09675e+01 218.789 0.9754 
1 1 1 -10 102 5  o 17 7.62353e+00 9.63008e-01 1.12993e+02 42.392  1.76589e+01  1.61203e+01  0.00000e+00 0.00000e+00 1.64793e+02 42.392  5.17995e+01 42.392  0.9789 
1 1 1 -10 102 6  o 16 2.85081e+00 8.89530e-01 6.84094e+01 232.854 -3.43797e+00 -4.53823e+00 0.00000e+00 0.00000e+00 2.78047e+01 232.854 4.06046e+01 52.854  0.9073 
1 1 1 -10 102 7  o 8  2.14530e+00 7.33087e-01 1.18751e+01 332.829 7.71926e-01  -3.96214e-01 0.00000e+00 0.00000e+00 1.98234e+01 332.829 7.94832e+00 332.829 0.3975 
1 1 1 -10 102 8  o 7  2.17691e+00 7.48604e-01 1.73476e+01 65.405  6.28168e-01  1.37233e+00  0.00000e+00 0.00000e+00 3.10288e+01 65.405  1.36812e+01 65.405  0.5984 
1 1 1 -10 103 1  o 3  7.74615e+00 8.91384e-01 1.50515e+02 90.261  -1.44944e-01 3.17986e+01  0.00000e+00 0.00000e+00 1.33850e+02 90.261  1.66649e+01 270.261 0.9841 
1 1 1 -10 103 2  o 14 4.77112e+00 1.01096e+00 6.49827e+01 333.406 6.50674e+00  -3.25741e+00 0.00000e+00 0.00000e+00 1.00182e+02 333.406 3.51990e+01 333.406 0.9285 
1 1 1 -10 103 3  o 3  3.86166e+00 9.92481e-01 4.89320e+01 178.684 -4.59356e+00 1.05530e-01  0.00000e+00 0.00000e+00 7.81354e+01 178.684 2.92034e+01 178.684 0.8831 
1 1 1 -10 103 4  f 0  5.70191e+00 1.04345e+00 9.72505e+01 48.302  9.45600e+00  1.06139e+01  0.00000e+00 0.00000e+00 1.07476e+02 48.302  1.02256e+01 48.302  0.9642 
1 1 1 -10 103 5  o 16 3.25863e+00 9.06379e-01 4.60345e+01 221.781 -3.30659e+00 -2.95445e+00 0.00000e+00 0.00000e+00 6.04833e+01 221.781 1.44488e+01 221.781 0.8784 
1 1 1 -10 103 6  o 10 3.75869e+00 9.26463e-01 5.13997e+01 307.203 3.38759e+00  -4.46252e+00 0.00000e+00 0.00000e+00 7.51945e+01 307.203 2.37948e+01 307.203 0.9057 
1 1 1 -10 103 7  o 7  2.12915e+00 7.31979e-01 4.85461e+01 106.441 -1.14886e+00 3.89330e+00  0.00000e+00 0.00000e+00 1.99471e+01 106.441 2.85989e+01 286.440 0.8658 
1 1 1 -10 103 8  o 7  3.13121e+00 9.44378e-01 5.85106e+01 326.514 4.95336e+00  -3.27679e+00 0.00000e+00 0.00000e+00 4.74370e+01 326.514 1.10736e+01 146.514 0.9114 
1 1 1 -10 104 1  f 0  3.78329e+00 1.00315e+00 1.98158e+01 252.827 -5.73756e-01 -1.85663e+00 0.00000e+00 0.00000e+00 7.72826e+01 252.827 5.74668e+01 252.827 0.6882 
1 1 1 -10 104 2  f 0  5.39809e+00 1.04719e+00 8.60977e+01 197.397 -1.07717e+01 -3.37495e+00 0.00000e+00 0.00000e+00 1.05974e+02 197.397 1.98760e+01 197.397 0.9546 
1 1 1 -10 104 3  o 5  7.37470e+00 1.01661e+00 1.00245e+02 25.746  1.75247e+01  8.45135e+00  0.00000e+00 0.00000e+00 1.67322e+02 25.746  6.70769e+01 25.746  0.9740 
1 1 1 -10 104 4  o 17 4.10822e+00 1.03781e+00 1.02490e+02 148.649 -9.32423e+00 5.68053e+00  0.00000e+00 0.00000e+00 4.32735e+01 148.649 5.92162e+01 328.649 0.9530 
1 1 1 -10 104 5  o 8  2.80594e+00 8.74501e-01 3.83708e+01 263.950 -3.63294e-01 -3.42753e+00 0.00000e+00 0.00000e+00 4.91380e+01 263.950 1.07672e+01 263.950 0.8383 
1 1 1 -10 104 6  o 2  3.13589e+00 9.15777e-01 5.00218e+01 157.312 -4.13598e+00 1.72910e+00  0.00000e+00 0.00000e+00 5.25491e+01 157.312 2.52728e+00 157.312 0.8798 
1 1 1 -10 104 7  o 9  2.90978e+00 9.10320e-01 3.92602e+01 37.818  3.00888e+00  2.33544e+00  0.00000e+00 0.00000e+00 5.32366e+01 37.818  1.39764e+01 37.818  0.8557 
1 1 1 -10 105 1  o 10 4.44082e+00 1.00207e+00 8.83833e+01 64.567  4.49762e+00  9.45799e+00  0.00000e+00 0.00000e+00 6.90588e+01 64.567  1.93246e+01 244.567 0.9510 
1 1 1 -10 105 2  o 9  3.69886e+00 1.00309e+00 3.88067e+01 316.753 2.58642e+00  -2.43277e+00 0.00000e+00 0.00000e+00 7.74799e+01 316.753 3.86732e+01 316.753 0.8437 
1 1 1 -10 105 3  o 14 3.03987e+00 8.67268e-01 4.02155e+01 130.372 -2.43401e+00 2.86278e+00  0.00000e+00 0.00000e+00 5.64094e+01 130.372 1.61938e+01 130.372 0.8535 
1 1 1 -10 105 4  o 13 4.95870e+00 1.01376e+00 3.69065e+01 324.154 3.83280e+00  -2.76902e+00 0.00000e+00 0.00000e+00 1.26734e+02 324.154 8.98277e+01 324.154 0.8867 
1 1 1 -10 105 5  o 19 2.49267e+00 7.91405e-01 1.10042e+01 290.204 3.39198e-01  -9.21697e-01 0.00000e+00 0.00000e+00 2.97905e+01 290.204 1.87863e+01 290.204 0.4400 
1 1 1 -10 105 6  o 17 6.68579e+00 9.80796e-01 8.61488e+01 61.477  8.36843e+00  1.53982e+01  0.00000e+00 0.00000e+00 1.55137e+02 61.477  6.89877e+01 61.477  0.9710 
1 1 1 -10 105 7  o 19 2.52101e+00 8.19665e-01 4.75661e+01 261.493 -6.63016e-01 -4.43253e+00 0.00000e+00 0.00000e+00 3.48006e+01 261.493 1.27656e+01 81.493  0.8798 
1 1 1 -10 106 1  o 15 4.01065e+00 1.01886e+00 8.19386e+01 187.999 -8.29488e+00 -1.16563e+00 0.00000e+00 0.00000e+00 5.83085e+01 187.999 2.36301e+01 7.999   0.9383 
1 1 1 -10 106 2  o 7  2.70305e+00 8.35648e-01 9.79071e+01 132.734 -5.52411e+00 5.97922e+00  0.00000e+00 0.00000e+00 3.61941e+00 312.734 1.01527e+02 312.734 0.9364 
1 1 1 -10 106 3  o 15 3.13976e+00 9.52599e-01 2.61269e+01 317.811 1.79339e+00  -1.62551e+00 0.00000e+00 0.00000e+00 6.22526e+01 317.811 3.61256e+01 317.811 0.7561 
1 1 1 -10 106 4  o 13 3.82484e+00 1.02551e+00 1.07612e+02 39.382  8.88060e+00  7.29005e+00  0.00000e+00 0.00000e+00 2.83601e+01 39.382  7.92515e+01 219.382 0.9554 
1 1 1 -10 106 5  o 7  2.52374e+00 8.19839e-01 5.79517e+01 118.795 -2.51862e+00 4.58225e+00  0.00000e+00 0.00000e+00 2.63559e+01 118.795 3.15958e+01 298.795 0.8984 
1 1 1 -10 106 6  o 6  3.19635e+00 9.48698e-01 2.45767e+01 273.620 1.58228e-01  -2.50118e+00 0.00000e+00 0.00000e+00 6.63539e+01 273.620 4.17771e+01 273.620 0.7657 
1 1 1 -10 107 1  o 19 2.96049e+00 9.14192e-01 7.29268e+01 130.272 -4.28297e+00 5.05525e+00  0.00000e+00 0.00000e+00 2.86744e+01 130.272 4.42524e+01 310.272 0.9211 
1 1 1 -10 107 2  o 3  4.38281e+00 1.07838e+00 9.56712e+01 30.719  8.97806e+00  5.33477e+00  0.00000e+00 0.00000e+00 5.95238e+01 30.719  3.61474e+01 210.719 0.9508 
1 1 1 -10 107 3  o 5  2.56301e+00 8.26176e-01 3.03628e+01 3.740   2.68008e+00  1.75213e-01  0.00000e+00 0.00000e+00 4.44055e+01 3.740   1.40427e+01 3.740   0.7838 
1 1 1 -10 107 4  o 5  3.30703e+00 9.68975e-01 6.08844e+01 127.199 -3.49949e+00 4.61051e+00  0.00000e+00 0.00000e+00 5.09248e+01 127.199 9.95956e+00 307.199 0.9089 
1 1 1 -10 107 5  o 9  4.15245e+00 1.04041e+00 7.79170e+01 286.494 2.70680e+00  -9.14170e+00 0.00000e+00 0.00000e+00 6.81018e+01 286.494 9.81519e+00 106.494 0.9460 
1 1 1 -10 107 6  o 5  3.00100e+00 9.01652e-01 4.31138e+01 357.808 4.56601e+00  -1.74760e-01 0.00000e+00 0.00000e+00 5.52395e+01 357.808 1.21257e+01 357.808 0.8823 
1 1 1 -10 108 1  o 1  6.21007e+00 1.03933e+00 1.16022e+02 280.046 3.18575e+00  -1.79837e+01 0.00000e+00 0.00000e+00 1.08866e+02 280.046 7.15611e+00 100.046 0.9722 
1 1 1 -10 108 2  o 6  5.72043e+00 1.05730e+00 1.07503e+02 57.466  8.68757e+00  1.36192e+01  0.00000e+00 0.00000e+00 9.87651e+01 57.466  8.73748e+00 237.466 0.9685 
1 1 1 -10 108 3  o 5  2.95825e+00 9.06388e-01 5.03767e+01 353.830 4.81796e+00  -5.20810e-01 0.00000e+00 0.00000e+00 4.75535e+01 353.830 2.82327e+00 173.830 0.8897 
1 1 1 -10 108 4  o 8  3.57869e+00 9.89890e-01 5.17885e+01 288.813 1.86660e+00  -5.47897e+00 0.00000e+00 0.00000e+00 6.91696e+01 288.813 1.73812e+01 288.813 0.9089 
1 1 1 -10 108 5  o 17 5.33253e+00 1.14051e+00 9.12333e+01 19.392  1.19436e+01  4.20423e+00  0.00000e+00 0.00000e+00 9.89332e+01 19.392  7.69987e+00 19.392  0.9597 
1 1 1 -10 109 1  o 6  2.77557e+00 8.29995e-01 4.79941e+01 88.264  1.45352e-01  4.79508e+00  0.00000e+00 0.00000e+00 4.38312e+01 88.264  4.16286e+00 268.264 0.8885 
1 1 1 -10 109 2  o 18 4.67702e+00 1.05386e+00 8.35511e+01 254.979 -2.84133e+00 -1.05883e+01 0.00000e+00 0.00000e+00 8.23801e+01 254.979 1.17096e+00 74.979  0.9532 
1 1 1 -10 109 3  o 9  3.94003e+00 1.04352e+00 6.55100e+01 112.081 -2.84821e+00 7.02105e+00  0.00000e+00 0.00000e+00 7.10044e+01 112.081 5.49441e+00 112.081 0.9315 
1 1 1 -10 109 4  o 12 2.61162e+00 8.34625e-01 6.54719e+01 23.698  5.75946e+00  2.52794e+00  0.00000e+00 0.00000e+00 2.35211e+01 23.698  4.19508e+01 203.698 0.9166 
1 1 1 -10 109 5  o 19 3.47355e+00 1.02567e+00 6.59398e+01 199.335 -6.63541e+00 -2.32819e+00 0.00000e+00 0.00000e+00 5.35374e+01 199.335 1.24023e+01 19.335  0.9259 
1 1 1 -10 110 1  o 17 2.68632e+00 8.00403e-01 3.45392e+01 162.267 -3.33400e+00 1.06612e+00  0.00000e+00 0.00000e+00 4.95726e+01 162.267 1.50334e+01 162.267 0.8411 
1 1 1 -10 110 2  o 4  2.20775e+00 7.42427e-01 3.56620e+01 260.386 -5.10140e-01 -3.01153e+00 0.00000e+00 0.00000e+00 3.11976e+01 260.386 4.46443e+00 80.386  0.8139 
1 1 1 -10 110 3  o 13 3.90814e+00 9.99067e-01 2.81390e+01 103.930 -8.06843e-01 3.25311e+00  0.00000e+00 0.00000e+00 9.29156e+01 103.930 6.47766e+01 103.930 0.8330 
1 1 1 -10 110 4  o 12 5.03685e+00 1.05980e+00 6.44229e+01 316.555 6.95214e+00  -6.58477e+00 0.00000e+00 0.00000e+00 1.12703e+02 316.555 4.82796e+01 316.555 0.9462 
1 1 1 -10 110 5  o 11 3.01815e+00 9.55643e-01 4.21417e+01 252.103 -1.31394e+00 -4.06884e+00 0.00000e+00 0.00000e+00 5.57509e+01 252.103 1.36092e+01 252.103 0.8733 
1 1 1 -10 111 1  o 9  5.34084e+00 1.01759e+00 6.58250e+01 308.151 6.69233e+00  -8.51932e+00 0.00000e+00 0.00000e+00 1.23523e+02 308.151 5.76978e+01 308.151 0.9527 
1 1 1 -10 111 2  o 5  2.72059e+00 8.67762e-01 7.49785e+01 156.258 -6.86031e+00 3.01740e+00  0.00000e+00 0.00000e+00 1.92008e+01 156.258 5.57778e+01 336.258 0.9307 
1 1 1 -10 111 3  o 2  3.13451e+00 9.11775e-01 3.28150e+01 48.470  2.41455e+00  2.72632e+00  0.00000e+00 0.00000e+00 6.60204e+01 48.470  3.32054e+01 48.470  0.8482 
1 1 1 -10 111 4  o 18 2.51450e+00 8.19204e-01 3.93348e+01 3.007   3.91285e+00  2.05516e-01  0.00000e+00 0.00000e+00 4.10342e+01 3.007   1.69948e+00 3.007   0.8603 
1 1 1 -10 112 1  f 0  2.56577e+00 8.25031e-01 6.89265e+01 142.424 -5.50314e+00 4.23439e+00  0.00000e+00 0.00000e+00 1.93586e+01 142.424 4.95679e+01 322.424 0.9249 
1 1 1 -10 112 2  o 2  4.87547e+00 1.09440e+00 8.32801e+01 37.048  8.89480e+00  6.71445e+00  0.00000e+00 0.00000e+00 8.96765e+01 37.048  6.39642e+00 37.048  0.9540 
1 1 1 -10 112 3  o 5  5.51886e+00 1.12719e+00 1.14972e+02 205.257 -1.57664e+01 -7.43823e+00 0.00000e+00 0.00000e+00 8.41576e+01 205.257 3.08147e+01 25.257  0.9709 
1 1 1 -10 112 4  o 14 2.67107e+00 8.47602e-01 2.82253e+01 328.103 2.47477e+00  -1.54024e+00 0.00000e+00 0.00000e+00 5.14861e+01 328.103 2.32607e+01 328.103 0.8035 
1 1 1 -10 113 1  o 3  4.37295e+00 8.76970e-01 4.64891e+01 302.217 4.26505e+00  -6.76842e+00 0.00000e+00 0.00000e+00 1.05614e+02 302.217 5.91252e+01 302.217 0.9352 
1 1 1 -10 113 2  o 19 2.06249e+00 7.02142e-01 2.04457e+01 162.231 -1.85514e+00 5.94519e-01  0.00000e+00 0.00000e+00 3.23838e+01 162.231 1.19381e+01 162.231 0.6891 
1 1 1 -10 113 3  o 8  2.99108e+00 8.84338e-01 3.08057e+01 126.957 -2.22584e+00 2.95840e+00  0.00000e+00 0.00000e+00 6.37632e+01 126.957 3.29575e+01 126.957 0.8510 
1 1 1 -10 114 1  o 19 4.30717e+00 1.09168e+00 6.32175e+01 49.799  5.23673e+00  6.19662e+00  0.00000e+00 0.00000e+00 8.67014e+01 49.799  2.34839e+01 49.799  0.9362 
1 1 1 -10 114 2  o 14 4.53744e+00 1.08687e+00 8.47377e+01 185.594 -1.14641e+01 -1.12282e+00 0.00000e+00 0.00000e+00 7.63863e+01 185.594 8.35143e+00 5.594   0.9556 
1 1 1 -10 114 3  o 10 2.42223e+00 8.04953e-01 1.47125e+01 19.896  1.35385e+00  4.89988e-01  0.00000e+00 0.00000e+00 3.75467e+01 19.896  2.28341e+01 19.896  0.5809 
1 1 1 -9  0   1  o 3  3.72581e+00 1.60117e+00 1.05516e+02 0.000   2.61854e-01  0.00000e+00  0.00000e+00 0.00000e+00 6.94635e+01 180.000 1.74980e+02 180.000 0.2560 
1 1 1 -9  0   2  o 2  2.96788e+01 9.89348e-01 4.29492e+02 180.000 -1.01497e+01 -0.00000e+00 0.00000e+00 0.00000e+00 6.91693e+02 180.000 2.62201e+02 180.000 1.0000 
1 1 1 -9  0   3  o 10 3.83890e+01 1.17110e+00 5.28794e+02 0.000   1.55834e+01  0.00000e+00  0.00000e+00 0.00000e+00 9.20694e+02 0.000   3.91900e+02 0.000   1.0000 
1 1 1 -9  0   4  o 13 2.30866e+01 9.15070e-01 2.42129e+02 180.000 -4.90302e+00 -0.00000e+00 0.00000e+00 0.00000e+00 6.28975e+02 180.000 3.86846e+02 180.000 0.9999 
1 1 1 -9  0   5  o 9  1.51698e+01 9.49082e-01 1.16262e+02 180.000 -1.84396e+00 -0.00000e+00 0.00000e+00 0.00000e+00 4.27892e+02 180.000 3.11630e+02 180.000 0.9512 
1 1 1 -9  0   6  o 19 4.62216e+01 1.36890e+00 6.69888e+02 180.000 -3.69545e+01 -0.00000e+00 0.00000e+00 0.00000e+00 1.07201e+03 180.000 4.02120e+02 180.000 1.0000 
1 1 1 -9  0   7  o 16 2.14244e+01 9.53260e-01 1.73505e+02 180.000 -5.07310e+00 -0.00000e+00 0.00000e+00 0.00000e+00 6.33212e+02 180.000 4.59707e+02 180.000 0.9999 
1 1 1 -9  0   8  o 14 3.71221e+01 1.19880e+00 5.61211e+02 0.000   3.16441e+01  0.00000e+00  0.00000e+00 0.00000e+00 8.35553e+02 0.000   2.74342e+02 0.000   1.0000 
1 1 1 -9  0   9  o 6  2.36843e+01 1.03702e+00 4.72653e+02 0.000   2.36595e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.17712e+02 0.000   5.49401e+01 180.000 1.0000 
1 1 1 -9  0   10 o 10 1.98538e+01 1.02086e+00 4.45323e+02 180.000 -2.36086e+01 -0.00000e+00 0.00000e+00 0.00000e+00 3.00338e+02 180.000 1.44985e+02 0.000   1.0000 
1 1 1 -9  0   11 o 6  1.01754e+01 1.07196e+00 2.09272e+02 180.000 -7.30540e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.72506e+02 180.000 3.67664e+01 0.000   1.0000 
1 1 1 -9  0   12 f 0  1.77400e+00 1.19505e+00 1.36680e+02 180.000 -9.94823e-01 0.00000e+00  0.00000e+00 0.00000e+00 8.61866e+01 0.000   2.22866e+02 0.000   0.7594 
1 1 1 -9  0   13 o 6  4.26356e+00 1.66018e+00 1.12292e+02 180.000 -2.18545e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.33417e+01 180.000 6.89498e+01 0.000   0.9750 
1 1 1 -9  0   14 o 10 2.10930e+00 1.32413e+00 8.00725e+00 0.000   1.02010e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.08800e-02 0.000   7.99637e+00 180.000 0.1017 
1 1 1 -9  0   15 o 5  2.34733e+00 1.38681e+00 4.00379e+00 180.000 -6.60059e-02 0.00000e+00  0.00000e+00 0.00000e+00 1.77421e+00 180.000 2.22958e+00 0.000   0.0659 
1 1 1 -9  0   16 o 14 1.90634e+00 1.26295e+00 3.16909e+00 0.000   4.88403e-02  0.00000e+00  0.00000e+00 0.00000e+00 3.00787e-01 0.000   2.86831e+00 180.000 0.0488 
1 1 1 -9  0   17 o 16 3.17097e+00 1.78957e+00 6.40202e+01 0.000   1.33495e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.87871e+01 0.000   2.52331e+01 180.000 0.8705 
1 1 1 -9  0   18 o 13 2.73255e+00 1.84398e+00 5.56132e+01 180.000 -1.16822e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.81016e+01 180.000 2.75117e+01 0.000   0.8237 
1 1 1 -9  0   19 o 11 2.86966e+00 1.94015e+00 6.48599e+01 180.000 -1.53185e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.22004e+01 180.000 3.26595e+01 0.000   0.9107 
1 1 1 -9  1   1  o 14 1.66999e+01 5.77599e-01 1.34110e+02 21.945  2.83473e+00  1.14213e+00  0.00000e+00 0.00000e+00 3.79690e+02 21.945  2.45581e+02 21.945  0.8141 
1 1 1 -9  1   2  o 16 4.92146e+01 1.00979e+00 8.26551e+02 62.095  2.98389e+01  5.63434e+01  0.00000e+00 0.00000e+00 1.01801e+03 62.095  1.91456e+02 62.095  0.9921 
1 1 1 -9  1   3  o 10 2.21748e+01 6.17195e-01 4.27678e+02 218.034 -1.15696e+01 -9.05037e+00 0.00000e+00 0.00000e+00 3.80572e+02 218.034 4.71054e+01 38.034  0.9653 
1 1 1 -9  1   4  o 12 2.70222e+01 6.82958e-01 5.10583e+02 82.276  3.24745e+00  2.39439e+01  0.00000e+00 0.00000e+00 4.87801e+02 82.276  2.27817e+01 262.276 0.9791 
1 1 1 -9  1   5  o 1  4.50092e+01 9.47370e-01 7.85193e+02 238.316 -3.81393e+01 -6.17918e+01 0.00000e+00 0.00000e+00 9.00465e+02 238.316 1.15272e+02 238.316 0.9931 
1 1 1 -9  1   6  o 8  2.27012e+01 7.61896e-01 2.10172e+02 70.311  3.89923e+00  1.08969e+01  0.00000e+00 0.00000e+00 6.07498e+02 70.311  3.97327e+02 70.311  0.9558 
1 1 1 -9  1   7  o 9  3.83802e+00 1.10177e+00 1.48663e+02 336.281 1.37221e+00  -6.02886e-01 0.00000e+00 0.00000e+00 6.25477e+01 156.281 2.11211e+02 156.281 0.5958 
1 1 1 -9  1   8  o 10 7.77765e+00 1.12880e+00 1.85565e+02 122.300 -2.27060e+00 3.59170e+00  0.00000e+00 0.00000e+00 6.97554e+01 122.300 1.15810e+02 302.300 0.8725 
1 1 1 -9  1   9  o 7  1.14180e+01 8.86247e-01 1.43825e+02 26.381  6.09823e+00  3.02472e+00  0.00000e+00 0.00000e+00 2.52494e+02 26.381  1.08669e+02 26.381  0.9233 
1 1 1 -9  1   10 o 16 6.90437e+00 1.17696e+00 1.59809e+02 283.947 1.30692e+00  -5.26255e+00 0.00000e+00 0.00000e+00 7.41765e+01 283.947 8.56329e+01 103.947 0.9023 
1 1 1 -9  1   11 o 19 7.81575e+00 9.17993e-01 8.32533e+01 157.816 -3.99603e+00 1.62948e+00  0.00000e+00 0.00000e+00 1.73232e+02 157.816 8.99792e+01 157.816 0.8746 
1 1 1 -9  1   12 o 12 1.19945e+01 6.47000e-01 1.70758e+02 269.886 -3.69230e-02 -1.85647e+01 0.00000e+00 0.00000e+00 2.66513e+02 269.886 9.57547e+01 269.886 0.9727 
1 1 1 -9  1   13 o 13 8.30371e+00 7.28592e-01 1.52416e+02 51.255  8.45549e+00  1.05374e+01  0.00000e+00 0.00000e+00 1.46720e+02 51.255  5.69542e+00 231.255 0.9622 
1 1 1 -9  1   14 o 15 2.01229e+01 6.14525e-01 3.28059e+02 356.858 8.97346e+01  -4.92633e+00 0.00000e+00 0.00000e+00 4.20201e+02 356.858 9.21427e+01 356.858 0.9944 
1 1 1 -9  1   15 o 1  5.64286e+00 9.00006e-01 1.27786e+02 76.175  2.52057e+00  1.02423e+01  0.00000e+00 0.00000e+00 7.27027e+01 76.175  5.50828e+01 256.174 0.9513 
1 1 1 -9  1   16 o 7  9.36107e+00 7.48877e-01 1.31382e+02 207.756 -1.89496e+01 -9.97226e+00 0.00000e+00 0.00000e+00 2.09512e+02 207.756 7.81296e+01 207.756 0.9764 
1 1 1 -9  1   17 o 8  7.66572e+00 9.83949e-01 7.44095e+01 242.604 -4.08532e+00 -7.88266e+00 0.00000e+00 0.00000e+00 1.94517e+02 242.604 1.20107e+02 242.604 0.9419 
1 1 1 -9  1   18 o 16 5.35268e+00 1.39846e+00 2.61211e+01 55.147  1.14480e+00  1.64390e+00  0.00000e+00 0.00000e+00 1.12901e+02 55.147  8.67795e+01 55.147  0.6983 
1 1 1 -9  1   19 o 13 3.47653e+00 1.16575e+00 6.02602e+01 47.906  2.75152e+00  3.04581e+00  0.00000e+00 0.00000e+00 5.17337e+01 47.906  8.52651e+00 227.906 0.8674 
1 1 1 -9  2   1  o 7  2.32408e+01 6.24250e-01 3.69733e+02 343.004 1.11946e+01  -3.42170e+00 0.00000e+00 0.00000e+00 4.70236e+02 343.004 1.00502e+02 343.004 0.9563 
1 1 1 -9  2   2  o 1  1.84289e+01 6.99915e-01 2.97894e+02 349.809 8.60091e+00  -1.54607e+00 0.00000e+00 0.00000e+00 3.57161e+02 349.809 5.92674e+01 349.809 0.9409 
1 1 1 -9  2   3  o 6  1.40399e+01 5.98878e-01 2.55648e+02 331.578 4.89111e+00  -2.64705e+00 0.00000e+00 0.00000e+00 2.24082e+02 331.578 3.15657e+01 151.578 0.9050 
1 1 1 -9  2   4  o 10 1.94742e+01 6.25383e-01 3.96289e+02 3.479   1.35211e+01  8.21915e-01  0.00000e+00 0.00000e+00 3.10921e+02 3.479   8.53681e+01 183.479 0.9624 
1 1 1 -9  2   5  o 16 2.68521e+01 6.90158e-01 6.19326e+02 212.951 -2.91429e+01 -1.88902e+01 0.00000e+00 0.00000e+00 3.78632e+02 212.951 2.40694e+02 32.951  0.9855 
1 1 1 -9  2   6  o 19 3.30954e+01 7.79574e-01 6.31731e+02 227.832 -3.39968e+01 -3.75359e+01 0.00000e+00 0.00000e+00 6.03109e+02 227.832 2.86218e+01 47.832  0.9901 
1 1 1 -9  2   7  o 14 2.12713e+01 6.77069e-01 3.91008e+02 178.116 -2.26811e+01 7.46181e-01  0.00000e+00 0.00000e+00 3.92152e+02 178.116 1.14442e+00 178.116 0.9777 
1 1 1 -9  2   8  o 7  2.01757e+01 7.04445e-01 3.03953e+02 320.205 1.44950e+01  -1.20746e+01 0.00000e+00 0.00000e+00 4.34777e+02 320.205 1.30825e+02 320.205 0.9731 
1 1 1 -9  2   9  o 4  2.28097e+01 7.27533e-01 2.31904e+02 131.414 -1.47973e+01 1.67761e+01  0.00000e+00 0.00000e+00 6.06186e+02 131.414 3.74282e+02 131.414 0.9774 
1 1 1 -9  2   10 o 3  1.64591e+01 7.17677e-01 2.80325e+02 304.234 1.38677e+01  -2.03798e+01 0.00000e+00 0.00000e+00 3.25164e+02 304.234 4.48391e+01 304.234 0.9795 
1 1 1 -9  2   11 f 0  1.40522e+01 6.89088e-01 2.22290e+02 130.504 -1.40995e+01 1.65058e+01  0.00000e+00 0.00000e+00 2.92654e+02 130.504 7.03647e+01 130.504 0.9767 
1 1 1 -9  2   12 f 0  1.61768e+01 6.06567e-01 3.23005e+02 166.436 -4.64343e+01 1.12030e+01  0.00000e+00 0.00000e+00 2.76914e+02 166.436 4.60911e+01 346.436 0.9895 
1 1 1 -9  2   13 o 13 7.46581e+00 7.46108e-01 1.81640e+02 326.024 1.19421e+01  -8.04777e+00 0.00000e+00 0.00000e+00 8.79747e+01 326.024 9.36657e+01 146.024 0.9646 
1 1 1 -9  2   14 o 19 9.65260e+00 6.46837e-01 1.84995e+02 235.008 -1.37963e+01 -1.97091e+01 0.00000e+00 0.00000e+00 1.68363e+02 235.008 1.66324e+01 55.008  0.9790 
1 1 1 -9  2   15 o 13 5.57891e+00 8.86546e-01 1.29951e+02 106.625 -2.98592e+00 1.00002e+01  0.00000e+00 0.00000e+00 6.81525e+01 106.625 6.17987e+01 286.625 0.9508 
1 1 1 -9  2   16 o 6  1.02654e+01 7.01632e-01 1.80725e+02 336.434 3.02791e+01  -1.32071e+01 0.00000e+00 0.00000e+00 1.96309e+02 336.434 1.55835e+01 336.434 0.9847 
1 1 1 -9  2   17 o 19 1.53749e+01 7.28635e-01 2.74679e+02 188.969 -7.43475e+01 -1.17348e+01 0.00000e+00 0.00000e+00 2.94162e+02 188.969 1.94838e+01 188.969 0.9933 
1 1 1 -9  2   18 o 14 5.22273e+00 1.40131e+00 4.05765e+01 305.691 1.76757e+00  -2.46069e+00 0.00000e+00 0.00000e+00 1.17185e+02 305.691 7.66088e+01 305.691 0.8122 
1 1 1 -9  2   19 f 0  6.26723e+00 1.55563e+00 1.61473e+02 79.310  2.65350e+00  1.40568e+01  0.00000e+00 0.00000e+00 6.29877e+01 79.310  9.84857e+01 259.310 0.9644 
1 1 1 -9  3   1  o 10 2.77295e+01 6.69179e-01 4.37730e+02 179.565 -1.65032e+01 1.25405e-01  0.00000e+00 0.00000e+00 5.78018e+02 179.565 1.40288e+02 179.565 0.9692 
1 1 1 -9  3   2  o 6  1.98845e+01 5.95057e-01 3.99663e+02 39.953  9.73180e+00  8.15243e+00  0.00000e+00 0.00000e+00 3.21291e+02 39.953  7.83721e+01 219.953 0.9598 
1 1 1 -9  3   3  o 2  3.67013e+01 8.03411e-01 7.48317e+02 104.262 -1.03921e+01 4.08828e+01  0.00000e+00 0.00000e+00 6.20906e+02 104.262 1.27411e+02 284.262 0.9881 
1 1 1 -9  3   4  o 11 1.65964e+01 6.16901e-01 5.19677e+02 337.524 1.39880e+01  -5.78711e+00 0.00000e+00 0.00000e+00 8.55470e+01 337.524 4.34130e+02 157.524 0.9664 
1 1 1 -9  3   5  o 9  3.59035e+01 8.03153e-01 8.59661e+02 76.824  1.45910e+01  6.23245e+01  0.00000e+00 0.00000e+00 4.83698e+02 76.824  3.75963e+02 256.824 0.9922 
1 1 1 -9  3   6  o 15 2.23873e+01 6.73114e-01 3.15723e+02 99.172  -2.74772e+00 1.70170e+01  0.00000e+00 0.00000e+00 5.03100e+02 99.172  1.87377e+02 99.172  0.9705 
1 1 1 -9  3   7  o 9  1.65160e+01 6.83667e-01 2.66834e+02 250.850 -3.94191e+00 -1.13515e+01 0.00000e+00 0.00000e+00 3.28635e+02 250.850 6.18012e+01 250.850 0.9574 
1 1 1 -9  3   8  o 18 2.42324e+01 7.06978e-01 4.81285e+02 266.653 -2.09353e+00 -3.58002e+01 0.00000e+00 0.00000e+00 4.17674e+02 266.653 6.36105e+01 86.653  0.9860 
1 1 1 -9  3   9  o 16 1.16579e+01 1.01009e+00 3.15236e+02 31.842  1.27031e+01  7.88928e+00  0.00000e+00 0.00000e+00 1.08096e+02 31.842  2.07140e+02 211.842 0.9660 
1 1 1 -9  3   10 o 6  1.07810e+01 8.33555e-01 1.64478e+02 325.600 7.67674e+00  -5.25627e+00 0.00000e+00 0.00000e+00 2.18003e+02 325.600 5.35251e+01 325.600 0.9446 
1 1 1 -9  3   11 o 9  1.75225e+01 6.54557e-01 2.76966e+02 45.197  2.39064e+01  2.40714e+01  0.00000e+00 0.00000e+00 3.70703e+02 45.197  9.37372e+01 45.197  0.9851 
1 1 1 -9  3   12 o 3  1.14633e+01 6.46488e-01 2.43318e+02 230.541 -1.60633e+01 -1.95152e+01 0.00000e+00 0.00000e+00 1.77733e+02 230.541 6.55850e+01 50.541  0.9800 
1 1 1 -9  3   13 o 10 9.69420e+00 6.82614e-01 1.96398e+02 73.164  5.76318e+00  1.90449e+01  0.00000e+00 0.00000e+00 1.57286e+02 73.164  3.91114e+01 253.164 0.9745 
1 1 1 -9  3   14 o 11 1.21637e+01 6.09336e-01 2.10952e+02 286.654 1.00253e+01  -3.35136e+01 0.00000e+00 0.00000e+00 2.37335e+02 286.654 2.63831e+01 286.654 0.9856 
1 1 1 -9  3   15 o 19 4.71244e+00 9.70970e-01 1.03033e+02 311.245 4.42127e+00  -5.04230e+00 0.00000e+00 0.00000e+00 5.92484e+01 311.245 4.37842e+01 131.245 0.9221 
1 1 1 -9  3   16 f 0  6.66203e+00 9.09641e-01 9.23088e+01 26.763  8.79698e+00  4.43662e+00  0.00000e+00 0.00000e+00 1.43198e+02 26.763  5.08891e+01 26.763  0.9478 
1 1 1 -9  3   17 o 18 8.90715e+00 9.05548e-01 1.43207e+02 54.611  1.20113e+01  1.69086e+01  0.00000e+00 0.00000e+00 1.80451e+02 54.611  3.72445e+01 54.611  0.9756 
1 1 1 -9  3   18 o 11 4.32538e+00 1.29913e+00 7.44756e+01 70.445  1.66337e+00  4.68297e+00  0.00000e+00 0.00000e+00 6.91316e+01 70.445  5.34397e+00 250.445 0.8927 
1 1 1 -9  3   19 f 0  3.60749e+00 1.18636e+00 7.28132e+00 210.840 -4.34152e-01 -2.59220e-01 0.00000e+00 0.00000e+00 2.55520e+01 210.840 1.82707e+01 210.840 0.2451 
1 1 1 -9  4   1  o 3  2.27633e+01 7.14073e-01 3.39433e+02 24.855  9.51166e+00  4.40615e+00  0.00000e+00 0.00000e+00 4.78751e+02 24.855  1.39319e+02 24.855  0.9510 
1 1 1 -9  4   2  o 5  1.26246e+01 6.14589e-01 1.79258e+02 229.462 -2.34629e+00 -2.74342e+00 0.00000e+00 0.00000e+00 2.24519e+02 229.462 4.52618e+01 229.462 0.8466 
1 1 1 -9  4   3  o 17 1.64907e+01 5.94850e-01 2.78435e+02 15.401  6.85296e+00  1.88776e+00  0.00000e+00 0.00000e+00 2.98581e+02 15.401  2.01459e+01 15.401  0.9267 
1 1 1 -9  4   4  o 2  4.21688e+01 8.98779e-01 5.32777e+02 273.885 2.63303e+00  -3.87712e+01 0.00000e+00 0.00000e+00 1.03787e+03 273.885 5.05089e+02 273.885 0.9870 
1 1 1 -9  4   5  o 6  4.07095e+01 8.78458e-01 8.12863e+02 103.071 -1.54366e+01 6.64890e+01  0.00000e+00 0.00000e+00 7.11057e+02 103.071 1.01806e+02 283.071 0.9926 
1 1 1 -9  4   6  o 16 2.62520e+01 7.00398e-01 4.60754e+02 302.380 1.57632e+01  -2.48582e+01 0.00000e+00 0.00000e+00 5.11596e+02 302.380 5.08420e+01 302.380 0.9829 
1 1 1 -9  4   7  o 19 1.37021e+01 7.18367e-01 1.89589e+02 314.833 4.98016e+00  -5.00918e+00 0.00000e+00 0.00000e+00 2.88322e+02 314.833 9.87329e+01 314.833 0.9262 
1 1 1 -9  4   8  f 0  1.09650e+01 8.72188e-01 2.08102e+02 126.434 -4.24210e+00 5.74668e+00  0.00000e+00 0.00000e+00 1.74381e+02 126.434 3.37207e+01 306.434 0.9271 
1 1 1 -9  4   9  o 4  1.99912e+01 7.14862e-01 2.76325e+02 59.156  1.19870e+01  2.00730e+01  0.00000e+00 0.00000e+00 4.58938e+02 59.156  1.82613e+02 59.156  0.9784 
1 1 1 -9  4   10 o 9  9.92102e+00 8.93362e-01 1.25088e+02 297.099 2.93522e+00  -5.73614e+00 0.00000e+00 0.00000e+00 2.17237e+02 297.099 9.21494e+01 297.099 0.9187 
1 1 1 -9  4   11 o 18 1.75935e+01 6.62014e-01 1.83977e+02 120.438 -1.20988e+01 2.05909e+01  0.00000e+00 0.00000e+00 4.62145e+02 120.438 2.78169e+02 120.438 0.9788 
1 1 1 -9  4   12 o 10 4.23735e+00 9.62584e-01 5.78201e+01 262.765 -2.57307e-01 -2.02686e+00 0.00000e+00 0.00000e+00 5.40996e+01 262.765 3.72049e+00 82.765  0.7047 
1 1 1 -9  4   13 o 9  8.83540e+00 6.89527e-01 2.13821e+02 357.638 1.96865e+01  -8.12166e-01 0.00000e+00 0.00000e+00 1.08443e+02 357.638 1.05377e+02 177.638 0.9743 
1 1 1 -9  4   14 o 4  4.25312e+00 9.13238e-01 1.01536e+02 176.106 -5.25309e+00 3.57571e-01  0.00000e+00 0.00000e+00 4.14666e+01 176.106 6.00694e+01 356.106 0.8992 
1 1 1 -9  4   15 f 0  5.85639e+00 8.80589e-01 7.38701e+01 137.886 -4.63184e+00 4.18718e+00  0.00000e+00 0.00000e+00 1.26467e+02 137.886 5.25973e+01 137.886 0.9160 
1 1 1 -9  4   16 o 13 1.22502e+01 6.58472e-01 1.48317e+02 168.690 -3.23454e+01 6.46912e+00  0.00000e+00 0.00000e+00 3.01598e+02 168.690 1.53281e+02 168.690 0.9847 
1 1 1 -9  4   17 o 6  1.02298e+01 7.94125e-01 1.45355e+02 59.542  1.29990e+01  2.21046e+01  0.00000e+00 0.00000e+00 2.28158e+02 59.542  8.28024e+01 59.542  0.9803 
1 1 1 -9  4   18 o 8  3.71077e+00 1.14245e+00 6.97076e+01 15.247  4.32412e+00  1.17862e+00  0.00000e+00 0.00000e+00 5.17156e+01 15.247  1.79920e+01 195.247 0.8798 
1 1 1 -9  4   19 o 15 3.73100e+00 1.23272e+00 8.54926e+01 273.715 3.82512e-01  -5.89042e+00 0.00000e+00 0.00000e+00 4.07092e+01 273.715 4.47834e+01 93.715  0.9108 
1 1 1 -9  5   1  o 2  3.44371e+01 7.63608e-01 6.65374e+02 88.316  9.11001e-01  3.09919e+01  0.00000e+00 0.00000e+00 6.14953e+02 88.316  5.04216e+01 268.316 0.9837 
1 1 1 -9  5   2  o 19 1.39220e+01 5.88626e-01 2.74753e+02 0.401   6.10136e+00  4.26970e-02  0.00000e+00 0.00000e+00 2.05888e+02 0.401   6.88653e+01 180.401 0.9139 
1 1 1 -9  5   3  o 11 2.50296e+01 6.43316e-01 4.91165e+02 31.978  1.61030e+01  1.00537e+01  0.00000e+00 0.00000e+00 4.28630e+02 31.978  6.25353e+01 211.978 0.9733 
1 1 1 -9  5   4  o 12 1.47648e+01 6.35950e-01 2.29712e+02 355.728 5.80457e+00  -4.33616e-01 0.00000e+00 0.00000e+00 2.77004e+02 355.728 4.72915e+01 355.728 0.9095 
1 1 1 -9  5   5  o 17 3.43117e+01 7.80739e-01 5.89199e+02 111.145 -1.51287e+01 3.91165e+01  0.00000e+00 0.00000e+00 6.89200e+02 111.145 1.00001e+02 111.145 0.9880 
1 1 1 -9  5   6  o 9  2.70336e+01 7.04427e-01 2.54497e+02 255.590 -4.16321e+00 -1.62025e+01 0.00000e+00 0.00000e+00 7.33315e+02 255.590 4.78818e+02 255.590 0.9696 
1 1 1 -9  5   7  o 5  1.53148e+01 6.76569e-01 3.92621e+02 336.131 1.53739e+01  -6.80291e+00 0.00000e+00 0.00000e+00 1.66647e+02 336.131 2.25974e+02 156.131 0.9698 
1 1 1 -9  5   8  o 1  2.67153e+01 7.32075e-01 4.19236e+02 146.954 -2.97660e+01 1.93641e+01  0.00000e+00 0.00000e+00 5.71669e+02 146.954 1.52433e+02 146.954 0.9858 
1 1 1 -9  5   9  o 1  2.15601e+01 7.11013e-01 4.35689e+02 297.528 1.83571e+01  -3.52222e+01 0.00000e+00 0.00000e+00 3.64523e+02 297.528 7.11659e+01 117.528 0.9873 
1 1 1 -9  5   10 f 0  2.43335e+01 7.24100e-01 4.75440e+02 7.124   6.12133e+01  7.65081e+00  0.00000e+00 0.00000e+00 4.30997e+02 7.124   4.44435e+01 187.124 0.9919 
1 1 1 -9  5   11 o 2  1.19929e+01 7.21251e-01 2.72221e+02 121.461 -1.24263e+01 2.03086e+01  0.00000e+00 0.00000e+00 1.68182e+02 121.461 1.04038e+02 301.461 0.9788 
1 1 1 -9  5   12 o 10 9.59384e+00 6.99145e-01 1.02066e+02 282.310 1.86807e+00  -8.56050e+00 0.00000e+00 0.00000e+00 2.36311e+02 282.310 1.34245e+02 282.310 0.9411 
1 1 1 -9  5   13 o 13 2.97963e+00 8.74531e-01 1.97173e+01 120.706 -2.96074e-01 4.98534e-01  0.00000e+00 0.00000e+00 1.13343e+01 120.706 8.38302e+00 300.706 0.2784 
1 1 1 -9  5   14 o 2  3.86479e+00 8.93442e-01 1.12366e+02 50.509  3.39419e+00  4.11886e+00  0.00000e+00 0.00000e+00 1.77897e+01 50.509  9.45764e+01 230.509 0.9007 
1 1 1 -9  5   15 o 1  1.64720e+01 5.96004e-01 2.74480e+02 232.336 -4.49568e+01 -5.82429e+01 0.00000e+00 0.00000e+00 3.36477e+02 232.336 6.19968e+01 232.336 0.9932 
1 1 1 -9  5   16 o 10 5.37704e+00 8.94519e-01 7.90687e+01 352.570 6.80757e+00  -8.87812e-01 0.00000e+00 0.00000e+00 1.06234e+02 352.570 2.71648e+01 352.570 0.9240 
1 1 1 -9  5   17 o 2  6.38608e+00 1.06934e+00 7.93843e+01 11.650  7.35004e+00  1.51550e+00  0.00000e+00 0.00000e+00 1.42001e+02 11.650  6.26168e+01 11.650  0.9308 
1 1 1 -9  5   18 o 2  6.25644e+00 1.33631e+00 1.02718e+02 47.584  6.50270e+00  7.11741e+00  0.00000e+00 0.00000e+00 1.17552e+02 47.584  1.48338e+01 47.584  0.9466 
1 1 1 -9  5   19 o 6  4.93598e+00 1.45258e+00 6.50778e+01 217.564 -3.91673e+00 -3.01241e+00 0.00000e+00 0.00000e+00 9.84306e+01 217.564 3.33527e+01 217.564 0.8920 
1 1 1 -9  6   1  o 7  3.96609e+01 8.51846e-01 7.09775e+02 253.060 -1.10487e+01 -3.62733e+01 0.00000e+00 0.00000e+00 7.69216e+02 253.060 5.94415e+01 253.060 0.9867 
1 1 1 -9  6   2  o 9  3.20099e+01 7.28368e-01 7.72262e+02 239.873 -1.96595e+01 -3.38780e+01 0.00000e+00 0.00000e+00 4.21391e+02 239.873 3.50872e+02 59.873  0.9872 
1 1 1 -9  6   3  o 18 2.44142e+01 6.39479e-01 5.39916e+02 114.283 -1.02918e+01 2.28120e+01  0.00000e+00 0.00000e+00 3.63259e+02 114.283 1.76656e+02 294.283 0.9798 
1 1 1 -9  6   4  o 10 2.08428e+01 6.24946e-01 3.52555e+02 235.584 -7.12396e+00 -1.03982e+01 0.00000e+00 0.00000e+00 4.02058e+02 235.584 4.95032e+01 235.584 0.9595 
1 1 1 -9  6   5  o 13 1.13483e+01 7.16995e-01 1.62568e+02 56.404  2.12760e+00  3.20279e+00  0.00000e+00 0.00000e+00 2.04307e+02 56.404  4.17394e+01 56.404  0.8573 
1 1 1 -9  6   6  o 7  2.63411e+01 6.96329e-01 4.92101e+02 206.266 -2.82600e+01 -1.39461e+01 0.00000e+00 0.00000e+00 4.84657e+02 206.266 7.44420e+00 26.266  0.9840 
1 1 1 -9  6   7  o 19 2.46322e+01 6.93749e-01 4.77489e+02 64.273  1.42493e+01  2.95724e+01  0.00000e+00 0.00000e+00 4.35804e+02 64.273  4.16847e+01 244.273 0.9846 
1 1 1 -9  6   8  o 17 1.96766e+01 7.01907e-01 1.95695e+02 278.529 1.81415e+00  -1.20967e+01 0.00000e+00 0.00000e+00 5.13685e+02 278.529 3.17990e+02 278.529 0.9582 
1 1 1 -9  6   9  o 19 8.13660e+00 1.07966e+00 9.75533e+01 235.987 -1.78287e+00 -2.64191e+00 0.00000e+00 0.00000e+00 1.54151e+02 235.987 5.65973e+01 235.987 0.8229 
1 1 1 -9  6   10 o 6  6.98545e+00 1.09401e+00 8.52124e+01 263.206 -3.51610e-01 -2.95140e+00 0.00000e+00 0.00000e+00 1.26739e+02 263.206 4.15261e+01 263.206 0.8079 
1 1 1 -9  6   11 o 7  1.17976e+01 7.28995e-01 2.29320e+02 322.523 1.56261e+01  -1.19802e+01 0.00000e+00 0.00000e+00 2.01911e+02 322.523 2.74090e+01 142.523 0.9743 
1 1 1 -9  6   12 o 18 1.55690e+01 5.91336e-01 2.68905e+02 184.268 -3.82316e+01 -2.85326e+00 0.00000e+00 0.00000e+00 3.06931e+02 184.268 3.80263e+01 184.268 0.9869 
1 1 1 -9  6   13 o 17 1.45464e+01 5.78616e-01 2.14533e+02 310.992 2.19385e+01  -2.52445e+01 0.00000e+00 0.00000e+00 3.21819e+02 310.992 1.07285e+02 310.992 0.9849 
1 1 1 -9  6   14 o 2  4.09890e+00 8.14013e-01 9.81856e+01 339.456 4.77921e+00  -1.79109e+00 0.00000e+00 0.00000e+00 3.90981e+01 339.456 5.90876e+01 159.456 0.8957 
1 1 1 -9  6   15 o 4  1.49557e+01 5.94818e-01 2.45339e+02 109.951 -2.03779e+01 5.61379e+01  0.00000e+00 0.00000e+00 3.08482e+02 109.951 6.31426e+01 109.951 0.9916 
1 1 1 -9  6   16 o 4  1.31846e+01 6.50122e-01 1.96701e+02 146.099 -3.92060e+01 2.63467e+01  0.00000e+00 0.00000e+00 2.89798e+02 146.099 9.30973e+01 146.099 0.9894 
1 1 1 -9  6   17 o 18 3.21056e+00 9.65328e-01 3.78147e+01 56.700  1.04755e+00  1.59474e+00  0.00000e+00 0.00000e+00 4.37457e+01 56.700  5.93097e+00 56.700  0.6821 
1 1 1 -9  6   18 o 14 4.05988e+00 1.17050e+00 8.34089e+01 252.689 -1.69825e+00 -5.44893e+00 0.00000e+00 0.00000e+00 5.36261e+01 252.689 2.97828e+01 72.689  0.9076 
1 1 1 -9  6   19 o 18 7.21627e+00 1.46566e+00 8.65983e+01 75.599  2.36459e+00  9.20871e+00  0.00000e+00 0.00000e+00 1.66874e+02 75.599  8.02753e+01 75.599  0.9459 
1 1 1 -9  7   1  o 8  5.75000e+01 1.15869e+00 1.29880e+03 20.913  1.08429e+02  4.14334e+01  0.00000e+00 0.00000e+00 8.64858e+02 20.913  4.33944e+02 200.913 0.9957 
1 1 1 -9  7   2  o 13 1.71713e+01 5.83638e-01 3.43939e+02 285.389 2.49410e+00  -9.06168e+00 0.00000e+00 0.00000e+00 2.69159e+02 285.389 7.47798e+01 105.389 0.9452 
1 1 1 -9  7   3  o 17 3.64204e+01 8.03449e-01 5.64660e+02 337.882 3.58247e+01  -1.45597e+01 0.00000e+00 0.00000e+00 7.92506e+02 337.882 2.27846e+02 337.882 0.9870 
1 1 1 -9  7   4  o 7  2.89442e+01 7.02817e-01 3.83463e+02 170.889 -1.87146e+01 3.00127e+00  0.00000e+00 0.00000e+00 6.79492e+02 170.889 2.96028e+02 170.889 0.9733 
1 1 1 -9  7   5  f 0  1.42905e+01 6.45199e-01 4.04235e+02 140.179 -9.27532e+00 7.73373e+00  0.00000e+00 0.00000e+00 1.11837e+02 140.179 2.92399e+02 320.179 0.9577 
1 1 1 -9  7   6  o 10 2.80792e+01 7.13559e-01 5.58015e+02 92.678  -1.77675e+00 3.79791e+01  0.00000e+00 0.00000e+00 4.86090e+02 92.678  7.19246e+01 272.678 0.9868 
1 1 1 -9  7   7  o 10 3.78516e+01 8.52184e-01 6.16540e+02 10.220  6.32455e+01  1.14029e+01  0.00000e+00 0.00000e+00 7.97611e+02 10.220  1.81071e+02 10.220  0.9922 
1 1 1 -9  7   8  o 6  1.50964e+01 7.46330e-01 3.24270e+02 328.390 1.31825e+01  -8.11304e+00 0.00000e+00 0.00000e+00 2.25047e+02 328.390 9.92237e+01 148.390 0.9671 
1 1 1 -9  7   9  o 9  2.70180e+01 7.41440e-01 4.27309e+02 242.502 -2.24326e+01 -4.30959e+01 0.00000e+00 0.00000e+00 5.77803e+02 242.502 1.50495e+02 242.502 0.9897 
1 1 1 -9  7   10 o 10 1.54302e+01 7.26833e-01 2.86819e+02 137.430 -1.91092e+01 1.75534e+01  0.00000e+00 0.00000e+00 2.81383e+02 137.430 5.43573e+00 317.430 0.9805 
1 1 1 -9  7   11 o 2  2.25717e+01 7.18029e-01 4.11030e+02 344.233 6.50865e+01  -1.83766e+01 0.00000e+00 0.00000e+00 4.29515e+02 344.233 1.84849e+01 344.233 0.9926 
1 1 1 -9  7   12 o 11 2.41942e+01 6.10227e-01 3.75151e+02 122.248 -4.41524e+01 6.99817e+01  0.00000e+00 0.00000e+00 5.26088e+02 122.248 1.50937e+02 122.248 0.9939 
1 1 1 -9  7   13 o 14 1.17361e+01 5.94633e-01 2.72629e+02 268.385 -9.62120e-01 -3.41351e+01 0.00000e+00 0.00000e+00 1.60234e+02 268.385 1.12396e+02 88.385  0.9852 
1 1 1 -9  7   14 o 15 7.45624e+00 7.25690e-01 1.76586e+02 88.056  5.61634e-01  1.65458e+01  0.00000e+00 0.00000e+00 9.36528e+01 88.056  8.29330e+01 268.056 0.9693 
1 1 1 -9  7   15 o 15 2.40910e+00 7.67220e-01 5.84084e+01 4.446   2.13076e+00  1.65657e-01  0.00000e+00 0.00000e+00 6.28262e+00 4.446   5.21258e+01 184.446 0.7191 
1 1 1 -9  7   16 o 4  9.79189e+00 6.99855e-01 1.80213e+02 151.945 -2.77233e+01 1.47751e+01  0.00000e+00 0.00000e+00 1.79117e+02 151.945 1.09618e+00 331.945 0.9840 
1 1 1 -9  7   17 o 14 3.20189e+00 1.01233e+00 6.50662e+01 224.546 -2.27089e+00 -2.23522e+00 0.00000e+00 0.00000e+00 3.30629e+01 224.546 3.20033e+01 44.546  0.8229 
1 1 1 -9  7   18 o 1  1.02149e+01 1.05699e+00 1.60443e+02 343.686 2.87851e+01  -8.42477e+00 0.00000e+00 0.00000e+00 2.13069e+02 343.686 5.26266e+01 343.686 0.9832 
1 1 1 -9  7   19 o 19 3.51636e+00 1.16186e+00 8.92256e+00 225.581 -4.31240e-01 -4.40080e-01 0.00000e+00 0.00000e+00 2.95104e+01 225.581 2.05879e+01 225.581 0.2943 
1 1 1 -9  8   1  o 6  6.31300e+01 1.26025e+00 1.29970e+03 137.772 -9.36096e+01 8.49644e+01  0.00000e+00 0.00000e+00 1.07660e+03 137.772 2.23099e+02 317.772 0.9960 
1 1 1 -9  8   2  o 3  5.14403e+01 1.04912e+00 9.80937e+02 11.029  7.69425e+01  1.49962e+01  0.00000e+00 0.00000e+00 9.49739e+02 11.029  3.11981e+01 191.029 0.9936 
1 1 1 -9  8   3  o 3  2.86225e+01 6.96817e-01 5.16311e+02 192.561 -2.72415e+01 -6.06977e+00 0.00000e+00 0.00000e+00 5.44779e+02 192.561 2.84680e+01 192.561 0.9819 
1 1 1 -9  8   4  o 13 3.47630e+01 7.82824e-01 5.57071e+02 281.406 6.50650e+00  -3.22524e+01 0.00000e+00 0.00000e+00 7.34544e+02 281.406 1.77473e+02 281.406 0.9847 
1 1 1 -9  8   5  o 9  1.61320e+01 6.36425e-01 2.75735e+02 93.882  -6.29286e-01 9.27323e+00  0.00000e+00 0.00000e+00 2.98861e+02 93.882  2.31266e+01 93.882  0.9446 
1 1 1 -9  8   6  o 13 2.39513e+01 6.78165e-01 4.75437e+02 180.153 -2.73377e+01 -7.30668e-02 0.00000e+00 0.00000e+00 4.10440e+02 180.153 6.49973e+01 0.153   0.9815 
1 1 1 -9  8   7  f 0  2.01783e+01 6.74391e-01 2.75585e+02 129.397 -9.85077e+00 1.19938e+01  0.00000e+00 0.00000e+00 4.59306e+02 129.397 1.83721e+02 129.397 0.9672 
1 1 1 -9  8   8  o 7  4.34918e+01 9.50299e-01 7.10961e+02 329.887 8.27981e+01  -4.80209e+01 0.00000e+00 0.00000e+00 9.16757e+02 329.887 2.05796e+02 329.887 0.9948 
1 1 1 -9  8   9  o 15 1.91445e+01 7.32360e-01 4.35090e+02 55.631  1.97936e+01  2.89418e+01  0.00000e+00 0.00000e+00 2.74209e+02 55.631  1.60881e+02 235.631 0.9856 
1 1 1 -9  8   10 o 10 2.76097e+01 6.81330e-01 5.01074e+02 246.319 -3.27869e+01 -7.47574e+01 0.00000e+00 0.00000e+00 5.29419e+02 246.319 2.83445e+01 246.319 0.9939 
1 1 1 -9  8   11 o 2  1.53168e+01 6.59006e-01 3.68492e+02 164.893 -4.01414e+01 1.08363e+01  0.00000e+00 0.00000e+00 1.99189e+02 164.893 1.69303e+02 344.893 0.9879 
1 1 1 -9  8   12 o 12 1.01518e+01 6.97568e-01 1.20470e+02 343.159 1.04602e+01  -3.16622e+00 0.00000e+00 0.00000e+00 2.42137e+02 343.159 1.21668e+02 343.159 0.9531 
1 1 1 -9  8   13 o 9  9.30826e+00 6.54439e-01 1.68820e+02 191.415 -1.61905e+01 -3.26889e+00 0.00000e+00 0.00000e+00 1.68911e+02 191.415 9.11496e-02 191.415 0.9692 
1 1 1 -9  8   14 o 14 9.43381e+00 6.36235e-01 1.06291e+02 198.495 -1.23043e+01 -4.11585e+00 0.00000e+00 0.00000e+00 2.32561e+02 198.495 1.26269e+02 198.495 0.9607 
1 1 1 -9  8   15 o 4  9.59593e+00 6.45886e-01 1.30028e+02 289.291 6.57878e+00  -1.87956e+01 0.00000e+00 0.00000e+00 2.19199e+02 289.291 8.91709e+01 289.291 0.9746 
1 1 1 -9  8   16 o 15 5.27171e+00 9.39463e-01 1.11784e+02 19.000  8.77242e+00  3.02059e+00  0.00000e+00 0.00000e+00 7.39026e+01 19.000  3.78816e+01 199.000 0.9445 
1 1 1 -9  8   17 o 14 4.78395e+00 1.14873e+00 6.09522e+01 282.969 9.22997e-01  -4.00799e+00 0.00000e+00 0.00000e+00 9.36511e+01 282.969 3.26989e+01 282.969 0.8677 
1 1 1 -9  8   18 o 6  3.99543e+00 1.18049e+00 7.75323e+01 314.408 3.62503e+00  -3.70068e+00 0.00000e+00 0.00000e+00 5.58129e+01 314.408 2.17194e+01 134.408 0.8974 
1 1 1 -9  8   19 o 8  5.94609e+00 1.47036e+00 5.30216e+01 8.815   4.71942e+00  7.31880e-01  0.00000e+00 0.00000e+00 1.43034e+02 8.815   9.00124e+01 8.815   0.8879 
1 1 1 -9  9   1  o 14 2.24874e+01 6.19101e-01 4.01147e+02 344.144 1.38310e+01  -3.92841e+00 0.00000e+00 0.00000e+00 4.18553e+02 344.144 1.74058e+01 344.144 0.9646 
1 1 1 -9  9   2  o 6  3.58324e+01 7.90949e-01 8.39757e+02 7.176   4.60863e+01  5.80230e+00  0.00000e+00 0.00000e+00 4.99097e+02 7.176   3.40660e+02 187.176 0.9892 
1 1 1 -9  9   3  o 14 7.96769e+00 7.52247e-01 1.85998e+02 107.909 -8.56894e-01 2.65160e+00  0.00000e+00 0.00000e+00 5.25091e+01 107.909 1.33489e+02 287.909 0.7929 
1 1 1 -9  9   4  o 17 3.70080e+01 8.15452e-01 6.26908e+02 292.992 1.53492e+01  -3.61746e+01 0.00000e+00 0.00000e+00 7.51593e+02 292.992 1.24684e+02 292.992 0.9872 
1 1 1 -9  9   5  o 4  1.72702e+01 6.39311e-01 3.04693e+02 36.573  8.81988e+00  6.54389e+00  0.00000e+00 0.00000e+00 3.16133e+02 36.573  1.14394e+01 36.573  0.9533 
1 1 1 -9  9   6  o 19 2.06968e+01 6.63718e-01 2.78334e+02 143.274 -1.10857e+01 8.27074e+00  0.00000e+00 0.00000e+00 4.72808e+02 143.274 1.94475e+02 143.274 0.9631 
1 1 1 -9  9   7  o 4  3.96220e+01 8.80255e-01 7.52719e+02 37.793  6.46396e+01  5.01267e+01  0.00000e+00 0.00000e+00 7.30017e+02 37.793  2.27014e+01 217.793 0.9939 
1 1 1 -9  9   8  o 4  1.81607e+01 7.12930e-01 3.61061e+02 197.374 -1.98071e+01 -6.19743e+00 0.00000e+00 0.00000e+00 3.05513e+02 197.374 5.55473e+01 17.374  0.9756 
1 1 1 -9  9   9  o 8  1.97736e+01 7.08273e-01 4.27464e+02 242.829 -1.62778e+01 -3.17133e+01 0.00000e+00 0.00000e+00 3.05302e+02 242.829 1.22162e+02 62.829  0.9859 
1 1 1 -9  9   10 o 19 3.43054e+00 9.80774e-01 7.78847e+01 0.404   1.49300e+00  1.05258e-02  0.00000e+00 0.00000e+00 1.30814e+00 180.404 7.91928e+01 180.404 0.5944 
1 1 1 -9  9   11 o 18 1.00636e+01 7.73467e-01 2.71742e+02 46.897  1.34508e+01  1.43725e+01  0.00000e+00 0.00000e+00 9.60829e+01 46.897  1.75660e+02 226.897 0.9743 
1 1 1 -9  9   12 o 5  5.90179e+00 8.92344e-01 6.58147e+01 135.039 -2.33337e+00 2.33016e+00  0.00000e+00 0.00000e+00 1.17713e+02 135.039 5.18985e+01 135.039 0.8298 
1 1 1 -9  9   13 o 8  7.62040e+00 7.65525e-01 1.55936e+02 95.773  -1.21802e+00 1.20467e+01  0.00000e+00 0.00000e+00 1.17277e+02 95.773  3.86586e+01 275.773 0.9578 
1 1 1 -9  9   14 f 0  1.54502e+01 5.56919e-01 2.80606e+02 286.950 1.67289e+01  -5.48905e+01 0.00000e+00 0.00000e+00 2.92009e+02 286.950 1.14029e+01 286.950 0.9912 
1 1 1 -9  9   15 o 2  8.33613e+00 6.81405e-01 7.61558e+01 251.745 -3.12866e+00 -9.48546e+00 0.00000e+00 0.00000e+00 2.19116e+02 251.745 1.42960e+02 251.745 0.9485 
1 1 1 -9  9   16 o 13 3.40717e+00 9.26737e-01 9.66207e+01 204.988 -4.71888e+00 -2.19928e+00 0.00000e+00 0.00000e+00 1.74786e+01 204.988 7.91422e+01 24.988  0.8980 
1 1 1 -9  9   17 o 13 2.96479e+00 9.63800e-01 4.48232e+01 164.589 -2.01274e+00 5.54816e-01  0.00000e+00 0.00000e+00 3.37578e+01 164.589 1.10654e+01 344.589 0.7117 
1 1 1 -9  9   18 o 12 5.04740e+00 1.23543e+00 6.82003e+01 328.990 4.73683e+00  -2.84732e+00 0.00000e+00 0.00000e+00 1.01548e+02 328.990 3.33475e+01 328.990 0.9043 
1 1 1 -9  9   19 o 5  5.67992e+00 1.47970e+00 7.05687e+01 147.829 -4.98861e+00 3.13801e+00  0.00000e+00 0.00000e+00 1.21507e+02 147.829 5.09383e+01 147.829 0.9107 
1 1 1 -9  10  1  o 16 2.23568e+01 7.57592e-01 4.00905e+02 99.861  -2.42791e+00 1.39669e+01  0.00000e+00 0.00000e+00 4.13580e+02 99.861  1.26750e+01 99.861  0.9641 
1 1 1 -9  10  2  o 5  2.46577e+01 8.72496e-01 1.71091e+02 202.670 -5.97547e+00 -2.49595e+00 0.00000e+00 0.00000e+00 6.85000e+02 202.670 5.13909e+02 202.670 0.9192 
1 1 1 -9  10  3  o 18 7.85058e+00 7.77145e-01 2.34756e+02 147.721 -2.92107e+00 1.84513e+00  0.00000e+00 0.00000e+00 1.38239e+01 147.721 2.20932e+02 327.721 0.8387 
1 1 1 -9  10  4  o 19 3.29006e+01 7.54508e-01 6.06893e+02 186.272 -3.36672e+01 -3.70006e+00 0.00000e+00 0.00000e+00 6.16013e+02 186.272 9.12073e+00 186.272 0.9851 
1 1 1 -9  10  5  o 16 1.68449e+01 6.35469e-01 2.92036e+02 84.392  1.00242e+00  1.02081e+01  0.00000e+00 0.00000e+00 3.11327e+02 84.392  1.92914e+01 84.392  0.9499 
1 1 1 -9  10  6  o 2  4.41086e+01 9.42502e-01 7.66171e+02 156.716 -7.29905e+01 3.14107e+01  0.00000e+00 0.00000e+00 8.85373e+02 156.716 1.19202e+02 156.716 0.9937 
1 1 1 -9  10  7  o 8  2.63976e+01 7.14526e-01 3.39149e+02 259.678 -4.45651e+00 -2.44691e+01 0.00000e+00 0.00000e+00 6.34579e+02 259.678 2.95430e+02 259.678 0.9797 
1 1 1 -9  10  8  o 13 2.10383e+01 7.06715e-01 3.99862e+02 159.612 -2.58152e+01 9.59441e+00  0.00000e+00 0.00000e+00 3.77114e+02 159.612 2.27480e+01 339.612 0.9817 
1 1 1 -9  10  9  o 19 3.98519e+00 1.15961e+00 1.31817e+02 15.442  1.99985e+00  5.52425e-01  0.00000e+00 0.00000e+00 2.55119e+01 195.442 1.57329e+02 195.442 0.7097 
1 1 1 -9  10  10 o 19 1.72389e+01 6.54597e-01 3.05341e+02 43.074  2.27396e+01  2.12598e+01  0.00000e+00 0.00000e+00 3.31536e+02 43.074  2.61954e+01 43.074  0.9838 
1 1 1 -9  10  11 o 14 1.41550e+01 6.64407e-01 2.82870e+02 148.739 -2.53471e+01 1.53879e+01  0.00000e+00 0.00000e+00 2.39118e+02 148.739 4.37519e+01 328.739 0.9830 
1 1 1 -9  10  12 o 11 3.27000e+00 9.19633e-01 5.32827e+01 145.897 -1.21575e+00 8.23234e-01  0.00000e+00 0.00000e+00 1.87953e+01 145.897 3.44873e+01 325.897 0.5882 
1 1 1 -9  10  13 o 17 1.76174e+01 5.76641e-01 2.47475e+02 249.720 -1.71340e+01 -4.63681e+01 0.00000e+00 0.00000e+00 4.05285e+02 249.720 1.57810e+02 249.720 0.9898 
1 1 1 -9  10  14 o 10 8.43041e+00 6.64327e-01 1.78566e+02 99.408  -3.15311e+00 1.90292e+01  0.00000e+00 0.00000e+00 1.28349e+02 99.408  5.02174e+01 279.408 0.9737 
1 1 1 -9  10  15 o 4  4.00278e+00 9.09307e-01 4.28148e+01 57.939  1.30214e+00  2.07894e+00  0.00000e+00 0.00000e+00 7.07514e+01 57.939  2.79366e+01 57.939  0.7598 
1 1 1 -9  10  16 o 14 7.76679e+00 7.41854e-01 1.89428e+02 201.005 -2.38826e+01 -9.17018e+00 0.00000e+00 0.00000e+00 9.44973e+01 201.005 9.49307e+01 21.005  0.9803 
1 1 1 -9  10  17 o 9  1.05594e+01 9.95650e-01 1.55044e+02 40.375  2.03113e+01  1.72712e+01  0.00000e+00 0.00000e+00 2.30757e+02 40.375  7.57130e+01 40.375  0.9811 
1 1 1 -9  10  18 o 6  9.50681e+00 1.04225e+00 1.30743e+02 134.131 -1.59905e+01 1.64829e+01  0.00000e+00 0.00000e+00 2.15013e+02 134.131 8.42696e+01 134.131 0.9780 
1 1 1 -9  10  19 o 17 4.52276e+00 1.32942e+00 9.48033e+01 201.700 -6.61848e+00 -2.63384e+00 0.00000e+00 0.00000e+00 6.08598e+01 201.700 3.39435e+01 21.700  0.9269 
1 1 1 -9  11  1  o 16 4.95533e+01 1.01795e+00 1.10326e+03 62.972  3.86767e+01  7.58156e+01  0.00000e+00 0.00000e+00 7.58235e+02 62.972  3.45028e+02 242.972 0.9941 
1 1 1 -9  11  2  o 6  3.54803e+01 7.88541e-01 6.93895e+02 267.445 -1.68851e+00 -3.78381e+01 0.00000e+00 0.00000e+00 6.28424e+02 267.445 6.54712e+01 87.445  0.9867 
1 1 1 -9  11  3  o 6  4.84225e+01 9.97773e-01 8.37722e+02 344.264 6.75702e+01  -1.90394e+01 0.00000e+00 0.00000e+00 9.77237e+02 344.264 1.39515e+02 344.264 0.9929 
1 1 1 -9  11  4  o 13 2.49720e+01 6.58104e-01 4.65027e+02 251.871 -6.21337e+00 -1.89772e+01 0.00000e+00 0.00000e+00 4.53259e+02 251.871 1.17686e+01 71.871  0.9746 
1 1 1 -9  11  5  o 9  1.15573e+01 8.74257e-01 1.87216e+02 203.128 -4.26957e+00 -1.82363e+00 0.00000e+00 0.00000e+00 1.98178e+02 203.128 1.09614e+01 203.128 0.8844 
1 1 1 -9  11  6  o 1  2.43989e+01 6.78416e-01 6.95345e+02 193.097 -3.95681e+01 -9.20564e+00 0.00000e+00 0.00000e+00 2.12606e+02 193.097 4.82739e+02 13.097  0.9876 
1 1 1 -9  11  7  o 8  1.44681e+01 7.29815e-01 2.56168e+02 356.649 1.10895e+01  -6.49213e-01 0.00000e+00 0.00000e+00 2.63440e+02 356.649 7.27294e+00 356.649 0.9539 
1 1 1 -9  11  8  o 7  4.51538e+01 1.14199e+00 6.80828e+02 103.120 -2.17431e+01 9.32908e+01  0.00000e+00 0.00000e+00 1.00897e+03 103.120 3.28138e+02 103.120 0.9948 
1 1 1 -9  11  9  o 15 1.25310e+01 7.98774e-01 2.04574e+02 11.134  1.08140e+01  2.12832e+00  0.00000e+00 0.00000e+00 2.44522e+02 11.134  3.99484e+01 11.134  0.9535 
1 1 1 -9  11  10 o 12 1.56200e+01 6.71993e-01 3.14356e+02 205.110 -2.62023e+01 -1.22794e+01 0.00000e+00 0.00000e+00 2.61971e+02 205.110 5.23854e+01 25.110  0.9826 
1 1 1 -9  11  11 f 0  6.60222e+00 9.90788e-01 9.81424e+01 137.787 -3.30379e+00 2.99700e+00  0.00000e+00 0.00000e+00 1.19602e+02 137.787 2.14601e+01 137.787 0.8792 
1 1 1 -9  11  12 o 4  7.69666e+00 8.15159e-01 1.30502e+02 337.580 8.04983e+00  -3.32112e+00 0.00000e+00 0.00000e+00 1.40816e+02 337.580 1.03134e+01 337.580 0.9407 
1 1 1 -9  11  13 o 7  1.95368e+01 5.81422e-01 2.86669e+02 295.812 2.75990e+01  -5.70606e+01 0.00000e+00 0.00000e+00 4.38832e+02 295.812 1.52163e+02 295.812 0.9921 
1 1 1 -9  11  14 o 6  9.52503e+00 6.11533e-01 2.00581e+02 50.390  1.58541e+01  1.91573e+01  0.00000e+00 0.00000e+00 1.48296e+02 50.390  5.22854e+01 230.390 0.9797 
1 1 1 -9  11  15 o 18 2.60708e+00 7.83041e-01 6.24760e+01 216.543 -1.98552e+00 -1.47154e+00 0.00000e+00 0.00000e+00 1.16893e+01 216.543 5.07867e+01 36.543  0.7618 
1 1 1 -9  11  16 o 16 7.75638e+00 7.51537e-01 1.12177e+02 80.242  2.55085e+00  1.48326e+01  0.00000e+00 0.00000e+00 1.67289e+02 80.242  5.51123e+01 80.242  0.9662 
1 1 1 -9  11  17 o 3  7.46122e+00 1.05483e+00 1.39154e+02 92.048  -5.82606e-01 1.62897e+01  0.00000e+00 0.00000e+00 1.30042e+02 92.048  9.11165e+00 272.048 0.9688 
1 1 1 -9  11  18 o 15 5.95744e+00 1.13854e+00 1.05335e+02 268.775 -2.32492e-01 -1.08735e+01 0.00000e+00 0.00000e+00 1.05761e+02 268.775 4.25514e-01 268.775 0.9529 
1 1 1 -9  11  19 o 2  4.47664e+00 1.52407e+00 6.57841e+01 282.558 9.07901e-01  -4.07572e+00 0.00000e+00 0.00000e+00 7.88234e+01 282.558 1.30393e+01 282.558 0.8700 
1 1 1 -9  12  1  o 12 2.16668e+01 6.10943e-01 4.49949e+02 30.884  1.30074e+01  7.77971e+00  0.00000e+00 0.00000e+00 3.41290e+02 30.884  1.08659e+02 210.884 0.9664 
1 1 1 -9  12  2  o 10 4.34273e+01 9.12184e-01 7.92194e+02 77.881  1.10230e+01  5.13327e+01  0.00000e+00 0.00000e+00 8.32356e+02 77.881  4.01614e+01 77.881  0.9904 
1 1 1 -9  12  3  o 19 3.00374e+01 7.08011e-01 4.44198e+02 0.040   2.34239e+01  1.63367e-02  0.00000e+00 0.00000e+00 6.65251e+02 0.040   2.21053e+02 0.040   0.9784 
1 1 1 -9  12  4  f 0  2.80321e+01 6.88980e-01 5.37678e+02 85.881  1.85724e+00  2.57917e+01  0.00000e+00 0.00000e+00 4.99281e+02 85.881  3.83970e+01 265.881 0.9805 
1 1 1 -9  12  5  o 7  7.17091e+01 1.43148e+00 1.33693e+03 225.505 -1.36863e+02 -1.39298e+02 0.00000e+00 0.00000e+00 1.35990e+03 225.505 2.29749e+01 225.505 0.9974 
1 1 1 -9  12  6  o 14 1.89277e+01 6.51781e-01 3.53578e+02 191.208 -1.75602e+01 -3.47969e+00 0.00000e+00 0.00000e+00 3.39370e+02 191.208 1.42080e+01 11.208  0.9717 
1 1 1 -9  12  7  o 7  3.25873e+01 7.83783e-01 6.33400e+02 261.077 -9.53870e+00 -6.07518e+01 0.00000e+00 0.00000e+00 5.83484e+02 261.077 4.99159e+01 81.077  0.9918 
1 1 1 -9  12  8  o 1  3.86614e+01 1.02374e+00 6.92304e+02 83.025  1.02697e+01  8.39475e+01  0.00000e+00 0.00000e+00 7.53468e+02 83.025  6.11639e+01 83.025  0.9941 
1 1 1 -9  12  9  o 17 4.53946e+00 1.20693e+00 1.26032e+02 300.012 1.15288e+00  -1.99587e+00 0.00000e+00 0.00000e+00 5.66847e-01 300.012 1.25466e+02 120.012 0.7420 
1 1 1 -9  12  10 o 18 6.92654e+00 1.04238e+00 1.58417e+02 332.488 5.16788e+00  -2.69160e+00 0.00000e+00 0.00000e+00 7.81587e+01 332.488 8.02578e+01 152.488 0.9096 
1 1 1 -9  12  11 o 18 1.29278e+01 6.79372e-01 1.74165e+02 165.968 -1.61075e+01 4.02572e+00  0.00000e+00 0.00000e+00 2.95951e+02 165.968 1.21786e+02 165.968 0.9694 
1 1 1 -9  12  12 o 12 1.62407e+01 6.27030e-01 3.16786e+02 42.951  3.41270e+01  3.17693e+01  0.00000e+00 0.00000e+00 2.85231e+02 42.951  3.15558e+01 222.951 0.9892 
1 1 1 -9  12  13 o 18 1.52274e+01 5.76854e-01 2.42771e+02 235.311 -2.38208e+01 -3.44154e+01 0.00000e+00 0.00000e+00 3.20347e+02 235.311 7.75758e+01 235.311 0.9880 
1 1 1 -9  12  14 f 0  3.27522e+00 8.78854e-01 5.42459e+01 264.745 -2.05732e-01 -2.23682e+00 0.00000e+00 0.00000e+00 3.56718e+01 264.745 1.85741e+01 84.745  0.7343 
1 1 1 -9  12  15 o 16 7.97403e+00 6.79008e-01 1.21693e+02 131.222 -1.01337e+01 1.15665e+01  0.00000e+00 0.00000e+00 1.66201e+02 131.222 4.45078e+01 131.222 0.9669 
1 1 1 -9  12  16 o 17 4.96135e+00 9.51334e-01 5.43987e+01 6.980   4.17331e+00  5.10938e-01  0.00000e+00 0.00000e+00 1.06736e+02 6.980   5.23374e+01 6.980   0.8709 
1 1 1 -9  12  17 o 8  3.12629e+00 9.87150e-01 7.64268e+01 14.771  3.77769e+00  9.96065e-01  0.00000e+00 0.00000e+00 2.36765e+01 14.771  5.27503e+01 194.771 0.8598 
1 1 1 -9  12  18 o 14 4.51630e+00 1.21582e+00 3.93397e+01 55.405  1.65070e+00  2.39326e+00  0.00000e+00 0.00000e+00 9.55006e+01 55.405  5.61609e+01 55.405  0.8029 
1 1 1 -9  12  19 o 11 4.24281e+00 1.46835e+00 7.81920e+01 113.998 -2.00028e+00 4.49302e+00  0.00000e+00 0.00000e+00 6.22450e+01 113.998 1.59469e+01 293.998 0.8915 
1 1 1 -9  13  1  o 3  3.85236e+01 8.32859e-01 6.74946e+02 315.123 2.83160e+01  -2.81944e+01 0.00000e+00 0.00000e+00 7.62367e+02 315.123 8.74214e+01 315.123 0.9874 
1 1 1 -9  13  2  o 12 8.20509e+00 7.33875e-01 3.51108e+01 88.449  1.47189e-02  5.43720e-01  0.00000e+00 0.00000e+00 4.61977e+01 88.449  1.10869e+01 88.449  0.2624 
1 1 1 -9  13  3  o 10 3.91255e+01 8.42719e-01 6.74973e+02 209.769 -3.98853e+01 -2.28139e+01 0.00000e+00 0.00000e+00 7.85820e+02 209.769 1.10848e+02 209.769 0.9891 
1 1 1 -9  13  4  o 9  2.06110e+01 6.10245e-01 5.45683e+02 73.061  5.63496e+00  1.85019e+01  0.00000e+00 0.00000e+00 2.11537e+02 73.061  3.34146e+02 253.061 0.9738 
1 1 1 -9  13  5  o 9  1.69431e+01 6.32356e-01 2.20817e+02 241.005 -3.93787e+00 -7.10546e+00 0.00000e+00 0.00000e+00 3.77276e+02 241.005 1.56458e+02 241.005 0.9363 
1 1 1 -9  13  6  o 15 2.90904e+01 8.52233e-01 5.43801e+02 130.160 -2.68493e+01 3.18166e+01  0.00000e+00 0.00000e+00 5.38992e+02 130.160 4.80884e+00 310.160 0.9879 
1 1 1 -9  13  7  o 4  5.94958e+01 1.21714e+00 1.09759e+03 179.157 -1.85251e+02 2.72704e+00  0.00000e+00 0.00000e+00 1.13627e+03 179.157 3.86790e+01 179.157 0.9973 
1 1 1 -9  13  8  o 5  1.26840e+01 8.34478e-01 1.80139e+02 66.166  2.97584e+00  6.73645e+00  0.00000e+00 0.00000e+00 2.63312e+02 66.166  8.31737e+01 66.166  0.9294 
1 1 1 -9  13  9  o 14 2.03420e+01 7.23491e-01 5.11932e+02 328.079 3.82739e+01  -2.38430e+01 0.00000e+00 0.00000e+00 2.44084e+02 328.079 2.67848e+02 148.079 0.9888 
1 1 1 -9  13  10 o 10 3.24529e+01 7.33850e-01 5.64706e+02 113.027 -4.02130e+01 9.46136e+01  0.00000e+00 0.00000e+00 6.47925e+02 113.027 8.32193e+01 113.027 0.9951 
1 1 1 -9  13  11 o 12 1.06375e+01 7.41910e-01 2.78636e+02 352.500 2.13880e+01  -2.81564e+00 0.00000e+00 0.00000e+00 1.11028e+02 352.500 1.67609e+02 172.500 0.9765 
1 1 1 -9  13  12 o 2  1.55544e+01 6.33009e-01 2.84683e+02 177.128 -3.99959e+01 2.00626e+00  0.00000e+00 0.00000e+00 2.90835e+02 177.128 6.15162e+00 177.128 0.9874 
1 1 1 -9  13  13 o 4  1.21410e+01 6.13530e-01 2.22740e+02 75.120  7.78426e+00  2.92976e+01  0.00000e+00 0.00000e+00 2.24129e+02 75.120  1.38873e+00 75.120  0.9834 
1 1 1 -9  13  14 o 12 1.44551e+01 5.68807e-01 2.67782e+02 273.052 2.91308e+00  -5.46296e+01 0.00000e+00 0.00000e+00 2.67653e+02 273.052 1.29432e-01 93.052  0.9908 
1 1 1 -9  13  15 o 7  1.04985e+01 5.84339e-01 1.87703e+02 153.833 -2.90367e+01 1.42670e+01  0.00000e+00 0.00000e+00 1.98183e+02 153.833 1.04801e+01 153.833 0.9844 
1 1 1 -9  13  16 o 2  9.94788e+00 6.05456e-01 1.61188e+02 66.081  1.23140e+01  2.77639e+01  0.00000e+00 0.00000e+00 2.03601e+02 66.081  4.24128e+01 66.081  0.9834 
1 1 1 -9  13  17 o 10 5.79916e+00 1.04499e+00 5.80902e+01 0.331   5.41184e+00  3.12906e-02  0.00000e+00 0.00000e+00 1.36725e+02 0.331   7.86344e+01 0.331   0.9021 
1 1 1 -9  13  18 o 7  4.07899e+00 1.29305e+00 6.71318e+01 236.653 -2.32490e+00 -3.53296e+00 0.00000e+00 0.00000e+00 6.50984e+01 236.653 2.03339e+00 56.653  0.8718 
1 1 1 -9  13  19 o 15 4.67797e+00 1.57681e+00 4.76416e+01 247.046 -1.19751e+00 -2.82741e+00 0.00000e+00 0.00000e+00 9.39271e+01 247.046 4.62855e+01 247.046 0.8151 
1 1 1 -9  14  1  o 17 1.84025e+01 5.84951e-01 2.98333e+02 350.396 8.38506e+00  -1.41889e+00 0.00000e+00 0.00000e+00 3.54733e+02 350.396 5.64007e+01 350.396 0.9392 
1 1 1 -9  14  2  o 15 2.98519e+01 7.04768e-01 4.36487e+02 45.235  1.73080e+01  1.74508e+01  0.00000e+00 0.00000e+00 6.67757e+02 45.235  2.31270e+02 45.235  0.9794 
1 1 1 -9  14  3  o 2  1.78195e+01 7.48248e-01 3.11328e+02 238.396 -5.07234e+00 -8.24372e+00 0.00000e+00 0.00000e+00 3.25562e+02 238.396 1.42338e+01 238.396 0.9468 
1 1 1 -9  14  4  o 4  9.23133e+00 7.35535e-01 1.27557e+02 239.998 -1.23138e+00 -2.13262e+00 0.00000e+00 0.00000e+00 1.37423e+02 239.998 9.86521e+00 239.998 0.7609 
1 1 1 -9  14  5  o 12 1.33690e+01 9.91340e-01 1.32252e+02 105.847 -1.02230e+00 3.60137e+00  0.00000e+00 0.00000e+00 2.97635e+02 105.847 1.65384e+02 105.847 0.8529 
1 1 1 -9  14  6  o 19 1.45393e+01 8.19703e-01 4.03822e+02 87.616  6.43584e-01  1.54597e+01  0.00000e+00 0.00000e+00 1.25948e+02 87.616  2.77875e+02 267.616 0.9671 
1 1 1 -9  14  7  o 17 1.17119e+01 7.84997e-01 2.00053e+02 204.589 -6.04838e+00 -2.76775e+00 0.00000e+00 0.00000e+00 2.06219e+02 204.589 6.16619e+00 204.589 0.9214 
1 1 1 -9  14  8  o 2  4.74659e+01 1.01733e+00 9.12583e+02 3.069   1.47357e+02  7.90134e+00  0.00000e+00 0.00000e+00 8.66837e+02 3.069   4.57455e+01 183.069 0.9966 
1 1 1 -9  14  9  o 9  1.31701e+01 7.84749e-01 2.39084e+02 235.813 -7.96119e+00 -1.17203e+01 0.00000e+00 0.00000e+00 2.38086e+02 235.813 9.98362e-01 55.813  0.9640 
1 1 1 -9  14  10 o 18 1.58315e+01 6.91385e-01 3.38882e+02 290.802 1.07411e+01  -2.82736e+01 0.00000e+00 0.00000e+00 2.45640e+02 290.802 9.32414e+01 110.802 0.9833 
1 1 1 -9  14  11 o 17 6.91432e+00 9.98572e-01 1.25372e+02 105.291 -1.54187e+00 5.63959e+00  0.00000e+00 0.00000e+00 1.10617e+02 105.291 1.47546e+01 285.291 0.9099 
1 1 1 -9  14  12 o 8  1.58660e+01 6.28048e-01 2.89768e+02 238.491 -2.17628e+01 -3.55007e+01 0.00000e+00 0.00000e+00 2.97547e+02 238.491 7.77981e+00 238.491 0.9879 
1 1 1 -9  14  13 o 19 1.53008e+01 5.76129e-01 2.53974e+02 146.350 -3.43121e+01 2.28401e+01  0.00000e+00 0.00000e+00 3.11709e+02 146.350 5.77351e+01 146.350 0.9878 
1 1 1 -9  14  14 o 8  7.46442e+00 6.98715e-01 7.10731e+01 349.101 7.05056e+00  -1.35760e+00 0.00000e+00 0.00000e+00 1.87738e+02 349.101 1.16665e+02 349.101 0.9275 
1 1 1 -9  14  15 o 17 7.09606e+00 6.92699e-01 9.76055e+01 15.249  1.04475e+01  2.84806e+00  0.00000e+00 0.00000e+00 1.54791e+02 15.249  5.71851e+01 15.249  0.9526 
1 1 1 -9  14  16 o 3  7.29570e+00 6.94061e-01 1.03868e+02 334.369 1.24281e+01  -5.96286e+00 0.00000e+00 0.00000e+00 1.58110e+02 334.369 5.42418e+01 334.369 0.9630 
1 1 1 -9  14  17 o 11 6.87928e+00 1.06853e+00 1.41382e+02 72.871  4.53163e+00  1.47035e+01  0.00000e+00 0.00000e+00 1.06310e+02 72.871  3.50717e+01 252.871 0.9669 
1 1 1 -9  14  18 o 1  4.05249e+00 1.30740e+00 4.43361e+01 283.867 6.57674e-01  -2.66418e+00 0.00000e+00 0.00000e+00 7.45749e+01 283.867 3.02388e+01 283.867 0.7891 
1 1 1 -9  15  1  o 11 1.71252e+01 9.38281e-01 4.33421e+02 332.708 1.23079e+01  -6.35035e+00 0.00000e+00 0.00000e+00 1.89803e+02 332.708 2.43618e+02 152.708 0.9632 
1 1 1 -9  15  2  o 6  2.23757e+01 6.13024e-01 3.53633e+02 239.909 -7.49668e+00 -1.29372e+01 0.00000e+00 0.00000e+00 4.62634e+02 239.909 1.09001e+02 239.909 0.9660 
1 1 1 -9  15  3  f 0  3.32496e+01 7.56601e-01 5.74503e+02 130.048 -2.09542e+01 2.49299e+01  0.00000e+00 0.00000e+00 6.61125e+02 130.048 8.66219e+01 130.048 0.9845 
1 1 1 -9  15  4  o 1  2.44579e+01 9.69267e-01 2.96382e+02 16.563  1.42779e+01  4.24627e+00  0.00000e+00 0.00000e+00 5.94752e+02 16.563  2.98370e+02 16.563  0.9658 
1 1 1 -9  15  5  o 13 1.82284e+01 6.21421e-01 2.04427e+02 281.723 1.68246e+00  -8.10792e+00 0.00000e+00 0.00000e+00 4.39851e+02 281.723 2.35424e+02 281.723 0.9375 
1 1 1 -9  15  6  o 19 1.33634e+01 6.84127e-01 1.20460e+02 317.212 3.14079e+00  -2.90715e+00 0.00000e+00 0.00000e+00 3.19297e+02 317.212 1.98837e+02 317.212 0.8735 
1 1 1 -9  15  7  o 19 2.01532e+01 8.04127e-01 3.22313e+02 239.426 -9.34821e+00 -1.58237e+01 0.00000e+00 0.00000e+00 4.15425e+02 239.426 9.31126e+01 239.426 0.9724 
1 1 1 -9  15  8  o 14 4.34963e+00 1.21967e+00 1.29303e+02 338.239 1.72663e+00  -6.89243e-01 0.00000e+00 0.00000e+00 1.91564e+01 158.239 1.48459e+02 158.239 0.6732 
1 1 1 -9  15  9  f 0  4.44691e+01 8.87742e-01 7.32816e+02 208.117 -1.27276e+02 -6.80077e+01 0.00000e+00 0.00000e+00 9.32597e+02 208.117 1.99782e+02 208.117 0.9965 
1 1 1 -9  15  10 o 5  1.72112e+01 6.80007e-01 3.02811e+02 207.599 -2.63133e+01 -1.37559e+01 0.00000e+00 0.00000e+00 3.32422e+02 207.599 2.96106e+01 207.599 0.9830 
1 1 1 -9  15  11 o 6  7.27103e+00 9.32438e-01 2.00763e+02 177.892 -9.98743e+00 3.67620e-01  0.00000e+00 0.00000e+00 5.79343e+01 177.892 1.42829e+02 357.892 0.9486 
1 1 1 -9  15  12 f 0  1.86732e+01 6.24634e-01 4.23856e+02 77.352  1.56952e+01  6.99392e+01  0.00000e+00 0.00000e+00 2.70901e+02 77.352  1.52956e+02 257.352 0.9930 
1 1 1 -9  15  13 o 8  5.93508e+00 8.61117e-01 8.10809e+01 102.005 -9.80901e-01 4.61267e+00  0.00000e+00 0.00000e+00 1.15801e+02 102.005 3.47199e+01 102.005 0.8863 
1 1 1 -9  15  14 o 4  3.25368e+00 8.69641e-01 8.03742e+01 300.525 1.69375e+00  -2.87257e+00 0.00000e+00 0.00000e+00 2.08181e+01 300.525 5.95561e+01 120.525 0.8320 
1 1 1 -9  15  15 o 7  5.58736e+00 7.56299e-01 1.18158e+02 11.214  9.85355e+00  1.95360e+00  0.00000e+00 0.00000e+00 7.97738e+01 11.214  3.83846e+01 191.214 0.9488 
1 1 1 -9  15  16 o 4  4.62022e+00 8.48901e-01 3.84108e+01 165.746 -2.89257e+00 7.34839e-01  0.00000e+00 0.00000e+00 1.00927e+02 165.746 6.25157e+01 165.746 0.8088 
1 1 1 -9  15  17 o 8  5.41975e+00 1.46355e+00 7.97929e+01 324.362 4.29252e+00  -3.07746e+00 0.00000e+00 0.00000e+00 1.01737e+02 324.362 2.19438e+01 324.362 0.8995 
1 1 1 -9  15  18 o 17 4.53736e+00 1.36828e+00 1.36597e+02 277.435 1.15453e+00  -8.84687e+00 0.00000e+00 0.00000e+00 2.23543e+01 277.435 1.14243e+02 97.435  0.9422 
1 1 1 -9  16  1  f 0  1.27355e+01 6.67073e-01 9.43257e+01 303.945 1.26762e+00  -1.88324e+00 0.00000e+00 0.00000e+00 2.60534e+02 303.945 1.66208e+02 303.945 0.7375 
1 1 1 -9  16  2  o 2  1.83862e+01 5.85183e-01 3.22821e+02 305.450 6.08133e+00  -8.54148e+00 0.00000e+00 0.00000e+00 3.37526e+02 305.450 1.47052e+01 305.450 0.9510 
1 1 1 -9  16  3  f 0  3.04586e+01 7.16665e-01 3.34627e+02 78.227  3.54281e+00  1.69984e+01  0.00000e+00 0.00000e+00 7.81412e+02 78.227  4.46785e+02 78.227  0.9708 
1 1 1 -9  16  4  o 6  2.12944e+01 6.19760e-01 4.50396e+02 15.261  1.93912e+01  5.29058e+00  0.00000e+00 0.00000e+00 3.32645e+02 15.261  1.17751e+02 195.261 0.9748 
1 1 1 -9  16  5  o 11 2.98096e+01 7.14136e-01 6.18745e+02 247.857 -1.53430e+01 -3.77048e+01 0.00000e+00 0.00000e+00 4.91151e+02 247.857 1.27594e+02 67.857  0.9876 
1 1 1 -9  16  6  o 1  2.26223e+01 6.62495e-01 3.72439e+02 308.779 1.37480e+01  -1.71116e+01 0.00000e+00 0.00000e+00 4.60155e+02 308.779 8.77161e+01 308.779 0.9769 
1 1 1 -9  16  7  o 4  8.84416e+00 9.41892e-01 2.78686e+02 99.066  -1.08303e+00 6.78726e+00  0.00000e+00 0.00000e+00 2.89686e+01 99.066  2.49718e+02 279.066 0.9241 
1 1 1 -9  16  8  o 13 2.26870e+01 7.02221e-01 4.37893e+02 216.405 -2.81221e+01 -2.07373e+01 0.00000e+00 0.00000e+00 4.03130e+02 216.405 3.47627e+01 36.405  0.9856 
1 1 1 -9  16  9  o 12 1.76959e+01 6.65474e-01 3.24493e+02 199.637 -2.46151e+01 -8.78309e+00 0.00000e+00 0.00000e+00 3.27666e+02 199.637 3.17277e+00 199.637 0.9807 
1 1 1 -9  16  10 o 8  9.42810e+00 8.67520e-01 1.12432e+02 273.777 3.85364e-01  -5.83790e+00 0.00000e+00 0.00000e+00 2.09673e+02 273.777 9.72412e+01 273.777 0.9100 
1 1 1 -9  16  11 f 0  2.35129e+01 6.54844e-01 4.33133e+02 267.185 -3.62406e+00 -7.37109e+01 0.00000e+00 0.00000e+00 4.42764e+02 267.185 9.63118e+00 267.185 0.9932 
1 1 1 -9  16  12 o 18 1.55714e+01 6.28539e-01 2.94159e+02 96.199  -4.73197e+00 4.35649e+01  0.00000e+00 0.00000e+00 2.82556e+02 96.199  1.16027e+01 276.199 0.9885 
1 1 1 -9  16  13 o 2  9.26337e+00 6.76536e-01 1.64891e+02 272.760 7.59571e-01  -1.57541e+01 0.00000e+00 0.00000e+00 1.70610e+02 272.760 5.71950e+00 272.760 0.9678 
1 1 1 -9  16  14 o 4  7.79427e+00 6.90468e-01 8.22887e+01 86.941  4.67285e-01  8.74485e+00  0.00000e+00 0.00000e+00 1.91885e+02 86.941  1.09597e+02 86.941  0.9410 
1 1 1 -9  16  15 o 14 3.83150e+00 8.61779e-01 1.27418e+02 303.195 3.87654e+00  -5.92498e+00 0.00000e+00 0.00000e+00 5.09987e+00 303.195 1.22319e+02 123.196 0.9264 
1 1 1 -9  16  16 o 15 5.04227e+00 9.40164e-01 5.93728e+01 247.646 -1.72884e+00 -4.20415e+00 0.00000e+00 0.00000e+00 1.06378e+02 247.646 4.70057e+01 247.646 0.8817 
1 1 1 -9  16  17 o 17 8.15031e+00 1.65228e+00 1.80079e+02 286.176 4.44807e+00  -1.53346e+01 0.00000e+00 0.00000e+00 1.13724e+02 286.176 6.63554e+01 106.176 0.9682 
1 1 1 -9  16  18 o 6  6.99188e+00 1.75872e+00 1.31077e+02 111.232 -3.59958e+00 9.26485e+00  0.00000e+00 0.00000e+00 1.15438e+02 111.232 1.56389e+01 291.232 0.9483 
1 1 1 -9  17  1  o 6  1.28389e+01 5.81674e-01 3.42028e+02 90.236  -3.41442e-02 8.30600e+00  0.00000e+00 0.00000e+00 1.12811e+02 90.236  2.29216e+02 270.236 0.9377 
1 1 1 -9  17  2  o 1  2.45468e+01 6.46508e-01 3.79850e+02 39.980  1.25551e+01  1.05277e+01  0.00000e+00 0.00000e+00 5.18349e+02 39.980  1.38499e+02 39.980  0.9690 
1 1 1 -9  17  3  o 9  1.03924e+01 6.50421e-01 1.77150e+02 120.814 -1.60690e+00 2.69406e+00  0.00000e+00 0.00000e+00 1.44336e+02 120.814 3.28143e+01 300.814 0.8196 
1 1 1 -9  17  4  f 0  3.25104e+01 7.46826e-01 5.86620e+02 60.476  1.95510e+01  3.45227e+01  0.00000e+00 0.00000e+00 6.24156e+02 60.476  3.75353e+01 60.476  0.9873 
1 1 1 -9  17  5  o 11 2.13157e+01 9.41680e-01 2.81336e+02 155.071 -1.30298e+01 6.05628e+00  0.00000e+00 0.00000e+00 4.93720e+02 155.071 2.12384e+02 155.071 0.9645 
1 1 1 -9  17  6  o 8  1.99436e+01 6.51075e-01 3.76916e+02 312.868 1.33178e+01  -1.43478e+01 0.00000e+00 0.00000e+00 3.54927e+02 312.868 2.19899e+01 132.868 0.9741 
1 1 1 -9  17  7  o 1  3.46391e+01 8.01850e-01 4.52374e+02 278.673 7.49586e+00  -4.91372e+01 0.00000e+00 0.00000e+00 8.38334e+02 278.673 3.85960e+02 278.673 0.9899 
1 1 1 -9  17  8  o 7  1.04671e+01 1.08269e+00 2.15421e+02 144.150 -5.99784e+00 4.33379e+00  0.00000e+00 0.00000e+00 1.50600e+02 144.150 6.48207e+01 324.150 0.9297 
1 1 1 -9  17  9  o 9  2.16308e+01 6.55854e-01 3.65464e+02 65.209  1.59566e+01  3.45483e+01  0.00000e+00 0.00000e+00 4.36628e+02 65.209  7.11640e+01 65.209  0.9868 
1 1 1 -9  17  10 o 1  1.08757e+01 7.83312e-01 1.59397e+02 169.294 -9.52709e+00 1.80110e+00  0.00000e+00 0.00000e+00 2.27240e+02 169.294 6.78428e+01 169.294 0.9469 
1 1 1 -9  17  11 f 0  7.58544e+00 9.30385e-01 1.75549e+02 90.314  -5.25176e-02 9.59500e+00  0.00000e+00 0.00000e+00 9.36830e+01 90.314  8.18660e+01 270.314 0.9464 
1 1 1 -9  17  12 o 7  1.85368e+01 6.17754e-01 3.25621e+02 61.732  2.73821e+01  5.09213e+01  0.00000e+00 0.00000e+00 3.62827e+02 61.732  3.72061e+01 61.732  0.9913 
1 1 1 -9  17  13 o 12 2.38246e+00 7.50740e-01 7.37778e+01 301.534 1.00817e+00  -1.64298e+00 0.00000e+00 0.00000e+00 1.26573e+01 121.534 8.64351e+01 121.534 0.6855 
1 1 1 -9  17  14 o 19 1.43686e+01 5.35475e-01 1.89420e+02 230.002 -2.50865e+01 -2.98988e+01 0.00000e+00 0.00000e+00 3.40729e+02 230.002 1.51309e+02 230.002 0.9871 
1 1 1 -9  17  15 o 15 3.12587e+00 7.63726e-01 1.14693e+02 332.934 4.86797e+00  -2.48741e+00 0.00000e+00 0.00000e+00 9.29590e+00 152.934 1.23989e+02 152.934 0.9032 
1 1 1 -9  17  16 o 10 1.00307e+01 7.71788e-01 1.83918e+02 161.053 -2.88213e+01 9.89407e+00  0.00000e+00 0.00000e+00 1.83866e+02 161.053 5.17076e-02 341.053 0.9835 
1 1 1 -9  17  17 o 9  4.46103e+00 1.37056e+00 6.36407e+01 17.967  3.54776e+00  1.15050e+00  0.00000e+00 0.00000e+00 7.79129e+01 17.967  1.42722e+01 17.967  0.8523 
1 1 1 -9  17  18 o 2  4.65897e+00 1.41257e+00 7.73149e+01 356.529 5.04593e+00  -3.06067e-01 0.00000e+00 0.00000e+00 7.76504e+01 356.529 3.35528e-01 356.529 0.8946 
1 1 1 -9  18  1  o 2  1.10085e+01 5.92611e-01 2.59078e+02 71.420  1.60376e+00  4.77110e+00  0.00000e+00 0.00000e+00 1.12780e+02 71.420  1.46298e+02 251.420 0.8942 
1 1 1 -9  18  2  f 0  2.10322e+01 9.30825e-01 5.98205e+02 26.381  1.90753e+01  9.46105e+00  0.00000e+00 0.00000e+00 1.77104e+02 26.381  4.21101e+02 206.381 0.9762 
1 1 1 -9  18  3  o 16 2.40924e+01 6.37945e-01 4.62644e+02 305.825 1.12221e+01  -1.55454e+01 0.00000e+00 0.00000e+00 4.22589e+02 305.825 4.00543e+01 125.825 0.9736 
1 1 1 -9  18  4  o 4  2.30651e+01 6.35190e-01 3.75223e+02 78.460  3.61589e+00  1.77096e+01  0.00000e+00 0.00000e+00 4.70357e+02 78.460  9.51342e+01 78.460  0.9719 
1 1 1 -9  18  5  o 16 2.97735e+01 1.04802e+00 4.45906e+02 262.163 -4.28714e+00 -3.11485e+01 0.00000e+00 0.00000e+00 6.58423e+02 262.163 2.12517e+02 262.163 0.9840 
1 1 1 -9  18  6  o 4  1.43227e+01 6.47275e-01 1.67592e+02 359.576 6.57863e+00  -4.86223e-02 0.00000e+00 0.00000e+00 3.29041e+02 359.576 1.61449e+02 359.576 0.9205 
1 1 1 -9  18  7  f 0  9.65131e+00 8.80668e-01 1.76366e+02 357.724 5.34246e+00  -2.12314e-01 0.00000e+00 0.00000e+00 1.50892e+02 357.724 2.54738e+01 177.724 0.9008 
1 1 1 -9  18  8  o 14 7.25744e+00 1.04490e+00 2.56940e+01 130.177 -3.96182e-01 4.69194e-01  0.00000e+00 0.00000e+00 5.43957e+01 130.177 2.87017e+01 130.177 0.2934 
1 1 1 -9  18  9  o 17 2.28616e+01 6.55389e-01 3.73170e+02 76.969  9.24799e+00  3.99579e+01  0.00000e+00 0.00000e+00 4.75347e+02 76.969  1.02177e+02 76.969  0.9877 
1 1 1 -9  18  10 o 9  7.97828e+00 9.63792e-01 1.62550e+02 292.292 2.83012e+00  -6.90313e+00 0.00000e+00 0.00000e+00 1.16099e+02 292.292 4.64506e+01 112.292 0.9303 
1 1 1 -9  18  11 o 16 1.16943e+01 6.93074e-01 1.32233e+02 84.603  1.10409e+00  1.16873e+01  0.00000e+00 0.00000e+00 2.87223e+02 84.603  1.54990e+02 84.603  0.9564 
1 1 1 -9  18  12 o 7  5.47014e+00 9.48693e-01 1.89892e+02 324.836 7.43320e+00  -5.23650e+00 0.00000e+00 0.00000e+00 3.41643e+00 324.836 1.86475e+02 144.836 0.9433 
1 1 1 -9  18  13 o 6  1.38036e+01 5.74855e-01 2.14934e+02 191.890 -3.34014e+01 -7.03288e+00 0.00000e+00 0.00000e+00 2.93989e+02 191.890 7.90553e+01 191.890 0.9852 
1 1 1 -9  18  14 o 11 6.25592e+00 7.39649e-01 8.14792e+01 279.061 1.11669e+00  -7.00211e+00 0.00000e+00 0.00000e+00 1.35167e+02 279.061 5.36881e+01 279.061 0.9265 
1 1 1 -9  18  15 o 8  5.50437e+00 6.94227e-01 1.33857e+02 29.222  1.00872e+01  5.64262e+00  0.00000e+00 0.00000e+00 6.25206e+01 29.222  7.13364e+01 209.222 0.9557 
1 1 1 -9  18  16 o 19 6.21768e+00 8.03301e-01 8.94474e+01 341.563 8.57537e+00  -2.85875e+00 0.00000e+00 0.00000e+00 1.29130e+02 341.563 3.96828e+01 341.563 0.9429 
1 1 1 -9  18  17 o 3  9.01645e+00 1.66652e+00 1.76676e+02 189.559 -1.69078e+01 -2.84738e+00 0.00000e+00 0.00000e+00 1.49066e+02 189.559 2.76095e+01 9.559   0.9704 
1 1 1 -9  18  18 o 11 5.65348e+00 1.57063e+00 8.12247e+01 310.663 3.73707e+00  -4.35036e+00 0.00000e+00 0.00000e+00 1.09625e+02 310.663 2.83998e+01 310.663 0.9080 
1 1 1 -9  19  1  o 18 1.97578e+01 5.81798e-01 5.19555e+02 295.520 7.78458e+00  -1.63059e+01 0.00000e+00 0.00000e+00 2.05855e+02 295.520 3.13700e+02 115.520 0.9719 
1 1 1 -9  19  2  o 7  4.21079e+01 8.47296e-01 8.53492e+02 28.818  5.33743e+01  2.93643e+01  0.00000e+00 0.00000e+00 7.23341e+02 28.818  1.30151e+02 208.818 0.9918 
1 1 1 -9  19  3  o 19 4.93710e+01 1.01776e+00 8.50967e+02 196.528 -6.77999e+01 -2.01195e+01 0.00000e+00 0.00000e+00 9.99036e+02 196.528 1.48069e+02 196.528 0.9929 
1 1 1 -9  19  4  o 17 2.41005e+01 7.61485e-01 3.19064e+02 292.653 6.40692e+00  -1.53515e+01 0.00000e+00 0.00000e+00 5.62186e+02 292.653 2.43122e+02 292.653 0.9695 
1 1 1 -9  19  5  o 13 7.84005e+00 8.15939e-01 1.31174e+02 14.596  2.39804e+00  6.24483e-01  0.00000e+00 0.00000e+00 9.41834e+01 14.596  3.69908e+01 194.596 0.7626 
1 1 1 -9  19  6  o 18 3.30477e+01 9.14594e-01 4.39115e+02 305.292 2.24598e+01  -3.17300e+01 0.00000e+00 0.00000e+00 7.89580e+02 305.292 3.50465e+02 305.292 0.9871 
1 1 1 -9  19  7  o 5  1.48196e+01 6.83971e-01 2.92441e+02 274.103 9.90101e-01  -1.38015e+01 0.00000e+00 0.00000e+00 2.44797e+02 274.103 4.76438e+01 94.103  0.9632 
1 1 1 -9  19  8  o 16 3.95521e+00 1.12996e+00 1.42563e+02 145.597 -1.70754e+00 1.16930e+00  0.00000e+00 0.00000e+00 3.71214e+01 325.597 1.79684e+02 325.597 0.7089 
1 1 1 -9  19  9  o 11 9.10159e+00 8.52289e-01 1.04625e+02 244.556 -1.87470e+00 -3.94028e+00 0.00000e+00 0.00000e+00 1.95016e+02 244.556 9.03909e+01 244.556 0.8762 
1 1 1 -9  19  10 o 6  9.34613e+00 1.05232e+00 1.09939e+02 333.416 5.17783e+00  -2.59100e+00 0.00000e+00 0.00000e+00 2.08966e+02 333.416 9.90269e+01 333.416 0.9090 
1 1 1 -9  19  11 o 2  2.92903e+01 6.96658e-01 4.90551e+02 71.623  3.71969e+01  1.11965e+02  0.00000e+00 0.00000e+00 6.03207e+02 71.623  1.12656e+02 71.623  0.9958 
1 1 1 -9  19  12 o 19 4.41357e+00 1.01118e+00 6.31760e+01 187.838 -2.39742e+00 -3.30023e-01 0.00000e+00 0.00000e+00 6.18216e+01 187.838 1.35437e+00 7.838   0.7560 
1 1 1 -9  19  13 o 12 1.17479e+01 5.82713e-01 2.39978e+02 45.615  2.38107e+01  2.43278e+01  0.00000e+00 0.00000e+00 1.93114e+02 45.615  4.68638e+01 225.615 0.9852 
1 1 1 -9  19  14 o 1  1.88796e+01 5.59576e-01 2.77332e+02 220.607 -5.88313e+01 -5.04364e+01 0.00000e+00 0.00000e+00 4.23720e+02 220.607 1.46388e+02 220.607 0.9935 
1 1 1 -9  19  15 o 15 4.84544e+00 7.15725e-01 3.87188e+01 329.967 2.52884e+00  -1.46195e+00 0.00000e+00 0.00000e+00 1.06696e+02 329.967 6.79776e+01 329.967 0.8040 
1 1 1 -9  19  16 o 18 5.01697e+00 1.34739e+00 5.13788e+01 316.432 2.38405e+00  -2.26775e+00 0.00000e+00 0.00000e+00 1.03734e+02 316.432 5.23554e+01 316.432 0.8294 
1 1 1 -9  19  17 o 9  5.35489e+00 1.35755e+00 1.09847e+02 181.771 -7.87508e+00 -2.43553e-01 0.00000e+00 0.00000e+00 7.63879e+01 181.771 3.34591e+01 1.771   0.9342 
1 1 1 -9  19  18 o 11 4.63132e+00 1.40553e+00 6.82365e+01 330.376 3.86997e+00  -2.20062e+00 0.00000e+00 0.00000e+00 8.30827e+01 330.376 1.48462e+01 330.376 0.8789 
1 1 1 -9  20  1  o 4  1.69596e+01 5.64392e-01 2.41558e+02 103.086 -1.59549e+00 6.86380e+00  0.00000e+00 0.00000e+00 3.51697e+02 103.086 1.10139e+02 103.086 0.9261 
1 1 1 -9  20  2  o 13 3.19921e+01 7.02306e-01 7.14940e+02 311.349 2.57149e+01  -2.92198e+01 0.00000e+00 0.00000e+00 4.77356e+02 311.349 2.37584e+02 131.349 0.9871 
1 1 1 -9  20  3  o 19 2.05710e+01 6.44761e-01 4.07831e+02 155.581 -1.60363e+01 7.28070e+00  0.00000e+00 0.00000e+00 3.46090e+02 155.581 6.17405e+01 335.581 0.9712 
1 1 1 -9  20  4  o 19 1.59984e+01 7.45174e-01 2.30435e+02 162.681 -7.60278e+00 2.37075e+00  0.00000e+00 0.00000e+00 3.33687e+02 162.681 1.03252e+02 162.681 0.9349 
1 1 1 -9  20  5  o 11 1.41107e+01 6.27989e-01 3.00590e+02 136.272 -7.37327e+00 7.05295e+00  0.00000e+00 0.00000e+00 2.04487e+02 136.272 9.61033e+01 316.272 0.9497 
1 1 1 -9  20  6  o 19 2.63994e+01 6.91236e-01 3.42022e+02 135.391 -1.79560e+01 1.77123e+01  0.00000e+00 0.00000e+00 6.32397e+02 135.391 2.90375e+02 135.391 0.9800 
1 1 1 -9  20  7  o 5  2.42240e+01 8.23147e-01 4.47651e+02 200.329 -3.10259e+01 -1.14945e+01 0.00000e+00 0.00000e+00 4.50169e+02 200.329 2.51737e+00 200.329 0.9848 
1 1 1 -9  20  8  o 16 9.12290e+00 1.18790e+00 1.23855e+02 345.749 3.97560e+00  -1.00977e+00 0.00000e+00 0.00000e+00 1.73700e+02 345.749 4.98458e+01 345.749 0.8673 
1 1 1 -9  20  9  o 7  1.66366e+01 6.61888e-01 2.62688e+02 327.537 1.72881e+01  -1.09980e+01 0.00000e+00 0.00000e+00 3.46941e+02 327.537 8.42528e+01 327.537 0.9753 
1 1 1 -9  20  10 o 3  7.24840e+00 9.70734e-01 2.26380e+02 149.231 -8.24633e+00 4.90968e+00  0.00000e+00 0.00000e+00 3.11124e+01 149.231 1.95267e+02 329.231 0.9464 
1 1 1 -9  20  11 o 11 3.06904e+00 9.11312e-01 9.68124e+01 273.665 1.47812e-01  -2.30777e+00 0.00000e+00 0.00000e+00 1.13067e+01 93.665  1.08119e+02 93.665  0.7430 
1 1 1 -9  20  12 o 16 8.27282e+00 7.47611e-01 1.07115e+02 302.796 4.50113e+00  -6.98555e+00 0.00000e+00 0.00000e+00 1.83488e+02 302.796 7.63733e+01 302.796 0.9377 
1 1 1 -9  20  13 o 10 6.78455e+00 8.01007e-01 1.06472e+02 73.734  2.28426e+00  7.82889e+00  0.00000e+00 0.00000e+00 1.31272e+02 73.734  2.48002e+01 73.734  0.9365 
1 1 1 -9  20  14 o 13 5.39472e+00 7.90799e-01 8.62611e+01 314.164 4.19968e+00  -4.32408e+00 0.00000e+00 0.00000e+00 9.77714e+01 314.164 1.15103e+01 314.164 0.9128 
1 1 1 -9  20  15 o 18 4.95529e+00 6.99862e-01 1.23505e+02 232.233 -5.86667e+00 -7.57238e+00 0.00000e+00 0.00000e+00 5.15186e+01 232.233 7.19862e+01 52.233  0.9463 
1 1 1 -9  20  16 o 10 3.34008e+00 1.09375e+00 6.93194e+01 30.142  2.99483e+00  1.73895e+00  0.00000e+00 0.00000e+00 3.51628e+01 30.142  3.41566e+01 210.142 0.8392 
1 1 1 -9  20  17 o 5  5.69409e+00 1.53273e+00 7.16366e+01 144.577 -3.95062e+00 2.80995e+00  0.00000e+00 0.00000e+00 1.16960e+02 144.577 4.53231e+01 144.577 0.8897 
1 1 1 -9  20  18 o 17 4.85482e+00 1.48007e+00 6.14491e+01 257.503 -8.93561e-01 -4.03162e+00 0.00000e+00 0.00000e+00 9.52550e+01 257.503 3.38059e+01 257.503 0.8683 
1 1 1 -9  21  1  o 15 4.79203e+01 9.38267e-01 8.50965e+02 37.509  5.44569e+01  4.18005e+01  0.00000e+00 0.00000e+00 9.45832e+02 37.509  9.48673e+01 37.509  0.9927 
1 1 1 -9  21  2  f 0  1.46879e+01 5.77680e-01 5.07999e+02 318.543 9.64597e+00  -8.52121e+00 0.00000e+00 0.00000e+00 2.45388e+01 318.543 4.83460e+02 138.543 0.9603 
1 1 1 -9  21  3  o 16 1.86344e+01 5.73916e-01 3.07383e+02 337.942 1.11513e+01  -4.51859e+00 0.00000e+00 0.00000e+00 3.65899e+02 337.942 5.85151e+01 337.942 0.9575 
1 1 1 -9  21  4  o 1  3.61365e+01 7.63047e-01 7.76710e+02 174.493 -6.01370e+01 5.79838e+00  0.00000e+00 0.00000e+00 5.74793e+02 174.493 2.01918e+02 354.493 0.9917 
1 1 1 -9  21  5  o 10 1.81826e+01 6.88714e-01 2.00496e+02 300.972 4.48858e+00  -7.47853e+00 0.00000e+00 0.00000e+00 4.44223e+02 300.972 2.43727e+02 300.972 0.9408 
1 1 1 -9  21  6  o 15 2.62042e+01 6.56603e-01 4.83543e+02 89.361  3.95038e-01  3.54083e+01  0.00000e+00 0.00000e+00 4.89346e+02 89.361  5.80299e+00 89.361  0.9858 
1 1 1 -9  21  7  o 12 1.30566e+01 6.71571e-01 1.94826e+02 304.341 4.42681e+00  -6.47956e+00 0.00000e+00 0.00000e+00 2.64082e+02 304.341 6.92561e+01 304.341 0.9339 
1 1 1 -9  21  8  o 17 2.04785e+01 6.38241e-01 4.75809e+02 320.270 3.21153e+01  -2.66909e+01 0.00000e+00 0.00000e+00 2.84977e+02 320.270 1.90831e+02 140.270 0.9880 
1 1 1 -9  21  9  o 2  1.69291e+01 6.40218e-01 2.95216e+02 78.465  4.68611e+00  2.29621e+01  0.00000e+00 0.00000e+00 3.27095e+02 78.465  3.18791e+01 78.465  0.9784 
1 1 1 -9  21  10 o 14 1.50191e+01 6.38881e-01 2.67690e+02 166.100 -2.42037e+01 5.98999e+00  0.00000e+00 0.00000e+00 2.84629e+02 166.100 1.69390e+01 166.100 0.9797 
1 1 1 -9  21  11 o 14 1.84092e+01 6.15521e-01 3.88999e+02 314.394 3.94539e+01  -4.02969e+01 0.00000e+00 0.00000e+00 2.95148e+02 314.394 9.38506e+01 134.394 0.9911 
1 1 1 -9  21  12 f 0  1.69570e+01 6.71122e-01 3.76272e+02 57.502  3.28233e+01  5.15253e+01  0.00000e+00 0.00000e+00 2.53671e+02 57.502  1.22601e+02 237.502 0.9918 
1 1 1 -9  21  13 o 10 4.10522e+00 9.22822e-01 1.68490e+02 96.320  -8.65312e-01 7.81341e+00  0.00000e+00 0.00000e+00 2.50240e+01 276.320 1.93514e+02 276.320 0.9340 
1 1 1 -9  21  14 o 12 1.83888e+01 5.25000e-01 2.77032e+02 212.467 -6.07494e+01 -3.86523e+01 0.00000e+00 0.00000e+00 4.05382e+02 212.467 1.28350e+02 212.467 0.9930 
1 1 1 -9  21  15 o 6  3.31082e+00 6.53032e-01 7.99953e+01 43.492  3.20365e+00  3.03932e+00  0.00000e+00 0.00000e+00 2.84783e+01 43.492  5.15170e+01 223.492 0.8778 
1 1 1 -9  21  16 f 0  7.70604e+00 1.48964e+00 2.05617e+02 113.083 -7.45414e+00 1.74903e+01  0.00000e+00 0.00000e+00 7.39674e+01 113.083 1.31650e+02 293.083 0.9733 
1 1 1 -9  21  17 o 17 1.02591e+01 1.58418e+00 1.59042e+02 228.649 -1.25025e+01 -1.42055e+01 0.00000e+00 0.00000e+00 2.12611e+02 228.649 5.35687e+01 228.649 0.9732 
1 1 1 -9  21  18 o 4  1.17038e+01 1.73397e+00 1.99044e+02 347.152 2.59711e+01  -5.92334e+00 0.00000e+00 0.00000e+00 2.27752e+02 347.152 2.87083e+01 347.152 0.9810 
1 1 1 -9  22  1  o 3  2.55321e+01 7.34343e-01 4.32268e+02 52.785  1.14478e+01  1.50736e+01  0.00000e+00 0.00000e+00 5.06236e+02 52.785  7.39671e+01 52.785  0.9732 
1 1 1 -9  22  2  o 9  2.17623e+01 7.60935e-01 4.59037e+02 337.727 1.57936e+01  -6.46863e+00 0.00000e+00 0.00000e+00 3.38096e+02 337.727 1.20941e+02 157.727 0.9702 
1 1 1 -9  22  3  o 9  2.16138e+01 5.86852e-01 2.47403e+02 116.100 -4.93303e+00 1.00696e+01  0.00000e+00 0.00000e+00 5.30886e+02 116.100 2.83482e+02 116.100 0.9543 
1 1 1 -9  22  4  o 7  2.18840e+01 7.83062e-01 2.17891e+02 148.298 -8.92631e+00 5.51351e+00  0.00000e+00 0.00000e+00 5.67005e+02 148.298 3.49114e+02 148.298 0.9511 
1 1 1 -9  22  5  o 12 1.78106e+01 5.83793e-01 3.07991e+02 109.835 -4.99379e+00 1.38442e+01  0.00000e+00 0.00000e+00 3.40018e+02 109.835 3.20268e+01 109.835 0.9654 
1 1 1 -9  22  6  o 2  2.84850e+01 6.83445e-01 3.98853e+02 205.089 -3.09803e+01 -1.45048e+01 0.00000e+00 0.00000e+00 6.58115e+02 205.089 2.59262e+02 205.089 0.9853 
1 1 1 -9  22  7  o 5  1.91575e+01 6.38152e-01 3.32698e+02 30.743  1.74823e+01  1.03979e+01  0.00000e+00 0.00000e+00 3.70289e+02 30.743  3.75903e+01 30.743  0.9751 
1 1 1 -9  22  8  o 4  2.56626e+01 7.54743e-01 4.40536e+02 339.939 4.48206e+01  -1.63674e+01 0.00000e+00 0.00000e+00 5.14245e+02 339.939 7.37093e+01 339.939 0.9895 
1 1 1 -9  22  9  o 15 1.46513e+01 6.49608e-01 2.40685e+02 184.746 -1.76843e+01 -1.46830e+00 0.00000e+00 0.00000e+00 2.93995e+02 184.746 5.33100e+01 184.746 0.9714 
1 1 1 -9  22  10 o 15 1.23089e+01 6.92275e-01 1.73559e+02 200.154 -1.35339e+01 -4.96722e+00 0.00000e+00 0.00000e+00 2.72106e+02 200.154 9.85473e+01 200.154 0.9647 
1 1 1 -9  22  11 o 1  1.30663e+01 6.50246e-01 1.24350e+02 270.942 2.08550e-01  -1.26872e+01 0.00000e+00 0.00000e+00 3.45849e+02 270.942 2.21500e+02 270.942 0.9597 
1 1 1 -9  22  12 o 6  4.08347e+00 9.79782e-01 8.85896e+01 32.201  2.68185e+00  1.68894e+00  0.00000e+00 0.00000e+00 3.70967e+01 32.201  5.14929e+01 212.201 0.8218 
1 1 1 -9  22  13 o 7  1.89897e+01 6.06765e-01 3.81110e+02 27.179  8.14703e+01  4.18316e+01  0.00000e+00 0.00000e+00 3.25459e+02 27.179  5.56510e+01 207.179 0.9945 
1 1 1 -9  22  14 o 13 1.18099e+01 5.16167e-01 2.13127e+02 239.147 -1.89970e+01 -3.18007e+01 0.00000e+00 0.00000e+00 2.22194e+02 239.147 9.06624e+00 239.147 0.9864 
1 1 1 -9  22  15 o 8  8.10751e+00 6.48407e-01 1.13722e+02 28.322  1.35441e+01  7.29937e+00  0.00000e+00 0.00000e+00 1.78861e+02 28.322  6.51393e+01 28.322  0.9669 
1 1 1 -9  22  16 o 11 5.77886e+00 1.41492e+00 7.87655e+01 335.553 5.22268e+00  -2.37428e+00 0.00000e+00 0.00000e+00 1.16828e+02 335.553 3.80626e+01 335.553 0.9081 
1 1 1 -9  22  17 o 5  4.54186e+00 1.36209e+00 7.00820e+01 4.765   4.28084e+00  3.56860e-01  0.00000e+00 0.00000e+00 7.76738e+01 4.765   7.59187e+00 4.765   0.8740 
1 1 1 -9  22  18 o 12 5.26402e+00 1.57334e+00 6.89531e+01 273.267 2.66783e-01  -4.67366e+00 0.00000e+00 0.00000e+00 1.04286e+02 273.267 3.53331e+01 273.267 0.8854 
1 1 1 -9  23  1  o 16 2.85985e+01 6.62078e-01 7.18729e+02 129.346 -2.23828e+01 2.73013e+01  0.00000e+00 0.00000e+00 3.45944e+02 129.346 3.72785e+02 309.346 0.9857 
1 1 1 -9  23  2  o 14 2.23890e+01 5.96876e-01 2.56654e+02 231.301 -7.55730e+00 -9.43337e+00 0.00000e+00 0.00000e+00 5.52775e+02 231.301 2.96120e+02 231.301 0.9577 
1 1 1 -9  23  3  o 13 2.19849e+01 7.35527e-01 2.53839e+02 293.522 4.62176e+00  -1.06181e+01 0.00000e+00 0.00000e+00 5.38996e+02 293.522 2.85157e+02 293.522 0.9558 
1 1 1 -9  23  4  o 7  3.53329e+01 7.49586e-01 6.88493e+02 164.425 -5.15468e+01 1.43676e+01  0.00000e+00 0.00000e+00 6.31358e+02 164.425 5.71350e+01 344.425 0.9906 
1 1 1 -9  23  5  o 3  3.71355e+01 7.74255e-01 7.07595e+02 270.304 3.68900e-01  -6.94383e+01 0.00000e+00 0.00000e+00 6.81732e+02 270.304 2.58627e+01 90.304  0.9928 
1 1 1 -9  23  6  f 0  1.51455e+01 8.01287e-01 1.60038e+02 78.614  1.42268e+00  7.06496e+00  0.00000e+00 0.00000e+00 3.69122e+02 78.614  2.09084e+02 78.614  0.9278 
1 1 1 -9  23  7  f 0  1.40907e+01 6.71400e-01 4.63213e+01 314.042 1.44040e+00  -1.48939e+00 0.00000e+00 0.00000e+00 3.29743e+02 314.042 2.83421e+02 314.042 0.7092 
1 1 1 -9  23  8  o 16 1.85846e+01 6.21311e-01 3.20757e+02 147.569 -2.14781e+01 1.36465e+01  0.00000e+00 0.00000e+00 3.64134e+02 147.569 4.33775e+01 147.569 0.9801 
1 1 1 -9  23  9  o 11 3.85921e+00 1.05368e+00 1.22656e+02 208.276 -2.10570e+00 -1.13265e+00 0.00000e+00 0.00000e+00 1.35484e+01 28.276  1.36204e+02 28.276  0.7526 
1 1 1 -9  23  10 o 4  2.43449e+01 6.34256e-01 4.23486e+02 67.596  2.67226e+01  6.48222e+01  0.00000e+00 0.00000e+00 4.83645e+02 67.596  6.01595e+01 67.596  0.9928 
1 1 1 -9  23  11 o 12 7.01661e+00 9.03613e-01 1.09878e+02 22.506  5.70770e+00  2.36492e+00  0.00000e+00 0.00000e+00 1.30843e+02 22.506  2.09650e+01 22.506  0.9150 
1 1 1 -9  23  12 o 12 9.00540e+00 7.39481e-01 1.36777e+02 49.423  8.32539e+00  9.72125e+00  0.00000e+00 0.00000e+00 1.87043e+02 49.423  5.02658e+01 49.423  0.9601 
1 1 1 -9  23  13 o 16 1.29505e+01 5.94272e-01 2.12646e+02 357.415 3.65611e+01  -1.65054e+00 0.00000e+00 0.00000e+00 2.65173e+02 357.415 5.25263e+01 357.415 0.9862 
1 1 1 -9  23  14 o 9  5.70066e+00 7.19265e-01 1.38521e+02 45.853  7.56297e+00  7.79165e+00  0.00000e+00 0.00000e+00 6.44314e+01 45.853  7.40900e+01 225.853 0.9528 
1 1 1 -9  23  15 o 1  9.14102e+00 7.33795e-01 1.32941e+02 290.274 6.31425e+00  -1.70931e+01 0.00000e+00 0.00000e+00 1.98701e+02 290.274 6.57594e+01 290.274 0.9722 
1 1 1 -9  23  16 o 2  4.05687e+00 1.24828e+00 1.01233e+02 144.817 -4.50651e+00 3.17700e+00  0.00000e+00 0.00000e+00 3.54657e+01 144.817 6.57670e+01 324.817 0.9041 
1 1 1 -9  23  17 o 9  4.13424e+00 1.31744e+00 8.30475e+01 343.808 4.74790e+00  -1.37870e+00 0.00000e+00 0.00000e+00 5.42192e+01 343.808 2.88283e+01 163.808 0.8921 
1 1 1 -9  23  18 o 9  1.24693e+01 1.84271e+00 1.98040e+02 206.406 -2.33590e+01 -1.15986e+01 0.00000e+00 0.00000e+00 2.56426e+02 206.406 5.83857e+01 206.406 0.9806 
1 1 1 -9  24  1  o 18 2.68005e+01 6.45906e-01 7.21792e+02 357.027 4.05770e+01  -2.10712e+00 0.00000e+00 0.00000e+00 2.77786e+02 357.027 4.44006e+02 177.027 0.9876 
1 1 1 -9  24  2  o 19 2.60576e+01 6.97875e-01 3.22567e+02 12.169  1.71400e+01  3.69624e+00  0.00000e+00 0.00000e+00 6.32569e+02 12.169  3.10002e+02 12.169  0.9711 
1 1 1 -9  24  3  o 13 2.47394e+01 6.20078e-01 3.47391e+02 252.192 -5.72161e+00 -1.78127e+01 0.00000e+00 0.00000e+00 5.60682e+02 252.192 2.13290e+02 252.192 0.9729 
1 1 1 -9  24  4  o 12 4.19373e+01 8.44350e-01 8.58213e+02 77.025  1.94722e+01  8.45089e+01  0.00000e+00 0.00000e+00 7.13946e+02 77.025  1.44267e+02 257.025 0.9942 
1 1 1 -9  24  5  o 19 2.24416e+01 7.24061e-01 3.17350e+02 284.009 4.47220e+00  -1.79254e+01 0.00000e+00 0.00000e+00 5.05086e+02 284.009 1.87736e+02 284.009 0.9725 
1 1 1 -9  24  6  o 16 1.54223e+01 6.12427e-01 2.79372e+02 99.882  -2.12626e+00 1.22051e+01  0.00000e+00 0.00000e+00 2.77414e+02 99.882  1.95865e+00 279.882 0.9588 
1 1 1 -9  24  7  o 19 9.89122e+00 8.37062e-01 1.13572e+02 80.244  6.14405e-01  3.57357e+00  0.00000e+00 0.00000e+00 2.01822e+02 80.244  8.82502e+01 80.244  0.8474 
1 1 1 -9  24  8  o 13 8.23499e+00 8.85607e-01 1.44920e+02 292.129 1.85515e+00  -4.56201e+00 0.00000e+00 0.00000e+00 1.31128e+02 292.129 1.37915e+01 112.129 0.8916 
1 1 1 -9  24  9  o 12 1.41450e+01 6.57399e-01 3.29903e+02 293.467 1.00090e+01  -2.30549e+01 0.00000e+00 0.00000e+00 1.90749e+02 293.467 1.39154e+02 113.467 0.9799 
1 1 1 -9  24  10 o 1  1.38870e+01 6.42775e-01 2.40931e+02 116.181 -1.03650e+01 2.10825e+01  0.00000e+00 0.00000e+00 2.69003e+02 116.181 2.80723e+01 116.181 0.9785 
1 1 1 -9  24  11 o 18 1.38361e+01 6.32913e-01 2.51107e+02 88.303  8.77626e-01  2.96269e+01  0.00000e+00 0.00000e+00 2.58784e+02 88.303  7.67745e+00 88.303  0.9830 
1 1 1 -9  24  12 o 3  1.46790e+01 6.19147e-01 2.23844e+02 218.968 -2.73734e+01 -2.21413e+01 0.00000e+00 0.00000e+00 3.18025e+02 218.968 9.41812e+01 218.968 0.9857 
1 1 1 -9  24  13 o 2  9.29819e+00 6.68082e-01 1.73977e+02 17.855  1.99758e+01  6.43454e+00  0.00000e+00 0.00000e+00 1.65460e+02 17.855  8.51652e+00 197.855 0.9759 
1 1 1 -9  24  14 o 15 7.01380e+00 6.21308e-01 6.18197e+01 59.483  3.32540e+00  5.64153e+00  0.00000e+00 0.00000e+00 1.79309e+02 59.483  1.17489e+02 59.483  0.9201 
1 1 1 -9  24  15 o 3  1.17653e+01 1.18140e+00 2.18537e+02 241.558 -1.47959e+01 -2.73167e+01 0.00000e+00 0.00000e+00 2.13387e+02 241.558 5.15028e+00 61.558  0.9838 
1 1 1 -9  24  16 o 13 4.61388e+00 1.28628e+00 6.23587e+01 95.808  -3.81363e-01 3.74951e+00  0.00000e+00 0.00000e+00 8.44888e+01 95.808  2.21302e+01 95.808  0.8540 
1 1 1 -9  24  17 o 15 1.18247e+01 1.58118e+00 1.25887e+02 169.832 -1.74992e+01 3.13839e+00  0.00000e+00 0.00000e+00 3.01635e+02 169.832 1.75748e+02 169.832 0.9715 
1 1 1 -9  24  18 o 16 3.88717e+00 1.30069e+00 5.61693e+01 179.737 -3.63047e+00 1.66668e-02  0.00000e+00 0.00000e+00 6.62831e+01 179.737 1.01138e+01 179.737 0.8476 
1 1 1 -9  25  1  o 8  2.78028e+01 8.53556e-01 5.21279e+02 112.254 -1.13510e+01 2.77397e+01  0.00000e+00 0.00000e+00 5.10951e+02 112.254 1.03279e+01 292.254 0.9832 
1 1 1 -9  25  2  o 12 1.79251e+01 5.64912e-01 2.80444e+02 181.483 -1.05377e+01 -2.72754e-01 0.00000e+00 0.00000e+00 3.63201e+02 181.483 8.27567e+01 181.483 0.9513 
1 1 1 -9  25  3  o 8  4.08983e+01 9.81718e-01 8.79851e+02 50.569  4.84568e+01  5.89274e+01  0.00000e+00 0.00000e+00 6.52913e+02 50.569  2.26938e+02 230.569 0.9934 
1 1 1 -9  25  4  o 7  2.19645e+01 7.78481e-01 2.79738e+02 258.391 -2.94967e+00 -1.43584e+01 0.00000e+00 0.00000e+00 5.19638e+02 258.391 2.39899e+02 258.391 0.9653 
1 1 1 -9  25  5  o 8  1.82663e+01 9.54864e-01 2.38986e+02 337.750 1.08053e+01  -4.42062e+00 0.00000e+00 0.00000e+00 4.19112e+02 337.750 1.80127e+02 337.750 0.9562 
1 1 1 -9  25  6  o 8  1.49587e+01 6.16416e-01 3.64770e+02 260.817 -2.49597e+00 -1.54389e+01 0.00000e+00 0.00000e+00 1.80160e+02 260.817 1.84610e+02 80.817  0.9675 
1 1 1 -9  25  7  o 4  1.35585e+01 6.64194e-01 1.99943e+02 151.077 -8.40861e+00 4.64617e+00  0.00000e+00 0.00000e+00 2.82863e+02 151.077 8.29198e+01 151.077 0.9464 
1 1 1 -9  25  8  o 6  1.89612e+01 7.51013e-01 2.78199e+02 239.389 -1.16177e+01 -1.96359e+01 0.00000e+00 0.00000e+00 4.18825e+02 239.389 1.40626e+02 239.389 0.9778 
1 1 1 -9  25  9  o 18 5.25475e+00 1.07489e+00 1.14217e+02 328.008 2.79052e+00  -1.74320e+00 0.00000e+00 0.00000e+00 4.94740e+01 328.008 6.47427e+01 148.007 0.8293 
1 1 1 -9  25  10 o 8  6.97896e+00 8.86372e-01 1.42342e+02 34.356  5.47918e+00  3.74544e+00  0.00000e+00 0.00000e+00 9.89200e+01 34.356  4.34222e+01 214.356 0.9212 
1 1 1 -9  25  11 o 14 1.11966e+01 6.70690e-01 2.81918e+02 195.357 -2.61031e+01 -7.16905e+00 0.00000e+00 0.00000e+00 1.29988e+02 195.357 1.51930e+02 15.357  0.9814 
1 1 1 -9  25  12 o 7  9.60299e+00 6.82284e-01 1.89991e+02 54.128  1.10775e+01  1.53184e+01  0.00000e+00 0.00000e+00 1.59975e+02 54.128  3.00152e+01 234.127 0.9732 
1 1 1 -9  25  13 f 0  4.27030e+00 7.99909e-01 5.19232e+01 224.078 -1.96985e+00 -1.90747e+00 0.00000e+00 0.00000e+00 7.40977e+01 224.078 2.21745e+01 224.078 0.7889 
1 1 1 -9  25  14 o 18 9.85851e+00 5.10370e-01 1.94153e+02 249.710 -1.03819e+01 -2.80809e+01 0.00000e+00 0.00000e+00 1.67968e+02 249.710 2.61847e+01 69.710  0.9832 
1 1 1 -9  25  15 o 1  4.14337e+00 1.14146e+00 3.98049e+01 108.352 -7.07352e-01 2.13231e+00  0.00000e+00 0.00000e+00 7.37368e+01 108.352 3.39319e+01 108.352 0.7344 
1 1 1 -9  25  16 o 11 5.40780e+00 1.41878e+00 1.00467e+02 191.910 -6.50376e+00 -1.37172e+00 0.00000e+00 0.00000e+00 8.52117e+01 191.910 1.52553e+01 11.910  0.9214 
1 1 1 -9  25  17 o 11 1.21081e+01 1.65608e+00 1.48718e+02 10.437  1.99828e+01  3.68103e+00  0.00000e+00 0.00000e+00 2.90651e+02 10.437  1.41933e+02 10.437  0.9751 
1 1 1 -9  25  18 o 1  3.02933e+00 1.06537e+00 2.39146e+01 0.495   1.48873e+00  1.28629e-02  0.00000e+00 0.00000e+00 4.28810e+01 0.495   1.89664e+01 0.495   0.5933 
1 1 1 -9  26  1  o 10 1.80048e+01 7.17998e-01 2.19250e+02 1.893   8.21469e+00  2.71464e-01  0.00000e+00 0.00000e+00 4.17793e+02 1.893   1.98544e+02 1.893   0.9370 
1 1 1 -9  26  2  o 5  2.37996e+01 6.91164e-01 5.53598e+02 108.845 -9.24313e+00 2.70823e+01  0.00000e+00 0.00000e+00 3.28819e+02 108.845 2.24779e+02 288.845 0.9824 
1 1 1 -9  26  3  o 3  8.54624e+00 7.48868e-01 1.06339e+02 81.996  2.78995e-01  1.98409e+00  0.00000e+00 0.00000e+00 1.18806e+02 81.996  1.24674e+01 81.996  0.6984 
1 1 1 -9  26  4  o 14 1.82211e+01 5.76240e-01 2.33571e+02 14.186  9.94346e+00  2.51342e+00  0.00000e+00 0.00000e+00 4.18983e+02 14.186  1.85412e+02 14.186  0.9499 
1 1 1 -9  26  5  f 0  8.91214e+00 7.18513e-01 1.07200e+02 177.224 -2.59836e+00 1.25966e-01  0.00000e+00 0.00000e+00 1.53232e+02 177.224 4.60321e+01 177.224 0.7756 
1 1 1 -9  26  6  o 12 2.44742e+01 6.35147e-01 4.47496e+02 341.099 3.33259e+01  -1.14109e+01 0.00000e+00 0.00000e+00 4.60802e+02 341.099 1.33061e+01 341.099 0.9857 
1 1 1 -9  26  7  o 9  3.58682e+01 7.77773e-01 5.61077e+02 142.504 -5.58095e+01 4.28178e+01  0.00000e+00 0.00000e+00 7.78736e+02 142.504 2.17660e+02 142.504 0.9929 
1 1 1 -9  26  8  o 1  1.54225e+01 6.28031e-01 3.47400e+02 345.900 2.27364e+01  -5.71103e+00 0.00000e+00 0.00000e+00 2.19848e+02 345.900 1.27551e+02 165.900 0.9784 
1 1 1 -9  26  9  o 9  7.89183e+00 8.41935e-01 1.15915e+02 227.824 -3.52119e+00 -3.88663e+00 0.00000e+00 0.00000e+00 1.50480e+02 227.824 3.45646e+01 227.824 0.8988 
1 1 1 -9  26  10 f 0  5.32519e+00 1.03102e+00 2.40205e+02 45.225  6.11071e+00  6.15883e+00  0.00000e+00 0.00000e+00 5.22846e+01 225.225 2.92490e+02 225.225 0.9405 
1 1 1 -9  26  11 o 7  9.37898e+00 7.36559e-01 2.03553e+02 37.390  1.27922e+01  9.77694e+00  0.00000e+00 0.00000e+00 1.36919e+02 37.390  6.66340e+01 217.390 0.9684 
1 1 1 -9  26  12 o 19 5.87814e+00 9.27435e-01 1.46963e+02 64.812  3.53297e+00  7.51205e+00  0.00000e+00 0.00000e+00 5.94281e+01 64.812  8.75346e+01 244.812 0.9377 
1 1 1 -9  26  13 o 10 4.25947e+00 9.00325e-01 6.54196e+01 230.274 -2.11676e+00 -2.54733e+00 0.00000e+00 0.00000e+00 6.69167e+01 230.274 1.49707e+00 230.274 0.8306 
1 1 1 -9  26  14 o 5  2.39231e+00 7.26006e-01 1.21352e+02 200.528 -3.85165e+00 -1.44221e+00 0.00000e+00 0.00000e+00 4.38008e+01 20.528  1.65153e+02 20.528  0.8677 
1 1 1 -9  26  15 o 11 3.98034e+00 1.17963e+00 8.59025e+01 17.572  4.33859e+00  1.37392e+00  0.00000e+00 0.00000e+00 4.50588e+01 17.572  4.08437e+01 197.572 0.8818 
1 1 1 -9  26  16 o 19 6.75616e+00 1.53421e+00 1.54288e+02 131.342 -7.45066e+00 8.46837e+00  0.00000e+00 0.00000e+00 8.60354e+01 131.342 6.82521e+01 311.342 0.9546 
1 1 1 -9  26  17 o 5  6.53640e+00 1.64440e+00 8.56301e+01 88.225  1.99830e-01  6.44822e+00  0.00000e+00 0.00000e+00 1.37864e+02 88.225  5.22335e+01 88.225  0.9188 
1 1 1 -9  26  18 o 18 5.42298e+00 1.64304e+00 1.30291e+02 205.491 -8.19999e+00 -3.90954e+00 0.00000e+00 0.00000e+00 5.97828e+01 205.491 7.05082e+01 25.491  0.9432 
1 1 1 -9  27  1  o 1  1.59924e+01 8.08023e-01 2.88996e+02 335.146 9.04814e+00  -4.19126e+00 0.00000e+00 0.00000e+00 2.83697e+02 335.146 5.29966e+00 155.146 0.9484 
1 1 1 -9  27  2  o 4  2.00788e+01 6.70661e-01 2.59816e+02 120.986 -5.82090e+00 9.69312e+00  0.00000e+00 0.00000e+00 4.63623e+02 120.986 2.03807e+02 120.986 0.9547 
1 1 1 -9  27  3  o 12 2.56972e+01 6.27644e-01 6.41062e+02 336.518 3.70215e+01  -1.60837e+01 0.00000e+00 0.00000e+00 3.16157e+02 336.518 3.24905e+02 156.518 0.9875 
1 1 1 -9  27  4  o 6  2.54972e+01 6.27822e-01 3.33182e+02 236.261 -1.26293e+01 -1.89087e+01 0.00000e+00 0.00000e+00 6.06643e+02 236.261 2.73461e+02 236.261 0.9778 
1 1 1 -9  27  5  o 4  1.08875e+01 6.19914e-01 3.28084e+02 353.774 9.96125e+00  -1.08667e+00 0.00000e+00 0.00000e+00 6.10566e+01 353.774 2.67028e+02 173.774 0.9487 
1 1 1 -9  27  6  o 4  3.58065e+01 7.62517e-01 6.07586e+02 292.254 2.61398e+01  -6.38827e+01 0.00000e+00 0.00000e+00 7.30660e+02 292.254 1.23073e+02 292.254 0.9927 
1 1 1 -9  27  7  o 12 1.95170e+01 6.84211e-01 1.91466e+02 183.761 -1.27934e+01 -8.41032e-01 0.00000e+00 0.00000e+00 5.13513e+02 183.761 3.22048e+02 183.761 0.9602 
1 1 1 -9  27  8  o 12 1.92757e+01 5.99438e-01 3.45050e+02 141.946 -2.40488e+01 1.88255e+01  0.00000e+00 0.00000e+00 3.67532e+02 141.946 2.24825e+01 141.946 0.9835 
1 1 1 -9  27  9  o 11 9.92521e+00 7.56409e-01 1.88952e+02 109.520 -3.50392e+00 9.88394e+00  0.00000e+00 0.00000e+00 1.65549e+02 109.520 2.34030e+01 289.520 0.9511 
1 1 1 -9  27  10 o 15 1.78177e+01 6.45662e-01 3.38568e+02 348.065 4.38609e+01  -9.27126e+00 0.00000e+00 0.00000e+00 3.22455e+02 348.065 1.61129e+01 168.064 0.9888 
1 1 1 -9  27  11 o 9  8.77748e+00 7.53253e-01 1.87917e+02 64.555  6.25581e+00  1.31478e+01  0.00000e+00 0.00000e+00 1.29576e+02 64.555  5.83409e+01 244.555 0.9650 
1 1 1 -9  27  12 o 7  9.54378e+00 7.02728e-01 1.44905e+02 209.239 -1.29882e+01 -7.27042e+00 0.00000e+00 0.00000e+00 2.00217e+02 209.239 5.53118e+01 209.239 0.9658 
1 1 1 -9  27  13 o 7  6.69956e+00 7.84601e-01 1.95590e+02 276.807 1.82401e+00  -1.52800e+01 0.00000e+00 0.00000e+00 4.66919e+01 276.807 1.48898e+02 96.807  0.9669 
1 1 1 -9  27  14 o 10 6.55463e+00 6.10466e-01 1.35920e+02 72.455  3.89697e+00  1.23255e+01  0.00000e+00 0.00000e+00 9.92639e+01 72.455  3.66564e+01 252.455 0.9605 
1 1 1 -9  27  15 o 13 5.58282e+00 1.35792e+00 1.46603e+02 238.642 -4.81026e+00 -7.89352e+00 0.00000e+00 0.00000e+00 5.00761e+01 238.642 9.65272e+01 58.642  0.9443 
1 1 1 -9  27  16 o 13 9.03847e+00 1.47532e+00 7.94808e+01 286.821 2.33030e+00  -7.70818e+00 0.00000e+00 0.00000e+00 2.35634e+02 286.821 1.56153e+02 286.821 0.9357 
1 1 1 -9  27  17 o 5  5.82687e+00 1.43394e+00 5.50071e+01 81.426  6.39106e-01  4.23894e+00  0.00000e+00 0.00000e+00 1.34426e+02 81.426  7.94191e+01 81.426  0.8737 
1 1 1 -9  27  18 o 8  5.22219e+00 1.57408e+00 9.13763e+01 271.046 1.20910e-01  -6.62090e+00 0.00000e+00 0.00000e+00 8.73415e+01 271.046 4.03482e+00 91.046  0.9211 
1 1 1 -9  28  1  o 13 4.69523e+00 8.89217e-01 1.42714e+02 226.062 -9.94247e-01 -1.03179e+00 0.00000e+00 0.00000e+00 4.00617e+01 46.062  1.82776e+02 46.062  0.5791 
1 1 1 -9  28  2  o 19 3.26836e+01 7.10918e-01 5.36228e+02 231.526 -2.41176e+01 -3.03482e+01 0.00000e+00 0.00000e+00 6.81130e+02 231.526 1.44902e+02 231.526 0.9870 
1 1 1 -9  28  3  o 2  2.03766e+01 5.77809e-01 4.87013e+02 246.463 -9.70404e+00 -2.22789e+01 0.00000e+00 0.00000e+00 2.65554e+02 246.463 2.21459e+02 66.463  0.9792 
1 1 1 -9  28  4  o 9  2.29666e+01 6.98577e-01 3.16341e+02 100.677 -3.50350e+00 1.85832e+01  0.00000e+00 0.00000e+00 5.26187e+02 100.677 2.09846e+02 100.677 0.9732 
1 1 1 -9  28  5  o 18 9.24634e+00 6.86734e-01 1.09340e+02 12.370  2.75022e+00  6.03176e-01  0.00000e+00 0.00000e+00 1.67706e+02 12.370  5.83656e+01 12.370  0.7954 
1 1 1 -9  28  6  o 14 1.70347e+01 6.12313e-01 2.58295e+02 349.121 1.34126e+01  -2.57783e+00 0.00000e+00 0.00000e+00 3.59039e+02 349.121 1.00744e+02 349.121 0.9627 
1 1 1 -9  28  7  o 14 2.24914e+01 5.98382e-01 5.41691e+02 155.145 -3.81069e+01 1.76518e+01  0.00000e+00 0.00000e+00 2.94226e+02 155.145 2.47465e+02 335.145 0.9880 
1 1 1 -9  28  8  o 9  1.77010e+01 6.15361e-01 3.11022e+02 87.380  1.21768e+00  2.66086e+01  0.00000e+00 0.00000e+00 3.41673e+02 87.380  3.06507e+01 87.380  0.9810 
1 1 1 -9  28  9  o 10 1.38383e+01 6.47320e-01 2.46050e+02 291.246 7.06430e+00  -1.81699e+01 0.00000e+00 0.00000e+00 2.60105e+02 291.246 1.40551e+01 291.246 0.9740 
1 1 1 -9  28  10 o 6  4.64221e+00 8.98252e-01 9.17853e+01 75.346  7.58394e-01  2.90024e+00  0.00000e+00 0.00000e+00 4.92551e+01 75.346  4.25302e+01 255.346 0.8098 
1 1 1 -9  28  11 o 9  1.07684e+01 6.58350e-01 2.08356e+02 15.967  1.94492e+01  5.56491e+00  0.00000e+00 0.00000e+00 1.85132e+02 15.967  2.32236e+01 195.967 0.9750 
1 1 1 -9  28  12 o 17 1.07833e+01 6.45239e-01 2.18844e+02 221.072 -1.87646e+01 -1.63531e+01 0.00000e+00 0.00000e+00 1.76683e+02 221.072 4.21613e+01 41.072  0.9797 
1 1 1 -9  28  13 o 14 8.08291e+00 6.98087e-01 1.07089e+02 110.310 -3.98280e+00 1.07611e+01  0.00000e+00 0.00000e+00 1.81703e+02 110.310 7.46144e+01 110.310 0.9554 
1 1 1 -9  28  14 o 19 3.62442e+00 7.79334e-01 1.03396e+02 43.835  3.68356e+00  3.53674e+00  0.00000e+00 0.00000e+00 1.78798e+01 43.835  8.55165e+01 223.835 0.8958 
1 1 1 -9  28  15 o 11 6.17818e+00 1.39501e+00 1.37149e+02 318.345 7.51988e+00  -6.68942e+00 0.00000e+00 0.00000e+00 8.15686e+01 318.345 5.55803e+01 138.345 0.9489 
1 1 1 -9  28  16 o 14 6.92220e+00 1.52948e+00 1.50978e+02 180.423 -1.20322e+01 -8.87722e-02 0.00000e+00 0.00000e+00 9.59652e+01 180.423 5.50132e+01 0.423   0.9575 
1 1 1 -9  28  17 o 10 1.09809e+01 1.65063e+00 1.57600e+02 73.027  5.96400e+00  1.95407e+01  0.00000e+00 0.00000e+00 2.40836e+02 73.027  8.32364e+01 73.027  0.9752 
1 1 1 -9  28  18 o 18 3.92024e+00 1.30234e+00 5.38482e+01 343.506 3.51485e+00  -1.04072e+00 0.00000e+00 0.00000e+00 6.98540e+01 343.506 1.60057e+01 343.506 0.8493 
1 1 1 -9  29  1  o 8  2.86536e+01 7.55927e-01 4.88999e+02 235.892 -1.73360e+01 -2.55971e+01 0.00000e+00 0.00000e+00 5.75062e+02 235.892 8.60628e+01 235.892 0.9837 
1 1 1 -9  29  2  o 19 3.18333e+01 9.19217e-01 5.63611e+02 318.990 3.25207e+01  -2.82796e+01 0.00000e+00 0.00000e+00 6.23560e+02 318.990 5.99488e+01 318.990 0.9883 
1 1 1 -9  29  3  o 10 1.86607e+01 7.30610e-01 2.61193e+02 234.905 -6.69906e+00 -9.53347e+00 0.00000e+00 0.00000e+00 4.11671e+02 234.905 1.50478e+02 234.905 0.9561 
1 1 1 -9  29  4  o 7  1.59168e+01 5.69081e-01 2.36964e+02 181.835 -9.87243e+00 -3.16317e-01 0.00000e+00 0.00000e+00 3.31751e+02 181.835 9.47861e+01 181.835 0.9479 
1 1 1 -9  29  5  o 10 2.22725e+01 7.90604e-01 4.15787e+02 333.523 2.46725e+01  -1.22888e+01 0.00000e+00 0.00000e+00 4.07825e+02 333.523 7.96253e+00 153.523 0.9817 
1 1 1 -9  29  6  o 14 1.37547e+01 7.39809e-01 1.69437e+02 273.200 4.12220e-01  -7.37293e+00 0.00000e+00 0.00000e+00 3.11865e+02 273.200 1.42427e+02 273.200 0.9296 
1 1 1 -9  29  7  o 16 2.38675e+01 6.04822e-01 3.24206e+02 277.074 3.72498e+00  -3.00183e+01 0.00000e+00 0.00000e+00 5.58573e+02 277.074 2.34367e+02 277.074 0.9833 
1 1 1 -9  29  8  o 3  2.61831e+01 6.21170e-01 4.30584e+02 104.564 -1.36762e+01 5.26400e+01  0.00000e+00 0.00000e+00 5.44361e+02 104.564 1.13778e+02 104.564 0.9908 
1 1 1 -9  29  9  o 13 2.13489e+01 6.03149e-01 3.72328e+02 318.032 3.39659e+01  -3.05485e+01 0.00000e+00 0.00000e+00 4.20493e+02 318.032 4.81651e+01 318.032 0.9890 
1 1 1 -9  29  10 o 2  1.14704e+01 6.47607e-01 2.28480e+02 275.948 1.97456e+00  -1.89530e+01 0.00000e+00 0.00000e+00 1.90375e+02 275.948 3.81056e+01 95.948  0.9734 
1 1 1 -9  29  11 o 11 6.99388e+00 8.54048e-01 1.25606e+02 176.064 -7.51265e+00 5.16958e-01  0.00000e+00 0.00000e+00 1.18421e+02 176.064 7.18513e+00 356.064 0.9310 
1 1 1 -9  29  12 o 8  4.18403e+00 9.63247e-01 1.33881e+02 155.087 -4.85929e+00 2.25698e+00  0.00000e+00 0.00000e+00 7.25929e+00 155.087 1.26622e+02 335.087 0.9011 
1 1 1 -9  29  13 o 7  4.29212e+00 8.93161e-01 5.13993e+01 88.117  8.91138e-02  2.71036e+00  0.00000e+00 0.00000e+00 7.47874e+01 88.117  2.33881e+01 88.117  0.7862 
1 1 1 -9  29  14 o 18 1.29907e+01 4.48937e-01 2.21279e+02 18.572  4.78386e+01  1.60731e+01  0.00000e+00 0.00000e+00 2.59095e+02 18.572  3.78159e+01 18.572  0.9900 
1 1 1 -9  29  15 o 6  6.70920e+00 1.25715e+00 1.00198e+02 343.886 8.33912e+00  -2.40923e+00 0.00000e+00 0.00000e+00 1.35187e+02 343.886 3.49889e+01 343.886 0.9405 
1 1 1 -9  29  16 o 10 4.22698e+00 1.27067e+00 1.35720e+02 122.384 -4.14070e+00 6.52870e+00  0.00000e+00 0.00000e+00 1.11857e+01 122.384 1.24535e+02 302.384 0.9329 
1 1 1 -9  29  17 o 18 7.52503e+00 1.73882e+00 8.19569e+01 358.032 6.82320e+00  -2.34454e-01 0.00000e+00 0.00000e+00 1.76599e+02 358.032 9.46424e+01 358.032 0.9236 
1 1 1 -9  29  18 o 8  4.24544e+00 1.41091e+00 1.04812e+02 232.617 -4.29490e+00 -5.62093e+00 0.00000e+00 0.00000e+00 4.12916e+01 232.617 6.35204e+01 52.617  0.9263 
1 1 1 -9  30  1  f 0  1.11537e+01 6.28480e-01 1.98143e+02 225.987 -3.76585e+00 -3.89795e+00 0.00000e+00 0.00000e+00 1.81746e+02 225.987 1.63965e+01 45.988  0.9023 
1 1 1 -9  30  2  o 17 3.08921e+01 8.97961e-01 3.13277e+02 197.563 -2.21227e+01 -7.00213e+00 0.00000e+00 0.00000e+00 8.26906e+02 197.563 5.13629e+02 197.563 0.9782 
1 1 1 -9  30  3  o 8  1.90164e+01 5.75381e-01 3.49646e+02 108.839 -5.77029e+00 1.69123e+01  0.00000e+00 0.00000e+00 3.47124e+02 108.839 2.52229e+00 288.839 0.9716 
1 1 1 -9  30  4  o 19 2.43707e+01 6.13738e-01 4.29906e+02 52.404  1.75515e+01  2.27946e+01  0.00000e+00 0.00000e+00 4.72508e+02 52.404  4.26016e+01 52.404  0.9825 
1 1 1 -9  30  5  o 5  2.27802e+01 7.99317e-01 2.34860e+02 241.844 -7.15259e+00 -1.33644e+01 0.00000e+00 0.00000e+00 5.94366e+02 241.844 3.59506e+02 241.844 0.9664 
1 1 1 -9  30  6  o 3  2.15966e+01 9.04128e-01 5.01957e+02 5.682   3.35212e+01  3.33534e+00  0.00000e+00 0.00000e+00 2.98766e+02 5.682   2.03191e+02 185.682 0.9850 
1 1 1 -9  30  7  o 7  1.95840e+01 5.79457e-01 3.92287e+02 322.134 2.61165e+01  -2.03064e+01 0.00000e+00 0.00000e+00 3.33060e+02 322.134 5.92271e+01 142.134 0.9848 
1 1 1 -9  30  8  o 7  1.17910e+01 6.36961e-01 2.47829e+02 92.255  -5.40724e-01 1.37315e+01  0.00000e+00 0.00000e+00 1.78836e+02 92.255  6.89932e+01 272.255 0.9629 
1 1 1 -9  30  9  o 2  6.26629e+00 9.02548e-01 1.58534e+02 74.701  1.52610e+00  5.57900e+00  0.00000e+00 0.00000e+00 5.53021e+01 74.701  1.03232e+02 254.701 0.9089 
1 1 1 -9  30  10 o 16 6.69428e+00 8.90876e-01 2.23393e+02 62.634  5.00522e+00  9.67024e+00  0.00000e+00 0.00000e+00 1.58941e+01 62.634  2.07498e+02 242.634 0.9529 
1 1 1 -9  30  11 o 2  4.15015e+00 9.76119e-01 8.10587e+01 285.033 7.21700e-01  -2.68723e+00 0.00000e+00 0.00000e+00 4.21949e+01 285.033 3.88637e+01 105.033 0.7925 
1 1 1 -9  30  12 o 3  2.87804e+00 8.63711e-01 9.82130e+01 65.381  1.22586e+00  2.67515e+00  0.00000e+00 0.00000e+00 1.14155e+01 245.381 1.09629e+02 245.381 0.8057 
1 1 1 -9  30  13 o 5  1.06260e+01 5.75180e-01 2.44822e+02 125.154 -1.97250e+01 2.80094e+01  0.00000e+00 0.00000e+00 1.46659e+02 125.154 9.81633e+01 305.154 0.9853 
1 1 1 -9  30  14 o 11 5.11292e+00 7.26959e-01 1.16756e+02 23.578  8.45949e+00  3.69205e+00  0.00000e+00 0.00000e+00 6.35354e+01 23.578  5.32210e+01 203.578 0.9442 
1 1 1 -9  30  15 o 3  7.38071e+00 1.43662e+00 1.62071e+02 210.172 -1.14443e+01 -6.65331e+00 0.00000e+00 0.00000e+00 1.02622e+02 210.172 5.94487e+01 30.172  0.9615 
1 1 1 -9  30  16 o 13 8.73804e+00 1.54766e+00 1.81374e+02 172.927 -1.77076e+01 2.19717e+00  0.00000e+00 0.00000e+00 1.34876e+02 172.927 4.64979e+01 352.927 0.9716 
1 1 1 -9  30  17 f 0  5.43021e+00 1.60070e+00 1.08966e+02 268.387 -1.97587e-01 -7.01774e+00 0.00000e+00 0.00000e+00 7.80450e+01 268.387 3.09206e+01 88.387  0.9258 
1 1 1 -9  30  18 o 1  4.13676e+00 1.39001e+00 6.03808e+01 118.057 -1.79121e+00 3.36065e+00  0.00000e+00 0.00000e+00 7.11177e+01 118.057 1.07369e+01 118.057 0.8557 
1 1 1 -9  31  1  f 0  2.11304e+01 5.98729e-01 3.07155e+02 117.031 -7.21895e+00 1.41490e+01  0.00000e+00 0.00000e+00 4.64878e+02 117.031 1.57723e+02 117.031 0.9680 
1 1 1 -9  31  2  o 1  2.78743e+01 6.47138e-01 5.39003e+02 329.810 3.12165e+01  -1.81609e+01 0.00000e+00 0.00000e+00 4.97966e+02 329.810 4.10376e+01 149.810 0.9861 
1 1 1 -9  31  3  o 12 1.60948e+01 9.72124e-01 3.97580e+02 229.748 -1.07459e+01 -1.26927e+01 0.00000e+00 0.00000e+00 1.90785e+02 229.748 2.06795e+02 49.748  0.9695 
1 1 1 -9  31  4  o 1  9.61701e+00 6.83084e-01 1.37255e+02 104.108 -8.99569e-01 3.57909e+00  0.00000e+00 0.00000e+00 1.70979e+02 104.108 3.37241e+01 104.108 0.8505 
1 1 1 -9  31  5  o 1  2.48178e+01 7.00037e-01 5.17461e+02 124.450 -2.32813e+01 3.39383e+01  0.00000e+00 0.00000e+00 4.05811e+02 124.450 1.11650e+02 304.450 0.9878 
1 1 1 -9  31  6  o 9  4.39795e+01 8.85087e-01 7.55011e+02 338.330 9.90681e+01  -3.93635e+01 0.00000e+00 0.00000e+00 8.92424e+02 338.330 1.37414e+02 338.330 0.9953 
1 1 1 -9  31  7  o 5  2.62768e+01 6.19369e-01 4.41938e+02 358.499 4.95863e+01  -1.29935e+00 0.00000e+00 0.00000e+00 5.36253e+02 358.499 9.43151e+01 358.499 0.9899 
1 1 1 -9  31  8  o 8  2.00170e+01 5.87125e-01 3.79013e+02 269.658 -2.29958e-01 -3.85181e+01 0.00000e+00 0.00000e+00 3.63329e+02 269.658 1.56842e+01 89.658  0.9869 
1 1 1 -9  31  9  o 10 5.12093e+00 1.02895e+00 7.99482e+01 332.838 2.10408e+00  -1.07957e+00 0.00000e+00 0.00000e+00 6.41419e+01 332.838 1.58063e+01 152.838 0.7495 
1 1 1 -9  31  10 o 14 1.47662e+01 6.07111e-01 2.73936e+02 254.394 -8.39217e+00 -3.00464e+01 0.00000e+00 0.00000e+00 2.70966e+02 254.394 2.96957e+00 74.395  0.9838 
1 1 1 -9  31  11 o 19 4.17242e+00 9.38856e-01 3.89546e+01 259.064 -2.71230e-01 -1.40375e+00 0.00000e+00 0.00000e+00 5.14539e+01 259.064 1.24992e+01 259.064 0.5783 
1 1 1 -9  31  12 o 3  5.34061e+00 8.49216e-01 6.44719e+01 191.364 -3.32273e+00 -6.67785e-01 0.00000e+00 0.00000e+00 1.02466e+02 191.364 3.79939e+01 191.364 0.8351 
1 1 1 -9  31  13 o 7  3.95459e+00 9.00320e-01 1.21857e+02 185.499 -6.01062e+00 -5.78663e-01 0.00000e+00 0.00000e+00 1.31285e+01 185.499 1.08728e+02 5.499   0.9130 
1 1 1 -9  31  14 o 4  9.03160e+00 4.18510e-01 1.40339e+02 331.144 1.90878e+01  -1.05180e+01 0.00000e+00 0.00000e+00 1.89106e+02 331.144 4.87665e+01 331.144 0.9768 
1 1 1 -9  31  15 o 9  7.27184e+00 1.40412e+00 1.33082e+02 294.570 4.80392e+00  -1.05074e+01 0.00000e+00 0.00000e+00 1.26121e+02 294.570 6.96068e+00 114.570 0.9557 
1 1 1 -9  31  16 o 9  3.13280e+00 1.02989e+00 8.19289e+01 140.217 -3.23822e+00 2.69633e+00  0.00000e+00 0.00000e+00 1.97413e+01 140.217 6.21876e+01 320.217 0.8713 
1 1 1 -9  31  17 o 1  5.18052e+00 1.47921e+00 8.45807e+01 298.420 2.68306e+00  -4.95806e+00 0.00000e+00 0.00000e+00 9.00716e+01 298.420 5.49092e+00 298.420 0.9063 
1 1 1 -9  32  1  o 6  2.48081e+01 6.30322e-01 6.10307e+02 215.962 -2.94876e+01 -2.13939e+01 0.00000e+00 0.00000e+00 3.13047e+02 215.962 2.97260e+02 35.962  0.9862 
1 1 1 -9  32  2  o 1  6.04443e+00 8.26271e-01 2.46817e+02 153.850 -3.53637e+00 1.73631e+00  0.00000e+00 0.00000e+00 5.04532e+01 333.850 2.97270e+02 333.850 0.8612 
1 1 1 -9  32  3  o 8  3.16523e+01 8.22885e-01 4.98123e+02 146.437 -3.38266e+01 2.24429e+01  0.00000e+00 0.00000e+00 6.80531e+02 146.437 1.82408e+02 146.437 0.9876 
1 1 1 -9  32  4  o 9  4.45162e+01 8.81542e-01 8.66126e+02 278.109 1.49152e+01  -1.04687e+02 0.00000e+00 0.00000e+00 8.03434e+02 278.109 6.26920e+01 98.109  0.9953 
1 1 1 -9  32  5  o 1  2.70476e+01 6.50192e-01 3.90680e+02 100.859 -6.38322e+00 3.32759e+01  0.00000e+00 0.00000e+00 6.12764e+02 100.859 2.22084e+02 100.859 0.9851 
1 1 1 -9  32  6  o 2  2.82873e+01 8.04670e-01 3.90709e+02 340.905 3.64630e+01  -1.26230e+01 0.00000e+00 0.00000e+00 6.59937e+02 340.905 2.69227e+02 340.905 0.9870 
1 1 1 -9  32  7  o 13 2.11418e+01 6.73060e-01 3.53010e+02 29.388  2.75318e+01  1.55059e+01  0.00000e+00 0.00000e+00 4.29328e+02 29.388  7.63183e+01 29.388  0.9840 
1 1 1 -9  32  8  o 14 1.52054e+01 6.15685e-01 3.19231e+02 5.000   2.43778e+01  2.13259e+00  0.00000e+00 0.00000e+00 2.40291e+02 5.000   7.89392e+01 185.000 0.9793 
1 1 1 -9  32  9  o 2  6.58360e+00 8.95510e-01 2.26385e+02 104.054 -2.14477e+00 8.56763e+00  0.00000e+00 0.00000e+00 6.32154e+00 104.054 2.20064e+02 284.054 0.9416 
1 1 1 -9  32  10 o 3  8.17867e+00 9.28422e-01 1.51976e+02 231.517 -5.99379e+00 -7.53992e+00 0.00000e+00 0.00000e+00 1.38376e+02 231.517 1.35996e+01 51.517  0.9466 
1 1 1 -9  32  11 o 3  1.04846e+01 6.64711e-01 2.21680e+02 306.897 1.32034e+01  -1.75874e+01 0.00000e+00 0.00000e+00 1.62110e+02 306.897 5.95700e+01 126.897 0.9770 
1 1 1 -9  32  12 o 19 1.47433e+01 6.01902e-01 2.33689e+02 66.594  1.56668e+01  3.61931e+01  0.00000e+00 0.00000e+00 3.11071e+02 66.594  7.73820e+01 66.594  0.9872 
1 1 1 -9  32  13 o 16 3.72774e+00 9.71650e-01 3.46489e+01 182.057 -1.56596e+00 -5.62499e-02 0.00000e+00 0.00000e+00 5.06768e+01 182.057 1.60280e+01 182.057 0.6123 
1 1 1 -9  32  14 o 15 4.84635e+00 5.87823e-01 1.33652e+02 339.925 9.98251e+00  -3.64814e+00 0.00000e+00 0.00000e+00 3.85787e+01 339.925 9.50731e+01 159.925 0.9517 
1 1 1 -9  32  15 o 2  5.50702e+00 1.39430e+00 8.55763e+01 83.722  6.17451e-01  5.61232e+00  0.00000e+00 0.00000e+00 1.00598e+02 83.722  1.50213e+01 83.722  0.9065 
1 1 1 -9  32  16 o 10 6.69500e+00 1.55606e+00 7.79676e+01 270.931 9.28672e-02  -5.71442e+00 0.00000e+00 0.00000e+00 1.48373e+02 270.931 7.04052e+01 270.931 0.9077 
1 1 1 -9  32  17 o 19 5.48221e+00 1.57088e+00 4.69027e+01 352.079 3.21292e+00  -4.47030e-01 0.00000e+00 0.00000e+00 1.21629e+02 352.079 7.47267e+01 352.079 0.8265 
1 1 1 -9  33  1  o 7  2.95114e+01 8.81301e-01 4.05453e+02 6.519   3.12440e+01  3.57045e+00  0.00000e+00 0.00000e+00 6.90398e+02 6.519   2.84945e+02 6.519   0.9840 
1 1 1 -9  33  2  o 19 2.22949e+01 6.02853e-01 4.08130e+02 354.334 2.37261e+01  -2.35398e+00 0.00000e+00 0.00000e+00 4.15027e+02 354.334 6.89692e+00 354.334 0.9788 
1 1 1 -9  33  3  o 3  1.46420e+01 5.80926e-01 2.36780e+02 287.897 2.93161e+00  -9.07788e+00 0.00000e+00 0.00000e+00 2.85457e+02 287.897 4.86773e+01 287.897 0.9460 
1 1 1 -9  33  4  o 19 1.24680e+01 6.20850e-01 1.38578e+02 232.141 -3.19967e+00 -4.11619e+00 0.00000e+00 0.00000e+00 2.83348e+02 232.141 1.44770e+02 232.141 0.8981 
1 1 1 -9  33  5  o 15 1.41910e+01 7.74412e-01 3.44618e+02 354.615 1.49249e+01  -1.40691e+00 0.00000e+00 0.00000e+00 1.71612e+02 354.615 1.73006e+02 174.615 0.9660 
1 1 1 -9  33  6  o 10 1.38330e+01 5.96939e-01 2.10267e+02 100.896 -1.90166e+00 9.87883e+00  0.00000e+00 0.00000e+00 2.83671e+02 100.896 7.34038e+01 100.896 0.9489 
1 1 1 -9  33  7  o 9  2.91688e+01 7.08805e-01 4.95554e+02 242.849 -2.86437e+01 -5.58520e+01 0.00000e+00 0.00000e+00 5.92446e+02 242.849 9.68918e+01 242.849 0.9920 
1 1 1 -9  33  8  o 1  1.88957e+01 5.77096e-01 2.94222e+02 322.559 2.40044e+01  -1.83800e+01 0.00000e+00 0.00000e+00 4.03850e+02 322.559 1.09628e+02 322.559 0.9833 
1 1 1 -9  33  9  o 15 4.68227e+00 1.00222e+00 1.99565e+01 151.205 -5.17301e-01 2.84327e-01  0.00000e+00 0.00000e+00 2.97820e+01 151.205 9.82546e+00 151.205 0.2830 
1 1 1 -9  33  10 o 1  1.68740e+01 5.75419e-01 3.41062e+02 208.221 -4.01856e+01 -2.15667e+01 0.00000e+00 0.00000e+00 2.84764e+02 208.221 5.62973e+01 28.221  0.9890 
1 1 1 -9  33  11 o 7  1.73677e+01 5.82864e-01 2.58113e+02 345.639 4.23621e+01  -1.08463e+01 0.00000e+00 0.00000e+00 3.85065e+02 345.639 1.26952e+02 345.639 0.9885 
1 1 1 -9  33  12 o 14 1.13580e+01 6.45243e-01 2.06784e+02 2.824   2.64915e+01  1.30681e+00  0.00000e+00 0.00000e+00 2.10188e+02 2.824   3.40335e+00 2.824   0.9810 
1 1 1 -9  33  13 o 7  4.85112e+00 8.76861e-01 5.66128e+01 181.381 -3.48783e+00 -8.40943e-02 0.00000e+00 0.00000e+00 9.58101e+01 181.381 3.91973e+01 181.381 0.8405 
1 1 1 -9  33  14 o 13 2.81605e+00 7.02227e-01 1.05511e+02 13.658  4.49557e+00  1.09240e+00  0.00000e+00 0.00000e+00 1.25709e+01 193.658 1.18082e+02 193.658 0.8839 
1 1 1 -9  33  15 o 9  4.05447e+00 1.21940e+00 3.89694e+01 282.006 4.37991e-01  -2.05943e+00 0.00000e+00 0.00000e+00 6.90380e+01 282.006 3.00686e+01 282.006 0.7144 
1 1 1 -9  33  16 o 1  5.25594e+00 1.48089e+00 1.12249e+02 328.363 5.76082e+00  -3.54926e+00 0.00000e+00 0.00000e+00 6.83870e+01 328.363 4.38621e+01 148.363 0.9228 
1 1 1 -9  33  17 o 11 9.84286e+00 1.83200e+00 1.07822e+02 183.751 -1.10478e+01 -7.24278e-01 0.00000e+00 0.00000e+00 2.41299e+02 183.751 1.33477e+02 183.751 0.9537 
1 1 1 -9  34  1  o 10 2.54105e+01 8.19612e-01 4.99683e+02 237.622 -1.75484e+01 -2.76750e+01 0.00000e+00 0.00000e+00 4.44427e+02 237.622 5.52564e+01 57.622  0.9846 
1 1 1 -9  34  2  o 1  3.32689e+01 7.21466e-01 5.60142e+02 74.038  1.32946e+01  4.64792e+01  0.00000e+00 0.00000e+00 6.81632e+02 74.038  1.21489e+02 74.038  0.9896 
1 1 1 -9  34  3  o 7  2.47047e+01 6.22861e-01 5.54408e+02 144.831 -3.14235e+01 2.21414e+01  0.00000e+00 0.00000e+00 3.64718e+02 144.831 1.89690e+02 324.831 0.9869 
1 1 1 -9  34  4  o 9  6.74597e+00 1.26544e+00 1.43652e+02 166.159 -2.53485e+00 6.24532e-01  0.00000e+00 0.00000e+00 5.37103e+01 166.159 8.99413e+01 346.159 0.7765 
1 1 1 -9  34  5  o 19 1.53114e+01 1.00848e+00 2.42684e+02 53.486  6.81414e+00  9.20415e+00  0.00000e+00 0.00000e+00 3.08050e+02 53.486  6.53657e+01 53.486  0.9553 
1 1 1 -9  34  6  o 2  2.30574e+01 5.86856e-01 4.32921e+02 264.665 -3.20278e+00 -3.42994e+01 0.00000e+00 0.00000e+00 4.21950e+02 264.665 1.09703e+01 84.665  0.9854 
1 1 1 -9  34  7  o 16 9.28553e+00 8.04515e-01 1.77964e+02 339.910 6.95850e+00  -2.54503e+00 0.00000e+00 0.00000e+00 1.46654e+02 339.910 3.13104e+01 159.910 0.9298 
1 1 1 -9  34  8  o 12 6.65997e+00 8.78470e-01 1.22065e+02 276.159 4.97193e-01  -4.60750e+00 0.00000e+00 0.00000e+00 9.91419e+01 276.159 2.29231e+01 96.159  0.8841 
1 1 1 -9  34  9  o 3  1.99736e+01 5.92570e-01 4.39074e+02 151.835 -5.47074e+01 2.92911e+01  0.00000e+00 0.00000e+00 3.04541e+02 151.835 1.34534e+02 331.835 0.9919 
1 1 1 -9  34  10 o 3  1.20968e+01 6.23141e-01 1.37645e+02 231.574 -8.86390e+00 -1.11732e+01 0.00000e+00 0.00000e+00 2.99760e+02 231.574 1.62115e+02 231.574 0.9643 
1 1 1 -9  34  11 o 9  4.32267e+00 9.68980e-01 1.11471e+02 120.391 -2.14449e+00 3.65656e+00  0.00000e+00 0.00000e+00 2.97513e+01 120.391 8.17192e+01 300.391 0.8721 
1 1 1 -9  34  12 o 4  3.54645e+00 9.08705e-01 6.67668e+01 287.363 7.67921e-01  -2.45591e+00 0.00000e+00 0.00000e+00 3.57819e+01 287.363 3.09849e+01 107.364 0.7727 
1 1 1 -9  34  13 o 6  8.02347e+00 7.43547e-01 1.18344e+02 92.884  -6.63337e-01 1.31688e+01  0.00000e+00 0.00000e+00 1.69954e+02 92.884  5.16102e+01 92.884  0.9613 
1 1 1 -9  34  14 o 15 5.41601e+00 5.80944e-01 7.22633e+01 26.498  5.74485e+00  2.86402e+00  0.00000e+00 0.00000e+00 1.13442e+02 26.498  4.11786e+01 26.498  0.9184 
1 1 1 -9  34  15 o 17 4.39220e+00 1.32281e+00 1.04177e+02 281.504 1.16046e+00  -5.70197e+00 0.00000e+00 0.00000e+00 4.47669e+01 281.504 5.94103e+01 101.504 0.9094 
1 1 1 -9  34  16 o 14 5.84924e+00 1.55429e+00 4.79382e+01 233.683 -1.88709e+00 -2.56739e+00 0.00000e+00 0.00000e+00 1.31297e+02 233.683 8.33588e+01 233.683 0.8229 
1 1 1 -9  34  17 o 11 7.62914e+00 1.80374e+00 1.14989e+02 160.489 -8.75902e+00 3.10357e+00  0.00000e+00 0.00000e+00 1.52991e+02 160.489 3.80023e+01 160.489 0.9446 
1 1 1 -9  35  1  f 0  2.06690e+01 7.26662e-01 4.02779e+01 221.052 -1.62789e+00 -1.41771e+00 0.00000e+00 0.00000e+00 5.22928e+02 221.052 4.82651e+02 221.052 0.7222 
1 1 1 -9  35  2  o 3  7.55308e+00 7.59350e-01 2.32717e+02 152.933 -4.25247e+00 2.17304e+00  0.00000e+00 0.00000e+00 2.02079e+01 152.933 2.12509e+02 332.933 0.8879 
1 1 1 -9  35  3  o 16 2.23742e+01 6.08684e-01 2.81254e+02 43.411  1.38492e+01  1.31016e+01  0.00000e+00 0.00000e+00 5.39705e+02 43.411  2.58450e+02 43.411  0.9734 
1 1 1 -9  35  4  o 4  2.02916e+01 5.86864e-01 3.34958e+02 270.767 2.93843e-01  -2.19574e+01 0.00000e+00 0.00000e+00 4.11871e+02 270.767 7.69122e+01 270.767 0.9770 
1 1 1 -9  35  5  o 12 4.11838e+01 8.43839e-01 7.10458e+02 317.309 6.95222e+01  -6.41338e+01 0.00000e+00 0.00000e+00 8.31843e+02 317.309 1.21385e+02 317.309 0.9947 
1 1 1 -9  35  6  o 5  1.61925e+01 5.71085e-01 2.64308e+02 162.119 -1.59639e+01 5.15045e+00  0.00000e+00 0.00000e+00 3.26448e+02 162.119 6.21398e+01 162.119 0.9697 
1 1 1 -9  35  7  o 9  1.77093e+01 7.08497e-01 2.42546e+02 258.320 -4.16072e+00 -2.01263e+01 0.00000e+00 0.00000e+00 4.06810e+02 258.320 1.64264e+02 258.320 0.9754 
1 1 1 -9  35  8  o 4  7.81953e+00 7.69575e-01 1.45806e+02 24.506  5.79100e+00  2.63981e+00  0.00000e+00 0.00000e+00 1.23738e+02 24.506  2.20684e+01 204.506 0.9177 
1 1 1 -9  35  9  o 15 1.73531e+01 5.82138e-01 2.60680e+02 39.913  2.59430e+01  2.17020e+01  0.00000e+00 0.00000e+00 3.80880e+02 39.913  1.20201e+02 39.913  0.9851 
1 1 1 -9  35  10 o 19 1.97343e+01 5.83379e-01 3.52217e+02 170.742 -5.90475e+01 9.62457e+00  0.00000e+00 0.00000e+00 3.81500e+02 170.742 2.92825e+01 170.742 0.9916 
1 1 1 -9  35  11 o 10 4.79592e+00 9.47187e-01 7.67323e+01 208.106 -3.15742e+00 -1.68633e+00 0.00000e+00 0.00000e+00 7.50909e+01 208.106 1.64135e+00 28.106  0.8452 
1 1 1 -9  35  12 o 8  8.76588e+00 6.99873e-01 1.37795e+02 28.743  1.30315e+01  7.14722e+00  0.00000e+00 0.00000e+00 1.78964e+02 28.743  4.11688e+01 28.743  0.9658 
1 1 1 -9  35  13 o 1  8.20933e+00 6.89941e-01 1.52083e+02 131.193 -1.10485e+01 1.26238e+01  0.00000e+00 0.00000e+00 1.45450e+02 131.193 6.63316e+00 311.193 0.9697 
1 1 1 -9  35  14 o 6  6.62961e+00 4.92133e-01 1.50555e+02 303.845 9.39819e+00  -1.40149e+01 0.00000e+00 0.00000e+00 8.94828e+01 303.845 6.10723e+01 123.845 0.9699 
1 1 1 -9  35  15 o 9  6.51086e+00 1.47995e+00 6.90758e+01 331.178 4.36586e+00  -2.40236e+00 0.00000e+00 0.00000e+00 1.47698e+02 331.178 7.86225e+01 331.178 0.8930 
1 1 1 -9  35  16 o 2  4.97957e+00 1.41529e+00 8.43747e+01 93.263  -3.01605e-01 5.29091e+00  0.00000e+00 0.00000e+00 8.24789e+01 93.263  1.89584e+00 273.263 0.8999 
1 1 1 -9  35  17 o 10 4.04948e+00 1.32478e+00 6.56381e+01 237.657 -2.14571e+00 -3.38859e+00 0.00000e+00 0.00000e+00 6.44502e+01 237.657 1.18790e+00 57.657  0.8639 
1 1 1 -9  36  1  o 7  2.10910e+01 6.46685e-01 2.62851e+02 280.195 2.68704e+00  -1.49411e+01 0.00000e+00 0.00000e+00 5.06186e+02 280.195 2.43335e+02 280.195 0.9665 
1 1 1 -9  36  2  o 1  1.58249e+01 5.91423e-01 3.07328e+02 218.075 -1.07594e+01 -8.42904e+00 0.00000e+00 0.00000e+00 2.67170e+02 218.075 4.01578e+01 38.075  0.9627 
1 1 1 -9  36  3  o 6  1.92757e+01 9.61228e-01 3.88489e+02 87.769  8.52660e-01  2.18832e+01  0.00000e+00 0.00000e+00 3.21244e+02 87.769  6.72452e+01 267.769 0.9769 
1 1 1 -9  36  4  o 18 2.82286e+01 6.65472e-01 5.88285e+02 38.019  4.05628e+01  3.17123e+01  0.00000e+00 0.00000e+00 4.64685e+02 38.019  1.23600e+02 218.019 0.9902 
1 1 1 -9  36  5  o 19 2.43898e+01 7.38974e-01 2.98528e+02 236.252 -1.31608e+01 -1.96981e+01 0.00000e+00 0.00000e+00 6.00037e+02 236.252 3.01509e+02 236.252 0.9787 
1 1 1 -9  36  6  o 19 2.21590e+01 5.79189e-01 3.99110e+02 135.407 -2.70922e+01 2.67102e+01  0.00000e+00 0.00000e+00 4.23456e+02 135.407 2.43455e+01 135.407 0.9868 
1 1 1 -9  36  7  o 4  2.05068e+01 5.69200e-01 3.21659e+02 59.711  1.57994e+01  2.70490e+01  0.00000e+00 0.00000e+00 4.36792e+02 59.711  1.15133e+02 59.711  0.9839 
1 1 1 -9  36  8  f 0  2.26912e+01 5.91659e-01 3.77054e+02 255.169 -1.26289e+01 -4.76949e+01 0.00000e+00 0.00000e+00 4.66533e+02 255.169 8.94793e+01 255.169 0.9898 
1 1 1 -9  36  9  o 3  1.22729e+01 6.06819e-01 2.41193e+02 91.336  -5.16602e-01 2.21429e+01  0.00000e+00 0.00000e+00 2.08844e+02 91.336  3.23490e+01 271.336 0.9772 
1 1 1 -9  36  10 o 2  1.08724e+01 6.37240e-01 1.78985e+02 249.653 -5.83440e+00 -1.57330e+01 0.00000e+00 0.00000e+00 2.16294e+02 249.653 3.73086e+01 249.653 0.9697 
1 1 1 -9  36  11 o 2  6.49902e+00 8.21335e-01 1.86868e+02 84.318  1.19810e+00  1.20419e+01  0.00000e+00 0.00000e+00 4.62568e+01 84.318  1.40611e+02 264.318 0.9577 
1 1 1 -9  36  12 o 1  1.91280e+01 5.89666e-01 2.98185e+02 159.049 -7.08659e+01 2.71340e+01  0.00000e+00 0.00000e+00 4.12726e+02 159.049 1.14542e+02 159.049 0.9934 
1 1 1 -9  36  13 o 13 2.00945e+01 7.17110e-01 3.54187e+02 325.139 8.04786e+01  -5.60605e+01 0.00000e+00 0.00000e+00 3.92933e+02 325.139 3.87458e+01 325.139 0.9949 
1 1 1 -9  36  14 o 14 2.97967e+00 7.26208e-01 9.35415e+01 325.839 3.56906e+00  -2.42193e+00 0.00000e+00 0.00000e+00 3.72999e+00 325.839 8.98115e+01 145.840 0.8746 
1 1 1 -9  36  15 o 4  6.09172e+00 1.46921e+00 9.12263e+01 250.688 -2.16926e+00 -6.19029e+00 0.00000e+00 0.00000e+00 1.17765e+02 250.688 2.65387e+01 250.688 0.9203 
1 1 1 -9  36  16 o 17 7.00366e+00 1.65583e+00 1.22497e+02 309.282 5.89194e+00  -7.20320e+00 0.00000e+00 0.00000e+00 1.23823e+02 309.282 1.32608e+00 309.282 0.9446 
1 1 1 -9  36  17 o 5  6.73357e+00 1.87207e+00 8.02878e+01 154.456 -4.88678e+00 2.33545e+00  0.00000e+00 0.00000e+00 1.45589e+02 154.456 6.53008e+01 154.456 0.9022 
1 1 1 -9  37  1  o 5  1.91727e+01 5.86690e-01 3.92076e+02 175.936 -2.10689e+01 1.49692e+00  0.00000e+00 0.00000e+00 3.13854e+02 175.936 7.82215e+01 355.936 0.9760 
1 1 1 -9  37  2  o 15 1.68014e+01 5.70441e-01 3.60471e+02 186.301 -1.82628e+01 -2.01665e+00 0.00000e+00 0.00000e+00 2.55563e+02 186.301 1.04909e+02 6.301   0.9724 
1 1 1 -9  37  3  o 18 1.56317e+01 5.92429e-01 1.15367e+02 342.214 4.93206e+00  -1.58220e+00 0.00000e+00 0.00000e+00 4.13297e+02 342.214 2.97930e+02 342.214 0.8974 
1 1 1 -9  37  4  o 3  1.29591e+01 6.20012e-01 9.61904e+01 291.323 1.40491e+00  -3.59906e+00 0.00000e+00 0.00000e+00 3.22637e+02 291.323 2.26447e+02 291.323 0.8581 
1 1 1 -9  37  5  o 9  1.63562e+01 5.76999e-01 4.08488e+02 247.138 -9.23720e+00 -2.19082e+01 0.00000e+00 0.00000e+00 1.94090e+02 247.138 2.14398e+02 67.138  0.9787 
1 1 1 -9  37  6  o 9  1.36313e+01 5.95201e-01 3.47017e+02 155.885 -1.84557e+01 8.26152e+00  0.00000e+00 0.00000e+00 1.52881e+02 155.885 1.94137e+02 335.885 0.9750 
1 1 1 -9  37  7  o 7  7.46704e+00 7.85462e-01 2.04280e+02 229.504 -4.56561e+00 -5.34635e+00 0.00000e+00 0.00000e+00 5.55750e+01 229.504 1.48705e+02 49.504  0.9259 
1 1 1 -9  37  8  o 15 1.37741e+01 5.90195e-01 2.56433e+02 46.212  1.50201e+01  1.56693e+01  0.00000e+00 0.00000e+00 2.48800e+02 46.212  7.63367e+00 226.212 0.9767 
1 1 1 -9  37  9  o 16 6.99997e+00 7.82564e-01 7.94891e+01 52.863  2.42427e+00  3.20111e+00  0.00000e+00 0.00000e+00 1.47476e+02 52.863  6.79874e+01 52.863  0.8641 
1 1 1 -9  37  10 o 18 6.07042e+00 8.55023e-01 8.72491e+01 171.441 -4.49939e+00 6.77141e-01  0.00000e+00 0.00000e+00 1.13412e+02 171.441 2.61629e+01 171.441 0.8818 
1 1 1 -9  37  11 o 12 8.20201e+00 7.14740e-01 9.80923e+01 86.304  5.57053e-01  8.62453e+00  0.00000e+00 0.00000e+00 1.90710e+02 86.304  9.26178e+01 86.304  0.9402 
1 1 1 -9  37  12 o 3  1.23267e+01 6.17775e-01 2.37619e+02 142.999 -3.07742e+01 2.31906e+01  0.00000e+00 0.00000e+00 2.17494e+02 142.999 2.01249e+01 322.999 0.9869 
1 1 1 -9  37  13 o 17 4.59235e+00 8.08373e-01 7.82160e+01 129.910 -3.23805e+00 3.87126e+00  0.00000e+00 0.00000e+00 7.52775e+01 129.910 2.93845e+00 309.910 0.8945 
1 1 1 -9  37  14 o 1  2.45179e+00 7.02036e-01 4.26706e+01 57.326  9.21639e-01  1.43706e+00  0.00000e+00 0.00000e+00 1.62006e+01 57.326  2.64700e+01 237.326 0.6433 
1 1 1 -9  37  15 o 6  5.21658e+00 1.39171e+00 1.26455e+02 330.243 7.33607e+00  -4.19409e+00 0.00000e+00 0.00000e+00 5.61040e+01 330.243 7.03513e+01 150.243 0.9388 
1 1 1 -9  37  16 o 1  5.55205e+00 1.59362e+00 7.64992e+01 356.398 4.83745e+00  -3.04514e-01 0.00000e+00 0.00000e+00 1.07395e+02 356.398 3.08963e+01 356.398 0.8897 
1 1 1 -9  37  17 o 5  8.37135e+00 3.37408e+00 6.53455e+01 185.339 -2.21590e+00 -2.07083e-01 0.00000e+00 0.00000e+00 1.62326e+02 185.339 9.69803e+01 185.339 0.7315 
1 1 1 -9  38  1  o 18 9.95875e+00 6.77646e-01 1.52340e+02 157.362 -4.21229e+00 1.75664e+00  0.00000e+00 0.00000e+00 1.79044e+02 157.362 2.67043e+01 157.362 0.8822 
1 1 1 -9  38  2  o 19 2.05729e+01 5.88243e-01 3.96955e+02 233.166 -1.41073e+01 -1.88346e+01 0.00000e+00 0.00000e+00 3.62032e+02 233.166 3.49223e+01 53.166  0.9785 
1 1 1 -9  38  3  o 17 1.16766e+01 1.01728e+00 1.41166e+02 110.983 -1.82700e+00 4.76382e+00  0.00000e+00 0.00000e+00 2.52953e+02 110.983 1.11788e+02 110.983 0.8957 
1 1 1 -9  38  4  o 3  2.05843e+01 6.03166e-01 3.44659e+02 175.709 -2.26116e+01 1.69653e+00  0.00000e+00 0.00000e+00 4.13283e+02 175.709 6.86244e+01 175.709 0.9777 
1 1 1 -9  38  5  o 1  1.16367e+01 1.00249e+00 3.12944e+02 163.566 -1.15718e+01 3.41326e+00  0.00000e+00 0.00000e+00 1.06469e+02 163.566 2.06475e+02 343.566 0.9576 
1 1 1 -9  38  6  o 15 4.54509e+01 8.52474e-01 8.56760e+02 59.214  8.50791e+01  1.42802e+02  0.00000e+00 0.00000e+00 8.47550e+02 59.214  9.21054e+00 239.214 0.9970 
1 1 1 -9  38  7  o 18 1.37208e+01 5.93083e-01 1.56377e+02 215.680 -8.81975e+00 -6.33299e+00 0.00000e+00 0.00000e+00 3.34934e+02 215.680 1.78557e+02 215.680 0.9528 
1 1 1 -9  38  8  o 13 1.56698e+01 6.94867e-01 2.74564e+02 179.802 -2.59422e+01 8.97004e-02  0.00000e+00 0.00000e+00 3.02411e+02 179.802 2.78476e+01 179.802 0.9805 
1 1 1 -9  38  9  f 0  7.73161e+00 7.06778e-01 2.57908e+02 193.934 -1.38964e+01 -3.44766e+00 0.00000e+00 0.00000e+00 2.18507e+01 193.934 2.36057e+02 13.934  0.9644 
1 1 1 -9  38  10 o 6  2.00416e+01 5.84609e-01 3.93642e+02 7.782   7.15186e+01  9.77352e+00  0.00000e+00 0.00000e+00 3.52360e+02 7.782   4.12825e+01 187.782 0.9930 
1 1 1 -9  38  11 o 3  3.55519e+00 8.77185e-01 2.77578e+01 44.627  7.15746e-01  7.06483e-01  0.00000e+00 0.00000e+00 3.19363e+01 44.627  4.17853e+00 44.627  0.4484 
1 1 1 -9  38  12 o 1  4.44105e+00 9.04171e-01 5.10982e+01 243.417 -1.14303e+00 -2.28426e+00 0.00000e+00 0.00000e+00 7.69435e+01 243.417 2.58453e+01 243.417 0.7708 
1 1 1 -9  38  13 o 19 3.82015e+00 8.36266e-01 8.27311e+01 335.392 3.98362e+00  -1.82453e+00 0.00000e+00 0.00000e+00 4.24106e+01 335.392 4.03205e+01 155.392 0.8767 
1 1 1 -9  38  14 f 0  7.85548e+00 4.95228e-01 2.29898e+02 297.621 1.36643e+01  -2.61147e+01 0.00000e+00 0.00000e+00 5.82457e+01 297.621 1.71652e+02 117.620 0.9829 
1 1 1 -9  38  15 o 5  7.48501e+00 1.42946e+00 7.55493e+01 157.497 -6.25762e+00 2.59237e+00  0.00000e+00 0.00000e+00 1.81930e+02 157.497 1.06381e+02 157.497 0.9229 
1 1 1 -9  38  16 o 4  5.94148e+00 2.65071e+00 3.96478e+01 330.131 1.19965e+00  -6.88979e-01 0.00000e+00 0.00000e+00 8.55240e+01 330.131 4.58762e+01 330.131 0.5660 
1 1 1 -9  38  17 o 5  8.40698e+00 3.44129e+00 1.22502e+02 84.903  3.63648e-01  4.07698e+00  0.00000e+00 0.00000e+00 1.48449e+02 84.903  2.59468e+01 84.903  0.8670 
1 1 1 -9  39  1  o 17 1.82889e+01 7.30390e-01 1.98874e+02 162.733 -9.89835e+00 3.07678e+00  0.00000e+00 0.00000e+00 4.56739e+02 162.733 2.57865e+02 162.733 0.9505 
1 1 1 -9  39  2  o 2  1.95789e+01 5.80826e-01 2.79495e+02 48.231  1.17934e+01  1.32046e+01  0.00000e+00 0.00000e+00 4.37444e+02 48.231  1.57949e+02 48.231  0.9713 
1 1 1 -9  39  3  o 18 1.40802e+01 5.90418e-01 3.55414e+02 189.187 -1.53725e+01 -2.48616e+00 0.00000e+00 0.00000e+00 1.57789e+02 189.187 1.97626e+02 9.187   0.9673 
1 1 1 -9  39  4  o 4  1.33199e+01 6.25388e-01 3.18843e+02 78.724  2.73171e+00  1.37001e+01  0.00000e+00 0.00000e+00 1.64449e+02 78.724  1.54394e+02 258.724 0.9635 
1 1 1 -9  39  5  o 13 1.96967e+01 5.71889e-01 3.30718e+02 354.941 2.54530e+01  -2.25320e+00 0.00000e+00 0.00000e+00 3.95886e+02 354.941 6.51684e+01 354.941 0.9802 
1 1 1 -9  39  6  o 4  2.45676e+01 6.73239e-01 3.53178e+02 48.324  2.63156e+01  2.95608e+01  0.00000e+00 0.00000e+00 5.58991e+02 48.324  2.05812e+02 48.324  0.9873 
1 1 1 -9  39  7  o 18 3.29371e+01 6.88054e-01 5.31628e+02 144.444 -7.64046e+01 5.46109e+01  0.00000e+00 0.00000e+00 6.99494e+02 144.444 1.67865e+02 144.444 0.9947 
1 1 1 -9  39  8  o 2  1.50376e+01 5.79842e-01 2.38849e+02 37.220  1.78801e+01  1.35818e+01  0.00000e+00 0.00000e+00 3.13060e+02 37.220  7.42102e+01 37.220  0.9775 
1 1 1 -9  39  9  o 14 9.82021e+00 6.33318e-01 1.39743e+02 18.755  9.97758e+00  3.38790e+00  0.00000e+00 0.00000e+00 2.10716e+02 18.755  7.09726e+01 18.755  0.9513 
1 1 1 -9  39  10 o 13 1.03582e+01 6.53639e-01 1.65129e+02 51.784  9.53064e+00  1.21045e+01  0.00000e+00 0.00000e+00 2.10272e+02 51.784  4.51427e+01 51.784  0.9670 
1 1 1 -9  39  11 o 17 5.99692e+00 8.68576e-01 7.71916e+01 152.111 -4.04038e+00 2.13825e+00  0.00000e+00 0.00000e+00 1.20935e+02 152.111 4.37439e+01 152.111 0.8824 
1 1 1 -9  39  12 o 8  3.35705e+00 9.21221e-01 5.53036e+01 18.049  1.97043e+00  6.42078e-01  0.00000e+00 0.00000e+00 3.37577e+01 18.049  2.15458e+01 198.049 0.7093 
1 1 1 -9  39  13 o 14 7.39445e+00 5.97457e-01 1.56240e+02 98.309  -2.47545e+00 1.69494e+01  0.00000e+00 0.00000e+00 1.11825e+02 98.309  4.44144e+01 278.309 0.9704 
1 1 1 -9  39  14 o 5  8.53885e+00 5.07624e-01 1.33568e+02 228.950 -1.38885e+01 -1.59486e+01 0.00000e+00 0.00000e+00 1.77436e+02 228.950 4.38682e+01 228.950 0.9761 
1 1 1 -9  39  15 f 0  6.30997e+00 2.70115e+00 1.60871e+02 42.251  4.14046e+00  3.76109e+00  0.00000e+00 0.00000e+00 5.20815e+01 42.251  1.08789e+02 222.251 0.9055 
1 1 1 -9  39  16 o 17 5.73949e+00 2.60793e+00 5.14373e+01 297.045 8.20033e-01  -1.60625e+00 0.00000e+00 0.00000e+00 9.01335e+01 297.045 3.86962e+01 297.045 0.6627 
1 1 1 -9  39  17 o 15 5.86548e+00 2.71585e+00 1.10266e+02 145.944 -3.17699e+00 2.14746e+00  0.00000e+00 0.00000e+00 7.65398e+01 145.944 3.37260e+01 325.944 0.8569 
1 1 1 -9  40  1  o 2  1.46584e+01 6.14124e-01 3.05937e+02 316.018 1.04049e+01  -1.00416e+01 0.00000e+00 0.00000e+00 2.27386e+02 316.018 7.85512e+01 136.018 0.9648 
1 1 1 -9  40  2  o 3  2.44261e+01 7.76058e-01 2.31067e+02 127.474 -1.05538e+01 1.37670e+01  0.00000e+00 0.00000e+00 6.62719e+02 127.474 4.31651e+02 127.474 0.9707 
1 1 1 -9  40  3  o 2  3.15062e+01 6.80253e-01 6.66409e+02 154.729 -6.04401e+01 2.85324e+01  0.00000e+00 0.00000e+00 5.11677e+02 154.729 1.54732e+02 334.729 0.9925 
1 1 1 -9  40  4  o 18 2.50388e+01 6.21537e-01 4.56391e+02 24.493  3.69167e+01  1.68186e+01  0.00000e+00 0.00000e+00 4.74711e+02 24.493  1.83198e+01 24.493  0.9876 
1 1 1 -9  40  5  o 9  1.85203e+01 5.67565e-01 3.62644e+02 13.559  2.81333e+01  6.78467e+00  0.00000e+00 0.00000e+00 3.22116e+02 13.559  4.05281e+01 193.559 0.9826 
1 1 1 -9  40  6  f 0  1.90786e+01 5.68761e-01 3.06409e+02 119.979 -1.42066e+01 2.46275e+01  0.00000e+00 0.00000e+00 3.98272e+02 119.979 9.18632e+01 119.979 0.9823 
1 1 1 -9  40  7  o 19 1.09719e+01 1.01036e+00 1.94208e+02 55.178  6.75492e+00  9.71115e+00  0.00000e+00 0.00000e+00 2.00228e+02 55.178  6.01985e+00 55.178  0.9568 
1 1 1 -9  40  8  o 5  1.39994e+01 5.82582e-01 2.30067e+02 283.126 5.01447e+00  -2.15038e+01 0.00000e+00 0.00000e+00 2.83480e+02 283.126 5.34134e+01 283.126 0.9771 
1 1 1 -9  40  9  o 7  3.14163e+00 8.80855e-01 1.13645e+02 39.095  2.17349e+00  1.76602e+00  0.00000e+00 0.00000e+00 2.00673e+01 219.095 1.33713e+02 219.095 0.7941 
1 1 1 -9  40  10 o 9  5.93120e+00 8.81138e-01 4.15648e+01 323.936 1.78332e+00  -1.29870e+00 0.00000e+00 0.00000e+00 1.20445e+02 323.936 7.88797e+01 323.936 0.7289 
1 1 1 -9  40  11 o 8  7.03596e+00 7.83797e-01 1.58561e+02 269.572 -8.90764e-02 -1.19174e+01 0.00000e+00 0.00000e+00 9.35429e+01 269.572 6.50182e+01 89.572  0.9571 
1 1 1 -9  40  12 o 11 9.84696e+00 6.59283e-01 1.39331e+02 20.375  1.72480e+01  6.40578e+00  0.00000e+00 0.00000e+00 2.18771e+02 20.375  7.94401e+01 20.375  0.9724 
1 1 1 -9  40  13 o 9  6.97470e+00 6.41645e-01 1.25419e+02 121.757 -6.60292e+00 1.06674e+01  0.00000e+00 0.00000e+00 1.24516e+02 121.757 9.03551e-01 301.757 0.9593 
1 1 1 -9  40  14 o 15 1.16834e+01 5.21021e-01 2.21977e+02 220.914 -3.31120e+01 -2.86964e+01 0.00000e+00 0.00000e+00 2.08942e+02 220.914 1.30354e+01 40.914  0.9885 
1 1 1 -9  40  15 o 13 5.20141e+00 2.36614e+00 1.43036e+02 317.276 3.67830e+00  -3.39707e+00 0.00000e+00 0.00000e+00 3.01588e+01 317.276 1.12878e+02 137.276 0.8935 
1 1 1 -9  40  16 o 11 5.28288e+00 2.42467e+00 1.17767e+02 162.334 -4.03431e+00 1.28484e+00  0.00000e+00 0.00000e+00 5.36651e+01 162.334 6.41020e+01 342.334 0.8720 
1 1 1 -9  40  17 o 4  4.41568e+00 2.17476e+00 3.45683e+01 194.386 -1.23755e+00 -3.17434e-01 0.00000e+00 0.00000e+00 5.34210e+01 194.386 1.88527e+01 194.386 0.5362 
1 1 1 -9  41  1  o 9  3.92279e+01 8.68667e-01 6.31472e+02 33.209  6.30831e+01  4.12940e+01  0.00000e+00 0.00000e+00 8.37870e+02 33.209  2.06398e+02 33.209  0.9933 
1 1 1 -9  41  2  o 4  1.68693e+01 5.81160e-01 3.00787e+02 267.084 -8.29983e-01 -1.62964e+01 0.00000e+00 0.00000e+00 3.15222e+02 267.084 1.44356e+01 267.084 0.9689 
1 1 1 -9  41  3  o 16 1.00168e+01 1.14127e+00 1.71443e+02 95.481  -5.11459e-01 5.33002e+00  0.00000e+00 0.00000e+00 1.68543e+02 95.481  2.89967e+00 275.481 0.9010 
1 1 1 -9  41  4  o 1  2.21687e+01 6.04439e-01 2.77384e+02 85.860  1.53296e+00  2.11777e+01  0.00000e+00 0.00000e+00 5.37354e+02 85.860  2.59971e+02 85.860  0.9762 
1 1 1 -9  41  5  o 4  2.03345e+01 6.51305e-01 3.60387e+02 92.219  -1.20608e+00 3.11312e+01  0.00000e+00 0.00000e+00 3.92321e+02 92.219  3.19346e+01 92.219  0.9838 
1 1 1 -9  41  6  o 12 2.06690e+01 5.76182e-01 4.21958e+02 202.832 -3.81280e+01 -1.60524e+01 0.00000e+00 0.00000e+00 3.45723e+02 202.832 7.62343e+01 22.832  0.9878 
1 1 1 -9  41  7  o 9  3.15311e+01 6.61683e-01 5.72632e+02 59.287  5.22783e+01  8.80022e+01  0.00000e+00 0.00000e+00 6.06201e+02 59.287  3.35689e+01 59.287  0.9951 
1 1 1 -9  41  8  o 9  2.55889e+01 6.15937e-01 4.19379e+02 172.536 -7.49510e+01 9.81968e+00  0.00000e+00 0.00000e+00 5.34842e+02 172.536 1.15463e+02 172.536 0.9934 
1 1 1 -9  41  9  o 8  2.61974e+00 8.02623e-01 3.06877e+01 309.386 3.85874e-01  -4.70000e-01 0.00000e+00 0.00000e+00 2.11305e+00 129.386 3.28007e+01 129.386 0.2908 
1 1 1 -9  41  10 o 12 1.32376e+01 6.03248e-01 1.82335e+02 182.505 -2.34418e+01 -1.02571e+00 0.00000e+00 0.00000e+00 3.03006e+02 182.505 1.20672e+02 182.505 0.9785 
1 1 1 -9  41  11 o 16 6.28992e+00 8.75288e-01 1.27687e+02 290.788 2.78015e+00  -7.32321e+00 0.00000e+00 0.00000e+00 9.21783e+01 290.788 3.55091e+01 110.789 0.9338 
1 1 1 -9  41  12 o 4  1.08256e+01 6.30167e-01 2.26363e+02 86.313  2.04031e+00  3.16643e+01  0.00000e+00 0.00000e+00 1.72014e+02 86.313  5.43491e+01 266.313 0.9841 
1 1 1 -9  41  13 o 4  6.87718e+00 7.71899e-01 8.72986e+01 176.578 -9.31434e+00 5.56930e-01  0.00000e+00 0.00000e+00 1.55393e+02 176.578 6.80941e+01 176.578 0.9448 
1 1 1 -9  41  14 o 5  6.54479e+00 6.57119e-01 1.64599e+02 28.038  1.69900e+01  9.04810e+00  0.00000e+00 0.00000e+00 7.31393e+01 28.038  9.14595e+01 208.038 0.9737 
1 1 1 -9  41  15 o 6  8.10224e+00 2.95561e+00 1.38391e+02 195.971 -5.09879e+00 -1.45931e+00 0.00000e+00 0.00000e+00 1.33307e+02 195.971 5.08369e+00 15.972  0.9000 
1 1 1 -9  41  16 o 13 6.35811e+00 2.68659e+00 1.57548e+02 352.614 5.77734e+00  -7.48887e-01 0.00000e+00 0.00000e+00 5.76519e+01 352.614 9.98956e+01 172.614 0.9096 
1 1 1 -9  41  17 o 2  3.90686e+00 1.87410e+00 3.77684e+01 33.186  1.31377e+00  8.59264e-01  0.00000e+00 0.00000e+00 5.12174e+01 33.186  1.34489e+01 33.186  0.6129 
1 1 1 -9  42  1  o 3  1.85852e+01 6.40574e-01 2.74849e+02 259.891 -2.86684e+00 -1.60802e+01 0.00000e+00 0.00000e+00 4.04071e+02 259.891 1.29222e+02 259.891 0.9689 
1 1 1 -9  42  2  f 0  1.49690e+01 7.12857e-01 3.78903e+02 53.272  1.11177e+01  1.49003e+01  0.00000e+00 0.00000e+00 1.69832e+02 53.272  2.09071e+02 233.272 0.9727 
1 1 1 -9  42  3  o 19 1.91369e+01 5.96075e-01 3.17458e+02 108.802 -6.97493e+00 2.04866e+01  0.00000e+00 0.00000e+00 3.86509e+02 108.802 6.90505e+01 108.802 0.9766 
1 1 1 -9  42  4  o 10 1.46907e+01 5.69233e-01 1.85993e+02 277.849 1.46469e+00  -1.06247e+01 0.00000e+00 0.00000e+00 3.40587e+02 277.849 1.54595e+02 277.849 0.9522 
1 1 1 -9  42  5  o 9  5.79513e+00 8.99369e-01 5.28000e+01 1.070   1.29707e+00  2.42256e-02  0.00000e+00 0.00000e+00 6.53417e+01 1.070   1.25417e+01 1.070   0.5419 
1 1 1 -9  42  6  o 1  1.68909e+01 5.71418e-01 2.53947e+02 239.456 -1.10961e+01 -1.88041e+01 0.00000e+00 0.00000e+00 3.66343e+02 239.456 1.12396e+02 239.456 0.9768 
1 1 1 -9  42  7  o 18 1.38167e+01 5.67236e-01 2.07805e+02 147.124 -1.39340e+01 9.00613e+00  0.00000e+00 0.00000e+00 2.95339e+02 147.124 8.75335e+01 147.124 0.9694 
1 1 1 -9  42  8  o 1  1.95712e+01 5.71900e-01 3.38212e+02 319.336 3.75445e+01  -3.22529e+01 0.00000e+00 0.00000e+00 3.88938e+02 319.336 5.07257e+01 319.336 0.9898 
1 1 1 -9  42  9  o 17 5.73758e+00 8.43557e-01 1.15792e+02 206.814 -4.82032e+00 -2.43639e+00 0.00000e+00 0.00000e+00 7.82759e+01 206.814 3.75163e+01 26.814  0.9019 
1 1 1 -9  42  10 o 10 4.80559e+00 8.95396e-01 9.65670e+01 201.064 -3.90065e+00 -1.50235e+00 0.00000e+00 0.00000e+00 6.00949e+01 201.064 3.64721e+01 21.064  0.8701 
1 1 1 -9  42  11 o 17 2.78697e+01 6.63139e-01 5.17000e+02 22.517  1.49659e+02  6.20415e+01  0.00000e+00 0.00000e+00 5.22917e+02 22.517  5.91685e+00 22.517  0.9969 
1 1 1 -9  42  12 o 7  7.38604e+00 7.57542e-01 1.16747e+02 84.459  1.10319e+00  1.13717e+01  0.00000e+00 0.00000e+00 1.47035e+02 84.459  3.02884e+01 84.459  0.9552 
1 1 1 -9  42  13 o 9  3.00868e+00 8.39401e-01 3.93245e+01 144.329 -1.41302e+00 1.01426e+00  0.00000e+00 0.00000e+00 3.37113e+01 144.329 5.61324e+00 324.329 0.6500 
1 1 1 -9  42  14 o 17 1.12694e+01 5.50497e-01 2.10015e+02 194.134 -3.99188e+01 -1.00522e+01 0.00000e+00 0.00000e+00 2.05230e+02 194.134 4.78548e+00 14.134  0.9878 
1 1 1 -9  42  15 o 6  5.76741e+00 2.52355e+00 7.36467e+01 135.231 -1.86191e+00 1.84693e+00  0.00000e+00 0.00000e+00 9.34590e+01 135.231 1.98123e+01 135.231 0.7777 
1 1 1 -9  42  16 o 1  5.08950e+00 2.41961e+00 2.08975e+02 27.318  6.49620e+00  3.35547e+00  0.00000e+00 0.00000e+00 3.30788e+01 207.318 2.42053e+02 207.318 0.9289 
1 1 1 -9  42  17 o 16 3.97877e+00 1.36034e+00 1.73593e+01 272.508 4.87330e-02  -1.11259e+00 0.00000e+00 0.00000e+00 5.43737e+01 272.508 3.70144e+01 272.508 0.4852 
1 1 1 -9  43  1  f 0  1.32354e+01 6.71003e-01 1.89303e+02 21.662  7.65088e+00  3.03877e+00  0.00000e+00 0.00000e+00 2.78291e+02 21.662  8.89879e+01 21.662  0.9371 
1 1 1 -9  43  2  o 13 2.63219e+01 6.32262e-01 3.18637e+02 5.158   2.97364e+01  2.68399e+00  0.00000e+00 0.00000e+00 6.56464e+02 5.158   3.37826e+02 5.158   0.9831 
1 1 1 -9  43  3  o 13 4.05138e+01 7.97945e-01 7.06090e+02 218.278 -7.62690e+01 -6.01856e+01 0.00000e+00 0.00000e+00 8.11879e+02 218.278 1.05789e+02 218.278 0.9948 
1 1 1 -9  43  4  o 6  1.91521e+01 5.62397e-01 4.09668e+02 347.119 3.29766e+01  -7.54134e+00 0.00000e+00 0.00000e+00 3.00492e+02 347.119 1.09176e+02 167.119 0.9851 
1 1 1 -9  43  5  o 16 1.67573e+01 7.27340e-01 2.54992e+02 342.621 1.84664e+01  -5.77953e+00 0.00000e+00 0.00000e+00 3.58848e+02 342.621 1.03856e+02 342.621 0.9738 
1 1 1 -9  43  6  o 13 1.56525e+01 5.81281e-01 3.44284e+02 202.949 -2.70502e+01 -1.14539e+01 0.00000e+00 0.00000e+00 2.33994e+02 202.949 1.10290e+02 22.949  0.9828 
1 1 1 -9  43  7  o 5  1.11118e+01 6.04924e-01 3.04627e+02 331.904 1.82782e+01  -9.75787e+00 0.00000e+00 0.00000e+00 1.02549e+02 331.904 2.02078e+02 151.904 0.9756 
1 1 1 -9  43  8  o 9  1.71089e+01 5.73596e-01 2.61246e+02 100.154 -5.91861e+00 3.30463e+01  0.00000e+00 0.00000e+00 3.71229e+02 100.154 1.09983e+02 100.154 0.9850 
1 1 1 -9  43  9  f 0  1.66703e+01 5.83216e-01 2.14176e+02 112.565 -1.19478e+01 2.87520e+01  0.00000e+00 0.00000e+00 4.00803e+02 112.565 1.86627e+02 112.565 0.9838 
1 1 1 -9  43  10 o 12 9.59590e+00 6.51840e-01 2.18444e+02 137.992 -1.65799e+01 1.49330e+01  0.00000e+00 0.00000e+00 1.32892e+02 137.992 8.55519e+01 317.992 0.9773 
1 1 1 -9  43  11 o 3  3.41755e+00 9.75878e-01 4.25647e+01 18.930  1.45779e+00  4.99956e-01  0.00000e+00 0.00000e+00 3.49612e+01 18.930  7.60346e+00 198.930 0.6061 
1 1 1 -9  43  12 o 5  4.89492e+00 9.56260e-01 9.42865e+01 61.646  2.69129e+00  4.98699e+00  0.00000e+00 0.00000e+00 7.16641e+01 61.646  2.26223e+01 241.646 0.9069 
1 1 1 -9  43  13 o 6  4.38524e+00 8.53107e-01 4.18793e+01 273.822 1.79788e-01  -2.69117e+00 0.00000e+00 0.00000e+00 8.66450e+01 273.822 4.47657e+01 273.822 0.7848 
1 1 1 -9  43  14 o 4  4.34280e+00 8.84714e-01 1.32455e+02 307.179 5.64296e+00  -7.44006e+00 0.00000e+00 0.00000e+00 2.05895e+01 307.179 1.11865e+02 127.179 0.9448 
1 1 1 -9  43  15 o 12 4.16337e+00 2.00684e+00 6.59103e+01 34.010  1.90785e+00  1.28737e+00  0.00000e+00 0.00000e+00 4.91037e+01 34.010  1.68065e+01 214.010 0.7416 
1 1 1 -9  43  16 o 9  5.71730e+00 1.63327e+00 1.02872e+02 282.607 1.53343e+00  -6.85635e+00 0.00000e+00 0.00000e+00 9.40518e+01 282.607 8.81989e+00 102.607 0.9258 
1 1 1 -9  44  1  o 3  2.57024e+01 7.11428e-01 4.33866e+02 230.732 -2.49127e+01 -3.04716e+01 0.00000e+00 0.00000e+00 5.22580e+02 230.732 8.87137e+01 230.732 0.9872 
1 1 1 -9  44  2  o 8  8.75266e+00 7.54706e-01 1.51001e+02 184.126 -4.50430e+00 -3.24919e-01 0.00000e+00 0.00000e+00 1.39465e+02 184.126 1.15357e+01 4.126   0.8808 
1 1 1 -9  44  3  o 2  2.54598e+01 6.30287e-01 4.70904e+02 2.333   4.68065e+01  1.90656e+00  0.00000e+00 0.00000e+00 4.77566e+02 2.333   6.66162e+00 2.333   0.9893 
1 1 1 -9  44  4  o 14 6.64445e+00 8.57510e-01 5.21753e+01 27.163  1.27919e+00  6.56367e-01  0.00000e+00 0.00000e+00 9.29573e+01 27.163  4.07820e+01 27.163  0.5804 
1 1 1 -9  44  5  o 19 8.52720e+00 6.96047e-01 1.87603e+02 332.969 6.82443e+00  -3.48188e+00 0.00000e+00 0.00000e+00 1.11393e+02 332.969 7.62099e+01 152.969 0.9322 
1 1 1 -9  44  6  o 19 2.01500e+01 5.74069e-01 3.46227e+02 49.598  2.71071e+01  3.18482e+01  0.00000e+00 0.00000e+00 4.02019e+02 49.598  5.57918e+01 49.598  0.9880 
1 1 1 -9  44  7  o 7  1.14402e+01 5.95782e-01 1.41156e+02 317.226 7.40271e+00  -6.84873e+00 0.00000e+00 0.00000e+00 2.66613e+02 317.226 1.25457e+02 317.226 0.9490 
1 1 1 -9  44  8  o 6  9.60170e+00 6.31205e-01 2.20837e+02 219.932 -1.18424e+01 -9.91297e+00 0.00000e+00 0.00000e+00 1.27612e+02 219.932 9.32256e+01 39.932  0.9671 
1 1 1 -9  44  9  o 17 1.76554e+01 5.74080e-01 3.19361e+02 217.340 -4.11732e+01 -3.14106e+01 0.00000e+00 0.00000e+00 3.36175e+02 217.340 1.68143e+01 217.340 0.9903 
1 1 1 -9  44  10 o 7  6.12834e+00 1.00627e+00 1.56918e+02 50.391  5.74501e+00  6.94225e+00  0.00000e+00 0.00000e+00 5.94982e+01 50.391  9.74198e+01 230.391 0.9428 
1 1 1 -9  44  11 o 14 1.38362e+01 7.40725e-01 2.11927e+02 274.467 2.77162e+00  -3.54768e+01 0.00000e+00 0.00000e+00 2.98501e+02 274.467 8.65744e+01 274.467 0.9858 
1 1 1 -9  44  12 o 7  9.04022e+00 7.24328e-01 1.80693e+02 52.856  1.37916e+01  1.82066e+01  0.00000e+00 0.00000e+00 1.49753e+02 52.856  3.09399e+01 232.856 0.9779 
1 1 1 -9  44  13 o 3  3.51122e+00 8.78403e-01 1.30475e+02 127.339 -4.00030e+00 5.24379e+00  0.00000e+00 0.00000e+00 9.76601e+00 307.339 1.40241e+02 307.339 0.9207 
1 1 1 -9  44  14 o 7  4.21257e+00 8.70123e-01 7.04157e+01 213.086 -4.04904e+00 -2.63816e+00 0.00000e+00 0.00000e+00 6.93051e+01 213.086 1.11066e+00 33.086  0.8894 
1 1 1 -9  44  15 o 15 4.52208e+00 1.32642e+00 6.28543e+01 345.988 3.72863e+00  -9.30452e-01 0.00000e+00 0.00000e+00 8.15297e+01 345.988 1.86753e+01 345.988 0.8572 
1 1 1 -9  44  16 o 10 5.08545e+00 1.54699e+00 5.34422e+01 327.074 2.81029e+00  -1.81987e+00 0.00000e+00 0.00000e+00 1.04093e+02 327.074 5.06503e+01 327.074 0.8328 
1 1 1 -9  45  1  o 18 1.84879e+01 6.68348e-01 4.00435e+02 269.716 -1.26292e-01 -2.54687e+01 0.00000e+00 0.00000e+00 2.82551e+02 269.716 1.17884e+02 89.716  0.9802 
1 1 1 -9  45  2  o 17 2.85625e+01 6.59018e-01 4.63743e+02 16.845  4.94876e+01  1.49834e+01  0.00000e+00 0.00000e+00 6.01825e+02 16.845  1.38082e+02 16.845  0.9903 
1 1 1 -9  45  3  o 6  2.34148e+01 6.12069e-01 4.05677e+02 133.518 -2.80860e+01 2.95777e+01  0.00000e+00 0.00000e+00 4.65087e+02 133.518 5.94102e+01 133.518 0.9877 
1 1 1 -9  45  4  o 2  2.53722e+01 5.91809e-01 4.20268e+02 65.882  1.91666e+01  4.28122e+01  0.00000e+00 0.00000e+00 5.24293e+02 65.882  1.04025e+02 65.882  0.9893 
1 1 1 -9  45  5  o 7  2.27837e+01 5.68682e-01 4.18645e+02 287.770 1.37953e+01  -4.30441e+01 0.00000e+00 0.00000e+00 4.28660e+02 287.770 1.00144e+01 287.770 0.9889 
1 1 1 -9  45  6  o 6  1.08111e+01 6.09476e-01 1.67869e+02 280.876 1.95866e+00  -1.01939e+01 0.00000e+00 0.00000e+00 2.18329e+02 280.876 5.04602e+01 280.876 0.9505 
1 1 1 -9  45  7  o 2  1.07946e+01 6.12128e-01 2.22151e+02 246.096 -6.63617e+00 -1.49728e+01 0.00000e+00 0.00000e+00 1.70637e+02 246.096 5.15140e+01 66.096  0.9690 
1 1 1 -9  45  8  f 0  1.17338e+01 6.76565e-01 2.24467e+02 103.417 -4.65468e+00 1.95128e+01  0.00000e+00 0.00000e+00 2.04687e+02 103.417 1.97795e+01 283.417 0.9747 
1 1 1 -9  45  9  o 15 9.13162e+00 8.05813e-01 2.43702e+02 23.883  1.76781e+01  7.82747e+00  0.00000e+00 0.00000e+00 8.96567e+01 23.883  1.54045e+02 203.883 0.9738 
1 1 1 -9  45  10 o 15 1.09563e+01 7.58129e-01 2.34448e+02 257.521 -5.88269e+00 -2.65810e+01 0.00000e+00 0.00000e+00 1.68294e+02 257.521 6.61542e+01 77.521  0.9815 
1 1 1 -9  45  11 o 8  7.54084e+00 1.32214e+00 5.96510e+01 297.905 2.07546e+00  -3.91911e+00 0.00000e+00 0.00000e+00 1.88181e+02 297.905 1.28530e+02 297.905 0.8784 
1 1 1 -9  45  12 o 9  3.90174e+00 9.48225e-01 5.73782e+01 156.256 -2.48634e+00 1.09371e+00  0.00000e+00 0.00000e+00 5.73336e+01 156.256 4.46521e-02 336.256 0.7866 
1 1 1 -9  45  13 o 14 4.09470e+00 8.87965e-01 6.15291e+01 98.858  -5.58451e-01 3.58343e+00  0.00000e+00 0.00000e+00 6.80226e+01 98.858  6.49347e+00 98.858  0.8475 
1 1 1 -9  45  14 o 12 3.55519e+00 8.84683e-01 5.38254e+01 177.432 -3.15520e+00 1.41497e-01  0.00000e+00 0.00000e+00 5.50218e+01 177.432 1.19645e+00 177.432 0.8210 
1 1 1 -9  45  15 o 5  3.63158e+00 1.20484e+00 6.51520e+01 231.687 -1.99922e+00 -2.53024e+00 0.00000e+00 0.00000e+00 4.64733e+01 231.687 1.86787e+01 51.687  0.8253 
1 1 1 -9  45  16 o 18 5.60946e+00 1.61240e+00 7.52092e+01 324.022 4.17788e+00  -3.03290e+00 0.00000e+00 0.00000e+00 1.11946e+02 324.022 3.67364e+01 324.022 0.8970 
1 1 1 -9  46  1  o 9  3.03245e+01 6.87843e-01 6.89126e+02 155.685 -7.40285e+01 3.34489e+01  0.00000e+00 0.00000e+00 4.46599e+02 155.685 2.42528e+02 335.685 0.9938 
1 1 1 -9  46  2  f 0  2.19911e+01 6.10409e-01 5.41421e+02 57.495  2.75297e+01  4.32043e+01  0.00000e+00 0.00000e+00 2.78812e+02 57.495  2.62609e+02 237.495 0.9902 
1 1 1 -9  46  3  o 6  2.50087e+01 5.92985e-01 5.01843e+02 251.748 -1.68126e+01 -5.09797e+01 0.00000e+00 0.00000e+00 4.30884e+02 251.748 7.09581e+01 71.748  0.9906 
1 1 1 -9  46  4  o 2  1.02014e+01 9.24911e-01 1.98230e+02 15.182  8.59136e+00  2.33127e+00  0.00000e+00 0.00000e+00 1.63365e+02 15.182  3.48648e+01 195.182 0.9420 
1 1 1 -9  46  5  o 2  2.02725e+01 5.53720e-01 2.89605e+02 31.687  2.54190e+01  1.56912e+01  0.00000e+00 0.00000e+00 4.59826e+02 31.687  1.70220e+02 31.687  0.9831 
1 1 1 -9  46  6  o 13 1.44923e+01 5.61116e-01 1.90205e+02 71.156  5.15401e+00  1.51020e+01  0.00000e+00 0.00000e+00 3.37016e+02 71.156  1.46811e+02 71.156  0.9681 
1 1 1 -9  46  7  o 4  1.11633e+01 9.41414e-01 1.84740e+02 1.823   1.36106e+01  4.33209e-01  0.00000e+00 0.00000e+00 2.18724e+02 1.823   3.39840e+01 1.823   0.9626 
1 1 1 -9  46  8  o 19 1.41122e+01 6.96775e-01 2.30338e+02 98.161  -3.77891e+00 2.63493e+01  0.00000e+00 0.00000e+00 2.89069e+02 98.161  5.87310e+01 98.161  0.9810 
1 1 1 -9  46  9  o 12 8.11905e+00 8.37141e-01 1.03740e+02 283.616 1.70595e+00  -7.04269e+00 0.00000e+00 0.00000e+00 1.78739e+02 283.616 7.49995e+01 283.616 0.9282 
1 1 1 -9  46  10 o 13 8.92256e+00 9.09714e-01 1.60500e+02 49.762  9.02226e+00  1.06620e+01  0.00000e+00 0.00000e+00 1.61446e+02 49.762  9.46068e-01 49.762  0.9635 
1 1 1 -9  46  11 f 0  4.04519e+00 1.01035e+00 7.19714e+01 149.779 -2.85718e+00 1.66434e+00  0.00000e+00 0.00000e+00 5.36860e+01 149.779 1.82854e+01 329.779 0.8303 
1 1 1 -9  46  12 o 6  7.74803e+00 7.89295e-01 1.62038e+02 210.307 -1.45063e+01 -8.47928e+00 0.00000e+00 0.00000e+00 1.18763e+02 210.307 4.32755e+01 30.307  0.9698 
1 1 1 -9  46  13 o 9  8.45175e+00 7.00412e-01 1.20802e+02 13.880  1.55025e+01  3.83070e+00  0.00000e+00 0.00000e+00 1.84651e+02 13.880  6.38497e+01 13.880  0.9682 
1 1 1 -9  46  14 o 3  3.85397e+00 7.81480e-01 6.60543e+01 173.124 -4.15535e+00 5.01086e-01  0.00000e+00 0.00000e+00 5.90023e+01 173.124 7.05194e+00 353.124 0.8703 
1 1 1 -9  46  15 o 12 5.01664e+00 1.46070e+00 8.57691e+01 100.323 -9.31502e-01 5.11416e+00  0.00000e+00 0.00000e+00 8.19477e+01 100.323 3.82141e+00 280.323 0.8978 
1 1 1 -9  46  16 o 1  5.10927e+00 1.52209e+00 1.14188e+02 309.144 4.78708e+00  -5.88116e+00 0.00000e+00 0.00000e+00 6.28115e+01 309.144 5.13767e+01 129.145 0.9315 
1 1 1 -9  47  1  o 3  1.27355e+01 6.43772e-01 2.35967e+02 45.162  9.07131e+00  9.12260e+00  0.00000e+00 0.00000e+00 2.24864e+02 45.162  1.11027e+01 225.161 0.9603 
1 1 1 -9  47  2  o 17 1.63061e+01 6.07453e-01 2.87521e+02 15.652  1.93155e+01  5.41174e+00  0.00000e+00 0.00000e+00 3.11109e+02 15.652  2.35877e+01 15.652  0.9747 
1 1 1 -9  47  3  o 8  1.38959e+01 5.90107e-01 2.82895e+02 10.136  1.70298e+01  3.04438e+00  0.00000e+00 0.00000e+00 2.24845e+02 10.136  5.80504e+01 190.136 0.9707 
1 1 1 -9  47  4  o 14 2.14340e+01 5.73529e-01 3.38844e+02 22.931  3.24633e+01  1.37339e+01  0.00000e+00 0.00000e+00 4.56023e+02 22.931  1.17179e+02 22.931  0.9857 
1 1 1 -9  47  5  o 15 1.40559e+01 5.61818e-01 1.81541e+02 87.559  5.92484e-01  1.38975e+01  0.00000e+00 0.00000e+00 3.27566e+02 87.559  1.46025e+02 87.559  0.9634 
1 1 1 -9  47  6  o 11 1.60995e+01 6.35898e-01 3.79998e+02 194.680 -3.60964e+01 -9.45647e+00 0.00000e+00 0.00000e+00 2.16727e+02 194.680 1.63270e+02 14.680  0.9865 
1 1 1 -9  47  7  o 13 1.12451e+01 7.01104e-01 1.96219e+02 250.210 -5.45925e+00 -1.51718e+01 0.00000e+00 0.00000e+00 2.12650e+02 250.210 1.64315e+01 250.210 0.9685 
1 1 1 -9  47  8  o 11 1.16335e+01 7.41947e-01 1.94389e+02 237.084 -9.41065e+00 -1.45379e+01 0.00000e+00 0.00000e+00 2.29219e+02 237.084 3.48294e+01 237.084 0.9707 
1 1 1 -9  47  9  o 12 7.19358e+00 9.06172e-01 8.58703e+01 289.368 1.81699e+00  -5.16881e+00 0.00000e+00 0.00000e+00 1.57701e+02 289.368 7.18304e+01 289.368 0.9034 
1 1 1 -9  47  10 o 13 1.28938e+01 7.45153e-01 2.06468e+02 235.443 -1.63346e+01 -2.37161e+01 0.00000e+00 0.00000e+00 2.67870e+02 235.443 6.14029e+01 235.443 0.9825 
1 1 1 -9  47  11 o 3  7.44683e+00 7.44566e-01 1.35352e+02 190.964 -1.17705e+01 -2.28036e+00 0.00000e+00 0.00000e+00 1.31324e+02 190.964 4.02748e+00 10.964  0.9573 
1 1 1 -9  47  12 o 2  7.79903e+00 7.78607e-01 1.15494e+02 297.771 5.82877e+00  -1.10690e+01 0.00000e+00 0.00000e+00 1.64027e+02 297.771 4.85325e+01 297.771 0.9592 
1 1 1 -9  47  13 f 0  4.24688e+00 9.16731e-01 8.95995e+01 335.398 5.10306e+00  -2.33661e+00 0.00000e+00 0.00000e+00 5.39946e+01 335.398 3.56049e+01 155.398 0.9059 
1 1 1 -9  47  14 o 12 4.88934e+00 9.08225e-01 1.11175e+02 99.807  -1.54550e+00 8.94069e+00  0.00000e+00 0.00000e+00 6.07417e+01 99.807  5.04330e+01 279.807 0.9432 
1 1 1 -9  47  15 o 11 3.76075e+00 1.22218e+00 3.78763e+01 224.861 -1.46522e+00 -1.45814e+00 0.00000e+00 0.00000e+00 6.13319e+01 224.861 2.34556e+01 224.861 0.7085 
1 1 1 -9  47  16 o 10 7.28734e+00 1.84313e+00 1.56541e+02 242.064 -5.52254e+00 -1.04147e+01 0.00000e+00 0.00000e+00 1.02677e+02 242.064 5.38642e+01 62.064  0.9566 
1 1 1 -9  48  1  o 10 7.13354e+00 8.63315e-01 1.52315e+02 37.527  3.57230e+00  2.74382e+00  0.00000e+00 0.00000e+00 8.43166e+01 37.527  6.79981e+01 217.527 0.8805 
1 1 1 -9  48  2  o 13 3.69482e+01 7.57776e-01 6.44321e+02 52.753  6.23320e+01  8.19808e+01  0.00000e+00 0.00000e+00 7.40308e+02 52.753  9.59876e+01 52.753  0.9951 
1 1 1 -9  48  3  o 2  2.17892e+01 5.71388e-01 5.10830e+02 295.588 2.21319e+01  -4.62176e+01 0.00000e+00 0.00000e+00 3.01248e+02 295.588 2.09582e+02 115.588 0.9902 
1 1 1 -9  48  4  o 18 1.22294e+01 6.84016e-01 2.56464e+02 65.441  6.08927e+00  1.33254e+01  0.00000e+00 0.00000e+00 1.87583e+02 65.441  6.88817e+01 245.441 0.9652 
1 1 1 -9  48  5  o 11 1.36585e+01 6.70778e-01 3.01816e+02 155.840 -2.21911e+01 9.95458e+00  0.00000e+00 0.00000e+00 2.00981e+02 155.840 1.00835e+02 335.840 0.9792 
1 1 1 -9  48  6  o 6  5.58069e+00 1.29258e+00 9.85694e+01 343.150 2.84933e+00  -8.62992e-01 0.00000e+00 0.00000e+00 7.08859e+01 343.150 2.76836e+01 163.150 0.8083 
1 1 1 -9  48  7  o 7  7.53748e+00 8.70636e-01 1.48421e+02 283.278 1.81906e+00  -7.70862e+00 0.00000e+00 0.00000e+00 1.16006e+02 283.278 3.24151e+01 103.278 0.9346 
1 1 1 -9  48  8  o 4  4.60514e+00 1.01228e+00 1.03254e+02 267.406 -1.69078e-01 -3.73180e+00 0.00000e+00 0.00000e+00 4.40006e+01 267.406 5.92533e+01 87.406  0.8525 
1 1 1 -9  48  9  o 11 6.18830e+00 1.00618e+00 1.20112e+02 264.906 -5.73071e-01 -6.42929e+00 0.00000e+00 0.00000e+00 9.29812e+01 264.906 2.71312e+01 84.906  0.9189 
1 1 1 -9  48  10 o 15 1.03788e+01 8.11090e-01 1.87826e+02 18.197  1.84305e+01  6.05870e+00  0.00000e+00 0.00000e+00 1.90595e+02 18.197  2.76945e+00 18.197  0.9739 
1 1 1 -9  48  11 o 6  6.48635e+00 8.24387e-01 1.68046e+02 333.013 1.17932e+01  -6.00561e+00 0.00000e+00 0.00000e+00 6.52001e+01 333.013 1.02845e+02 153.013 0.9614 
1 1 1 -9  48  12 f 0  7.30810e+00 7.09999e-01 1.31884e+02 146.158 -1.12164e+01 7.52059e+00  0.00000e+00 0.00000e+00 1.30847e+02 146.158 1.03719e+00 326.158 0.9622 
1 1 1 -9  48  13 o 8  4.82294e+00 8.19187e-01 1.09221e+02 260.591 -1.39813e+00 -8.43706e+00 0.00000e+00 0.00000e+00 5.98939e+01 260.591 4.93268e+01 80.591  0.9396 
1 1 1 -9  48  14 o 3  5.25061e+00 8.96988e-01 9.56346e+01 250.587 -2.92712e+00 -8.30611e+00 0.00000e+00 0.00000e+00 8.86120e+01 250.587 7.02261e+00 70.587  0.9414 
1 1 1 -9  48  15 o 10 4.69135e+00 1.27613e+00 5.74308e+01 141.159 -2.97021e+00 2.39160e+00  0.00000e+00 0.00000e+00 9.20624e+01 141.159 3.46316e+01 141.159 0.8559 
1 1 1 -9  48  16 o 1  5.50125e+00 1.69350e+00 8.52007e+01 351.697 5.27161e+00  -7.69358e-01 0.00000e+00 0.00000e+00 9.89765e+01 351.697 1.37758e+01 351.697 0.9005 
1 1 1 -9  49  1  o 9  1.52400e+01 6.81545e-01 2.52394e+02 111.007 -6.00952e+00 1.56500e+01  0.00000e+00 0.00000e+00 3.04305e+02 111.007 5.19114e+01 111.007 0.9697 
1 1 1 -9  49  2  o 13 1.25047e+01 7.46476e-01 2.14223e+02 134.709 -8.51908e+00 8.60603e+00  0.00000e+00 0.00000e+00 2.36737e+02 134.709 2.25146e+01 134.709 0.9578 
1 1 1 -9  49  3  o 5  1.69466e+01 6.63562e-01 3.00673e+02 305.087 1.40709e+01  -2.00308e+01 0.00000e+00 0.00000e+00 3.23926e+02 305.087 2.32539e+01 305.087 0.9794 
1 1 1 -9  49  4  o 17 9.79284e+00 7.60927e-01 1.71962e+02 234.128 -5.25289e+00 -7.26410e+00 0.00000e+00 0.00000e+00 1.75171e+02 234.128 3.20906e+00 234.128 0.9425 
1 1 1 -9  49  5  o 11 1.70979e+01 6.47440e-01 3.21180e+02 350.901 3.10745e+01  -4.97674e+00 0.00000e+00 0.00000e+00 3.11203e+02 350.901 9.97752e+00 170.901 0.9840 
1 1 1 -9  49  6  f 0  9.02203e+00 9.34411e-01 1.33303e+02 302.036 4.09552e+00  -6.54506e+00 0.00000e+00 0.00000e+00 1.82805e+02 302.036 4.95015e+01 302.036 0.9328 
1 1 1 -9  49  7  o 4  9.40607e+00 7.49718e-01 1.90236e+02 347.287 1.31305e+01  -2.96215e+00 0.00000e+00 0.00000e+00 1.49427e+02 347.287 4.08095e+01 167.287 0.9621 
1 1 1 -9  49  8  o 10 4.29642e+00 9.78827e-01 6.07851e+01 148.794 -1.85407e+00 1.12314e+00  0.00000e+00 0.00000e+00 5.57868e+01 148.794 4.99829e+00 328.794 0.7235 
1 1 1 -9  49  9  o 13 1.00099e+01 7.81441e-01 1.07120e+02 239.965 -5.51180e+00 -9.53329e+00 0.00000e+00 0.00000e+00 2.50486e+02 239.965 1.43366e+02 239.965 0.9535 
1 1 1 -9  49  10 o 3  4.81711e+00 1.06817e+00 1.20807e+02 199.952 -5.35871e+00 -1.94533e+00 0.00000e+00 0.00000e+00 4.28270e+01 199.952 7.79805e+01 19.952  0.9074 
1 1 1 -9  49  11 o 9  4.22439e+00 8.68980e-01 1.03190e+02 110.141 -1.90604e+00 5.19697e+00  0.00000e+00 0.00000e+00 3.96973e+01 110.141 6.34928e+01 290.141 0.9045 
1 1 1 -9  49  12 o 16 2.85892e+00 7.88087e-01 7.13475e+01 51.906  1.94268e+00  2.47813e+00  0.00000e+00 0.00000e+00 1.62723e+01 51.906  5.50752e+01 231.906 0.8204 
1 1 1 -9  49  13 o 12 6.54644e+00 8.00655e-01 7.14667e+01 294.452 2.93201e+00  -6.44787e+00 0.00000e+00 0.00000e+00 1.54845e+02 294.452 8.33780e+01 294.452 0.9265 
1 1 1 -9  49  14 o 12 6.04004e+00 8.61247e-01 8.34763e+01 141.117 -6.61530e+00 5.33461e+00  0.00000e+00 0.00000e+00 1.27946e+02 141.117 4.44701e+01 141.117 0.9392 
1 1 1 -9  49  15 o 5  6.65666e+00 1.31201e+00 8.88650e+01 145.468 -6.80994e+00 4.68588e+00  0.00000e+00 0.00000e+00 1.43411e+02 145.468 5.45462e+01 145.468 0.9374 
1 1 1 -9  49  16 o 3  3.39255e+00 1.16044e+00 5.67716e+01 321.259 2.53574e+00  -2.03451e+00 0.00000e+00 0.00000e+00 4.75230e+01 321.259 9.24857e+00 141.259 0.8270 
1 1 1 -9  50  1  o 15 1.96830e+01 6.81070e-01 3.35275e+02 325.326 2.61131e+01  -1.80639e+01 0.00000e+00 0.00000e+00 3.94318e+02 325.326 5.90429e+01 325.326 0.9841 
1 1 1 -9  50  2  o 4  4.07755e+00 9.90351e-01 6.42876e+01 174.851 -1.19709e+00 1.07873e-01  0.00000e+00 0.00000e+00 1.45227e+01 174.851 4.97649e+01 354.851 0.5134 
1 1 1 -9  50  3  o 5  2.96248e+01 8.48357e-01 4.27673e+02 329.917 5.38297e+01  -3.11828e+01 0.00000e+00 0.00000e+00 6.78072e+02 329.917 2.50399e+02 329.917 0.9919 
1 1 1 -9  50  4  o 5  3.81826e+00 9.74868e-01 5.79913e+01 98.955  -1.93125e-01 1.22561e+00  0.00000e+00 0.00000e+00 1.74264e+01 98.955  4.05649e+01 278.955 0.5252 
1 1 1 -9  50  5  o 9  8.99321e+00 9.94493e-01 1.02824e+02 38.927  4.11656e+00  3.32490e+00  0.00000e+00 0.00000e+00 2.01278e+02 38.927  9.84541e+01 38.927  0.8997 
1 1 1 -9  50  6  o 19 1.02693e+01 7.26892e-01 1.83026e+02 21.625  1.20703e+01  4.78495e+00  0.00000e+00 0.00000e+00 1.87492e+02 21.625  4.46595e+00 21.625  0.9607 
1 1 1 -9  50  7  o 13 7.93850e+00 8.36500e-01 1.89930e+02 155.874 -1.09381e+01 4.89879e+00  0.00000e+00 0.00000e+00 9.52742e+01 155.874 9.46562e+01 335.874 0.9573 
1 1 1 -9  50  8  o 12 7.14093e+00 8.77624e-01 1.35377e+02 268.322 -2.41457e-01 -8.24028e+00 0.00000e+00 0.00000e+00 1.15581e+02 268.322 1.97967e+01 88.322  0.9372 
1 1 1 -9  50  9  o 18 9.41562e+00 7.90446e-01 8.54156e+01 115.076 -3.42758e+00 7.32507e+00  0.00000e+00 0.00000e+00 2.44745e+02 115.076 1.59330e+02 115.076 0.9360 
1 1 1 -9  50  10 o 5  8.71721e+00 8.09218e-01 1.63412e+02 332.804 1.42556e+01  -7.32506e+00 0.00000e+00 0.00000e+00 1.52516e+02 332.804 1.08954e+01 152.804 0.9683 
1 1 1 -9  50  11 o 10 3.44097e+00 8.62521e-01 6.48014e+01 329.598 2.45949e+00  -1.44308e+00 0.00000e+00 0.00000e+00 3.79211e+01 329.598 2.68803e+01 149.598 0.7984 
1 1 1 -9  50  12 o 14 5.88240e+00 8.11460e-01 9.46191e+01 214.567 -6.82705e+00 -4.70391e+00 0.00000e+00 0.00000e+00 1.11387e+02 214.567 1.67680e+01 214.567 0.9376 
1 1 1 -9  50  13 o 11 8.03412e+00 7.18430e-01 1.82623e+02 188.419 -2.52253e+01 -3.73345e+00 0.00000e+00 0.00000e+00 1.11189e+02 188.419 7.14333e+01 8.419   0.9802 
1 1 1 -9  50  14 o 12 4.34664e+00 9.48392e-01 1.08923e+02 206.816 -6.46921e+00 -3.27012e+00 0.00000e+00 0.00000e+00 4.14269e+01 206.816 6.74964e+01 26.816  0.9282 
1 1 1 -9  50  15 o 8  6.79512e+00 1.34626e+00 1.11739e+02 71.362  3.42269e+00  1.01479e+01  0.00000e+00 0.00000e+00 1.29053e+02 71.362  1.73142e+01 71.362  0.9521 
1 1 1 -9  50  16 o 4  1.42520e+01 1.83692e+00 2.69259e+02 219.457 -3.14323e+01 -2.58709e+01 0.00000e+00 0.00000e+00 2.53941e+02 219.457 1.53173e+01 39.457  0.9876 
1 1 1 -9  51  1  o 7  1.18999e+01 7.37839e-01 2.12381e+02 48.237  7.84463e+00  8.78521e+00  0.00000e+00 0.00000e+00 2.16301e+02 48.237  3.92029e+00 48.237  0.9566 
1 1 1 -9  51  2  o 4  8.54659e+00 1.73083e+00 1.70750e+02 280.379 1.00553e+00  -5.48998e+00 0.00000e+00 0.00000e+00 1.20508e+02 280.379 5.02420e+01 100.379 0.9053 
1 1 1 -9  51  3  o 13 2.07250e+01 6.64794e-01 4.16634e+02 329.443 4.01101e+01  -2.36800e+01 0.00000e+00 0.00000e+00 3.54695e+02 329.443 6.19397e+01 149.443 0.9892 
1 1 1 -9  51  4  o 4  1.00391e+01 7.70026e-01 2.04385e+02 294.725 4.79177e+00  -1.04062e+01 0.00000e+00 0.00000e+00 1.56232e+02 294.725 4.81526e+01 114.725 0.9553 
1 1 1 -9  51  5  o 13 9.81758e+00 7.35071e-01 1.86469e+02 289.215 3.68707e+00  -1.05791e+01 0.00000e+00 0.00000e+00 1.65582e+02 289.215 2.08870e+01 109.215 0.9543 
1 1 1 -9  51  6  o 10 1.20348e+01 7.60808e-01 1.11184e+02 158.219 -9.03657e+00 3.61089e+00  0.00000e+00 0.00000e+00 3.16851e+02 158.219 2.05667e+02 158.219 0.9471 
1 1 1 -9  51  7  f 0  1.56924e+01 6.67491e-01 2.45223e+02 38.382  2.35044e+01  1.86174e+01  0.00000e+00 0.00000e+00 3.33699e+02 38.382  8.84760e+01 38.382  0.9832 
1 1 1 -9  51  8  o 9  8.07499e+00 8.85828e-01 4.90869e+01 54.124  1.97286e+00  2.72784e+00  0.00000e+00 0.00000e+00 2.03350e+02 54.124  1.54263e+02 54.124  0.8338 
1 1 1 -9  51  9  o 13 7.49735e+00 7.26090e-01 1.49124e+02 244.244 -5.19697e+00 -1.07718e+01 0.00000e+00 0.00000e+00 1.19710e+02 244.244 2.94146e+01 64.244  0.9572 
1 1 1 -9  51  10 o 7  6.79319e+00 9.22599e-01 1.36666e+02 42.588  8.08466e+00  7.43123e+00  0.00000e+00 0.00000e+00 1.05693e+02 42.588  3.09726e+01 222.588 0.9533 
1 1 1 -9  51  11 o 6  2.64619e+00 7.68397e-01 6.21012e+01 199.622 -2.12897e+00 -7.59029e-01 0.00000e+00 0.00000e+00 1.07317e+01 199.622 5.13695e+01 19.622  0.7362 
1 1 1 -9  51  12 o 17 5.13937e+00 8.09654e-01 6.26701e+01 5.589   4.80343e+00  4.70013e-01  0.00000e+00 0.00000e+00 1.07999e+02 5.589   4.53293e+01 5.589   0.8892 
1 1 1 -9  51  13 o 13 4.20585e+00 9.40610e-01 8.20784e+01 105.344 -1.33602e+00 4.86899e+00  0.00000e+00 0.00000e+00 5.82668e+01 105.344 2.38116e+01 285.344 0.8945 
1 1 1 -9  51  14 o 18 3.59757e+00 9.30255e-01 7.24460e+01 271.604 1.22869e-01  -4.38698e+00 0.00000e+00 0.00000e+00 4.51076e+01 271.604 2.73384e+01 91.604  0.8770 
1 1 1 -9  51  15 o 17 2.99204e+00 9.97497e-01 9.43440e+01 55.025  2.88250e+00  4.12048e+00  0.00000e+00 0.00000e+00 5.20284e+00 55.025  8.91411e+01 235.025 0.8940 
1 1 1 -9  51  16 o 6  4.23462e+00 1.36729e+00 1.30837e+02 219.206 -6.47347e+00 -5.28073e+00 0.00000e+00 0.00000e+00 1.67987e+01 219.206 1.14038e+02 39.206  0.9381 
1 1 1 -9  52  1  o 5  1.12739e+01 7.34068e-01 1.90302e+02 33.444  8.92974e+00  5.89796e+00  0.00000e+00 0.00000e+00 2.13864e+02 33.444  2.35627e+01 33.444  0.9521 
1 1 1 -9  52  2  o 16 1.23935e+01 6.85491e-01 2.47584e+02 207.592 -1.46443e+01 -7.65338e+00 0.00000e+00 0.00000e+00 2.04535e+02 207.592 4.30488e+01 27.592  0.9693 
1 1 1 -9  52  3  o 14 9.75374e+00 7.48127e-01 2.19301e+02 256.605 -2.89380e+00 -1.21516e+01 0.00000e+00 0.00000e+00 1.32609e+02 256.605 8.66916e+01 76.605  0.9591 
1 1 1 -9  52  4  o 16 1.39867e+01 6.69063e-01 3.18185e+02 123.341 -1.39480e+01 2.12008e+01  0.00000e+00 0.00000e+00 1.97197e+02 123.341 1.20987e+02 303.341 0.9801 
1 1 1 -9  52  5  o 18 6.99666e+00 8.78057e-01 1.90812e+02 308.278 5.37827e+00  -6.81539e+00 0.00000e+00 0.00000e+00 5.64321e+01 308.278 1.34379e+02 128.278 0.9405 
1 1 1 -9  52  6  o 4  1.69958e+01 6.58565e-01 2.60948e+02 189.021 -3.18242e+01 -5.05222e+00 0.00000e+00 0.00000e+00 3.67199e+02 189.021 1.06250e+02 189.021 0.9844 
1 1 1 -9  52  7  o 19 9.54849e+00 7.77330e-01 1.69433e+02 51.950  8.24288e+00  1.05314e+01  0.00000e+00 0.00000e+00 1.75140e+02 51.950  5.70695e+00 51.950  0.9619 
1 1 1 -9  52  8  o 8  8.27826e+00 7.03859e-01 1.14759e+02 131.456 -5.89982e+00 6.67882e+00  0.00000e+00 0.00000e+00 1.77599e+02 131.456 6.28398e+01 131.456 0.9421 
1 1 1 -9  52  9  o 5  1.59651e+01 6.25823e-01 2.49072e+02 260.400 -7.02299e+00 -4.15217e+01 0.00000e+00 0.00000e+00 3.41739e+02 260.400 9.26666e+01 260.400 0.9881 
1 1 1 -9  52  10 o 19 6.49046e+00 7.49649e-01 7.14240e+01 283.933 1.40584e+00  -5.66690e+00 0.00000e+00 0.00000e+00 1.49528e+02 283.933 7.81038e+01 283.933 0.9098 
1 1 1 -9  52  11 o 6  3.54667e+00 8.86746e-01 6.10763e+01 344.769 2.60342e+00  -7.08858e-01 0.00000e+00 0.00000e+00 4.29896e+01 344.769 1.80867e+01 164.769 0.7849 
1 1 1 -9  52  12 o 7  1.32862e+01 6.11404e-01 2.80545e+02 96.461  -6.75974e+00 5.96881e+01  0.00000e+00 0.00000e+00 2.11430e+02 96.461  6.91149e+01 276.461 0.9916 
1 1 1 -9  52  13 o 3  9.46926e+00 6.88004e-01 1.55125e+02 229.748 -1.69861e+01 -2.00635e+01 0.00000e+00 0.00000e+00 1.91286e+02 229.748 3.61612e+01 229.748 0.9808 
1 1 1 -9  52  14 o 8  4.26811e+00 9.52304e-01 7.60292e+01 111.246 -1.92554e+00 4.95244e+00  0.00000e+00 0.00000e+00 6.71066e+01 111.246 8.92264e+00 291.246 0.9002 
1 1 1 -9  52  15 o 2  6.17212e+00 1.33696e+00 1.15739e+02 101.753 -2.08469e+00 1.00203e+01  0.00000e+00 0.00000e+00 1.02390e+02 101.753 1.33484e+01 281.753 0.9498 
1 1 1 -9  52  16 o 18 6.37891e+00 1.75215e+00 1.23855e+02 227.091 -6.35711e+00 -6.83895e+00 0.00000e+00 0.00000e+00 1.00106e+02 227.091 2.37496e+01 47.091  0.9448 
1 1 1 -9  53  1  o 17 1.65963e+01 6.84223e-01 3.65710e+02 345.949 3.16461e+01  -7.92023e+00 0.00000e+00 0.00000e+00 2.49474e+02 345.949 1.16236e+02 165.949 0.9846 
1 1 1 -9  53  2  o 5  1.92892e+01 6.66808e-01 3.33496e+02 240.567 -1.87150e+01 -3.31695e+01 0.00000e+00 0.00000e+00 3.82802e+02 240.567 4.93059e+01 240.567 0.9868 
1 1 1 -9  53  3  o 9  2.79113e+01 8.22691e-01 4.22200e+02 98.755  -9.91741e+00 6.43945e+01  0.00000e+00 0.00000e+00 6.19530e+02 98.755  1.97330e+02 98.755  0.9923 
1 1 1 -9  53  4  o 12 2.31935e+01 6.89097e-01 4.38916e+02 318.176 4.58265e+01  -4.10082e+01 0.00000e+00 0.00000e+00 4.25833e+02 318.176 1.30822e+01 138.176 0.9918 
1 1 1 -9  53  5  o 10 1.31483e+01 6.70274e-01 1.73873e+02 52.213  9.77960e+00  1.26138e+01  0.00000e+00 0.00000e+00 3.04335e+02 52.213  1.30462e+02 52.213  0.9681 
1 1 1 -9  53  6  o 17 8.37145e+00 7.65044e-01 1.54765e+02 19.400  9.15302e+00  3.22322e+00  0.00000e+00 0.00000e+00 1.42844e+02 19.400  1.19210e+01 199.400 0.9470 
1 1 1 -9  53  7  o 11 2.63048e+01 6.59856e-01 4.76913e+02 11.415  1.05533e+02  2.13073e+01  0.00000e+00 0.00000e+00 5.05247e+02 11.415  2.83343e+01 11.415  0.9953 
1 1 1 -9  53  8  o 3  7.91477e+00 7.26437e-01 1.13715e+02 185.899 -8.46274e+00 -8.74323e-01 0.00000e+00 0.00000e+00 1.64920e+02 185.899 5.12050e+01 185.899 0.9392 
1 1 1 -9  53  9  f 0  5.89475e+00 8.59380e-01 1.30568e+02 346.658 7.80374e+00  -1.85078e+00 0.00000e+00 0.00000e+00 7.59220e+01 346.658 5.46461e+01 166.658 0.9354 
1 1 1 -9  53  10 o 12 6.16372e+00 7.90571e-01 1.28205e+02 138.324 -6.91745e+00 6.15794e+00  0.00000e+00 0.00000e+00 8.95686e+01 138.324 3.86368e+01 318.324 0.9444 
1 1 1 -9  53  11 o 17 4.77572e+00 8.55855e-01 9.51532e+01 2.024   6.25262e+00  2.20978e-01  0.00000e+00 0.00000e+00 6.83788e+01 2.024   2.67743e+01 182.024 0.9162 
1 1 1 -9  53  12 o 9  6.80433e+00 7.92226e-01 5.58395e+01 66.650  2.26917e+00  5.25632e+00  0.00000e+00 0.00000e+00 1.74799e+02 66.650  1.18960e+02 66.650  0.9079 
1 1 1 -9  53  13 o 16 3.97808e+00 9.57890e-01 9.96770e+01 153.117 -5.60841e+00 2.84319e+00  0.00000e+00 0.00000e+00 3.63093e+01 153.117 6.33677e+01 333.117 0.9166 
1 1 1 -9  53  14 o 19 3.69108e+00 9.79883e-01 6.63579e+01 57.103  2.25224e+00  3.48177e+00  0.00000e+00 0.00000e+00 5.31127e+01 57.103  1.32452e+01 237.103 0.8689 
1 1 1 -9  53  15 o 16 4.76776e+00 1.02812e+00 1.06494e+02 310.611 5.87764e+00  -6.85497e+00 0.00000e+00 0.00000e+00 6.07505e+01 310.611 4.57434e+01 130.611 0.9429 
1 1 1 -9  53  16 o 14 3.94591e+00 1.31754e+00 6.07433e+01 115.163 -1.74870e+00 3.72243e+00  0.00000e+00 0.00000e+00 6.64712e+01 115.163 5.72785e+00 115.163 0.8677 
1 1 1 -9  54  1  o 14 1.25934e+01 7.28063e-01 1.43083e+02 207.048 -9.39241e+00 -4.79554e+00 0.00000e+00 0.00000e+00 3.07910e+02 207.048 1.64827e+02 207.048 0.9513 
1 1 1 -9  54  2  o 15 1.93527e+01 6.72541e-01 3.30840e+02 185.678 -3.61031e+01 -3.58949e+00 0.00000e+00 0.00000e+00 3.87231e+02 185.678 5.63907e+01 185.678 0.9861 
1 1 1 -9  54  3  o 14 1.38052e+01 6.74546e-01 2.09743e+02 100.194 -3.11489e+00 1.73214e+01  0.00000e+00 0.00000e+00 2.94459e+02 100.194 8.47157e+01 100.194 0.9712 
1 1 1 -9  54  4  o 13 1.38702e+01 9.68017e-01 1.79728e+02 242.271 -7.40536e+00 -1.40879e+01 0.00000e+00 0.00000e+00 3.24938e+02 242.271 1.45210e+02 242.271 0.9681 
1 1 1 -9  54  5  o 6  4.07650e+00 8.90517e-01 7.92628e+01 317.863 1.69309e+00  -1.53181e+00 0.00000e+00 0.00000e+00 3.39246e+01 317.863 4.53382e+01 137.863 0.7392 
1 1 1 -9  54  6  o 17 5.19520e+00 8.36583e-01 5.45026e+01 185.205 -2.23736e+00 -2.03821e-01 0.00000e+00 0.00000e+00 8.87059e+01 185.205 3.42033e+01 185.205 0.7344 
1 1 1 -9  54  7  o 8  2.15584e+01 6.14924e-01 2.63320e+02 94.394  -3.96039e+00 5.15387e+01  0.00000e+00 0.00000e+00 5.37406e+02 94.394  2.74086e+02 94.394  0.9903 
1 1 1 -9  54  8  o 3  1.16864e+01 6.33016e-01 1.96622e+02 167.230 -2.39747e+01 5.43370e+00  0.00000e+00 0.00000e+00 2.32337e+02 167.230 3.57151e+01 167.230 0.9794 
1 1 1 -9  54  9  o 6  6.54329e+00 8.10042e-01 1.28268e+02 174.144 -8.99097e+00 9.22203e-01  0.00000e+00 0.00000e+00 1.02753e+02 174.144 2.55154e+01 354.144 0.9429 
1 1 1 -9  54  10 o 4  1.00920e+01 6.06786e-01 1.31245e+02 243.283 -8.12321e+00 -1.61390e+01 0.00000e+00 0.00000e+00 2.35673e+02 243.283 1.04428e+02 243.283 0.9719 
1 1 1 -9  54  11 o 11 7.60093e+00 7.18978e-01 1.25025e+02 301.731 7.10427e+00  -1.14887e+01 0.00000e+00 0.00000e+00 1.48298e+02 301.731 2.32728e+01 301.731 0.9622 
1 1 1 -9  54  12 o 11 5.08261e+00 9.00772e-01 9.02075e+01 311.779 4.54675e+00  -5.08899e+00 0.00000e+00 0.00000e+00 8.50161e+01 311.779 5.19134e+00 131.779 0.9235 
1 1 1 -9  54  13 o 16 8.75742e+00 7.16505e-01 1.82475e+02 125.375 -1.56866e+01 2.20933e+01  0.00000e+00 0.00000e+00 1.37991e+02 125.375 4.44839e+01 305.375 0.9814 
1 1 1 -9  54  14 o 15 1.03432e+01 7.19229e-01 1.92114e+02 29.327  3.29656e+01  1.85200e+01  0.00000e+00 0.00000e+00 1.87980e+02 29.327  4.13400e+00 209.327 0.9867 
1 1 1 -9  54  15 o 4  2.67704e+00 8.63163e-01 2.24293e+01 152.313 -1.04477e+00 5.48212e-01  0.00000e+00 0.00000e+00 2.80077e+01 152.313 5.57846e+00 152.313 0.5065 
1 1 1 -9  54  16 o 7  3.88472e+00 1.31060e+00 3.63535e+01 358.010 2.44062e+00  -8.47796e-02 0.00000e+00 0.00000e+00 7.31147e+01 358.010 3.67611e+01 358.010 0.7585 
1 1 1 -9  55  1  o 1  2.11910e+01 6.85972e-01 3.57403e+02 176.124 -4.30843e+01 2.91912e+00  0.00000e+00 0.00000e+00 4.30896e+02 176.124 7.34925e+01 176.124 0.9884 
1 1 1 -9  55  2  o 12 1.52380e+01 6.78300e-01 3.13867e+02 246.750 -1.07502e+01 -2.50214e+01 0.00000e+00 0.00000e+00 2.48775e+02 246.750 6.50918e+01 66.750  0.9815 
1 1 1 -9  55  3  o 15 1.65524e+01 6.18185e-01 2.26622e+02 182.313 -2.33803e+01 -9.44379e-01 0.00000e+00 0.00000e+00 3.82326e+02 182.313 1.55704e+02 182.313 0.9784 
1 1 1 -9  55  4  o 5  1.01136e+01 6.57962e-01 2.59110e+02 313.875 1.27257e+01  -1.32353e+01 0.00000e+00 0.00000e+00 1.10459e+02 313.875 1.48651e+02 133.875 0.9724 
1 1 1 -9  55  5  o 9  3.13950e+01 7.03199e-01 5.45672e+02 5.909   1.22753e+02  1.27053e+01  0.00000e+00 0.00000e+00 6.28611e+02 5.909   8.29397e+01 5.909   0.9959 
1 1 1 -9  55  6  o 18 7.22495e+00 7.26459e-01 1.40404e+02 282.536 1.84619e+00  -8.30306e+00 0.00000e+00 0.00000e+00 1.14270e+02 282.536 2.61336e+01 102.536 0.9392 
1 1 1 -9  55  7  o 19 7.21936e+00 7.35544e-01 1.33868e+02 161.222 -8.08917e+00 2.75038e+00  0.00000e+00 0.00000e+00 1.20492e+02 161.222 1.33758e+01 341.222 0.9395 
1 1 1 -9  55  8  o 13 1.01607e+01 6.62039e-01 1.55168e+02 49.568  1.06495e+01  1.24988e+01  0.00000e+00 0.00000e+00 2.13775e+02 49.568  5.86077e+01 49.568  0.9691 
1 1 1 -9  55  9  o 9  6.86778e+00 7.89859e-01 2.20749e+02 60.100  8.56987e+00  1.49036e+01  0.00000e+00 0.00000e+00 2.87691e+01 60.100  1.91980e+02 240.100 0.9705 
1 1 1 -9  55  10 o 12 5.91187e+00 8.13827e-01 1.23203e+02 137.974 -7.02661e+00 6.33266e+00  0.00000e+00 0.00000e+00 8.58763e+01 137.974 3.73270e+01 317.973 0.9456 
1 1 1 -9  55  11 o 12 4.16937e+00 8.90390e-01 2.99080e+01 279.123 2.57425e-01  -1.60302e+00 0.00000e+00 0.00000e+00 6.74938e+01 279.123 3.75858e+01 279.123 0.6252 
1 1 1 -9  55  12 o 3  3.98462e+00 9.40212e-01 9.98700e+01 260.170 -9.28106e-01 -5.35635e+00 0.00000e+00 0.00000e+00 3.43695e+01 260.170 6.55005e+01 80.170  0.9026 
1 1 1 -9  55  13 o 6  4.19496e+00 9.13851e-01 1.00820e+02 21.366  6.55396e+00  2.56403e+00  0.00000e+00 0.00000e+00 4.39976e+01 21.366  5.68229e+01 201.366 0.9260 
1 1 1 -9  55  14 o 13 7.52509e+00 8.39346e-01 1.07902e+02 255.043 -3.80572e+00 -1.42459e+01 0.00000e+00 0.00000e+00 1.62645e+02 255.043 5.47433e+01 255.043 0.9655 
1 1 1 -9  55  15 o 12 4.19094e+00 1.10564e+00 1.17723e+02 72.037  2.70923e+00  8.35674e+00  0.00000e+00 0.00000e+00 2.89865e+01 72.037  8.87369e+01 252.037 0.9412 
1 1 1 -9  55  16 o 8  4.86283e+00 1.45053e+00 1.04662e+02 209.763 -6.41859e+00 -3.67047e+00 0.00000e+00 0.00000e+00 6.32593e+01 209.763 4.14027e+01 29.763  0.9297 
1 1 1 -9  56  1  o 7  1.25949e+01 6.06144e-01 2.31473e+02 51.672  1.10837e+01  1.40202e+01  0.00000e+00 0.00000e+00 2.29045e+02 51.672  2.42871e+00 231.672 0.9716 
1 1 1 -9  56  2  o 17 1.62207e+01 6.45685e-01 2.94805e+02 151.158 -2.60407e+01 1.43410e+01  0.00000e+00 0.00000e+00 3.04990e+02 151.158 1.01849e+01 151.158 0.9830 
1 1 1 -9  56  3  f 0  1.66193e+01 7.37328e-01 2.54077e+02 333.541 2.52956e+01  -1.25891e+01 0.00000e+00 0.00000e+00 3.59581e+02 333.541 1.05504e+02 333.541 0.9821 
1 1 1 -9  56  4  o 8  1.15168e+01 7.80977e-01 1.43038e+02 229.941 -7.62943e+00 -9.07325e+00 0.00000e+00 0.00000e+00 2.71023e+02 229.941 1.27984e+02 229.941 0.9568 
1 1 1 -9  56  5  o 4  1.14554e+01 6.21192e-01 2.00993e+02 21.112  1.65448e+01  6.38809e+00  0.00000e+00 0.00000e+00 2.16849e+02 21.112  1.58559e+01 21.112  0.9714 
1 1 1 -9  56  6  o 8  1.60898e+01 5.80222e-01 2.65518e+02 216.212 -3.01206e+01 -2.20543e+01 0.00000e+00 0.00000e+00 3.30093e+02 216.212 6.45750e+01 216.212 0.9865 
1 1 1 -9  56  7  o 12 1.38624e+01 6.96402e-01 2.08028e+02 36.747  2.17228e+01  1.62194e+01  0.00000e+00 0.00000e+00 3.02070e+02 36.747  9.40419e+01 36.747  0.9814 
1 1 1 -9  56  8  o 10 1.15352e+01 6.24427e-01 2.33584e+02 353.719 2.94360e+01  -3.24003e+00 0.00000e+00 0.00000e+00 1.91217e+02 353.719 4.23664e+01 173.719 0.9830 
1 1 1 -9  56  9  o 7  8.83471e+00 6.31777e-01 1.02515e+02 73.865  3.16180e+00  1.09296e+01  0.00000e+00 0.00000e+00 2.13298e+02 73.865  1.10783e+02 73.865  0.9550 
1 1 1 -9  56  10 o 7  8.31064e+00 6.21984e-01 1.27081e+02 238.487 -7.71808e+00 -1.25885e+01 0.00000e+00 0.00000e+00 1.72991e+02 238.487 4.59093e+01 238.487 0.9655 
1 1 1 -9  56  11 o 12 1.10997e+01 6.03874e-01 2.22735e+02 191.127 -4.04139e+01 -7.94876e+00 0.00000e+00 0.00000e+00 1.86873e+02 191.127 3.58616e+01 11.127  0.9878 
1 1 1 -9  56  12 o 3  2.74595e+00 8.27383e-01 2.82844e+01 87.852  4.35694e-02  1.16144e+00  0.00000e+00 0.00000e+00 2.30495e+01 87.852  5.23484e+00 267.852 0.5009 
1 1 1 -9  56  13 o 3  2.49311e+00 7.75347e-01 4.42754e+01 102.782 -4.58692e-01 2.02193e+00  0.00000e+00 0.00000e+00 2.16581e+01 102.782 2.26174e+01 282.782 0.7095 
1 1 1 -9  56  14 o 1  4.08154e+00 1.06365e+00 5.23362e+01 31.526  2.92573e+00  1.79473e+00  0.00000e+00 0.00000e+00 7.49348e+01 31.526  2.25986e+01 31.526  0.8375 
1 1 1 -9  56  15 o 16 7.52049e+00 1.00421e+00 7.05522e+01 317.199 7.43827e+00  -6.88827e+00 0.00000e+00 0.00000e+00 1.94934e+02 317.199 1.24382e+02 317.199 0.9493 
1 1 1 -9  56  16 o 7  8.52014e+00 1.88584e+00 2.16996e+02 192.239 -1.94426e+01 -4.21747e+00 0.00000e+00 0.00000e+00 9.13639e+01 192.239 1.25632e+02 12.239  0.9745 
1 1 1 -9  57  1  o 18 2.29346e+01 6.38146e-01 4.30251e+02 71.058  1.98911e+01  5.79601e+01  0.00000e+00 0.00000e+00 4.25629e+02 71.058  4.62209e+00 251.058 0.9918 
1 1 1 -9  57  2  o 1  8.86866e+00 7.37208e-01 2.00513e+02 167.363 -1.16180e+01 2.60485e+00  0.00000e+00 0.00000e+00 1.18702e+02 167.363 8.18104e+01 347.363 0.9570 
1 1 1 -9  57  3  o 8  4.20221e+00 9.33193e-01 1.31879e+02 215.537 -2.98370e+00 -2.13118e+00 0.00000e+00 0.00000e+00 2.28688e+00 215.537 1.29592e+02 35.537  0.8494 
1 1 1 -9  57  4  o 13 1.85477e+01 6.04039e-01 2.84554e+02 306.911 2.32717e+01  -3.09823e+01 0.00000e+00 0.00000e+00 4.03200e+02 306.911 1.18646e+02 306.911 0.9870 
1 1 1 -9  57  5  o 8  1.33927e+01 6.01569e-01 1.63745e+02 24.953  1.57158e+01  7.31263e+00  0.00000e+00 0.00000e+00 3.24350e+02 24.953  1.60606e+02 24.953  0.9707 
1 1 1 -9  57  6  o 8  1.56588e+01 5.92845e-01 3.15258e+02 267.722 -1.79600e+00 -4.51534e+01 0.00000e+00 0.00000e+00 2.65696e+02 267.722 4.95618e+01 87.722  0.9889 
1 1 1 -9  57  7  o 8  1.58116e+01 5.99690e-01 3.48853e+02 30.056  4.65180e+01  2.69178e+01  0.00000e+00 0.00000e+00 2.38377e+02 30.056  1.10476e+02 210.056 0.9907 
1 1 1 -9  57  8  o 19 7.72782e+00 7.62235e-01 1.06007e+02 145.088 -7.23604e+00 5.05010e+00  0.00000e+00 0.00000e+00 1.66536e+02 145.088 6.05284e+01 145.088 0.9415 
1 1 1 -9  57  9  o 3  1.46855e+01 5.46641e-01 2.34065e+02 66.921  1.81021e+01  4.24836e+01  0.00000e+00 0.00000e+00 3.09571e+02 66.921  7.55061e+01 66.921  0.9891 
1 1 1 -9  57  10 o 13 4.13539e+00 8.42477e-01 1.24315e+02 168.582 -6.72255e+00 1.35772e+00  0.00000e+00 0.00000e+00 1.85453e+01 168.582 1.05769e+02 348.582 0.9239 
1 1 1 -9  57  11 o 14 3.31856e+00 8.90472e-01 8.21875e+01 300.940 2.02558e+00  -3.37919e+00 0.00000e+00 0.00000e+00 2.45613e+01 300.940 5.76261e+01 120.940 0.8612 
1 1 1 -9  57  12 o 10 3.47680e+00 9.07919e-01 9.52010e+01 138.718 -3.93086e+00 3.45118e+00  0.00000e+00 0.00000e+00 2.13589e+01 138.718 7.38421e+01 318.718 0.8985 
1 1 1 -9  57  13 o 14 3.69738e+00 9.69346e-01 6.30666e+01 168.842 -3.70710e+00 7.31185e-01  0.00000e+00 0.00000e+00 5.46792e+01 168.842 8.38743e+00 348.842 0.8544 
1 1 1 -9  57  14 f 0  3.57073e+00 9.86360e-01 4.18831e+01 0.372   2.55451e+00  1.66030e-02  0.00000e+00 0.00000e+00 6.05781e+01 0.372   1.86950e+01 0.372   0.7708 
1 1 1 -9  57  15 o 6  5.68767e+00 1.15721e+00 1.37446e+02 87.348  6.07231e-01  1.31113e+01  0.00000e+00 0.00000e+00 6.58019e+01 87.348  7.16445e+01 267.348 0.9611 
1 1 1 -9  57  16 o 12 3.78185e+00 1.27971e+00 3.18712e+01 354.865 2.13422e+00  -1.91774e-01 0.00000e+00 0.00000e+00 6.92206e+01 354.865 3.73494e+01 354.865 0.7199 
1 1 1 -9  58  1  o 4  1.14139e+01 6.47744e-01 1.87403e+02 34.344  1.24164e+01  8.48387e+00  0.00000e+00 0.00000e+00 2.27464e+02 34.344  4.00604e+01 34.344  0.9662 
1 1 1 -9  58  2  o 8  2.40108e+01 6.89337e-01 4.24352e+02 340.748 6.69688e+01  -2.33894e+01 0.00000e+00 0.00000e+00 4.72151e+02 340.748 4.77989e+01 340.748 0.9929 
1 1 1 -9  58  3  o 2  1.83664e+01 6.04812e-01 3.41692e+02 171.705 -4.65135e+01 6.78154e+00  0.00000e+00 0.00000e+00 3.41210e+02 171.705 4.81553e-01 351.705 0.9893 
1 1 1 -9  58  4  o 8  1.60965e+01 6.80416e-01 2.87647e+02 236.182 -1.96486e+01 -2.93313e+01 0.00000e+00 0.00000e+00 3.08353e+02 236.182 2.07062e+01 236.182 0.9857 
1 1 1 -9  58  5  o 12 1.93849e+01 6.02248e-01 2.46394e+02 345.599 3.97863e+01  -1.02161e+01 0.00000e+00 0.00000e+00 4.72371e+02 345.599 2.25977e+02 345.599 0.9878 
1 1 1 -9  58  6  o 11 1.08871e+01 6.26425e-01 1.49460e+02 141.542 -1.15630e+01 9.18365e+00  0.00000e+00 0.00000e+00 2.44860e+02 141.542 9.53995e+01 141.542 0.9655 
1 1 1 -9  58  7  o 10 1.34403e+01 6.07207e-01 2.14113e+02 246.033 -1.25843e+01 -2.83081e+01 0.00000e+00 0.00000e+00 2.81481e+02 246.033 6.73683e+01 246.033 0.9837 
1 1 1 -9  58  8  o 9  1.53096e+01 5.76832e-01 3.59990e+02 88.088  1.94852e+00  5.83795e+01  0.00000e+00 0.00000e+00 2.08472e+02 88.088  1.51518e+02 268.088 0.9914 
1 1 1 -9  58  9  o 11 3.24723e+00 7.56298e-01 6.52818e+01 76.238  5.98152e-01  2.44231e+00  0.00000e+00 0.00000e+00 2.78642e+01 76.238  3.74177e+01 256.238 0.7666 
1 1 1 -9  58  10 o 11 9.69830e+00 5.87594e-01 1.46164e+02 133.704 -1.41163e+01 1.47697e+01  0.00000e+00 0.00000e+00 2.07417e+02 133.704 6.12530e+01 133.704 0.9752 
1 1 1 -9  58  11 o 8  1.03456e+01 6.13659e-01 1.36434e+02 84.262  2.27415e+00  2.26323e+01  0.00000e+00 0.00000e+00 2.41353e+02 84.262  1.04919e+02 84.262  0.9778 
1 1 1 -9  58  12 o 19 4.92780e+00 8.89354e-01 8.82834e+01 1.178   6.52747e+00  1.34273e-01  0.00000e+00 0.00000e+00 8.08273e+01 1.178   7.45608e+00 181.178 0.9199 
1 1 1 -9  58  13 f 0  6.98784e+00 8.52052e-01 9.99269e+01 62.604  5.16822e+00  9.97243e+00  0.00000e+00 0.00000e+00 1.48601e+02 62.604  4.86736e+01 62.604  0.9544 
1 1 1 -9  58  14 o 2  5.11247e+00 1.01998e+00 6.19145e+01 275.001 4.88333e-01  -5.58026e+00 0.00000e+00 0.00000e+00 1.10431e+02 275.001 4.85160e+01 275.001 0.9057 
1 1 1 -9  58  15 o 9  6.11212e+00 1.13934e+00 8.49295e+01 186.277 -8.84034e+00 -9.72392e-01 0.00000e+00 0.00000e+00 1.29104e+02 186.277 4.41741e+01 186.277 0.9420 
1 1 1 -9  58  16 o 18 4.98468e+00 1.54509e+00 8.10736e+01 94.591  -4.50808e-01 5.61414e+00  0.00000e+00 0.00000e+00 8.66359e+01 94.591  5.56228e+00 94.591  0.9062 
1 1 1 -9  59  1  o 18 7.23733e+00 7.94358e-01 1.33219e+02 80.297  1.16765e+00  6.82915e+00  0.00000e+00 0.00000e+00 1.18517e+02 80.297  1.47020e+01 260.297 0.9247 
1 1 1 -9  59  2  o 15 2.55672e+01 6.98886e-01 4.85933e+02 225.472 -6.41737e+01 -6.52394e+01 0.00000e+00 0.00000e+00 4.70063e+02 225.472 1.58692e+01 45.472  0.9945 
1 1 1 -9  59  3  o 4  1.02721e+01 6.72819e-01 2.11709e+02 114.099 -6.42825e+00 1.43712e+01  0.00000e+00 0.00000e+00 1.61830e+02 114.099 4.98785e+01 294.099 0.9677 
1 1 1 -9  59  4  o 10 1.03195e+01 7.56791e-01 1.99110e+02 280.151 2.92879e+00  -1.63577e+01 0.00000e+00 0.00000e+00 1.76605e+02 280.151 2.25053e+01 100.151 0.9694 
1 1 1 -9  59  5  o 16 3.69651e+00 9.13584e-01 2.92397e+01 62.652  4.00704e-01  7.74762e-01  0.00000e+00 0.00000e+00 2.61588e+01 62.652  3.08083e+00 242.652 0.3993 
1 1 1 -9  59  6  o 19 6.29644e+00 7.98490e-01 2.03135e+02 197.875 -1.11567e+01 -3.59819e+00 0.00000e+00 0.00000e+00 2.27118e+01 197.875 1.80423e+02 17.875  0.9563 
1 1 1 -9  59  7  o 8  8.23747e+00 6.63233e-01 8.89930e+01 282.878 1.70033e+00  -7.43725e+00 0.00000e+00 0.00000e+00 1.98720e+02 282.878 1.09727e+02 282.878 0.9319 
1 1 1 -9  59  8  o 10 1.33087e+01 6.19407e-01 2.42011e+02 15.376  3.53212e+01  9.71340e+00  0.00000e+00 0.00000e+00 2.49511e+02 15.376  7.49980e+00 15.376  0.9863 
1 1 1 -9  59  9  o 8  4.59902e+00 8.22932e-01 3.93029e+01 116.976 -1.03684e+00 2.03698e+00  0.00000e+00 0.00000e+00 8.79465e+01 116.976 4.86436e+01 116.976 0.7395 
1 1 1 -9  59  10 o 9  7.47210e+00 6.74352e-01 1.69092e+02 206.944 -1.66871e+01 -8.48216e+00 0.00000e+00 0.00000e+00 1.02640e+02 206.944 6.64521e+01 26.944  0.9729 
1 1 1 -9  59  11 o 18 8.53048e+00 7.05637e-01 1.48502e+02 21.069  1.84545e+01  7.10946e+00  0.00000e+00 0.00000e+00 1.61875e+02 21.069  1.33732e+01 21.069  0.9744 
1 1 1 -9  59  12 o 8  4.79694e+00 9.31680e-01 9.19872e+01 262.359 -9.25376e-01 -6.89768e+00 0.00000e+00 0.00000e+00 7.35390e+01 262.359 1.84483e+01 82.359  0.9251 
1 1 1 -9  59  13 o 18 6.04834e+00 9.50786e-01 8.47698e+01 200.726 -7.86601e+00 -2.97645e+00 0.00000e+00 0.00000e+00 1.26732e+02 200.726 4.19627e+01 200.726 0.9385 
1 1 1 -9  59  14 o 14 7.15519e+00 9.67252e-01 1.44217e+02 68.841  6.76871e+00  1.74883e+01  0.00000e+00 0.00000e+00 1.14865e+02 68.841  2.93524e+01 248.841 0.9730 
1 1 1 -9  59  15 o 2  5.63284e+00 1.21390e+00 1.10077e+02 33.822  8.74726e+00  5.86055e+00  0.00000e+00 0.00000e+00 8.90838e+01 33.822  2.09928e+01 213.822 0.9513 
1 1 1 -9  59  16 o 13 4.06968e+00 1.34692e+00 1.18947e+02 94.373  -6.26084e-01 8.18616e+00  0.00000e+00 0.00000e+00 2.25965e+01 94.373  9.63505e+01 274.374 0.9370 
1 1 1 -9  60  1  o 7  3.82412e+01 8.04999e-01 7.32101e+02 342.854 1.89249e+02  -5.83857e+01 0.00000e+00 0.00000e+00 7.02454e+02 342.854 2.96469e+01 162.854 0.9975 
1 1 1 -9  60  2  o 18 1.09642e+01 6.56225e-01 2.58006e+02 269.835 -5.90414e-02 -2.05468e+01 0.00000e+00 0.00000e+00 1.43996e+02 269.835 1.14010e+02 89.835  0.9754 
1 1 1 -9  60  3  o 4  2.03888e+01 6.10453e-01 2.64074e+02 158.868 -4.20327e+01 1.62459e+01  0.00000e+00 0.00000e+00 4.93425e+02 158.868 2.29351e+02 158.868 0.9888 
1 1 1 -9  60  4  o 15 1.44832e+01 6.03213e-01 2.26916e+02 284.498 7.07950e+00  -2.73775e+01 0.00000e+00 0.00000e+00 3.07229e+02 284.498 8.03133e+01 284.498 0.9822 
1 1 1 -9  60  5  o 18 9.39799e+00 6.59760e-01 2.22330e+02 50.681  1.19438e+01  1.45825e+01  0.00000e+00 0.00000e+00 1.20856e+02 50.681  1.01474e+02 230.681 0.9731 
1 1 1 -9  60  6  o 2  8.46125e+00 6.47706e-01 1.34203e+02 271.252 2.38722e-01  -1.09209e+01 0.00000e+00 0.00000e+00 1.68203e+02 271.252 3.40005e+01 271.252 0.9531 
1 1 1 -9  60  7  o 8  1.16979e+01 5.76738e-01 2.21682e+02 352.848 2.76162e+01  -3.46510e+00 0.00000e+00 0.00000e+00 2.08708e+02 352.848 1.29736e+01 172.848 0.9819 
1 1 1 -9  60  8  o 10 7.06352e+00 6.56789e-01 1.38906e+02 155.725 -1.11626e+01 5.03417e+00  0.00000e+00 0.00000e+00 1.14519e+02 155.725 2.43872e+01 335.725 0.9583 
1 1 1 -9  60  9  o 2  2.67523e+00 7.82441e-01 7.87464e+01 110.201 -9.56186e-01 2.59873e+00  0.00000e+00 0.00000e+00 4.47364e-01 110.201 7.82991e+01 290.201 0.7913 
1 1 1 -9  60  10 o 14 1.25698e+01 5.66206e-01 1.89607e+02 43.861  2.57404e+01  2.47371e+01  0.00000e+00 0.00000e+00 2.73534e+02 43.861  8.39269e+01 43.861  0.9859 
1 1 1 -9  60  11 o 2  4.66645e+00 9.00338e-01 1.05301e+02 178.507 -7.31439e+00 1.90679e-01  0.00000e+00 0.00000e+00 5.65360e+01 178.507 4.87646e+01 358.507 0.9289 
1 1 1 -9  60  12 o 2  8.70174e+00 7.34850e-01 1.83824e+02 271.417 7.05686e-01  -2.85233e+01 0.00000e+00 0.00000e+00 1.34971e+02 271.417 4.88526e+01 91.417  0.9823 
1 1 1 -9  60  13 o 18 4.55429e+00 1.04667e+00 6.50027e+01 80.200  8.18581e-01  4.73933e+00  0.00000e+00 0.00000e+00 8.57880e+01 80.200  2.07853e+01 80.200  0.8888 
1 1 1 -9  60  14 o 8  9.79348e+00 8.43602e-01 1.54006e+02 19.480  3.01010e+01  1.06477e+01  0.00000e+00 0.00000e+00 2.04648e+02 19.480  5.06426e+01 19.480  0.9842 
1 1 1 -9  60  15 o 14 5.46285e+00 1.17605e+00 1.22349e+02 300.251 6.18902e+00  -1.06122e+01 0.00000e+00 0.00000e+00 7.22186e+01 300.251 5.01301e+01 120.251 0.9584 
1 1 1 -9  60  16 o 17 3.05578e+00 1.07696e+00 7.67191e+01 116.057 -2.42791e+00 4.96530e+00  0.00000e+00 0.00000e+00 2.58424e+01 116.057 5.08766e+01 296.057 0.9043 
1 1 1 -9  61  1  o 3  4.54639e+00 9.53292e-01 1.51199e+02 44.891  3.49332e+00  3.48002e+00  0.00000e+00 0.00000e+00 1.24997e+00 44.891  1.49949e+02 224.891 0.8918 
1 1 1 -9  61  2  o 13 1.76613e+01 6.06603e-01 3.82847e+02 139.686 -4.31930e+01 3.66482e+01  0.00000e+00 0.00000e+00 2.75069e+02 139.686 1.07778e+02 319.686 0.9911 
1 1 1 -9  61  3  o 6  1.61504e+01 5.98695e-01 2.43261e+02 218.430 -2.43055e+01 -1.92852e+01 0.00000e+00 0.00000e+00 3.53584e+02 218.430 1.10323e+02 218.430 0.9838 
1 1 1 -9  61  4  o 5  1.11085e+01 5.98656e-01 2.06752e+02 14.970  1.93071e+01  5.16238e+00  0.00000e+00 0.00000e+00 1.99735e+02 14.970  7.01752e+00 194.970 0.9747 
1 1 1 -9  61  5  o 17 5.46673e+00 8.30883e-01 1.30492e+02 17.121  5.88176e+00  1.81186e+00  0.00000e+00 0.00000e+00 5.71229e+01 17.121  7.33694e+01 197.121 0.9147 
1 1 1 -9  61  6  o 7  5.93669e+00 8.02359e-01 8.78329e+01 267.082 -2.70947e-01 -5.31508e+00 0.00000e+00 0.00000e+00 1.12576e+02 267.082 2.47426e+01 267.082 0.9004 
1 1 1 -9  61  7  o 13 7.81154e+00 6.51481e-01 1.54523e+02 141.414 -1.04852e+01 8.36617e+00  0.00000e+00 0.00000e+00 1.27010e+02 141.414 2.75136e+01 321.413 0.9620 
1 1 1 -9  61  8  o 17 1.76537e+01 5.88701e-01 2.84888e+02 317.276 4.91367e+01  -4.53803e+01 0.00000e+00 0.00000e+00 3.71013e+02 317.276 8.61249e+01 317.276 0.9925 
1 1 1 -9  61  9  o 9  3.79261e+00 8.36897e-01 7.42825e+01 33.540  3.03352e+00  2.01086e+00  0.00000e+00 0.00000e+00 4.60161e+01 33.540  2.82664e+01 213.540 0.8481 
1 1 1 -9  61  10 o 2  6.38670e+00 7.93690e-01 1.05527e+02 28.997  9.07800e+00  5.03141e+00  0.00000e+00 0.00000e+00 1.21315e+02 28.997  1.57878e+01 28.997  0.9505 
1 1 1 -9  61  11 o 18 7.76636e+00 7.28923e-01 8.88906e+01 318.805 7.79695e+00  -6.82448e+00 0.00000e+00 0.00000e+00 1.86653e+02 318.805 9.77624e+01 318.805 0.9504 
1 1 1 -9  61  12 o 10 1.01236e+01 7.12205e-01 2.07131e+02 204.954 -3.22527e+01 -1.50081e+01 0.00000e+00 0.00000e+00 1.65026e+02 204.954 4.21050e+01 24.954  0.9858 
1 1 1 -9  61  13 o 10 7.29801e+00 8.68492e-01 1.26632e+02 67.838  5.77379e+00  1.41751e+01  0.00000e+00 0.00000e+00 1.36163e+02 67.838  9.53126e+00 67.838  0.9668 
1 1 1 -9  61  14 o 15 2.78632e+00 9.59840e-01 8.93266e+01 252.327 -1.40588e+00 -4.41250e+00 0.00000e+00 0.00000e+00 2.31432e+00 252.327 8.70123e+01 72.327  0.8841 
1 1 1 -9  61  15 o 1  1.02688e+01 9.37424e-01 2.07541e+02 27.764  4.28882e+01  2.25781e+01  0.00000e+00 0.00000e+00 1.70056e+02 27.764  3.74846e+01 207.764 0.9896 
1 1 1 -9  61  16 o 14 3.67868e+00 1.25918e+00 4.28802e+01 350.977 2.93668e+00  -4.66331e-01 0.00000e+00 0.00000e+00 6.74189e+01 350.977 2.45387e+01 350.977 0.8080 
1 1 1 -9  62  1  o 3  1.74711e+01 7.25866e-01 2.79730e+02 306.616 2.37553e+01  -3.19672e+01 0.00000e+00 0.00000e+00 3.68809e+02 306.616 8.90792e+01 306.616 0.9874 
1 1 1 -9  62  2  o 11 5.48205e+00 9.41980e-01 9.47651e+01 112.918 -1.48160e+00 3.50436e+00  0.00000e+00 0.00000e+00 8.14892e+01 112.918 1.32759e+01 292.918 0.8556 
1 1 1 -9  62  3  o 18 1.04674e+01 6.05884e-01 1.02542e+02 275.938 9.52732e-01  -9.16032e+00 0.00000e+00 0.00000e+00 2.68605e+02 275.938 1.66064e+02 275.938 0.9440 
1 1 1 -9  62  4  o 7  8.27722e+00 6.83640e-01 1.70407e+02 65.472  5.25546e+00  1.15173e+01  0.00000e+00 0.00000e+00 1.27765e+02 65.472  4.26414e+01 245.472 0.9597 
1 1 1 -9  62  5  o 15 3.30862e+00 8.43376e-01 7.45541e+01 293.170 8.88508e-01  -2.07603e+00 0.00000e+00 0.00000e+00 1.67883e+01 293.170 5.77658e+01 113.170 0.7359 
1 1 1 -9  62  6  o 1  6.53460e+00 7.41707e-01 1.13162e+02 199.317 -7.11324e+00 -2.49332e+00 0.00000e+00 0.00000e+00 1.14923e+02 199.317 1.76138e+00 199.317 0.9311 
1 1 1 -9  62  7  o 14 5.98067e+00 7.70597e-01 1.06562e+02 18.975  6.57645e+00  2.26119e+00  0.00000e+00 0.00000e+00 1.00670e+02 18.975  5.89163e+00 198.975 0.9250 
1 1 1 -9  62  8  o 18 8.10005e+00 6.08365e-01 1.33833e+02 13.599  1.30932e+01  3.16746e+00  0.00000e+00 0.00000e+00 1.57859e+02 13.599  2.40264e+01 13.599  0.9621 
1 1 1 -9  62  9  o 8  1.37376e+01 5.63489e-01 2.18496e+02 293.747 1.69300e+01  -3.84815e+01 0.00000e+00 0.00000e+00 2.89080e+02 293.747 7.05840e+01 293.747 0.9880 
1 1 1 -9  62  10 o 2  2.83586e+00 7.96037e-01 3.63325e+01 117.939 -7.23826e-01 1.36479e+00  0.00000e+00 0.00000e+00 2.79809e+01 117.939 8.35154e+00 297.940 0.6070 
1 1 1 -9  62  11 o 2  7.47721e+00 7.45461e-01 1.16094e+02 242.408 -6.23852e+00 -1.19374e+01 0.00000e+00 0.00000e+00 1.52407e+02 242.408 3.63125e+01 242.408 0.9621 
1 1 1 -9  62  12 o 10 3.49764e+00 9.47485e-01 1.06170e+02 96.545  -7.20905e-01 6.28323e+00  0.00000e+00 0.00000e+00 1.34245e+01 96.545  9.27456e+01 276.545 0.9171 
1 1 1 -9  62  13 o 13 3.87747e+00 1.01505e+00 3.69129e+01 213.471 -1.95297e+00 -1.29124e+00 0.00000e+00 0.00000e+00 7.08914e+01 213.471 3.39785e+01 213.471 0.7466 
1 1 1 -9  62  14 o 13 5.57741e+00 1.10764e+00 1.19907e+02 298.526 5.33056e+00  -9.80700e+00 0.00000e+00 0.00000e+00 7.80309e+01 298.526 4.18760e+01 118.526 0.9541 
1 1 1 -9  62  15 o 12 3.14242e+00 1.01038e+00 1.03374e+02 272.840 3.58739e-01  -7.23056e+00 0.00000e+00 0.00000e+00 4.97561e+00 272.840 9.83983e+01 92.840  0.9281 
1 1 1 -9  62  16 o 4  3.41393e+00 1.19322e+00 7.38072e+01 61.394  2.44913e+00  4.49085e+00  0.00000e+00 0.00000e+00 3.96808e+01 61.394  3.41263e+01 241.394 0.8960 
1 1 1 -9  63  1  o 9  1.19060e+01 7.21716e-01 1.86884e+02 355.967 1.86329e+01  -1.31358e+00 0.00000e+00 0.00000e+00 2.48504e+02 355.967 6.16203e+01 355.967 0.9729 
1 1 1 -9  63  2  o 2  1.94690e+01 5.73450e-01 3.19350e+02 144.437 -4.43448e+01 3.17044e+01  0.00000e+00 0.00000e+00 4.05404e+02 144.437 8.60542e+01 144.437 0.9908 
1 1 1 -9  63  3  o 11 1.62237e+01 5.59160e-01 2.29331e+02 224.642 -2.44345e+01 -2.41314e+01 0.00000e+00 0.00000e+00 3.70978e+02 224.642 1.41647e+02 224.642 0.9853 
1 1 1 -9  63  4  o 19 2.10911e+01 5.72618e-01 4.09131e+02 120.562 -4.02211e+01 6.81137e+01  0.00000e+00 0.00000e+00 3.77426e+02 120.562 3.17053e+01 300.562 0.9937 
1 1 1 -9  63  5  o 6  1.22619e+01 5.80003e-01 2.51479e+02 273.997 2.10152e+00  -3.00735e+01 0.00000e+00 0.00000e+00 2.00741e+02 273.997 5.07380e+01 93.997  0.9833 
1 1 1 -9  63  6  o 13 1.39379e+01 5.59299e-01 2.83983e+02 228.383 -2.83371e+01 -3.18978e+01 0.00000e+00 0.00000e+00 2.32267e+02 228.383 5.17164e+01 48.383  0.9882 
1 1 1 -9  63  7  o 12 8.15224e+00 6.01985e-01 7.65764e+01 358.386 7.49294e+00  -2.11100e-01 0.00000e+00 0.00000e+00 2.07583e+02 358.386 1.31007e+02 358.386 0.9307 
1 1 1 -9  63  8  o 9  6.32335e+00 6.85822e-01 1.38670e+02 294.581 4.85204e+00  -1.06069e+01 0.00000e+00 0.00000e+00 8.75787e+01 294.581 5.10917e+01 114.581 0.9561 
1 1 1 -9  63  9  o 16 1.04067e+01 5.98685e-01 1.43688e+02 315.343 1.52609e+01  -1.50794e+01 0.00000e+00 0.00000e+00 2.36229e+02 315.343 9.25408e+01 315.343 0.9764 
1 1 1 -9  63  10 o 18 3.61989e+00 8.48978e-01 5.64203e+01 123.793 -1.65966e+00 2.47981e+00  0.00000e+00 0.00000e+00 5.29414e+01 123.793 3.47885e+00 303.793 0.8088 
1 1 1 -9  63  11 o 1  4.24618e+00 8.44782e-01 1.91946e+01 256.030 -3.21257e-01 -1.29133e+00 0.00000e+00 0.00000e+00 6.81769e+01 256.030 4.89823e+01 256.030 0.5514 
1 1 1 -9  63  12 o 9  1.22816e+01 6.82672e-01 2.08772e+02 126.821 -2.83616e+01 3.78824e+01  0.00000e+00 0.00000e+00 2.44178e+02 126.821 3.54058e+01 126.821 0.9894 
1 1 1 -9  63  13 o 11 1.19893e+01 7.32898e-01 1.75481e+02 191.384 -4.02863e+01 -8.11118e+00 0.00000e+00 0.00000e+00 2.65471e+02 191.384 8.99902e+01 191.384 0.9878 
1 1 1 -9  63  14 o 9  7.96939e+00 9.79339e-01 7.94079e+01 13.774  1.18836e+01  2.91321e+00  0.00000e+00 0.00000e+00 2.04593e+02 13.774  1.25185e+02 13.774  0.9582 
1 1 1 -9  63  15 f 0  6.14866e+00 1.15822e+00 1.04342e+02 326.067 9.73641e+00  -6.55064e+00 0.00000e+00 0.00000e+00 1.14084e+02 326.067 9.74158e+00 326.067 0.9564 
1 1 1 -9  63  16 o 9  4.25603e+00 1.27292e+00 3.31949e+01 242.924 -1.26369e+00 -2.47208e+00 0.00000e+00 0.00000e+00 9.18430e+01 242.924 5.86481e+01 242.924 0.7920 
1 1 1 -9  64  1  o 6  2.11231e+01 6.83946e-01 3.36705e+02 60.834  2.96375e+01  5.31048e+01  0.00000e+00 0.00000e+00 4.50605e+02 60.834  1.13899e+02 60.834  0.9917 
1 1 1 -9  64  2  o 14 1.49582e+01 5.68715e-01 3.21345e+02 283.244 1.01454e+01  -4.31051e+01 0.00000e+00 0.00000e+00 2.34189e+02 283.244 8.71568e+01 103.244 0.9886 
1 1 1 -9  64  3  o 15 5.44056e+00 8.41020e-01 1.59342e+02 114.193 -3.05905e+00 6.80904e+00  0.00000e+00 0.00000e+00 3.07103e+01 114.193 1.28632e+02 294.193 0.9304 
1 1 1 -9  64  4  o 7  7.38143e+00 6.97652e-01 1.72945e+02 25.772  1.09474e+01  5.28555e+00  0.00000e+00 0.00000e+00 9.23928e+01 25.772  8.05518e+01 205.772 0.9579 
1 1 1 -9  64  5  o 11 1.28753e+01 5.60485e-01 2.23041e+02 25.096  2.78214e+01  1.30300e+01  0.00000e+00 0.00000e+00 2.51868e+02 25.096  2.88270e+01 25.096  0.9836 
1 1 1 -9  64  6  o 9  1.21420e+01 5.85842e-01 2.03964e+02 138.333 -2.09158e+01 1.86136e+01  0.00000e+00 0.00000e+00 2.42854e+02 138.333 3.88895e+01 138.333 0.9820 
1 1 1 -9  64  7  f 0  6.95725e+00 6.40991e-01 7.34162e+01 180.667 -6.69730e+00 -7.79389e-02 0.00000e+00 0.00000e+00 1.66784e+02 180.667 9.33674e+01 180.667 0.9220 
1 1 1 -9  64  8  o 13 3.80824e+00 8.00030e-01 2.99629e+01 46.992  1.01634e+00  1.08959e+00  0.00000e+00 0.00000e+00 5.46250e+01 46.992  2.46621e+01 46.992  0.5937 
1 1 1 -9  64  9  o 3  3.88492e+00 8.84910e-01 9.59886e+01 292.724 1.91317e+00  -4.56811e+00 0.00000e+00 0.00000e+00 3.35939e+01 292.724 6.23947e+01 112.724 0.8923 
1 1 1 -9  64  10 o 8  1.42727e+01 5.82566e-01 2.73485e+02 98.013  -8.90967e+00 6.32937e+01  0.00000e+00 0.00000e+00 2.55376e+02 98.013  1.81090e+01 278.013 0.9921 
1 1 1 -9  64  11 o 7  8.86038e+00 6.95890e-01 1.31839e+02 202.648 -1.92490e+01 -8.03164e+00 0.00000e+00 0.00000e+00 1.90715e+02 202.648 5.88763e+01 202.648 0.9757 
1 1 1 -9  64  12 o 9  6.07591e+00 9.71213e-01 1.35105e+02 351.249 1.22608e+01  -1.88735e+00 0.00000e+00 0.00000e+00 8.20159e+01 351.249 5.30890e+01 171.249 0.9588 
1 1 1 -9  64  13 o 1  3.47534e+00 9.96620e-01 7.21744e+01 332.168 3.82422e+00  -2.01903e+00 0.00000e+00 0.00000e+00 4.10247e+01 332.168 3.11497e+01 152.168 0.8749 
1 1 1 -9  64  14 o 14 8.25365e+00 9.56739e-01 1.08048e+02 266.972 -9.29106e-01 -1.75619e+01 0.00000e+00 0.00000e+00 1.89997e+02 266.972 8.19495e+01 266.972 0.9711 
1 1 1 -9  64  15 o 18 3.31879e+00 1.06008e+00 9.89673e+01 63.079  3.11263e+00  6.12975e+00  0.00000e+00 0.00000e+00 1.49300e+01 63.079  8.40374e+01 243.079 0.9241 
1 1 1 -9  65  1  o 18 1.07825e+01 7.23139e-01 1.57335e+02 244.443 -6.50876e+00 -1.36111e+01 0.00000e+00 0.00000e+00 2.34165e+02 244.443 7.68306e+01 244.443 0.9663 
1 1 1 -9  65  2  o 1  1.31253e+01 6.75643e-01 2.36156e+02 57.675  1.48927e+01  2.35348e+01  0.00000e+00 0.00000e+00 2.47884e+02 57.675  1.17277e+01 57.675  0.9819 
1 1 1 -9  65  3  o 2  8.73920e+00 6.46655e-01 2.31473e+02 229.006 -1.26457e+01 -1.45504e+01 0.00000e+00 0.00000e+00 8.79690e+01 229.006 1.43504e+02 49.006  0.9737 
1 1 1 -9  65  4  o 7  1.06627e+01 5.84352e-01 1.51064e+02 358.112 1.57228e+01  -5.18155e-01 0.00000e+00 0.00000e+00 2.36051e+02 358.112 8.49869e+01 358.112 0.9677 
1 1 1 -9  65  5  o 9  1.75597e+01 5.64670e-01 2.94792e+02 121.389 -3.01177e+01 4.93621e+01  0.00000e+00 0.00000e+00 3.57875e+02 121.389 6.30827e+01 121.389 0.9913 
1 1 1 -9  65  6  o 12 6.63184e+00 7.51460e-01 8.77565e+01 128.530 -3.97943e+00 4.99752e+00  0.00000e+00 0.00000e+00 1.40350e+02 128.530 5.25933e+01 128.530 0.9180 
1 1 1 -9  65  7  o 2  1.03828e+01 5.57346e-01 1.71067e+02 233.931 -1.40006e+01 -1.92218e+01 0.00000e+00 0.00000e+00 2.09395e+02 233.931 3.83282e+01 233.931 0.9787 
1 1 1 -9  65  8  o 5  9.58229e+00 6.16171e-01 1.30497e+02 62.734  8.02286e+00  1.55665e+01  0.00000e+00 0.00000e+00 2.17575e+02 62.734  8.70781e+01 62.734  0.9710 
1 1 1 -9  65  9  o 4  5.51466e+00 8.20991e-01 6.03015e+01 259.322 -8.26075e-01 -4.38133e+00 0.00000e+00 0.00000e+00 1.20894e+02 259.322 6.05923e+01 259.322 0.8791 
1 1 1 -9  65  10 o 1  7.71799e+00 7.34671e-01 1.30570e+02 270.197 5.58247e-02  -1.62296e+01 0.00000e+00 0.00000e+00 1.48600e+02 270.197 1.80300e+01 270.197 0.9687 
1 1 1 -9  65  11 o 15 4.13252e+00 9.48228e-01 3.39137e+01 126.291 -1.29486e+00 1.76331e+00  0.00000e+00 0.00000e+00 7.80508e+01 126.291 4.41371e+01 126.291 0.7263 
1 1 1 -9  65  12 o 15 4.60765e+00 9.02830e-01 6.99749e+01 25.195  4.98523e+00  2.34533e+00  0.00000e+00 0.00000e+00 8.52376e+01 25.195  1.52627e+01 25.195  0.9040 
1 1 1 -9  65  13 o 13 9.96897e+00 8.46557e-01 1.34355e+02 238.641 -1.37917e+01 -2.26311e+01 0.00000e+00 0.00000e+00 2.29635e+02 238.641 9.52805e+01 238.641 0.9809 
1 1 1 -9  65  14 o 18 4.13884e+00 1.08502e+00 7.04012e+01 307.376 3.15331e+00  -4.12798e+00 0.00000e+00 0.00000e+00 6.77295e+01 307.376 2.67169e+00 127.376 0.8977 
1 1 1 -9  65  15 o 14 3.89528e+00 1.14210e+00 6.74752e+01 66.483  2.09351e+00  4.81095e+00  0.00000e+00 0.00000e+00 6.25235e+01 66.483  4.95166e+00 246.483 0.8988 
1 1 1 -9  66  1  o 7  1.61067e+01 6.82729e-01 2.88212e+02 306.636 2.48051e+01  -3.33561e+01 0.00000e+00 0.00000e+00 3.09584e+02 306.636 2.13718e+01 306.636 0.9879 
1 1 1 -9  66  2  o 12 5.47483e+00 9.75986e-01 1.13246e+02 62.975  2.45014e+00  4.80341e+00  0.00000e+00 0.00000e+00 7.21467e+01 62.975  4.10997e+01 242.975 0.9017 
1 1 1 -9  66  3  o 19 8.42721e+00 6.40432e-01 2.09543e+02 118.964 -8.26515e+00 1.49328e+01  0.00000e+00 0.00000e+00 9.73449e+01 118.964 1.12198e+02 298.964 0.9702 
1 1 1 -9  66  4  o 1  9.31224e+00 6.37727e-01 1.62158e+02 172.125 -1.57072e+01 2.17264e+00  0.00000e+00 0.00000e+00 1.75956e+02 172.125 1.37977e+01 172.125 0.9679 
1 1 1 -9  66  5  o 5  1.99311e+01 6.37246e-01 3.13173e+02 38.328  5.47265e+01  4.32640e+01  0.00000e+00 0.00000e+00 4.28618e+02 38.328  1.15445e+02 38.328  0.9928 
1 1 1 -9  66  6  o 4  9.65738e+00 5.75110e-01 2.13845e+02 97.811  -3.39347e+00 2.47375e+01  0.00000e+00 0.00000e+00 1.40612e+02 97.811  7.32329e+01 277.811 0.9798 
1 1 1 -9  66  7  o 2  1.28615e+01 5.48903e-01 1.84427e+02 276.559 3.76804e+00  -3.27733e+01 0.00000e+00 0.00000e+00 2.89663e+02 276.559 1.05236e+02 276.559 0.9847 
1 1 1 -9  66  8  o 17 4.86739e+00 7.95972e-01 1.53867e+02 117.095 -4.41163e+00 8.62298e+00  0.00000e+00 0.00000e+00 1.85130e+01 117.095 1.35354e+02 297.095 0.9469 
1 1 1 -9  66  9  o 17 6.24811e+00 7.72487e-01 8.28425e+01 129.187 -4.96053e+00 6.08507e+00  0.00000e+00 0.00000e+00 1.35223e+02 129.187 5.23801e+01 129.187 0.9340 
1 1 1 -9  66  10 o 6  1.04452e+01 6.51199e-01 1.94373e+02 5.428   3.12727e+01  2.97181e+00  0.00000e+00 0.00000e+00 1.89327e+02 5.428   5.04610e+00 185.428 0.9840 
1 1 1 -9  66  11 o 16 4.45011e+00 9.64230e-01 8.43994e+01 137.518 -4.15122e+00 3.80153e+00  0.00000e+00 0.00000e+00 6.60017e+01 137.518 1.83977e+01 317.518 0.9062 
1 1 1 -9  66  12 o 10 8.85637e+00 8.42091e-01 1.18090e+02 266.042 -1.32804e+00 -1.91948e+01 0.00000e+00 0.00000e+00 2.03177e+02 266.042 8.50867e+01 266.042 0.9737 
1 1 1 -9  66  13 o 1  1.04678e+01 8.30392e-01 1.36921e+02 315.842 2.08519e+01  -2.02481e+01 0.00000e+00 0.00000e+00 2.45873e+02 315.842 1.08952e+02 315.842 0.9826 
1 1 1 -9  66  14 o 12 7.34414e+00 1.09786e+00 1.00887e+02 98.452  -2.02047e+00 1.35979e+01  0.00000e+00 0.00000e+00 1.61974e+02 98.452  6.10877e+01 98.452  0.9629 
1 1 1 -9  66  15 o 4  6.90481e+00 1.22707e+00 9.27006e+01 270.820 1.68449e-01  -1.17639e+01 0.00000e+00 0.00000e+00 1.52486e+02 270.820 5.97858e+01 270.820 0.9565 
1 1 1 -9  67  1  o 17 9.39559e+00 7.43746e-01 2.11681e+02 196.082 -1.79850e+01 -5.18498e+00 0.00000e+00 0.00000e+00 1.31680e+02 196.082 8.00012e+01 16.082  0.9729 
1 1 1 -9  67  2  o 4  5.81383e+00 9.02162e-01 1.21474e+02 327.262 5.34882e+00  -3.43885e+00 0.00000e+00 0.00000e+00 7.88218e+01 327.262 4.26525e+01 147.262 0.9176 
1 1 1 -9  67  3  o 7  6.57888e+00 7.42557e-01 1.52448e+02 289.352 3.45204e+00  -9.82885e+00 0.00000e+00 0.00000e+00 8.22663e+01 289.352 7.01812e+01 109.352 0.9507 
1 1 1 -9  67  4  o 16 1.19585e+01 5.76738e-01 2.64669e+02 76.353  8.31570e+00  3.42500e+01  0.00000e+00 0.00000e+00 1.77419e+02 76.353  8.72492e+01 256.353 0.9857 
1 1 1 -9  67  5  o 4  1.21233e+01 5.87828e-01 1.84123e+02 343.195 2.25997e+01  -6.82520e+00 0.00000e+00 0.00000e+00 2.60535e+02 343.195 7.64117e+01 343.195 0.9786 
1 1 1 -9  67  6  o 18 1.08864e+01 5.45828e-01 1.79873e+02 103.339 -6.09110e+00 2.56889e+01  0.00000e+00 0.00000e+00 2.20071e+02 103.339 4.01975e+01 103.339 0.9809 
1 1 1 -9  67  7  o 8  4.56642e+00 8.09323e-01 6.68833e+01 117.152 -1.70006e+00 3.31481e+00  0.00000e+00 0.00000e+00 7.87366e+01 117.152 1.18533e+01 117.152 0.8521 
1 1 1 -9  67  8  o 5  7.80398e+00 8.98362e-01 1.18664e+02 107.587 -3.58213e+00 1.13010e+01  0.00000e+00 0.00000e+00 1.60575e+02 107.587 4.19106e+01 107.587 0.9568 
1 1 1 -9  67  9  o 16 1.00810e+01 6.01436e-01 2.23443e+02 49.143  2.40620e+01  2.78204e+01  0.00000e+00 0.00000e+00 1.48051e+02 49.143  7.53916e+01 229.143 0.9863 
1 1 1 -9  67  10 o 12 4.18558e+00 9.12794e-01 4.45728e+01 184.481 -2.67027e+00 -2.09272e-01 0.00000e+00 0.00000e+00 7.77736e+01 184.481 3.32008e+01 184.481 0.7831 
1 1 1 -9  67  11 o 13 9.54661e+00 7.11250e-01 2.16531e+02 257.387 -8.36165e+00 -3.73695e+01 0.00000e+00 0.00000e+00 1.34778e+02 257.387 8.17526e+01 77.387  0.9869 
1 1 1 -9  67  12 o 9  6.70696e+00 9.39364e-01 1.20197e+02 117.784 -6.33168e+00 1.20171e+01  0.00000e+00 0.00000e+00 1.20257e+02 117.784 5.95138e-02 117.784 0.9625 
1 1 1 -9  67  13 o 11 4.44581e+00 1.09349e+00 4.61297e+01 167.338 -3.55219e+00 7.98049e-01  0.00000e+00 0.00000e+00 9.41674e+01 167.338 4.80378e+01 167.338 0.8481 
1 1 1 -9  67  14 o 15 3.33980e+00 1.03306e+00 9.77083e+01 139.579 -5.11775e+00 4.35883e+00  0.00000e+00 0.00000e+00 1.67665e+01 139.579 8.09417e+01 319.579 0.9223 
1 1 1 -9  67  15 o 3  2.76927e+00 9.08249e-01 5.05143e+01 298.749 1.65469e+00  -3.01625e+00 0.00000e+00 0.00000e+00 3.56142e+01 298.749 1.49002e+01 118.749 0.8379 
1 1 1 -9  68  1  o 17 1.12457e+01 7.25292e-01 1.75848e+02 181.539 -2.06747e+01 -5.55639e-01 0.00000e+00 0.00000e+00 2.36150e+02 181.539 6.03016e+01 181.539 0.9755 
1 1 1 -9  68  2  f 0  6.58836e+00 8.81522e-01 1.12912e+02 318.314 5.52590e+00  -4.92090e+00 0.00000e+00 0.00000e+00 1.17029e+02 318.314 4.11740e+00 318.314 0.9297 
1 1 1 -9  68  3  f 0  1.04556e+01 7.23203e-01 2.06815e+02 3.083   2.31614e+01  1.24760e+00  0.00000e+00 0.00000e+00 1.76919e+02 3.083   2.98955e+01 183.083 0.9782 
1 1 1 -9  68  4  o 5  1.93599e+01 5.65938e-01 4.02724e+02 92.644  -4.09124e+00 8.86023e+01  0.00000e+00 0.00000e+00 3.19121e+02 92.644  8.36028e+01 272.644 0.9943 
1 1 1 -9  68  5  o 9  3.83017e+00 8.87447e-01 1.03782e+02 14.769  4.21748e+00  1.11187e+00  0.00000e+00 0.00000e+00 2.19673e+01 14.769  8.18146e+01 194.769 0.8761 
1 1 1 -9  68  6  o 2  7.30371e+00 6.33753e-01 1.66072e+02 160.707 -1.49809e+01 5.24413e+00  0.00000e+00 0.00000e+00 9.86719e+01 160.707 6.74005e+01 340.707 0.9680 
1 1 1 -9  68  7  o 16 1.28806e+01 5.51875e-01 2.37416e+02 71.023  1.42197e+01  4.13514e+01  0.00000e+00 0.00000e+00 2.39021e+02 71.023  1.60446e+00 71.023  0.9885 
1 1 1 -9  68  8  o 14 3.79871e+00 8.69107e-01 2.22844e+01 87.858  4.22861e-02  1.13078e+00  0.00000e+00 0.00000e+00 4.74611e+01 87.858  2.51767e+01 87.858  0.4911 
1 1 1 -9  68  9  o 18 5.11459e+00 8.26343e-01 8.39743e+01 203.824 -5.82775e+00 -2.57328e+00 0.00000e+00 0.00000e+00 9.13703e+01 203.824 7.39599e+00 203.824 0.9178 
1 1 1 -9  68  10 o 1  9.25270e+00 6.97992e-01 1.61370e+02 0.870   2.45279e+01  3.72340e-01  0.00000e+00 0.00000e+00 1.76829e+02 0.870   1.54583e+01 0.870   0.9794 
1 1 1 -9  68  11 o 8  7.23452e+00 7.79234e-01 1.32089e+02 206.787 -1.50286e+01 -7.58732e+00 0.00000e+00 0.00000e+00 1.29495e+02 206.787 2.59388e+00 26.787  0.9698 
1 1 1 -9  68  12 o 1  3.26657e+00 9.45859e-01 5.86331e+01 39.295  2.52750e+00  2.06837e+00  0.00000e+00 0.00000e+00 4.20833e+01 39.295  1.65498e+01 219.295 0.8279 
1 1 1 -9  68  13 o 7  8.67123e+00 8.81440e-01 1.45772e+02 87.685  9.91530e-01  2.45267e+01  0.00000e+00 0.00000e+00 1.70166e+02 87.685  2.43935e+01 87.685  0.9794 
1 1 1 -9  68  14 o 19 3.69071e+00 1.09447e+00 7.54934e+01 309.392 3.66276e+00  -4.46037e+00 0.00000e+00 0.00000e+00 4.91155e+01 309.392 2.63779e+01 129.392 0.9087 
1 1 1 -9  68  15 o 9  4.00736e+00 1.16564e+00 5.21364e+01 188.159 -4.38683e+00 -6.28937e-01 0.00000e+00 0.00000e+00 7.84784e+01 188.159 2.63420e+01 188.159 0.8783 
1 1 1 -9  69  1  o 18 7.21977e+00 1.14720e+00 9.05470e+01 334.579 5.25432e+00  -2.49729e+00 0.00000e+00 0.00000e+00 1.55992e+02 334.579 6.54446e+01 334.579 0.9094 
1 1 1 -9  69  2  o 6  4.46645e+00 9.64110e-01 1.02559e+02 194.229 -4.40175e+00 -1.11617e+00 0.00000e+00 0.00000e+00 4.52136e+01 194.229 5.73449e+01 14.229  0.8815 
1 1 1 -9  69  3  o 4  1.05955e+01 6.87119e-01 2.17382e+02 246.422 -9.61309e+00 -2.20262e+01 0.00000e+00 0.00000e+00 1.71718e+02 246.422 4.56646e+01 66.422  0.9790 
1 1 1 -9  69  4  o 1  5.58973e+00 8.07413e-01 7.35137e+01 142.096 -3.23061e+00 2.51533e+00  0.00000e+00 0.00000e+00 1.08188e+02 142.096 3.46743e+01 142.096 0.8671 
1 1 1 -9  69  5  o 1  7.71529e+00 6.16146e-01 1.51430e+02 340.227 1.38840e+01  -4.99107e+00 0.00000e+00 0.00000e+00 1.27661e+02 340.227 2.37685e+01 160.227 0.9655 
1 1 1 -9  69  6  o 16 4.53248e+00 8.25026e-01 9.74303e+01 102.598 -1.21838e+00 5.45169e+00  0.00000e+00 0.00000e+00 5.62160e+01 102.598 4.12143e+01 282.598 0.9054 
1 1 1 -9  69  7  o 8  4.15301e+00 8.60873e-01 6.43487e+01 139.930 -2.70752e+00 2.27749e+00  0.00000e+00 0.00000e+00 6.66405e+01 139.930 2.29180e+00 139.930 0.8431 
1 1 1 -9  69  8  o 8  4.21380e+00 8.83971e-01 6.04958e+01 330.864 3.28747e+00  -1.83247e+00 0.00000e+00 0.00000e+00 7.39890e+01 330.864 1.34932e+01 330.864 0.8538 
1 1 1 -9  69  9  o 6  8.57358e+00 6.49993e-01 1.39783e+02 215.754 -1.62485e+01 -1.16990e+01 0.00000e+00 0.00000e+00 1.72325e+02 215.754 3.25418e+01 215.754 0.9747 
1 1 1 -9  69  10 o 18 1.11753e+01 6.57732e-01 1.70691e+02 46.469  2.38500e+01  2.51057e+01  0.00000e+00 0.00000e+00 2.40228e+02 46.469  6.95363e+01 46.469  0.9855 
1 1 1 -9  69  11 o 14 9.05022e+00 7.30965e-01 1.73579e+02 160.312 -2.52836e+01 9.04687e+00  0.00000e+00 0.00000e+00 1.57432e+02 160.312 1.61469e+01 340.312 0.9812 
1 1 1 -9  69  12 o 9  1.02536e+01 7.78683e-01 1.21904e+02 18.821  2.29160e+01  7.81070e+00  0.00000e+00 0.00000e+00 2.51928e+02 18.821  1.30023e+02 18.821  0.9791 
1 1 1 -9  69  13 o 6  3.72281e+00 1.00095e+00 5.67671e+01 354.340 4.00668e+00  -3.97056e-01 0.00000e+00 0.00000e+00 6.29408e+01 354.340 6.17365e+00 354.340 0.8645 
1 1 1 -9  69  14 o 19 3.35761e+00 1.02567e+00 3.85490e+01 114.315 -1.17176e+00 2.59337e+00  0.00000e+00 0.00000e+00 6.09776e+01 114.315 2.24286e+01 114.315 0.7979 
1 1 1 -9  69  15 o 15 4.04153e+00 1.20137e+00 7.55356e+01 348.676 6.03468e+00  -1.20850e+00 0.00000e+00 0.00000e+00 6.16276e+01 348.676 1.39080e+01 168.676 0.9147 
1 1 1 -9  70  1  o 14 6.89358e+00 1.18461e+00 1.70054e+02 354.588 1.03135e+01  -9.77127e-01 0.00000e+00 0.00000e+00 7.59146e+01 354.588 9.41390e+01 174.588 0.9504 
1 1 1 -9  70  2  o 14 1.02774e+01 7.10202e-01 1.99953e+02 346.208 2.18747e+01  -5.36965e+00 0.00000e+00 0.00000e+00 1.77041e+02 346.208 2.29118e+01 166.208 0.9775 
1 1 1 -9  70  3  o 15 1.01428e+01 7.11940e-01 1.86132e+02 134.838 -1.36580e+01 1.37354e+01  0.00000e+00 0.00000e+00 1.84321e+02 134.838 1.81103e+00 314.838 0.9738 
1 1 1 -9  70  4  o 12 8.75710e+00 6.43468e-01 1.20413e+02 39.592  9.65072e+00  7.98148e+00  0.00000e+00 0.00000e+00 1.94442e+02 39.592  7.40284e+01 39.592  0.9592 
1 1 1 -9  70  5  o 19 1.66305e+01 5.33459e-01 3.07047e+02 294.720 2.87955e+01  -6.25479e+01 0.00000e+00 0.00000e+00 3.11383e+02 294.720 4.33572e+00 294.720 0.9927 
1 1 1 -9  70  6  o 10 2.01740e+01 5.50504e-01 3.84374e+02 104.314 -2.72947e+01 1.06975e+02  0.00000e+00 0.00000e+00 3.67378e+02 104.314 1.69955e+01 284.314 0.9955 
1 1 1 -9  70  7  o 15 7.25697e+00 6.50153e-01 1.07486e+02 2.958   1.09923e+01  5.67978e-01  0.00000e+00 0.00000e+00 1.51319e+02 2.958   4.38324e+01 2.958   0.9534 
1 1 1 -9  70  8  o 14 1.73752e+01 5.64878e-01 3.33860e+02 174.367 -9.49634e+01 9.36638e+00  0.00000e+00 0.00000e+00 3.12113e+02 174.367 2.17474e+01 354.367 0.9947 
1 1 1 -9  70  9  o 11 7.83284e+00 7.67595e-01 9.96590e+01 349.534 1.13433e+01  -2.09532e+00 0.00000e+00 0.00000e+00 1.79848e+02 349.534 8.01892e+01 349.534 0.9556 
1 1 1 -9  70  10 o 3  3.47278e+00 9.64504e-01 4.91851e+01 176.206 -2.69198e+00 1.78502e-01  0.00000e+00 0.00000e+00 5.25044e+01 176.206 3.31928e+00 176.206 0.7849 
1 1 1 -9  70  11 o 5  8.22995e+00 7.78019e-01 1.53754e+02 239.209 -1.18666e+01 -1.99133e+01 0.00000e+00 0.00000e+00 1.46274e+02 239.209 7.47925e+00 59.209  0.9782 
1 1 1 -9  70  12 o 9  3.57991e+00 1.01230e+00 8.13769e+01 16.172  4.77030e+00  1.38338e+00  0.00000e+00 0.00000e+00 3.75863e+01 16.172  4.37906e+01 196.172 0.8926 
1 1 1 -9  70  13 o 14 4.79863e+00 1.12654e+00 7.01008e+01 55.016  3.36781e+00  4.81260e+00  0.00000e+00 0.00000e+00 9.23487e+01 55.016  2.22478e+01 55.016  0.9104 
1 1 1 -9  70  14 o 11 6.09641e+00 1.22954e+00 1.50776e+02 163.881 -1.61948e+01 4.68015e+00  0.00000e+00 0.00000e+00 6.88389e+01 163.881 8.19374e+01 343.881 0.9699 
1 1 1 -9  70  15 o 3  5.65765e+00 1.30367e+00 9.57472e+01 4.540   1.04928e+01  8.33263e-01  0.00000e+00 0.00000e+00 1.03898e+02 4.540   8.15110e+00 4.540   0.9512 
1 1 1 -9  71  1  o 7  6.98956e+00 1.10372e+00 1.42108e+02 293.293 3.55006e+00  -8.24588e+00 0.00000e+00 0.00000e+00 1.05165e+02 293.293 3.69435e+01 113.293 0.9425 
1 1 1 -9  71  2  o 12 1.26698e+01 6.22546e-01 2.79631e+02 143.067 -2.97234e+01 2.23441e+01  0.00000e+00 0.00000e+00 1.89268e+02 143.067 9.03629e+01 323.066 0.9865 
1 1 1 -9  71  3  f 0  4.71934e+00 1.00699e+00 2.76631e+01 52.249  8.38581e-01  1.08300e+00  0.00000e+00 0.00000e+00 7.18326e+01 52.249  4.41694e+01 52.249  0.5622 
1 1 1 -9  71  4  o 4  5.61055e+00 9.34953e-01 1.12179e+02 350.970 7.31934e+00  -1.16319e+00 0.00000e+00 0.00000e+00 8.33342e+01 350.970 2.88446e+01 170.970 0.9299 
1 1 1 -9  71  5  o 12 1.12804e+01 5.55078e-01 2.27882e+02 333.319 3.18996e+01  -1.60308e+01 0.00000e+00 0.00000e+00 1.88636e+02 333.319 3.92452e+01 153.319 0.9859 
1 1 1 -9  71  6  o 10 7.33013e+00 6.69639e-01 1.18627e+02 80.646  1.94477e+00  1.18061e+01  0.00000e+00 0.00000e+00 1.43984e+02 80.646  2.53563e+01 80.646  0.9573 
1 1 1 -9  71  7  o 2  1.01235e+01 6.03167e-01 2.20973e+02 78.863  6.40608e+00  3.25413e+01  0.00000e+00 0.00000e+00 1.51871e+02 78.863  6.91015e+01 258.863 0.9848 
1 1 1 -9  71  8  o 3  9.99486e+00 6.06813e-01 1.41682e+02 240.343 -1.13281e+01 -1.98946e+01 0.00000e+00 0.00000e+00 2.23546e+02 240.343 8.18643e+01 240.343 0.9779 
1 1 1 -9  71  9  o 8  7.21553e+00 7.49929e-01 1.58650e+02 86.985  9.32348e-01  1.77039e+01  0.00000e+00 0.00000e+00 1.03023e+02 86.985  5.56270e+01 266.985 0.9714 
1 1 1 -9  71  10 o 17 1.34226e+01 6.38495e-01 2.66143e+02 266.859 -3.42929e+00 -6.24865e+01 0.00000e+00 0.00000e+00 2.30487e+02 266.859 3.56567e+01 86.859  0.9920 
1 1 1 -9  71  11 o 18 1.43369e+01 6.51920e-01 2.11506e+02 5.541   6.15290e+01  5.96889e+00  0.00000e+00 0.00000e+00 3.18368e+02 5.541   1.06862e+02 5.541   0.9919 
1 1 1 -9  71  12 o 8  3.48871e+00 9.63355e-01 6.62597e+01 159.411 -3.94382e+00 1.48155e+00  0.00000e+00 0.00000e+00 4.68754e+01 159.411 1.93843e+01 339.411 0.8712 
1 1 1 -9  71  13 o 15 5.37780e+00 1.15604e+00 1.28268e+02 198.105 -1.11035e+01 -3.63017e+00 0.00000e+00 0.00000e+00 6.29179e+01 198.105 6.53500e+01 18.105  0.9562 
1 1 1 -9  71  14 o 16 1.09559e+01 9.69333e-01 1.64990e+02 3.451   4.17145e+01  2.51557e+00  0.00000e+00 0.00000e+00 2.36968e+02 3.451   7.19786e+01 3.451   0.9880 
1 1 1 -9  71  15 o 15 2.83595e+00 9.49615e-01 5.26095e+01 305.153 2.41580e+00  -3.43055e+00 0.00000e+00 0.00000e+00 3.89684e+01 305.153 1.36411e+01 125.153 0.8707 
1 1 1 -9  72  1  o 14 1.36629e+01 8.81851e-01 2.06869e+02 221.801 -2.21535e+01 -1.98083e+01 0.00000e+00 0.00000e+00 2.97155e+02 221.801 9.02860e+01 221.801 0.9830 
1 1 1 -9  72  2  o 11 7.44626e+00 9.23471e-01 1.87158e+02 233.630 -8.95040e+00 -1.21533e+01 0.00000e+00 0.00000e+00 8.27318e+01 233.630 1.04426e+02 53.630  0.9663 
1 1 1 -9  72  3  o 12 7.15807e+00 8.75377e-01 1.26763e+02 252.412 -3.17406e+00 -1.00130e+01 0.00000e+00 0.00000e+00 1.28483e+02 252.412 1.71949e+00 252.412 0.9511 
1 1 1 -9  72  4  o 18 1.24432e+01 6.38110e-01 1.59130e+02 85.802  1.89476e+00  2.58159e+01  0.00000e+00 0.00000e+00 2.98005e+02 85.802  1.38874e+02 85.802  0.9805 
1 1 1 -9  72  5  o 2  9.34731e+00 6.12622e-01 1.56296e+02 297.213 8.70534e+00  -1.69295e+01 0.00000e+00 0.00000e+00 1.84393e+02 297.213 2.80970e+01 297.213 0.9734 
1 1 1 -9  72  6  o 6  4.28918e+00 8.13142e-01 6.73314e+01 6.456   3.68606e+00  4.17127e-01  0.00000e+00 0.00000e+00 6.93058e+01 6.456   1.97446e+00 6.456   0.8513 
1 1 1 -9  72  7  o 5  4.88502e+00 7.93094e-01 1.29214e+02 93.107  -4.63829e-01 8.54533e+00  0.00000e+00 0.00000e+00 4.24093e+01 93.107  8.68050e+01 273.107 0.9396 
1 1 1 -9  72  8  o 4  1.12024e+01 5.96919e-01 2.42338e+02 131.247 -2.92185e+01 3.33202e+01  0.00000e+00 0.00000e+00 1.71429e+02 131.247 7.09088e+01 311.247 0.9887 
1 1 1 -9  72  9  o 10 3.18495e+00 8.58251e-01 6.44304e+01 39.191  2.42782e+00  1.97946e+00  0.00000e+00 0.00000e+00 3.29736e+01 39.191  3.14568e+01 219.191 0.8193 
1 1 1 -9  72  10 o 17 3.39167e+00 9.18525e-01 2.40439e+01 301.538 7.38937e-01  -1.20402e+00 0.00000e+00 0.00000e+00 4.85302e+01 301.538 2.44862e+01 301.538 0.5738 
1 1 1 -9  72  11 o 7  1.40887e+01 6.71843e-01 1.95655e+02 122.472 -2.88343e+01 4.53104e+01  0.00000e+00 0.00000e+00 3.24296e+02 122.472 1.28641e+02 122.472 0.9906 
1 1 1 -9  72  12 o 12 7.67379e+00 8.86093e-01 1.43636e+02 276.145 2.42684e+00  -2.25409e+01 0.00000e+00 0.00000e+00 1.35569e+02 276.145 8.06688e+00 96.145  0.9777 
1 1 1 -9  72  13 o 16 6.40433e+00 1.08523e+00 1.10912e+02 64.069  5.81723e+00  1.19637e+01  0.00000e+00 0.00000e+00 1.18022e+02 64.069  7.10945e+00 64.069  0.9616 
1 1 1 -9  72  14 o 3  3.30865e+00 1.00421e+00 2.85122e+01 99.666  -3.43226e-01 2.01505e+00  0.00000e+00 0.00000e+00 5.80788e+01 99.666  2.95666e+01 99.666  0.7049 
1 1 1 -9  72  15 o 2  4.59548e+00 1.25570e+00 5.93576e+01 227.958 -3.82094e+00 -4.23736e+00 0.00000e+00 0.00000e+00 9.52942e+01 227.958 3.59366e+01 227.958 0.9075 
1 1 1 -9  73  1  o 8  9.70357e+00 7.88859e-01 1.35576e+02 91.857  -5.10133e-01 1.57309e+01  0.00000e+00 0.00000e+00 2.16733e+02 91.857  8.11566e+01 91.857  0.9677 
1 1 1 -9  73  2  o 3  4.04622e+00 1.02969e+00 1.03790e+02 111.068 -1.70865e+00 4.43551e+00  0.00000e+00 0.00000e+00 3.08553e+01 111.068 7.29344e+01 291.068 0.8873 
1 1 1 -9  73  3  o 6  1.36615e+01 7.87123e-01 2.35478e+02 347.260 3.90289e+01  -8.82411e+00 0.00000e+00 0.00000e+00 2.70156e+02 347.260 3.46777e+01 347.260 0.9874 
1 1 1 -9  73  4  o 14 3.71355e+00 8.49284e-01 5.94927e+01 189.019 -2.73407e+00 -4.33968e-01 0.00000e+00 0.00000e+00 5.05862e+01 189.019 8.90648e+00 9.019   0.7913 
1 1 1 -9  73  5  o 3  2.40790e+00 7.17514e-01 6.29176e+01 238.326 -1.07687e+00 -1.74540e+00 0.00000e+00 0.00000e+00 7.21205e-01 238.326 6.21964e+01 58.326  0.7060 
1 1 1 -9  73  6  o 7  2.47912e+00 7.40825e-01 6.06539e+01 29.118  1.89890e+00  1.05768e+00  0.00000e+00 0.00000e+00 6.52434e+00 29.118  5.41296e+01 209.118 0.7243 
1 1 1 -9  73  7  o 6  1.19697e+01 5.82485e-01 2.38275e+02 341.320 4.41856e+01  -1.49389e+01 0.00000e+00 0.00000e+00 2.04365e+02 341.320 3.39099e+01 161.320 0.9892 
1 1 1 -9  73  8  o 14 6.19131e+00 8.02044e-01 8.90177e+01 180.600 -8.60176e+00 -9.01342e-02 0.00000e+00 0.00000e+00 1.28352e+02 180.600 3.93345e+01 180.600 0.9399 
1 1 1 -9  73  9  o 19 4.33920e+00 8.53579e-01 6.28989e+01 57.843  2.39681e+00  3.81238e+00  0.00000e+00 0.00000e+00 7.96736e+01 57.843  1.67747e+01 57.843  0.8804 
1 1 1 -9  73  10 o 17 5.20212e+00 9.59331e-01 1.16529e+02 198.397 -9.37523e+00 -3.11815e+00 0.00000e+00 0.00000e+00 6.73329e+01 198.397 4.91964e+01 18.397  0.9480 
1 1 1 -9  73  11 o 5  6.47554e+00 9.46472e-01 1.21540e+02 200.791 -1.25379e+01 -4.76036e+00 0.00000e+00 0.00000e+00 1.10478e+02 200.791 1.10620e+01 20.791  0.9620 
1 1 1 -9  73  12 o 13 3.31586e+00 9.21673e-01 5.80610e+01 226.356 -2.53315e+00 -2.65599e+00 0.00000e+00 0.00000e+00 4.67479e+01 226.356 1.13131e+01 46.356  0.8495 
1 1 1 -9  73  13 o 5  2.98968e+00 9.29978e-01 4.94525e+01 70.466  1.10339e+00  3.10999e+00  0.00000e+00 0.00000e+00 4.27622e+01 70.466  6.69030e+00 250.466 0.8299 
1 1 1 -9  73  14 o 8  2.64747e+00 8.83912e-01 6.01866e+01 276.804 4.74170e-01  -3.97415e+00 0.00000e+00 0.00000e+00 2.46863e+01 276.804 3.55003e+01 96.804  0.8636 
1 1 1 -9  73  15 f 0  4.78281e+00 1.28058e+00 7.05443e+01 316.628 4.86411e+00  -4.59528e+00 0.00000e+00 0.00000e+00 9.29308e+01 316.628 2.23865e+01 316.628 0.9219 
1 1 1 -9  74  1  o 11 4.71478e+00 1.06164e+00 3.87565e+01 34.420  1.67796e+00  1.14980e+00  0.00000e+00 0.00000e+00 8.56285e+01 34.420  4.68720e+01 34.420  0.7033 
1 1 1 -9  74  2  o 5  6.45662e+00 9.31812e-01 1.28698e+02 134.975 -6.90287e+00 6.90901e+00  0.00000e+00 0.00000e+00 1.00641e+02 134.975 2.80570e+01 314.975 0.9473 
1 1 1 -9  74  3  o 7  5.67748e+00 1.26413e+00 8.58762e+01 305.687 2.95815e+00  -4.11869e+00 0.00000e+00 0.00000e+00 1.04550e+02 305.687 1.86734e+01 305.687 0.8950 
1 1 1 -9  74  4  o 3  4.74375e+00 8.94394e-01 1.09527e+02 15.006  6.30860e+00  1.69110e+00  0.00000e+00 0.00000e+00 5.39125e+01 15.006  5.56140e+01 195.006 0.9199 
1 1 1 -9  74  5  o 6  1.29629e+01 5.73489e-01 1.87665e+02 129.134 -2.14490e+01 2.63611e+01  0.00000e+00 0.00000e+00 2.90342e+02 129.134 1.02678e+02 129.134 0.9852 
1 1 1 -9  74  6  o 8  9.38129e+00 6.32168e-01 1.62764e+02 301.641 1.15532e+01  -1.87495e+01 0.00000e+00 0.00000e+00 1.80070e+02 301.641 1.73069e+01 301.641 0.9770 
1 1 1 -9  74  7  o 2  4.42726e+00 8.07605e-01 1.00239e+02 70.825  2.17069e+00  6.24223e+00  0.00000e+00 0.00000e+00 5.21404e+01 70.825  4.80987e+01 250.825 0.9209 
1 1 1 -9  74  8  o 6  1.00583e+01 6.36615e-01 2.22876e+02 100.945 -7.51240e+00 3.88486e+01  0.00000e+00 0.00000e+00 1.47970e+02 100.945 7.49058e+01 280.945 0.9873 
1 1 1 -9  74  9  o 13 1.08788e+01 6.53505e-01 1.92768e+02 294.255 1.59726e+01  -3.54495e+01 0.00000e+00 0.00000e+00 2.07884e+02 294.255 1.51163e+01 294.255 0.9871 
1 1 1 -9  74  10 o 6  5.91716e+00 9.14161e-01 6.24983e+01 117.597 -2.91338e+00 5.57352e+00  0.00000e+00 0.00000e+00 1.39684e+02 117.597 7.71854e+01 117.597 0.9166 
1 1 1 -9  74  11 o 11 4.61887e+00 1.01372e+00 4.05626e+01 207.033 -2.80452e+00 -1.43099e+00 0.00000e+00 0.00000e+00 1.00547e+02 207.033 5.99844e+01 207.033 0.8204 
1 1 1 -9  74  12 o 4  5.04999e+00 1.09732e+00 1.18682e+02 114.722 -4.49064e+00 9.75347e+00  0.00000e+00 0.00000e+00 6.02014e+01 114.722 5.84805e+01 294.722 0.9522 
1 1 1 -9  74  13 o 14 5.58321e+00 1.10839e+00 1.12523e+02 73.364  3.67990e+00  1.23158e+01  0.00000e+00 0.00000e+00 8.66944e+01 73.364  2.58289e+01 253.364 0.9603 
1 1 1 -9  74  14 o 15 6.28131e+00 1.21486e+00 1.46786e+02 224.096 -1.34319e+01 -1.30146e+01 0.00000e+00 0.00000e+00 8.00147e+01 224.096 6.67715e+01 44.096  0.9729 
1 1 1 -9  74  15 o 13 3.39308e+00 1.08631e+00 6.06520e+01 162.101 -5.02646e+00 1.62343e+00  0.00000e+00 0.00000e+00 5.24846e+01 162.101 8.16742e+00 342.101 0.8995 
1 1 1 -9  75  1  o 10 4.11046e+00 9.29437e-01 8.52524e+01 211.783 -3.32025e+00 -2.05732e+00 0.00000e+00 0.00000e+00 4.72946e+01 211.783 3.79578e+01 31.783  0.8598 
1 1 1 -9  75  2  o 14 6.47008e+00 9.68615e-01 1.34583e+02 335.521 9.45399e+00  -4.30425e+00 0.00000e+00 0.00000e+00 9.59738e+01 335.521 3.86087e+01 155.521 0.9506 
1 1 1 -9  75  3  o 6  4.99343e+00 1.15049e+00 8.87523e+01 43.018  3.62944e+00  3.38660e+00  0.00000e+00 0.00000e+00 7.82358e+01 43.018  1.05165e+01 223.018 0.8925 
1 1 1 -9  75  4  o 18 8.33153e+00 6.84109e-01 1.67674e+02 138.923 -1.49816e+01 1.30587e+01  0.00000e+00 0.00000e+00 1.36356e+02 138.923 3.13182e+01 318.923 0.9745 
1 1 1 -9  75  5  o 10 1.10149e+01 6.31942e-01 1.67906e+02 300.083 1.39718e+01  -2.41194e+01 0.00000e+00 0.00000e+00 2.36834e+02 300.083 6.89275e+01 300.083 0.9819 
1 1 1 -9  75  6  o 4  6.99636e+00 7.11602e-01 7.95830e+01 4.538   8.86384e+00  7.03589e-01  0.00000e+00 0.00000e+00 1.66870e+02 4.538   8.72869e+01 4.538   0.9420 
1 1 1 -9  75  7  o 11 2.55370e+00 7.69890e-01 4.49893e+01 257.181 -3.88140e-01 -1.70578e+00 0.00000e+00 0.00000e+00 1.72301e+01 257.181 2.77592e+01 77.181  0.6520 
1 1 1 -9  75  8  o 18 5.07069e+00 8.42785e-01 5.10852e+01 110.277 -1.46873e+00 3.97544e+00  0.00000e+00 0.00000e+00 1.14023e+02 110.277 6.29377e+01 110.277 0.8721 
1 1 1 -9  75  9  o 4  7.68922e+00 7.77254e-01 9.65677e+01 317.395 9.80828e+00  -9.02074e+00 0.00000e+00 0.00000e+00 1.79290e+02 317.395 8.27223e+01 317.395 0.9617 
1 1 1 -9  75  10 o 19 9.45316e+00 7.11535e-01 1.22652e+02 356.568 2.15784e+01  -1.29409e+00 0.00000e+00 0.00000e+00 2.21409e+02 356.568 9.87570e+01 356.568 0.9766 
1 1 1 -9  75  11 o 8  5.65993e+00 1.02016e+00 1.13500e+02 126.627 -6.78220e+00 9.12310e+00  0.00000e+00 0.00000e+00 8.77343e+01 126.627 2.57656e+01 306.627 0.9549 
1 1 1 -9  75  12 o 8  3.75128e+00 1.02496e+00 9.42689e+01 139.358 -5.04712e+00 4.33234e+00  0.00000e+00 0.00000e+00 3.42853e+01 139.358 5.99836e+01 319.358 0.9214 
1 1 1 -9  75  13 o 1  7.48141e+00 1.08351e+00 1.46651e+02 216.113 -1.72063e+01 -1.25532e+01 0.00000e+00 0.00000e+00 1.24678e+02 216.113 2.19735e+01 36.113  0.9762 
1 1 1 -9  75  14 o 18 9.30905e+00 1.07130e+00 1.16468e+02 350.100 2.42151e+01  -4.22635e+00 0.00000e+00 0.00000e+00 2.21852e+02 350.100 1.05384e+02 350.100 0.9794 
1 1 1 -9  75  15 o 1  2.59208e+00 8.97963e-01 7.28127e+01 203.677 -5.52898e+00 -2.42439e+00 0.00000e+00 0.00000e+00 1.48851e+01 203.677 5.79276e+01 23.677  0.9129 
1 1 1 -9  76  1  o 11 6.74889e+00 8.17280e-01 8.13161e+01 109.811 -2.26490e+00 6.28723e+00  0.00000e+00 0.00000e+00 1.51956e+02 109.811 7.06395e+01 109.811 0.9218 
1 1 1 -9  76  2  o 10 6.40275e+00 9.78439e-01 1.41153e+02 309.989 7.04321e+00  -8.39694e+00 0.00000e+00 0.00000e+00 8.75930e+01 309.989 5.35599e+01 129.989 0.9532 
1 1 1 -9  76  3  o 4  8.89416e+00 9.60517e-01 2.00424e+02 7.061   2.17064e+01  2.68866e+00  0.00000e+00 0.00000e+00 1.25043e+02 7.061   7.53801e+01 187.061 0.9769 
1 1 1 -9  76  4  o 16 7.22595e+00 7.77772e-01 1.11556e+02 46.465  7.22559e+00  7.60498e+00  0.00000e+00 0.00000e+00 1.45735e+02 46.465  3.41787e+01 46.465  0.9511 
1 1 1 -9  76  5  o 2  1.57510e+01 6.11400e-01 2.98441e+02 248.376 -2.55938e+01 -6.45622e+01 0.00000e+00 0.00000e+00 2.86617e+02 248.376 1.18239e+01 68.376  0.9928 
1 1 1 -9  76  6  o 10 1.60260e+01 5.49549e-01 2.04124e+02 95.584  -5.30045e+00 5.42131e+01  0.00000e+00 0.00000e+00 3.89536e+02 95.584  1.85411e+02 95.584  0.9908 
1 1 1 -9  76  7  o 16 9.10283e+00 6.56262e-01 1.61663e+02 329.103 2.10095e+01  -1.25724e+01 0.00000e+00 0.00000e+00 1.71400e+02 329.103 9.73668e+00 329.103 0.9794 
1 1 1 -9  76  8  o 9  6.01255e+00 8.11342e-01 1.02092e+02 358.476 1.03614e+01  -2.75678e-01 0.00000e+00 0.00000e+00 1.11234e+02 358.476 9.14117e+00 358.476 0.9505 
1 1 1 -9  76  9  o 8  5.87038e+00 9.08713e-01 4.72645e+01 24.468  4.15528e+00  1.89091e+00  0.00000e+00 0.00000e+00 1.45892e+02 24.468  9.86276e+01 24.468  0.8822 
1 1 1 -9  76  10 o 18 3.31375e+00 9.31247e-01 3.89379e+01 247.238 -7.99458e-01 -1.90540e+00 0.00000e+00 0.00000e+00 4.85279e+01 247.238 9.59000e+00 247.238 0.7084 
1 1 1 -9  76  11 o 6  9.74966e+00 7.85724e-01 1.44105e+02 142.010 -2.31003e+01 1.80414e+01  0.00000e+00 0.00000e+00 2.12569e+02 142.010 6.84634e+01 142.010 0.9828 
1 1 1 -9  76  12 o 12 1.05716e+01 8.28623e-01 1.70171e+02 29.925  3.32152e+01  1.91189e+01  0.00000e+00 0.00000e+00 2.17762e+02 29.925  4.75910e+01 29.925  0.9869 
1 1 1 -9  76  13 o 7  6.55834e+00 1.06519e+00 1.00634e+02 246.435 -5.50184e+00 -1.26140e+01 0.00000e+00 0.00000e+00 1.33934e+02 246.435 3.32999e+01 246.435 0.9630 
1 1 1 -9  76  14 o 3  3.78086e+00 1.10505e+00 8.84882e+01 146.710 -6.56673e+00 4.31190e+00  0.00000e+00 0.00000e+00 4.25171e+01 146.710 4.59711e+01 326.710 0.9340 
1 1 1 -9  77  1  o 6  4.77776e+00 9.17150e-01 7.50851e+01 102.123 -9.42795e-01 4.38922e+00  0.00000e+00 0.00000e+00 8.25355e+01 102.123 7.45041e+00 102.123 0.8800 
1 1 1 -9  77  2  o 10 9.52848e+00 8.40013e-01 1.66013e+02 309.819 1.35584e+01  -1.62623e+01 0.00000e+00 0.00000e+00 1.82496e+02 309.819 1.64831e+01 309.819 0.9761 
1 1 1 -9  77  3  f 0  5.95824e+00 1.03737e+00 1.06553e+02 102.400 -1.59283e+00 7.24473e+00  0.00000e+00 0.00000e+00 1.00957e+02 102.400 5.59618e+00 282.400 0.9299 
1 1 1 -9  77  4  o 19 1.35627e+01 6.28378e-01 2.57983e+02 119.992 -2.63684e+01 4.56861e+01  0.00000e+00 0.00000e+00 2.44839e+02 119.992 1.31442e+01 299.992 0.9905 
1 1 1 -9  77  5  o 19 9.32247e+00 6.72115e-01 1.58762e+02 272.572 1.07873e+00  -2.40104e+01 0.00000e+00 0.00000e+00 1.82627e+02 272.572 2.38654e+01 272.572 0.9790 
1 1 1 -9  77  6  o 16 6.46050e+00 7.33291e-01 7.45941e+01 29.863  6.46232e+00  3.71050e+00  0.00000e+00 0.00000e+00 1.50060e+02 29.863  7.54659e+01 29.863  0.9303 
1 1 1 -9  77  7  o 18 4.44765e+00 9.18488e-01 5.11235e+01 244.826 -1.49132e+00 -3.17300e+00 0.00000e+00 0.00000e+00 8.86602e+01 244.826 3.75367e+01 244.826 0.8414 
1 1 1 -9  77  8  o 5  1.67676e+01 6.11675e-01 2.86000e+02 103.533 -2.06773e+01 8.59070e+01  0.00000e+00 0.00000e+00 3.36240e+02 103.533 5.02404e+01 103.533 0.9943 
1 1 1 -9  77  9  o 15 4.62749e+00 9.85054e-01 1.06047e+02 56.823  4.30815e+00  6.58933e+00  0.00000e+00 0.00000e+00 5.51414e+01 56.823  5.09060e+01 236.823 0.9341 
1 1 1 -9  77  10 o 2  4.74495e+00 9.44321e-01 1.01691e+02 251.109 -2.66750e+00 -7.79519e+00 0.00000e+00 0.00000e+00 6.39723e+01 251.109 3.77183e+01 71.109  0.9372 
1 1 1 -9  77  11 o 17 6.17775e+00 9.71416e-01 1.08541e+02 177.134 -1.29706e+01 6.49226e-01  0.00000e+00 0.00000e+00 1.12333e+02 177.134 3.79157e+00 177.134 0.9607 
1 1 1 -9  77  12 o 3  3.32242e+00 9.98156e-01 5.22023e+01 66.897  1.36074e+00  3.18976e+00  0.00000e+00 0.00000e+00 5.14777e+01 66.897  7.24617e-01 246.897 0.8394 
1 1 1 -9  77  13 o 14 3.91473e+00 1.08630e+00 9.27561e+01 157.600 -7.02447e+00 2.89526e+00  0.00000e+00 0.00000e+00 4.26803e+01 157.600 5.00758e+01 337.600 0.9317 
1 1 1 -9  77  14 o 2  3.52197e+00 1.07647e+00 4.07678e+01 299.998 1.78002e+00  -3.08331e+00 0.00000e+00 0.00000e+00 6.95099e+01 299.998 2.87422e+01 299.998 0.8442 
1 1 1 -9  78  1  o 7  4.33628e+00 8.16326e-01 8.31434e+01 112.387 -1.76414e+00 4.28289e+00  0.00000e+00 0.00000e+00 6.05432e+01 112.387 2.26002e+01 292.387 0.8841 
1 1 1 -9  78  2  o 19 4.12860e+00 8.26721e-01 5.71017e+01 168.216 -3.05342e+00 6.37019e-01  0.00000e+00 0.00000e+00 6.94852e+01 168.216 1.23835e+01 168.216 0.8184 
1 1 1 -9  78  3  o 10 1.32265e+01 7.53569e-01 2.78675e+02 12.026  5.18591e+01  1.10475e+01  0.00000e+00 0.00000e+00 2.11888e+02 12.026  6.67875e+01 192.026 0.9905 
1 1 1 -9  78  4  o 3  3.53973e+00 9.84421e-01 1.11698e+02 326.345 4.11204e+00  -2.73771e+00 0.00000e+00 0.00000e+00 6.45774e+00 326.345 1.05241e+02 146.345 0.8920 
1 1 1 -9  78  5  o 6  3.49414e+00 8.84682e-01 8.85694e+01 138.983 -3.38277e+00 2.94232e+00  0.00000e+00 0.00000e+00 2.64047e+01 138.983 6.21647e+01 318.983 0.8798 
1 1 1 -9  78  6  o 1  1.14420e+01 6.55275e-01 1.49730e+02 182.045 -2.85473e+01 -1.01936e+00 0.00000e+00 0.00000e+00 2.70335e+02 182.045 1.20605e+02 182.045 0.9823 
1 1 1 -9  78  7  o 18 7.01731e+00 7.41771e-01 1.25483e+02 30.591  1.30339e+01  7.70538e+00  0.00000e+00 0.00000e+00 1.27766e+02 30.591  2.28277e+00 30.591  0.9664 
1 1 1 -9  78  8  o 3  9.39798e+00 6.98787e-01 1.64204e+02 46.606  1.81114e+01  1.91561e+01  0.00000e+00 0.00000e+00 1.79751e+02 46.606  1.55463e+01 46.606  0.9808 
1 1 1 -9  78  9  o 2  6.94343e+00 8.59197e-01 1.68904e+02 232.580 -1.24924e+01 -1.63278e+01 0.00000e+00 0.00000e+00 8.35752e+01 232.580 8.53290e+01 52.580  0.9754 
1 1 1 -9  78  10 o 17 9.70892e+00 7.33215e-01 1.41855e+02 81.758  3.92138e+00  2.70715e+01  0.00000e+00 0.00000e+00 2.13085e+02 81.758  7.12302e+01 81.758  0.9815 
1 1 1 -9  78  11 o 10 3.96292e+00 9.63699e-01 2.91559e+01 84.436  2.06194e-01  2.11646e+00  0.00000e+00 0.00000e+00 7.66398e+01 84.436  4.74839e+01 84.436  0.7175 
1 1 1 -9  78  12 o 7  5.10897e+00 1.11507e+00 5.77728e+01 215.334 -4.64509e+00 -3.29304e+00 0.00000e+00 0.00000e+00 1.14521e+02 215.334 5.67486e+01 215.334 0.9073 
1 1 1 -9  78  13 o 11 2.97137e+00 8.90438e-01 2.76311e+01 247.033 -7.77552e-01 -1.83471e+00 0.00000e+00 0.00000e+00 4.92121e+01 247.033 2.15810e+01 247.033 0.6966 
1 1 1 -9  78  14 o 5  4.85350e+00 1.06166e+00 1.06378e+02 85.274  1.07739e+00  1.30322e+01  0.00000e+00 0.00000e+00 6.65779e+01 85.274  3.97996e+01 265.274 0.9610 
1 1 1 -9  79  1  o 13 4.02385e+00 8.29381e-01 5.01883e+01 345.685 2.72897e+00  -6.96359e-01 0.00000e+00 0.00000e+00 6.97509e+01 345.685 1.95626e+01 345.685 0.7954 
1 1 1 -9  79  2  f 0  5.45743e+00 7.95511e-01 7.25737e+01 224.249 -4.00900e+00 -3.90528e+00 0.00000e+00 0.00000e+00 1.12540e+02 224.249 3.99662e+01 224.249 0.9056 
1 1 1 -9  79  3  o 14 7.66877e+00 9.45827e-01 1.39487e+02 355.069 1.35609e+01  -1.16990e+00 0.00000e+00 0.00000e+00 1.36845e+02 355.069 2.64170e+00 175.069 0.9625 
1 1 1 -9  79  4  o 18 3.76125e+00 9.99313e-01 8.33566e+01 226.384 -2.94573e+00 -3.09156e+00 0.00000e+00 0.00000e+00 3.95198e+01 226.384 4.38369e+01 46.384  0.8732 
1 1 1 -9  79  5  o 7  8.77529e+00 6.83915e-01 1.73618e+02 153.768 -2.15714e+01 1.06292e+01  0.00000e+00 0.00000e+00 1.47600e+02 153.768 2.60184e+01 333.768 0.9790 
1 1 1 -9  79  6  o 13 5.50036e+00 8.91418e-01 1.47311e+02 287.472 3.80995e+00  -1.21045e+01 0.00000e+00 0.00000e+00 4.99358e+01 287.472 9.73751e+01 107.472 0.9598 
1 1 1 -9  79  7  o 9  4.62054e+00 9.37364e-01 1.22078e+02 84.372  8.72932e-01  8.85906e+00  0.00000e+00 0.00000e+00 4.04358e+01 84.372  8.16418e+01 264.372 0.9420 
1 1 1 -9  79  8  o 4  7.87461e+00 7.27844e-01 9.16130e+01 128.932 -8.74259e+00 1.08224e+01  0.00000e+00 0.00000e+00 1.91390e+02 128.932 9.97774e+01 128.932 0.9634 
1 1 1 -9  79  9  o 8  6.16669e+00 9.30730e-01 1.17596e+02 358.093 1.26536e+01  -4.21271e-01 0.00000e+00 0.00000e+00 1.02980e+02 358.093 1.46155e+01 178.093 0.9597 
1 1 1 -9  79  10 o 17 6.90134e+00 9.06269e-01 8.24833e+01 3.370   1.08429e+01  6.38579e-01  0.00000e+00 0.00000e+00 1.62373e+02 3.370   7.98899e+01 3.370   0.9528 
1 1 1 -9  79  11 o 4  9.64605e+00 8.12932e-01 1.51315e+02 214.021 -2.61959e+01 -1.76836e+01 0.00000e+00 0.00000e+00 2.01795e+02 214.021 5.04798e+01 214.021 0.9841 
1 1 1 -9  79  12 o 14 3.90987e+00 1.06966e+00 3.49542e+01 354.530 2.87510e+00  -2.75317e-01 0.00000e+00 0.00000e+00 8.14792e+01 354.530 4.65250e+01 354.530 0.8014 
1 1 1 -9  79  13 o 7  3.53693e+00 1.04488e+00 8.56082e+01 44.723  5.22786e+00  5.17762e+00  0.00000e+00 0.00000e+00 3.63991e+01 44.723  4.92090e+01 224.723 0.9293 
1 1 1 -9  79  14 o 7  3.24122e+00 1.04255e+00 5.93920e+01 95.035  -4.24916e-01 4.82268e+00  0.00000e+00 0.00000e+00 4.75048e+01 95.035  1.18872e+01 275.035 0.8896 
1 1 1 -9  80  1  o 10 4.64724e+00 8.76180e-01 9.70227e+01 281.332 1.16338e+00  -5.80519e+00 0.00000e+00 0.00000e+00 6.16059e+01 281.332 3.54169e+01 101.332 0.9111 
1 1 1 -9  80  2  o 19 4.52982e+00 8.69935e-01 4.15994e+01 152.772 -2.20316e+00 1.13361e+00  0.00000e+00 0.00000e+00 8.77513e+01 152.772 4.61519e+01 152.772 0.7625 
1 1 1 -9  80  3  o 11 5.77747e+00 1.04604e+00 1.08619e+02 337.783 7.72874e+00  -3.15675e+00 0.00000e+00 0.00000e+00 9.42227e+01 337.783 1.43962e+01 157.783 0.9380 
1 1 1 -9  80  4  o 3  6.24600e+00 1.01881e+00 1.10697e+02 262.406 -1.22938e+00 -9.22127e+00 0.00000e+00 0.00000e+00 1.10003e+02 262.406 6.93964e-01 82.406  0.9446 
1 1 1 -9  80  5  o 2  2.53617e+00 7.77542e-01 3.24498e+01 44.463  9.28685e-01  9.11440e-01  0.00000e+00 0.00000e+00 1.90330e+01 44.463  1.34168e+01 224.463 0.5430 
1 1 1 -9  80  6  o 9  4.64511e+00 9.75976e-01 9.49722e+01 27.887  5.42164e+00  2.86907e+00  0.00000e+00 0.00000e+00 6.36971e+01 27.887  3.12752e+01 207.887 0.9144 
1 1 1 -9  80  7  o 15 7.97744e+00 7.01293e-01 1.31762e+02 249.901 -6.55404e+00 -1.79109e+01 0.00000e+00 0.00000e+00 1.58105e+02 249.901 2.63427e+01 249.901 0.9734 
1 1 1 -9  80  8  o 6  5.78250e+00 8.29927e-01 1.13642e+02 317.375 8.47723e+00  -7.80192e+00 0.00000e+00 0.00000e+00 9.24464e+01 317.375 2.11956e+01 137.375 0.9556 
1 1 1 -9  80  9  o 2  1.97329e+01 6.60964e-01 3.08478e+02 132.188 -8.00256e+01 8.82918e+01  0.00000e+00 0.00000e+00 4.23767e+02 132.188 1.15289e+02 132.188 0.9958 
1 1 1 -9  80  10 f 0  1.06378e+01 7.74815e-01 1.52439e+02 331.965 3.00639e+01  -1.60085e+01 0.00000e+00 0.00000e+00 2.37742e+02 331.965 8.53028e+01 331.965 0.9852 
1 1 1 -9  80  11 o 13 4.55634e+00 1.08420e+00 4.00251e+01 277.259 4.07652e-01  -3.20044e+00 0.00000e+00 0.00000e+00 9.98493e+01 277.259 5.98242e+01 277.259 0.8254 
1 1 1 -9  80  12 o 4  3.43191e+00 1.00561e+00 4.14728e+01 94.141  -2.11839e-01 2.92623e+00  0.00000e+00 0.00000e+00 6.11644e+01 94.141  1.96916e+01 94.141  0.8050 
1 1 1 -9  80  13 o 4  5.02523e+00 1.23685e+00 9.47745e+01 159.843 -8.59051e+00 3.15335e+00  0.00000e+00 0.00000e+00 8.12091e+01 159.843 1.35654e+01 339.843 0.9437 
1 1 1 -9  80  14 o 14 4.25435e+00 1.22379e+00 1.13740e+02 221.049 -7.87845e+00 -6.86040e+00 0.00000e+00 0.00000e+00 3.62048e+01 221.049 7.75354e+01 41.049  0.9509 
1 1 1 -9  81  1  o 16 1.12244e+01 5.97114e-01 1.76229e+02 212.356 -2.72537e+01 -1.72666e+01 0.00000e+00 0.00000e+00 2.37622e+02 212.356 6.13932e+01 212.356 0.9844 
1 1 1 -9  81  2  o 6  6.96378e+00 6.71596e-01 1.09244e+02 83.241  1.41732e+00  1.19594e+01  0.00000e+00 0.00000e+00 1.40402e+02 83.241  3.11578e+01 83.241  0.9575 
1 1 1 -9  81  3  f 0  8.45396e+00 6.66555e-01 4.07810e+01 217.662 -4.32014e+00 -3.33447e+00 0.00000e+00 0.00000e+00 2.44881e+02 217.662 2.04100e+02 217.662 0.9030 
1 1 1 -9  81  4  o 1  7.11894e+00 9.88055e-01 1.51843e+02 168.052 -1.45216e+01 3.07297e+00  0.00000e+00 0.00000e+00 1.05261e+02 168.052 4.65813e+01 348.052 0.9657 
1 1 1 -9  81  5  o 3  9.04250e+00 9.73720e-01 1.52365e+02 64.419  8.91584e+00  1.86247e+01  0.00000e+00 0.00000e+00 1.77304e+02 64.419  2.49389e+01 64.419  0.9755 
1 1 1 -9  81  6  o 14 4.35857e+00 9.31342e-01 2.51870e+01 199.277 -1.52317e+00 -5.32717e-01 0.00000e+00 0.00000e+00 7.62271e+01 199.277 5.10402e+01 199.277 0.6230 
1 1 1 -9  81  7  o 11 6.36700e+00 8.75321e-01 9.33486e+01 204.750 -9.19027e+00 -4.23682e+00 0.00000e+00 0.00000e+00 1.32202e+02 204.750 3.88534e+01 204.750 0.9492 
1 1 1 -9  81  8  o 13 1.24026e+01 6.34848e-01 2.53564e+02 98.698  -9.36996e+00 6.12462e+01  0.00000e+00 0.00000e+00 2.05172e+02 98.698  4.83920e+01 278.698 0.9919 
1 1 1 -9  81  9  o 4  9.14929e+00 7.63457e-01 1.90019e+02 338.996 3.12339e+01  -1.19917e+01 0.00000e+00 0.00000e+00 1.45716e+02 338.996 4.43031e+01 158.996 0.9849 
1 1 1 -9  81  10 o 8  5.38981e+00 9.55655e-01 8.78413e+01 253.273 -2.66813e+00 -8.87809e+00 0.00000e+00 0.00000e+00 1.01623e+02 253.273 1.37816e+01 253.273 0.9444 
1 1 1 -9  81  11 o 3  3.10148e+00 9.40607e-01 7.01367e+01 118.794 -2.18452e+00 3.97454e+00  0.00000e+00 0.00000e+00 3.15057e+01 118.794 3.86310e+01 298.794 0.8814 
1 1 1 -9  81  12 o 11 4.10977e+00 1.09274e+00 7.26668e+01 108.087 -1.88849e+00 5.78241e+00  0.00000e+00 0.00000e+00 6.68023e+01 108.087 5.86449e+00 288.087 0.9136 
1 1 1 -9  81  13 o 1  4.13186e+00 1.12637e+00 2.88203e+01 199.731 -2.57966e+00 -9.25227e-01 0.00000e+00 0.00000e+00 9.21063e+01 199.731 6.32860e+01 199.731 0.7888 
1 1 1 -9  81  14 o 5  4.61766e+00 1.22979e+00 1.14250e+02 21.134  1.03751e+01  4.01058e+00  0.00000e+00 0.00000e+00 4.89896e+01 21.134  6.52601e+01 201.134 0.9539 
1 1 1 -9  82  1  f 0  9.72387e+00 6.29373e-01 2.15458e+02 81.676  4.90819e+00  3.35471e+01  0.00000e+00 0.00000e+00 1.43267e+02 81.676  7.21912e+01 261.676 0.9851 
1 1 1 -9  82  2  o 10 8.75061e+00 6.45328e-01 1.71280e+02 120.002 -1.19534e+01 2.07022e+01  0.00000e+00 0.00000e+00 1.49335e+02 120.002 2.19453e+01 300.002 0.9789 
1 1 1 -9  82  3  o 14 3.89344e+00 8.59785e-01 8.03956e+01 101.036 -8.76789e-01 4.49558e+00  0.00000e+00 0.00000e+00 4.81691e+01 101.036 3.22265e+01 281.036 0.8826 
1 1 1 -9  82  4  o 5  4.06327e+00 9.80886e-01 8.79581e+01 237.656 -2.56591e+00 -4.05193e+00 0.00000e+00 0.00000e+00 4.70160e+01 237.656 4.09421e+01 57.656  0.8884 
1 1 1 -9  82  5  o 11 9.41825e+00 8.94276e-01 1.22188e+02 266.485 -1.12471e+00 -1.83079e+01 0.00000e+00 0.00000e+00 2.20002e+02 266.485 9.78144e+01 266.485 0.9723 
1 1 1 -9  82  6  o 13 3.91064e+00 9.56398e-01 7.73091e+01 69.311  1.66057e+00  4.39706e+00  0.00000e+00 0.00000e+00 5.20570e+01 69.311  2.52521e+01 249.311 0.8859 
1 1 1 -9  82  7  o 3  1.07428e+01 7.26504e-01 2.05268e+02 230.453 -2.54261e+01 -3.07929e+01 0.00000e+00 0.00000e+00 1.90509e+02 230.453 1.47585e+01 50.453  0.9874 
1 1 1 -9  82  8  o 10 7.88775e+00 7.71954e-01 1.46924e+02 107.988 -6.85444e+00 2.11108e+01  0.00000e+00 0.00000e+00 1.40435e+02 107.988 6.48942e+00 287.988 0.9772 
1 1 1 -9  82  9  o 4  7.50870e+00 8.58238e-01 9.16570e+01 245.763 -5.31028e+00 -1.17956e+01 0.00000e+00 0.00000e+00 1.76989e+02 245.763 8.53316e+01 245.763 0.9605 
1 1 1 -9  82  10 o 1  5.97597e+00 9.73828e-01 4.89373e+01 100.106 -9.37893e-01 5.26197e+00  0.00000e+00 0.00000e+00 1.51387e+02 100.106 1.02450e+02 100.106 0.9008 
1 1 1 -9  82  11 o 1  4.78333e+00 1.02830e+00 8.36802e+01 174.672 -8.24560e+00 7.68950e-01  0.00000e+00 0.00000e+00 8.30324e+01 174.672 6.47773e-01 354.672 0.9375 
1 1 1 -9  82  12 o 10 4.22779e+00 1.13381e+00 1.44335e+02 317.196 8.73367e+00  -8.08864e+00 0.00000e+00 0.00000e+00 5.92088e+00 317.196 1.38414e+02 137.196 0.9570 
1 1 1 -9  82  13 o 11 3.29727e+00 1.02667e+00 4.98009e+01 142.451 -3.39265e+00 2.60787e+00  0.00000e+00 0.00000e+00 5.70312e+01 142.451 7.23033e+00 142.451 0.8735 
1 1 1 -9  82  14 o 2  4.47234e+00 1.16278e+00 1.17102e+02 359.487 1.29106e+01  -1.15512e-01 0.00000e+00 0.00000e+00 4.20459e+01 359.487 7.50564e+01 179.487 0.9605 
1 1 1 -9  83  1  o 19 7.75522e+00 7.01478e-01 2.11357e+02 97.689  -3.43634e+00 2.54526e+01  0.00000e+00 0.00000e+00 7.32819e+01 97.689  1.38075e+02 277.689 0.9803 
1 1 1 -9  83  2  o 4  6.82865e+00 7.39405e-01 1.30017e+02 135.518 -9.77270e+00 9.59766e+00  0.00000e+00 0.00000e+00 1.16013e+02 135.518 1.40039e+01 315.518 0.9628 
1 1 1 -9  83  3  o 18 7.69206e+00 6.74868e-01 1.75231e+02 279.798 3.79026e+00  -2.19470e+01 0.00000e+00 0.00000e+00 1.05939e+02 279.798 6.92919e+01 99.798  0.9773 
1 1 1 -9  83  4  o 1  5.57004e+00 1.10075e+00 6.65961e+01 299.098 2.35432e+00  -4.23024e+00 0.00000e+00 0.00000e+00 1.18625e+02 299.098 5.20289e+01 299.098 0.8896 
1 1 1 -9  83  5  o 15 3.99904e+00 1.02985e+00 4.85816e+01 277.317 3.70966e-01  -2.88890e+00 0.00000e+00 0.00000e+00 7.14281e+01 277.317 2.28464e+01 277.317 0.8033 
1 1 1 -9  83  6  o 18 8.37983e+00 8.02093e-01 1.58998e+02 157.829 -2.00938e+01 8.18824e+00  0.00000e+00 0.00000e+00 1.46537e+02 157.829 1.24612e+01 337.829 0.9767 
1 1 1 -9  83  7  o 6  6.32136e+00 9.42648e-01 1.49925e+02 157.953 -1.34973e+01 5.46608e+00  0.00000e+00 0.00000e+00 7.76341e+01 157.953 7.22912e+01 337.953 0.9650 
1 1 1 -9  83  8  o 14 1.03983e+01 7.28292e-01 1.48495e+02 347.821 2.85845e+01  -6.16940e+00 0.00000e+00 0.00000e+00 2.32389e+02 347.821 8.38946e+01 347.821 0.9828 
1 1 1 -9  83  9  o 16 1.52258e+01 6.63463e-01 2.53131e+02 284.177 2.06395e+01  -8.17054e+01 0.00000e+00 0.00000e+00 3.10495e+02 284.177 5.73637e+01 284.177 0.9940 
1 1 1 -9  83  10 o 15 3.91170e+00 9.99778e-01 6.66867e+01 38.564  3.88498e+00  3.09731e+00  0.00000e+00 0.00000e+00 6.32227e+01 38.564  3.46405e+00 218.564 0.8926 
1 1 1 -9  83  11 o 7  6.13140e+00 1.08357e+00 1.03782e+02 117.748 -6.19338e+00 1.17724e+01  0.00000e+00 0.00000e+00 1.15364e+02 117.748 1.15815e+01 117.748 0.9616 
1 1 1 -9  83  12 o 17 3.60188e+00 1.04676e+00 5.23711e+01 241.432 -1.97660e+00 -3.63018e+00 0.00000e+00 0.00000e+00 6.37674e+01 241.432 1.13962e+01 241.432 0.8685 
1 1 1 -9  83  13 o 11 4.86606e+00 1.20807e+00 6.20128e+01 14.862  6.39085e+00  1.69597e+00  0.00000e+00 0.00000e+00 1.04179e+02 14.862  4.21657e+01 14.862  0.9209 
1 1 1 -9  84  1  o 5  1.28449e+01 5.99663e-01 2.17484e+02 76.061  1.14673e+01  4.62028e+01  0.00000e+00 0.00000e+00 2.58231e+02 76.061  4.07467e+01 76.061  0.9894 
1 1 1 -9  84  2  o 13 5.24370e+00 9.08664e-01 9.40969e+01 249.342 -2.41803e+00 -6.41319e+00 0.00000e+00 0.00000e+00 8.71516e+01 249.342 6.94526e+00 69.342  0.9239 
1 1 1 -9  84  3  o 5  5.50782e+00 8.20488e-01 6.86726e+01 32.413  5.17929e+00  3.28855e+00  0.00000e+00 0.00000e+00 1.19660e+02 32.413  5.09871e+01 32.413  0.9144 
1 1 1 -9  84  4  o 4  4.97384e+00 8.73264e-01 6.18163e+01 159.467 -4.36533e+00 1.63498e+00  0.00000e+00 0.00000e+00 1.02672e+02 159.467 4.08559e+01 159.467 0.8849 
1 1 1 -9  84  5  o 18 7.14394e+00 1.00149e+00 1.10306e+02 211.513 -1.03983e+01 -6.37532e+00 0.00000e+00 0.00000e+00 1.45329e+02 211.513 3.50234e+01 211.513 0.9581 
1 1 1 -9  84  6  o 3  4.29819e+00 9.72309e-01 6.37164e+01 351.810 4.54810e+00  -6.54579e-01 0.00000e+00 0.00000e+00 7.79440e+01 351.810 1.42276e+01 351.810 0.8831 
1 1 1 -9  84  7  o 3  8.78059e+00 7.89349e-01 1.69987e+02 148.219 -2.27773e+01 1.41123e+01  0.00000e+00 0.00000e+00 1.51310e+02 148.219 1.86766e+01 328.219 0.9812 
1 1 1 -9  84  8  o 6  8.39552e+00 8.63848e-01 8.16027e+01 335.066 1.12966e+01  -5.25187e+00 0.00000e+00 0.00000e+00 2.18415e+02 335.066 1.36812e+02 335.066 0.9590 
1 1 1 -9  84  9  o 4  9.09487e+00 8.03479e-01 1.21677e+02 145.230 -1.97614e+01 1.37191e+01  0.00000e+00 0.00000e+00 2.09820e+02 145.230 8.81431e+01 145.230 0.9790 
1 1 1 -9  84  10 o 10 4.48914e+00 1.06280e+00 9.08951e+01 13.717  7.11589e+00  1.73686e+00  0.00000e+00 0.00000e+00 6.42254e+01 13.717  2.66697e+01 193.717 0.9290 
1 1 1 -9  84  11 o 9  3.35909e+00 1.00295e+00 4.39694e+01 163.300 -2.92450e+00 8.77387e-01  0.00000e+00 0.00000e+00 5.76143e+01 163.300 1.36449e+01 163.300 0.8138 
1 1 1 -9  84  12 o 15 5.33808e+00 1.17971e+00 1.11698e+02 169.311 -1.22721e+01 2.31636e+00  0.00000e+00 0.00000e+00 7.83393e+01 169.311 3.33591e+01 349.311 0.9591 
1 1 1 -9  84  13 o 3  3.88582e+00 1.08938e+00 7.59331e+01 322.567 5.63063e+00  -4.31007e+00 0.00000e+00 0.00000e+00 5.75574e+01 322.567 1.83757e+01 142.567 0.9265 
1 1 1 -9  85  1  o 2  2.52680e+00 7.75496e-01 7.26143e+01 277.259 3.84642e-01  -3.01977e+00 0.00000e+00 0.00000e+00 4.27975e+00 277.259 6.83346e+01 97.259  0.8132 
1 1 1 -9  85  2  o 16 7.91951e+00 7.80717e-01 1.56529e+02 75.196  4.84299e+00  1.83253e+01  0.00000e+00 0.00000e+00 1.31776e+02 75.196  2.47525e+01 255.196 0.9733 
1 1 1 -9  85  3  o 3  9.70763e+00 6.14022e-01 1.75057e+02 162.512 -2.95144e+01 9.29922e+00  0.00000e+00 0.00000e+00 1.81955e+02 162.512 6.89815e+00 162.512 0.9837 
1 1 1 -9  85  4  o 8  7.99072e+00 7.14049e-01 9.24834e+01 347.728 1.27451e+01  -2.77242e+00 0.00000e+00 0.00000e+00 1.94398e+02 347.728 1.01915e+02 347.728 0.9609 
1 1 1 -9  85  5  o 2  4.27207e+00 1.05761e+00 2.80794e+01 116.795 -8.28550e-01 1.64061e+00  0.00000e+00 0.00000e+00 7.86850e+01 116.795 5.06056e+01 116.795 0.6693 
1 1 1 -9  85  6  o 6  1.24338e+01 8.42447e-01 1.95181e+02 99.217  -6.76788e+00 4.17079e+01  0.00000e+00 0.00000e+00 2.63253e+02 99.217  6.80724e+01 99.217  0.9881 
1 1 1 -9  85  7  o 16 9.29432e+00 7.84099e-01 1.62994e+02 94.022  -1.84349e+00 2.62200e+01  0.00000e+00 0.00000e+00 1.76894e+02 94.022  1.39001e+01 94.022  0.9808 
1 1 1 -9  85  8  o 19 5.46270e+00 9.66291e-01 8.77690e+01 335.678 7.68222e+00  -3.47226e+00 0.00000e+00 0.00000e+00 1.03264e+02 335.678 1.54946e+01 335.678 0.9387 
1 1 1 -9  85  9  o 12 1.20322e+01 7.17055e-01 1.82518e+02 276.154 5.05737e+00  -4.69076e+01 0.00000e+00 0.00000e+00 2.60575e+02 276.154 7.80568e+01 276.154 0.9893 
1 1 1 -9  85  10 o 3  3.82768e+00 1.02655e+00 6.73934e+01 245.068 -2.12611e+00 -4.57367e+00 0.00000e+00 0.00000e+00 5.99142e+01 245.068 7.47913e+00 65.068  0.8944 
1 1 1 -9  85  11 o 9  8.37251e+00 9.47150e-01 1.26436e+02 97.367  -3.11680e+00 2.41065e+01  0.00000e+00 0.00000e+00 1.78135e+02 97.367  5.16985e+01 97.367  0.9792 
1 1 1 -9  85  12 o 4  3.13305e+00 9.80108e-01 5.25642e+01 326.589 3.38134e+00  -2.23054e+00 0.00000e+00 0.00000e+00 4.80600e+01 326.589 4.50422e+00 146.589 0.8654 
1 1 1 -9  85  13 o 7  2.63951e+00 8.87940e-01 7.16136e+01 344.332 5.48518e+00  -1.53849e+00 0.00000e+00 0.00000e+00 1.71666e+01 344.332 5.44470e+01 164.332 0.9074 
1 1 1 -9  86  1  o 17 1.04925e+01 6.36376e-01 2.02558e+02 41.953  2.85282e+01  2.56445e+01  0.00000e+00 0.00000e+00 1.84847e+02 41.953  1.77110e+01 221.953 0.9869 
1 1 1 -9  86  2  o 15 6.76262e+00 8.62707e-01 1.70649e+02 189.416 -1.73417e+01 -2.87577e+00 0.00000e+00 0.00000e+00 7.49448e+01 189.416 9.57040e+01 9.416   0.9711 
1 1 1 -9  86  3  o 11 1.00806e+01 6.20695e-01 1.78039e+02 221.140 -2.49539e+01 -2.17997e+01 0.00000e+00 0.00000e+00 1.93012e+02 221.140 1.49735e+01 221.140 0.9848 
1 1 1 -9  86  4  o 18 8.33572e+00 7.01932e-01 1.59650e+02 65.956  9.27079e+00  2.07795e+01  0.00000e+00 0.00000e+00 1.44812e+02 65.956  1.48387e+01 245.956 0.9778 
1 1 1 -9  86  5  o 19 6.27038e+00 8.94489e-01 1.49855e+02 191.725 -1.52651e+01 -3.16827e+00 0.00000e+00 0.00000e+00 7.65914e+01 191.725 7.32633e+01 11.725  0.9674 
1 1 1 -9  86  6  o 13 6.88307e+00 1.10540e+00 8.03663e+01 296.601 3.74998e+00  -7.48823e+00 0.00000e+00 0.00000e+00 1.60553e+02 296.601 8.01863e+01 296.601 0.9382 
1 1 1 -9  86  7  o 18 6.86423e+00 9.39547e-01 1.35077e+02 106.533 -4.52302e+00 1.52377e+01  0.00000e+00 0.00000e+00 1.12616e+02 106.533 2.24609e+01 286.532 0.9680 
1 1 1 -9  86  8  f 0  5.98742e+00 9.60911e-01 6.88054e+01 298.862 3.63300e+00  -6.59154e+00 0.00000e+00 0.00000e+00 1.38812e+02 298.862 7.00068e+01 298.862 0.9310 
1 1 1 -9  86  9  o 14 4.42624e+00 9.54195e-01 1.09756e+02 113.281 -3.78120e+00 8.78790e+00  0.00000e+00 0.00000e+00 4.60982e+01 113.281 6.36577e+01 293.281 0.9462 
1 1 1 -9  86  10 o 18 4.01356e+00 1.02486e+00 5.00511e+01 159.763 -3.90695e+00 1.44038e+00  0.00000e+00 0.00000e+00 7.97010e+01 159.763 2.96499e+01 159.763 0.8695 
1 1 1 -9  86  11 o 14 5.18906e+00 1.04870e+00 1.53942e+02 340.847 1.57888e+01  -5.48371e+00 0.00000e+00 0.00000e+00 3.29289e+01 340.847 1.21013e+02 160.847 0.9696 
1 1 1 -9  86  12 o 13 4.20800e+00 1.03384e+00 6.56103e+01 91.571  -1.86020e-01 6.78436e+00  0.00000e+00 0.00000e+00 7.85031e+01 91.571  1.28928e+01 91.571  0.9231 
1 1 1 -9  86  13 o 19 2.34673e+00 8.10880e-01 8.14380e+01 186.977 -6.00256e+00 -7.34533e-01 0.00000e+00 0.00000e+00 2.02726e+00 6.977   8.34652e+01 6.977   0.9131 
1 1 1 -9  87  1  o 13 1.46741e+01 5.99346e-01 2.30120e+02 175.639 -6.27637e+01 4.78657e+00  0.00000e+00 0.00000e+00 3.14374e+02 175.639 8.42535e+01 175.639 0.9920 
1 1 1 -9  87  2  o 9  2.68822e+00 8.08131e-01 4.34919e+01 207.365 -1.74874e+00 -9.05099e-01 0.00000e+00 0.00000e+00 2.61211e+01 207.365 1.73708e+01 27.365  0.6926 
1 1 1 -9  87  3  o 7  2.30199e+00 7.38765e-01 6.34362e+01 102.921 -5.49254e-01 2.39418e+00  0.00000e+00 0.00000e+00 1.95385e+00 102.921 6.14824e+01 282.921 0.7602 
1 1 1 -9  87  4  o 17 4.55032e+00 8.91808e-01 7.16509e+01 8.191   5.68755e+00  8.18660e-01  0.00000e+00 0.00000e+00 8.26911e+01 8.191   1.10402e+01 8.191   0.9082 
1 1 1 -9  87  5  o 18 3.36974e+00 8.77726e-01 6.61483e+01 349.300 3.48462e+00  -6.58402e-01 0.00000e+00 0.00000e+00 3.99348e+01 349.300 2.62135e+01 169.300 0.8435 
1 1 1 -9  87  6  o 2  4.37438e+00 1.14540e+00 8.55862e+01 43.757  4.12238e+00  3.94731e+00  0.00000e+00 0.00000e+00 6.24813e+01 43.757  2.31049e+01 223.757 0.9076 
1 1 1 -9  87  7  o 15 2.65735e+00 8.87037e-01 5.37254e+01 21.174  2.42254e+00  9.38389e-01  0.00000e+00 0.00000e+00 2.30504e+01 21.174  3.06751e+01 201.174 0.7752 
1 1 1 -9  87  8  o 15 3.58527e+00 1.00296e+00 7.83413e+01 65.261  2.22945e+00  4.83852e+00  0.00000e+00 0.00000e+00 4.18766e+01 65.261  3.64646e+01 245.261 0.9005 
1 1 1 -9  87  9  o 3  2.95155e+00 9.32074e-01 5.98564e+01 225.957 -2.41827e+00 -2.50044e+00 0.00000e+00 0.00000e+00 3.23828e+01 225.957 2.74736e+01 45.957  0.8400 
1 1 1 -9  87  10 f 0  4.27552e+00 1.04866e+00 6.43592e+01 204.649 -5.37841e+00 -2.46798e+00 0.00000e+00 0.00000e+00 8.04261e+01 204.649 1.60668e+01 204.649 0.9111 
1 1 1 -9  87  11 o 1  5.95698e+00 1.09710e+00 8.25904e+01 33.985  8.56497e+00  5.77396e+00  0.00000e+00 0.00000e+00 1.27610e+02 33.985  4.50200e+01 33.985  0.9503 
1 1 1 -9  87  12 o 10 3.45993e+00 1.03365e+00 5.67104e+01 176.559 -4.70960e+00 2.83217e-01  0.00000e+00 0.00000e+00 5.70500e+01 176.559 3.39618e-01 176.559 0.8864 
1 1 1 -9  87  13 o 18 2.94604e+00 9.54891e-01 5.07155e+01 204.439 -4.19538e+00 -1.90659e+00 0.00000e+00 0.00000e+00 4.57143e+01 204.439 5.00121e+00 24.439  0.8834 
1 1 1 -9  88  1  o 11 6.94708e+00 7.85277e-01 1.76900e+02 84.674  1.87773e+00  2.01433e+01  0.00000e+00 0.00000e+00 7.63834e+01 84.674  1.00517e+02 264.674 0.9750 
1 1 1 -9  88  2  o 8  5.68350e+00 8.09770e-01 6.28822e+01 145.005 -4.75394e+00 3.32816e+00  0.00000e+00 0.00000e+00 1.30265e+02 145.005 6.73827e+01 145.005 0.9092 
1 1 1 -9  88  3  o 8  6.61141e+00 7.87862e-01 1.83857e+02 173.800 -2.26042e+01 2.45550e+00  0.00000e+00 0.00000e+00 5.76441e+01 173.800 1.26213e+02 353.800 0.9778 
1 1 1 -9  88  4  o 11 9.00261e+00 7.25608e-01 1.54200e+02 282.963 5.77238e+00  -2.50770e+01 0.00000e+00 0.00000e+00 1.75337e+02 282.963 2.11363e+01 282.963 0.9804 
1 1 1 -9  88  5  o 7  2.68321e+00 8.10872e-01 9.72427e+00 30.241  4.00120e-01  2.33257e-01  0.00000e+00 0.00000e+00 1.28607e+01 30.241  3.13644e+00 30.241  0.2256 
1 1 1 -9  88  6  o 10 1.22331e+01 8.72502e-01 2.19028e+02 47.142  3.18833e+01  3.43611e+01  0.00000e+00 0.00000e+00 2.32223e+02 47.142  1.31944e+01 47.142  0.9893 
1 1 1 -9  88  7  o 3  6.85427e+00 1.16654e+00 7.46161e+01 185.691 -8.14913e+00 -8.12165e-01 0.00000e+00 0.00000e+00 1.64627e+02 185.691 9.00110e+01 185.691 0.9368 
1 1 1 -9  88  8  o 15 8.24285e+00 9.28032e-01 1.07032e+02 138.520 -1.24644e+01 1.10199e+01  0.00000e+00 0.00000e+00 1.90468e+02 138.520 8.34354e+01 138.520 0.9695 
1 1 1 -9  88  9  o 5  7.39945e+00 1.06494e+00 1.24645e+02 70.758  5.78005e+00  1.65585e+01  0.00000e+00 0.00000e+00 1.42618e+02 70.758  1.79733e+01 70.758  0.9711 
1 1 1 -9  88  10 o 8  9.38506e+00 1.14320e+00 1.26902e+02 332.548 1.95596e+01  -1.01610e+01 0.00000e+00 0.00000e+00 2.13849e+02 332.548 8.69469e+01 332.548 0.9770 
1 1 1 -9  88  11 o 17 3.73913e+00 1.01978e+00 6.55991e+01 237.941 -3.15908e+00 -5.04406e+00 0.00000e+00 0.00000e+00 6.09400e+01 237.941 4.65905e+00 57.941  0.9116 
1 1 1 -9  88  12 o 7  4.21579e+00 1.10562e+00 6.80936e+01 52.468  4.09960e+00  5.33661e+00  0.00000e+00 0.00000e+00 7.61097e+01 52.468  8.01610e+00 52.468  0.9224 
1 1 1 -9  89  1  f 0  4.91417e+00 8.66777e-01 8.68549e+01 294.339 3.14787e+00  -6.95898e+00 0.00000e+00 0.00000e+00 8.43796e+01 294.339 2.47538e+00 114.339 0.9320 
1 1 1 -9  89  2  o 13 3.44258e+00 8.93707e-01 7.78936e+01 183.064 -4.71108e+00 -2.52175e-01 0.00000e+00 0.00000e+00 3.61386e+01 183.064 4.17549e+01 3.064   0.8864 
1 1 1 -9  89  3  o 7  2.16367e+00 7.08505e-01 9.06732e+01 1.990   3.66687e+00  1.27412e-01  0.00000e+00 0.00000e+00 2.20251e+01 181.990 1.12698e+02 181.990 0.8495 
1 1 1 -9  89  4  o 13 1.11082e+01 7.04913e-01 1.82477e+02 29.910  3.34895e+01  1.92653e+01  0.00000e+00 0.00000e+00 2.26772e+02 29.910  4.42953e+01 29.910  0.9870 
1 1 1 -9  89  5  o 15 4.11914e+00 8.87926e-01 2.65740e+01 253.344 -5.15367e-01 -1.72262e+00 0.00000e+00 0.00000e+00 7.50990e+01 253.344 4.85250e+01 253.344 0.6617 
1 1 1 -9  89  6  o 10 4.67452e+00 9.68377e-01 7.49118e+01 289.059 1.95001e+00  -5.64431e+00 0.00000e+00 0.00000e+00 8.39980e+01 289.059 9.08624e+00 289.059 0.9119 
1 1 1 -9  89  7  o 4  7.71727e+00 1.11549e+00 1.53548e+02 117.662 -9.22796e+00 1.76052e+01  0.00000e+00 0.00000e+00 1.26594e+02 117.662 2.69542e+01 297.662 0.9745 
1 1 1 -9  89  8  o 16 6.95770e+00 9.44217e-01 1.23404e+02 7.817   1.68602e+01  2.31480e+00  0.00000e+00 0.00000e+00 1.27832e+02 7.817   4.42806e+00 7.817   0.9702 
1 1 1 -9  89  9  o 18 1.12555e+01 8.48095e-01 1.40994e+02 232.902 -2.27639e+01 -3.01014e+01 0.00000e+00 0.00000e+00 2.71978e+02 232.902 1.30984e+02 232.902 0.9867 
1 1 1 -9  89  10 o 14 6.57044e+00 9.95766e-01 9.80488e+01 60.663  7.13984e+00  1.27039e+01  0.00000e+00 0.00000e+00 1.37524e+02 60.663  3.94756e+01 60.663  0.9651 
1 1 1 -9  89  11 o 15 3.11470e+00 9.58913e-01 1.05338e+02 295.099 3.48843e+00  -7.44724e+00 0.00000e+00 0.00000e+00 2.98731e+00 295.099 1.02351e+02 115.099 0.9371 
1 1 1 -9  89  12 o 17 3.21258e+00 9.45150e-01 5.04238e+01 258.391 -9.68939e-01 -4.71665e+00 0.00000e+00 0.00000e+00 5.54511e+01 258.391 5.02726e+00 258.391 0.8889 
1 1 1 -9  90  1  o 15 9.36369e+00 6.72477e-01 1.32650e+02 340.520 2.22958e+01  -7.88649e+00 0.00000e+00 0.00000e+00 2.09856e+02 340.520 7.72060e+01 340.520 0.9786 
1 1 1 -9  90  2  o 19 7.21060e+00 7.95125e-01 1.20216e+02 125.301 -8.94910e+00 1.26388e+01  0.00000e+00 0.00000e+00 1.40324e+02 125.301 2.01087e+01 125.301 0.9672 
1 1 1 -9  90  3  o 17 6.60737e+00 8.12053e-01 7.78249e+01 333.088 8.26439e+00  -4.19484e+00 0.00000e+00 0.00000e+00 1.55182e+02 333.088 7.73576e+01 333.088 0.9444 
1 1 1 -9  90  4  o 17 4.47030e+00 9.69911e-01 1.10795e+02 218.185 -6.64014e+00 -5.22239e+00 0.00000e+00 0.00000e+00 4.58236e+01 218.185 6.49714e+01 38.185  0.9388 
1 1 1 -9  90  5  o 19 4.08101e+00 9.25217e-01 5.35067e+01 167.201 -3.68056e+00 8.36106e-01  0.00000e+00 0.00000e+00 7.65125e+01 167.201 2.30057e+01 167.201 0.8542 
1 1 1 -9  90  6  o 13 3.61561e+00 9.53313e-01 7.91900e+01 282.714 1.16689e+00  -5.17187e+00 0.00000e+00 0.00000e+00 4.20787e+01 282.714 3.71114e+01 102.714 0.8999 
1 1 1 -9  90  7  o 1  4.25430e+00 1.15544e+00 5.08961e+01 102.134 -7.41065e-01 3.44675e+00  0.00000e+00 0.00000e+00 8.25732e+01 102.134 3.16771e+01 102.134 0.8424 
1 1 1 -9  90  8  o 18 7.82632e+00 1.20345e+00 1.75278e+02 53.410  1.32726e+01  1.78782e+01  0.00000e+00 0.00000e+00 1.09327e+02 53.410  6.59504e+01 233.410 0.9773 
1 1 1 -9  90  9  o 19 3.68011e+00 1.00595e+00 1.78828e+01 136.471 -1.06414e+00 1.01085e+00  0.00000e+00 0.00000e+00 6.25733e+01 136.471 4.46906e+01 136.471 0.5881 
1 1 1 -9  90  10 o 19 2.62836e+00 8.60515e-01 4.02141e+01 322.459 2.08634e+00  -1.60325e+00 0.00000e+00 0.00000e+00 3.57910e+01 322.459 4.42311e+00 142.459 0.7785 
1 1 1 -9  90  11 o 1  3.19958e+00 9.42669e-01 5.86296e+01 262.645 -6.43039e-01 -4.98173e+00 0.00000e+00 0.00000e+00 4.74974e+01 262.645 1.11322e+01 82.645  0.8939 
1 1 1 -9  90  12 o 12 2.86057e+00 9.26697e-01 1.79925e+01 37.056  1.27377e+00  9.61792e-01  0.00000e+00 0.00000e+00 4.76403e+01 37.056  2.96479e+01 37.056  0.6190 
1 1 1 -9  91  1  o 11 5.12144e+00 9.02471e-01 5.20841e+01 123.886 -2.54811e+00 3.79398e+00  0.00000e+00 0.00000e+00 1.16779e+02 123.886 6.46947e+01 123.886 0.8824 
1 1 1 -9  91  2  o 6  5.73195e+00 8.37006e-01 6.16197e+01 165.039 -5.97635e+00 1.59699e+00  0.00000e+00 0.00000e+00 1.34308e+02 165.039 7.26887e+01 165.039 0.9152 
1 1 1 -9  91  3  o 14 6.05596e+00 8.40443e-01 7.97421e+01 131.954 -5.95160e+00 6.62065e+00  0.00000e+00 0.00000e+00 1.33232e+02 131.954 5.34902e+01 131.954 0.9420 
1 1 1 -9  91  4  o 1  4.14779e+00 8.99821e-01 1.02980e+02 274.824 6.19109e-01  -7.33596e+00 0.00000e+00 0.00000e+00 4.08431e+01 274.824 6.21370e+01 94.824  0.9294 
1 1 1 -9  91  5  o 1  8.65864e+00 7.34142e-01 1.30054e+02 232.725 -1.35419e+01 -1.77923e+01 0.00000e+00 0.00000e+00 1.85489e+02 232.725 5.54353e+01 232.725 0.9774 
1 1 1 -9  91  6  o 11 2.81649e+00 8.68897e-01 1.56570e+01 68.420  3.21303e-01  8.12338e-01  0.00000e+00 0.00000e+00 2.62998e+01 68.420  1.06427e+01 68.420  0.3998 
1 1 1 -9  91  7  f 0  1.05829e+01 9.92964e-01 1.55278e+02 51.355  1.98361e+01  2.48086e+01  0.00000e+00 0.00000e+00 2.32488e+02 51.355  7.72105e+01 51.355  0.9841 
1 1 1 -9  91  8  o 14 5.05358e+00 1.23005e+00 6.89630e+01 12.607  5.69937e+00  1.27473e+00  0.00000e+00 0.00000e+00 1.02079e+02 12.607  3.31163e+01 12.607  0.9098 
1 1 1 -9  91  9  o 1  3.47652e+00 1.03646e+00 4.85813e+01 290.406 1.18537e+00  -3.18632e+00 0.00000e+00 0.00000e+00 5.94035e+01 290.406 1.08222e+01 290.406 0.8357 
1 1 1 -9  91  10 o 19 2.97005e+00 9.32002e-01 2.25726e+01 320.007 1.38854e+00  -1.16482e+00 0.00000e+00 0.00000e+00 5.07067e+01 320.007 2.81341e+01 320.007 0.6644 
1 1 1 -9  91  11 o 10 5.05033e+00 9.88138e-01 6.22391e+01 203.532 -7.22320e+00 -3.14550e+00 0.00000e+00 0.00000e+00 1.12780e+02 203.532 5.05407e+01 203.532 0.9342 
1 1 1 -9  91  12 o 1  5.31372e+00 1.14571e+00 8.01079e+01 75.501  2.55550e+00  9.88229e+00  0.00000e+00 0.00000e+00 1.06891e+02 75.501  2.67834e+01 75.501  0.9497 
1 1 1 -9  92  1  o 6  5.74593e+00 9.00898e-01 6.60965e+01 232.969 -4.06971e+00 -5.39471e+00 0.00000e+00 0.00000e+00 1.31973e+02 232.969 6.58768e+01 232.969 0.9227 
1 1 1 -9  92  2  o 17 5.75181e+00 8.77047e-01 1.23279e+02 190.966 -1.15099e+01 -2.23026e+00 0.00000e+00 0.00000e+00 8.21270e+01 190.966 4.11520e+01 10.966  0.9564 
1 1 1 -9  92  3  o 19 3.54760e+00 9.17101e-01 4.65141e+01 256.629 -6.51250e-01 -2.73975e+00 0.00000e+00 0.00000e+00 5.88015e+01 256.629 1.22873e+01 256.629 0.7954 
1 1 1 -9  92  4  f 0  5.17533e+00 9.44993e-01 1.38269e+02 236.923 -6.76007e+00 -1.03792e+01 0.00000e+00 0.00000e+00 4.68092e+01 236.923 9.14600e+01 56.923  0.9587 
1 1 1 -9  92  5  o 18 5.51829e+00 9.09728e-01 1.43497e+02 42.940  1.10307e+01  1.02648e+01  0.00000e+00 0.00000e+00 5.52594e+01 42.940  8.82380e+01 222.940 0.9662 
1 1 1 -9  92  6  o 2  6.04724e+00 9.34538e-01 1.13228e+02 256.442 -3.03982e+00 -1.26059e+01 0.00000e+00 0.00000e+00 1.03169e+02 256.442 1.00591e+01 76.442  0.9606 
1 1 1 -9  92  7  o 1  5.48961e+00 1.11895e+00 9.72917e+01 57.606  5.02587e+00  7.92133e+00  0.00000e+00 0.00000e+00 9.58264e+01 57.606  1.46523e+00 237.606 0.9451 
1 1 1 -9  92  8  o 9  8.82827e+00 1.09320e+00 1.54401e+02 348.947 2.62648e+01  -5.13043e+00 0.00000e+00 0.00000e+00 1.67745e+02 348.947 1.33436e+01 348.947 0.9811 
1 1 1 -9  92  9  o 8  4.30338e+00 1.09470e+00 8.95506e+01 123.871 -4.36575e+00 6.50395e+00  0.00000e+00 0.00000e+00 5.97732e+01 123.871 2.97774e+01 303.871 0.9338 
1 1 1 -9  92  10 o 10 3.32645e+00 8.91237e-01 4.56192e+01 274.381 3.01941e-01  -3.94138e+00 0.00000e+00 0.00000e+00 6.07920e+01 274.381 1.51728e+01 274.381 0.8617 
1 1 1 -9  92  11 o 12 3.57095e+00 1.03852e+00 4.97265e+01 153.933 -3.98661e+00 1.95017e+00  0.00000e+00 0.00000e+00 6.66155e+01 153.933 1.68890e+01 153.933 0.8785 
1 1 1 -9  92  12 o 3  3.85129e+00 1.06316e+00 5.84480e+01 297.687 2.90521e+00  -5.53675e+00 0.00000e+00 0.00000e+00 7.22634e+01 297.687 1.38155e+01 297.687 0.9161 
1 1 1 -9  93  1  o 12 9.23673e+00 7.00027e-01 1.40206e+02 353.729 2.47381e+01  -2.71860e+00 0.00000e+00 0.00000e+00 1.97771e+02 353.729 5.75651e+01 353.729 0.9797 
1 1 1 -9  93  2  o 17 4.96238e+00 9.51304e-01 1.33606e+02 79.945  1.97051e+00  1.11128e+01  0.00000e+00 0.00000e+00 4.32413e+01 79.945  9.03643e+01 259.945 0.9546 
1 1 1 -9  93  3  o 5  4.65418e+00 9.08642e-01 9.45908e+01 6.832   7.73515e+00  9.26749e-01  0.00000e+00 0.00000e+00 6.75066e+01 6.832   2.70842e+01 186.832 0.9334 
1 1 1 -9  93  4  o 7  1.23962e+01 6.99139e-01 2.46046e+02 199.951 -5.89543e+01 -2.14006e+01 0.00000e+00 0.00000e+00 2.12522e+02 199.951 3.35231e+01 19.951  0.9920 
1 1 1 -9  93  5  o 10 2.98782e+00 8.88108e-01 6.48336e+01 325.355 3.11417e+00  -2.15192e+00 0.00000e+00 0.00000e+00 3.03390e+01 325.355 3.44946e+01 145.355 0.8547 
1 1 1 -9  93  6  o 4  7.34752e+00 8.35188e-01 1.10058e+02 140.067 -1.33767e+01 1.11977e+01  0.00000e+00 0.00000e+00 1.55611e+02 140.067 4.55532e+01 140.067 0.9709 
1 1 1 -9  93  7  o 5  9.10890e+00 7.80281e-01 1.69190e+02 25.137  3.06261e+01  1.43706e+01  0.00000e+00 0.00000e+00 1.64732e+02 25.137  4.45857e+00 205.137 0.9851 
1 1 1 -9  93  8  o 11 3.21068e+00 1.01409e+00 1.04380e+02 331.628 6.55552e+00  -3.54046e+00 0.00000e+00 0.00000e+00 6.67356e+00 331.628 9.77064e+01 151.628 0.9302 
1 1 1 -9  93  9  o 5  3.05377e+00 9.98836e-01 6.02984e+01 286.556 1.14162e+00  -3.84035e+00 0.00000e+00 0.00000e+00 3.76934e+01 286.556 2.26050e+01 106.556 0.8638 
1 1 1 -9  93  10 o 5  3.13054e+00 9.47010e-01 5.12480e+01 154.708 -3.96742e+00 1.87470e+00  0.00000e+00 0.00000e+00 5.06433e+01 154.708 6.04742e-01 334.708 0.8769 
1 1 1 -9  93  11 o 1  4.45205e+00 1.21678e+00 8.97532e+01 249.056 -3.10531e+00 -8.11330e+00 0.00000e+00 0.00000e+00 6.55041e+01 249.056 2.42491e+01 69.056  0.9406 
1 1 1 -9  93  12 o 16 3.63081e+00 1.08450e+00 1.06471e+02 36.595  8.30474e+00  6.16662e+00  0.00000e+00 0.00000e+00 2.13308e+01 36.595  8.51405e+01 216.595 0.9504 
1 1 1 -9  94  1  o 7  2.60979e+00 7.94876e-01 2.52040e+01 136.896 -9.07968e-01 8.49767e-01  0.00000e+00 0.00000e+00 2.60607e+01 136.896 8.56684e-01 136.896 0.5261 
1 1 1 -9  94  2  o 6  3.60104e+00 9.16764e-01 4.88141e+01 239.384 -1.59946e+00 -2.70283e+00 0.00000e+00 0.00000e+00 6.13754e+01 239.384 1.25612e+01 239.384 0.8199 
1 1 1 -9  94  3  o 5  2.45123e+00 7.65477e-01 5.93800e+01 264.931 -2.54984e-01 -2.87447e+00 0.00000e+00 0.00000e+00 1.38778e+01 264.931 4.55022e+01 84.931  0.8012 
1 1 1 -9  94  4  o 7  7.69902e+00 8.29005e-01 1.13888e+02 23.333  1.63630e+01  7.05811e+00  0.00000e+00 0.00000e+00 1.64970e+02 23.333  5.10816e+01 23.333  0.9715 
1 1 1 -9  94  5  o 6  4.63418e+00 9.51322e-01 7.42172e+01 94.283  -4.77494e-01 6.37593e+00  0.00000e+00 0.00000e+00 8.42968e+01 94.283  1.00795e+01 94.283  0.9181 
1 1 1 -9  94  6  o 3  8.51428e+00 8.29554e-01 1.41332e+02 235.781 -1.45743e+01 -2.14304e+01 0.00000e+00 0.00000e+00 1.69492e+02 235.781 2.81596e+01 235.781 0.9805 
1 1 1 -9  94  7  o 17 3.31155e+00 9.50001e-01 7.57626e+01 328.343 4.70061e+00  -2.89832e+00 0.00000e+00 0.00000e+00 3.56402e+01 328.343 4.01224e+01 148.343 0.9042 
1 1 1 -9  94  8  o 8  3.05763e+00 9.60734e-01 6.93131e+01 315.128 3.44701e+00  -3.43162e+00 0.00000e+00 0.00000e+00 3.18600e+01 315.128 3.74531e+01 135.128 0.8901 
1 1 1 -9  94  9  f 0  3.71438e+00 1.12104e+00 1.18822e+01 44.655  7.10439e-01  7.01928e-01  0.00000e+00 0.00000e+00 4.96355e+01 44.655  3.77533e+01 44.655  0.4459 
1 1 1 -9  94  10 o 17 4.58360e+00 1.15732e+00 5.56902e+01 247.421 -2.24315e+00 -5.39435e+00 0.00000e+00 0.00000e+00 9.90500e+01 247.421 4.33598e+01 247.421 0.9098 
1 1 1 -9  94  11 o 10 1.08169e+01 1.16169e+00 1.60629e+02 99.574  -6.50513e+00 3.85676e+01  0.00000e+00 0.00000e+00 2.35172e+02 99.574  7.45439e+01 99.574  0.9871 
1 1 1 -9  95  1  o 17 5.28577e+00 9.57761e-01 9.43876e+01 63.153  4.16138e+00  8.22120e+00  0.00000e+00 0.00000e+00 9.18920e+01 63.153  2.49559e+00 243.153 0.9441 
1 1 1 -9  95  2  o 11 3.35406e+00 8.89189e-01 7.70143e+01 199.193 -4.70414e+00 -1.63752e+00 0.00000e+00 0.00000e+00 3.47362e+01 199.193 4.22780e+01 19.193  0.8929 
1 1 1 -9  95  3  o 17 3.53377e+00 9.31629e-01 6.47860e+01 172.511 -4.31753e+00 5.67555e-01  0.00000e+00 0.00000e+00 5.06454e+01 172.511 1.41406e+01 352.511 0.8759 
1 1 1 -9  95  4  o 19 3.41912e+00 9.23539e-01 8.12627e+01 63.735  2.34562e+00  4.75332e+00  0.00000e+00 0.00000e+00 3.34198e+01 63.735  4.78429e+01 243.735 0.8999 
1 1 1 -9  95  5  o 16 8.91339e+00 7.60947e-01 1.78709e+02 205.291 -3.22903e+01 -1.52571e+01 0.00000e+00 0.00000e+00 1.48617e+02 205.291 3.00924e+01 25.291  0.9859 
1 1 1 -9  95  6  o 15 7.98869e+00 8.70433e-01 1.74889e+02 31.213  2.47269e+01  1.49827e+01  0.00000e+00 0.00000e+00 1.17279e+02 31.213  5.76095e+01 211.213 0.9826 
1 1 1 -9  95  7  o 14 3.79145e+00 9.90526e-01 1.02664e+02 326.454 7.33090e+00  -4.86068e+00 0.00000e+00 0.00000e+00 3.00785e+01 326.454 7.25855e+01 146.454 0.9413 
1 1 1 -9  95  8  o 10 3.67364e+00 1.02368e+00 6.08870e+01 247.456 -1.89326e+00 -4.56092e+00 0.00000e+00 0.00000e+00 6.08838e+01 247.456 3.13773e-03 67.456  0.8919 
1 1 1 -9  95  9  o 17 5.92204e+00 1.31822e+00 6.98861e+01 74.096  2.02878e+00  7.12030e+00  0.00000e+00 0.00000e+00 1.34562e+02 74.096  6.46762e+01 74.096  0.9298 
1 1 1 -9  95  10 o 10 3.14623e+00 9.77325e-01 8.42852e+01 69.250  2.49348e+00  6.58156e+00  0.00000e+00 0.00000e+00 2.37841e+01 69.250  6.05011e+01 249.250 0.9260 
1 1 1 -9  95  11 o 19 2.64794e+00 8.89569e-01 2.09225e+01 222.701 -1.34835e+00 -1.24428e+00 0.00000e+00 0.00000e+00 4.46940e+01 222.701 2.37715e+01 222.701 0.6687 
1 1 1 -9  96  1  o 12 2.73975e+00 8.26013e-01 4.60633e+01 330.625 2.23919e+00  -1.26044e+00 0.00000e+00 0.00000e+00 3.29079e+01 330.625 1.31554e+01 150.625 0.7724 
1 1 1 -9  96  2  o 8  2.45490e+00 7.81076e-01 2.51317e+01 139.270 -1.03233e+00 8.88869e-01  0.00000e+00 0.00000e+00 2.61681e+01 139.270 1.03644e+00 139.270 0.5602 
1 1 1 -9  96  3  o 4  4.34030e+00 9.34437e-01 7.24132e+01 242.180 -2.77799e+00 -5.26455e+00 0.00000e+00 0.00000e+00 7.51063e+01 242.180 2.69313e+00 242.180 0.9116 
1 1 1 -9  96  4  o 19 5.04780e+00 9.92589e-01 8.46958e+01 309.056 5.20887e+00  -6.41952e+00 0.00000e+00 0.00000e+00 9.16233e+01 309.056 6.92751e+00 309.056 0.9374 
1 1 1 -9  96  5  o 19 6.54382e+00 8.94761e-01 1.13836e+02 309.246 9.51350e+00  -1.16454e+01 0.00000e+00 0.00000e+00 1.21598e+02 309.246 7.76153e+00 309.246 0.9662 
1 1 1 -9  96  6  o 3  3.69509e+00 9.88689e-01 8.78274e+01 215.570 -5.63671e+00 -4.03101e+00 0.00000e+00 0.00000e+00 3.93270e+01 215.570 4.85003e+01 35.570  0.9247 
1 1 1 -9  96  7  o 10 6.76433e+00 8.97417e-01 1.51399e+02 180.789 -2.29216e+01 -3.15508e-01 0.00000e+00 0.00000e+00 9.45781e+01 180.789 5.68205e+01 0.789   0.9779 
1 1 1 -9  96  8  o 11 4.16190e+00 9.72630e-01 8.66891e+01 275.614 8.01504e-01  -8.15380e+00 0.00000e+00 0.00000e+00 5.81714e+01 275.614 2.85176e+01 95.614  0.9368 
1 1 1 -9  96  9  o 13 3.64762e+00 1.12945e+00 7.56071e+01 127.235 -3.82785e+00 5.03670e+00  0.00000e+00 0.00000e+00 4.85772e+01 127.235 2.70299e+01 307.235 0.9171 
1 1 1 -9  96  10 f 0  5.00862e+00 1.18313e+00 1.14013e+02 280.943 2.51975e+00  -1.30327e+01 0.00000e+00 0.00000e+00 6.45961e+01 280.943 4.94168e+01 100.943 0.9616 
1 1 1 -9  96  11 o 11 4.32706e+00 1.16163e+00 2.80088e+01 139.577 -2.37454e+00 2.02253e+00  0.00000e+00 0.00000e+00 1.03193e+02 139.577 7.51847e+01 139.577 0.8184 
1 1 1 -9  97  1  o 7  2.40731e+00 7.88330e-01 6.47538e+01 261.803 -4.61935e-01 -3.20678e+00 0.00000e+00 0.00000e+00 9.45867e+00 261.803 5.52951e+01 81.803  0.8263 
1 1 1 -9  97  2  o 10 5.27785e+00 9.58208e-01 4.07660e+01 345.177 3.84810e+00  -1.01839e+00 0.00000e+00 0.00000e+00 1.29050e+02 345.177 8.82844e+01 345.177 0.8628 
1 1 1 -9  97  3  f 0  7.18858e+00 8.56282e-01 7.43605e+01 40.325  8.66636e+00  7.35601e+00  0.00000e+00 0.00000e+00 1.81513e+02 40.325  1.07153e+02 40.325  0.9549 
1 1 1 -9  97  4  f 0  2.55003e+00 7.82772e-01 9.38311e+01 270.695 6.44187e-02  -5.31239e+00 0.00000e+00 0.00000e+00 8.32042e+00 90.695  1.02152e+02 90.695  0.9002 
1 1 1 -9  97  5  o 18 4.32936e+00 9.91287e-01 6.95093e+01 43.449  4.38617e+00  4.15485e+00  0.00000e+00 0.00000e+00 7.76443e+01 43.449  8.13501e+00 43.449  0.9130 
1 1 1 -9  97  6  o 2  4.77166e+00 1.00605e+00 9.27122e+01 102.516 -2.13821e+00 9.63207e+00  0.00000e+00 0.00000e+00 7.55537e+01 102.516 1.71585e+01 282.516 0.9479 
1 1 1 -9  97  7  o 2  5.77085e+00 1.03284e+00 9.70420e+01 251.013 -3.89674e+00 -1.13255e+01 0.00000e+00 0.00000e+00 1.08324e+02 251.013 1.12824e+01 251.013 0.9573 
1 1 1 -9  97  8  o 5  4.50741e+00 9.66591e-01 8.27907e+01 176.443 -9.49394e+00 5.90090e-01  0.00000e+00 0.00000e+00 7.55701e+01 176.443 7.22067e+00 356.443 0.9459 
1 1 1 -9  97  9  o 11 2.98079e+00 9.86062e-01 5.43733e+01 78.871  8.48045e-01  4.31096e+00  0.00000e+00 0.00000e+00 4.26536e+01 78.871  1.17197e+01 258.871 0.8771 
1 1 1 -9  97  10 o 1  3.61807e+00 1.11505e+00 6.24866e+01 237.489 -3.08627e+00 -4.84236e+00 0.00000e+00 0.00000e+00 5.93369e+01 237.489 3.14977e+00 57.489  0.9082 
1 1 1 -9  98  1  o 10 4.16066e+00 9.60457e-01 7.05868e+01 145.216 -4.77055e+00 3.31368e+00  0.00000e+00 0.00000e+00 7.05261e+01 145.216 6.07811e-02 325.216 0.9093 
1 1 1 -9  98  2  o 13 6.46138e+00 8.74913e-01 9.62173e+01 8.921   1.27714e+01  2.00471e+00  0.00000e+00 0.00000e+00 1.35169e+02 8.921   3.89518e+01 8.921   0.9605 
1 1 1 -9  98  3  f 0  4.85559e+00 8.84582e-01 4.01112e+01 209.620 -3.44579e+00 -1.95905e+00 0.00000e+00 0.00000e+00 1.15878e+02 209.620 7.57666e+01 209.620 0.8621 
1 1 1 -9  98  4  o 10 3.99889e+00 9.68117e-01 9.74498e+01 223.034 -5.82452e+00 -5.43794e+00 0.00000e+00 0.00000e+00 4.17931e+01 223.034 5.56567e+01 43.034  0.9350 
1 1 1 -9  98  5  f 0  4.24082e+00 9.91042e-01 9.48061e+01 181.834 -8.77184e+00 -2.80894e-01 0.00000e+00 0.00000e+00 5.37466e+01 181.834 4.10596e+01 1.834   0.9412 
1 1 1 -9  98  6  o 14 3.49816e+00 9.33919e-01 4.13344e+01 261.570 -4.61525e-01 -3.11405e+00 0.00000e+00 0.00000e+00 6.53994e+01 261.570 2.40650e+01 261.570 0.8204 
1 1 1 -9  98  7  o 2  4.68237e+00 1.05531e+00 1.19562e+02 175.467 -1.18484e+01 9.39311e-01  0.00000e+00 0.00000e+00 4.69656e+01 175.467 7.25965e+01 355.467 0.9570 
1 1 1 -9  98  8  o 9  4.39732e+00 1.04318e+00 8.99058e+01 86.121  6.21660e-01  9.16859e+00  0.00000e+00 0.00000e+00 6.42252e+01 86.121  2.56806e+01 266.121 0.9439 
1 1 1 -9  98  9  o 18 5.91793e+00 1.11794e+00 9.43910e+01 185.283 -1.28894e+01 -1.19185e+00 0.00000e+00 0.00000e+00 1.16511e+02 185.283 2.21204e+01 185.283 0.9606 
1 1 1 -9  98  10 o 18 4.22319e+00 1.21353e+00 1.00265e+02 0.473   9.47833e+00  7.81747e-02  0.00000e+00 0.00000e+00 4.77685e+01 0.473   5.24969e+01 180.473 0.9457 
1 1 1 -9  99  1  o 3  8.15963e+00 8.22520e-01 1.26932e+02 83.140  2.62225e+00  2.17977e+01  0.00000e+00 0.00000e+00 1.70327e+02 83.140  4.33956e+01 83.140  0.9770 
1 1 1 -9  99  2  o 2  4.59934e+00 9.73202e-01 4.68466e+01 104.508 -1.03209e+00 3.98854e+00  0.00000e+00 0.00000e+00 1.01952e+02 104.508 5.51054e+01 104.508 0.8680 
1 1 1 -9  99  3  f 0  8.27372e+00 8.95734e-01 9.96090e+01 246.313 -7.13527e+00 -1.62643e+01 0.00000e+00 0.00000e+00 1.99811e+02 246.313 1.00202e+02 246.313 0.9714 
1 1 1 -9  99  4  o 11 4.84601e+00 1.05556e+00 7.59258e+01 300.414 3.77075e+00  -6.42352e+00 0.00000e+00 0.00000e+00 9.19124e+01 300.414 1.59866e+01 300.414 0.9302 
1 1 1 -9  99  5  o 15 3.52711e+00 9.32998e-01 4.82496e+01 5.159   4.02901e+00  3.63768e-01  0.00000e+00 0.00000e+00 6.53041e+01 5.159   1.70545e+01 5.159   0.8652 
1 1 1 -9  99  6  o 12 7.91544e+00 8.73949e-01 1.31612e+02 0.474   2.60601e+01  2.15444e-01  0.00000e+00 0.00000e+00 1.57000e+02 0.474   2.53880e+01 0.474   0.9806 
1 1 1 -9  99  7  o 13 6.13489e+00 9.90078e-01 8.65626e+01 167.904 -1.32894e+01 2.84804e+00  0.00000e+00 0.00000e+00 1.32822e+02 167.904 4.62596e+01 167.904 0.9625 
1 1 1 -9  99  8  o 11 4.58343e+00 1.05768e+00 9.21639e+01 61.944  4.77355e+00  8.95649e+00  0.00000e+00 0.00000e+00 6.93770e+01 61.944  2.27869e+01 241.944 0.9494 
1 1 1 -9  99  9  o 4  3.51191e+00 1.03356e+00 4.94246e+01 219.500 -3.63106e+00 -2.99322e+00 0.00000e+00 0.00000e+00 6.59967e+01 219.500 1.65721e+01 219.500 0.8861 
1 1 1 -9  99  10 o 13 3.01183e+00 1.00142e+00 4.65014e+01 257.100 -9.64495e-01 -4.21116e+00 0.00000e+00 0.00000e+00 5.11317e+01 257.100 4.63031e+00 257.100 0.8748 
1 1 1 -9  100 1  o 8  3.38034e+00 9.29958e-01 7.60726e+01 332.657 4.80059e+00  -2.48234e+00 0.00000e+00 0.00000e+00 3.75942e+01 332.657 3.84785e+01 152.657 0.9020 
1 1 1 -9  100 2  o 15 4.19140e+00 8.78514e-01 8.08151e+01 227.321 -5.01068e+00 -5.43396e+00 0.00000e+00 0.00000e+00 6.43823e+01 227.321 1.64328e+01 47.321  0.9297 
1 1 1 -9  100 3  o 17 2.70507e+00 8.52015e-01 3.61344e+01 186.030 -2.30456e+00 -2.43437e-01 0.00000e+00 0.00000e+00 3.87791e+01 186.030 2.64464e+00 186.030 0.7436 
1 1 1 -9  100 4  f 0  2.81462e+00 8.69906e-01 3.46527e+01 261.870 -3.43873e-01 -2.40712e+00 0.00000e+00 0.00000e+00 4.46912e+01 261.870 1.00385e+01 261.870 0.7573 
1 1 1 -9  100 5  o 14 3.30372e+00 9.31003e-01 5.24674e+01 74.835  1.06550e+00  3.93105e+00  0.00000e+00 0.00000e+00 5.39910e+01 74.835  1.52364e+00 74.835  0.8663 
1 1 1 -9  100 6  o 3  3.63301e+00 9.67621e-01 1.00796e+02 186.459 -8.30256e+00 -9.39903e-01 0.00000e+00 0.00000e+00 2.58920e+01 186.459 7.49042e+01 6.459   0.9381 
1 1 1 -9  100 7  o 16 2.45484e+00 7.98950e-01 5.74513e+01 92.059  -1.42697e-01 3.96840e+00  0.00000e+00 0.00000e+00 2.11847e+01 92.059  3.62667e+01 272.059 0.8624 
1 1 1 -9  100 8  o 12 3.76200e+00 1.01836e+00 9.19973e+01 79.688  1.63932e+00  9.01006e+00  0.00000e+00 0.00000e+00 3.97655e+01 79.688  5.22317e+01 259.688 0.9437 
1 1 1 -9  100 9  o 9  3.62311e+00 1.00228e+00 7.88754e+01 305.077 4.69754e+00  -6.68960e+00 0.00000e+00 0.00000e+00 4.69647e+01 305.077 3.19107e+01 125.077 0.9367 
1 1 1 -9  101 1  o 3  1.14051e+01 7.18670e-01 1.48616e+02 274.559 3.63042e+00  -4.55241e+01 0.00000e+00 0.00000e+00 2.71768e+02 274.559 1.23152e+02 274.559 0.9890 
1 1 1 -9  101 2  f 0  1.34692e+01 6.99764e-01 2.18424e+02 61.999  3.76600e+01  7.08243e+01  0.00000e+00 0.00000e+00 2.80202e+02 61.999  6.17782e+01 61.999  0.9937 
1 1 1 -9  101 3  o 18 8.96962e+00 8.41993e-01 1.45522e+02 225.490 -2.34450e+01 -2.38494e+01 0.00000e+00 0.00000e+00 1.83416e+02 225.490 3.78941e+01 225.490 0.9849 
1 1 1 -9  101 4  o 10 5.29943e+00 1.04266e+00 1.35376e+02 354.254 1.53123e+01  -1.54082e+00 0.00000e+00 0.00000e+00 5.53070e+01 354.254 8.00689e+01 174.254 0.9669 
1 1 1 -9  101 5  o 6  4.46225e+00 9.98352e-01 6.63643e+01 158.551 -6.00966e+00 2.36111e+00  0.00000e+00 0.00000e+00 8.61237e+01 158.551 1.97594e+01 158.551 0.9189 
1 1 1 -9  101 6  f 0  2.52251e+00 8.03634e-01 2.87888e+01 134.521 -1.54886e+00 1.57500e+00  0.00000e+00 0.00000e+00 3.95748e+01 134.521 1.07860e+01 134.521 0.7293 
1 1 1 -9  101 7  o 15 2.35756e+00 7.90502e-01 3.76739e+01 208.902 -2.39784e+00 -1.32377e+00 0.00000e+00 0.00000e+00 3.13707e+01 208.902 6.30317e+00 28.902  0.7887 
1 1 1 -9  101 8  o 15 5.96490e+00 1.07993e+00 8.71059e+01 335.510 1.14653e+01  -5.22246e+00 0.00000e+00 0.00000e+00 1.25239e+02 335.510 3.81331e+01 335.510 0.9595 
1 1 1 -9  101 9  o 3  5.50052e+00 1.13258e+00 1.19243e+02 177.452 -1.66744e+01 7.42165e-01  0.00000e+00 0.00000e+00 7.84587e+01 177.452 4.07847e+01 357.451 0.9696 
1 1 1 -9  102 1  o 17 5.00130e+00 1.00099e+00 1.21360e+02 83.424  1.56188e+00  1.35485e+01  0.00000e+00 0.00000e+00 5.80160e+01 83.424  6.33444e+01 263.424 0.9626 
1 1 1 -9  102 2  o 15 4.44148e+00 1.02583e+00 2.68001e+01 271.699 7.17340e-02  -2.41812e+00 0.00000e+00 0.00000e+00 9.82355e+01 271.699 7.14353e+01 271.699 0.7559 
1 1 1 -9  102 3  o 13 7.72135e+00 9.49986e-01 1.49205e+02 269.811 -8.79937e-02 -2.66708e+01 0.00000e+00 0.00000e+00 1.32766e+02 269.811 1.64394e+01 89.811  0.9811 
1 1 1 -9  102 4  o 8  6.72619e+00 9.31904e-01 1.22257e+02 59.648  9.90198e+00  1.69099e+01  0.00000e+00 0.00000e+00 1.21497e+02 59.648  7.60205e-01 239.648 0.9741 
1 1 1 -9  102 5  o 18 9.00800e+00 7.87426e-01 1.25296e+02 204.727 -2.78564e+01 -1.28282e+01 0.00000e+00 0.00000e+00 2.04095e+02 204.727 7.87983e+01 204.727 0.9836 
1 1 1 -9  102 6  o 10 7.95950e+00 8.74590e-01 1.42415e+02 37.888  2.41742e+01  1.88107e+01  0.00000e+00 0.00000e+00 1.48427e+02 37.888  6.01136e+00 37.888  0.9835 
1 1 1 -9  102 7  o 7  2.12108e+00 7.20034e-01 1.21750e+01 15.126  7.94150e-01  2.14658e-01  0.00000e+00 0.00000e+00 1.77505e+01 15.126  5.57556e+00 15.126  0.3800 
1 1 1 -9  102 8  o 14 5.17938e+00 1.04386e+00 8.41865e+01 275.742 1.12452e+00  -1.11829e+01 0.00000e+00 0.00000e+00 9.91760e+01 275.742 1.49895e+01 275.742 0.9544 
1 1 1 -9  102 9  o 9  3.88932e+00 1.01765e+00 6.09232e+01 335.038 6.50096e+00  -3.02617e+00 0.00000e+00 0.00000e+00 7.27508e+01 335.038 1.18276e+01 335.038 0.9274 
1 1 1 -9  103 1  o 13 4.09841e+00 9.29427e-01 7.56744e+01 235.756 -4.10689e+00 -6.03317e+00 0.00000e+00 0.00000e+00 6.61042e+01 235.756 9.57018e+00 55.756  0.9287 
1 1 1 -9  103 2  o 9  3.68343e+00 9.96832e-01 5.21701e+01 237.436 -2.28049e+00 -3.57090e+00 0.00000e+00 0.00000e+00 6.74234e+01 237.436 1.52533e+01 237.436 0.8721 
1 1 1 -9  103 3  o 10 3.71555e+00 9.33397e-01 1.24962e+02 41.103  8.32292e+00  7.26126e+00  0.00000e+00 0.00000e+00 6.88716e+00 41.103  1.18075e+02 221.103 0.9536 
1 1 1 -9  103 4  o 13 4.35419e+00 1.03982e+00 1.06364e+02 163.009 -9.76985e+00 2.98520e+00  0.00000e+00 0.00000e+00 4.74305e+01 163.009 5.89335e+01 343.009 0.9497 
1 1 1 -9  103 5  o 10 7.20907e+00 9.73353e-01 1.23142e+02 340.622 2.11845e+01  -7.45102e+00 0.00000e+00 0.00000e+00 1.38764e+02 340.622 1.56220e+01 340.622 0.9775 
1 1 1 -9  103 6  o 3  3.99007e+00 9.81095e-01 6.63347e+01 136.494 -4.95785e+00 4.70579e+00  0.00000e+00 0.00000e+00 7.05469e+01 136.494 4.21227e+00 136.494 0.9236 
1 1 1 -9  103 7  o 5  2.83353e+00 8.84899e-01 7.33891e+01 246.421 -2.43864e+00 -5.58745e+00 0.00000e+00 0.00000e+00 2.27105e+01 246.421 5.06786e+01 66.421  0.9138 
1 1 1 -9  103 8  o 18 2.97588e+00 9.51804e-01 3.60857e+01 275.817 3.18843e-01  -3.12994e+00 0.00000e+00 0.00000e+00 5.44301e+01 275.817 1.83444e+01 275.817 0.8202 
1 1 1 -9  103 9  o 3  3.22136e+00 9.54404e-01 3.33267e+01 18.023  3.27628e+00  1.06598e+00  0.00000e+00 0.00000e+00 6.67132e+01 18.023  3.33864e+01 18.023  0.8382 
1 1 1 -9  104 1  o 11 3.17305e+00 9.02094e-01 4.56402e+00 102.918 -7.62548e-02 3.32454e-01  0.00000e+00 0.00000e+00 1.52996e+01 102.918 1.07356e+01 102.918 0.1681 
1 1 1 -9  104 2  o 6  4.81974e+00 1.00421e+00 9.81681e+01 14.695  9.91817e+00  2.60107e+00  0.00000e+00 0.00000e+00 7.22418e+01 14.695  2.59264e+01 194.695 0.9499 
1 1 1 -9  104 3  o 13 3.94684e+00 1.00683e+00 9.15563e+01 100.631 -1.51165e+00 8.05327e+00  0.00000e+00 0.00000e+00 4.59982e+01 100.631 4.55581e+01 280.631 0.9368 
1 1 1 -9  104 4  o 5  3.95242e+00 8.33783e-01 6.51107e+01 261.322 -1.11533e+00 -7.30780e+00 0.00000e+00 0.00000e+00 7.15070e+01 261.322 6.39633e+00 261.322 0.9297 
1 1 1 -9  104 5  o 7  2.69493e+00 8.54280e-01 5.73773e+01 0.612   4.62300e+00  4.93624e-02  0.00000e+00 0.00000e+00 3.11264e+01 0.612   2.62509e+01 180.612 0.8838 
1 1 1 -9  104 6  o 1  6.07429e+00 9.84070e-01 7.56234e+01 263.248 -1.47871e+00 -1.24906e+01 0.00000e+00 0.00000e+00 1.40760e+02 263.248 6.51362e+01 263.248 0.9594 
1 1 1 -9  104 7  o 5  2.78293e+00 8.96279e-01 2.57444e+00 76.627  4.95151e-02  2.08270e-01  0.00000e+00 0.00000e+00 8.41477e+00 76.627  5.84033e+00 76.627  0.1064 
1 1 1 -9  104 8  o 6  2.88459e+00 9.00356e-01 4.60032e+01 54.468  2.56521e+00  3.59206e+00  0.00000e+00 0.00000e+00 4.78613e+01 54.468  1.85805e+00 54.468  0.8777 
1 1 1 -9  105 1  o 6  5.48980e+00 9.99828e-01 1.21690e+02 21.862  1.41338e+01  5.67098e+00  0.00000e+00 0.00000e+00 7.58527e+01 21.862  4.58373e+01 201.862 0.9666 
1 1 1 -9  105 2  o 16 3.80770e+00 1.01933e+00 4.58950e+01 59.984  2.17679e+00  3.76794e+00  0.00000e+00 0.00000e+00 7.81935e+01 59.984  3.22985e+01 59.984  0.8758 
1 1 1 -9  105 3  o 17 6.85118e+00 9.00925e-01 1.31093e+02 270.024 1.02279e-02  -2.42776e+01 0.00000e+00 0.00000e+00 1.18406e+02 270.024 1.26871e+01 90.024  0.9792 
1 1 1 -9  105 4  o 14 6.05975e+00 9.90941e-01 1.12526e+02 85.511  1.40038e+00  1.78385e+01  0.00000e+00 0.00000e+00 1.06326e+02 85.511  6.20003e+00 265.511 0.9716 
1 1 1 -9  105 5  o 10 3.02820e+00 9.08375e-01 3.55046e+01 114.245 -1.29270e+00 2.87037e+00  0.00000e+00 0.00000e+00 5.67743e+01 114.245 2.12697e+01 114.245 0.8204 
1 1 1 -9  105 6  o 18 4.50319e+00 1.04125e+00 5.57324e+01 295.069 2.67657e+00  -5.72205e+00 0.00000e+00 0.00000e+00 9.75560e+01 295.069 4.18236e+01 295.069 0.9170 
1 1 1 -9  105 7  o 3  3.21051e+00 9.63398e-01 7.71232e+01 118.055 -3.17656e+00 5.96033e+00  0.00000e+00 0.00000e+00 3.27529e+01 118.055 4.43703e+01 298.055 0.9227 
1 1 1 -9  105 8  o 8  5.23939e+00 1.09667e+00 7.71361e+01 292.800 4.13608e+00  -9.83918e+00 0.00000e+00 0.00000e+00 1.07710e+02 292.800 3.05742e+01 292.800 0.9519 
1 1 1 -9  106 1  o 7  3.09290e+00 9.06455e-01 4.42659e+01 255.964 -8.54334e-01 -3.41747e+00 0.00000e+00 0.00000e+00 5.26864e+01 255.964 8.42052e+00 255.964 0.8423 
1 1 1 -9  106 2  o 10 4.80291e+00 8.34795e-01 8.54273e+01 6.222   1.11466e+01  1.21516e+00  0.00000e+00 0.00000e+00 8.50759e+01 6.222   3.51402e-01 186.222 0.9543 
1 1 1 -9  106 3  o 7  2.26940e+00 7.52728e-01 3.69697e+01 67.000  1.07825e+00  2.54022e+00  0.00000e+00 0.00000e+00 2.97318e+01 67.000  7.23788e+00 247.000 0.7905 
1 1 1 -9  106 4  o 6  3.40976e+00 9.59085e-01 5.48700e+01 171.116 -5.15051e+00 8.05065e-01  0.00000e+00 0.00000e+00 5.89223e+01 171.116 4.05236e+00 171.116 0.8981 
1 1 1 -9  106 5  o 16 5.08921e+00 1.08804e+00 1.11346e+02 335.145 1.22594e+01  -5.67906e+00 0.00000e+00 0.00000e+00 7.05094e+01 335.145 4.08365e+01 155.145 0.9623 
1 1 1 -9  106 6  o 14 2.33392e+00 7.70405e-01 3.03093e+01 205.107 -2.34678e+00 -1.09965e+00 0.00000e+00 0.00000e+00 3.67798e+01 205.107 6.47049e+00 205.107 0.7746 
1 1 1 -9  106 7  o 2  4.24165e+00 1.03913e+00 6.76920e+01 136.438 -5.93697e+00 5.64609e+00  0.00000e+00 0.00000e+00 7.96566e+01 136.438 1.19646e+01 136.438 0.9368 
1 1 1 -9  106 8  o 16 3.97442e+00 1.07912e+00 1.18573e+02 297.978 6.34742e+00  -1.19489e+01 0.00000e+00 0.00000e+00 2.31321e+01 297.978 9.54406e+01 117.978 0.9623 
1 1 1 -9  107 1  o 8  3.39767e+00 9.54164e-01 5.68902e+01 329.239 4.51170e+00  -2.68533e+00 0.00000e+00 0.00000e+00 5.67400e+01 329.239 1.50241e-01 149.239 0.8989 
1 1 1 -9  107 2  o 12 2.20355e+00 7.28231e-01 4.82972e+01 286.043 9.59037e-01  -3.33507e+00 0.00000e+00 0.00000e+00 2.05003e+01 286.043 2.77969e+01 106.043 0.8395 
1 1 1 -9  107 3  o 18 9.84133e+00 7.53022e-01 1.28728e+02 167.093 -4.20714e+01 9.64130e+00  0.00000e+00 0.00000e+00 2.32808e+02 167.093 1.04079e+02 167.093 0.9883 
1 1 1 -9  107 4  o 13 3.98356e+00 1.01600e+00 9.35421e+01 334.519 8.60226e+00  -4.09964e+00 0.00000e+00 0.00000e+00 4.64456e+01 334.519 4.70965e+01 154.519 0.9460 
1 1 1 -9  107 5  o 13 2.69403e+00 8.15289e-01 4.98528e+01 143.096 -3.65096e+00 2.74166e+00  0.00000e+00 0.00000e+00 3.83834e+01 143.096 1.14694e+01 323.095 0.8822 
1 1 1 -9  107 6  o 1  2.67561e+00 8.41129e-01 3.67138e+01 246.576 -1.28157e+00 -2.95808e+00 0.00000e+00 0.00000e+00 4.52023e+01 246.576 8.48854e+00 246.576 0.8253 
1 1 1 -9  107 7  o 13 2.51415e+00 8.18409e-01 5.02078e+01 286.769 1.34509e+00  -4.46395e+00 0.00000e+00 0.00000e+00 3.22664e+01 286.769 1.79415e+01 106.769 0.8849 
1 1 1 -9  107 8  o 1  2.94218e+00 9.20914e-01 1.22955e+01 68.560  4.42046e-01  1.12568e+00  0.00000e+00 0.00000e+00 4.39016e+01 68.560  3.16062e+01 68.560  0.5157 
1 1 1 -9  108 1  o 13 6.12867e+00 9.54004e-01 1.25928e+02 166.879 -1.94561e+01 4.53499e+00  0.00000e+00 0.00000e+00 9.62453e+01 166.879 2.96830e+01 346.879 0.9746 
1 1 1 -9  108 2  o 4  3.71261e+00 9.87190e-01 6.00585e+01 338.796 5.21317e+00  -2.02249e+00 0.00000e+00 0.00000e+00 6.49260e+01 338.796 4.86748e+00 338.796 0.9055 
1 1 1 -9  108 3  o 9  7.44001e+00 8.89096e-01 1.17046e+02 336.042 2.29774e+01  -1.02098e+01 0.00000e+00 0.00000e+00 1.53860e+02 336.042 3.68143e+01 336.042 0.9799 
1 1 1 -9  108 4  o 10 7.32484e+00 9.43169e-01 9.18596e+01 108.500 -6.35999e+00 1.90075e+01  0.00000e+00 0.00000e+00 1.73290e+02 108.500 8.14301e+01 108.500 0.9747 
1 1 1 -9  108 5  o 11 4.20157e+00 1.04708e+00 3.34189e+01 190.160 -3.47720e+00 -6.23142e-01 0.00000e+00 0.00000e+00 9.80013e+01 190.160 6.45825e+01 190.160 0.8428 
1 1 1 -9  108 6  o 2  2.68829e+00 8.32032e-01 3.80409e+01 81.026  5.98352e-01  3.78903e+00  0.00000e+00 0.00000e+00 4.73945e+01 81.026  9.35362e+00 81.026  0.8569 
1 1 1 -9  108 7  o 5  2.67569e+00 8.60655e-01 4.28275e+01 122.554 -2.28585e+00 3.58056e+00  0.00000e+00 0.00000e+00 4.36819e+01 122.554 8.54371e-01 122.554 0.8724 
1 1 1 -9  109 1  o 9  3.00394e+00 8.95497e-01 2.02558e+01 56.200  9.70683e-01  1.44997e+00  0.00000e+00 0.00000e+00 5.24714e+01 56.200  3.22156e+01 56.200  0.6511 
1 1 1 -9  109 2  o 14 4.30755e+00 1.00630e+00 2.03337e+01 134.524 -1.59945e+00 1.62627e+00  0.00000e+00 0.00000e+00 9.79665e+01 134.524 7.76328e+01 134.524 0.7389 
1 1 1 -9  109 3  o 4  2.47925e+00 7.91649e-01 5.66362e+01 335.567 4.45294e+00  -2.02302e+00 0.00000e+00 0.00000e+00 2.54041e+01 335.567 3.12322e+01 155.567 0.8908 
1 1 1 -9  109 4  o 7  6.74574e+00 9.23757e-01 8.66627e+01 141.790 -1.30448e+01 1.02688e+01  0.00000e+00 0.00000e+00 1.56117e+02 141.790 6.94545e+01 141.790 0.9694 
1 1 1 -9  109 5  o 19 2.70305e+00 8.38944e-01 3.26688e+01 217.858 -2.48530e+00 -1.93184e+00 0.00000e+00 0.00000e+00 4.96036e+01 217.858 1.69348e+01 217.858 0.8203 
1 1 1 -9  109 6  o 4  2.80006e+00 8.58650e-01 5.72819e+01 23.123  5.03966e+00  2.15200e+00  0.00000e+00 0.00000e+00 3.65100e+01 23.123  2.07719e+01 203.123 0.9034 
1 1 1 -9  109 7  o 15 3.05820e+00 9.35211e-01 4.55653e+01 22.059  4.24788e+00  1.72138e+00  0.00000e+00 0.00000e+00 5.44495e+01 22.059  8.88419e+00 22.059  0.8827 
1 1 1 -9  110 1  o 12 3.76464e+00 9.77613e-01 7.78262e+01 359.846 8.07309e+00  -2.16738e-02 0.00000e+00 0.00000e+00 5.31370e+01 359.846 2.46892e+01 179.846 0.9358 
1 1 1 -9  110 2  o 11 2.99221e+00 8.53243e-01 7.44503e+01 92.804  -3.65870e-01 7.46878e+00  0.00000e+00 0.00000e+00 2.90011e+01 92.804  4.54491e+01 272.804 0.9305 
1 1 1 -9  110 3  o 19 3.12418e+00 9.30619e-01 6.83309e+01 228.935 -3.95284e+00 -4.53689e+00 0.00000e+00 0.00000e+00 3.75530e+01 228.935 3.07778e+01 48.935  0.9126 
1 1 1 -9  110 4  o 17 2.38337e+00 7.75350e-01 4.63277e+01 292.792 1.60350e+00  -3.81604e+00 0.00000e+00 0.00000e+00 3.05139e+01 292.792 1.58138e+01 112.792 0.8687 
1 1 1 -9  110 5  o 18 3.10842e+00 9.17727e-01 8.66282e+01 45.699  6.21606e+00  6.36967e+00  0.00000e+00 0.00000e+00 2.19830e+01 45.699  6.46452e+01 225.699 0.9420 
1 1 1 -9  110 6  o 7  2.55645e+00 8.34985e-01 3.21907e+01 90.232  -1.28240e-02 3.17036e+00  0.00000e+00 0.00000e+00 4.56829e+01 90.232  1.34922e+01 90.232  0.8218 
1 1 1 -9  111 1  o 19 5.80686e+00 9.83200e-01 1.05810e+02 206.246 -1.56317e+01 -7.70737e+00 0.00000e+00 0.00000e+00 1.03695e+02 206.246 2.11577e+00 26.246  0.9709 
1 1 1 -9  111 2  o 16 2.17368e+00 7.21985e-01 2.56857e+01 335.864 1.88594e+00  -8.45041e-01 0.00000e+00 0.00000e+00 3.15116e+01 335.864 5.82596e+00 335.864 0.7084 
1 1 1 -9  111 3  o 14 2.51122e+00 7.77459e-01 3.36779e+01 13.323  3.13952e+00  7.43452e-01  0.00000e+00 0.00000e+00 4.32755e+01 13.323  9.59759e+00 13.323  0.8254 
1 1 1 -9  111 4  o 3  2.98542e+00 9.08576e-01 4.03635e+01 274.788 3.36025e-01  -4.01171e+00 0.00000e+00 0.00000e+00 5.53981e+01 274.788 1.50346e+01 274.788 0.8645 
1 1 1 -9  111 5  o 3  2.73831e+00 8.25118e-01 3.51748e+01 115.763 -1.61931e+00 3.35522e+00  0.00000e+00 0.00000e+00 5.13420e+01 115.763 1.61673e+01 115.763 0.8521 
1 1 1 -9  111 6  o 4  3.16609e+00 9.20000e-01 3.84073e+01 250.855 -1.33316e+00 -3.84029e+00 0.00000e+00 0.00000e+00 6.31867e+01 250.855 2.47794e+01 250.855 0.8660 
1 1 1 -9  112 1  o 18 3.02530e+00 9.09849e-01 5.11401e+01 340.032 4.78554e+00  -1.73873e+00 0.00000e+00 0.00000e+00 4.95006e+01 340.032 1.63951e+00 160.032 0.8955 
1 1 1 -9  112 2  o 6  2.15171e+00 6.96909e-01 2.29310e+01 57.199  1.17065e+00  1.81645e+00  0.00000e+00 0.00000e+00 3.47976e+01 57.199  1.18666e+01 57.199  0.7225 
1 1 1 -9  112 3  o 19 2.80380e+00 8.67107e-01 4.75436e+01 41.441  3.49557e+00  3.08619e+00  0.00000e+00 0.00000e+00 4.45425e+01 41.441  3.00113e+00 221.441 0.8849 
1 1 1 -9  112 4  o 18 4.31049e+00 1.03425e+00 7.78621e+01 177.223 -9.81853e+00 4.76211e-01  0.00000e+00 0.00000e+00 7.36597e+01 177.223 4.20246e+00 357.223 0.9477 
1 1 1 -9  112 5  o 18 2.36408e+00 7.78131e-01 2.86796e+01 294.343 1.16077e+00  -2.56573e+00 0.00000e+00 0.00000e+00 4.10253e+01 294.343 1.23457e+01 294.343 0.7954 
1 1 1 -9  113 1  o 18 4.13788e+00 9.55717e-01 6.39470e+01 191.058 -7.98538e+00 -1.56060e+00 0.00000e+00 0.00000e+00 7.99483e+01 191.058 1.60012e+01 191.058 0.9364 
1 1 1 -9  113 2  o 8  3.29561e+00 9.52399e-01 8.67220e+01 166.066 -8.92187e+00 2.21358e+00  0.00000e+00 0.00000e+00 2.87567e+01 166.066 5.79653e+01 346.066 0.9439 
1 1 1 -9  113 3  o 15 4.86294e+00 1.04209e+00 7.60523e+01 326.518 9.24164e+00  -6.11272e+00 0.00000e+00 0.00000e+00 9.60294e+01 326.518 1.99771e+01 326.518 0.9537 
1 1 1 -9  113 4  o 8  2.39283e+00 7.68989e-01 2.88832e+01 320.672 2.24588e+00  -1.84006e+00 0.00000e+00 0.00000e+00 4.23287e+01 320.672 1.34455e+01 320.672 0.8026 
1 1 1 -9  113 5  o 8  2.70918e+00 8.64265e-01 2.62645e+01 39.209  2.20623e+00  1.79996e+00  0.00000e+00 0.00000e+00 5.38541e+01 39.209  2.75896e+01 39.209  0.7980 
1 1 1 -9  114 1  o 1  2.87048e+00 8.60120e-01 4.10725e+01 132.507 -2.97902e+00 3.25026e+00  0.00000e+00 0.00000e+00 5.24541e+01 132.507 1.13816e+01 132.507 0.8776 
1 1 1 -9  114 2  o 7  2.76790e+00 8.47806e-01 2.28643e+01 224.790 -1.70295e+00 -1.69053e+00 0.00000e+00 0.00000e+00 5.45446e+01 224.790 3.16802e+01 224.790 0.7536 
1 1 1 -9  114 3  o 1  2.63792e+00 8.12913e-01 4.47904e+01 3.019   4.46220e+00  2.35361e-01  0.00000e+00 0.00000e+00 4.12519e+01 3.019   3.53856e+00 183.019 0.8794 
1 1 1 -9  114 4  o 14 3.03011e+00 9.20773e-01 4.05385e+01 221.487 -3.42651e+00 -3.03010e+00 0.00000e+00 0.00000e+00 5.85845e+01 221.487 1.80460e+01 221.487 0.8825 
1 1 1 -9  115 1  f 0  2.54008e+00 8.25606e-01 4.80288e+01 181.107 -4.54220e+00 -8.78008e-02 0.00000e+00 0.00000e+00 3.50828e+01 181.107 1.29459e+01 1.107   0.8816 
1 1 1 -9  115 2  o 6  3.01593e+00 9.14726e-01 2.68840e+01 264.418 -2.78483e-01 -2.84945e+00 0.00000e+00 0.00000e+00 6.25494e+01 264.418 3.56654e+01 264.418 0.7993 
1 1 1 -9  115 3  o 16 2.32777e+00 7.73740e-01 3.42931e+01 272.979 1.86467e-01  -3.58266e+00 0.00000e+00 0.00000e+00 3.86876e+01 272.979 4.39453e+00 272.979 0.8455 
1 1 1 -9  115 4  o 15 2.15541e+00 7.39685e-01 2.40796e+01 20.005  2.37435e+00  8.64450e-01  0.00000e+00 0.00000e+00 3.72549e+01 20.005  1.31753e+01 20.005  0.7679 
1 1 1 -9  116 1  o 1  2.23047e+00 7.43382e-01 1.07796e+01 207.155 -9.39451e-01 -4.81878e-01 0.00000e+00 0.00000e+00 2.77710e+01 207.155 1.69914e+01 207.155 0.4658 
1 1 1 -9  116 2  o 10 2.87800e+00 8.93393e-01 3.60983e+01 223.882 -2.97498e+00 -2.86109e+00 0.00000e+00 0.00000e+00 5.65748e+01 223.882 2.04765e+01 223.882 0.8683 
1 1 1 -9  116 3  o 10 3.26544e+00 9.44896e-01 4.69054e+01 79.552  9.91976e-01  5.37962e+00  0.00000e+00 0.00000e+00 6.24264e+01 79.552  1.55210e+01 79.552  0.9033 
1 1 1 -9  117 2  o 8  3.04615e+00 8.78466e-01 2.62624e+01 253.424 -1.00912e+00 -3.39024e+00 0.00000e+00 0.00000e+00 6.89446e+01 253.424 4.26822e+01 253.424 0.8430 
1 1 1 -8  0   1  o 19 1.36957e+01 7.31357e-01 3.57975e+02 0.000   3.24123e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.57409e+02 0.000   2.00566e+02 180.000 0.9969 
1 1 1 -8  0   2  o 7  2.69222e+01 8.90418e-01 5.21014e+02 0.000   9.16415e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.94783e+02 0.000   2.62308e+01 180.000 1.0000 
1 1 1 -8  0   3  o 6  9.91328e+00 8.71503e-01 1.52962e+02 180.000 -9.33999e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.20872e+02 180.000 3.20907e+01 0.000   0.7325 
1 1 1 -8  0   4  o 10 1.22243e+01 8.10094e-01 3.85983e+02 180.000 -3.02171e+00 -0.00000e+00 0.00000e+00 0.00000e+00 7.26038e+01 180.000 3.13379e+02 0.000   0.9953 
1 1 1 -8  0   5  o 1  3.08142e+01 9.99748e-01 3.59415e+02 180.000 -8.76766e+00 0.00000e+00  0.00000e+00 0.00000e+00 8.01363e+02 180.000 4.41948e+02 180.000 1.0000 
1 1 1 -8  0   6  o 9  2.43089e+01 9.12277e-01 6.45867e+02 180.000 -1.34210e+01 -0.00000e+00 0.00000e+00 0.00000e+00 2.69249e+02 180.000 3.76618e+02 0.000   1.0000 
1 1 1 -8  0   7  o 10 4.95717e+00 1.84815e+00 3.72010e+02 180.000 -1.89659e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.93746e+02 0.000   5.65756e+02 0.000   0.9559 
1 1 1 -8  0   8  o 16 1.79802e+01 8.83045e-01 5.25204e+02 180.000 -1.22863e+01 -0.00000e+00 0.00000e+00 0.00000e+00 1.50654e+02 180.000 3.74550e+02 0.000   1.0000 
1 1 1 -8  0   9  o 14 1.10107e+01 1.06380e+00 1.01310e+02 180.000 -1.70670e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.85858e+02 180.000 1.84547e+02 180.000 0.9362 
1 1 1 -8  0   10 o 7  1.05159e+01 1.09790e+00 2.94565e+02 0.000   6.47541e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.00027e+02 0.000   1.94538e+02 180.000 1.0000 
1 1 1 -8  0   11 o 13 3.96406e+00 1.74455e+00 1.07909e+01 0.000   1.12515e-01  0.00000e+00  0.00000e+00 0.00000e+00 5.85887e+00 0.000   4.93204e+00 180.000 0.1120 
1 1 1 -8  0   12 o 19 2.50739e+00 1.45602e+00 4.59210e+01 0.000   3.84712e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.14796e+01 180.000 5.74006e+01 180.000 0.3668 
1 1 1 -8  0   13 o 16 1.60913e+00 1.07825e+00 3.28424e+01 0.000   2.44232e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.84264e+01 180.000 5.12689e+01 180.000 0.2395 
1 1 1 -8  0   14 o 6  5.33722e+00 1.24554e+00 1.13495e+02 0.000   3.17555e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.52366e+01 0.000   2.82589e+01 180.000 0.9965 
1 1 1 -8  0   15 o 4  2.74626e+00 1.47271e+00 2.62243e+01 180.000 -4.19452e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.44101e+01 180.000 1.18142e+01 0.000   0.3965 
1 1 1 -8  0   16 o 8  2.67370e+00 1.54703e+00 5.90456e+01 180.000 -1.06051e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.92704e+01 180.000 3.97752e+01 0.000   0.7859 
1 1 1 -8  0   17 f 0  8.27153e+00 1.81934e+00 1.91911e+02 180.000 -1.03998e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.15982e+02 180.000 7.59284e+01 0.000   1.0000 
1 1 1 -8  0   18 o 6  8.70007e+00 2.10549e+00 2.43356e+02 0.000   1.34333e+01  0.00000e+00  0.00000e+00 0.00000e+00 8.00384e+01 0.000   1.63318e+02 180.000 1.0000 
1 1 1 -8  0   19 o 4  2.65247e+00 1.83042e+00 3.12007e+01 0.000   7.04436e-01  0.00000e+00  0.00000e+00 0.00000e+00 2.85776e+01 0.000   2.62312e+00 180.000 0.6072 
1 1 1 -8  1   1  o 11 2.08031e+01 5.59686e-01 6.17746e+02 52.576  1.03128e+01  1.34769e+01  0.00000e+00 0.00000e+00 1.43996e+02 52.576  4.73750e+02 232.576 0.9701 
1 1 1 -8  1   2  o 14 1.67961e+01 5.22340e-01 4.20895e+02 184.989 -9.22917e+00 -8.05741e-01 0.00000e+00 0.00000e+00 1.77587e+02 184.989 2.43308e+02 4.989   0.9444 
1 1 1 -8  1   3  o 14 1.06310e+01 5.68441e-01 2.32785e+02 299.122 1.48547e+00  -2.66642e+00 0.00000e+00 0.00000e+00 9.34778e+01 299.122 1.39307e+02 119.122 0.8138 
1 1 1 -8  1   4  o 3  3.24484e+01 8.33158e-01 4.21772e+02 49.771  1.12208e+01  1.32644e+01  0.00000e+00 0.00000e+00 7.65557e+02 49.771  3.43785e+02 49.771  0.9708 
1 1 1 -8  1   5  o 19 1.07870e+01 6.45470e-01 1.93155e+02 147.384 -2.78531e+00 1.78236e+00  0.00000e+00 0.00000e+00 1.44250e+02 147.384 4.89044e+01 327.384 0.8303 
1 1 1 -8  1   6  o 4  3.40635e+01 7.61798e-01 6.20688e+02 199.902 -3.38064e+01 -1.22392e+01 0.00000e+00 0.00000e+00 6.43685e+02 199.902 2.29971e+01 199.902 0.9860 
1 1 1 -8  1   7  o 13 2.93371e+01 7.01604e-01 4.86192e+02 261.116 -4.75419e+00 -3.04153e+01 0.00000e+00 0.00000e+00 5.99343e+02 261.116 1.13151e+02 261.116 0.9836 
1 1 1 -8  1   8  o 6  3.48852e+00 9.25468e-01 6.91268e+01 148.874 -5.25161e-01 3.17122e-01  0.00000e+00 0.00000e+00 3.06847e+01 328.874 9.98114e+01 328.874 0.2932 
1 1 1 -8  1   9  o 10 1.13785e+01 7.48597e-01 2.39846e+02 52.575  5.07638e+00  6.63359e+00  0.00000e+00 0.00000e+00 1.61037e+02 52.575  7.88096e+01 232.575 0.9381 
1 1 1 -8  1   10 o 14 4.77577e+00 9.81941e-01 1.32915e+02 193.779 -2.50632e+00 -6.14638e-01 0.00000e+00 0.00000e+00 5.69619e+00 193.779 1.27219e+02 13.779  0.7735 
1 1 1 -8  1   11 o 3  2.18113e+01 5.65080e-01 4.28469e+02 300.438 2.82559e+01  -4.80870e+01 0.00000e+00 0.00000e+00 3.81811e+02 300.438 4.66586e+01 120.438 0.9910 
1 1 1 -8  1   12 o 6  1.93836e+01 5.40561e-01 3.93642e+02 206.875 -5.03124e+01 -2.54978e+01 0.00000e+00 0.00000e+00 3.25787e+02 206.875 6.78555e+01 26.875  0.9911 
1 1 1 -8  1   13 o 7  2.07040e+01 5.35729e-01 3.94851e+02 286.406 2.24848e+01  -7.63669e+01 0.00000e+00 0.00000e+00 3.74768e+02 286.406 2.00822e+01 106.406 0.9937 
1 1 1 -8  1   14 o 12 9.72328e+00 5.64903e-01 1.74472e+02 98.714  -2.95945e+00 1.93075e+01  0.00000e+00 0.00000e+00 1.79414e+02 98.714  4.94193e+00 98.714  0.9741 
1 1 1 -8  1   15 o 19 1.03882e+01 6.08799e-01 1.84022e+02 279.910 4.53603e+00  -2.59629e+01 0.00000e+00 0.00000e+00 1.96237e+02 279.910 1.22152e+01 279.910 0.9808 
1 1 1 -8  1   16 f 0  6.17189e+00 8.88989e-01 1.57131e+02 314.120 1.00978e+01  -1.04128e+01 0.00000e+00 0.00000e+00 6.48356e+01 314.120 9.22949e+01 134.120 0.9649 
1 1 1 -8  1   17 o 19 8.25062e+00 1.14456e+00 1.52629e+02 27.063  1.60431e+01  8.19648e+00  0.00000e+00 0.00000e+00 1.45837e+02 27.063  6.79192e+00 207.063 0.9718 
1 1 1 -8  1   18 o 15 4.06912e+00 1.24261e+00 5.99615e+01 0.442   3.67953e+00  2.83869e-02  0.00000e+00 0.00000e+00 6.85997e+01 0.442   8.63825e+00 0.442   0.8500 
1 1 1 -8  1   19 o 9  4.71807e+00 1.41033e+00 7.61820e+01 258.531 -1.10693e+00 -5.45572e+00 0.00000e+00 0.00000e+00 8.23140e+01 258.531 6.13198e+00 258.531 0.9051 
1 1 1 -8  2   1  o 18 2.11181e+01 5.64067e-01 2.77630e+02 241.740 -3.66370e+00 -6.81567e+00 0.00000e+00 0.00000e+00 4.66050e+02 241.740 1.88421e+02 241.740 0.9329 
1 1 1 -8  2   2  o 12 1.99369e+01 5.51820e-01 2.31906e+02 282.823 1.34319e+00  -5.90090e+00 0.00000e+00 0.00000e+00 4.55000e+02 282.823 2.23093e+02 282.823 0.9132 
1 1 1 -8  2   3  o 9  2.35834e+01 5.96558e-01 5.14772e+02 267.920 -5.42731e-01 -1.49468e+01 0.00000e+00 0.00000e+00 3.44355e+02 267.920 1.70417e+02 87.920  0.9660 
1 1 1 -8  2   4  o 17 3.85847e+01 8.15006e-01 8.08248e+02 99.382  -6.45643e+00 3.90764e+01  0.00000e+00 0.00000e+00 6.27625e+02 99.382  1.80624e+02 279.382 0.9873 
1 1 1 -8  2   5  o 2  1.21105e+01 6.27644e-01 2.32285e+02 243.748 -1.97551e+00 -4.00557e+00 0.00000e+00 0.00000e+00 1.68869e+02 243.748 6.34157e+01 63.748  0.8793 
1 1 1 -8  2   6  o 14 3.13985e+01 7.17469e-01 7.78812e+02 105.845 -1.13749e+01 4.00773e+01  0.00000e+00 0.00000e+00 3.88916e+02 105.845 3.89897e+02 285.845 0.9879 
1 1 1 -8  2   7  o 2  3.45783e+01 7.68986e-01 5.79793e+02 38.632  3.36595e+01  2.69009e+01  0.00000e+00 0.00000e+00 7.05791e+02 38.632  1.25998e+02 38.632  0.9883 
1 1 1 -8  2   8  o 7  1.92247e+01 6.25127e-01 4.25860e+02 133.575 -1.46822e+01 1.54311e+01  0.00000e+00 0.00000e+00 2.79599e+02 133.575 1.46261e+02 313.575 0.9762 
1 1 1 -8  2   9  o 7  1.74134e+01 6.46627e-01 3.48867e+02 156.036 -1.71287e+01 7.61338e+00  0.00000e+00 0.00000e+00 2.87438e+02 156.036 6.14293e+01 336.036 0.9729 
1 1 1 -8  2   10 o 1  1.38578e+01 6.95118e-01 2.91314e+02 336.847 1.56623e+01  -6.69754e+00 0.00000e+00 0.00000e+00 2.13173e+02 336.847 7.81412e+01 156.847 0.9702 
1 1 1 -8  2   11 o 11 1.64270e+01 5.56381e-01 2.99722e+02 296.394 1.25847e+01  -2.53579e+01 0.00000e+00 0.00000e+00 3.05101e+02 296.394 5.37909e+00 296.394 0.9822 
1 1 1 -8  2   12 o 2  7.51362e+00 6.98759e-01 8.39223e+01 318.230 3.38419e+00  -3.02259e+00 0.00000e+00 0.00000e+00 1.64088e+02 318.230 8.01655e+01 318.230 0.8814 
1 1 1 -8  2   13 o 4  9.77780e+00 5.82368e-01 1.80289e+02 160.776 -1.60550e+01 5.59852e+00  0.00000e+00 0.00000e+00 1.74555e+02 160.776 5.73431e+00 340.776 0.9701 
1 1 1 -8  2   14 o 18 1.09093e+01 5.51842e-01 2.14468e+02 161.741 -2.56609e+01 8.46625e+00  0.00000e+00 0.00000e+00 1.85542e+02 161.741 2.89257e+01 341.741 0.9813 
1 1 1 -8  2   15 o 19 7.90184e+00 6.70878e-01 1.63500e+02 351.815 1.72763e+01  -2.48491e+00 0.00000e+00 0.00000e+00 1.22820e+02 351.815 4.06792e+01 171.815 0.9709 
1 1 1 -8  2   16 o 11 9.55124e+00 6.70489e-01 1.66005e+02 89.751  1.13650e-01  2.62013e+01  0.00000e+00 0.00000e+00 1.83134e+02 89.751  1.71295e+01 89.751  0.9807 
1 1 1 -8  2   17 o 19 3.86372e+00 1.10379e+00 1.41004e+01 180.175 -7.98854e-01 -2.43398e-03 0.00000e+00 0.00000e+00 3.92020e+01 180.175 2.51016e+01 180.175 0.3706 
1 1 1 -8  2   18 o 7  5.26694e+00 1.36193e+00 9.04525e+01 219.081 -5.13006e+00 -4.16626e+00 0.00000e+00 0.00000e+00 8.98372e+01 219.081 6.15377e-01 39.081  0.9209 
1 1 1 -8  2   19 o 8  4.01096e+00 1.29485e+00 6.85497e+01 301.571 2.44931e+00  -3.98588e+00 0.00000e+00 0.00000e+00 6.32570e+01 301.571 5.29272e+00 121.571 0.8853 
1 1 1 -8  3   1  o 13 3.44301e+01 7.44246e-01 6.17242e+02 62.316  1.29456e+01  2.46745e+01  0.00000e+00 0.00000e+00 6.58821e+02 62.316  4.15797e+01 62.316  0.9819 
1 1 1 -8  3   2  o 14 3.38403e+01 7.36372e-01 6.89314e+02 277.029 3.71206e+00  -3.01068e+01 0.00000e+00 0.00000e+00 5.66267e+02 277.029 1.23048e+02 97.029  0.9834 
1 1 1 -8  3   3  o 19 4.18632e+01 8.70273e-01 7.33480e+02 93.632  -2.37303e+00 3.73838e+01  0.00000e+00 0.00000e+00 8.24066e+02 93.632  9.05858e+01 93.632  0.9866 
1 1 1 -8  3   4  o 12 1.37392e+01 5.57307e-01 2.63769e+02 140.192 -3.56393e+00 2.97021e+00  0.00000e+00 0.00000e+00 1.94171e+02 140.192 6.95977e+01 320.192 0.8843 
1 1 1 -8  3   5  o 17 2.24967e+01 7.17325e-01 6.87943e+02 166.293 -2.37733e+01 5.79849e+00  0.00000e+00 0.00000e+00 1.42003e+02 166.293 5.45940e+02 346.293 0.9793 
1 1 1 -8  3   6  o 3  5.05735e+01 1.03044e+00 9.75900e+02 72.234  2.52039e+01  7.86595e+01  0.00000e+00 0.00000e+00 9.16374e+02 72.234  5.95253e+01 252.234 0.9939 
1 1 1 -8  3   7  o 14 3.80809e+01 8.24197e-01 6.82817e+02 310.375 3.60624e+01  -4.24113e+01 0.00000e+00 0.00000e+00 7.36780e+02 310.375 5.39631e+01 310.375 0.9910 
1 1 1 -8  3   8  o 5  2.93559e+01 7.06938e-01 5.73339e+02 282.188 9.19385e+00  -4.25673e+01 0.00000e+00 0.00000e+00 5.17359e+02 282.188 5.59799e+01 102.188 0.9885 
1 1 1 -8  3   9  o 18 9.41294e+00 8.63435e-01 3.01627e+02 323.275 6.88919e+00  -5.13970e+00 0.00000e+00 0.00000e+00 3.06433e+01 323.275 2.70984e+02 143.275 0.9399 
1 1 1 -8  3   10 o 19 3.20415e+01 6.98583e-01 5.87078e+02 134.357 -5.54564e+01 5.67156e+01  0.00000e+00 0.00000e+00 6.07610e+02 134.357 2.05314e+01 134.357 0.9937 
1 1 1 -8  3   11 o 4  1.45234e+01 5.82752e-01 2.60986e+02 191.494 -2.12820e+01 -4.32751e+00 0.00000e+00 0.00000e+00 2.70763e+02 191.494 9.77745e+00 191.494 0.9767 
1 1 1 -8  3   12 o 6  1.59152e+01 5.26651e-01 2.44630e+02 93.944  -1.98285e+00 2.87605e+01  0.00000e+00 0.00000e+00 3.40938e+02 93.944  9.63078e+01 93.944  0.9825 
1 1 1 -8  3   13 o 1  1.29828e+01 5.25411e-01 3.04552e+02 135.026 -2.72849e+01 2.72600e+01  0.00000e+00 0.00000e+00 1.74765e+02 135.026 1.29787e+02 315.026 0.9869 
1 1 1 -8  3   14 o 4  4.92813e+00 8.25320e-01 1.15623e+02 1.542   6.08313e+00  1.63779e-01  0.00000e+00 0.00000e+00 5.26176e+01 1.542   6.30058e+01 181.542 0.9137 
1 1 1 -8  3   15 o 16 4.44021e+00 8.83160e-01 1.05717e+02 103.478 -1.36440e+00 5.69275e+00  0.00000e+00 0.00000e+00 4.50808e+01 103.478 6.06366e+01 283.478 0.9100 
1 1 1 -8  3   16 o 1  5.99415e+00 9.19944e-01 1.13279e+02 77.499  2.16419e+00  9.76095e+00  0.00000e+00 0.00000e+00 9.86512e+01 77.499  1.46274e+01 257.499 0.9486 
1 1 1 -8  3   17 o 17 5.23215e+00 1.23155e+00 7.36532e+01 209.050 -4.56749e+00 -2.53704e+00 0.00000e+00 0.00000e+00 1.01305e+02 209.050 2.76514e+01 209.050 0.8983 
1 1 1 -8  3   18 o 9  7.43375e+00 1.46497e+00 6.07520e+01 222.047 -4.32688e+00 -3.90235e+00 0.00000e+00 0.00000e+00 1.90583e+02 222.047 1.29831e+02 222.047 0.9096 
1 1 1 -8  3   19 o 10 5.22329e+00 1.46166e+00 1.01010e+02 214.673 -6.44643e+00 -4.45929e+00 0.00000e+00 0.00000e+00 8.00370e+01 214.673 2.09732e+01 34.673  0.9338 
1 1 1 -8  4   1  o 3  3.62285e+01 7.73465e-01 7.55057e+02 307.610 2.18430e+01  -2.83533e+01 0.00000e+00 0.00000e+00 5.93169e+02 307.610 1.61888e+02 127.610 0.9859 
1 1 1 -8  4   2  o 13 3.42554e+01 7.41683e-01 8.12544e+02 83.907  3.51727e+00  3.29473e+01  0.00000e+00 0.00000e+00 4.60258e+02 83.907  3.52287e+02 263.906 0.9848 
1 1 1 -8  4   3  o 17 1.87624e+01 5.52934e-01 3.24836e+02 218.494 -5.87563e+00 -4.67277e+00 0.00000e+00 0.00000e+00 3.33765e+02 218.494 8.92939e+00 218.494 0.9308 
1 1 1 -8  4   4  f 0  2.90357e+01 6.70612e-01 6.50532e+02 325.817 1.99227e+01  -1.35306e+01 0.00000e+00 0.00000e+00 4.20910e+02 325.817 2.29622e+02 145.817 0.9790 
1 1 1 -8  4   5  o 19 2.81738e+01 7.85882e-01 5.50051e+02 117.459 -1.12558e+01 2.16601e+01  0.00000e+00 0.00000e+00 4.89266e+02 117.459 6.07850e+01 297.459 0.9793 
1 1 1 -8  4   6  o 11 3.86238e+01 8.30155e-01 6.71010e+02 14.593  4.24481e+01  1.10515e+01  0.00000e+00 0.00000e+00 7.66296e+02 14.593  9.52863e+01 14.593  0.9885 
1 1 1 -8  4   7  o 6  3.17650e+01 7.29674e-01 6.16676e+02 35.516  3.43252e+01  2.44983e+01  0.00000e+00 0.00000e+00 5.63988e+02 35.516  5.26889e+01 215.516 0.9881 
1 1 1 -8  4   8  f 0  5.65977e+00 1.08398e+00 1.37403e+02 33.434  1.70913e+00  1.12840e+00  0.00000e+00 0.00000e+00 1.26862e+01 33.434  1.24717e+02 213.433 0.7055 
1 1 1 -8  4   9  f 0  2.90002e+01 7.20447e-01 5.58353e+02 177.205 -5.12820e+01 2.50330e+00  0.00000e+00 0.00000e+00 5.20133e+02 177.205 3.82208e+01 357.205 0.9902 
1 1 1 -8  4   10 o 6  1.03100e+01 7.40273e-01 2.05986e+02 156.474 -8.16919e+00 3.55656e+00  0.00000e+00 0.00000e+00 1.58468e+02 156.474 4.75178e+01 336.473 0.9421 
1 1 1 -8  4   11 o 2  2.71742e+01 6.04281e-01 5.29039e+02 98.436  -1.20459e+01 8.12252e+01  0.00000e+00 0.00000e+00 4.83403e+02 98.436  4.56359e+01 278.436 0.9939 
1 1 1 -8  4   12 o 8  2.18014e+01 5.53092e-01 3.67028e+02 249.460 -2.06998e+01 -5.52461e+01 0.00000e+00 0.00000e+00 4.42444e+02 249.460 7.54156e+01 249.460 0.9915 
1 1 1 -8  4   13 o 3  1.03482e+01 5.43002e-01 1.76320e+02 93.506  -1.08431e+00 1.76996e+01  0.00000e+00 0.00000e+00 1.99700e+02 93.506  2.33799e+01 93.506  0.9714 
1 1 1 -8  4   14 o 11 4.39230e+00 8.23646e-01 9.64842e+01 203.274 -4.36308e+00 -1.87667e+00 0.00000e+00 0.00000e+00 4.91246e+01 203.274 4.73595e+01 23.274  0.8872 
1 1 1 -8  4   15 o 15 6.10667e+00 7.69576e-01 1.29674e+02 93.856  -6.94305e-01 1.03013e+01  0.00000e+00 0.00000e+00 8.68877e+01 93.856  4.27867e+01 273.856 0.9503 
1 1 1 -8  4   16 o 16 1.81981e+01 6.06190e-01 2.38772e+02 315.672 5.26832e+01  -5.14611e+01 0.00000e+00 0.00000e+00 4.34887e+02 315.672 1.96115e+02 315.672 0.9932 
1 1 1 -8  4   17 o 13 4.77582e+00 1.21528e+00 7.04440e+01 245.116 -1.93857e+00 -4.17932e+00 0.00000e+00 0.00000e+00 8.65948e+01 245.116 1.61508e+01 245.116 0.8834 
1 1 1 -8  4   18 o 3  4.04007e+00 1.24699e+00 8.46583e+01 73.752  1.43838e+00  4.93559e+00  0.00000e+00 0.00000e+00 4.99788e+01 73.752  3.46795e+01 253.752 0.8966 
1 1 1 -8  4   19 o 11 4.89237e+00 1.38593e+00 1.33909e+02 192.782 -1.00909e+01 -2.28931e+00 0.00000e+00 0.00000e+00 3.86681e+01 192.782 9.52411e+01 12.782  0.9504 
1 1 1 -8  5   1  o 8  2.60454e+01 6.22617e-01 4.70819e+02 182.511 -1.60929e+01 -7.05712e-01 0.00000e+00 0.00000e+00 4.81249e+02 182.511 1.04300e+01 182.511 0.9684 
1 1 1 -8  5   2  o 3  3.20539e+01 7.06942e-01 6.64689e+02 68.653  9.23122e+00  2.36202e+01  0.00000e+00 0.00000e+00 5.20602e+02 68.653  1.44087e+02 248.653 0.9801 
1 1 1 -8  5   3  o 10 1.96988e+01 5.60253e-01 2.04725e+02 342.906 4.74232e+00  -1.45842e+00 0.00000e+00 0.00000e+00 4.58278e+02 342.906 2.53553e+02 342.906 0.8925 
1 1 1 -8  5   4  o 12 4.55674e+01 9.32801e-01 8.72502e+02 12.831  4.88872e+01  1.11351e+01  0.00000e+00 0.00000e+00 8.27783e+02 12.831  4.47192e+01 192.831 0.9900 
1 1 1 -8  5   5  o 5  3.40286e+01 7.52877e-01 7.13762e+02 72.503  1.15089e+01  3.65089e+01  0.00000e+00 0.00000e+00 5.51203e+02 72.503  1.62560e+02 252.503 0.9869 
1 1 1 -8  5   6  o 15 3.70434e+00 1.01071e+00 9.43119e+01 158.185 -5.42777e-01 2.17261e-01  0.00000e+00 0.00000e+00 5.51965e+01 338.185 1.49508e+02 338.185 0.2805 
1 1 1 -8  5   7  o 11 2.98733e+01 7.11932e-01 4.51995e+02 301.229 1.50783e+01  -2.48689e+01 0.00000e+00 0.00000e+00 6.52257e+02 301.229 2.00262e+02 301.229 0.9827 
1 1 1 -8  5   8  o 3  2.47086e+01 6.52124e-01 4.32072e+02 242.080 -1.36670e+01 -2.57903e+01 0.00000e+00 0.00000e+00 4.80614e+02 242.080 4.85416e+01 242.080 0.9827 
1 1 1 -8  5   9  o 1  3.87054e+01 8.51102e-01 8.64676e+02 128.424 -6.51188e+01 8.20900e+01  0.00000e+00 0.00000e+00 5.81993e+02 128.424 2.82683e+02 308.424 0.9952 
1 1 1 -8  5   10 o 1  2.86912e+01 7.89010e-01 5.36995e+02 343.939 6.17247e+01  -1.77709e+01 0.00000e+00 0.00000e+00 5.31145e+02 343.939 5.85077e+00 163.939 0.9922 
1 1 1 -8  5   11 o 6  1.06556e+01 6.63087e-01 2.01314e+02 204.172 -1.10842e+01 -4.97496e+00 0.00000e+00 0.00000e+00 1.81311e+02 204.172 2.00033e+01 24.172  0.9579 
1 1 1 -8  5   12 o 14 9.56980e+00 6.06541e-01 1.51800e+02 29.708  9.22005e+00  5.26071e+00  0.00000e+00 0.00000e+00 1.89244e+02 29.708  3.74449e+01 29.708  0.9517 
1 1 1 -8  5   13 o 15 9.76741e+00 5.53533e-01 1.49902e+02 22.638  1.31017e+01  5.46389e+00  0.00000e+00 0.00000e+00 2.02352e+02 22.638  5.24498e+01 22.638  0.9641 
1 1 1 -8  5   14 o 4  1.03104e+01 5.57631e-01 1.49770e+02 346.731 1.82430e+01  -4.30204e+00 0.00000e+00 0.00000e+00 2.25045e+02 346.731 7.52748e+01 346.731 0.9729 
1 1 1 -8  5   15 o 2  3.46409e+00 8.80829e-01 7.62489e+01 206.111 -2.95944e+00 -1.45051e+00 0.00000e+00 0.00000e+00 3.10087e+01 206.111 4.52402e+01 26.111  0.8297 
1 1 1 -8  5   16 o 5  8.79124e+00 7.98416e-01 1.31720e+02 13.216  1.76015e+01  4.13369e+00  0.00000e+00 0.00000e+00 1.86749e+02 13.216  5.50294e+01 13.216  0.9719 
1 1 1 -8  5   17 o 4  4.17858e+00 1.20070e+00 1.26725e+02 165.535 -7.08393e+00 1.82746e+00  0.00000e+00 0.00000e+00 1.77510e+01 165.535 1.08974e+02 345.535 0.9289 
1 1 1 -8  5   18 o 4  4.98120e+00 1.35177e+00 9.27462e+01 256.893 -1.46319e+00 -6.28403e+00 0.00000e+00 0.00000e+00 7.73820e+01 256.893 1.53643e+01 76.893  0.9189 
1 1 1 -8  5   19 f 0  4.26499e+00 1.35125e+00 6.64946e+01 155.987 -4.20806e+00 1.87472e+00  0.00000e+00 0.00000e+00 7.33456e+01 155.987 6.85102e+00 155.987 0.8834 
1 1 1 -8  6   1  o 7  3.15948e+01 7.00588e-01 5.44334e+02 9.179   2.22117e+01  3.58911e+00  0.00000e+00 0.00000e+00 6.21389e+02 9.179   7.70557e+01 9.179   0.9775 
1 1 1 -8  6   2  o 3  3.03625e+01 8.02012e-01 1.55911e+02 335.307 5.09521e+00  -2.34280e+00 0.00000e+00 0.00000e+00 8.81729e+02 335.307 7.25818e+02 335.307 0.9058 
1 1 1 -8  6   3  o 2  3.30546e+01 7.26382e-01 8.13108e+02 121.619 -1.72288e+01 2.79845e+01  0.00000e+00 0.00000e+00 4.14299e+02 121.619 3.98809e+02 301.619 0.9847 
1 1 1 -8  6   4  o 3  2.13996e+01 5.85892e-01 4.11207e+02 93.305  -6.47171e-01 1.12072e+01  0.00000e+00 0.00000e+00 3.58551e+02 93.305  5.26560e+01 273.305 0.9544 
1 1 1 -8  6   5  o 15 2.82597e+01 6.66593e-01 6.09966e+02 339.909 2.55783e+01  -9.35591e+00 0.00000e+00 0.00000e+00 4.34799e+02 339.909 1.75167e+02 159.909 0.9815 
1 1 1 -8  6   6  o 4  1.02116e+01 6.37055e-01 2.77302e+02 168.757 -4.73530e+00 9.41299e-01  0.00000e+00 0.00000e+00 6.45208e+01 168.757 2.12781e+02 348.757 0.8892 
1 1 1 -8  6   7  o 16 2.10629e+01 6.20765e-01 3.89718e+02 285.988 5.01888e+00  -1.75165e+01 0.00000e+00 0.00000e+00 3.80534e+02 285.988 9.18410e+00 105.988 0.9722 
1 1 1 -8  6   8  o 17 3.03722e+01 7.21690e-01 5.82293e+02 312.278 3.23539e+01  -3.55837e+01 0.00000e+00 0.00000e+00 5.47376e+02 312.278 3.49170e+01 132.278 0.9895 
1 1 1 -8  6   9  o 17 4.47461e+01 9.46547e-01 6.97362e+02 105.086 -2.51569e+01 9.33258e+01  0.00000e+00 0.00000e+00 9.74381e+02 105.086 2.77019e+02 105.086 0.9948 
1 1 1 -8  6   10 o 1  1.88824e+01 6.13851e-01 3.99066e+02 87.401  1.45158e+00  3.19789e+01  0.00000e+00 0.00000e+00 2.98274e+02 87.401  1.00793e+02 267.401 0.9843 
1 1 1 -8  6   11 o 12 5.35422e+00 9.44186e-01 9.94368e+01 87.936  1.03593e-01  2.87395e+00  0.00000e+00 0.00000e+00 6.12011e+01 87.936  3.82357e+01 267.936 0.8004 
1 1 1 -8  6   12 o 5  2.13211e+01 5.39232e-01 2.96436e+02 41.304  3.50463e+01  3.07933e+01  0.00000e+00 0.00000e+00 4.93372e+02 41.304  1.96936e+02 41.304  0.9892 
1 1 1 -8  6   13 o 3  1.76808e+01 5.20218e-01 3.48635e+02 226.397 -4.14680e+01 -4.35417e+01 0.00000e+00 0.00000e+00 3.07216e+02 226.397 4.14197e+01 46.397  0.9916 
1 1 1 -8  6   14 o 10 3.09915e+00 8.22909e-01 2.50813e+01 253.344 -2.49602e-01 -8.34321e-01 0.00000e+00 0.00000e+00 2.10938e+01 253.344 3.98741e+00 73.344  0.3988 
1 1 1 -8  6   15 o 11 7.31773e+00 6.51784e-01 9.29580e+01 6.013   9.18967e+00  9.68019e-01  0.00000e+00 0.00000e+00 1.64898e+02 6.013   7.19398e+01 6.013   0.9442 
1 1 1 -8  6   16 o 19 3.77397e+00 1.03496e+00 8.34580e+01 264.300 -4.33627e-01 -4.34425e+00 0.00000e+00 0.00000e+00 3.97950e+01 264.300 4.36630e+01 84.300  0.8763 
1 1 1 -8  6   17 o 15 5.07670e+00 1.18667e+00 7.64179e+01 269.408 -5.58536e-02 -5.40499e+00 0.00000e+00 0.00000e+00 9.40264e+01 269.408 1.76085e+01 269.408 0.9020 
1 1 1 -8  6   18 o 10 4.04281e+00 1.22769e+00 5.63715e+01 148.075 -2.94553e+00 1.83518e+00  0.00000e+00 0.00000e+00 6.97869e+01 148.075 1.34155e+01 148.075 0.8395 
1 1 1 -8  6   19 o 13 3.64024e+00 1.17442e+00 8.28801e+01 91.776  -1.81074e-01 5.83997e+00  0.00000e+00 0.00000e+00 4.00490e+01 91.776  4.28311e+01 271.776 0.9098 
1 1 1 -8  7   1  o 19 1.19266e+01 5.26409e-01 2.85370e+02 247.943 -1.67798e+00 -4.14137e+00 0.00000e+00 0.00000e+00 1.10497e+02 247.943 1.74872e+02 67.943  0.8794 
1 1 1 -8  7   2  o 19 2.53222e+01 6.15598e-01 5.29055e+02 49.504  1.03492e+01  1.21192e+01  0.00000e+00 0.00000e+00 3.95831e+02 49.504  1.33224e+02 229.504 0.9681 
1 1 1 -8  7   3  o 3  1.41599e+01 5.47005e-01 3.11334e+02 163.477 -5.18764e+00 1.53894e+00  0.00000e+00 0.00000e+00 1.70373e+02 163.477 1.40961e+02 343.477 0.9021 
1 1 1 -8  7   4  o 8  3.05847e+01 6.94684e-01 6.43313e+02 343.330 2.49444e+01  -7.46946e+00 0.00000e+00 0.00000e+00 4.87072e+02 343.330 1.56241e+02 163.330 0.9806 
1 1 1 -8  7   5  f 0  2.26853e+01 7.19525e-01 4.39442e+02 53.213  9.22432e+00  1.23364e+01  0.00000e+00 0.00000e+00 3.86841e+02 53.213  5.26006e+01 233.213 0.9670 
1 1 1 -8  7   6  o 10 1.83461e+01 5.80721e-01 3.68961e+02 238.620 -6.01618e+00 -9.86378e+00 0.00000e+00 0.00000e+00 2.91041e+02 238.620 7.79195e+01 58.620  0.9557 
1 1 1 -8  7   7  o 7  1.16360e+01 6.49928e-01 2.21850e+02 156.026 -5.22406e+00 2.32302e+00  0.00000e+00 0.00000e+00 1.75460e+02 156.026 4.63903e+01 336.026 0.9077 
1 1 1 -8  7   8  f 0  2.08207e+01 6.29935e-01 3.28956e+02 30.279  1.61782e+01  9.44573e+00  0.00000e+00 0.00000e+00 4.32438e+02 30.279  1.03481e+02 30.279  0.9729 
1 1 1 -8  7   9  o 6  8.40635e+00 9.58226e-01 1.21134e+02 262.095 -4.32923e-01 -3.11783e+00 0.00000e+00 0.00000e+00 1.37846e+02 262.095 1.67124e+01 262.095 0.8203 
1 1 1 -8  7   10 o 13 2.49863e+01 6.30868e-01 4.34710e+02 170.641 -4.69291e+01 7.73450e+00  0.00000e+00 0.00000e+00 4.92890e+02 170.641 5.81804e+01 170.641 0.9894 
1 1 1 -8  7   11 f 0  1.09374e+01 6.02622e-01 2.94129e+02 59.799  9.22857e+00  1.58556e+01  0.00000e+00 0.00000e+00 1.04520e+02 59.799  1.89609e+02 239.799 0.9724 
1 1 1 -8  7   12 o 3  1.85969e+01 5.31491e-01 2.82255e+02 340.490 3.65396e+01  -1.29467e+01 0.00000e+00 0.00000e+00 4.05090e+02 340.490 1.22836e+02 340.490 0.9870 
1 1 1 -8  7   13 o 14 1.64980e+01 5.11375e-01 2.91094e+02 157.851 -4.34406e+01 1.76829e+01  0.00000e+00 0.00000e+00 3.19409e+02 157.851 2.83146e+01 157.851 0.9893 
1 1 1 -8  7   14 o 11 4.67640e+00 7.53770e-01 9.72999e+01 333.943 4.68466e+00  -2.29063e+00 0.00000e+00 0.00000e+00 5.96251e+01 333.943 3.76748e+01 153.943 0.8981 
1 1 1 -8  7   15 o 5  3.24378e+00 8.51998e-01 1.09600e+02 262.710 -5.69177e-01 -4.44918e+00 0.00000e+00 0.00000e+00 3.08728e+00 82.710  1.12687e+02 82.710  0.8799 
1 1 1 -8  7   16 f 0  1.02726e+01 7.53153e-01 2.25789e+02 111.825 -1.28181e+01 3.20069e+01  0.00000e+00 0.00000e+00 1.51480e+02 111.825 7.43085e+01 291.825 0.9854 
1 1 1 -8  7   17 o 15 3.66399e+00 1.07806e+00 7.37563e+01 240.270 -2.03468e+00 -3.56291e+00 0.00000e+00 0.00000e+00 4.45322e+01 240.270 2.92241e+01 60.270  0.8674 
1 1 1 -8  7   18 o 3  9.44901e+00 1.27988e+00 1.52907e+02 144.785 -1.73291e+01 1.22309e+01  0.00000e+00 0.00000e+00 1.89921e+02 144.785 3.70143e+01 144.785 0.9761 
1 1 1 -8  7   19 o 11 5.33642e+00 1.46636e+00 1.24346e+02 300.040 5.03645e+00  -8.70934e+00 0.00000e+00 0.00000e+00 6.35981e+01 300.040 6.07481e+01 120.040 0.9489 
1 1 1 -8  8   1  o 16 8.90866e+00 5.76476e-01 9.08628e+01 318.563 7.94037e-01  -7.00942e-01 0.00000e+00 0.00000e+00 6.61480e+01 318.563 2.47147e+01 138.563 0.4670 
1 1 1 -8  8   2  o 12 2.62721e+01 6.26370e-01 5.41004e+02 132.175 -1.13258e+01 1.25017e+01  0.00000e+00 0.00000e+00 4.20333e+02 132.175 1.20671e+02 312.175 0.9699 
1 1 1 -8  8   3  o 7  1.62255e+01 5.31680e-01 4.08354e+02 58.967  4.48015e+00  7.44653e+00  0.00000e+00 0.00000e+00 1.67143e+02 58.967  2.41211e+02 238.967 0.9406 
1 1 1 -8  8   4  o 11 3.65763e+01 7.85945e-01 6.34995e+02 90.686  -3.66136e-01 3.05853e+01  0.00000e+00 0.00000e+00 7.20818e+02 90.686  8.58230e+01 90.686  0.9835 
1 1 1 -8  8   5  o 4  2.68322e+01 6.51558e-01 5.51399e+02 328.608 1.95418e+01  -1.19243e+01 0.00000e+00 0.00000e+00 4.36959e+02 328.608 1.14440e+02 148.609 0.9779 
1 1 1 -8  8   6  o 10 2.81171e+01 7.98026e-01 4.28895e+02 139.278 -1.54320e+01 1.32840e+01  0.00000e+00 0.00000e+00 6.03166e+02 139.278 1.74271e+02 139.278 0.9751 
1 1 1 -8  8   7  o 18 3.25252e+01 7.43274e-01 6.16997e+02 163.314 -4.23103e+01 1.26822e+01  0.00000e+00 0.00000e+00 5.92511e+02 163.314 2.44859e+01 343.314 0.9886 
1 1 1 -8  8   8  o 17 1.80660e+01 6.38313e-01 3.24199e+02 37.495  1.26955e+01  9.73996e+00  0.00000e+00 0.00000e+00 3.33249e+02 37.495  9.04953e+00 37.495  0.9682 
1 1 1 -8  8   9  o 7  3.18972e+01 6.91618e-01 4.87604e+02 57.670  2.63616e+01  4.16517e+01  0.00000e+00 0.00000e+00 6.98052e+02 57.670  2.10448e+02 57.670  0.9898 
1 1 1 -8  8   10 o 14 3.41100e+01 7.18388e-01 5.38557e+02 12.975  7.75808e+01  1.78750e+01  0.00000e+00 0.00000e+00 7.33191e+02 12.975  1.94634e+02 12.975  0.9937 
1 1 1 -8  8   11 o 18 1.98500e+01 5.84006e-01 3.17675e+02 179.702 -3.60159e+01 1.87506e-01  0.00000e+00 0.00000e+00 4.15979e+02 179.702 9.83042e+01 179.702 0.9860 
1 1 1 -8  8   12 o 19 3.74587e+00 9.15088e-01 2.37794e+01 171.679 -6.04120e-01 8.83605e-02  0.00000e+00 0.00000e+00 1.71615e+01 171.679 6.61794e+00 351.679 0.2919 
1 1 1 -8  8   13 o 18 2.31835e+00 7.18161e-01 1.90414e+01 341.452 3.90384e-01  -1.30984e-01 0.00000e+00 0.00000e+00 1.55541e+00 161.452 2.05968e+01 161.452 0.2016 
1 1 1 -8  8   14 o 1  4.20144e+00 8.04055e-01 1.09366e+02 281.487 1.03094e+00  -5.07314e+00 0.00000e+00 0.00000e+00 3.14913e+01 281.487 7.78747e+01 101.487 0.8973 
1 1 1 -8  8   15 o 14 5.81382e+00 7.79594e-01 1.05313e+02 122.808 -4.46087e+00 6.91985e+00  0.00000e+00 0.00000e+00 9.80039e+01 122.808 7.30882e+00 302.808 0.9371 
1 1 1 -8  8   16 o 11 1.14139e+01 7.05781e-01 2.03241e+02 290.444 1.22752e+01  -3.29293e+01 0.00000e+00 0.00000e+00 2.16052e+02 290.444 1.28110e+01 290.444 0.9857 
1 1 1 -8  8   17 o 4  4.16447e+00 1.12821e+00 1.19413e+02 103.741 -1.73858e+00 7.10962e+00  0.00000e+00 0.00000e+00 2.45726e+01 103.741 9.48408e+01 283.741 0.9289 
1 1 1 -8  8   18 o 4  4.07779e+00 1.20938e+00 3.49485e+01 56.414  1.21520e+00  1.82999e+00  0.00000e+00 0.00000e+00 7.53253e+01 56.414  4.03767e+01 56.414  0.7276 
1 1 1 -8  8   19 f 0  3.79381e+00 1.23334e+00 1.13612e+02 57.720  4.23959e+00  6.71168e+00  0.00000e+00 0.00000e+00 1.80001e+01 57.720  9.56114e+01 237.720 0.9347 
1 1 1 -8  9   1  o 9  1.93269e+01 5.54303e-01 4.46542e+02 0.036   1.03263e+01  6.48964e-03  0.00000e+00 0.00000e+00 2.46625e+02 0.036   1.99917e+02 180.036 0.9503 
1 1 1 -8  9   2  o 11 1.65321e+01 5.34070e-01 1.56545e+02 252.731 -9.11983e-01 -2.93360e+00 0.00000e+00 0.00000e+00 3.51881e+02 252.731 1.95336e+02 252.731 0.8152 
1 1 1 -8  9   3  o 7  6.67131e+00 7.25769e-01 8.92576e+01 251.805 -2.41986e-01 -7.36238e-01 0.00000e+00 0.00000e+00 1.56847e+00 251.805 8.76891e+01 71.805  0.3610 
1 1 1 -8  9   4  o 6  4.56137e+01 9.37842e-01 7.17096e+02 176.541 -4.26494e+01 2.57807e+00  0.00000e+00 0.00000e+00 9.81776e+02 176.541 2.64680e+02 176.541 0.9882 
1 1 1 -8  9   5  o 6  1.79087e+01 6.91202e-01 5.35220e+01 226.920 -1.00990e+00 -1.07995e+00 0.00000e+00 0.00000e+00 3.44995e+02 226.920 2.91473e+02 226.920 0.5908 
1 1 1 -8  9   6  o 6  1.25151e+01 6.02321e-01 2.10909e+02 192.102 -4.43818e+00 -9.51655e-01 0.00000e+00 0.00000e+00 2.04336e+02 192.102 6.57300e+00 12.102  0.8815 
1 1 1 -8  9   7  o 19 3.52140e+01 7.76456e-01 7.41438e+02 59.074  2.94455e+01  4.91490e+01  0.00000e+00 0.00000e+00 5.71496e+02 59.074  1.69942e+02 239.074 0.9912 
1 1 1 -8  9   8  o 18 1.51029e+01 6.44195e-01 2.48645e+02 275.477 9.78101e-01  -1.02014e+01 0.00000e+00 0.00000e+00 2.90545e+02 275.477 4.19004e+01 275.477 0.9499 
1 1 1 -8  9   9  o 4  3.04455e+01 6.73960e-01 4.73794e+02 63.346  2.05172e+01  4.08757e+01  0.00000e+00 0.00000e+00 6.56960e+02 63.346  1.83166e+02 63.346  0.9890 
1 1 1 -8  9   10 o 15 1.66783e+01 5.99555e-01 3.70001e+02 202.018 -2.50937e+01 -1.01476e+01 0.00000e+00 0.00000e+00 2.44086e+02 202.018 1.25915e+02 22.018  0.9814 
1 1 1 -8  9   11 o 7  2.63472e+01 6.26487e-01 4.71457e+02 119.678 -3.49032e+01 6.12462e+01  0.00000e+00 0.00000e+00 5.09086e+02 119.678 3.76290e+01 119.678 0.9929 
1 1 1 -8  9   12 o 11 1.97421e+01 5.22702e-01 3.90751e+02 189.622 -5.95033e+01 -1.00875e+01 0.00000e+00 0.00000e+00 3.42334e+02 189.622 4.84167e+01 9.622   0.9917 
1 1 1 -8  9   13 o 4  1.38399e+01 5.04033e-01 1.75771e+02 335.578 2.19450e+01  -9.96493e+00 0.00000e+00 0.00000e+00 3.31040e+02 335.578 1.55269e+02 335.578 0.9790 
1 1 1 -8  9   14 o 1  9.30352e+00 5.33785e-01 1.31156e+02 85.447  1.18051e+00  1.48244e+01  0.00000e+00 0.00000e+00 2.04536e+02 85.447  7.33796e+01 85.447  0.9658 
1 1 1 -8  9   15 o 2  5.45067e+00 8.03836e-01 5.06628e+01 165.097 -3.55264e+00 9.45477e-01  0.00000e+00 0.00000e+00 1.22186e+02 165.097 7.15230e+01 165.097 0.8498 
1 1 1 -8  9   16 o 14 1.01349e+01 7.82775e-01 2.18067e+02 120.860 -1.66290e+01 2.78286e+01  0.00000e+00 0.00000e+00 1.53777e+02 120.860 6.42896e+01 300.860 0.9845 
1 1 1 -8  9   17 o 19 7.11432e+00 1.07552e+00 1.44182e+02 343.014 1.49074e+01  -4.55364e+00 0.00000e+00 0.00000e+00 1.11967e+02 343.014 3.22156e+01 163.014 0.9674 
1 1 1 -8  9   18 o 2  3.41123e+00 1.10940e+00 5.32473e+01 203.773 -2.79948e+00 -1.23316e+00 0.00000e+00 0.00000e+00 4.99895e+01 203.773 3.25775e+00 23.773  0.8143 
1 1 1 -8  9   19 o 10 6.87890e+00 1.78972e+00 6.82000e+01 284.355 1.36004e+00  -5.31441e+00 0.00000e+00 0.00000e+00 1.62475e+02 284.355 9.42748e+01 284.355 0.9035 
1 1 1 -8  10  1  o 15 1.13787e+01 5.36733e-01 2.64506e+02 35.580  2.92241e+00  2.09073e+00  0.00000e+00 0.00000e+00 9.87339e+01 35.580  1.65772e+02 215.580 0.8458 
1 1 1 -8  10  2  o 15 2.32607e+01 5.89425e-01 4.86088e+02 214.890 -1.14688e+01 -7.99770e+00 0.00000e+00 0.00000e+00 3.59448e+02 214.890 1.26640e+02 34.890  0.9635 
1 1 1 -8  10  3  f 0  2.52841e+01 6.16361e-01 6.38917e+02 1.712   2.10514e+01  6.29281e-01  0.00000e+00 0.00000e+00 2.91572e+02 1.712   3.47346e+02 181.712 0.9760 
1 1 1 -8  10  4  f 0  8.59183e+00 6.58262e-01 2.43668e+01 19.626  2.59965e-01  9.27017e-02  0.00000e+00 0.00000e+00 1.98979e+01 19.626  4.46894e+00 199.626 0.1367 
1 1 1 -8  10  5  o 19 1.42342e+01 5.54126e-01 4.26585e+02 251.811 -2.93347e+00 -8.92819e+00 0.00000e+00 0.00000e+00 8.01658e+01 251.811 3.46419e+02 71.811  0.9452 
1 1 1 -8  10  6  o 17 2.79183e+01 6.67551e-01 4.44925e+02 239.993 -1.06457e+01 -1.84339e+01 0.00000e+00 0.00000e+00 5.80940e+02 239.993 1.36015e+02 239.993 0.9762 
1 1 1 -8  10  7  o 4  2.86700e+01 6.85715e-01 4.77511e+02 294.990 1.27487e+01  -2.73519e+01 0.00000e+00 0.00000e+00 5.82836e+02 294.990 1.05325e+02 294.990 0.9833 
1 1 1 -8  10  8  o 9  2.96590e+01 7.10984e-01 5.11944e+02 30.690  3.63444e+01  2.15714e+01  0.00000e+00 0.00000e+00 5.89485e+02 30.690  7.75407e+01 30.690  0.9881 
1 1 1 -8  10  9  o 13 1.67220e+01 5.97244e-01 1.62580e+02 354.196 8.61585e+00  -8.75758e-01 0.00000e+00 0.00000e+00 4.27915e+02 354.196 2.65335e+02 354.196 0.9404 
1 1 1 -8  10  10 o 19 5.99748e+00 1.01072e+00 2.53015e+02 200.636 -5.90224e+00 -2.22277e+00 0.00000e+00 0.00000e+00 4.67032e+01 20.636  2.99718e+02 20.636  0.9169 
1 1 1 -8  10  11 o 16 1.12146e+01 6.21878e-01 2.17814e+02 59.801  7.04449e+00  1.21039e+01  0.00000e+00 0.00000e+00 1.87234e+02 59.801  3.05809e+01 239.801 0.9636 
1 1 1 -8  10  12 o 14 5.77348e+00 8.07070e-01 1.12021e+02 201.755 -4.44982e+00 -1.77577e+00 0.00000e+00 0.00000e+00 8.00117e+01 201.755 3.20097e+01 21.755  0.8883 
1 1 1 -8  10  13 o 19 4.16399e+00 8.11748e-01 8.03080e+01 340.274 2.89974e+00  -1.03973e+00 0.00000e+00 0.00000e+00 4.67443e+01 340.274 3.35637e+01 160.274 0.8158 
1 1 1 -8  10  14 o 6  7.10900e+00 5.97921e-01 1.26353e+02 118.376 -5.41543e+00 1.00255e+01  0.00000e+00 0.00000e+00 1.27304e+02 118.376 9.51488e-01 118.376 0.9551 
1 1 1 -8  10  15 o 11 5.84163e+00 7.28976e-01 7.87822e+01 127.732 -3.85753e+00 4.98527e+00  0.00000e+00 0.00000e+00 1.21069e+02 127.732 4.22871e+01 127.732 0.9168 
1 1 1 -8  10  16 o 18 3.97086e+00 9.94596e-01 5.15237e+01 160.761 -2.56799e+00 8.96217e-01  0.00000e+00 0.00000e+00 6.49311e+01 160.761 1.34074e+01 160.761 0.7869 
1 1 1 -8  10  17 o 15 1.00428e+01 9.53877e-01 1.75580e+02 257.347 -6.30731e+00 -2.80944e+01 0.00000e+00 0.00000e+00 1.91646e+02 257.347 1.60666e+01 257.347 0.9825 
1 1 1 -8  10  18 o 18 4.06589e+00 1.21862e+00 7.28203e+01 110.802 -1.63976e+00 4.31620e+00  0.00000e+00 0.00000e+00 6.07158e+01 110.802 1.21045e+01 290.802 0.8837 
1 1 1 -8  10  19 o 18 4.27666e+00 1.47519e+00 5.12293e+01 343.286 3.15626e+00  -9.47775e-01 0.00000e+00 0.00000e+00 8.04523e+01 343.286 2.92230e+01 343.286 0.8297 
1 1 1 -8  11  1  o 13 1.79153e+01 5.33290e-01 5.99239e+02 273.501 7.80596e-01  -1.27578e+01 0.00000e+00 0.00000e+00 4.98756e+01 273.501 5.49363e+02 93.501  0.9600 
1 1 1 -8  11  2  o 3  1.63775e+01 5.25269e-01 3.46462e+02 127.586 -4.27639e+00 5.55588e+00  0.00000e+00 0.00000e+00 2.25441e+02 127.586 1.21021e+02 307.586 0.9257 
1 1 1 -8  11  3  o 6  2.07650e+01 5.66648e-01 4.15161e+02 195.240 -1.08374e+01 -2.95267e+00 0.00000e+00 0.00000e+00 3.32107e+02 195.240 8.30542e+01 15.240  0.9544 
1 1 1 -8  11  4  o 3  3.54861e+01 7.68152e-01 6.59146e+02 111.427 -1.11988e+01 2.85365e+01  0.00000e+00 0.00000e+00 6.56201e+02 111.427 2.94506e+00 291.427 0.9836 
1 1 1 -8  11  5  o 17 1.00764e+01 5.85306e-01 3.83076e+02 170.653 -5.87814e+00 9.67553e-01  0.00000e+00 0.00000e+00 3.70753e+01 350.653 4.20151e+02 350.653 0.9117 
1 1 1 -8  11  6  o 7  2.22699e+01 6.03813e-01 4.39251e+02 273.113 9.12135e-01  -1.67689e+01 0.00000e+00 0.00000e+00 3.73617e+02 273.113 6.56339e+01 93.113  0.9698 
1 1 1 -8  11  7  o 4  2.60581e+01 6.58237e-01 4.38410e+02 237.170 -1.51159e+01 -2.34280e+01 0.00000e+00 0.00000e+00 5.23949e+02 237.170 8.55391e+01 237.170 0.9819 
1 1 1 -8  11  8  o 10 4.41358e+01 9.26634e-01 7.66396e+02 346.013 8.96144e+01  -2.23210e+01 0.00000e+00 0.00000e+00 8.83340e+02 346.013 1.16944e+02 346.013 0.9946 
1 1 1 -8  11  9  o 7  1.43148e+01 8.42609e-01 1.99330e+02 28.857  8.05617e+00  4.43932e+00  0.00000e+00 0.00000e+00 3.08087e+02 28.857  1.08757e+02 28.857  0.9440 
1 1 1 -8  11  10 o 6  3.13038e+01 7.62180e-01 5.47065e+02 157.250 -6.79106e+01 2.84767e+01  0.00000e+00 0.00000e+00 6.19363e+02 157.250 7.22979e+01 157.250 0.9932 
1 1 1 -8  11  11 o 10 1.41227e+01 5.82441e-01 2.73250e+02 178.096 -2.22081e+01 7.38072e-01  0.00000e+00 0.00000e+00 2.44032e+02 178.096 2.92181e+01 358.096 0.9772 
1 1 1 -8  11  12 o 3  4.85006e+00 8.22111e-01 8.57587e+01 269.905 -5.06843e-03 -3.06843e+00 0.00000e+00 0.00000e+00 6.22299e+01 269.905 2.35287e+01 89.905  0.8149 
1 1 1 -8  11  13 o 11 9.96197e+00 5.29512e-01 1.93777e+02 298.688 9.12712e+00  -1.66796e+01 0.00000e+00 0.00000e+00 1.68886e+02 298.688 2.48916e+01 118.687 0.9733 
1 1 1 -8  11  14 o 14 9.70602e+00 5.16972e-01 1.72300e+02 277.334 2.76602e+00  -2.14899e+01 0.00000e+00 0.00000e+00 1.81839e+02 277.334 9.53874e+00 277.334 0.9766 
1 1 1 -8  11  15 o 1  1.15722e+01 5.31416e-01 2.57547e+02 115.929 -1.90514e+01 3.91837e+01  0.00000e+00 0.00000e+00 1.69272e+02 115.929 8.82747e+01 295.929 0.9885 
1 1 1 -8  11  16 o 14 5.35716e+00 9.97242e-01 1.43147e+02 306.002 5.98197e+00  -8.23292e+00 0.00000e+00 0.00000e+00 4.64179e+01 306.002 9.67293e+01 126.002 0.9495 
1 1 1 -8  11  17 o 15 5.66350e+00 1.06905e+00 8.43768e+01 265.418 -5.81854e-01 -7.26087e+00 0.00000e+00 0.00000e+00 1.11347e+02 265.418 2.69703e+01 265.418 0.9286 
1 1 1 -8  11  18 o 5  4.74633e+00 1.55789e+00 5.78487e+01 115.271 -1.43547e+00 3.04074e+00  0.00000e+00 0.00000e+00 8.91952e+01 115.271 3.13465e+01 115.271 0.8336 
1 1 1 -8  11  19 o 13 5.39129e+00 1.74909e+00 4.98369e+01 143.482 -2.61166e+00 1.93379e+00  0.00000e+00 0.00000e+00 1.15602e+02 143.482 6.57653e+01 143.482 0.8269 
1 1 1 -8  12  1  o 18 3.64352e+01 7.80243e-01 7.39518e+02 233.214 -1.90141e+01 -2.54298e+01 0.00000e+00 0.00000e+00 6.13680e+02 233.214 1.25839e+02 53.214  0.9841 
1 1 1 -8  12  2  o 5  1.77271e+01 5.51053e-01 3.10250e+02 349.957 6.66957e+00  -1.18116e+00 0.00000e+00 0.00000e+00 3.06924e+02 349.957 3.32568e+00 169.957 0.9229 
1 1 1 -8  12  3  o 7  9.23666e+00 7.20399e-01 1.54155e+02 264.040 -1.89407e-01 -1.81423e+00 0.00000e+00 0.00000e+00 7.80258e+01 264.040 7.61293e+01 84.040  0.6667 
1 1 1 -8  12  4  o 19 9.51245e+00 8.04837e-01 2.67379e+02 155.756 -3.13734e+00 1.41285e+00  0.00000e+00 0.00000e+00 3.30091e+01 155.756 2.34370e+02 335.756 0.8380 
1 1 1 -8  12  5  o 10 2.07344e+01 5.81702e-01 5.22392e+02 29.640  1.78517e+01  1.01575e+01  0.00000e+00 0.00000e+00 2.39270e+02 29.640  2.83122e+02 209.640 0.9753 
1 1 1 -8  12  6  o 1  2.76029e+01 6.65946e-01 5.11869e+02 255.675 -5.98101e+00 -2.34220e+01 0.00000e+00 0.00000e+00 5.05328e+02 255.675 6.54054e+00 75.675  0.9791 
1 1 1 -8  12  7  o 6  1.96292e+01 6.08147e-01 2.35045e+02 93.715  -7.30675e-01 1.12531e+01  0.00000e+00 0.00000e+00 4.69691e+02 93.715  2.34646e+02 93.715  0.9546 
1 1 1 -8  12  8  o 13 1.28906e+01 6.63063e-01 2.66694e+02 221.756 -7.14785e+00 -6.38103e+00 0.00000e+00 0.00000e+00 1.91731e+02 221.756 7.49633e+01 41.756  0.9463 
1 1 1 -8  12  9  o 1  9.10483e+00 1.02186e+00 1.02079e+02 359.466 2.93320e+00  -2.73325e-02 0.00000e+00 0.00000e+00 1.73115e+02 359.466 7.10361e+01 359.466 0.8049 
1 1 1 -8  12  10 o 1  7.72273e+00 7.95904e-01 1.32147e+02 234.738 -2.64133e+00 -3.73573e+00 0.00000e+00 0.00000e+00 1.23536e+02 234.738 8.61131e+00 54.738  0.8825 
1 1 1 -8  12  11 f 0  1.53526e+01 5.80935e-01 2.70915e+02 252.076 -7.36538e+00 -2.27707e+01 0.00000e+00 0.00000e+00 2.92346e+02 252.076 2.14318e+01 252.076 0.9789 
1 1 1 -8  12  12 o 11 6.08523e+00 7.87078e-01 1.77107e+02 28.706  7.02236e+00  3.84565e+00  0.00000e+00 0.00000e+00 3.59888e+01 28.706  1.41119e+02 208.706 0.9353 
1 1 1 -8  12  13 o 4  1.31258e+01 5.01068e-01 2.85182e+02 135.097 -2.62410e+01 2.61523e+01  0.00000e+00 0.00000e+00 1.99064e+02 135.097 8.61175e+01 315.097 0.9864 
1 1 1 -8  12  14 o 10 1.02069e+01 5.09387e-01 1.46490e+02 78.691  3.80407e+00  1.90213e+01  0.00000e+00 0.00000e+00 2.24856e+02 78.691  7.83655e+01 78.691  0.9739 
1 1 1 -8  12  15 o 17 4.14336e+00 7.98049e-01 8.59476e+01 216.613 -4.03031e+00 -2.99458e+00 0.00000e+00 0.00000e+00 5.22447e+01 216.613 3.37028e+01 36.613  0.8939 
1 1 1 -8  12  16 o 7  7.71921e+00 8.47891e-01 1.51937e+02 73.149  5.43528e+00  1.79452e+01  0.00000e+00 0.00000e+00 1.27943e+02 73.149  2.39942e+01 253.149 0.9730 
1 1 1 -8  12  17 o 9  7.15507e+00 1.43820e+00 1.12603e+02 164.183 -8.89748e+00 2.52058e+00  0.00000e+00 0.00000e+00 1.38842e+02 164.183 2.62392e+01 164.183 0.9443 
1 1 1 -8  12  18 o 10 7.97970e+00 1.68397e+00 1.56471e+02 183.964 -1.39520e+01 -9.66816e-01 0.00000e+00 0.00000e+00 1.29280e+02 183.964 2.71914e+01 3.964   0.9636 
1 1 1 -8  12  19 o 4  5.20678e+00 1.67764e+00 1.03827e+02 9.927   6.81334e+00  1.19247e+00  0.00000e+00 0.00000e+00 7.48272e+01 9.927   2.89996e+01 189.927 0.9246 
1 1 1 -8  13  1  o 10 2.64256e+01 8.66056e-01 2.34189e+02 260.223 -1.28652e+00 -7.46605e+00 0.00000e+00 0.00000e+00 6.94692e+02 260.223 4.60503e+02 260.223 0.9315 
1 1 1 -8  13  2  o 15 2.22278e+01 7.88676e-01 4.49534e+02 13.624  1.18393e+01  2.86947e+00  0.00000e+00 0.00000e+00 3.53759e+02 13.624  9.57747e+01 193.624 0.9580 
1 1 1 -8  13  3  o 5  2.56347e+01 8.51066e-01 2.80643e+02 115.741 -3.97234e+00 8.23899e+00  0.00000e+00 0.00000e+00 6.31418e+02 115.741 3.50775e+02 115.741 0.9436 
1 1 1 -8  13  4  o 11 4.14640e+01 8.63852e-01 8.67654e+02 206.118 -4.34963e+01 -2.13257e+01 0.00000e+00 0.00000e+00 6.78659e+02 206.118 1.88994e+02 26.118  0.9896 
1 1 1 -8  13  5  o 8  3.06630e+01 6.99467e-01 5.13056e+02 118.431 -1.40951e+01 2.60345e+01  0.00000e+00 0.00000e+00 6.22084e+02 118.431 1.09028e+02 118.431 0.9830 
1 1 1 -8  13  6  o 1  2.15730e+01 6.02288e-01 3.21440e+02 126.856 -8.73325e+00 1.16502e+01  0.00000e+00 0.00000e+00 4.62096e+02 126.856 1.40656e+02 126.856 0.9650 
1 1 1 -8  13  7  o 19 2.08860e+01 6.19396e-01 3.11912e+02 190.855 -1.56039e+01 -2.99201e+00 0.00000e+00 0.00000e+00 4.48465e+02 190.855 1.36552e+02 190.855 0.9680 
1 1 1 -8  13  8  o 6  2.58479e+01 6.74511e-01 3.45553e+02 235.770 -1.39753e+01 -2.05410e+01 0.00000e+00 0.00000e+00 6.06063e+02 235.770 2.60510e+02 235.770 0.9797 
1 1 1 -8  13  9  o 5  6.16438e+00 1.03926e+00 8.76289e+01 81.480  2.51726e-01  1.68037e+00  0.00000e+00 0.00000e+00 6.08883e+01 81.480  2.67406e+01 261.480 0.6416 
1 1 1 -8  13  10 f 0  3.82275e+00 1.01192e+00 4.14706e+01 133.481 -4.72881e-01 4.98644e-01  0.00000e+00 0.00000e+00 5.10869e+00 133.481 3.63619e+01 313.481 0.3248 
1 1 1 -8  13  11 o 19 4.13293e+00 9.82885e-01 2.84814e+01 27.418  5.62554e-01  2.91830e-01  0.00000e+00 0.00000e+00 1.82911e+01 27.418  1.01902e+01 207.418 0.3020 
1 1 1 -8  13  12 f 0  1.07038e+01 5.76679e-01 1.32015e+02 314.543 8.31986e+00  -8.45352e+00 0.00000e+00 0.00000e+00 2.51450e+02 314.543 1.19435e+02 314.543 0.9569 
1 1 1 -8  13  13 f 0  1.38656e+01 4.86071e-01 2.34849e+02 181.028 -3.23785e+01 -5.80998e-01 0.00000e+00 0.00000e+00 2.75647e+02 181.028 4.07979e+01 181.028 0.9844 
1 1 1 -8  13  14 f 0  8.35863e+00 5.27825e-01 7.20200e+01 41.455  5.82274e+00  5.14343e+00  0.00000e+00 0.00000e+00 2.19381e+02 41.455  1.47361e+02 41.455  0.9332 
1 1 1 -8  13  15 o 12 8.03849e+00 5.61003e-01 1.43500e+02 274.758 1.47326e+00  -1.76996e+01 0.00000e+00 0.00000e+00 1.47859e+02 274.758 4.35884e+00 274.758 0.9714 
1 1 1 -8  13  16 o 19 3.04008e+00 9.19290e-01 1.95167e+01 310.991 5.99348e-01  -6.89692e-01 0.00000e+00 0.00000e+00 2.74954e+01 310.991 7.97875e+00 310.991 0.4150 
1 1 1 -8  13  17 o 7  3.37299e+00 1.11784e+00 1.17744e+01 142.245 -4.36524e-01 3.38057e-01  0.00000e+00 0.00000e+00 2.16213e+01 142.245 9.84686e+00 142.245 0.2660 
1 1 1 -8  13  18 f 0  5.20548e+00 1.66075e+00 1.13304e+02 256.291 -1.63864e+00 -6.71757e+00 0.00000e+00 0.00000e+00 6.55537e+01 256.291 4.77502e+01 76.291  0.9246 
1 1 1 -8  13  19 o 8  5.80940e+00 1.83451e+00 1.36586e+02 349.436 8.82387e+00  -1.64560e+00 0.00000e+00 0.00000e+00 6.66050e+01 349.436 6.99815e+01 169.436 0.9425 
1 1 1 -8  14  1  o 14 1.29602e+01 5.29501e-01 2.74791e+02 120.793 -2.24935e+00 3.77441e+00  0.00000e+00 0.00000e+00 1.54185e+02 120.793 1.20606e+02 300.793 0.8771 
1 1 1 -8  14  2  o 16 1.75962e+01 5.36202e-01 3.24508e+02 141.643 -5.86882e+00 4.64438e+00  0.00000e+00 0.00000e+00 2.93150e+02 141.643 3.13580e+01 321.643 0.9306 
1 1 1 -8  14  3  f 0  3.54530e+01 7.62505e-01 6.86514e+02 351.422 3.06180e+01  -4.61861e+00 0.00000e+00 0.00000e+00 6.28398e+02 351.422 5.81159e+01 171.422 0.9837 
1 1 1 -8  14  4  o 1  2.62658e+01 6.28554e-01 5.63955e+02 205.183 -1.81707e+01 -8.54374e+00 0.00000e+00 0.00000e+00 4.00837e+02 205.183 1.63118e+02 25.183  0.9748 
1 1 1 -8  14  5  o 7  2.95591e+01 6.84196e-01 5.05460e+02 328.468 2.39265e+01  -1.46806e+01 0.00000e+00 0.00000e+00 5.87724e+02 328.468 8.22645e+01 328.468 0.9820 
1 1 1 -8  14  6  o 5  1.70674e+01 5.78058e-01 3.49728e+02 354.294 1.24617e+01  -1.24521e+00 0.00000e+00 0.00000e+00 2.66404e+02 354.294 8.33241e+01 174.294 0.9592 
1 1 1 -8  14  7  o 14 8.55064e+00 7.53411e-01 9.22891e+01 234.440 -1.10806e+00 -1.55004e+00 0.00000e+00 0.00000e+00 1.26897e+02 234.440 3.46083e+01 234.440 0.6816 
1 1 1 -8  14  8  o 14 3.97366e+00 1.08288e+00 3.04615e+01 261.278 -5.29989e-02 -3.45467e-01 0.00000e+00 0.00000e+00 4.75681e+00 81.278  3.52184e+01 81.278  0.1721 
1 1 1 -8  14  9  o 2  2.83679e+01 8.60667e-01 4.10754e+02 348.895 3.96451e+01  -7.78139e+00 0.00000e+00 0.00000e+00 6.41117e+02 348.895 2.30363e+02 348.895 0.9875 
1 1 1 -8  14  10 o 11 3.31362e+01 7.70688e-01 4.86149e+02 293.310 2.85916e+01  -6.63573e+01 0.00000e+00 0.00000e+00 7.48270e+02 293.310 2.62121e+02 293.310 0.9931 
1 1 1 -8  14  11 o 8  1.61303e+01 5.79037e-01 1.72195e+02 326.564 1.42233e+01  -9.39116e+00 0.00000e+00 0.00000e+00 4.14314e+02 326.564 2.42119e+02 326.564 0.9702 
1 1 1 -8  14  12 o 18 8.07450e+00 6.76160e-01 1.74701e+02 193.149 -1.12939e+01 -2.63839e+00 0.00000e+00 0.00000e+00 1.14257e+02 193.149 6.04449e+01 13.149  0.9559 
1 1 1 -8  14  13 o 9  9.37136e+00 5.16365e-01 2.36446e+02 110.271 -7.58422e+00 2.05351e+01  0.00000e+00 0.00000e+00 1.05924e+02 110.271 1.30522e+02 290.271 0.9769 
1 1 1 -8  14  14 o 7  2.15053e+00 6.68586e-01 8.49510e+01 240.634 -1.16206e+00 -2.06519e+00 0.00000e+00 0.00000e+00 2.46972e+01 60.634  1.09648e+02 60.634  0.7500 
1 1 1 -8  14  15 o 13 4.16515e+00 9.25070e-01 8.15999e+01 51.547  2.81521e+00  3.54516e+00  0.00000e+00 0.00000e+00 5.53279e+01 51.547  2.62720e+01 231.547 0.8811 
1 1 1 -8  14  16 o 1  6.77836e+00 8.91778e-01 7.35811e+01 53.889  4.58990e+00  6.29174e+00  0.00000e+00 0.00000e+00 1.62177e+02 53.889  8.85958e+01 53.889  0.9334 
1 1 1 -8  14  17 o 2  4.94289e+00 1.35397e+00 1.19002e+02 130.708 -4.63094e+00 5.38241e+00  0.00000e+00 0.00000e+00 5.14442e+01 130.708 6.75582e+01 310.708 0.9266 
1 1 1 -8  14  18 o 6  4.38468e+00 1.47631e+00 5.70459e+01 134.535 -2.35219e+00 2.39068e+00  0.00000e+00 0.00000e+00 7.86986e+01 134.535 2.16527e+01 134.535 0.8331 
1 1 1 -8  14  19 o 18 4.63623e+00 1.56085e+00 1.85884e+01 121.630 -6.34914e-01 1.03083e+00  0.00000e+00 0.00000e+00 7.01968e+01 121.630 5.16084e+01 121.630 0.5161 
1 1 1 -8  15  1  o 19 7.61889e+00 6.13062e-01 1.19763e+02 69.152  3.98467e-01  1.04632e+00  0.00000e+00 0.00000e+00 2.02984e+01 69.152  9.94642e+01 249.152 0.4872 
1 1 1 -8  15  2  o 19 2.30156e+01 5.87400e-01 5.35400e+02 208.584 -1.41213e+01 -7.69407e+00 0.00000e+00 0.00000e+00 3.05291e+02 208.584 2.30110e+02 28.584  0.9684 
1 1 1 -8  15  3  o 15 2.10860e+01 6.58374e-01 5.18911e+02 97.868  -1.90679e+00 1.37983e+01  0.00000e+00 0.00000e+00 2.46967e+02 97.868  2.71944e+02 277.868 0.9634 
1 1 1 -8  15  4  o 17 1.68049e+01 5.32701e-01 3.69927e+02 153.154 -8.86518e+00 4.48705e+00  0.00000e+00 0.00000e+00 2.30536e+02 153.154 1.39391e+02 333.154 0.9483 
1 1 1 -8  15  5  o 16 3.06275e+01 8.37253e-01 6.46428e+02 97.714  -4.62884e+00 3.41716e+01  0.00000e+00 0.00000e+00 4.90112e+02 97.714  1.56316e+02 277.714 0.9854 
1 1 1 -8  15  6  o 8  2.35365e+01 7.44945e-01 4.01904e+02 245.239 -8.22490e+00 -1.78322e+01 0.00000e+00 0.00000e+00 4.61008e+02 245.239 5.91040e+01 245.239 0.9742 
1 1 1 -8  15  7  o 4  2.60020e+01 6.62114e-01 4.82386e+02 56.558  1.65635e+01  2.50794e+01  0.00000e+00 0.00000e+00 4.79055e+02 56.558  3.33112e+00 236.558 0.9832 
1 1 1 -8  15  8  o 18 5.20159e+00 1.04080e+00 7.70643e+01 235.111 -6.64146e-01 -9.52429e-01 0.00000e+00 0.00000e+00 2.07789e+01 235.111 5.62854e+01 55.111  0.5006 
1 1 1 -8  15  9  o 14 1.37201e+01 6.21819e-01 1.78927e+02 62.522  4.01329e+00  7.71681e+00  0.00000e+00 0.00000e+00 3.05620e+02 62.522  1.26693e+02 62.522  0.9406 
1 1 1 -8  15  10 o 9  1.42089e+01 6.96219e-01 2.83056e+02 124.749 -1.09636e+01 1.58048e+01  0.00000e+00 0.00000e+00 2.35900e+02 124.749 4.71557e+01 304.749 0.9736 
1 1 1 -8  15  11 o 17 1.36029e+01 5.91277e-01 1.40396e+02 25.301  1.05627e+01  4.99331e+00  0.00000e+00 0.00000e+00 3.47054e+02 25.301  2.06657e+02 25.301  0.9562 
1 1 1 -8  15  12 o 13 2.06385e+01 5.32330e-01 3.35168e+02 205.792 -5.25392e+01 -2.53898e+01 0.00000e+00 0.00000e+00 4.30833e+02 205.792 9.56642e+01 205.792 0.9914 
1 1 1 -8  15  13 o 4  1.66356e+01 4.77022e-01 3.66154e+02 303.667 3.35668e+01  -5.03947e+01 0.00000e+00 0.00000e+00 2.50802e+02 303.667 1.15353e+02 123.667 0.9917 
1 1 1 -8  15  14 o 6  8.60779e+00 4.87767e-01 1.21544e+02 182.245 -1.42727e+01 -5.59541e-01 0.00000e+00 0.00000e+00 1.88521e+02 182.245 6.69774e+01 182.245 0.9643 
1 1 1 -8  15  15 o 19 5.97801e+00 7.12049e-01 8.28817e+01 67.678  2.74275e+00  6.68013e+00  0.00000e+00 0.00000e+00 1.24075e+02 67.678  4.11928e+01 67.678  0.9279 
1 1 1 -8  15  16 o 19 6.90993e+00 1.33643e+00 1.16830e+02 8.819   9.12424e+00  1.41568e+00  0.00000e+00 0.00000e+00 1.26273e+02 8.819   9.44336e+00 8.819   0.9442 
1 1 1 -8  15  17 o 4  1.12253e+01 1.30519e+00 1.62083e+02 256.403 -5.70316e+00 -2.35797e+01 0.00000e+00 0.00000e+00 2.46930e+02 256.403 8.48472e+01 256.403 0.9792 
1 1 1 -8  15  18 o 19 5.28923e+00 1.62292e+00 1.06656e+02 209.849 -5.89098e+00 -3.38051e+00 0.00000e+00 0.00000e+00 7.47842e+01 209.849 3.18714e+01 29.849  0.9231 
1 1 1 -8  15  19 o 19 4.86465e+00 1.63912e+00 4.70139e+01 193.732 -2.79168e+00 -6.82193e-01 0.00000e+00 0.00000e+00 9.74295e+01 193.732 5.04156e+01 193.732 0.8002 
1 1 1 -8  16  1  o 7  3.03976e+01 6.83172e-01 6.06989e+02 352.393 2.38729e+01  -3.18832e+00 0.00000e+00 0.00000e+00 5.15940e+02 352.393 9.10489e+01 172.393 0.9790 
1 1 1 -8  16  2  o 7  2.19675e+01 5.81389e-01 4.28387e+02 190.368 -1.20467e+01 -2.20402e+00 0.00000e+00 0.00000e+00 3.65590e+02 190.368 6.27967e+01 10.368  0.9583 
1 1 1 -8  16  3  o 1  3.37390e+01 7.41111e-01 5.21151e+02 295.341 9.92548e+00  -2.09590e+01 0.00000e+00 0.00000e+00 7.23066e+02 295.341 2.01915e+02 295.341 0.9782 
1 1 1 -8  16  4  o 18 2.61154e+01 6.32403e-01 5.37284e+02 112.156 -8.40061e+00 2.06300e+01  0.00000e+00 0.00000e+00 4.24381e+02 112.156 1.12902e+02 292.156 0.9773 
1 1 1 -8  16  5  o 9  3.31497e+01 7.31579e-01 5.18275e+02 178.894 -3.00043e+01 5.79163e-01  0.00000e+00 0.00000e+00 7.09066e+02 178.894 1.90791e+02 178.894 0.9832 
1 1 1 -8  16  6  o 17 3.66463e+01 9.37178e-01 6.32687e+02 345.152 4.59284e+01  -1.21760e+01 0.00000e+00 0.00000e+00 7.31803e+02 345.152 9.91158e+01 345.152 0.9894 
1 1 1 -8  16  7  o 15 4.15340e+01 1.24539e+00 5.91593e+02 302.292 2.99134e+01  -4.73326e+01 0.00000e+00 0.00000e+00 9.56287e+02 302.292 3.64694e+02 302.292 0.9910 
1 1 1 -8  16  8  o 1  2.31495e+01 6.03605e-01 4.42894e+02 120.677 -1.57393e+01 2.65326e+01  0.00000e+00 0.00000e+00 4.12749e+02 120.677 3.01443e+01 300.677 0.9837 
1 1 1 -8  16  9  o 13 1.37128e+01 6.58562e-01 2.06006e+02 288.027 3.08226e+00  -9.47117e+00 0.00000e+00 0.00000e+00 2.82257e+02 288.027 7.62506e+01 288.027 0.9484 
1 1 1 -8  16  10 o 7  9.12205e+00 7.44669e-01 1.68442e+02 307.510 4.44132e+00  -5.78601e+00 0.00000e+00 0.00000e+00 1.49324e+02 307.510 1.91177e+01 127.510 0.9287 
1 1 1 -8  16  11 o 15 1.37173e+01 5.94479e-01 3.00138e+02 242.538 -1.18604e+01 -2.28209e+01 0.00000e+00 0.00000e+00 2.03812e+02 242.538 9.63268e+01 62.538  0.9804 
1 1 1 -8  16  12 o 10 1.83783e+01 5.16655e-01 3.01111e+02 237.173 -2.39706e+01 -3.71571e+01 0.00000e+00 0.00000e+00 3.79067e+02 237.173 7.79563e+01 237.173 0.9886 
1 1 1 -8  16  13 f 0  4.67989e+00 7.64046e-01 1.14944e+02 148.106 -4.70713e+00 2.92924e+00  0.00000e+00 0.00000e+00 4.33718e+01 148.106 7.15725e+01 328.106 0.9046 
1 1 1 -8  16  14 o 5  1.23083e+01 4.35644e-01 2.51012e+02 347.184 4.16045e+01  -9.46451e+00 0.00000e+00 0.00000e+00 2.03309e+02 347.184 4.77031e+01 167.184 0.9882 
1 1 1 -8  16  15 o 16 4.28759e+00 8.84933e-01 8.35487e+01 64.192  2.06808e+00  4.27656e+00  0.00000e+00 0.00000e+00 5.83737e+01 64.192  2.51750e+01 244.192 0.8873 
1 1 1 -8  16  16 o 12 3.94365e+00 1.18677e+00 6.76868e+01 284.437 8.27190e-01  -3.21318e+00 0.00000e+00 0.00000e+00 5.44193e+01 284.437 1.32675e+01 104.437 0.8310 
1 1 1 -8  16  17 o 3  5.86527e+00 1.54772e+00 7.23800e+01 214.671 -3.97136e+00 -2.74694e+00 0.00000e+00 0.00000e+00 1.21698e+02 214.671 4.93179e+01 214.671 0.8893 
1 1 1 -8  16  18 o 5  4.39831e+00 1.48654e+00 8.51591e+01 43.991  3.46932e+00  3.34924e+00  0.00000e+00 0.00000e+00 6.01487e+01 43.991  2.50104e+01 223.991 0.8891 
1 1 1 -8  16  19 o 10 4.59313e+00 1.57851e+00 5.54622e+01 26.249  3.00633e+00  1.48249e+00  0.00000e+00 0.00000e+00 8.64993e+01 26.249  3.10371e+01 26.249  0.8330 
1 1 1 -8  17  1  o 9  2.07267e+01 5.42751e-01 4.52081e+02 346.885 1.19234e+01  -2.77785e+00 0.00000e+00 0.00000e+00 2.97314e+02 346.885 1.54767e+02 166.885 0.9582 
1 1 1 -8  17  2  o 3  2.58391e+01 6.26450e-01 5.96701e+02 159.068 -1.84680e+01 7.06397e+00  0.00000e+00 0.00000e+00 3.52873e+02 159.068 2.43827e+02 339.068 0.9744 
1 1 1 -8  17  3  o 7  3.96417e+01 9.81952e-01 7.48176e+02 65.369  1.60849e+01  3.50824e+01  0.00000e+00 0.00000e+00 7.26745e+02 65.369  2.14313e+01 245.369 0.9870 
1 1 1 -8  17  4  o 12 3.18702e+01 7.10061e-01 6.27683e+02 232.104 -1.93794e+01 -2.48977e+01 0.00000e+00 0.00000e+00 5.53929e+02 232.104 7.37536e+01 52.104  0.9840 
1 1 1 -8  17  5  o 11 1.69936e+01 5.54142e-01 3.63173e+02 93.446  -6.51079e-01 1.08126e+01  0.00000e+00 0.00000e+00 2.46431e+02 93.446  1.16742e+02 273.446 0.9527 
1 1 1 -8  17  6  o 3  1.30263e+01 5.85167e-01 3.05036e+02 263.802 -8.95830e-01 -8.24944e+00 0.00000e+00 0.00000e+00 1.54587e+02 263.802 1.50449e+02 83.802  0.9377 
1 1 1 -8  17  7  o 4  2.22963e+01 7.39897e-01 5.85726e+02 184.261 -3.45492e+01 -2.57424e+00 0.00000e+00 0.00000e+00 2.40500e+02 184.261 3.45227e+02 4.261   0.9855 
1 1 1 -8  17  8  o 12 1.45021e+01 5.89018e-01 3.11041e+02 133.132 -8.85524e+00 9.45229e+00  0.00000e+00 0.00000e+00 2.12386e+02 133.132 9.86549e+01 313.132 0.9606 
1 1 1 -8  17  9  o 7  2.21953e+01 5.97026e-01 3.79900e+02 39.562  2.24289e+01  1.85296e+01  0.00000e+00 0.00000e+00 4.38916e+02 39.562  5.90156e+01 39.562  0.9827 
1 1 1 -8  17  10 o 11 9.20857e+00 7.48803e-01 2.78836e+02 118.117 -5.73388e+00 1.07307e+01  0.00000e+00 0.00000e+00 5.20503e+01 118.117 2.26786e+02 298.117 0.9580 
1 1 1 -8  17  11 o 8  4.79088e+00 1.00456e+00 7.23370e+01 97.150  -2.49900e-01 1.99220e+00  0.00000e+00 0.00000e+00 5.31610e+01 97.150  1.91759e+01 277.150 0.6991 
1 1 1 -8  17  12 o 12 1.60032e+01 5.06358e-01 2.69252e+02 271.149 6.90358e-01  -3.44258e+01 0.00000e+00 0.00000e+00 3.21049e+02 271.149 5.17974e+01 271.149 0.9854 
1 1 1 -8  17  13 o 7  1.02742e+01 4.90138e-01 1.84186e+02 164.392 -2.00924e+01 5.61304e+00  0.00000e+00 0.00000e+00 1.90678e+02 164.392 6.49201e+00 164.392 0.9757 
1 1 1 -8  17  14 o 5  5.22246e+00 5.72214e-01 1.33935e+02 54.058  5.46620e+00  7.53955e+00  0.00000e+00 0.00000e+00 5.03352e+01 54.058  8.36000e+01 234.058 0.9447 
1 1 1 -8  17  15 o 17 1.10314e+01 1.04529e+00 2.00133e+02 259.216 -5.08535e+00 -2.66987e+01 0.00000e+00 0.00000e+00 2.03755e+02 259.216 3.62194e+00 259.216 0.9814 
1 1 1 -8  17  16 o 19 5.14209e+00 1.31646e+00 1.03498e+02 319.207 4.65479e+00  -4.01691e+00 0.00000e+00 0.00000e+00 7.17254e+01 319.207 3.17731e+01 139.207 0.9146 
1 1 1 -8  17  17 o 3  1.00382e+01 1.51958e+00 1.58785e+02 102.526 -4.00300e+00 1.80180e+01  0.00000e+00 0.00000e+00 2.04458e+02 102.526 4.56734e+01 102.526 0.9725 
1 1 1 -8  17  18 o 10 7.82655e+00 1.99933e+00 8.64218e+01 77.172  1.35382e+00  5.94547e+00  0.00000e+00 0.00000e+00 1.79334e+02 77.172  9.29125e+01 77.172  0.9139 
1 1 1 -8  18  1  o 5  4.99426e+00 7.39441e-01 4.54901e+01 40.607  2.23223e-01  1.91374e-01  0.00000e+00 0.00000e+00 1.80831e+01 220.607 6.35731e+01 220.607 0.1454 
1 1 1 -8  18  2  o 13 2.67071e+01 6.07961e-01 3.77608e+02 199.497 -1.21542e+01 -4.30343e+00 0.00000e+00 0.00000e+00 5.89742e+02 199.497 2.12133e+02 199.497 0.9604 
1 1 1 -8  18  3  o 14 2.45687e+01 6.07757e-01 4.36265e+02 127.564 -8.91109e+00 1.15863e+01  0.00000e+00 0.00000e+00 4.57616e+02 127.564 2.13513e+01 127.564 0.9652 
1 1 1 -8  18  4  o 17 3.58834e+01 1.07862e+00 7.93188e+02 319.806 3.29118e+01  -2.78063e+01 0.00000e+00 0.00000e+00 5.42973e+02 319.806 2.50215e+02 139.806 0.9883 
1 1 1 -8  18  5  o 2  4.81633e+01 9.82581e-01 1.02459e+03 156.413 -7.59270e+01 3.31516e+01  0.00000e+00 0.00000e+00 7.77942e+02 156.413 2.46652e+02 336.413 0.9939 
1 1 1 -8  18  6  o 8  1.53942e+01 6.93444e-01 1.00958e+02 157.085 -3.10208e+00 1.31131e+00  0.00000e+00 0.00000e+00 3.82086e+02 157.085 2.81128e+02 157.085 0.8339 
1 1 1 -8  18  7  o 11 1.09554e+01 6.36865e-01 2.23549e+02 332.919 5.81587e+00  -2.97375e+00 0.00000e+00 0.00000e+00 1.55397e+02 332.919 6.81520e+01 152.919 0.9199 
1 1 1 -8  18  8  o 10 1.48105e+01 5.98436e-01 2.23116e+02 64.462  4.07949e+00  8.53829e+00  0.00000e+00 0.00000e+00 3.03067e+02 64.462  7.99516e+01 64.462  0.9456 
1 1 1 -8  18  9  o 14 1.65612e+01 5.84110e-01 2.21048e+02 262.488 -1.65022e+00 -1.25152e+01 0.00000e+00 0.00000e+00 3.75511e+02 262.488 1.54463e+02 262.488 0.9595 
1 1 1 -8  18  10 o 18 1.71608e+01 5.84542e-01 2.15105e+02 74.760  4.58403e+00  1.68255e+01  0.00000e+00 0.00000e+00 4.09806e+02 74.760  1.94701e+02 74.760  0.9709 
1 1 1 -8  18  11 o 15 8.12465e+00 7.08970e-01 1.13341e+02 325.098 4.62285e+00  -3.22513e+00 0.00000e+00 0.00000e+00 1.62574e+02 325.098 4.92338e+01 325.098 0.9063 
1 1 1 -8  18  12 o 15 1.34843e+01 5.40428e-01 2.48064e+02 243.120 -1.31394e+01 -2.59219e+01 0.00000e+00 0.00000e+00 2.47921e+02 243.120 1.43349e-01 63.120  0.9826 
1 1 1 -8  18  13 o 5  5.00568e+00 7.03360e-01 1.08255e+02 79.398  1.04306e+00  5.57253e+00  0.00000e+00 0.00000e+00 6.14888e+01 79.398  4.67658e+01 259.398 0.9069 
1 1 1 -8  18  14 o 5  4.83961e+00 5.92520e-01 8.75165e+01 334.429 5.05332e+00  -2.41798e+00 0.00000e+00 0.00000e+00 7.61908e+01 334.429 1.13257e+01 154.429 0.9057 
1 1 1 -8  18  15 o 6  3.23088e+00 1.01497e+00 6.03370e+01 312.594 1.62370e+00  -1.76614e+00 0.00000e+00 0.00000e+00 3.04846e+01 312.594 2.98524e+01 132.594 0.7536 
1 1 1 -8  18  16 o 12 3.54544e+00 1.10556e+00 1.32521e+02 66.332  2.66640e+00  6.08349e+00  0.00000e+00 0.00000e+00 1.08255e+01 246.332 1.43346e+02 246.332 0.9213 
1 1 1 -8  18  17 o 8  4.86755e+00 1.34775e+00 1.00421e+02 328.792 5.35953e+00  -3.24682e+00 0.00000e+00 0.00000e+00 6.55277e+01 328.792 3.48931e+01 148.792 0.9163 
1 1 1 -8  18  18 f 0  3.64509e+00 1.74856e+00 9.42019e+01 164.965 -3.53420e+00 9.49274e-01  0.00000e+00 0.00000e+00 2.07834e+01 164.965 7.34185e+01 344.965 0.8490 
1 1 1 -8  19  1  o 3  2.38174e+01 6.95728e-01 3.86340e+02 231.057 -7.39392e+00 -9.14933e+00 0.00000e+00 0.00000e+00 4.73154e+02 231.057 8.68136e+01 231.057 0.9565 
1 1 1 -8  19  2  o 4  2.11692e+01 5.47857e-01 4.25209e+02 223.558 -8.67578e+00 -8.24972e+00 0.00000e+00 0.00000e+00 3.39023e+02 223.558 8.61861e+01 43.558  0.9573 
1 1 1 -8  19  3  o 16 2.82417e+01 6.18838e-01 6.80193e+02 99.050  -4.10598e+00 2.57781e+01  0.00000e+00 0.00000e+00 3.63763e+02 99.050  3.16430e+02 279.050 0.9807 
1 1 1 -8  19  4  o 5  2.41265e+01 5.74916e-01 5.57967e+02 357.410 2.07855e+01  -9.40376e-01 0.00000e+00 0.00000e+00 3.28856e+02 357.410 2.29111e+02 177.410 0.9757 
1 1 1 -8  19  5  o 9  1.80985e+01 5.48176e-01 4.33349e+02 167.689 -1.30995e+01 2.85879e+00  0.00000e+00 0.00000e+00 2.22161e+02 167.689 2.11187e+02 347.689 0.9620 
1 1 1 -8  19  6  o 8  3.14216e+01 7.19359e-01 4.36495e+02 58.440  1.54966e+01  2.52293e+01  0.00000e+00 0.00000e+00 7.25659e+02 58.440  2.89164e+02 58.440  0.9830 
1 1 1 -8  19  7  o 10 5.96540e+00 1.13326e+00 1.14624e+02 67.872  6.56835e-01  1.61535e+00  0.00000e+00 0.00000e+00 3.13676e+01 67.872  8.32559e+01 247.872 0.6509 
1 1 1 -8  19  8  o 2  1.10100e+01 6.53621e-01 1.14833e+02 307.740 2.48225e+00  -3.20705e+00 0.00000e+00 0.00000e+00 2.43230e+02 307.740 1.28397e+02 307.740 0.8656 
1 1 1 -8  19  9  o 16 4.49027e+00 9.93620e-01 1.27193e+02 69.042  7.63994e-01  1.99466e+00  0.00000e+00 0.00000e+00 6.01833e+00 249.042 1.33211e+02 249.042 0.7189 
1 1 1 -8  19  10 o 6  1.08363e+01 6.49440e-01 9.89866e+01 86.526  3.04235e-01  5.01184e+00  0.00000e+00 0.00000e+00 2.64293e+02 86.526  1.65307e+02 86.526  0.8939 
1 1 1 -8  19  11 o 3  8.82386e+00 6.68599e-01 1.49379e+02 340.083 8.38142e+00  -3.03686e+00 0.00000e+00 0.00000e+00 1.62104e+02 340.083 1.27247e+01 340.083 0.9421 
1 1 1 -8  19  12 o 11 2.50383e+00 7.61742e-01 2.56280e+01 81.556  7.80843e-02  5.25998e-01  0.00000e+00 0.00000e+00 1.55102e+00 261.556 2.71790e+01 261.556 0.2569 
1 1 1 -8  19  13 o 12 6.33451e+00 5.88739e-01 1.40374e+02 209.737 -8.17706e+00 -4.67117e+00 0.00000e+00 0.00000e+00 8.35194e+01 209.737 5.68542e+01 29.737  0.9453 
1 1 1 -8  19  14 o 4  1.15856e+01 3.96885e-01 2.17003e+02 305.916 1.92476e+01  -2.65735e+01 0.00000e+00 0.00000e+00 2.09038e+02 305.916 7.96569e+00 125.916 0.9846 
1 1 1 -8  19  15 o 2  7.97374e+00 1.22742e+00 1.54254e+02 212.377 -1.15166e+01 -7.30222e+00 0.00000e+00 0.00000e+00 1.32058e+02 212.377 2.21955e+01 32.377  0.9626 
1 1 1 -8  19  16 o 9  5.07883e+00 1.36086e+00 9.78331e+01 309.487 3.82913e+00  -4.64730e+00 0.00000e+00 0.00000e+00 7.48562e+01 309.487 2.29769e+01 129.487 0.9127 
1 1 1 -8  19  17 o 11 1.07164e+01 1.47022e+00 1.71638e+02 53.112  1.30701e+01  1.74155e+01  0.00000e+00 0.00000e+00 2.17796e+02 53.112  4.61580e+01 53.112  0.9768 
1 1 1 -8  19  18 o 10 8.11614e+00 1.69295e+00 1.65903e+02 31.381  1.27267e+01  7.76265e+00  0.00000e+00 0.00000e+00 1.25340e+02 31.381  4.05635e+01 211.381 0.9659 
1 1 1 -8  20  1  o 18 3.11147e+01 6.64733e-01 5.78002e+02 21.863  2.12753e+01  8.53655e+00  0.00000e+00 0.00000e+00 5.69928e+02 21.863  8.07449e+00 201.863 0.9779 
1 1 1 -8  20  2  o 9  3.45244e+01 7.08354e-01 6.62826e+02 175.601 -3.00759e+01 2.31382e+00  0.00000e+00 0.00000e+00 6.17329e+02 175.601 4.54976e+01 355.601 0.9833 
1 1 1 -8  20  3  o 2  2.54469e+01 5.91122e-01 4.46887e+02 3.924   1.81259e+01  1.24337e+00  0.00000e+00 0.00000e+00 4.85481e+02 3.924   3.85944e+01 3.924   0.9721 
1 1 1 -8  20  4  o 17 1.10912e+01 5.45951e-01 3.81110e+02 225.762 -5.59843e+00 -5.74943e+00 0.00000e+00 0.00000e+00 9.74485e+00 225.762 3.71366e+02 45.762  0.9354 
1 1 1 -8  20  5  o 3  2.28861e+01 7.49602e-01 1.61186e+02 350.132 6.20980e+00  -1.08026e+00 0.00000e+00 0.00000e+00 6.28797e+02 350.132 4.67611e+02 350.132 0.9168 
1 1 1 -8  20  6  o 5  2.22164e+01 5.72558e-01 2.98138e+02 301.136 7.43322e+00  -1.23045e+01 0.00000e+00 0.00000e+00 5.08131e+02 301.136 2.09994e+02 301.136 0.9646 
1 1 1 -8  20  7  o 1  3.31537e+01 8.15994e-01 6.27791e+02 21.548  4.97797e+01  1.96572e+01  0.00000e+00 0.00000e+00 6.07011e+02 21.548  2.07801e+01 201.548 0.9906 
1 1 1 -8  20  8  o 17 1.39057e+01 6.52706e-01 4.14712e+02 201.984 -1.71168e+01 -6.91008e+00 0.00000e+00 0.00000e+00 9.33477e+01 201.984 3.21364e+02 21.984  0.9725 
1 1 1 -8  20  9  o 16 2.51439e+01 6.15620e-01 5.23603e+02 71.578  1.62232e+01  4.87061e+01  0.00000e+00 0.00000e+00 4.10978e+02 71.578  1.12625e+02 251.578 0.9902 
1 1 1 -8  20  10 o 17 3.00468e+01 6.65543e-01 6.01509e+02 228.796 -5.97691e+01 -6.82643e+01 0.00000e+00 0.00000e+00 5.19104e+02 228.796 8.24056e+01 48.796  0.9945 
1 1 1 -8  20  11 f 0  9.00609e+00 6.63796e-01 9.53100e+01 201.425 -5.39900e+00 -2.11858e+00 0.00000e+00 0.00000e+00 2.11457e+02 201.425 1.16147e+02 201.425 0.9091 
1 1 1 -8  20  12 o 13 4.68072e+00 8.72586e-01 8.55444e+01 260.275 -5.44336e-01 -3.17631e+00 0.00000e+00 0.00000e+00 5.90209e+01 260.275 2.65235e+01 80.275  0.8252 
1 1 1 -8  20  13 o 8  5.51386e+00 6.57743e-01 1.01766e+02 238.756 -3.02683e+00 -4.98925e+00 0.00000e+00 0.00000e+00 8.57750e+01 238.756 1.59906e+01 58.756  0.9097 
1 1 1 -8  20  14 o 16 6.37452e+00 6.42255e-01 1.30712e+02 213.623 -8.51689e+00 -5.66363e+00 0.00000e+00 0.00000e+00 9.53876e+01 213.623 3.53248e+01 33.623  0.9498 
1 1 1 -8  20  15 o 19 7.39416e+00 1.30131e+00 1.11111e+02 28.428  8.51823e+00  4.61123e+00  0.00000e+00 0.00000e+00 1.50039e+02 28.428  3.89284e+01 28.428  0.9469 
1 1 1 -8  20  16 o 16 1.90517e+01 1.08000e+00 3.62720e+02 157.789 -8.69022e+01 3.54840e+01  0.00000e+00 0.00000e+00 3.43211e+02 157.789 1.95089e+01 337.789 0.9947 
1 1 1 -8  20  17 o 10 3.53990e+00 1.16107e+00 1.02340e+02 349.916 5.38332e+00  -9.57356e-01 0.00000e+00 0.00000e+00 1.66072e+01 349.916 8.57331e+01 169.916 0.9032 
1 1 1 -8  20  18 o 6  6.37746e+00 1.64318e+00 1.03606e+02 168.726 -7.42343e+00 1.47979e+00  0.00000e+00 0.00000e+00 1.17067e+02 168.726 1.34615e+01 168.726 0.9314 
1 1 1 -8  21  1  o 12 4.14640e+01 8.14905e-01 7.53833e+02 26.018  3.69590e+01  1.80402e+01  0.00000e+00 0.00000e+00 7.91206e+02 26.018  3.73727e+01 26.018  0.9878 
1 1 1 -8  21  2  o 9  4.13255e+01 8.61282e-01 8.05404e+02 168.697 -4.41251e+01 8.81935e+00  0.00000e+00 0.00000e+00 7.35484e+02 168.697 6.99198e+01 348.697 0.9888 
1 1 1 -8  21  3  o 11 1.10208e+01 5.52813e-01 2.08431e+02 17.194  3.49517e+00  1.08155e+00  0.00000e+00 0.00000e+00 1.44214e+02 17.194  6.42164e+01 197.194 0.8490 
1 1 1 -8  21  4  o 16 2.76485e+01 6.09589e-01 5.17460e+02 345.514 2.61337e+01  -6.75194e+00 0.00000e+00 0.00000e+00 5.04578e+02 345.514 1.28815e+01 165.514 0.9813 
1 1 1 -8  21  5  o 2  1.27713e+01 5.29469e-01 2.27686e+02 190.686 -4.91890e+00 -9.28226e-01 0.00000e+00 0.00000e+00 2.01923e+02 190.686 2.57630e+01 10.686  0.8935 
1 1 1 -8  21  6  o 13 2.02197e+01 5.64912e-01 3.50786e+02 318.409 1.17922e+01  -1.04664e+01 0.00000e+00 0.00000e+00 3.85397e+02 318.409 3.46112e+01 318.409 0.9677 
1 1 1 -8  21  7  o 15 2.58217e+01 5.87419e-01 2.56592e+02 100.657 -3.19586e+00 1.69834e+01  0.00000e+00 0.00000e+00 6.85668e+02 100.657 4.29076e+02 100.657 0.9706 
1 1 1 -8  21  8  o 17 1.74240e+01 5.53075e-01 3.19531e+02 239.331 -8.85193e+00 -1.49267e+01 0.00000e+00 0.00000e+00 3.15876e+02 239.331 3.65572e+00 59.331  0.9707 
1 1 1 -8  21  9  o 17 2.26706e+01 5.91683e-01 4.58282e+02 137.339 -3.28459e+01 3.02676e+01  0.00000e+00 0.00000e+00 3.83068e+02 137.339 7.52136e+01 317.339 0.9887 
1 1 1 -8  21  10 o 15 1.95651e+01 5.61621e-01 3.24015e+02 210.650 -2.76427e+01 -1.63805e+01 0.00000e+00 0.00000e+00 3.98183e+02 210.650 7.41686e+01 210.650 0.9843 
1 1 1 -8  21  11 o 6  8.11277e+00 8.39114e-01 2.17247e+02 179.356 -1.19026e+01 1.33704e-01  0.00000e+00 0.00000e+00 7.36333e+01 179.356 1.43614e+02 359.356 0.9570 
1 1 1 -8  21  12 o 7  5.01526e+00 7.98876e-01 1.40719e+02 318.136 4.36665e+00  -3.91307e+00 0.00000e+00 0.00000e+00 3.01246e+01 318.136 1.10594e+02 138.136 0.9102 
1 1 1 -8  21  13 o 18 2.29308e+01 4.85694e-01 4.08929e+02 88.391  2.98768e+00  1.06333e+02  0.00000e+00 0.00000e+00 4.44313e+02 88.391  3.53837e+01 88.391  0.9953 
1 1 1 -8  21  14 o 4  8.53555e+00 7.74068e-01 1.77847e+02 277.386 2.51508e+00  -1.94014e+01 0.00000e+00 0.00000e+00 1.32638e+02 277.386 4.52087e+01 97.386  0.9741 
1 1 1 -8  21  15 o 15 4.94711e+00 1.19712e+00 1.07773e+02 178.245 -6.66146e+00 2.04083e-01  0.00000e+00 0.00000e+00 6.22737e+01 178.245 4.54988e+01 358.245 0.9216 
1 1 1 -8  21  16 o 5  1.39978e+01 1.17381e+00 3.02050e+02 77.231  1.20388e+01  5.31233e+01  0.00000e+00 0.00000e+00 2.14563e+02 77.231  8.74872e+01 257.231 0.9908 
1 1 1 -8  21  17 o 1  4.82547e+00 1.41116e+00 1.14522e+02 299.170 3.44118e+00  -6.16486e+00 0.00000e+00 0.00000e+00 5.17413e+01 299.170 6.27804e+01 119.170 0.9262 
1 1 1 -8  21  18 o 11 4.20317e+00 1.35318e+00 3.27649e+01 4.883   2.03430e+00  1.73789e-01  0.00000e+00 0.00000e+00 7.72392e+01 4.883   4.44743e+01 4.883   0.7045 
1 1 1 -8  22  1  o 4  2.19618e+01 5.60153e-01 4.52109e+02 13.363  1.27683e+01  3.03315e+00  0.00000e+00 0.00000e+00 3.44105e+02 13.363  1.08004e+02 193.363 0.9611 
1 1 1 -8  22  2  o 1  3.14000e+01 8.26478e-01 5.60991e+02 211.114 -2.03431e+01 -1.22788e+01 0.00000e+00 0.00000e+00 5.97785e+02 211.114 3.67944e+01 211.114 0.9787 
1 1 1 -8  22  3  f 0  5.05381e+01 9.59625e-01 1.09817e+03 92.567  -3.79876e+00 8.47379e+01  0.00000e+00 0.00000e+00 7.95245e+02 92.567  3.02923e+02 272.567 0.9941 
1 1 1 -8  22  4  o 16 2.47342e+01 5.79587e-01 4.36708e+02 218.519 -1.48911e+01 -1.18529e+01 0.00000e+00 0.00000e+00 4.70157e+02 218.519 3.34482e+01 218.519 0.9734 
1 1 1 -8  22  5  o 15 2.81106e+01 6.28192e-01 6.57418e+02 177.126 -3.87112e+01 1.94309e+00  0.00000e+00 0.00000e+00 3.87070e+02 177.126 2.70348e+02 357.126 0.9870 
1 1 1 -8  22  6  o 15 2.88664e+01 6.41433e-01 4.67393e+02 195.887 -2.86694e+01 -8.15943e+00 0.00000e+00 0.00000e+00 6.00199e+02 195.887 1.32805e+02 195.887 0.9831 
1 1 1 -8  22  7  o 17 1.95735e+01 5.41695e-01 2.83713e+02 359.592 1.52765e+01  -1.08683e-01 0.00000e+00 0.00000e+00 4.27614e+02 359.592 1.43901e+02 359.592 0.9667 
1 1 1 -8  22  8  o 11 1.35021e+01 6.20194e-01 2.22823e+02 153.343 -8.32404e+00 4.17869e+00  0.00000e+00 0.00000e+00 2.56315e+02 153.343 3.34917e+01 153.343 0.9447 
1 1 1 -8  22  9  o 4  6.56066e+00 1.10224e+00 3.95805e+01 73.657  2.93005e-01  9.99188e-01  0.00000e+00 0.00000e+00 7.38906e+01 73.657  3.43101e+01 73.657  0.4608 
1 1 1 -8  22  10 o 2  2.53287e+01 5.98156e-01 3.51322e+02 89.395  5.10116e-01  4.82771e+01  0.00000e+00 0.00000e+00 5.88578e+02 89.395  2.37257e+02 89.395  0.9896 
1 1 1 -8  22  11 o 13 9.14909e+00 6.36359e-01 1.39531e+02 307.634 5.46265e+00  -7.08471e+00 0.00000e+00 0.00000e+00 1.83450e+02 307.634 4.39187e+01 307.634 0.9423 
1 1 1 -8  22  12 o 3  6.38879e+00 6.92976e-01 9.23851e+01 127.280 -3.04000e+00 3.99345e+00  0.00000e+00 0.00000e+00 1.21322e+02 127.280 2.89366e+01 127.280 0.8938 
1 1 1 -8  22  13 o 1  2.55875e+00 7.23177e-01 5.94595e+01 195.312 -1.56727e+00 -4.29112e-01 0.00000e+00 0.00000e+00 3.76044e-01 195.312 5.90835e+01 15.312  0.6255 
1 1 1 -8  22  14 o 6  5.85999e+00 6.41065e-01 9.25742e+01 270.445 5.68869e-02  -7.31446e+00 0.00000e+00 0.00000e+00 1.10680e+02 270.445 1.81059e+01 270.445 0.9289 
1 1 1 -8  22  15 o 10 7.57961e+00 1.29218e+00 1.45982e+02 154.932 -1.16536e+01 5.45091e+00  0.00000e+00 0.00000e+00 1.25484e+02 154.932 2.04977e+01 334.932 0.9603 
1 1 1 -8  22  16 o 8  4.16152e+00 1.15487e+00 7.26273e+01 268.080 -1.40830e-01 -4.20184e+00 0.00000e+00 0.00000e+00 6.23758e+01 268.080 1.02515e+01 88.080  0.8709 
1 1 1 -8  22  17 o 12 7.06894e+00 1.44869e+00 1.33341e+02 228.524 -7.31571e+00 -8.27601e+00 0.00000e+00 0.00000e+00 1.17412e+02 228.524 1.59286e+01 48.524  0.9536 
1 1 1 -8  22  18 o 3  5.98360e+00 1.64185e+00 1.48593e+02 12.561  1.03864e+01  2.31416e+00  0.00000e+00 0.00000e+00 6.29617e+01 12.561  8.56317e+01 192.561 0.9518 
1 1 1 -8  23  1  o 18 4.76278e+01 9.11653e-01 9.82497e+02 62.596  2.89900e+01  5.59177e+01  0.00000e+00 0.00000e+00 7.99663e+02 62.596  1.82834e+02 242.596 0.9920 
1 1 1 -8  23  2  o 15 2.23293e+01 7.26563e-01 4.21273e+02 119.490 -7.35650e+00 1.30079e+01  0.00000e+00 0.00000e+00 3.91944e+02 119.490 2.93285e+01 299.490 0.9659 
1 1 1 -8  23  3  o 13 1.50227e+01 5.67557e-01 2.32093e+02 293.870 2.18548e+00  -4.93873e+00 0.00000e+00 0.00000e+00 2.78515e+02 293.870 4.64221e+01 293.870 0.9019 
1 1 1 -8  23  4  o 1  6.47840e+00 6.55864e-01 2.43816e+02 307.875 1.69701e+00  -2.18188e+00 0.00000e+00 0.00000e+00 5.08241e+01 127.875 2.94640e+02 127.875 0.7909 
1 1 1 -8  23  5  o 15 1.79036e+01 5.22452e-01 2.93614e+02 158.398 -1.02687e+01 4.06598e+00  0.00000e+00 0.00000e+00 3.49053e+02 158.398 5.54385e+01 158.398 0.9536 
1 1 1 -8  23  6  o 11 2.14348e+01 5.72721e-01 3.99570e+02 10.915  2.05887e+01  3.97047e+00  0.00000e+00 0.00000e+00 3.87298e+02 10.915  1.22718e+01 190.915 0.9759 
1 1 1 -8  23  7  o 18 1.86375e+01 5.31596e-01 4.26250e+02 279.688 3.67286e+00  -2.15142e+01 0.00000e+00 0.00000e+00 2.58107e+02 279.688 1.68143e+02 99.688  0.9768 
1 1 1 -8  23  8  o 9  2.67780e+01 6.03631e-01 4.51833e+02 124.442 -2.18908e+01 3.19208e+01  0.00000e+00 0.00000e+00 5.40913e+02 124.442 8.90803e+01 124.442 0.9870 
1 1 1 -8  23  9  o 16 1.42927e+01 5.99258e-01 1.88035e+02 319.101 8.67720e+00  -7.51627e+00 0.00000e+00 0.00000e+00 3.24446e+02 319.101 1.36410e+02 319.101 0.9554 
1 1 1 -8  23  10 o 19 1.79108e+01 5.65504e-01 4.19814e+02 278.574 6.09213e+00  -4.04064e+01 0.00000e+00 0.00000e+00 2.43506e+02 278.574 1.76308e+02 98.574  0.9877 
1 1 1 -8  23  11 o 1  9.37892e+00 6.36034e-01 1.64668e+02 86.746  6.48498e-01  1.14055e+01  0.00000e+00 0.00000e+00 1.70918e+02 86.746  6.25010e+00 86.746  0.9552 
1 1 1 -8  23  12 o 19 1.02246e+01 5.46123e-01 1.90401e+02 32.101  1.52142e+01  9.54431e+00  0.00000e+00 0.00000e+00 1.81412e+02 32.101  8.98965e+00 212.101 0.9717 
1 1 1 -8  23  13 o 4  6.53461e+00 5.20787e-01 7.41805e+01 177.352 -5.24872e+00 2.42723e-01  0.00000e+00 0.00000e+00 1.45410e+02 177.352 7.12296e+01 177.352 0.8990 
1 1 1 -8  23  14 o 7  3.79116e+00 1.04182e+00 4.21361e+01 282.090 3.71599e-01  -1.73475e+00 0.00000e+00 0.00000e+00 5.08606e+01 282.090 8.72451e+00 282.090 0.6570 
1 1 1 -8  23  15 o 3  9.49393e+00 1.19135e+00 1.41599e+02 3.362   1.64884e+01  9.68751e-01  0.00000e+00 0.00000e+00 2.01568e+02 3.362   5.99689e+01 3.362   0.9692 
1 1 1 -8  23  16 o 8  3.12922e+00 1.02621e+00 4.05866e+01 176.092 -1.89909e+00 1.29716e-01  0.00000e+00 0.00000e+00 3.88162e+01 176.092 1.77040e+00 356.092 0.6813 
1 1 1 -8  23  17 o 4  6.25203e+00 1.55514e+00 1.36820e+02 71.617  2.95294e+00  8.88568e+00  0.00000e+00 0.00000e+00 8.29391e+01 71.617  5.38810e+01 251.617 0.9450 
1 1 1 -8  23  18 o 5  5.54373e+00 1.55831e+00 9.05261e+01 346.073 6.16371e+00  -1.52848e+00 0.00000e+00 0.00000e+00 9.84007e+01 346.073 7.87459e+00 346.073 0.9175 
1 1 1 -8  24  1  o 17 3.86446e+01 7.69658e-01 9.41397e+02 70.346  1.65047e+01  4.62134e+01  0.00000e+00 0.00000e+00 5.01219e+02 70.346  4.40178e+02 250.346 0.9898 
1 1 1 -8  24  2  o 18 3.13261e+01 6.60343e-01 6.54416e+02 152.223 -2.87508e+01 1.51440e+01  0.00000e+00 0.00000e+00 5.08294e+02 152.223 1.46122e+02 332.223 0.9845 
1 1 1 -8  24  3  o 3  3.62428e+01 7.33672e-01 6.18856e+02 123.552 -2.33632e+01 3.52288e+01  0.00000e+00 0.00000e+00 7.30632e+02 123.552 1.11776e+02 123.552 0.9881 
1 1 1 -8  24  4  o 15 2.06759e+01 8.63632e-01 3.50301e+02 242.736 -5.60978e+00 -1.08856e+01 0.00000e+00 0.00000e+00 3.95909e+02 242.736 4.56084e+01 242.736 0.9583 
1 1 1 -8  24  5  o 14 8.30484e+00 1.03548e+00 1.45756e+02 230.108 -1.57889e+00 -1.88888e+00 0.00000e+00 0.00000e+00 9.20634e+01 230.108 5.36923e+01 50.108  0.7608 
1 1 1 -8  24  6  o 18 1.38301e+01 6.19730e-01 1.98718e+02 68.730  2.42749e+00  6.23600e+00  0.00000e+00 0.00000e+00 2.80892e+02 68.730  8.21743e+01 68.730  0.9219 
1 1 1 -8  24  7  o 1  1.69333e+01 5.20850e-01 3.81509e+02 302.831 9.85458e+00  -1.52734e+01 0.00000e+00 0.00000e+00 2.37226e+02 302.831 1.44283e+02 122.831 0.9721 
1 1 1 -8  24  8  o 16 1.98816e+01 5.52787e-01 3.64983e+02 164.497 -2.23842e+01 6.20878e+00  0.00000e+00 0.00000e+00 3.65501e+02 164.497 5.17807e-01 164.497 0.9782 
1 1 1 -8  24  9  o 13 1.57762e+01 5.74938e-01 3.83414e+02 227.123 -1.75774e+01 -1.89305e+01 0.00000e+00 0.00000e+00 1.97053e+02 227.123 1.86362e+02 47.123  0.9804 
1 1 1 -8  24  10 o 1  1.33700e+01 5.78080e-01 2.42142e+02 118.195 -9.13852e+00 1.70472e+01  0.00000e+00 0.00000e+00 2.46014e+02 118.195 3.87224e+00 118.195 0.9738 
1 1 1 -8  24  11 f 0  1.45621e+01 5.49797e-01 3.40545e+02 201.765 -3.44830e+01 -1.37678e+01 0.00000e+00 0.00000e+00 1.97521e+02 201.765 1.43024e+02 21.765  0.9864 
1 1 1 -8  24  12 o 11 2.16020e+01 5.49265e-01 3.98726e+02 88.699  1.79915e+00  7.92276e+01  0.00000e+00 0.00000e+00 4.04490e+02 88.699  5.76350e+00 88.699  0.9937 
1 1 1 -8  24  13 o 10 1.95507e+00 6.18910e-01 8.72670e+01 303.490 9.96419e-01  -1.50597e+00 0.00000e+00 0.00000e+00 3.88050e+01 123.490 1.26072e+02 123.490 0.6632 
1 1 1 -8  24  14 o 10 8.41265e+00 1.11984e+00 1.52482e+02 206.813 -1.22720e+01 -6.20248e+00 0.00000e+00 0.00000e+00 1.49965e+02 206.813 2.51749e+00 26.813  0.9629 
1 1 1 -8  24  15 o 15 5.52656e+00 1.24185e+00 1.03785e+02 82.606  8.86684e-01  6.83237e+00  0.00000e+00 0.00000e+00 8.66988e+01 82.606  1.70862e+01 262.606 0.9243 
1 1 1 -8  24  16 o 4  1.11564e+01 1.26880e+00 1.80618e+02 177.109 -2.60372e+01 1.31491e+00  0.00000e+00 0.00000e+00 2.26836e+02 177.109 4.62180e+01 177.109 0.9806 
1 1 1 -8  24  17 o 16 4.33427e+00 1.36206e+00 1.03072e+02 176.672 -5.75375e+00 3.34573e-01  0.00000e+00 0.00000e+00 4.33891e+01 176.672 5.96827e+01 356.672 0.9085 
1 1 1 -8  24  18 o 8  4.80862e+00 1.49879e+00 1.06314e+02 61.697  3.20202e+00  5.94610e+00  0.00000e+00 0.00000e+00 5.84773e+01 61.697  4.78365e+01 241.697 0.9227 
1 1 1 -8  25  1  o 7  4.15015e+01 8.14040e-01 7.08673e+02 170.167 -4.56929e+01 7.91962e+00  0.00000e+00 0.00000e+00 8.39550e+02 170.167 1.30876e+02 170.167 0.9892 
1 1 1 -8  25  2  o 19 1.89319e+01 5.15207e-01 3.27750e+02 11.944  9.44447e+00  1.99787e+00  0.00000e+00 0.00000e+00 3.47913e+02 11.944  2.01632e+01 11.944  0.9467 
1 1 1 -8  25  3  o 16 3.20108e+01 6.76852e-01 4.32101e+02 211.617 -2.21659e+01 -1.36454e+01 0.00000e+00 0.00000e+00 7.50685e+02 211.617 3.18584e+02 211.617 0.9806 
1 1 1 -8  25  4  o 11 1.30702e+01 5.71690e-01 1.41617e+02 318.533 2.36699e+00  -2.09172e+00 0.00000e+00 0.00000e+00 2.62537e+02 318.533 1.20920e+02 318.533 0.8211 
1 1 1 -8  25  5  o 14 1.53798e+01 5.92500e-01 1.94499e+02 235.596 -3.52453e+00 -5.14675e+00 0.00000e+00 0.00000e+00 3.35685e+02 235.596 1.41186e+02 235.596 0.9159 
1 1 1 -8  25  6  o 7  2.42498e+01 5.89188e-01 4.86114e+02 13.535  2.75529e+01  6.63246e+00  0.00000e+00 0.00000e+00 4.09758e+02 13.535  7.63565e+01 193.535 0.9822 
1 1 1 -8  25  7  o 1  1.82248e+01 5.71238e-01 4.10368e+02 139.991 -1.73519e+01 1.45648e+01  0.00000e+00 0.00000e+00 2.59336e+02 139.991 1.51031e+02 319.991 0.9777 
1 1 1 -8  25  8  o 4  3.08374e+01 6.36274e-01 3.77794e+02 229.267 -2.49720e+01 -2.89988e+01 0.00000e+00 0.00000e+00 7.65123e+02 229.267 3.87329e+02 229.267 0.9868 
1 1 1 -8  25  9  o 6  3.06792e+01 6.41884e-01 5.61717e+02 337.219 6.94764e+01  -2.91776e+01 0.00000e+00 0.00000e+00 5.81859e+02 337.219 2.01414e+01 337.219 0.9933 
1 1 1 -8  25  10 f 0  1.31903e+01 5.75990e-01 3.97197e+02 240.766 -1.52558e+01 -2.72586e+01 0.00000e+00 0.00000e+00 8.93417e+01 240.766 3.07855e+02 60.766  0.9839 
1 1 1 -8  25  11 o 14 5.59705e+00 8.33748e-01 1.33363e+02 21.559  4.95502e+00  1.95771e+00  0.00000e+00 0.00000e+00 5.54092e+01 21.559  7.79539e+01 201.559 0.9005 
1 1 1 -8  25  12 o 9  1.22484e+01 5.17942e-01 2.24161e+02 53.025  1.52743e+01  2.02883e+01  0.00000e+00 0.00000e+00 2.25020e+02 53.025  8.59786e-01 53.025  0.9801 
1 1 1 -8  25  13 o 19 2.20826e+00 6.46958e-01 1.13021e+02 209.749 -2.40703e+00 -1.37570e+00 0.00000e+00 0.00000e+00 4.76817e+01 29.749  1.60703e+02 29.749  0.7916 
1 1 1 -8  25  14 o 8  3.41018e+00 1.02505e+00 8.02882e+01 60.935  1.57670e+00  2.83691e+00  0.00000e+00 0.00000e+00 2.49516e+01 60.935  5.53366e+01 240.935 0.8266 
1 1 1 -8  25  15 f 0  5.89516e+00 1.28442e+00 1.19656e+02 305.346 4.78220e+00  -6.74258e+00 0.00000e+00 0.00000e+00 8.64042e+01 305.346 3.32516e+01 125.346 0.9374 
1 1 1 -8  25  16 o 9  6.57263e+00 1.49156e+00 1.62582e+02 46.190  8.32898e+00  8.68234e+00  0.00000e+00 0.00000e+00 7.17843e+01 46.190  9.07979e+01 226.190 0.9575 
1 1 1 -8  25  17 o 18 6.65154e+00 1.50393e+00 1.28143e+02 110.600 -3.52204e+00 9.37025e+00  0.00000e+00 0.00000e+00 1.06534e+02 110.600 2.16092e+01 290.600 0.9487 
1 1 1 -8  25  18 o 6  6.22585e+00 1.66534e+00 6.12026e+01 289.384 1.48447e+00  -4.21924e+00 0.00000e+00 0.00000e+00 1.42166e+02 289.384 8.09635e+01 289.384 0.8795 
1 1 1 -8  26  1  o 15 4.61529e+01 8.89533e-01 7.37300e+02 230.542 -3.31706e+01 -4.02993e+01 0.00000e+00 0.00000e+00 9.86440e+02 230.542 2.49140e+02 230.542 0.9904 
1 1 1 -8  26  2  o 11 5.56222e+01 1.18478e+00 8.57321e+02 76.692  1.64546e+01  6.95634e+01  0.00000e+00 0.00000e+00 1.22469e+03 76.692  3.67366e+02 76.692  0.9930 
1 1 1 -8  26  3  o 12 4.05112e+01 9.04291e-01 8.08132e+02 138.757 -4.26851e+01 3.74249e+01  0.00000e+00 0.00000e+00 7.04741e+02 138.757 1.03391e+02 318.757 0.9912 
1 1 1 -8  26  4  o 4  2.59084e+01 6.75029e-01 6.19474e+02 75.494  6.88696e+00  2.66192e+01  0.00000e+00 0.00000e+00 3.38268e+02 75.494  2.81206e+02 255.494 0.9816 
1 1 1 -8  26  5  o 7  1.67497e+01 6.08036e-01 3.23263e+02 29.372  1.02494e+01  5.76857e+00  0.00000e+00 0.00000e+00 2.79692e+02 29.372  4.35709e+01 209.372 0.9565 
1 1 1 -8  26  6  o 3  2.63427e+01 6.09394e-01 4.93119e+02 269.009 -6.00849e-01 -3.47510e+01 0.00000e+00 0.00000e+00 4.83286e+02 269.009 9.83301e+00 89.009  0.9855 
1 1 1 -8  26  7  o 4  2.60305e+01 7.61984e-01 4.01438e+02 173.956 -3.09331e+01 3.27511e+00  0.00000e+00 0.00000e+00 5.61023e+02 173.956 1.59585e+02 173.956 0.9838 
1 1 1 -8  26  8  o 3  1.65627e+01 5.52052e-01 2.91203e+02 181.311 -1.58947e+01 -3.63743e-01 0.00000e+00 0.00000e+00 3.10902e+02 181.311 1.96993e+01 181.311 0.9680 
1 1 1 -8  26  9  o 1  8.07054e+00 7.43133e-01 9.65315e+01 348.826 3.29640e+00  -6.51166e-01 0.00000e+00 0.00000e+00 1.55859e+02 348.826 5.93274e+01 348.826 0.8334 
1 1 1 -8  26  10 o 19 1.51117e+01 5.93478e-01 1.99694e+02 142.701 -1.37102e+01 1.04439e+01  0.00000e+00 0.00000e+00 3.50133e+02 142.701 1.50438e+02 142.701 0.9705 
1 1 1 -8  26  11 o 7  3.19963e+00 8.83705e-01 1.21673e+02 185.948 -2.72782e+00 -2.84182e-01 0.00000e+00 0.00000e+00 2.71239e+01 5.948   1.48797e+02 5.948   0.7890 
1 1 1 -8  26  12 o 19 7.21225e+00 6.78554e-01 7.48545e+01 95.940  -4.99919e-01 4.80499e+00  0.00000e+00 0.00000e+00 1.65117e+02 95.940  9.02621e+01 95.940  0.8893 
1 1 1 -8  26  13 o 13 8.14339e+00 4.25261e-01 1.18130e+02 0.242   1.05075e+01  4.44621e-02  0.00000e+00 0.00000e+00 1.71351e+02 0.242   5.32212e+01 0.242   0.9512 
1 1 1 -8  26  14 o 14 3.73970e+00 1.08613e+00 1.47770e+02 182.364 -6.35610e+00 -2.62385e-01 0.00000e+00 0.00000e+00 1.96632e+01 2.364   1.67433e+02 2.364   0.9176 
1 1 1 -8  26  15 o 3  3.83706e+00 1.10094e+00 5.02789e+01 260.826 -3.95981e-01 -2.45188e+00 0.00000e+00 0.00000e+00 5.89106e+01 260.826 8.63163e+00 260.826 0.7632 
1 1 1 -8  26  16 o 8  4.05112e+00 1.24452e+00 9.64658e+01 125.708 -3.04526e+00 4.23669e+00  0.00000e+00 0.00000e+00 3.90329e+01 125.708 5.74329e+01 305.708 0.8982 
1 1 1 -8  26  17 f 0  6.27164e+00 1.55605e+00 8.27911e+01 151.913 -5.26245e+00 2.80835e+00  0.00000e+00 0.00000e+00 1.29874e+02 151.913 4.70834e+01 151.913 0.9118 
1 1 1 -8  26  18 o 17 5.98060e+00 1.73135e+00 1.36375e+02 351.443 8.92687e+00  -1.34318e+00 0.00000e+00 0.00000e+00 7.30383e+01 351.443 6.33364e+01 171.443 0.9429 
1 1 1 -8  27  1  o 14 2.96755e+01 8.46326e-01 4.06073e+02 156.746 -1.69407e+01 7.27979e+00  0.00000e+00 0.00000e+00 6.82172e+02 156.746 2.76099e+02 156.746 0.9725 
1 1 1 -8  27  2  f 0  1.46766e+01 5.15207e-01 4.74060e+02 96.454  -1.48497e+00 1.31261e+01  0.00000e+00 0.00000e+00 5.77776e+01 96.454  4.16283e+02 276.454 0.9614 
1 1 1 -8  27  3  o 1  1.92757e+01 5.26452e-01 3.77894e+02 66.465  5.11181e+00  1.17367e+01  0.00000e+00 0.00000e+00 3.19354e+02 66.465  5.85404e+01 246.465 0.9601 
1 1 1 -8  27  4  o 18 1.74374e+01 5.97271e-01 3.50006e+02 153.135 -1.14433e+01 5.79668e+00  0.00000e+00 0.00000e+00 2.80462e+02 153.135 6.95443e+01 333.135 0.9602 
1 1 1 -8  27  5  o 14 1.91525e+01 5.35237e-01 3.94158e+02 319.621 1.28224e+01  -1.09046e+01 0.00000e+00 0.00000e+00 3.04849e+02 319.621 8.93086e+01 139.621 0.9698 
1 1 1 -8  27  6  o 4  2.21456e+01 5.36079e-01 3.12474e+02 202.855 -1.70892e+01 -7.20307e+00 0.00000e+00 0.00000e+00 4.97596e+02 202.855 1.85123e+02 202.855 0.9727 
1 1 1 -8  27  7  o 19 7.66511e+00 6.79724e-01 7.98468e+01 136.244 -1.26181e+00 1.20816e+00  0.00000e+00 0.00000e+00 1.07831e+02 136.244 2.79844e+01 136.244 0.6515 
1 1 1 -8  27  8  o 15 2.34397e+01 5.63877e-01 3.22782e+02 58.881  1.39203e+01  2.30583e+01  0.00000e+00 0.00000e+00 5.40914e+02 58.881  2.18132e+02 58.881  0.9813 
1 1 1 -8  27  9  o 12 1.64185e+01 6.09070e-01 3.88928e+02 251.696 -9.18577e+00 -2.77692e+01 0.00000e+00 0.00000e+00 2.16465e+02 251.696 1.72463e+02 71.696  0.9828 
1 1 1 -8  27  10 o 15 3.19629e+01 6.53802e-01 6.13409e+02 184.169 -1.11643e+02 -8.13699e+00 0.00000e+00 0.00000e+00 5.79386e+02 184.169 3.40237e+01 4.169   0.9955 
1 1 1 -8  27  11 o 12 5.70239e+00 8.28602e-01 1.72759e+02 66.588  2.73984e+00  6.32777e+00  0.00000e+00 0.00000e+00 2.46375e+01 66.588  1.48122e+02 246.588 0.9243 
1 1 1 -8  27  12 o 8  7.29554e+00 6.64358e-01 1.20953e+02 336.981 7.27977e+00  -3.09295e+00 0.00000e+00 0.00000e+00 1.34096e+02 336.981 1.31432e+01 336.981 0.9345 
1 1 1 -8  27  13 o 9  1.52810e+01 3.94407e-01 3.20370e+02 145.917 -4.44270e+01 3.00602e+01  0.00000e+00 0.00000e+00 2.45345e+02 145.917 7.50248e+01 325.917 0.9906 
1 1 1 -8  27  14 o 13 9.82204e+00 1.04310e+00 1.44690e+02 173.434 -1.66659e+01 1.91835e+00  0.00000e+00 0.00000e+00 2.10845e+02 173.434 6.61547e+01 173.434 0.9697 
1 1 1 -8  27  15 o 12 6.61494e+00 1.32984e+00 9.71098e+01 21.769  6.76969e+00  2.70345e+00  0.00000e+00 0.00000e+00 1.31913e+02 21.769  3.48029e+01 21.769  0.9286 
1 1 1 -8  27  16 o 14 4.50955e+00 1.25276e+00 4.48755e+01 40.614  1.95289e+00  1.67466e+00  0.00000e+00 0.00000e+00 8.48675e+01 40.614  3.99920e+01 40.614  0.7727 
1 1 1 -8  27  17 o 2  6.08272e+00 1.51978e+00 6.87995e+01 254.936 -1.29323e+00 -4.80495e+00 0.00000e+00 0.00000e+00 1.33150e+02 254.936 6.43504e+01 254.936 0.8928 
1 1 1 -8  27  18 o 2  4.37997e+00 1.40515e+00 1.03924e+02 210.302 -5.50282e+00 -3.21589e+00 0.00000e+00 0.00000e+00 4.53533e+01 210.302 5.85710e+01 30.302  0.9178 
1 1 1 -8  28  1  o 10 8.54705e+00 8.00564e-01 8.45990e+01 152.464 -1.20210e+00 6.26740e-01  0.00000e+00 0.00000e+00 9.53518e+01 152.464 1.07527e+01 152.464 0.5584 
1 1 1 -8  28  2  o 19 1.88425e+01 5.31226e-01 2.99015e+02 122.242 -5.31353e+00 8.42392e+00  0.00000e+00 0.00000e+00 3.74507e+02 122.242 7.54916e+01 122.242 0.9484 
1 1 1 -8  28  3  f 0  2.90758e+01 6.38788e-01 5.65365e+02 75.028  7.24752e+00  2.71012e+01  0.00000e+00 0.00000e+00 5.10287e+02 75.028  5.50776e+01 255.028 0.9820 
1 1 1 -8  28  4  o 2  2.73850e+01 8.04837e-01 4.18409e+02 23.438  2.17631e+01  9.43494e+00  0.00000e+00 0.00000e+00 5.90724e+02 23.438  1.72315e+02 23.438  0.9787 
1 1 1 -8  28  5  o 13 1.35456e+01 6.04027e-01 3.00122e+02 99.135  -1.43003e+00 8.89345e+00  0.00000e+00 0.00000e+00 1.80410e+02 99.135  1.19712e+02 279.135 0.9427 
1 1 1 -8  28  6  o 10 2.99157e+01 7.58738e-01 4.82501e+02 153.048 -3.32289e+01 1.68960e+01  0.00000e+00 0.00000e+00 6.27283e+02 153.048 1.44781e+02 153.048 0.9865 
1 1 1 -8  28  7  o 13 3.09006e+01 6.86922e-01 6.58411e+02 22.440  5.34708e+01  2.20830e+01  0.00000e+00 0.00000e+00 4.92687e+02 22.440  1.65724e+02 202.440 0.9913 
1 1 1 -8  28  8  o 3  2.08764e+01 5.49837e-01 3.37791e+02 100.806 -4.58031e+00 2.39972e+01  0.00000e+00 0.00000e+00 4.29873e+02 100.806 9.20819e+01 100.806 0.9793 
1 1 1 -8  28  9  o 9  7.15692e+00 9.84963e-01 1.81446e+02 162.241 -5.67036e+00 1.81609e+00  0.00000e+00 0.00000e+00 6.33349e+01 162.241 1.18111e+02 342.241 0.9116 
1 1 1 -8  28  10 o 16 3.09566e+01 6.47440e-01 5.15096e+02 45.428  6.38137e+01  6.47735e+01  0.00000e+00 0.00000e+00 6.38855e+02 45.428  1.23759e+02 45.428  0.9945 
1 1 1 -8  28  11 o 17 1.80879e+01 5.39308e-01 3.41861e+02 247.333 -1.85906e+01 -4.45144e+01 0.00000e+00 0.00000e+00 3.28418e+02 247.333 1.34433e+01 67.333  0.9896 
1 1 1 -8  28  12 o 11 1.26521e+01 5.20646e-01 2.49824e+02 1.818   3.08271e+01  9.78631e-01  0.00000e+00 0.00000e+00 2.15737e+02 1.818   3.40864e+01 181.818 0.9837 
1 1 1 -8  28  13 o 1  4.33706e+00 4.91577e-01 9.42396e+01 198.736 -4.53796e+00 -1.53917e+00 0.00000e+00 0.00000e+00 4.97282e+01 198.736 4.45114e+01 18.736  0.8883 
1 1 1 -8  28  14 o 6  8.77378e+00 1.11639e+00 1.83423e+02 240.375 -9.36124e+00 -1.64622e+01 0.00000e+00 0.00000e+00 1.35292e+02 240.375 4.81315e+01 60.375  0.9732 
1 1 1 -8  28  15 o 9  1.30542e+01 1.05889e+00 2.42381e+02 175.639 -4.16784e+01 3.17824e+00  0.00000e+00 0.00000e+00 2.38423e+02 175.639 3.95790e+00 355.639 0.9880 
1 1 1 -8  28  16 o 1  1.09142e+01 1.35804e+00 1.84303e+02 354.366 2.38670e+01  -2.35454e+00 0.00000e+00 0.00000e+00 2.13497e+02 354.366 2.91936e+01 354.366 0.9789 
1 1 1 -8  28  17 o 10 4.83380e+00 1.42927e+00 1.25532e+02 219.886 -5.87696e+00 -4.91155e+00 0.00000e+00 0.00000e+00 4.20232e+01 219.886 8.35089e+01 39.887  0.9322 
1 1 1 -8  28  18 o 6  7.60610e+00 1.74669e+00 1.38786e+02 41.885  8.64654e+00  7.75400e+00  0.00000e+00 0.00000e+00 1.31193e+02 41.885  7.59336e+00 221.885 0.9559 
1 1 1 -8  29  1  o 18 2.95768e+01 6.49339e-01 4.82709e+02 243.931 -1.10461e+01 -2.25786e+01 0.00000e+00 0.00000e+00 6.10013e+02 243.931 1.27304e+02 243.931 0.9799 
1 1 1 -8  29  2  o 7  1.75961e+01 5.69730e-01 3.00056e+02 237.408 -4.99655e+00 -7.81519e+00 0.00000e+00 0.00000e+00 3.26260e+02 237.408 2.62039e+01 237.408 0.9445 
1 1 1 -8  29  3  o 10 2.89765e+01 8.26486e-01 4.35733e+02 54.966  1.23409e+01  1.76024e+01  0.00000e+00 0.00000e+00 6.30097e+02 54.966  1.94364e+02 54.966  0.9765 
1 1 1 -8  29  4  o 15 3.67596e+01 7.39591e-01 5.31749e+02 251.018 -1.31874e+01 -3.83392e+01 0.00000e+00 0.00000e+00 8.35048e+02 251.018 3.03299e+02 251.018 0.9876 
1 1 1 -8  29  5  o 14 2.53002e+01 5.91265e-01 5.09297e+02 170.282 -3.10728e+01 5.32119e+00  0.00000e+00 0.00000e+00 4.27447e+02 170.282 8.18505e+01 350.282 0.9840 
1 1 1 -8  29  6  o 3  5.55591e+00 8.31048e-01 1.47851e+02 303.232 1.21478e+00  -1.85408e+00 0.00000e+00 0.00000e+00 4.72297e+00 303.232 1.43128e+02 123.232 0.7303 
1 1 1 -8  29  7  o 5  1.85754e+01 7.19833e-01 2.88361e+02 306.021 1.00289e+01  -1.37927e+01 0.00000e+00 0.00000e+00 3.88823e+02 306.021 1.00462e+02 306.021 0.9702 
1 1 1 -8  29  8  o 13 4.74196e+00 9.24950e-01 3.39022e+01 245.993 -2.18186e-01 -4.89885e-01 0.00000e+00 0.00000e+00 1.21993e+01 245.993 2.17029e+01 65.993  0.2589 
1 1 1 -8  29  9  o 3  1.73653e+01 5.49064e-01 1.74339e+02 53.778  8.68312e+00  1.18545e+01  0.00000e+00 0.00000e+00 4.54531e+02 53.778  2.80192e+02 53.778  0.9654 
1 1 1 -8  29  10 o 6  2.10307e+01 6.05720e-01 3.49840e+02 84.150  4.58252e+00  4.47239e+01  0.00000e+00 0.00000e+00 4.29579e+02 84.150  7.97384e+01 84.150  0.9888 
1 1 1 -8  29  11 o 19 1.50549e+01 5.40125e-01 2.71709e+02 254.672 -8.41642e+00 -3.07063e+01 0.00000e+00 0.00000e+00 2.83082e+02 254.672 1.13738e+01 254.672 0.9842 
1 1 1 -8  29  12 o 16 4.62132e+00 8.41026e-01 1.32518e+02 22.035  5.18843e+00  2.09993e+00  0.00000e+00 0.00000e+00 2.40289e+01 22.035  1.08489e+02 202.035 0.9056 
1 1 1 -8  29  13 o 15 5.61699e+00 8.16933e-01 2.70400e+01 44.119  1.22473e+00  1.18765e+00  0.00000e+00 0.00000e+00 1.07931e+02 44.119  8.08913e+01 44.119  0.6431 
1 1 1 -8  29  14 o 2  7.44844e+00 1.17932e+00 1.12469e+02 210.211 -8.24962e+00 -4.80354e+00 0.00000e+00 0.00000e+00 1.50534e+02 210.211 3.80650e+01 210.211 0.9461 
1 1 1 -8  29  15 o 9  4.65234e+00 1.26360e+00 4.93748e+01 236.946 -1.48262e+00 -2.27831e+00 0.00000e+00 0.00000e+00 8.70749e+01 236.946 3.77001e+01 236.946 0.7868 
1 1 1 -8  29  16 o 4  5.31615e+00 1.41499e+00 7.92603e+01 185.354 -5.12609e+00 -4.80386e-01 0.00000e+00 0.00000e+00 9.82177e+01 185.354 1.89573e+01 185.354 0.8967 
1 1 1 -8  29  17 o 15 6.76336e+00 1.62542e+00 9.19690e+01 358.419 6.94452e+00  -1.91625e-01 0.00000e+00 0.00000e+00 1.40619e+02 358.419 4.86503e+01 358.419 0.9249 
1 1 1 -8  29  18 o 9  4.56529e+00 1.45566e+00 4.42101e+01 99.239  -4.57190e-01 2.81072e+00  0.00000e+00 0.00000e+00 9.10632e+01 99.239  4.68532e+01 99.239  0.7981 
1 1 1 -8  30  1  o 5  4.08158e+01 7.73680e-01 5.92698e+02 167.362 -4.11150e+01 9.21867e+00  0.00000e+00 0.00000e+00 9.27682e+02 167.362 3.34985e+02 167.362 0.9881 
1 1 1 -8  30  2  o 9  2.90458e+01 6.37508e-01 3.61873e+02 13.139  1.74854e+01  4.08143e+00  0.00000e+00 0.00000e+00 7.01766e+02 13.139  3.39893e+02 13.139  0.9717 
1 1 1 -8  30  3  o 5  9.52701e+00 6.32893e-01 2.14669e+02 356.328 3.49870e+00  -2.24543e-01 0.00000e+00 0.00000e+00 8.72696e+01 356.328 1.27400e+02 176.328 0.8414 
1 1 1 -8  30  4  o 1  1.72963e+01 5.17679e-01 3.23921e+02 8.869   1.20974e+01  1.88775e+00  0.00000e+00 0.00000e+00 3.00032e+02 8.869   2.38895e+01 188.869 0.9583 
1 1 1 -8  30  5  o 2  1.97369e+01 6.30385e-01 2.51662e+02 124.727 -6.80049e+00 9.81137e+00  0.00000e+00 0.00000e+00 4.59095e+02 124.727 2.07433e+02 124.727 0.9572 
1 1 1 -8  30  6  o 6  1.07424e+01 6.04625e-01 1.40974e+02 44.856  2.93812e+00  2.92337e+00  0.00000e+00 0.00000e+00 2.09964e+02 44.856  6.89899e+01 44.856  0.8689 
1 1 1 -8  30  7  o 15 1.04337e+01 5.83165e-01 1.93761e+02 11.018  6.16819e+00  1.20096e+00  0.00000e+00 0.00000e+00 1.65542e+02 11.018  2.82183e+01 191.018 0.9166 
1 1 1 -8  30  8  o 8  1.32855e+01 5.45671e-01 1.63028e+02 85.923  6.04314e-01  8.47771e+00  0.00000e+00 0.00000e+00 3.05412e+02 85.923  1.42384e+02 85.923  0.9392 
1 1 1 -8  30  9  o 7  3.64102e+00 9.43520e-01 7.85568e+01 11.245  1.26344e+00  2.51209e-01  0.00000e+00 0.00000e+00 4.90776e+00 191.245 8.34645e+01 191.245 0.5392 
1 1 1 -8  30  10 o 2  9.54428e+00 6.29218e-01 1.74303e+02 323.294 8.28639e+00  -6.17774e+00 0.00000e+00 0.00000e+00 1.65619e+02 323.294 8.68403e+00 143.294 0.9503 
1 1 1 -8  30  11 o 8  1.01309e+01 5.89317e-01 2.09365e+02 278.551 2.63647e+00  -1.75349e+01 0.00000e+00 0.00000e+00 1.59092e+02 278.551 5.02725e+01 98.551  0.9714 
1 1 1 -8  30  12 o 11 9.00327e+00 5.50209e-01 1.54488e+02 198.284 -1.29484e+01 -4.27822e+00 0.00000e+00 0.00000e+00 1.69666e+02 198.284 1.51787e+01 198.284 0.9626 
1 1 1 -8  30  13 o 9  1.11231e+01 5.84314e-01 1.61293e+02 221.827 -1.60878e+01 -1.43980e+01 0.00000e+00 0.00000e+00 2.44546e+02 221.827 8.32534e+01 221.827 0.9766 
1 1 1 -8  30  14 o 7  1.00538e+01 1.12154e+00 2.14042e+02 126.582 -1.43915e+01 1.93908e+01  0.00000e+00 0.00000e+00 1.53306e+02 126.582 6.07361e+01 306.582 0.9791 
1 1 1 -8  30  15 o 3  4.60540e+00 1.26027e+00 6.95133e+01 159.410 -3.54782e+00 1.33286e+00  0.00000e+00 0.00000e+00 7.72459e+01 159.410 7.73261e+00 159.410 0.8549 
1 1 1 -8  30  16 o 6  5.22028e+00 1.41274e+00 8.83212e+01 248.395 -2.14424e+00 -5.41448e+00 0.00000e+00 0.00000e+00 8.84312e+01 248.395 1.09979e-01 248.395 0.9095 
1 1 1 -8  30  17 o 1  6.17055e+00 1.61488e+00 1.04067e+02 22.525  6.73860e+00  2.79467e+00  0.00000e+00 0.00000e+00 1.08978e+02 22.525  4.91030e+00 22.525  0.9287 
1 1 1 -8  30  18 o 19 4.19312e+00 1.35817e+00 5.54148e+01 233.721 -2.08805e+00 -2.84471e+00 0.00000e+00 0.00000e+00 7.57534e+01 233.721 2.03386e+01 233.721 0.8426 
1 1 1 -8  31  1  o 1  4.28838e+01 9.00764e-01 7.88442e+02 311.055 3.74554e+01  -4.30046e+01 0.00000e+00 0.00000e+00 8.13900e+02 311.055 2.54587e+01 311.055 0.9912 
1 1 1 -8  31  2  o 17 2.12369e+01 7.05265e-01 3.77665e+02 312.290 9.24787e+00  -1.01669e+01 0.00000e+00 0.00000e+00 3.92878e+02 312.290 1.52130e+01 312.290 0.9629 
1 1 1 -8  31  3  o 7  1.90918e+01 5.29351e-01 4.44409e+02 137.246 -1.30970e+01 1.21084e+01  0.00000e+00 0.00000e+00 2.54192e+02 137.246 1.90217e+02 317.246 0.9716 
1 1 1 -8  31  4  o 12 2.78066e+01 7.11986e-01 3.52364e+02 0.892   2.11223e+01  3.28859e-01  0.00000e+00 0.00000e+00 6.69279e+02 0.892   3.16916e+02 0.892   0.9760 
1 1 1 -8  31  5  o 5  2.23546e+01 5.64369e-01 3.46701e+02 152.074 -1.64717e+01 8.73085e+00  0.00000e+00 0.00000e+00 4.71417e+02 152.074 1.24716e+02 152.074 0.9728 
1 1 1 -8  31  6  o 8  1.30800e+01 5.18667e-01 1.43519e+02 292.704 2.03848e+00  -4.87226e+00 0.00000e+00 0.00000e+00 2.98826e+02 292.704 1.55307e+02 292.704 0.8995 
1 1 1 -8  31  7  o 17 1.37805e+01 5.37216e-01 3.20869e+02 333.906 1.27708e+01  -6.25474e+00 0.00000e+00 0.00000e+00 1.78298e+02 333.906 1.42571e+02 153.906 0.9642 
1 1 1 -8  31  8  o 12 7.95383e+00 6.88763e-01 1.00954e+02 190.453 -3.35863e+00 -6.19623e-01 0.00000e+00 0.00000e+00 1.48827e+02 190.453 4.78731e+01 190.453 0.8366 
1 1 1 -8  31  9  o 8  1.29567e+01 5.76790e-01 3.03387e+02 229.592 -1.29331e+01 -1.51918e+01 0.00000e+00 0.00000e+00 1.70249e+02 229.592 1.33138e+02 49.592  0.9746 
1 1 1 -8  31  10 o 7  9.62643e+00 6.25071e-01 1.15131e+02 293.509 2.74083e+00  -6.30085e+00 0.00000e+00 0.00000e+00 2.18216e+02 293.509 1.03085e+02 293.509 0.9241 
1 1 1 -8  31  11 o 15 7.05069e+00 7.06477e-01 1.27265e+02 87.026  3.59318e-01  6.91720e+00  0.00000e+00 0.00000e+00 1.16822e+02 87.026  1.04424e+01 267.026 0.9247 
1 1 1 -8  31  12 o 7  8.24164e+00 5.71630e-01 1.92524e+02 320.720 1.19983e+01  -9.81344e+00 0.00000e+00 0.00000e+00 1.05594e+02 320.720 8.69300e+01 140.720 0.9672 
1 1 1 -8  31  13 o 12 7.26936e+00 6.71611e-01 1.24993e+02 30.090  9.74801e+00  5.64844e+00  0.00000e+00 0.00000e+00 1.34235e+02 30.090  9.24177e+00 30.090  0.9545 
1 1 1 -8  31  14 o 12 1.50004e+01 9.38036e-01 2.19590e+02 135.933 -2.97833e+01 2.88282e+01  0.00000e+00 0.00000e+00 3.33371e+02 135.933 1.13781e+02 135.933 0.9879 
1 1 1 -8  31  15 o 13 8.06087e+00 1.30407e+00 1.54081e+02 154.796 -1.34038e+01 6.30843e+00  0.00000e+00 0.00000e+00 1.36032e+02 154.796 1.80492e+01 334.796 0.9656 
1 1 1 -8  31  16 o 1  5.38899e+00 1.41318e+00 9.55248e+01 66.239  2.61697e+00  5.94445e+00  0.00000e+00 0.00000e+00 8.89098e+01 66.239  6.61497e+00 246.239 0.9194 
1 1 1 -8  31  17 o 10 6.28435e+00 1.56225e+00 1.04769e+02 237.940 -4.11190e+00 -6.56504e+00 0.00000e+00 0.00000e+00 1.13200e+02 237.940 8.43076e+00 237.940 0.9330 
1 1 1 -8  31  18 o 15 4.36421e+00 1.42459e+00 1.48794e+02 17.044  8.96457e+00  2.74822e+00  0.00000e+00 0.00000e+00 4.31661e+00 17.044  1.44478e+02 197.044 0.9451 
1 1 1 -8  32  1  o 11 3.26848e+01 6.61460e-01 4.33176e+02 316.769 1.77147e+01  -1.66532e+01 0.00000e+00 0.00000e+00 7.73220e+02 316.769 3.40044e+02 316.769 0.9792 
1 1 1 -8  32  2  o 14 9.99989e+00 5.50965e-01 1.54637e+02 246.675 -1.05316e+00 -2.44253e+00 0.00000e+00 0.00000e+00 1.39747e+02 246.675 1.48900e+01 66.675  0.7813 
1 1 1 -8  32  3  f 0  1.29360e+01 5.19871e-01 3.20370e+02 54.754  5.01749e+00  7.10055e+00  0.00000e+00 0.00000e+00 1.37864e+02 54.754  1.82506e+02 234.754 0.9406 
1 1 1 -8  32  4  o 6  1.09589e+01 5.38353e-01 3.06297e+02 156.567 -6.85103e+00 2.96941e+00  0.00000e+00 0.00000e+00 7.74857e+01 156.567 2.28811e+02 336.567 0.9304 
1 1 1 -8  32  5  o 3  2.74095e+01 5.80589e-01 5.86904e+02 337.620 3.98103e+01  -1.63925e+01 0.00000e+00 0.00000e+00 4.32121e+02 337.620 1.54783e+02 157.620 0.9883 
1 1 1 -8  32  6  o 18 1.88966e+01 7.06116e-01 1.70740e+02 320.636 7.47412e+00  -6.13154e+00 0.00000e+00 0.00000e+00 5.01820e+02 320.636 3.31080e+02 320.636 0.9468 
1 1 1 -8  32  7  o 2  1.04933e+01 5.76951e-01 2.60262e+02 278.913 1.35201e+00  -8.62045e+00 0.00000e+00 0.00000e+00 1.10597e+02 278.913 1.49665e+02 98.914  0.9408 
1 1 1 -8  32  8  o 5  5.25770e+00 9.17491e-01 1.11155e+02 71.844  7.50032e-01  2.28713e+00  0.00000e+00 0.00000e+00 3.77466e+01 71.844  7.34079e+01 251.844 0.7545 
1 1 1 -8  32  9  o 14 8.12976e+00 6.77623e-01 1.26599e+02 230.043 -3.30242e+00 -3.94166e+00 0.00000e+00 0.00000e+00 1.46771e+02 230.043 2.01722e+01 230.043 0.8966 
1 1 1 -8  32  10 o 5  4.42981e+00 9.34369e-01 1.44643e+02 8.223   4.06403e+00  5.87331e-01  0.00000e+00 0.00000e+00 6.49951e-01 188.223 1.45293e+02 188.223 0.8675 
1 1 1 -8  32  11 f 0  1.71757e+01 5.40266e-01 3.05543e+02 2.116   4.55581e+01  1.68297e+00  0.00000e+00 0.00000e+00 3.30330e+02 2.116   2.47863e+01 2.116   0.9890 
1 1 1 -8  32  12 o 15 1.29955e+01 5.07070e-01 2.27744e+02 77.914  6.81374e+00  3.18213e+01  0.00000e+00 0.00000e+00 2.50713e+02 77.914  2.29687e+01 77.914  0.9845 
1 1 1 -8  32  13 o 13 3.12917e+00 8.78704e-01 6.23890e+01 91.626  -6.65787e-02 2.34614e+00  0.00000e+00 0.00000e+00 2.49632e+01 91.626  3.74258e+01 271.625 0.7473 
1 1 1 -8  32  14 o 16 2.98146e+00 9.52734e-01 3.87012e+01 199.426 -1.35842e+00 -4.79082e-01 0.00000e+00 0.00000e+00 2.59396e+01 199.426 1.27616e+01 19.426  0.5811 
1 1 1 -8  32  15 o 19 1.13973e+01 1.15901e+00 1.66636e+02 325.383 1.91123e+01  -1.31929e+01 0.00000e+00 0.00000e+00 2.48870e+02 325.383 8.22346e+01 325.383 0.9782 
1 1 1 -8  32  16 o 6  6.05345e+00 1.36945e+00 1.31514e+02 127.114 -5.97214e+00 7.89250e+00  0.00000e+00 0.00000e+00 8.20935e+01 127.114 4.94204e+01 307.114 0.9481 
1 1 1 -8  32  17 o 5  4.74486e+00 1.37974e+00 7.41720e+01 73.176  1.40293e+00  4.63970e+00  0.00000e+00 0.00000e+00 8.27477e+01 73.176  8.57566e+00 73.176  0.8897 
1 1 1 -8  32  18 o 3  4.70910e+00 1.46709e+00 5.53023e+01 328.194 3.22293e+00  -1.99878e+00 0.00000e+00 0.00000e+00 9.41568e+01 328.194 3.88546e+01 328.194 0.8550 
1 1 1 -8  33  1  f 0  2.71024e+01 5.96312e-01 3.84772e+02 201.438 -2.04358e+01 -8.02449e+00 0.00000e+00 0.00000e+00 6.13180e+02 201.438 2.28407e+02 201.438 0.9770 
1 1 1 -8  33  2  o 17 7.56283e+00 6.24205e-01 3.67005e+01 172.448 -5.75938e-01 7.63527e-02  0.00000e+00 0.00000e+00 4.27608e+01 172.448 6.06032e+00 172.448 0.2789 
1 1 1 -8  33  3  o 2  1.14516e+01 5.18631e-01 1.26275e+02 133.784 -2.18689e+00 2.28171e+00  0.00000e+00 0.00000e+00 2.27841e+02 133.784 1.01566e+02 133.784 0.8212 
1 1 1 -8  33  4  o 15 1.75074e+01 5.28324e-01 2.76350e+02 37.227  9.45960e+00  7.18718e+00  0.00000e+00 0.00000e+00 3.54193e+02 37.227  7.78430e+01 37.227  0.9569 
1 1 1 -8  33  5  o 9  4.41912e+01 8.82410e-01 7.19638e+02 328.376 6.92874e+01  -4.26656e+01 0.00000e+00 0.00000e+00 9.32321e+02 328.376 2.12683e+02 328.376 0.9938 
1 1 1 -8  33  6  o 18 1.58981e+01 8.95887e-01 3.45677e+02 348.717 1.51254e+01  -3.01777e+00 0.00000e+00 0.00000e+00 2.32210e+02 348.717 1.13467e+02 168.717 0.9670 
1 1 1 -8  33  7  o 2  1.33760e+01 5.36428e-01 2.66066e+02 210.800 -1.01040e+01 -6.02323e+00 0.00000e+00 0.00000e+00 2.14509e+02 210.800 5.15566e+01 30.800  0.9565 
1 1 1 -8  33  8  o 10 2.90296e+01 6.09316e-01 4.93110e+02 77.838  1.28338e+01  5.95490e+01  0.00000e+00 0.00000e+00 5.87472e+02 77.838  9.43627e+01 77.838  0.9918 
1 1 1 -8  33  9  o 1  1.79556e+01 5.39613e-01 2.38330e+02 195.337 -2.25047e+01 -6.17243e+00 0.00000e+00 0.00000e+00 4.20438e+02 195.337 1.82108e+02 195.337 0.9783 
1 1 1 -8  33  10 o 1  4.99706e+00 8.51670e-01 1.67162e+02 154.237 -5.06446e+00 2.44425e+00  0.00000e+00 0.00000e+00 2.48038e+00 154.237 1.64682e+02 334.237 0.9061 
1 1 1 -8  33  11 o 3  8.90255e+00 6.27101e-01 1.17966e+02 258.650 -1.76163e+00 -8.77609e+00 0.00000e+00 0.00000e+00 1.96063e+02 258.650 7.80972e+01 258.650 0.9424 
1 1 1 -8  33  12 o 17 9.10286e+00 5.58930e-01 9.71779e+01 258.735 -1.84459e+00 -9.26048e+00 0.00000e+00 0.00000e+00 2.24642e+02 258.735 1.27464e+02 258.735 0.9455 
1 1 1 -8  33  13 o 17 5.40705e+00 4.62923e-01 1.28079e+02 137.185 -6.96256e+00 6.45068e+00  0.00000e+00 0.00000e+00 6.29310e+01 137.185 6.51484e+01 317.185 0.9458 
1 1 1 -8  33  14 o 19 1.20002e+01 1.07400e+00 1.82821e+02 286.284 7.62841e+00  -2.61135e+01 0.00000e+00 0.00000e+00 2.56591e+02 286.284 7.37703e+01 286.284 0.9814 
1 1 1 -8  33  15 o 5  5.19898e+00 1.36267e+00 1.03320e+02 72.501  1.92861e+00  6.11703e+00  0.00000e+00 0.00000e+00 7.45978e+01 72.501  2.87221e+01 252.501 0.9183 
1 1 1 -8  33  16 o 18 4.87985e+00 1.39082e+00 1.40912e+02 276.278 9.36710e-01  -8.51468e+00 0.00000e+00 0.00000e+00 2.97471e+01 276.278 1.11165e+02 96.278  0.9397 
1 1 1 -8  33  17 o 1  3.55386e+00 1.19378e+00 5.51257e+01 85.331  2.48745e-01  3.04549e+00  0.00000e+00 0.00000e+00 5.23964e+01 85.331  2.72936e+00 265.331 0.8140 
1 1 1 -8  33  18 o 19 4.73604e+00 1.51326e+00 7.91259e+01 224.291 -3.82648e+00 -3.73288e+00 0.00000e+00 0.00000e+00 7.92239e+01 224.291 9.80214e-02 224.291 0.9008 
1 1 1 -8  34  1  o 3  2.05629e+01 5.98773e-01 3.44425e+02 334.569 1.34026e+01  -6.37298e+00 0.00000e+00 0.00000e+00 4.03942e+02 334.569 5.95163e+01 334.569 0.9657 
1 1 1 -8  34  2  o 9  2.50774e+01 5.74982e-01 4.47018e+02 179.485 -2.34557e+01 2.10682e-01  0.00000e+00 0.00000e+00 4.77313e+02 179.485 3.02945e+01 179.485 0.9784 
1 1 1 -8  34  3  o 17 3.92737e+01 8.56837e-01 8.27493e+02 16.502  6.65540e+01  1.97167e+01  0.00000e+00 0.00000e+00 6.40596e+02 16.502  1.86897e+02 196.502 0.9928 
1 1 1 -8  34  4  o 5  2.96195e+01 8.42134e-01 4.05563e+02 320.662 2.20187e+01  -1.80465e+01 0.00000e+00 0.00000e+00 6.89351e+02 320.662 2.83788e+02 320.662 0.9823 
1 1 1 -8  34  5  o 17 1.86545e+01 6.34435e-01 2.67385e+02 200.020 -1.28360e+01 -4.67695e+00 0.00000e+00 0.00000e+00 4.08031e+02 200.020 1.40646e+02 200.020 0.9627 
1 1 1 -8  34  6  o 9  1.47375e+01 5.15430e-01 3.59040e+02 65.456  6.32276e+00  1.38460e+01  0.00000e+00 0.00000e+00 1.76364e+02 65.456  1.82675e+02 245.456 0.9666 
1 1 1 -8  34  7  o 2  2.44227e+01 5.68373e-01 3.18128e+02 308.002 1.70403e+01  -2.18089e+01 0.00000e+00 0.00000e+00 5.82429e+02 308.002 2.64301e+02 308.002 0.9818 
1 1 1 -8  34  8  o 14 1.97363e+01 5.42263e-01 4.28703e+02 267.246 -1.79295e+00 -3.72750e+01 0.00000e+00 0.00000e+00 3.01994e+02 267.246 1.26709e+02 87.246  0.9865 
1 1 1 -8  34  9  o 12 1.00414e+01 5.99299e-01 2.39862e+02 134.871 -1.01192e+01 1.01650e+01  0.00000e+00 0.00000e+00 1.23294e+02 134.871 1.16568e+02 314.871 0.9645 
1 1 1 -8  34  10 o 8  1.12830e+01 5.75433e-01 1.93268e+02 221.500 -1.22082e+01 -1.08011e+01 0.00000e+00 0.00000e+00 2.16259e+02 221.500 2.29916e+01 221.500 0.9688 
1 1 1 -8  34  11 o 14 1.39873e+01 5.42975e-01 1.27074e+02 227.914 -1.04480e+01 -1.15688e+01 0.00000e+00 0.00000e+00 3.79362e+02 227.914 2.52288e+02 227.914 0.9674 
1 1 1 -8  34  12 o 4  1.26435e+01 4.60588e-01 2.74687e+02 93.890  -2.56068e+00 3.76540e+01  0.00000e+00 0.00000e+00 1.91742e+02 93.890  8.29456e+01 273.890 0.9867 
1 1 1 -8  34  13 o 7  1.60725e+01 4.06190e-01 2.81364e+02 268.785 -1.32911e+00 -6.26675e+01 0.00000e+00 0.00000e+00 3.14117e+02 268.785 3.27537e+01 268.785 0.9920 
1 1 1 -8  34  14 o 8  4.70174e+00 1.19696e+00 1.55564e+02 36.658  6.70203e+00  4.98797e+00  0.00000e+00 0.00000e+00 8.98055e+00 36.658  1.46583e+02 216.658 0.9381 
1 1 1 -8  34  15 f 0  3.71052e+00 1.15975e+00 1.85249e+01 272.705 4.36591e-02  -9.24092e-01 0.00000e+00 0.00000e+00 3.94368e+01 272.705 2.09119e+01 272.705 0.4192 
1 1 1 -8  34  16 o 5  6.73657e+00 1.50926e+00 1.34759e+02 116.339 -4.42521e+00 8.93824e+00  0.00000e+00 0.00000e+00 1.03013e+02 116.339 3.17456e+01 296.339 0.9485 
1 1 1 -8  34  17 o 3  3.98302e+00 1.29655e+00 3.77894e+01 99.668  -3.73119e-01 2.19025e+00  0.00000e+00 0.00000e+00 7.04227e+01 99.668  3.26332e+01 99.668  0.7310 
1 1 1 -8  34  18 o 3  4.67214e+00 1.49438e+00 2.91978e+01 229.665 -1.27759e+00 -1.50464e+00 0.00000e+00 0.00000e+00 9.10407e+01 229.665 6.18429e+01 229.665 0.6934 
1 1 1 -8  35  1  o 16 2.28278e+01 7.26647e-01 3.13795e+02 75.720  3.66774e+00  1.44104e+01  0.00000e+00 0.00000e+00 5.16978e+02 75.720  2.03183e+02 75.720  0.9658 
1 1 1 -8  35  2  f 0  8.89033e+00 6.03821e-01 1.29653e+02 67.423  9.62935e-01  2.31594e+00  0.00000e+00 0.00000e+00 1.26822e+02 67.423  2.83025e+00 247.423 0.7659 
1 1 1 -8  35  3  f 0  3.23864e+01 7.38529e-01 5.66064e+02 272.113 1.48681e+00  -4.03023e+01 0.00000e+00 0.00000e+00 6.38056e+02 272.113 7.19921e+01 272.113 0.9875 
1 1 1 -8  35  4  o 15 1.81276e+01 5.19744e-01 1.37394e+02 131.652 -3.98894e+00 4.48460e+00  0.00000e+00 0.00000e+00 4.84976e+02 131.652 3.47583e+02 131.652 0.9124 
1 1 1 -8  35  5  o 12 1.48127e+01 5.06278e-01 3.37170e+02 241.148 -6.63169e+00 -1.20370e+01 0.00000e+00 0.00000e+00 1.99223e+02 241.148 1.37947e+02 61.148  0.9629 
1 1 1 -8  35  6  o 12 1.29712e+01 5.64133e-01 3.37868e+02 125.040 -8.10654e+00 1.15601e+01  0.00000e+00 0.00000e+00 1.32024e+02 125.040 2.05844e+02 305.040 0.9639 
1 1 1 -8  35  7  o 9  2.00639e+01 5.41470e-01 1.97793e+02 308.829 8.62676e+00  -1.07184e+01 0.00000e+00 0.00000e+00 5.27787e+02 308.829 3.29994e+02 308.829 0.9629 
1 1 1 -8  35  8  o 5  1.02487e+01 5.97687e-01 8.88972e+01 338.868 3.89948e+00  -1.50722e+00 0.00000e+00 0.00000e+00 2.45746e+02 338.868 1.56849e+02 338.868 0.8701 
1 1 1 -8  35  9  o 4  1.64598e+01 5.45035e-01 3.50664e+02 196.651 -3.18063e+01 -9.51258e+00 0.00000e+00 0.00000e+00 2.57118e+02 196.651 9.35456e+01 16.651  0.9848 
1 1 1 -8  35  10 o 11 1.27857e+01 5.53874e-01 2.95219e+02 349.222 2.77255e+01  -5.27805e+00 0.00000e+00 0.00000e+00 1.75176e+02 349.222 1.20043e+02 169.222 0.9821 
1 1 1 -8  35  11 o 2  2.25523e+01 5.57814e-01 4.04219e+02 146.203 -6.97338e+01 4.66776e+01  0.00000e+00 0.00000e+00 4.34740e+02 146.203 3.05213e+01 146.203 0.9940 
1 1 1 -8  35  12 o 3  2.10034e+00 6.47433e-01 1.14043e+02 184.384 -2.60615e+00 -1.99787e-01 0.00000e+00 0.00000e+00 5.30435e+01 4.384   1.67086e+02 4.384   0.7768 
1 1 1 -8  35  13 f 0  1.96752e+01 4.55763e-01 2.65324e+02 320.500 5.18775e+01  -4.27644e+01 0.00000e+00 0.00000e+00 4.63970e+02 320.500 1.98647e+02 320.500 0.9925 
1 1 1 -8  35  14 o 8  4.72362e+00 1.20353e+00 1.44345e+02 158.376 -7.11527e+00 2.82056e+00  0.00000e+00 0.00000e+00 1.99074e+01 158.376 1.24438e+02 338.376 0.9322 
1 1 1 -8  35  15 o 6  8.07342e+00 1.37905e+00 1.29106e+02 241.199 -5.59950e+00 -1.01851e+01 0.00000e+00 0.00000e+00 1.58443e+02 241.199 2.93365e+01 241.199 0.9560 
1 1 1 -8  35  16 o 2  6.94402e+00 1.54548e+00 7.76712e+01 96.924  -6.97552e-01 5.74447e+00  0.00000e+00 0.00000e+00 1.57181e+02 96.924  7.95098e+01 96.924  0.9089 
1 1 1 -8  35  17 o 15 5.74275e+00 1.57097e+00 1.04421e+02 193.449 -7.07375e+00 -1.69162e+00 0.00000e+00 0.00000e+00 9.37172e+01 193.449 1.07042e+01 13.449  0.9285 
1 1 1 -8  36  1  o 9  3.93433e+01 9.63800e-01 4.90646e+02 107.019 -1.20118e+01 3.92429e+01  0.00000e+00 0.00000e+00 9.73614e+02 107.019 4.82968e+02 107.019 0.9877 
1 1 1 -8  36  2  o 4  1.47852e+01 5.23268e-01 2.17936e+02 24.036  6.56829e+00  2.92935e+00  0.00000e+00 0.00000e+00 2.98624e+02 24.036  8.06886e+01 24.036  0.9276 
1 1 1 -8  36  3  o 11 2.73168e+01 6.66303e-01 6.73683e+02 319.923 3.42834e+01  -2.88452e+01 0.00000e+00 0.00000e+00 3.43140e+02 319.923 3.30543e+02 139.923 0.9888 
1 1 1 -8  36  4  o 10 2.93112e+01 6.21420e-01 4.52800e+02 166.233 -3.43875e+01 8.42557e+00  0.00000e+00 0.00000e+00 6.34370e+02 166.233 1.81570e+02 166.233 0.9858 
1 1 1 -8  36  5  o 11 4.99106e+01 9.73595e-01 7.70218e+02 30.013  9.03364e+01  5.21825e+01  0.00000e+00 0.00000e+00 1.09757e+03 30.013  3.27349e+02 30.013  0.9952 
1 1 1 -8  36  6  f 0  1.08816e+01 5.73433e-01 2.19578e+02 61.095  3.58951e+00  6.50104e+00  0.00000e+00 0.00000e+00 1.60713e+02 61.095  5.88648e+01 241.095 0.9300 
1 1 1 -8  36  7  o 19 3.25746e+01 7.21595e-01 4.82864e+02 206.390 -4.79859e+01 -2.38103e+01 0.00000e+00 0.00000e+00 7.28888e+02 206.390 2.46025e+02 206.390 0.9906 
1 1 1 -8  36  8  o 8  1.92333e+01 5.40384e-01 3.28159e+02 201.563 -2.85755e+01 -1.12928e+01 0.00000e+00 0.00000e+00 3.81672e+02 201.563 5.35130e+01 201.563 0.9836 
1 1 1 -8  36  9  f 0  2.52084e+01 5.81716e-01 5.38756e+02 10.805  7.69084e+01  1.46774e+01  0.00000e+00 0.00000e+00 4.00267e+02 10.805  1.38489e+02 190.804 0.9936 
1 1 1 -8  36  10 o 11 8.66346e+00 6.45613e-01 1.84578e+02 154.169 -1.06564e+01 5.15853e+00  0.00000e+00 0.00000e+00 1.25904e+02 154.169 5.86740e+01 334.169 0.9568 
1 1 1 -8  36  11 o 6  6.95752e+00 6.95202e-01 1.20374e+02 147.382 -6.29568e+00 4.02905e+00  0.00000e+00 0.00000e+00 1.21881e+02 147.382 1.50654e+00 147.382 0.9305 
1 1 1 -8  36  12 o 11 2.97697e+01 6.02364e-01 5.26566e+02 269.790 -6.12405e-01 -1.66780e+02 0.00000e+00 0.00000e+00 5.82955e+02 269.790 5.63892e+01 269.790 0.9970 
1 1 1 -8  36  13 o 7  2.04505e+00 5.95931e-01 2.85844e+01 286.756 2.30540e-01  -7.65716e-01 0.00000e+00 0.00000e+00 2.57119e-01 106.756 2.88416e+01 106.756 0.3709 
1 1 1 -8  36  14 o 4  9.67008e+00 1.12721e+00 1.78539e+02 243.193 -1.01196e+01 -2.00272e+01 0.00000e+00 0.00000e+00 1.74013e+02 243.193 4.52629e+00 63.193  0.9775 
1 1 1 -8  36  15 o 3  6.17411e+00 1.38795e+00 8.90402e+01 334.995 5.93924e+00  -2.77019e+00 0.00000e+00 0.00000e+00 1.22610e+02 334.995 3.35702e+01 334.995 0.9202 
1 1 1 -8  36  16 o 6  8.98542e+00 1.52565e+00 1.71201e+02 105.192 -4.65007e+00 1.71242e+01  0.00000e+00 0.00000e+00 1.53555e+02 105.192 1.76460e+01 285.192 0.9714 
1 1 1 -8  36  17 o 12 3.48436e+00 1.16651e+00 6.47022e+01 60.517  1.86799e+00  3.30401e+00  0.00000e+00 0.00000e+00 4.60159e+01 60.517  1.86863e+01 240.517 0.8552 
1 1 1 -8  37  1  o 15 3.10132e+01 7.16396e-01 4.89883e+02 58.194  1.76871e+01  2.85195e+01  0.00000e+00 0.00000e+00 6.61016e+02 58.194  1.71134e+02 58.194  0.9850 
1 1 1 -8  37  2  o 17 2.62049e+01 5.90093e-01 4.77391e+02 312.500 2.07385e+01  -2.26319e+01 0.00000e+00 0.00000e+00 4.93277e+02 312.500 1.58856e+01 312.500 0.9836 
1 1 1 -8  37  3  o 9  3.79326e+01 8.21981e-01 7.47367e+02 48.885  4.42073e+01  5.06481e+01  0.00000e+00 0.00000e+00 6.69837e+02 48.885  7.75292e+01 228.884 0.9925 
1 1 1 -8  37  4  o 10 3.07095e+01 7.16547e-01 5.97964e+02 243.252 -2.14035e+01 -4.24678e+01 0.00000e+00 0.00000e+00 5.45176e+02 243.252 5.27882e+01 63.252  0.9894 
1 1 1 -8  37  5  o 8  1.19441e+01 5.25228e-01 1.77977e+02 120.834 -3.30067e+00 5.52944e+00  0.00000e+00 0.00000e+00 2.34601e+02 120.834 5.66249e+01 120.834 0.9187 
1 1 1 -8  37  6  o 18 2.47375e+01 5.69492e-01 3.21928e+02 286.900 7.41671e+00  -2.44113e+01 0.00000e+00 0.00000e+00 5.89176e+02 286.900 2.67248e+02 286.900 0.9802 
1 1 1 -8  37  7  o 6  2.83496e+01 6.08514e-01 3.41883e+02 46.736  2.58969e+01  2.75161e+01  0.00000e+00 0.00000e+00 7.08399e+02 46.736  3.66515e+02 46.736  0.9867 
1 1 1 -8  37  8  f 0  1.22731e+01 5.58724e-01 1.39863e+02 306.323 4.82483e+00  -6.56265e+00 0.00000e+00 0.00000e+00 2.91337e+02 306.323 1.51474e+02 306.323 0.9364 
1 1 1 -8  37  9  o 15 1.23010e+01 5.55162e-01 2.59047e+02 219.557 -1.41699e+01 -1.17043e+01 0.00000e+00 0.00000e+00 1.89355e+02 219.557 6.96922e+01 39.557  0.9724 
1 1 1 -8  37  10 f 0  8.05621e+00 6.54879e-01 2.53587e+02 249.302 -5.22913e+00 -1.38397e+01 0.00000e+00 0.00000e+00 3.77596e+01 249.302 2.15828e+02 69.302  0.9656 
1 1 1 -8  37  11 o 7  6.00496e+00 7.39326e-01 1.15162e+02 116.576 -2.72944e+00 5.45619e+00  0.00000e+00 0.00000e+00 9.01796e+01 116.576 2.49821e+01 296.576 0.9139 
1 1 1 -8  37  12 o 13 2.19577e+00 6.75159e-01 7.38447e+01 181.534 -1.78755e+00 -4.78751e-02 0.00000e+00 0.00000e+00 1.96967e+01 1.534   9.35414e+01 1.534   0.6597 
1 1 1 -8  37  13 o 15 2.72212e+00 6.72327e-01 7.98031e+01 190.452 -2.72988e+00 -5.03568e-01 0.00000e+00 0.00000e+00 6.89728e-01 190.452 7.91134e+01 10.452  0.7920 
1 1 1 -8  37  14 o 18 5.98944e+00 1.29799e+00 1.03406e+02 177.055 -7.16841e+00 3.68829e-01  0.00000e+00 0.00000e+00 1.03769e+02 177.055 3.62880e-01 177.055 0.9275 
1 1 1 -8  37  15 o 16 8.93621e+00 1.38728e+00 1.62659e+02 30.400  1.42837e+01  8.38033e+00  0.00000e+00 0.00000e+00 1.60003e+02 30.400  2.65594e+00 210.400 0.9693 
1 1 1 -8  37  16 f 0  6.06987e+00 1.54646e+00 5.18754e+01 109.338 -1.17492e+00 3.34792e+00  0.00000e+00 0.00000e+00 1.38618e+02 109.338 8.67429e+01 109.338 0.8436 
1 1 1 -8  37  17 o 12 8.30822e+00 1.77661e+00 1.38740e+02 273.721 7.84863e-01  -1.20692e+01 0.00000e+00 0.00000e+00 1.56888e+02 273.721 1.81477e+01 273.721 0.9577 
1 1 1 -8  38  1  o 12 2.86693e+01 6.78774e-01 6.02280e+02 326.544 3.51446e+01  -2.32227e+01 0.00000e+00 0.00000e+00 4.64847e+02 326.544 1.37433e+02 146.544 0.9881 
1 1 1 -8  38  2  o 3  1.87124e+01 6.68628e-01 2.26337e+02 247.599 -3.92432e+00 -9.52050e+00 0.00000e+00 0.00000e+00 4.43159e+02 247.599 2.16822e+02 247.599 0.9501 
1 1 1 -8  38  3  o 12 1.24729e+01 5.33751e-01 2.33693e+02 220.200 -5.98227e+00 -5.05547e+00 0.00000e+00 0.00000e+00 2.04684e+02 220.200 2.90091e+01 40.200  0.9338 
1 1 1 -8  38  4  o 14 2.07291e+01 5.13093e-01 3.43487e+02 250.570 -6.52531e+00 -1.84988e+01 0.00000e+00 0.00000e+00 4.16159e+02 250.570 7.26717e+01 250.570 0.9742 
1 1 1 -8  38  5  o 3  1.10459e+01 9.28216e-01 1.71900e+02 321.247 4.13381e+00  -3.31804e+00 0.00000e+00 0.00000e+00 2.01816e+02 321.247 2.99160e+01 321.247 0.8999 
1 1 1 -8  38  6  o 13 1.34767e+01 5.25055e-01 2.54068e+02 89.453  1.08220e-01  1.13408e+01  0.00000e+00 0.00000e+00 2.29400e+02 89.453  2.46673e+01 269.453 0.9548 
1 1 1 -8  38  7  o 5  7.81928e+00 6.92923e-01 2.67439e+02 255.100 -2.28125e+00 -8.57344e+00 0.00000e+00 0.00000e+00 9.05079e+00 255.100 2.58388e+02 75.100  0.9418 
1 1 1 -8  38  8  o 4  1.84863e+01 5.31642e-01 2.73912e+02 326.511 2.00051e+01  -1.32354e+01 0.00000e+00 0.00000e+00 4.04980e+02 326.511 1.31067e+02 326.511 0.9789 
1 1 1 -8  38  9  o 13 2.29107e+01 5.59451e-01 4.16607e+02 214.039 -4.85539e+01 -3.27979e+01 0.00000e+00 0.00000e+00 4.34795e+02 214.039 1.81871e+01 214.039 0.9914 
1 1 1 -8  38  10 o 14 2.85112e+00 7.83971e-01 2.42324e+01 140.038 -3.94090e-01 3.30240e-01  0.00000e+00 0.00000e+00 2.34792e+00 140.038 2.18845e+01 320.038 0.2489 
1 1 1 -8  38  11 o 11 9.73818e+00 5.76862e-01 1.89508e+02 244.859 -7.57525e+00 -1.61417e+01 0.00000e+00 0.00000e+00 1.64459e+02 244.859 2.50495e+01 64.859  0.9715 
1 1 1 -8  38  12 o 3  8.06644e+00 5.39605e-01 1.75339e+02 310.625 9.83413e+00  -1.14636e+01 0.00000e+00 0.00000e+00 1.15984e+02 310.625 5.93549e+01 130.625 0.9663 
1 1 1 -8  38  13 o 19 9.45933e+00 4.47644e-01 1.97306e+02 85.623  2.08014e+00  2.71751e+01  0.00000e+00 0.00000e+00 1.49310e+02 85.623  4.79961e+01 265.623 0.9815 
1 1 1 -8  38  14 o 13 9.52893e+00 1.18521e+00 1.32294e+02 190.101 -1.52921e+01 -2.72413e+00 0.00000e+00 0.00000e+00 2.11417e+02 190.101 7.91228e+01 190.101 0.9673 
1 1 1 -8  38  15 o 9  5.40736e+00 1.35808e+00 1.05600e+02 214.981 -5.74660e+00 -4.02101e+00 0.00000e+00 0.00000e+00 8.08363e+01 214.981 2.47642e+01 34.981  0.9257 
1 1 1 -8  38  16 o 13 5.53344e+00 1.49378e+00 1.45580e+02 81.410  1.45446e+00  9.62850e+00  0.00000e+00 0.00000e+00 4.93846e+01 81.410  9.61953e+01 261.410 0.9472 
1 1 1 -8  38  17 o 2  4.78010e+00 2.30039e+00 2.76353e+01 320.012 7.47554e-01  -6.27014e-01 0.00000e+00 0.00000e+00 5.00930e+01 320.012 2.24577e+01 320.012 0.4377 
1 1 1 -8  39  1  o 2  1.56721e+01 5.61986e-01 2.76827e+02 107.659 -3.17843e+00 9.98379e+00  0.00000e+00 0.00000e+00 2.84586e+02 107.659 7.75981e+00 107.659 0.9510 
1 1 1 -8  39  2  o 9  3.90699e+01 8.38774e-01 6.58833e+02 197.514 -5.80826e+01 -1.83290e+01 0.00000e+00 0.00000e+00 8.00108e+02 197.514 1.41275e+02 197.514 0.9918 
1 1 1 -8  39  3  o 10 2.90891e+01 6.21420e-01 5.49858e+02 39.650  3.21398e+01  2.66361e+01  0.00000e+00 0.00000e+00 5.31696e+02 39.650  1.81616e+01 219.650 0.9879 
1 1 1 -8  39  4  o 5  2.82882e+01 5.79433e-01 3.95011e+02 278.987 4.89708e+00  -3.09638e+01 0.00000e+00 0.00000e+00 6.51914e+02 278.987 2.56903e+02 278.987 0.9839 
1 1 1 -8  39  5  o 16 1.72334e+01 7.85563e-01 1.94827e+02 336.366 9.74527e+00  -4.26440e+00 0.00000e+00 0.00000e+00 4.21759e+02 336.366 2.26932e+02 336.366 0.9518 
1 1 1 -8  39  6  o 2  2.98735e+01 5.98703e-01 4.22240e+02 251.067 -1.45580e+01 -4.24402e+01 0.00000e+00 0.00000e+00 6.87437e+02 251.067 2.65197e+02 251.067 0.9888 
1 1 1 -8  39  7  o 16 1.23247e+01 5.55322e-01 2.14997e+02 156.942 -1.04342e+01 4.44145e+00  0.00000e+00 0.00000e+00 2.26777e+02 156.942 1.17800e+01 156.942 0.9548 
1 1 1 -8  39  8  o 1  1.19623e+01 5.62183e-01 3.63238e+02 185.081 -2.19309e+01 -1.94986e+00 0.00000e+00 0.00000e+00 7.51623e+01 185.081 2.88076e+02 5.081   0.9770 
1 1 1 -8  39  9  o 2  1.38697e+01 5.49031e-01 3.25097e+02 35.702  2.29492e+01  1.64922e+01  0.00000e+00 0.00000e+00 1.85443e+02 35.702  1.39653e+02 215.702 0.9821 
1 1 1 -8  39  10 o 1  1.53809e+01 5.36360e-01 2.86217e+02 94.600  -2.98120e+00 3.70522e+01  0.00000e+00 0.00000e+00 2.81924e+02 94.600  4.29375e+00 274.600 0.9865 
1 1 1 -8  39  11 o 19 1.56874e+01 4.95029e-01 2.30313e+02 270.813 5.02028e-01  -3.53666e+01 0.00000e+00 0.00000e+00 3.48181e+02 270.813 1.17868e+02 270.813 0.9858 
1 1 1 -8  39  12 o 4  2.26320e+00 6.83018e-01 6.63246e+01 105.358 -4.44507e-01 1.61844e+00  0.00000e+00 0.00000e+00 1.24287e+01 285.358 7.87533e+01 285.358 0.6372 
1 1 1 -8  39  13 o 3  7.40350e+00 4.94507e-01 1.07548e+02 87.597  4.84320e-01  1.15415e+01  0.00000e+00 0.00000e+00 1.56579e+02 87.597  4.90310e+01 87.597  0.9557 
1 1 1 -8  39  14 o 8  1.03855e+01 1.15995e+00 1.19542e+02 217.289 -1.23965e+01 -9.43985e+00 0.00000e+00 0.00000e+00 2.55066e+02 217.289 1.35524e+02 217.289 0.9674 
1 1 1 -8  39  15 o 7  4.22662e+00 1.20413e+00 4.59963e+01 181.977 -2.61465e+00 -9.02404e-02 0.00000e+00 0.00000e+00 7.63215e+01 181.977 3.03252e+01 181.977 0.7771 
1 1 1 -8  39  16 o 9  5.07716e+00 1.56705e+00 6.73601e+01 67.550  1.41940e+00  3.43513e+00  0.00000e+00 0.00000e+00 9.34752e+01 67.550  2.61151e+01 67.550  0.8517 
1 1 1 -8  39  17 o 8  5.68883e+00 2.60877e+00 7.91915e+01 25.083  2.55253e+00  1.19480e+00  0.00000e+00 0.00000e+00 8.89315e+01 25.083  9.73993e+00 25.083  0.7956 
1 1 1 -8  40  1  o 19 3.14364e+01 7.26862e-01 5.80499e+02 128.852 -3.04459e+01 3.77967e+01  0.00000e+00 0.00000e+00 5.91252e+02 128.852 1.07536e+01 128.852 0.9896 
1 1 1 -8  40  2  o 14 2.34424e+01 7.14094e-01 3.26302e+02 8.348   2.00818e+01  2.94679e+00  0.00000e+00 0.00000e+00 5.34238e+02 8.348   2.07936e+02 8.348   0.9750 
1 1 1 -8  40  3  o 5  1.21250e+01 5.76457e-01 5.07691e+02 263.058 -2.04573e+00 -1.68011e+01 0.00000e+00 0.00000e+00 6.51138e+01 83.058  5.72804e+02 83.058  0.9700 
1 1 1 -8  40  4  o 8  8.15194e+00 6.39912e-01 1.21132e+02 279.949 5.13649e-01  -2.92825e+00 0.00000e+00 0.00000e+00 1.26586e+02 279.949 5.45435e+00 279.949 0.8080 
1 1 1 -8  40  5  o 5  2.29407e+01 5.71013e-01 2.74590e+02 128.932 -1.23140e+01 1.52435e+01  0.00000e+00 0.00000e+00 5.65398e+02 128.932 2.90808e+02 128.932 0.9741 
1 1 1 -8  40  6  o 6  5.82288e+00 1.13223e+00 6.71212e+01 265.135 -1.07990e-01 -1.26885e+00 0.00000e+00 0.00000e+00 4.98831e+01 265.135 1.72381e+01 85.135  0.5349 
1 1 1 -8  40  7  o 1  2.25433e+01 6.21959e-01 3.49987e+02 135.804 -2.47597e+01 2.40746e+01  0.00000e+00 0.00000e+00 4.83851e+02 135.804 1.33865e+02 135.804 0.9854 
1 1 1 -8  40  8  o 19 6.66949e+00 7.51869e-01 1.48353e+02 86.248  3.43387e-01  5.23616e+00  0.00000e+00 0.00000e+00 7.64869e+01 86.248  7.18657e+01 266.248 0.8988 
1 1 1 -8  40  9  o 5  1.38142e+01 5.41243e-01 2.78490e+02 66.241  1.06741e+01  2.42480e+01  0.00000e+00 0.00000e+00 2.29333e+02 66.241  4.91565e+01 246.241 0.9809 
1 1 1 -8  40  10 o 6  4.79510e+00 8.88056e-01 9.59035e+01 191.170 -3.34191e+00 -6.59897e-01 0.00000e+00 0.00000e+00 5.41986e+01 191.170 4.17049e+01 11.170  0.8361 
1 1 1 -8  40  11 o 6  1.11728e+01 5.36753e-01 3.43088e+02 277.960 5.21806e+00  -3.73181e+01 0.00000e+00 0.00000e+00 6.92463e+01 277.960 2.73842e+02 97.960  0.9866 
1 1 1 -8  40  12 o 9  5.37500e+00 6.69967e-01 1.15109e+02 145.475 -6.00090e+00 4.12810e+00  0.00000e+00 0.00000e+00 7.13905e+01 145.475 4.37187e+01 325.475 0.9286 
1 1 1 -8  40  13 o 2  3.51365e+00 7.26507e-01 4.40803e+01 323.160 1.73216e+00  -1.29768e+00 0.00000e+00 0.00000e+00 5.07414e+01 323.160 6.66113e+00 323.160 0.7230 
1 1 1 -8  40  14 o 16 5.70942e+00 1.33067e+00 1.23147e+02 170.307 -7.86272e+00 1.34295e+00  0.00000e+00 0.00000e+00 7.58912e+01 170.307 4.72556e+01 350.307 0.9350 
1 1 1 -8  40  15 o 4  3.72527e+00 1.12943e+00 7.63314e+01 163.812 -3.91326e+00 1.13603e+00  0.00000e+00 0.00000e+00 4.38497e+01 163.812 3.24817e+01 343.812 0.8663 
1 1 1 -8  40  16 o 6  1.19779e+01 3.32495e+00 2.21942e+02 46.819  7.31728e+00  7.79718e+00  0.00000e+00 0.00000e+00 2.02157e+02 46.819  1.97841e+01 226.819 0.9520 
1 1 1 -8  40  17 o 10 4.99771e+00 2.36799e+00 2.58240e+01 43.458  6.78574e-01  6.42999e-01  0.00000e+00 0.00000e+00 5.26616e+01 43.458  2.68376e+01 43.458  0.4228 
1 1 1 -8  41  1  o 12 2.17421e+01 5.62093e-01 3.35520e+02 260.197 -3.25741e+00 -1.88521e+01 0.00000e+00 0.00000e+00 4.61584e+02 260.197 1.26064e+02 260.197 0.9735 
1 1 1 -8  41  2  o 1  2.30007e+01 5.60492e-01 4.60203e+02 0.162   2.76957e+01  7.85368e-02  0.00000e+00 0.00000e+00 3.89858e+02 0.162   7.03447e+01 180.162 0.9818 
1 1 1 -8  41  3  o 2  3.07382e+01 6.70702e-01 5.96343e+02 74.535  1.36524e+01  4.93447e+01  0.00000e+00 0.00000e+00 5.48862e+02 74.535  4.74807e+01 254.535 0.9902 
1 1 1 -8  41  4  o 2  2.75516e+01 5.70563e-01 5.80033e+02 307.993 2.82869e+01  -3.62145e+01 0.00000e+00 0.00000e+00 4.44733e+02 307.993 1.35300e+02 127.993 0.9891 
1 1 1 -8  41  5  o 3  1.91316e+01 5.92739e-01 3.28926e+02 72.682  5.99355e+00  1.92215e+01  0.00000e+00 0.00000e+00 3.72016e+02 72.682  4.30895e+01 72.682  0.9748 
1 1 1 -8  41  6  o 12 1.15921e+01 7.89546e-01 2.64500e+02 159.544 -1.10321e+01 4.11504e+00  0.00000e+00 0.00000e+00 1.51965e+02 159.544 1.12535e+02 339.544 0.9565 
1 1 1 -8  41  7  o 18 1.77626e+01 5.23982e-01 2.40279e+02 95.016  -1.72326e+00 1.96357e+01  0.00000e+00 0.00000e+00 4.09243e+02 95.016  1.68963e+02 95.016  0.9743 
1 1 1 -8  41  8  o 15 5.45822e+00 8.93227e-01 8.27916e+01 138.188 -1.91057e+00 1.70897e+00  0.00000e+00 0.00000e+00 7.51760e+01 138.188 7.61569e+00 318.188 0.7717 
1 1 1 -8  41  9  o 9  1.48924e+01 5.98208e-01 3.09445e+02 280.026 5.65911e+00  -3.20085e+01 0.00000e+00 0.00000e+00 2.39934e+02 280.026 6.95106e+01 100.026 0.9845 
1 1 1 -8  41  10 o 16 1.14265e+01 5.62601e-01 2.70765e+02 24.549  2.43261e+01  1.11110e+01  0.00000e+00 0.00000e+00 1.48936e+02 24.549  1.21829e+02 204.549 0.9811 
1 1 1 -8  41  11 o 2  9.07295e+00 5.31700e-01 2.33578e+02 125.199 -1.20199e+01 1.70398e+01  0.00000e+00 0.00000e+00 9.75198e+01 125.199 1.36058e+02 305.199 0.9757 
1 1 1 -8  41  12 o 17 6.83315e+00 5.84624e-01 1.35490e+02 23.487  1.08120e+01  4.69826e+00  0.00000e+00 0.00000e+00 1.08734e+02 23.487  2.67560e+01 203.487 0.9566 
1 1 1 -8  41  13 o 6  1.44803e+01 4.77453e-01 2.67389e+02 284.999 1.43531e+01  -5.35711e+01 0.00000e+00 0.00000e+00 2.68149e+02 284.999 7.59295e-01 284.999 0.9909 
1 1 1 -8  41  14 f 0  5.13581e+00 1.27521e+00 4.74180e+01 244.205 -1.24488e+00 -2.57569e+00 0.00000e+00 0.00000e+00 1.05585e+02 244.205 5.81666e+01 244.205 0.7991 
1 1 1 -8  41  15 o 15 3.99498e+00 1.89436e+00 5.91781e+01 269.128 -3.09533e-02 -2.03324e+00 0.00000e+00 0.00000e+00 4.54222e+01 269.128 1.37559e+01 89.128  0.7032 
1 1 1 -8  41  16 o 3  5.67643e+00 2.46061e+00 1.05271e+01 288.542 1.22920e-01  -3.66474e-01 0.00000e+00 0.00000e+00 2.95266e+01 288.542 1.89994e+01 288.542 0.1897 
1 1 1 -8  41  17 o 15 6.15567e+00 2.77943e+00 1.27449e+02 47.820  2.97429e+00  3.28245e+00  0.00000e+00 0.00000e+00 7.33180e+01 47.820  5.41315e+01 227.820 0.8782 
1 1 1 -8  42  1  o 5  4.00989e+00 9.09668e-01 1.10612e+02 195.576 -1.08986e+00 -3.03804e-01 0.00000e+00 0.00000e+00 3.64716e+01 15.576  1.47084e+02 15.576  0.4910 
1 1 1 -8  42  2  o 17 2.22268e+01 5.60487e-01 3.82314e+02 171.599 -2.31026e+01 3.41201e+00  0.00000e+00 0.00000e+00 4.36184e+02 171.599 5.38706e+01 171.599 0.9783 
1 1 1 -8  42  3  o 5  5.66771e+00 7.99952e-01 1.34441e+02 269.857 -5.64463e-03 -2.26823e+00 0.00000e+00 0.00000e+00 2.27639e+01 269.857 1.11677e+02 89.857  0.7373 
1 1 1 -8  42  4  o 18 2.34875e+01 6.00996e-01 3.50295e+02 165.541 -2.56489e+01 6.61362e+00  0.00000e+00 0.00000e+00 5.16039e+02 165.541 1.65744e+02 165.541 0.9809 
1 1 1 -8  42  5  o 1  7.18596e+00 1.08821e+00 1.53134e+02 332.470 3.05893e+00  -1.59440e+00 0.00000e+00 0.00000e+00 7.32753e+01 332.470 7.98589e+01 152.470 0.8384 
1 1 1 -8  42  6  o 17 9.47477e+00 6.59320e-01 9.21336e+01 258.449 -7.46745e-01 -3.65360e+00 0.00000e+00 0.00000e+00 2.11108e+02 258.449 1.18974e+02 258.449 0.8522 
1 1 1 -8  42  7  o 2  2.63061e+01 6.40535e-01 4.56202e+02 29.007  5.05019e+01  2.80021e+01  0.00000e+00 0.00000e+00 5.22410e+02 29.007  6.62074e+01 29.007  0.9913 
1 1 1 -8  42  8  o 17 3.25740e+01 6.58149e-01 5.02754e+02 119.258 -4.52931e+01 8.08488e+01  0.00000e+00 0.00000e+00 7.12100e+02 119.258 2.09346e+02 119.258 0.9946 
1 1 1 -8  42  9  o 1  7.16722e+00 7.74420e-01 8.38162e+01 282.528 9.37247e-01  -4.21773e+00 0.00000e+00 0.00000e+00 1.51098e+02 282.528 6.72813e+01 282.528 0.8748 
1 1 1 -8  42  10 o 2  1.10932e+01 5.65224e-01 2.00234e+02 316.825 1.41637e+01  -1.32891e+01 0.00000e+00 0.00000e+00 2.04181e+02 316.825 3.94664e+00 316.825 0.9739 
1 1 1 -8  42  11 o 7  1.13099e+01 5.37646e-01 1.47341e+02 184.262 -1.81249e+01 -1.35086e+00 0.00000e+00 0.00000e+00 2.63807e+02 184.262 1.16467e+02 184.262 0.9721 
1 1 1 -8  42  12 o 14 2.88776e+00 7.40738e-01 5.80603e+01 101.385 -4.19139e-01 2.08145e+00  0.00000e+00 0.00000e+00 1.92919e+01 101.385 3.87685e+01 281.385 0.7170 
1 1 1 -8  42  13 o 16 1.30785e+01 4.85632e-01 2.20072e+02 98.369  -5.97331e+00 4.06025e+01  0.00000e+00 0.00000e+00 2.62004e+02 98.369  4.19320e+01 98.369  0.9877 
1 1 1 -8  42  14 o 12 1.39143e+01 2.35560e+00 2.68047e+02 293.570 9.42491e+00  -2.16030e+01 0.00000e+00 0.00000e+00 2.39484e+02 293.570 2.85631e+01 113.571 0.9786 
1 1 1 -8  42  15 o 12 6.23431e+00 2.54778e+00 7.62128e+01 8.992   2.83792e+00  4.49075e-01  0.00000e+00 0.00000e+00 1.09506e+02 8.992   3.32936e+01 8.992   0.8002 
1 1 1 -8  42  16 o 8  3.89954e+00 1.90774e+00 1.08206e+02 208.440 -3.40835e+00 -1.84598e+00 0.00000e+00 0.00000e+00 1.62847e+01 208.440 9.19217e+01 28.440  0.8586 
1 1 1 -8  42  17 o 15 4.62443e+00 2.22569e+00 5.94835e+01 6.563   2.15719e+00  2.48172e-01  0.00000e+00 0.00000e+00 6.48435e+01 6.563   5.36003e+00 6.563   0.7240 
1 1 1 -8  43  1  o 4  1.37862e+01 5.54699e-01 3.82688e+02 29.615  1.26001e+01  7.16230e+00  0.00000e+00 0.00000e+00 1.18136e+02 29.615  2.64552e+02 209.615 0.9649 
1 1 1 -8  43  2  o 17 6.78364e+00 7.04412e-01 1.18531e+02 52.702  1.35505e+00  1.77890e+00  0.00000e+00 0.00000e+00 6.86046e+01 52.702  4.99263e+01 232.702 0.7330 
1 1 1 -8  43  3  o 17 2.02680e+01 7.81047e-01 2.27949e+02 329.342 1.12706e+01  -6.68076e+00 0.00000e+00 0.00000e+00 5.04780e+02 329.342 2.76830e+02 329.342 0.9610 
1 1 1 -8  43  4  o 4  3.14331e+01 6.15067e-01 5.45327e+02 286.626 1.52155e+01  -5.09546e+01 0.00000e+00 0.00000e+00 6.25305e+02 286.626 7.99782e+01 286.626 0.9906 
1 1 1 -8  43  5  o 13 3.21831e+01 6.25526e-01 4.05431e+02 312.061 3.10061e+01  -3.43615e+01 0.00000e+00 0.00000e+00 7.90704e+02 312.061 3.85273e+02 312.061 0.9891 
1 1 1 -8  43  6  o 13 2.44465e+01 5.50963e-01 4.43224e+02 71.261  1.49446e+01  4.40542e+01  0.00000e+00 0.00000e+00 4.64821e+02 71.261  2.15969e+01 71.261  0.9892 
1 1 1 -8  43  7  o 19 3.41786e+01 6.50851e-01 6.49993e+02 124.444 -5.89172e+01 8.59040e+01  0.00000e+00 0.00000e+00 6.26321e+02 124.444 2.36725e+01 304.444 0.9952 
1 1 1 -8  43  8  o 1  9.36066e+00 6.21223e-01 1.86469e+02 226.481 -6.88181e+00 -7.24712e+00 0.00000e+00 0.00000e+00 1.46446e+02 226.481 4.00223e+01 46.481  0.9486 
1 1 1 -8  43  9  o 9  1.48990e+01 5.44043e-01 2.98656e+02 244.904 -1.42201e+01 -3.03621e+01 0.00000e+00 0.00000e+00 2.51105e+02 244.904 4.75516e+01 64.904  0.9850 
1 1 1 -8  43  10 o 3  6.28882e+00 7.27023e-01 1.71644e+02 192.517 -9.35369e+00 -2.07659e+00 0.00000e+00 0.00000e+00 5.10924e+01 192.517 1.20551e+02 12.517  0.9463 
1 1 1 -8  43  11 o 11 1.01002e+01 5.25151e-01 1.30224e+02 212.068 -1.19591e+01 -7.49270e+00 0.00000e+00 0.00000e+00 2.33809e+02 212.068 1.03585e+02 212.068 0.9639 
1 1 1 -8  43  12 o 1  1.02724e+01 5.12014e-01 1.53491e+02 78.620  4.21241e+00  2.09287e+01  0.00000e+00 0.00000e+00 2.21127e+02 78.620  6.76352e+01 78.620  0.9763 
1 1 1 -8  43  13 o 11 1.08822e+01 5.50325e-01 1.16077e+02 248.828 -6.62841e+00 -1.71143e+01 0.00000e+00 0.00000e+00 2.78755e+02 248.828 1.62678e+02 248.828 0.9724 
1 1 1 -8  43  14 o 18 3.68420e+00 1.76274e+00 1.20130e+02 237.432 -2.16472e+00 -3.38899e+00 0.00000e+00 0.00000e+00 1.44594e+00 57.432  1.21576e+02 57.432  0.8643 
1 1 1 -8  43  15 o 15 5.55279e+00 2.38771e+00 4.87328e+01 331.293 1.60217e+00  -8.77431e-01 0.00000e+00 0.00000e+00 8.91731e+01 331.293 4.04403e+01 331.293 0.6672 
1 1 1 -8  43  16 o 14 5.57972e+00 2.49694e+00 8.59147e+01 17.378  2.92676e+00  9.15954e-01  0.00000e+00 0.00000e+00 8.31115e+01 17.378  2.80326e+00 197.378 0.8148 
1 1 1 -8  43  17 o 18 4.63385e+00 1.47991e+00 7.71461e+01 78.734  9.32523e-01  4.68118e+00  0.00000e+00 0.00000e+00 7.56073e+01 78.734  1.53875e+00 258.734 0.8878 
1 1 1 -8  44  1  o 3  2.89382e+01 6.34387e-01 5.82912e+02 96.034  -5.35691e+00 5.06754e+01  0.00000e+00 0.00000e+00 4.95765e+02 96.034  8.71466e+01 276.034 0.9901 
1 1 1 -8  44  2  o 11 1.92920e+01 8.22592e-01 4.46515e+02 256.224 -6.07793e+00 -2.47891e+01 0.00000e+00 0.00000e+00 2.65091e+02 256.224 1.81424e+02 76.224  0.9802 
1 1 1 -8  44  3  o 13 1.46524e+01 5.89427e-01 1.84647e+02 217.962 -6.88067e+00 -5.36839e+00 0.00000e+00 0.00000e+00 3.33865e+02 217.962 1.49218e+02 217.962 0.9408 
1 1 1 -8  44  4  o 16 3.32524e+01 6.37179e-01 5.52548e+02 100.048 -1.02224e+01 5.76935e+01  0.00000e+00 0.00000e+00 6.86786e+02 100.048 1.34238e+02 100.048 0.9914 
1 1 1 -8  44  5  o 5  1.36217e+01 5.72171e-01 2.54332e+02 112.441 -4.57279e+00 1.10717e+01  0.00000e+00 0.00000e+00 2.35590e+02 112.441 1.87419e+01 292.441 0.9573 
1 1 1 -8  44  6  o 8  1.52286e+01 5.14106e-01 2.55145e+02 318.793 1.29526e+01  -1.13417e+01 0.00000e+00 0.00000e+00 2.99760e+02 318.793 4.46149e+01 318.793 0.9705 
1 1 1 -8  44  7  o 19 6.78968e+00 7.28409e-01 1.46935e+02 19.474  4.67867e+00  1.65444e+00  0.00000e+00 0.00000e+00 8.04212e+01 19.474  6.65139e+01 199.474 0.8925 
1 1 1 -8  44  8  f 0  8.78481e+00 6.04476e-01 2.22096e+02 119.513 -5.86912e+00 1.03682e+01  0.00000e+00 0.00000e+00 9.31007e+01 119.513 1.28995e+02 299.513 0.9571 
1 1 1 -8  44  9  o 6  7.30251e+00 6.65910e-01 6.73744e+01 96.468  -4.00630e-01 3.53383e+00  0.00000e+00 0.00000e+00 1.63489e+02 96.468  9.61149e+01 96.468  0.8440 
1 1 1 -8  44  10 o 13 4.42914e+00 7.59277e-01 7.14816e+01 43.955  2.00254e+00  1.93082e+00  0.00000e+00 0.00000e+00 5.98732e+01 43.955  1.16084e+01 223.955 0.7925 
1 1 1 -8  44  11 o 15 3.03781e+00 8.08720e-01 2.79160e+01 192.613 -8.61449e-01 -1.92769e-01 0.00000e+00 0.00000e+00 1.78906e+01 192.613 1.00254e+01 12.613  0.4033 
1 1 1 -8  44  12 o 3  9.55779e+00 5.38005e-01 1.47777e+02 348.687 1.75156e+01  -3.50410e+00 0.00000e+00 0.00000e+00 1.99061e+02 348.687 5.12841e+01 348.687 0.9716 
1 1 1 -8  44  13 o 11 5.67404e+00 7.64096e-01 1.15892e+02 255.872 -2.24002e+00 -8.89964e+00 0.00000e+00 0.00000e+00 8.39106e+01 255.872 3.19818e+01 75.872  0.9438 
1 1 1 -8  44  14 f 0  1.27422e+01 1.02142e+00 2.52484e+02 14.376  4.08799e+01  1.04783e+01  0.00000e+00 0.00000e+00 2.16709e+02 14.376  3.57748e+01 194.376 0.9881 
1 1 1 -8  44  15 f 0  8.72078e+00 2.89708e+00 1.47328e+02 221.143 -4.79730e+00 -4.19128e+00 0.00000e+00 0.00000e+00 1.50573e+02 221.143 3.24556e+00 221.143 0.9178 
1 1 1 -8  44  16 o 3  7.78909e+00 2.46584e+00 1.38550e+02 310.729 4.61434e+00  -5.35921e+00 0.00000e+00 0.00000e+00 1.29670e+02 310.729 8.87946e+00 130.729 0.9263 
1 1 1 -8  44  17 o 3  4.38213e+00 1.43635e+00 1.32742e+02 102.376 -1.78465e+00 8.13303e+00  0.00000e+00 0.00000e+00 1.98361e+01 102.376 1.12906e+02 282.376 0.9379 
1 1 1 -8  45  1  f 0  2.09119e+01 5.71957e-01 2.87749e+02 341.625 1.64601e+01  -5.46759e+00 0.00000e+00 0.00000e+00 4.76371e+02 341.625 1.88623e+02 341.625 0.9707 
1 1 1 -8  45  2  o 18 1.58189e+01 8.48224e-01 3.42685e+02 271.272 3.38348e-01  -1.52370e+01 0.00000e+00 0.00000e+00 2.32649e+02 271.272 1.10036e+02 91.272  0.9666 
1 1 1 -8  45  3  o 5  2.40222e+00 7.64222e-01 2.19720e+02 306.421 9.61430e-01  -1.30307e+00 0.00000e+00 0.00000e+00 1.63320e+02 126.421 3.83039e+02 126.421 0.6243 
1 1 1 -8  45  4  o 14 8.01976e+00 6.70354e-01 1.27527e+02 320.128 2.57106e+00  -2.14760e+00 0.00000e+00 0.00000e+00 1.23539e+02 320.128 3.98782e+00 140.128 0.8329 
1 1 1 -8  45  5  o 7  4.97849e+00 8.55126e-01 1.66221e+02 343.682 3.02269e+00  -8.84942e-01 0.00000e+00 0.00000e+00 1.27782e+01 163.682 1.79000e+02 163.682 0.8205 
1 1 1 -8  45  6  o 12 1.74432e+01 5.82221e-01 3.65615e+02 284.890 7.54195e+00  -2.83647e+01 0.00000e+00 0.00000e+00 2.77964e+02 284.890 8.76511e+01 104.890 0.9828 
1 1 1 -8  45  7  f 0  1.53262e+01 7.18670e-01 3.34186e+02 114.901 -1.15033e+01 2.47813e+01  0.00000e+00 0.00000e+00 2.30138e+02 114.901 1.04048e+02 294.901 0.9815 
1 1 1 -8  45  8  o 18 1.14493e+01 5.49447e-01 1.23838e+02 353.701 8.83378e+00  -9.75074e-01 0.00000e+00 0.00000e+00 2.80417e+02 353.701 1.56580e+02 353.701 0.9419 
1 1 1 -8  45  9  f 0  2.33280e+01 5.69921e-01 3.23384e+02 204.815 -5.30820e+01 -2.45439e+01 0.00000e+00 0.00000e+00 5.42822e+02 204.815 2.19438e+02 204.815 0.9914 
1 1 1 -8  45  10 o 19 1.32518e+01 4.95285e-01 2.19592e+02 44.451  1.92727e+01  1.89067e+01  0.00000e+00 0.00000e+00 2.67008e+02 44.451  4.74167e+01 44.451  0.9813 
1 1 1 -8  45  11 o 15 7.91517e+00 6.02896e-01 1.12878e+02 324.312 7.71191e+00  -5.53918e+00 0.00000e+00 0.00000e+00 1.66973e+02 324.312 5.40956e+01 324.312 0.9458 
1 1 1 -8  45  12 o 3  3.03805e+00 8.26630e-01 5.78262e+01 5.526   2.20872e+00  2.13690e-01  0.00000e+00 0.00000e+00 2.50709e+01 5.526   3.27553e+01 185.526 0.7307 
1 1 1 -8  45  13 o 13 2.58653e+00 7.68320e-01 8.66864e+01 307.179 1.85500e+00  -2.44576e+00 0.00000e+00 0.00000e+00 8.04739e+00 127.179 9.47338e+01 127.179 0.8150 
1 1 1 -8  45  14 o 14 5.23952e+00 1.27202e+00 1.22743e+02 347.351 7.90655e+00  -1.77443e+00 0.00000e+00 0.00000e+00 6.00130e+01 347.351 6.27304e+01 167.351 0.9361 
1 1 1 -8  45  15 o 1  5.71430e+00 2.43208e+00 4.56222e+01 224.392 -1.20706e+00 -1.18173e+00 0.00000e+00 0.00000e+00 9.03893e+01 224.392 4.47671e+01 224.392 0.6396 
1 1 1 -8  45  16 o 10 5.60498e+00 1.61594e+00 4.90908e+01 265.716 -2.39700e-01 -3.20006e+00 0.00000e+00 0.00000e+00 1.22644e+02 265.716 7.35532e+01 265.716 0.8243 
1 1 1 -8  46  1  o 15 2.33817e+01 5.88155e-01 5.53666e+02 326.776 3.49639e+01  -2.29004e+01 0.00000e+00 0.00000e+00 3.15761e+02 326.776 2.37905e+02 146.776 0.9880 
1 1 1 -8  46  2  o 8  4.60006e+01 7.98443e-01 7.79187e+02 344.887 1.09378e+02  -2.95386e+01 0.00000e+00 0.00000e+00 9.43768e+02 344.887 1.64581e+02 344.887 0.9956 
1 1 1 -8  46  3  o 15 2.05324e+01 6.73780e-01 3.92988e+02 119.347 -1.25836e+01 2.23803e+01  0.00000e+00 0.00000e+00 3.63916e+02 119.347 2.90720e+01 299.347 0.9803 
1 1 1 -8  46  4  o 1  1.43257e+01 5.16560e-01 2.83310e+02 130.204 -9.36387e+00 1.10793e+01  0.00000e+00 0.00000e+00 2.36195e+02 130.204 4.71144e+01 310.204 0.9649 
1 1 1 -8  46  5  o 17 1.55759e+01 5.09728e-01 2.42894e+02 97.031  -2.00260e+00 1.62380e+01  0.00000e+00 0.00000e+00 3.23982e+02 97.031  8.10878e+01 97.031  0.9689 
1 1 1 -8  46  6  o 12 1.07198e+01 5.78312e-01 2.15555e+02 300.591 5.70430e+00  -9.64871e+00 0.00000e+00 0.00000e+00 1.68437e+02 300.591 4.71179e+01 120.592 0.9543 
1 1 1 -8  46  7  o 12 1.86956e+01 5.23964e-01 3.08023e+02 162.283 -3.29652e+01 1.05315e+01  0.00000e+00 0.00000e+00 3.83027e+02 162.283 7.50037e+01 162.283 0.9854 
1 1 1 -8  46  8  f 0  4.19600e+00 8.76021e-01 1.91267e+02 292.872 2.02347e+00  -4.79664e+00 0.00000e+00 0.00000e+00 5.00497e+01 112.872 2.41317e+02 112.872 0.8980 
1 1 1 -8  46  9  o 19 1.11137e+01 5.80205e-01 2.10982e+02 242.070 -9.19110e+00 -1.73370e+01 0.00000e+00 0.00000e+00 1.94463e+02 242.070 1.65188e+01 62.070  0.9742 
1 1 1 -8  46  10 o 11 1.46422e+01 5.01473e-01 2.06116e+02 30.471  2.54713e+01  1.49863e+01  0.00000e+00 0.00000e+00 3.32368e+02 30.471  1.26252e+02 30.471  0.9829 
1 1 1 -8  46  11 o 4  4.10527e+00 7.59672e-01 9.70985e+01 147.593 -3.61548e+00 2.29511e+00  0.00000e+00 0.00000e+00 3.69496e+01 147.593 6.01489e+01 327.593 0.8736 
1 1 1 -8  46  12 o 10 2.70845e+00 7.63386e-01 5.42319e+00 140.581 -1.40662e-01 1.15618e-01  0.00000e+00 0.00000e+00 3.74617e+00 140.581 1.67701e+00 320.581 0.0907 
1 1 1 -8  46  13 o 14 4.34487e+00 8.56218e-01 8.65590e+01 329.561 4.84563e+00  -2.84733e+00 0.00000e+00 0.00000e+00 6.02737e+01 329.561 2.62853e+01 149.561 0.9060 
1 1 1 -8  46  14 o 14 1.39409e+01 1.07747e+00 2.39738e+02 274.548 3.49185e+00  -4.39010e+01 0.00000e+00 0.00000e+00 2.73726e+02 274.548 3.39881e+01 274.548 0.9886 
1 1 1 -8  46  15 f 0  7.92465e+00 1.59180e+00 1.38251e+02 196.602 -1.09590e+01 -3.26737e+00 0.00000e+00 0.00000e+00 1.43437e+02 196.602 5.18651e+00 196.602 0.9552 
1 1 1 -8  46  16 o 16 5.09886e+00 1.56063e+00 7.44635e+01 341.027 4.33058e+00  -1.48883e+00 0.00000e+00 0.00000e+00 9.27910e+01 341.027 1.83275e+01 341.027 0.8826 
1 1 1 -8  47  1  o 1  2.27033e+01 5.82398e-01 4.21365e+02 310.789 1.94601e+01  -2.25531e+01 0.00000e+00 0.00000e+00 4.18547e+02 310.789 2.81874e+00 130.789 0.9831 
1 1 1 -8  47  2  o 6  1.12076e+01 5.67208e-01 2.54679e+02 307.703 5.42255e+00  -7.01530e+00 0.00000e+00 0.00000e+00 1.42375e+02 307.703 1.12304e+02 127.703 0.9418 
1 1 1 -8  47  3  o 1  2.60595e+01 5.66373e-01 4.20496e+02 241.899 -1.70487e+01 -3.19280e+01 0.00000e+00 0.00000e+00 5.45678e+02 241.899 1.25182e+02 241.899 0.9861 
1 1 1 -8  47  4  o 12 1.25346e+01 5.42945e-01 2.43809e+02 145.702 -8.74128e+00 5.96239e+00  0.00000e+00 0.00000e+00 2.04382e+02 145.702 3.94269e+01 325.702 0.9515 
1 1 1 -8  47  5  o 14 1.29176e+01 5.38583e-01 1.94876e+02 323.000 8.62164e+00  -6.49691e+00 0.00000e+00 0.00000e+00 2.67212e+02 323.000 7.23354e+01 323.000 0.9525 
1 1 1 -8  47  6  o 3  1.60811e+01 5.11100e-01 1.98185e+02 182.836 -1.51597e+01 -7.51070e-01 0.00000e+00 0.00000e+00 3.85129e+02 182.836 1.86944e+02 182.836 0.9665 
1 1 1 -8  47  7  o 18 1.33116e+01 5.31183e-01 2.67428e+02 294.322 8.43148e+00  -1.86543e+01 0.00000e+00 0.00000e+00 2.19466e+02 294.322 4.79616e+01 114.322 0.9753 
1 1 1 -8  47  8  o 5  1.93197e+01 5.29251e-01 3.06708e+02 103.485 -9.83937e+00 4.10323e+01  0.00000e+00 0.00000e+00 4.08670e+02 103.485 1.01962e+02 103.485 0.9881 
1 1 1 -8  47  9  o 11 1.37617e+01 5.52275e-01 2.29837e+02 156.028 -2.29076e+01 1.01855e+01  0.00000e+00 0.00000e+00 2.75069e+02 156.028 4.52314e+01 156.028 0.9798 
1 1 1 -8  47  10 o 3  1.43432e+01 6.94264e-01 2.86566e+02 21.090  3.64230e+01  1.40471e+01  0.00000e+00 0.00000e+00 2.43093e+02 21.090  4.34740e+01 201.090 0.9871 
1 1 1 -8  47  11 o 8  1.05202e+01 6.42422e-01 1.64630e+02 218.608 -1.53088e+01 -1.22243e+01 0.00000e+00 0.00000e+00 2.18380e+02 218.608 5.37505e+01 218.608 0.9741 
1 1 1 -8  47  12 o 11 7.16194e+00 7.65577e-01 1.30639e+02 8.008   1.22406e+01  1.72195e+00  0.00000e+00 0.00000e+00 1.25701e+02 8.008   4.93755e+00 188.008 0.9587 
1 1 1 -8  47  13 o 17 7.96088e+00 6.88247e-01 1.80890e+02 227.191 -1.53568e+01 -1.65786e+01 0.00000e+00 0.00000e+00 1.09366e+02 227.191 7.15236e+01 47.191  0.9776 
1 1 1 -8  47  14 o 15 4.26890e+00 1.14322e+00 9.30732e+01 86.772  3.09108e-01  5.48024e+00  0.00000e+00 0.00000e+00 5.06242e+01 86.772  4.24490e+01 266.772 0.9036 
1 1 1 -8  47  15 o 10 5.00502e+00 1.46786e+00 7.06574e+01 42.433  3.12872e+00  2.86018e+00  0.00000e+00 0.00000e+00 9.17522e+01 42.433  2.10948e+01 42.433  0.8721 
1 1 1 -8  47  16 o 1  5.65544e+00 1.63344e+00 1.45506e+02 17.198  9.12649e+00  2.82482e+00  0.00000e+00 0.00000e+00 5.33273e+01 17.198  9.21785e+01 197.198 0.9461 
1 1 1 -8  48  1  o 18 4.55911e+01 8.55332e-01 8.42216e+02 258.329 -2.43203e+01 -1.17737e+02 0.00000e+00 0.00000e+00 8.66109e+02 258.329 2.38920e+01 258.329 0.9958 
1 1 1 -8  48  2  o 15 1.39781e+01 5.42600e-01 2.57179e+02 240.425 -5.88081e+00 -1.03626e+01 0.00000e+00 0.00000e+00 2.45992e+02 240.425 1.11871e+01 60.425  0.9571 
1 1 1 -8  48  3  o 15 9.12464e+00 6.92818e-01 1.37246e+02 332.983 3.93210e+00  -2.00499e+00 0.00000e+00 0.00000e+00 1.63846e+02 332.983 2.65998e+01 332.983 0.8777 
1 1 1 -8  48  4  f 0  2.62745e+01 5.69590e-01 3.83684e+02 181.261 -3.94632e+01 -8.68786e-01 0.00000e+00 0.00000e+00 5.90962e+02 181.261 2.07279e+02 181.261 0.9873 
1 1 1 -8  48  5  o 17 2.61667e+01 9.48958e-01 4.21452e+02 134.333 -3.23609e+01 3.31229e+01  0.00000e+00 0.00000e+00 5.50472e+02 134.333 1.29019e+02 134.333 0.9891 
1 1 1 -8  48  6  o 14 1.12556e+01 5.40172e-01 2.81111e+02 342.282 1.53458e+01  -4.90286e+00 0.00000e+00 0.00000e+00 1.27946e+02 342.282 1.53165e+02 162.282 0.9684 
1 1 1 -8  48  7  o 12 1.93133e+01 5.26995e-01 3.66405e+02 58.378  2.14854e+01  3.48938e+01  0.00000e+00 0.00000e+00 3.48945e+02 58.378  1.74594e+01 238.378 0.9877 
1 1 1 -8  48  8  o 2  1.09850e+01 5.67499e-01 1.66563e+02 97.650  -1.83188e+00 1.36389e+01  0.00000e+00 0.00000e+00 2.29801e+02 97.650  6.32374e+01 97.650  0.9630 
1 1 1 -8  48  9  o 4  7.05674e+00 8.26708e-01 1.00281e+02 91.256  -1.28187e-01 5.84490e+00  0.00000e+00 0.00000e+00 1.40111e+02 91.256  3.98302e+01 91.256  0.9099 
1 1 1 -8  48  10 o 7  6.95639e+00 8.27612e-01 2.00906e+02 315.581 9.14836e+00  -8.96480e+00 0.00000e+00 0.00000e+00 4.89247e+01 315.581 1.51981e+02 135.581 0.9601 
1 1 1 -8  48  11 o 12 1.11447e+01 6.25563e-01 1.38385e+02 291.996 6.88573e+00  -1.70461e+01 0.00000e+00 0.00000e+00 2.66590e+02 291.996 1.28204e+02 291.996 0.9724 
1 1 1 -8  48  12 o 8  3.99624e+00 8.52486e-01 9.36292e+01 193.679 -4.66330e+00 -1.13499e+00 0.00000e+00 0.00000e+00 3.89213e+01 193.679 5.47080e+01 13.679  0.8885 
1 1 1 -8  48  13 o 1  8.49928e+00 6.82397e-01 1.32040e+02 115.210 -7.56190e+00 1.60627e+01  0.00000e+00 0.00000e+00 1.75840e+02 115.210 4.37991e+01 115.210 0.9714 
1 1 1 -8  48  14 o 1  2.96761e+00 8.49430e-01 3.69573e+01 67.168  7.03756e-01  1.67153e+00  0.00000e+00 0.00000e+00 3.65124e+01 67.168  4.44914e-01 247.168 0.6647 
1 1 1 -8  48  15 o 16 5.82978e+00 1.53173e+00 1.11906e+02 253.566 -2.10013e+00 -7.11992e+00 0.00000e+00 0.00000e+00 8.97884e+01 253.566 2.21179e+01 73.566  0.9300 
1 1 1 -8  48  16 o 8  4.70342e+00 1.47476e+00 1.01760e+02 116.278 -2.84357e+00 5.75908e+00  0.00000e+00 0.00000e+00 5.87477e+01 116.278 4.30124e+01 296.278 0.9185 
1 1 1 -8  49  1  f 0  2.26765e+01 6.60992e-01 2.20159e+02 81.906  2.30567e+00  1.62118e+01  0.00000e+00 0.00000e+00 6.06511e+02 81.906  3.86352e+02 81.906  0.9690 
1 1 1 -8  49  2  o 3  1.81481e+01 8.74412e-01 1.88220e+02 211.261 -1.01185e+01 -6.14275e+00 0.00000e+00 0.00000e+00 4.64774e+02 211.261 2.76554e+02 211.261 0.9568 
1 1 1 -8  49  3  o 18 2.77082e+01 5.85276e-01 4.39233e+02 294.400 1.73543e+01  -3.82570e+01 0.00000e+00 0.00000e+00 5.89817e+02 294.400 1.50585e+02 294.400 0.9880 
1 1 1 -8  49  4  o 5  3.14378e+01 6.53486e-01 6.42133e+02 112.543 -3.29666e+01 7.94210e+01  0.00000e+00 0.00000e+00 5.32058e+02 112.543 1.10076e+02 292.543 0.9942 
1 1 1 -8  49  5  o 6  2.29771e+01 5.44071e-01 3.74436e+02 242.250 -1.84443e+01 -3.50568e+01 0.00000e+00 0.00000e+00 4.77309e+02 242.250 1.02873e+02 242.250 0.9873 
1 1 1 -8  49  6  o 12 4.73493e+00 8.84278e-01 1.89637e+02 82.459  6.12461e-01  4.62654e+00  0.00000e+00 0.00000e+00 3.23992e+01 262.459 2.22036e+02 262.459 0.8850 
1 1 1 -8  49  7  o 19 7.15298e+00 8.23631e-01 9.34012e+01 143.882 -3.24922e+00 2.37096e+00  0.00000e+00 0.00000e+00 1.38423e+02 143.882 4.50214e+01 143.882 0.8644 
1 1 1 -8  49  8  o 6  1.39898e+01 6.39771e-01 2.49533e+02 26.262  2.27797e+01  1.12398e+01  0.00000e+00 0.00000e+00 2.64176e+02 26.262  1.46427e+01 26.262  0.9801 
1 1 1 -8  49  9  o 10 3.21341e+00 8.59429e-01 3.80070e+01 338.485 9.75272e-01  -3.84459e-01 0.00000e+00 0.00000e+00 1.77173e+01 338.485 2.02897e+01 158.485 0.4632 
1 1 1 -8  49  10 o 15 1.76467e+01 7.01719e-01 2.86387e+02 280.723 9.84594e+00  -5.19954e+01 0.00000e+00 0.00000e+00 3.67335e+02 280.723 8.09485e+01 280.723 0.9905 
1 1 1 -8  49  11 o 16 1.30017e+01 6.22293e-01 2.77608e+02 115.895 -1.98458e+01 4.08806e+01  0.00000e+00 0.00000e+00 2.02812e+02 115.895 7.47958e+01 295.895 0.9889 
1 1 1 -8  49  12 o 8  8.33737e+00 6.99163e-01 1.08687e+02 268.222 -3.96549e-01 -1.27764e+01 0.00000e+00 0.00000e+00 1.90079e+02 268.222 8.13914e+01 268.222 0.9601 
1 1 1 -8  49  13 o 7  1.19993e+01 5.86565e-01 2.28486e+02 104.787 -1.13742e+01 4.30897e+01  0.00000e+00 0.00000e+00 2.13864e+02 104.787 1.46222e+01 284.787 0.9887 
1 1 1 -8  49  14 o 12 6.84040e+00 8.14522e-01 8.47261e+01 36.051  7.85447e+00  5.71731e+00  0.00000e+00 0.00000e+00 1.56536e+02 36.051  7.18104e+01 36.051  0.9470 
1 1 1 -8  49  15 o 19 4.00123e+00 1.29201e+00 6.00836e+01 196.443 -3.18996e+00 -9.41448e-01 0.00000e+00 0.00000e+00 6.36687e+01 196.443 3.58509e+00 196.443 0.8315 
1 1 1 -8  49  16 o 19 5.35777e+00 1.61051e+00 1.86563e+02 328.826 1.00758e+01  -6.09589e+00 0.00000e+00 0.00000e+00 3.83199e+00 328.826 1.82731e+02 148.826 0.9566 
1 1 1 -8  50  1  o 15 3.26107e+01 6.46629e-01 5.69947e+02 123.329 -3.61364e+01 5.49522e+01  0.00000e+00 0.00000e+00 6.47417e+02 123.329 7.74695e+01 123.329 0.9924 
1 1 1 -8  50  2  o 13 1.40213e+01 5.41100e-01 3.05060e+02 166.457 -1.44204e+01 3.47335e+00  0.00000e+00 0.00000e+00 2.04069e+02 166.457 1.00991e+02 346.457 0.9657 
1 1 1 -8  50  3  o 12 1.47549e+01 5.47231e-01 3.60254e+02 245.945 -8.49769e+00 -1.90374e+01 0.00000e+00 0.00000e+00 1.80825e+02 245.945 1.79429e+02 65.945  0.9757 
1 1 1 -8  50  4  o 9  2.66628e+01 5.72018e-01 3.96997e+02 20.282  4.37851e+01  1.61811e+01  0.00000e+00 0.00000e+00 5.93768e+02 20.282  1.96771e+02 20.282  0.9892 
1 1 1 -8  50  5  o 1  2.54064e+01 5.62886e-01 4.95203e+02 187.981 -5.91353e+01 -8.29108e+00 0.00000e+00 0.00000e+00 4.50565e+02 187.981 4.46377e+01 7.981   0.9916 
1 1 1 -8  50  6  o 2  2.80360e+01 6.46155e-01 6.07223e+02 245.360 -4.19719e+01 -9.15043e+01 0.00000e+00 0.00000e+00 4.39354e+02 245.360 1.67869e+02 65.360  0.9950 
1 1 1 -8  50  7  o 12 1.36870e+01 6.28767e-01 3.41907e+02 26.262  2.85908e+01  1.41067e+01  0.00000e+00 0.00000e+00 1.63098e+02 26.262  1.78809e+02 206.262 0.9842 
1 1 1 -8  50  8  o 15 7.25134e+00 8.30180e-01 1.47163e+02 243.315 -3.53254e+00 -7.02835e+00 0.00000e+00 0.00000e+00 1.06570e+02 243.315 4.05935e+01 63.315  0.9341 
1 1 1 -8  50  9  o 12 1.21995e+01 5.83220e-01 2.26164e+02 335.731 2.29987e+01  -1.03694e+01 0.00000e+00 0.00000e+00 2.21306e+02 335.731 4.85774e+00 155.731 0.9800 
1 1 1 -8  50  10 o 2  3.99476e+00 8.96003e-01 4.83658e+01 198.550 -1.85640e+00 -6.22960e-01 0.00000e+00 0.00000e+00 5.48254e+01 198.550 6.45967e+00 198.550 0.6908 
1 1 1 -8  50  11 o 5  5.46005e+00 7.84951e-01 1.13447e+02 73.941  2.13383e+00  7.41255e+00  0.00000e+00 0.00000e+00 7.68120e+01 73.941  3.66351e+01 253.941 0.9327 
1 1 1 -8  50  12 o 15 2.20754e+00 7.08090e-01 2.06003e+01 83.516  6.84388e-02  6.02160e-01  0.00000e+00 0.00000e+00 3.28429e+00 83.516  1.73160e+01 263.516 0.2899 
1 1 1 -8  50  13 o 7  5.11773e+00 8.16387e-01 8.29010e+01 202.241 -5.84070e+00 -2.38844e+00 0.00000e+00 0.00000e+00 9.20388e+01 202.241 9.13780e+00 202.241 0.9169 
1 1 1 -8  50  14 o 19 7.20709e+00 8.12785e-01 1.57238e+02 66.092  7.87059e+00  1.77544e+01  0.00000e+00 0.00000e+00 1.04132e+02 66.092  5.31062e+01 246.092 0.9739 
1 1 1 -8  50  15 o 1  3.85891e+00 1.26369e+00 6.13809e+01 32.290  2.63135e+00  1.66284e+00  0.00000e+00 0.00000e+00 5.60180e+01 32.290  5.36285e+00 212.290 0.8180 
1 1 1 -8  50  16 o 2  3.54253e+00 1.20059e+00 8.07546e+01 149.480 -4.09472e+00 2.41389e+00  0.00000e+00 0.00000e+00 3.60070e+01 149.480 4.47476e+01 329.480 0.8873 
1 1 1 -8  51  1  o 17 8.13532e+00 6.89349e-01 2.03226e+02 323.991 4.57640e+00  -3.32608e+00 0.00000e+00 0.00000e+00 7.42065e+01 323.991 1.29020e+02 143.991 0.9067 
1 1 1 -8  51  2  o 19 8.02396e+00 7.41536e-01 1.33426e+02 2.549   4.12435e+00  1.83584e-01  0.00000e+00 0.00000e+00 1.28512e+02 2.549   4.91330e+00 182.549 0.8683 
1 1 1 -8  51  3  o 6  2.42380e+01 5.57841e-01 4.34239e+02 342.884 4.31902e+01  -1.32999e+01 0.00000e+00 0.00000e+00 4.66458e+02 342.884 3.22192e+01 342.884 0.9889 
1 1 1 -8  51  4  o 8  1.92378e+01 5.51221e-01 2.24452e+02 197.333 -1.90235e+01 -5.93717e+00 0.00000e+00 0.00000e+00 4.79721e+02 197.333 2.55269e+02 197.333 0.9746 
1 1 1 -8  51  5  o 10 3.15147e+01 6.22075e-01 6.18380e+02 49.879  6.34422e+01  7.52846e+01  0.00000e+00 0.00000e+00 5.58534e+02 49.879  5.98456e+01 229.879 0.9949 
1 1 1 -8  51  6  o 18 7.06777e+00 9.99244e-01 1.18772e+02 64.671  1.91595e+00  4.04801e+00  0.00000e+00 0.00000e+00 1.14455e+02 64.671  4.31733e+00 244.671 0.8797 
1 1 1 -8  51  7  o 9  2.23702e+01 6.61919e-01 3.69435e+02 48.156  3.85270e+01  4.30233e+01  0.00000e+00 0.00000e+00 4.61806e+02 48.156  9.23706e+01 48.156  0.9913 
1 1 1 -8  51  8  o 5  2.43719e+01 6.89855e-01 3.69087e+02 118.797 -3.55256e+01 6.46285e+01  0.00000e+00 0.00000e+00 5.37554e+02 118.797 1.68466e+02 118.797 0.9932 
1 1 1 -8  51  9  o 9  1.28195e+01 5.85121e-01 2.15588e+02 256.264 -5.98699e+00 -2.44922e+01 0.00000e+00 0.00000e+00 2.54552e+02 256.264 3.89646e+01 256.264 0.9800 
1 1 1 -8  51  10 o 2  1.37010e+01 5.78962e-01 2.97929e+02 330.560 3.80610e+01  -2.14813e+01 0.00000e+00 0.00000e+00 2.08455e+02 330.560 8.94742e+01 150.560 0.9885 
1 1 1 -8  51  11 o 8  9.82512e+00 5.61906e-01 1.82147e+02 125.356 -1.38184e+01 1.94762e+01  0.00000e+00 0.00000e+00 1.77090e+02 125.356 5.05627e+00 305.356 0.9788 
1 1 1 -8  51  12 o 14 7.23017e+00 7.09315e-01 9.65305e+01 90.024  -4.02218e-03 9.62022e+00  0.00000e+00 0.00000e+00 1.58834e+02 90.024  6.23037e+01 90.024  0.9465 
1 1 1 -8  51  13 o 6  2.71563e+00 8.02007e-01 8.96038e+01 218.444 -2.85109e+00 -2.26333e+00 0.00000e+00 0.00000e+00 3.75416e+00 38.444  9.33579e+01 38.444  0.8481 
1 1 1 -8  51  14 o 14 9.25104e+00 7.26215e-01 1.91479e+02 3.197   2.98099e+01  1.66482e+00  0.00000e+00 0.00000e+00 1.47139e+02 3.197   4.43403e+01 183.197 0.9831 
1 1 1 -8  51  15 o 15 1.04800e+01 1.71356e+00 9.08248e+01 297.885 4.60986e+00  -8.71190e+00 0.00000e+00 0.00000e+00 2.78566e+02 297.885 1.87741e+02 297.885 0.9478 
1 1 1 -8  51  16 o 2  4.01785e+00 1.31418e+00 7.72021e+01 144.525 -3.82818e+00 2.72809e+00  0.00000e+00 0.00000e+00 5.50021e+01 144.525 2.22000e+01 324.525 0.8859 
1 1 1 -8  52  1  o 11 1.97386e+01 5.53250e-01 2.75599e+02 299.263 1.14902e+01  -2.05060e+01 0.00000e+00 0.00000e+00 4.50741e+02 299.263 1.75141e+02 299.263 0.9785 
1 1 1 -8  52  2  o 16 2.66891e+01 6.80356e-01 3.41993e+02 94.273  -2.89146e+00 3.86978e+01  0.00000e+00 0.00000e+00 6.48269e+02 94.273  3.06276e+02 94.273  0.9870 
1 1 1 -8  52  3  f 0  3.14497e+01 6.24721e-01 4.01334e+02 248.976 -1.98547e+01 -5.16592e+01 0.00000e+00 0.00000e+00 7.69609e+02 248.976 3.68276e+02 248.976 0.9909 
1 1 1 -8  52  4  o 16 1.42588e+01 6.14509e-01 1.86492e+02 13.536  1.24854e+01  3.00578e+00  0.00000e+00 0.00000e+00 3.27682e+02 13.536  1.41191e+02 13.536  0.9602 
1 1 1 -8  52  5  o 19 6.63696e+00 8.90524e-01 1.28537e+02 150.714 -3.86582e+00 2.16812e+00  0.00000e+00 0.00000e+00 9.02402e+01 150.714 3.82972e+01 330.714 0.8783 
1 1 1 -8  52  6  o 14 4.97142e+00 9.69500e-01 1.65887e+02 135.984 -3.40678e+00 3.29178e+00  0.00000e+00 0.00000e+00 5.14773e-01 315.983 1.66401e+02 315.983 0.8869 
1 1 1 -8  52  7  o 14 1.77254e+01 6.21629e-01 2.85310e+02 175.156 -3.73350e+01 3.16391e+00  0.00000e+00 0.00000e+00 3.70096e+02 175.156 8.47853e+01 175.156 0.9866 
1 1 1 -8  52  8  o 9  2.26847e+01 6.75361e-01 3.70947e+02 279.324 1.05746e+01  -6.44071e+01 0.00000e+00 0.00000e+00 4.72058e+02 279.324 1.01111e+02 279.324 0.9923 
1 1 1 -8  52  9  o 8  1.20844e+01 5.76674e-01 2.39130e+02 310.791 1.82045e+01  -2.10965e+01 0.00000e+00 0.00000e+00 2.04857e+02 310.791 3.42722e+01 130.791 0.9819 
1 1 1 -8  52  10 f 0  3.00033e+00 7.64358e-01 7.37862e+01 156.364 -2.17870e+00 9.53467e-01  0.00000e+00 0.00000e+00 1.04585e+01 156.364 6.33278e+01 336.364 0.7511 
1 1 1 -8  52  11 o 15 3.39628e+00 8.44822e-01 7.94276e+01 251.627 -9.75746e-01 -2.93777e+00 0.00000e+00 0.00000e+00 2.41813e+01 251.627 5.52462e+01 71.627  0.8168 
1 1 1 -8  52  12 o 2  8.82643e+00 6.26315e-01 1.91189e+02 171.073 -2.44829e+01 3.84580e+00  0.00000e+00 0.00000e+00 1.31413e+02 171.073 5.97763e+01 351.073 0.9796 
1 1 1 -8  52  13 o 3  7.21912e+00 7.77710e-01 1.71974e+02 56.376  1.01138e+01  1.52086e+01  0.00000e+00 0.00000e+00 8.96085e+01 56.376  8.23650e+01 236.376 0.9722 
1 1 1 -8  52  14 o 3  4.16577e+00 8.28443e-01 1.23809e+02 25.193  8.13199e+00  3.82544e+00  0.00000e+00 0.00000e+00 2.23696e+01 25.193  1.01439e+02 205.193 0.9426 
1 1 1 -8  52  15 f 0  6.96427e+00 1.58767e+00 4.18012e+01 203.154 -3.04005e+00 -1.30011e+00 0.00000e+00 0.00000e+00 1.73205e+02 203.154 1.31403e+02 203.154 0.8303 
1 1 1 -8  52  16 o 19 4.28045e+00 1.36829e+00 5.16730e+01 98.195  -4.60659e-01 3.19854e+00  0.00000e+00 0.00000e+00 7.95824e+01 98.195  2.79094e+01 98.195  0.8257 
1 1 1 -8  53  1  o 12 1.56149e+01 5.61977e-01 2.38656e+02 292.236 6.04877e+00  -1.47951e+01 0.00000e+00 0.00000e+00 3.29810e+02 292.236 9.11535e+01 292.236 0.9682 
1 1 1 -8  53  2  o 15 1.29728e+01 6.35443e-01 1.64096e+02 333.066 8.32190e+00  -4.22809e+00 0.00000e+00 0.00000e+00 2.96589e+02 333.066 1.32493e+02 333.066 0.9448 
1 1 1 -8  53  3  o 9  6.43648e+00 9.77106e-01 8.21366e+01 277.639 3.06765e-01  -2.28716e+00 0.00000e+00 0.00000e+00 9.73672e+01 277.639 1.52307e+01 277.639 0.7423 
1 1 1 -8  53  4  o 11 1.93276e+01 6.40697e-01 3.09507e+02 9.223   2.77068e+01  4.49872e+00  0.00000e+00 0.00000e+00 4.03154e+02 9.223   9.36473e+01 9.223   0.9820 
1 1 1 -8  53  5  o 12 1.61701e+01 6.09149e-01 3.08632e+02 302.199 1.58140e+01  -2.51132e+01 0.00000e+00 0.00000e+00 2.87843e+02 302.199 2.07892e+01 122.199 0.9830 
1 1 1 -8  53  6  o 15 2.25506e+01 7.76059e-01 5.07011e+02 140.825 -5.37617e+01 4.38083e+01  0.00000e+00 0.00000e+00 3.32530e+02 140.825 1.74481e+02 320.825 0.9928 
1 1 1 -8  53  7  o 7  1.24533e+01 6.30054e-01 1.72903e+02 1.875   1.59838e+01  5.23322e-01  0.00000e+00 0.00000e+00 2.78934e+02 1.875   1.06031e+02 1.875   0.9682 
1 1 1 -8  53  8  o 18 1.17091e+01 1.32857e+00 2.90340e+02 69.959  8.24619e+00  2.26054e+01  0.00000e+00 0.00000e+00 1.38890e+02 69.959  1.51450e+02 249.959 0.9790 
1 1 1 -8  53  9  o 3  4.45838e+00 8.69000e-01 7.75299e+01 272.942 1.60992e-01  -3.13289e+00 0.00000e+00 0.00000e+00 5.91844e+01 272.942 1.83455e+01 92.942  0.8196 
1 1 1 -8  53  10 o 15 8.09525e+00 6.30552e-01 1.08648e+02 224.465 -6.55530e+00 -6.43397e+00 0.00000e+00 0.00000e+00 1.76965e+02 224.465 6.83170e+01 224.465 0.9439 
1 1 1 -8  53  11 o 15 4.02741e+00 7.75259e-01 2.35181e+01 310.613 7.61151e-01  -8.87639e-01 0.00000e+00 0.00000e+00 5.21565e+01 310.613 2.86384e+01 310.613 0.5032 
1 1 1 -8  53  12 o 12 7.87493e+00 6.65402e-01 2.03168e+02 54.052  1.33551e+01  1.84172e+01  0.00000e+00 0.00000e+00 8.40742e+01 54.052  1.19094e+02 234.052 0.9778 
1 1 1 -8  53  13 o 7  1.27968e+01 6.15912e-01 2.57318e+02 216.309 -4.71844e+01 -3.46714e+01 0.00000e+00 0.00000e+00 2.15457e+02 216.309 4.18605e+01 36.309  0.9914 
1 1 1 -8  53  14 o 3  7.12097e+00 8.61989e-01 9.18114e+01 315.663 7.88559e+00  -7.70527e+00 0.00000e+00 0.00000e+00 1.60921e+02 315.663 6.91091e+01 315.663 0.9535 
1 1 1 -8  53  15 o 10 5.21566e+00 1.46261e+00 8.42298e+01 162.998 -5.23833e+00 1.60169e+00  0.00000e+00 0.00000e+00 9.09397e+01 162.998 6.70984e+00 162.998 0.9034 
1 1 1 -8  53  16 o 9  8.18421e+00 1.78182e+00 9.60251e+01 302.173 4.46642e+00  -7.09988e+00 0.00000e+00 0.00000e+00 1.89116e+02 302.173 9.30907e+01 302.173 0.9383 
1 1 1 -8  54  1  o 19 6.10220e+00 9.46433e-01 1.14966e+02 180.514 -2.95095e+00 -2.64691e-02 0.00000e+00 0.00000e+00 7.00131e+01 180.514 4.49530e+01 0.514   0.8063 
1 1 1 -8  54  2  o 8  2.50163e+01 8.51455e-01 4.35751e+02 302.380 2.60011e+01  -4.10029e+01 0.00000e+00 0.00000e+00 4.94635e+02 302.380 5.88837e+01 302.380 0.9896 
1 1 1 -8  54  3  o 1  1.75016e+01 6.83310e-01 2.71311e+02 182.642 -2.27071e+01 -1.04773e+00 0.00000e+00 0.00000e+00 3.71465e+02 182.642 1.00153e+02 182.642 0.9778 
1 1 1 -8  54  4  o 19 1.55232e+01 6.35604e-01 3.53870e+02 319.730 2.10629e+01  -1.78438e+01 0.00000e+00 0.00000e+00 2.18251e+02 319.730 1.35619e+02 139.730 0.9817 
1 1 1 -8  54  5  o 7  2.00441e+01 6.34593e-01 3.42802e+02 12.195  3.81079e+01  8.23591e+00  0.00000e+00 0.00000e+00 3.99541e+02 12.195  5.67396e+01 12.195  0.9871 
1 1 1 -8  54  6  o 16 1.23294e+01 6.43348e-01 1.89977e+02 257.748 -3.37296e+00 -1.55328e+01 0.00000e+00 0.00000e+00 2.57530e+02 257.748 6.75534e+01 257.748 0.9680 
1 1 1 -8  54  7  o 17 4.89741e+00 1.01894e+00 1.24910e+02 314.228 3.00360e+00  -3.08567e+00 0.00000e+00 0.00000e+00 3.55293e+01 314.228 8.93805e+01 134.228 0.8743 
1 1 1 -8  54  8  o 13 1.17895e+01 5.77759e-01 1.98893e+02 129.656 -1.37333e+01 1.65677e+01  0.00000e+00 0.00000e+00 2.32114e+02 129.656 3.32211e+01 129.656 0.9765 
1 1 1 -8  54  9  o 3  6.13338e+00 6.84201e-01 1.36758e+02 188.698 -8.74034e+00 -1.33713e+00 0.00000e+00 0.00000e+00 7.92834e+01 188.698 5.74748e+01 8.698   0.9416 
1 1 1 -8  54  10 o 16 9.24677e+00 6.15891e-01 2.36368e+02 115.424 -1.06648e+01 2.24358e+01  0.00000e+00 0.00000e+00 1.02189e+02 115.424 1.34178e+02 295.424 0.9797 
1 1 1 -8  54  11 o 8  1.19679e+01 5.67685e-01 1.84424e+02 147.199 -2.62091e+01 1.68914e+01  0.00000e+00 0.00000e+00 2.55204e+02 147.199 7.07796e+01 147.199 0.9838 
1 1 1 -8  54  12 o 15 5.88404e+00 7.78423e-01 6.88341e+01 264.292 -6.23735e-01 -6.24049e+00 0.00000e+00 0.00000e+00 1.32285e+02 264.292 6.34510e+01 264.292 0.9164 
1 1 1 -8  54  13 o 11 5.37098e+00 9.33483e-01 1.13317e+02 17.458  8.24045e+00  2.59164e+00  0.00000e+00 0.00000e+00 7.48335e+01 17.458  3.84833e+01 197.458 0.9402 
1 1 1 -8  54  14 f 0  1.36602e+01 6.28009e-01 1.85416e+02 160.325 -4.62121e+01 1.65232e+01  0.00000e+00 0.00000e+00 3.17759e+02 160.325 1.32343e+02 160.325 0.9898 
1 1 1 -8  54  15 o 18 4.88766e+00 1.40626e+00 7.35179e+01 274.072 3.34077e-01  -4.69260e+00 0.00000e+00 0.00000e+00 8.74591e+01 274.072 1.39413e+01 274.072 0.8860 
1 1 1 -8  54  16 o 3  4.17967e+00 1.33999e+00 4.40338e+01 108.277 -8.53231e-01 2.58342e+00  0.00000e+00 0.00000e+00 7.80835e+01 108.277 3.40497e+01 108.277 0.7870 
1 1 1 -8  55  1  o 11 8.99960e+00 9.75227e-01 1.23931e+02 293.114 1.90950e+00  -4.47364e+00 0.00000e+00 0.00000e+00 1.77198e+02 293.114 5.32677e+01 293.114 0.8901 
1 1 1 -8  55  2  o 10 3.16600e+01 8.50513e-01 4.55134e+02 117.429 -3.10857e+01 5.98951e+01  0.00000e+00 0.00000e+00 7.25632e+02 117.429 2.70499e+02 117.429 0.9926 
1 1 1 -8  55  3  f 0  3.20662e+01 7.56082e-01 4.81052e+02 253.054 -2.23517e+01 -7.33545e+01 0.00000e+00 0.00000e+00 7.15371e+02 253.054 2.34318e+02 253.054 0.9935 
1 1 1 -8  55  4  o 18 1.72045e+01 6.40521e-01 2.89208e+02 320.770 2.28622e+01  -1.86656e+01 0.00000e+00 0.00000e+00 3.45556e+02 320.770 5.63483e+01 320.770 0.9829 
1 1 1 -8  55  5  o 16 2.39282e+01 6.61596e-01 4.73904e+02 67.984  2.58118e+01  6.38343e+01  0.00000e+00 0.00000e+00 4.17202e+02 67.984  5.67019e+01 247.984 0.9927 
1 1 1 -8  55  6  o 9  1.83359e+01 7.40158e-01 3.14300e+02 219.957 -3.03844e+01 -2.54566e+01 0.00000e+00 0.00000e+00 3.64377e+02 219.957 5.00769e+01 219.957 0.9873 
1 1 1 -8  55  7  o 13 2.24279e+01 6.61156e-01 3.59779e+02 98.997  -1.04177e+01 6.57959e+01  0.00000e+00 0.00000e+00 4.74095e+02 98.997  1.14317e+02 98.997  0.9925 
1 1 1 -8  55  8  o 8  3.70323e+00 8.37435e-01 9.08602e+01 64.763  1.23478e+00  2.61964e+00  0.00000e+00 0.00000e+00 2.03160e+01 64.763  7.05442e+01 244.763 0.8020 
1 1 1 -8  55  9  o 13 3.25695e+00 7.98144e-01 7.78487e+01 331.728 2.23607e+00  -1.20258e+00 0.00000e+00 0.00000e+00 1.58481e+01 331.728 6.20006e+01 151.728 0.7692 
1 1 1 -8  55  10 o 6  7.61706e+00 6.38922e-01 1.25354e+02 25.770  1.07755e+01  5.20222e+00  0.00000e+00 0.00000e+00 1.47114e+02 25.770  2.17601e+01 25.770  0.9573 
1 1 1 -8  55  11 o 10 2.69524e+00 7.93807e-01 3.98872e+01 168.438 -1.38238e+00 2.82805e-01  0.00000e+00 0.00000e+00 1.78031e+01 168.438 2.20842e+01 348.438 0.5734 
1 1 1 -8  55  12 o 6  5.91694e+00 8.08973e-01 1.56459e+02 246.393 -5.51941e+00 -1.26295e+01 0.00000e+00 0.00000e+00 5.60442e+01 246.393 1.00415e+02 66.393  0.9630 
1 1 1 -8  55  13 o 10 1.25275e+01 6.09027e-01 1.64280e+02 202.084 -3.47099e+01 -1.40827e+01 0.00000e+00 0.00000e+00 2.96137e+02 202.084 1.31857e+02 202.084 0.9866 
1 1 1 -8  55  14 o 19 2.93809e+00 9.08264e-01 6.62218e+01 288.076 9.42498e-01  -2.88764e+00 0.00000e+00 0.00000e+00 2.26317e+01 288.076 4.35901e+01 108.076 0.8127 
1 1 1 -8  55  15 o 18 7.85687e+00 1.71624e+00 1.46952e+02 124.236 -7.03488e+00 1.03375e+01  0.00000e+00 0.00000e+00 1.33123e+02 124.236 1.38290e+01 304.236 0.9591 
1 1 1 -8  55  16 o 19 5.06263e+00 1.52604e+00 1.13953e+02 181.010 -7.71307e+00 -1.35980e-01 0.00000e+00 0.00000e+00 6.13238e+01 181.010 5.26290e+01 1.010   0.9327 
1 1 1 -8  56  1  o 1  2.47239e+01 6.94313e-01 4.19016e+02 207.065 -4.31590e+01 -2.20528e+01 0.00000e+00 0.00000e+00 5.00580e+02 207.065 8.15639e+01 207.065 0.9896 
1 1 1 -8  56  2  o 4  6.21977e+00 9.44021e-01 1.10587e+02 223.112 -2.25952e+00 -2.11529e+00 0.00000e+00 0.00000e+00 8.02697e+01 223.112 3.03173e+01 43.112  0.8168 
1 1 1 -8  56  3  o 6  2.25913e+01 6.56279e-01 2.55534e+02 298.865 1.50204e+01  -2.72491e+01 0.00000e+00 0.00000e+00 5.79047e+02 298.865 3.23513e+02 298.865 0.9838 
1 1 1 -8  56  4  o 18 4.56965e+00 9.89435e-01 2.76614e+01 237.075 -3.67957e-01 -5.68225e-01 0.00000e+00 0.00000e+00 2.72989e+01 237.075 3.62519e-01 57.075  0.3205 
1 1 1 -8  56  5  o 7  2.95958e+00 8.29324e-01 5.18712e+01 247.875 -3.47196e-01 -8.53983e-01 0.00000e+00 0.00000e+00 5.46716e+00 67.875  5.73384e+01 67.875  0.4180 
1 1 1 -8  56  6  o 15 1.04226e+01 6.75217e-01 2.20866e+02 180.068 -1.69906e+01 -2.01032e-02 0.00000e+00 0.00000e+00 1.58136e+02 180.068 6.27296e+01 0.068   0.9701 
1 1 1 -8  56  7  o 1  8.04276e+00 6.36789e-01 1.71695e+02 131.129 -7.10125e+00 8.13195e+00  0.00000e+00 0.00000e+00 1.15251e+02 131.129 5.64431e+01 311.129 0.9525 
1 1 1 -8  56  8  o 5  3.08423e+00 7.64472e-01 9.12795e+01 62.206  1.14923e+00  2.18030e+00  0.00000e+00 0.00000e+00 3.42217e+00 242.206 9.47017e+01 242.206 0.7611 
1 1 1 -8  56  9  o 10 8.80511e+00 6.09495e-01 1.67051e+02 122.615 -8.73423e+00 1.36493e+01  0.00000e+00 0.00000e+00 1.51898e+02 122.615 1.51535e+01 302.615 0.9686 
1 1 1 -8  56  10 o 7  1.24745e+01 5.49059e-01 2.01756e+02 287.585 1.02161e+01  -3.22347e+01 0.00000e+00 0.00000e+00 2.57378e+02 287.585 5.56221e+01 287.585 0.9851 
1 1 1 -8  56  11 f 0  6.40031e+00 7.36335e-01 2.53961e+01 185.375 -2.13847e+00 -2.01220e-01 0.00000e+00 0.00000e+00 1.46763e+02 185.375 1.21366e+02 185.375 0.7206 
1 1 1 -8  56  12 o 9  7.86338e+00 6.78107e-01 1.53900e+02 84.516  1.81720e+00  1.89278e+01  0.00000e+00 0.00000e+00 1.31493e+02 84.516  2.24075e+01 264.516 0.9733 
1 1 1 -8  56  13 o 5  5.78285e+00 8.89916e-01 1.07024e+02 83.184  1.18869e+00  9.94441e+00  0.00000e+00 0.00000e+00 9.73194e+01 83.184  9.70447e+00 263.183 0.9487 
1 1 1 -8  56  14 o 16 1.27716e+01 8.98122e-01 1.63752e+02 142.064 -2.82403e+01 2.20129e+01  0.00000e+00 0.00000e+00 3.04732e+02 142.064 1.40980e+02 142.064 0.9859 
1 1 1 -8  56  15 o 18 3.87062e+00 1.21908e+00 4.46954e+01 39.366  2.08498e+00  1.71055e+00  0.00000e+00 0.00000e+00 6.81865e+01 39.366  2.34911e+01 39.366  0.7848 
1 1 1 -8  56  16 o 14 4.81608e+00 1.50497e+00 7.99433e+01 358.640 5.43813e+00  -1.29117e-01 0.00000e+00 0.00000e+00 8.13986e+01 358.640 1.45529e+00 358.640 0.9027 
1 1 1 -8  57  1  o 16 1.85646e+01 6.70729e-01 4.24106e+02 301.919 2.08940e+01  -3.35423e+01 0.00000e+00 0.00000e+00 2.64642e+02 301.919 1.59464e+02 121.919 0.9873 
1 1 1 -8  57  2  o 18 6.81323e+00 8.81523e-01 2.40909e+02 260.634 -1.39207e+00 -8.43957e+00 0.00000e+00 0.00000e+00 4.44714e-01 80.634  2.41354e+02 80.634  0.9396 
1 1 1 -8  57  3  o 14 1.46334e+01 6.37630e-01 2.59640e+02 16.486  2.15873e+01  6.38890e+00  0.00000e+00 0.00000e+00 2.77429e+02 16.486  1.77895e+01 16.486  0.9775 
1 1 1 -8  57  4  o 6  1.49963e+01 7.54786e-01 3.02658e+02 158.345 -2.36884e+01 9.40523e+00  0.00000e+00 0.00000e+00 2.48928e+02 158.345 5.37301e+01 338.345 0.9802 
1 1 1 -8  57  5  o 17 1.23357e+01 6.41111e-01 2.09504e+02 33.338  1.46471e+01  9.63532e+00  0.00000e+00 0.00000e+00 2.39726e+02 33.338  3.02219e+01 33.338  0.9710 
1 1 1 -8  57  6  o 6  3.78441e+00 8.67836e-01 4.85426e+01 256.133 -3.05720e-01 -1.23839e+00 0.00000e+00 0.00000e+00 2.74180e+01 256.133 2.11246e+01 76.133  0.5356 
1 1 1 -8  57  7  o 1  5.82071e+00 7.16019e-01 1.67701e+02 263.212 -9.79360e-01 -8.22731e+00 0.00000e+00 0.00000e+00 3.66781e+01 263.212 1.31023e+02 83.212  0.9376 
1 1 1 -8  57  8  o 5  7.97511e+00 5.92657e-01 2.09046e+02 296.894 7.34029e+00  -1.44724e+01 0.00000e+00 0.00000e+00 8.00494e+01 296.894 1.28997e+02 116.894 0.9687 
1 1 1 -8  57  9  o 19 1.84021e+01 6.05897e-01 2.94294e+02 171.874 -6.02670e+01 8.60493e+00  0.00000e+00 0.00000e+00 3.88090e+02 171.874 9.37960e+01 171.874 0.9918 
1 1 1 -8  57  10 o 16 6.31195e+00 6.98087e-01 7.23326e+01 19.430  5.50827e+00  1.94300e+00  0.00000e+00 0.00000e+00 1.42195e+02 19.430  6.98623e+01 19.430  0.9098 
1 1 1 -8  57  11 o 13 7.41856e+00 6.52428e-01 1.26557e+02 51.623  8.20856e+00  1.03650e+01  0.00000e+00 0.00000e+00 1.39623e+02 51.623  1.30652e+01 51.623  0.9614 
1 1 1 -8  57  12 o 6  7.81470e+00 6.79929e-01 1.50564e+02 97.062  -2.28124e+00 1.84143e+01  0.00000e+00 0.00000e+00 1.32823e+02 97.062  1.77408e+01 277.062 0.9727 
1 1 1 -8  57  13 o 17 5.15719e+00 9.53150e-01 1.02774e+02 216.932 -6.59314e+00 -4.95610e+00 0.00000e+00 0.00000e+00 7.72395e+01 216.932 2.55346e+01 36.932  0.9373 
1 1 1 -8  57  14 o 18 2.79813e+00 8.93932e-01 4.01592e+01 41.704  1.49675e+00  1.33376e+00  0.00000e+00 0.00000e+00 3.25526e+01 41.704  7.60658e+00 221.704 0.6986 
1 1 1 -8  57  15 o 4  6.71961e+00 1.27190e+00 1.50369e+02 69.345  5.55471e+00  1.47354e+01  0.00000e+00 0.00000e+00 9.12306e+01 69.345  5.91388e+01 249.345 0.9677 
1 1 1 -8  57  16 o 3  2.80096e+00 9.93268e-01 8.05268e+01 122.147 -2.60981e+00 4.15290e+00  0.00000e+00 0.00000e+00 1.20932e+01 122.147 6.84335e+01 302.146 0.8911 
1 1 1 -8  58  1  o 4  4.06116e+01 8.97462e-01 7.12542e+02 219.867 -1.15157e+02 -9.61738e+01 0.00000e+00 0.00000e+00 8.08251e+02 219.867 9.57099e+01 219.867 0.9967 
1 1 1 -8  58  2  o 11 1.76290e+01 6.40154e-01 2.65655e+02 43.279  2.02090e+01  1.90301e+01  0.00000e+00 0.00000e+00 3.84404e+02 43.279  1.18749e+02 43.279  0.9818 
1 1 1 -8  58  3  o 10 1.52493e+01 6.28238e-01 2.56875e+02 219.197 -1.74197e+01 -1.42058e+01 0.00000e+00 0.00000e+00 3.02692e+02 219.197 4.58167e+01 219.197 0.9775 
1 1 1 -8  58  4  o 1  6.99891e+00 8.81247e-01 8.31818e+01 339.225 3.24009e+00  -1.22917e+00 0.00000e+00 0.00000e+00 1.37207e+02 339.225 5.40250e+01 339.225 0.8393 
1 1 1 -8  58  5  o 11 8.58027e+00 6.05973e-01 1.95412e+02 299.524 6.14903e+00  -1.08578e+01 0.00000e+00 0.00000e+00 1.13146e+02 299.524 8.22657e+01 119.524 0.9591 
1 1 1 -8  58  6  o 9  1.52673e+01 5.63899e-01 2.47234e+02 35.575  2.38199e+01  1.70375e+01  0.00000e+00 0.00000e+00 3.15010e+02 35.575  6.77762e+01 35.575  0.9828 
1 1 1 -8  58  7  o 1  1.05016e+01 5.36375e-01 1.58529e+02 219.027 -1.19620e+01 -9.69584e+00 0.00000e+00 0.00000e+00 2.21712e+02 219.027 6.31830e+01 219.027 0.9670 
1 1 1 -8  58  8  o 2  1.69918e+01 5.37319e-01 2.37442e+02 76.035  9.57994e+00  3.85243e+01  0.00000e+00 0.00000e+00 3.90262e+02 76.035  1.52820e+02 76.035  0.9873 
1 1 1 -8  58  9  o 9  7.12973e+00 7.33329e-01 8.00618e+01 72.446  1.75106e+00  5.53533e+00  0.00000e+00 0.00000e+00 1.62285e+02 72.446  8.22233e+01 72.446  0.9092 
1 1 1 -8  58  10 o 14 4.88965e+00 8.02279e-01 3.45786e+01 172.742 -2.13810e+00 2.72304e-01  0.00000e+00 0.00000e+00 9.72281e+01 172.742 6.26495e+01 172.742 0.7217 
1 1 1 -8  58  11 o 2  5.58005e+00 7.74991e-01 6.91411e+01 100.470 -9.97001e-01 5.39490e+00  0.00000e+00 0.00000e+00 1.18996e+02 100.470 4.98546e+01 100.470 0.9036 
1 1 1 -8  58  12 o 4  3.28367e+00 8.67434e-01 4.84088e+01 147.386 -1.94364e+00 1.24366e+00  0.00000e+00 0.00000e+00 4.24549e+01 147.386 5.95386e+00 327.386 0.7423 
1 1 1 -8  58  13 o 14 1.00223e+01 6.97910e-01 2.15865e+02 7.151   3.89084e+01  4.88139e+00  0.00000e+00 0.00000e+00 1.52537e+02 7.151   6.33278e+01 187.151 0.9872 
1 1 1 -8  58  14 o 12 4.72859e+00 1.01506e+00 1.41032e+02 21.320  9.48129e+00  3.70040e+00  0.00000e+00 0.00000e+00 2.59629e+01 21.320  1.15069e+02 201.320 0.9495 
1 1 1 -8  58  15 o 13 3.72758e+00 1.09361e+00 8.15906e+01 214.474 -4.23106e+00 -2.90514e+00 0.00000e+00 0.00000e+00 4.25322e+01 214.474 3.90583e+01 34.474  0.8964 
1 1 1 -8  58  16 o 5  6.59080e+00 1.70965e+00 5.77806e+01 128.718 -2.97169e+00 3.70684e+00  0.00000e+00 0.00000e+00 1.59180e+02 128.718 1.01400e+02 128.718 0.8873 
1 1 1 -8  59  1  o 13 1.72424e+01 6.49045e-01 3.64968e+02 159.964 -3.36166e+01 1.22596e+01  0.00000e+00 0.00000e+00 2.73655e+02 159.964 9.13126e+01 339.964 0.9859 
1 1 1 -8  59  2  o 9  1.78047e+01 7.10486e-01 3.11247e+02 121.103 -1.60771e+01 2.66485e+01  0.00000e+00 0.00000e+00 3.46511e+02 121.103 3.52640e+01 121.103 0.9838 
1 1 1 -8  59  3  o 1  1.12611e+01 6.66053e-01 2.36766e+02 321.752 1.27007e+01  -1.00115e+01 0.00000e+00 0.00000e+00 1.72617e+02 321.752 6.41489e+01 141.752 0.9686 
1 1 1 -8  59  4  o 15 1.26382e+01 5.84524e-01 2.46132e+02 336.163 1.94952e+01  -8.61343e+00 0.00000e+00 0.00000e+00 2.16708e+02 336.163 2.94242e+01 156.163 0.9763 
1 1 1 -8  59  5  o 12 8.96116e+00 6.18088e-01 1.14088e+02 214.641 -6.26680e+00 -4.32987e+00 0.00000e+00 0.00000e+00 1.98972e+02 214.641 8.48837e+01 214.641 0.9318 
1 1 1 -8  59  6  o 18 1.05203e+01 6.12262e-01 2.14058e+02 328.874 1.51640e+01  -9.15687e+00 0.00000e+00 0.00000e+00 1.68804e+02 328.874 4.52539e+01 148.874 0.9714 
1 1 1 -8  59  7  o 15 8.90583e+00 5.50173e-01 1.92457e+02 246.361 -6.31912e+00 -1.44370e+01 0.00000e+00 0.00000e+00 1.30211e+02 246.361 6.22454e+01 66.361  0.9677 
1 1 1 -8  59  8  o 11 4.73535e+00 7.80676e-01 1.07341e+02 17.262  4.96861e+00  1.54397e+00  0.00000e+00 0.00000e+00 5.17184e+01 17.262  5.56228e+01 197.262 0.8979 
1 1 1 -8  59  9  o 10 9.06541e+00 6.03641e-01 1.00366e+02 190.462 -1.02037e+01 -1.88419e+00 0.00000e+00 0.00000e+00 2.21718e+02 190.462 1.21352e+02 190.462 0.9505 
1 1 1 -8  59  10 o 8  8.46796e+00 6.22509e-01 1.98027e+02 311.052 1.42843e+01  -1.64021e+01 0.00000e+00 0.00000e+00 1.10849e+02 311.052 8.71783e+01 131.052 0.9767 
1 1 1 -8  59  11 o 18 2.04222e+01 5.66951e-01 3.42801e+02 178.629 -1.02884e+02 2.46249e+00  0.00000e+00 0.00000e+00 4.15416e+02 178.629 7.26150e+01 178.629 0.9951 
1 1 1 -8  59  12 o 9  9.31605e+00 6.24950e-01 1.36900e+02 356.380 1.98848e+01  -1.25816e+00 0.00000e+00 0.00000e+00 2.01485e+02 356.380 6.45855e+01 356.380 0.9746 
1 1 1 -8  59  13 o 1  4.08025e+00 9.93676e-01 1.18521e+02 110.140 -2.64608e+00 7.21506e+00  0.00000e+00 0.00000e+00 2.31275e+01 110.140 9.53937e+01 290.140 0.9325 
1 1 1 -8  59  14 o 7  3.77549e+00 1.06099e+00 9.74533e+01 5.927   5.71481e+00  5.93339e-01  0.00000e+00 0.00000e+00 3.00601e+01 5.927   6.73932e+01 185.927 0.9082 
1 1 1 -8  59  15 o 10 4.51019e+00 1.21977e+00 6.02573e+01 38.785  3.46830e+00  2.78704e+00  0.00000e+00 0.00000e+00 8.69626e+01 38.785  2.67053e+01 38.785  0.8788 
1 1 1 -8  59  16 o 12 8.11541e+00 1.87123e+00 1.47073e+02 316.471 9.13582e+00  -8.67828e+00 0.00000e+00 0.00000e+00 1.41767e+02 316.471 5.30582e+00 136.471 0.9595 
1 1 1 -8  60  1  o 10 9.15089e+00 7.66254e-01 1.91820e+02 176.741 -9.83808e+00 5.60187e-01  0.00000e+00 0.00000e+00 1.33956e+02 176.741 5.78639e+01 356.741 0.9478 
1 1 1 -8  60  2  o 2  6.48768e+00 7.78780e-01 8.36400e+01 232.642 -1.96172e+00 -2.56976e+00 0.00000e+00 0.00000e+00 1.17517e+02 232.642 3.38765e+01 232.642 0.8258 
1 1 1 -8  60  3  o 2  4.78333e+00 8.39687e-01 1.12773e+02 128.416 -2.00742e+00 2.53132e+00  0.00000e+00 0.00000e+00 3.54432e+01 128.416 7.73293e+01 308.415 0.8257 
1 1 1 -8  60  4  o 3  1.72823e+01 5.59604e-01 3.89760e+02 292.285 1.91712e+01  -4.67791e+01 0.00000e+00 0.00000e+00 2.52005e+02 292.285 1.37755e+02 112.285 0.9901 
1 1 1 -8  60  5  o 6  1.22540e+01 6.11209e-01 1.67320e+02 306.142 9.33632e+00  -1.27834e+01 0.00000e+00 0.00000e+00 2.77262e+02 306.142 1.09942e+02 306.142 0.9679 
1 1 1 -8  60  6  o 7  6.07348e+00 6.70396e-01 8.62288e+01 133.913 -3.07169e+00 3.19052e+00  0.00000e+00 0.00000e+00 1.13573e+02 133.913 2.73443e+01 133.913 0.8782 
1 1 1 -8  60  7  f 0  6.08905e+00 7.13449e-01 2.22498e+02 24.790  1.15174e+01  5.31923e+00  0.00000e+00 0.00000e+00 3.74271e+00 204.789 2.26241e+02 204.789 0.9597 
1 1 1 -8  60  8  o 11 8.59002e+00 5.79976e-01 1.33255e+02 30.504  1.09583e+01  6.45595e+00  0.00000e+00 0.00000e+00 1.75143e+02 30.504  4.18875e+01 30.504  0.9598 
1 1 1 -8  60  9  o 10 1.29985e+01 5.33477e-01 2.31778e+02 263.571 -4.35331e+00 -3.86332e+01 0.00000e+00 0.00000e+00 2.47717e+02 263.571 1.59395e+01 263.571 0.9871 
1 1 1 -8  60  10 o 13 1.67039e+01 5.28260e-01 2.83703e+02 134.434 -4.77002e+01 4.86526e+01  0.00000e+00 0.00000e+00 3.35403e+02 134.434 5.17000e+01 134.434 0.9926 
1 1 1 -8  60  11 o 1  2.37670e+00 7.45444e-01 4.29192e+01 54.015  9.41943e-01  1.29718e+00  0.00000e+00 0.00000e+00 1.21019e+01 54.015  3.08172e+01 234.015 0.6206 
1 1 1 -8  60  12 o 1  5.11000e+00 8.82063e-01 7.33696e+01 125.647 -3.42974e+00 4.78231e+00  0.00000e+00 0.00000e+00 1.00015e+02 125.647 2.66457e+01 125.647 0.9105 
1 1 1 -8  60  13 f 0  1.07042e+01 6.77997e-01 1.71166e+02 342.986 3.46063e+01  -1.05891e+01 0.00000e+00 0.00000e+00 2.21742e+02 342.986 5.05756e+01 342.986 0.9861 
1 1 1 -8  60  14 o 18 1.73917e+01 6.81716e-01 2.91228e+02 312.905 6.91825e+01  -7.44349e+01 0.00000e+00 0.00000e+00 3.52227e+02 312.905 6.09987e+01 312.905 0.9951 
1 1 1 -8  60  15 o 12 3.28404e+00 1.04297e+00 6.55873e+01 142.002 -3.13333e+00 2.44786e+00  0.00000e+00 0.00000e+00 3.96130e+01 142.002 2.59743e+01 322.002 0.8626 
1 1 1 -8  60  16 o 15 4.15537e+00 1.35425e+00 1.23267e+02 60.830  4.09750e+00  7.34070e+00  0.00000e+00 0.00000e+00 2.13728e+01 60.830  1.01894e+02 240.830 0.9385 
1 1 1 -8  61  1  o 2  1.54292e+01 5.84281e-01 2.33383e+02 25.574  2.03514e+01  9.73960e+00  0.00000e+00 0.00000e+00 3.33061e+02 25.574  9.96780e+01 25.574  0.9776 
1 1 1 -8  61  2  o 11 1.12001e+01 6.05690e-01 2.21491e+02 203.350 -1.41849e+01 -6.12360e+00 0.00000e+00 0.00000e+00 1.85103e+02 203.350 3.63883e+01 23.350  0.9671 
1 1 1 -8  61  3  o 19 1.22904e+01 6.00734e-01 2.23119e+02 81.948  2.71474e+00  1.91911e+01  0.00000e+00 0.00000e+00 2.25970e+02 81.948  2.85112e+00 81.948  0.9739 
1 1 1 -8  61  4  o 7  1.39156e+01 5.69161e-01 2.50796e+02 281.171 5.08205e+00  -2.57334e+01 0.00000e+00 0.00000e+00 2.61006e+02 281.171 1.02102e+01 281.171 0.9807 
1 1 1 -8  61  5  o 13 5.85885e+00 8.07914e-01 1.26996e+02 197.066 -5.68336e+00 -1.74479e+00 0.00000e+00 0.00000e+00 7.31515e+01 197.066 5.38440e+01 17.066  0.9115 
1 1 1 -8  61  6  o 14 6.82052e+00 6.53467e-01 8.32113e+01 217.797 -4.05453e+00 -3.14467e+00 0.00000e+00 0.00000e+00 1.45762e+02 217.797 6.25502e+01 217.797 0.8963 
1 1 1 -8  61  7  o 9  1.54582e+01 5.30265e-01 3.20045e+02 356.602 4.86614e+01  -2.88929e+00 0.00000e+00 0.00000e+00 2.52542e+02 356.602 6.75031e+01 176.602 0.9897 
1 1 1 -8  61  8  o 18 1.33138e+01 5.33192e-01 2.44711e+02 195.762 -3.38742e+01 -9.56137e+00 0.00000e+00 0.00000e+00 2.46068e+02 195.762 1.35650e+00 195.762 0.9857 
1 1 1 -8  61  9  o 17 1.29353e+01 5.44888e-01 1.80860e+02 315.093 2.22797e+01  -2.22078e+01 0.00000e+00 0.00000e+00 2.94738e+02 315.093 1.13878e+02 315.093 0.9840 
1 1 1 -8  61  10 o 12 7.44018e+00 6.43885e-01 9.74629e+01 195.294 -1.00660e+01 -2.75253e+00 0.00000e+00 0.00000e+00 1.66633e+02 195.294 6.91706e+01 195.294 0.9508 
1 1 1 -8  61  11 o 7  8.88872e+00 6.18401e-01 1.57575e+02 82.023  3.13033e+00  2.23388e+01  0.00000e+00 0.00000e+00 1.66509e+02 82.023  8.93433e+00 82.023  0.9776 
1 1 1 -8  61  12 f 0  1.00925e+01 9.28890e-01 1.69814e+02 285.749 7.26665e+00  -2.57665e+01 0.00000e+00 0.00000e+00 1.99122e+02 285.749 2.93084e+01 285.749 0.9811 
1 1 1 -8  61  13 o 9  3.39605e+00 9.39481e-01 5.15905e+01 31.790  2.45459e+00  1.52130e+00  0.00000e+00 0.00000e+00 4.96928e+01 31.790  1.89770e+00 211.790 0.8013 
1 1 1 -8  61  14 f 0  6.39611e+00 1.11797e+00 8.03636e+01 278.217 1.15312e+00  -7.98547e+00 0.00000e+00 0.00000e+00 1.42148e+02 278.217 6.17847e+01 278.217 0.9358 
1 1 1 -8  61  15 o 4  5.17345e+00 1.13351e+00 6.31000e+01 324.457 4.53603e+00  -3.24061e+00 0.00000e+00 0.00000e+00 1.10781e+02 324.457 4.76809e+01 324.457 0.9052 
1 1 1 -8  61  16 o 14 4.79032e+00 1.49795e+00 8.94542e+01 147.980 -5.38401e+00 3.36689e+00  0.00000e+00 0.00000e+00 7.35261e+01 147.980 1.59281e+01 327.980 0.9175 
1 1 1 -8  62  1  o 13 1.66441e+01 5.86999e-01 1.80618e+02 53.973  1.21248e+01  1.66716e+01  0.00000e+00 0.00000e+00 4.28982e+02 53.973  2.48364e+02 53.973  0.9754 
1 1 1 -8  62  2  o 9  1.95975e+01 5.79524e-01 3.59906e+02 142.883 -3.98974e+01 3.01925e+01  0.00000e+00 0.00000e+00 3.68247e+02 142.883 8.34116e+00 142.883 0.9900 
1 1 1 -8  62  3  o 11 8.69635e+00 1.06515e+00 1.78335e+02 286.884 3.02383e+00  -9.96271e+00 0.00000e+00 0.00000e+00 1.31818e+02 286.884 4.65168e+01 106.884 0.9507 
1 1 1 -8  62  4  o 4  1.09647e+01 6.01567e-01 1.81012e+02 244.206 -6.31188e+00 -1.30604e+01 0.00000e+00 0.00000e+00 2.15670e+02 244.206 3.46577e+01 244.206 0.9649 
1 1 1 -8  62  5  o 4  4.05050e+00 8.91330e-01 8.78557e+01 95.733  -2.62851e-01 2.61814e+00  0.00000e+00 0.00000e+00 3.03140e+01 95.733  5.75418e+01 275.733 0.7786 
1 1 1 -8  62  6  o 19 8.95415e+00 5.75878e-01 1.39709e+02 172.120 -1.13444e+01 1.57007e+00  0.00000e+00 0.00000e+00 1.80610e+02 172.120 4.09010e+01 172.120 0.9553 
1 1 1 -8  62  7  o 9  1.25256e+01 5.14663e-01 2.58192e+02 237.736 -1.89753e+01 -3.00578e+01 0.00000e+00 0.00000e+00 2.03882e+02 237.736 5.43095e+01 57.736  0.9858 
1 1 1 -8  62  8  o 6  1.65224e+01 5.18149e-01 2.69668e+02 16.942  4.57373e+01  1.39326e+01  0.00000e+00 0.00000e+00 3.41633e+02 16.942  7.19653e+01 16.942  0.9895 
1 1 1 -8  62  9  o 18 2.92933e+00 7.77660e-01 4.94936e+01 185.734 -1.69774e+00 -1.70478e-01 0.00000e+00 0.00000e+00 2.08919e+01 185.734 2.86017e+01 5.734   0.6431 
1 1 1 -8  62  10 o 12 5.91300e+00 7.35685e-01 8.84503e+01 214.304 -5.69889e+00 -3.88811e+00 0.00000e+00 0.00000e+00 1.15570e+02 214.304 2.71200e+01 214.304 0.9244 
1 1 1 -8  62  11 o 9  6.22492e+00 7.95471e-01 1.25915e+02 103.046 -2.64530e+00 1.14166e+01  0.00000e+00 0.00000e+00 9.60768e+01 103.046 2.98385e+01 283.046 0.9563 
1 1 1 -8  62  12 o 8  1.03371e+01 6.40481e-01 2.00289e+02 353.850 3.45494e+01  -3.72290e+00 0.00000e+00 0.00000e+00 1.79205e+02 353.850 2.10841e+01 173.850 0.9855 
1 1 1 -8  62  13 o 17 1.01824e+01 7.02649e-01 1.77170e+02 267.829 -1.18077e+00 -3.11432e+01 0.00000e+00 0.00000e+00 1.95604e+02 267.829 1.84342e+01 267.829 0.9838 
1 1 1 -8  62  14 o 10 1.17411e+01 7.87730e-01 2.18717e+02 352.987 5.23055e+01  -6.43421e+00 0.00000e+00 0.00000e+00 2.13525e+02 352.987 5.19115e+00 172.987 0.9905 
1 1 1 -8  62  15 o 11 5.58366e+00 1.30346e+00 1.15022e+02 111.024 -3.50037e+00 9.10718e+00  0.00000e+00 0.00000e+00 8.13364e+01 111.024 3.36859e+01 291.024 0.9473 
1 1 1 -8  62  16 o 15 4.81577e+00 1.51639e+00 7.54226e+01 202.044 -4.80208e+00 -1.94441e+00 0.00000e+00 0.00000e+00 8.48135e+01 202.044 9.39082e+00 202.044 0.8974 
1 1 1 -8  63  1  o 4  1.40355e+01 5.95071e-01 1.89437e+02 67.398  7.63217e+00  1.83335e+01  0.00000e+00 0.00000e+00 3.24034e+02 67.398  1.34597e+02 67.398  0.9745 
1 1 1 -8  63  2  o 10 1.13770e+01 6.18292e-01 2.48104e+02 179.932 -2.09367e+01 2.48301e-02  0.00000e+00 0.00000e+00 1.68504e+02 179.932 7.96008e+01 359.932 0.9758 
1 1 1 -8  63  3  o 19 8.67654e+00 6.58619e-01 1.10338e+02 241.364 -3.33102e+00 -6.10033e+00 0.00000e+00 0.00000e+00 1.90687e+02 241.364 8.03493e+01 241.364 0.9250 
1 1 1 -8  63  4  o 1  1.13833e+01 5.94797e-01 1.84695e+02 123.787 -9.78332e+00 1.46213e+01  0.00000e+00 0.00000e+00 2.29732e+02 123.787 4.50372e+01 123.787 0.9711 
1 1 1 -8  63  5  o 8  1.69378e+01 5.21035e-01 2.28493e+02 308.595 2.12930e+01  -2.66781e+01 0.00000e+00 0.00000e+00 3.96726e+02 308.595 1.68232e+02 308.595 0.9852 
1 1 1 -8  63  6  o 1  1.41859e+01 5.05235e-01 1.78679e+02 248.295 -9.19087e+00 -2.30901e+01 0.00000e+00 0.00000e+00 3.41655e+02 248.295 1.62976e+02 248.295 0.9797 
1 1 1 -8  63  7  o 12 7.33143e+00 6.05197e-01 5.95928e+01 114.057 -1.87926e+00 4.20966e+00  0.00000e+00 0.00000e+00 1.82744e+02 114.057 1.23152e+02 114.057 0.8835 
1 1 1 -8  63  8  f 0  9.00734e+00 5.62383e-01 1.22516e+02 331.329 1.11636e+01  -6.10459e+00 0.00000e+00 0.00000e+00 2.00706e+02 331.329 7.81900e+01 331.329 0.9599 
1 1 1 -8  63  9  o 9  2.92651e+00 7.82428e-01 1.85340e+01 283.996 1.68343e-01  -6.75404e-01 0.00000e+00 0.00000e+00 1.73790e+01 283.996 1.15498e+00 103.996 0.3285 
1 1 1 -8  63  10 o 10 6.72335e+00 6.72159e-01 1.39234e+02 109.905 -4.72135e+00 1.30388e+01  0.00000e+00 0.00000e+00 1.02456e+02 109.905 3.67772e+01 289.905 0.9632 
1 1 1 -8  63  11 o 5  3.49801e+00 8.08412e-01 8.83557e+01 147.142 -3.87413e+00 2.50227e+00  0.00000e+00 0.00000e+00 2.68733e+01 147.142 6.14824e+01 327.142 0.8835 
1 1 1 -8  63  12 o 13 5.62671e+00 8.51890e-01 1.02541e+02 349.180 9.32161e+00  -1.78161e+00 0.00000e+00 0.00000e+00 9.56590e+01 349.180 6.88250e+00 169.180 0.9457 
1 1 1 -8  63  13 o 17 6.18515e+00 9.53382e-01 5.89650e+01 156.702 -5.48263e+00 2.36099e+00  0.00000e+00 0.00000e+00 1.50876e+02 156.702 9.19112e+01 156.702 0.9119 
1 1 1 -8  63  14 o 2  3.00311e+00 9.58038e-01 5.88203e+01 65.756  1.32520e+00  2.94270e+00  0.00000e+00 0.00000e+00 3.33058e+01 65.756  2.55144e+01 245.756 0.8255 
1 1 1 -8  63  15 o 18 3.78115e+00 1.13932e+00 7.11715e+01 142.554 -3.83932e+00 2.94025e+00  0.00000e+00 0.00000e+00 5.36575e+01 142.554 1.75140e+01 322.554 0.8894 
1 1 1 -8  63  16 o 2  4.57337e+00 1.45812e+00 5.01839e+01 351.456 3.50545e+00  -5.26615e-01 0.00000e+00 0.00000e+00 9.28052e+01 351.456 4.26212e+01 351.456 0.8434 
1 1 1 -8  64  1  o 7  1.61212e+01 6.66523e-01 3.24746e+02 94.667  -3.14990e+00 3.85889e+01  0.00000e+00 0.00000e+00 2.72498e+02 94.667  5.22478e+01 274.666 0.9870 
1 1 1 -8  64  2  o 13 5.26853e+00 9.00809e-01 1.78844e+02 138.924 -4.90510e+00 4.27537e+00  0.00000e+00 0.00000e+00 2.93098e+00 138.924 1.75913e+02 318.924 0.9196 
1 1 1 -8  64  3  o 11 6.53018e+00 7.62312e-01 1.02256e+02 89.330  5.84430e-02  4.99639e+00  0.00000e+00 0.00000e+00 1.16508e+02 89.330  1.42516e+01 89.330  0.8933 
1 1 1 -8  64  4  o 7  7.05721e+00 7.08075e-01 1.03513e+02 209.535 -4.89926e+00 -2.77585e+00 0.00000e+00 0.00000e+00 1.36195e+02 209.535 3.26821e+01 209.535 0.9062 
1 1 1 -8  64  5  o 4  7.74871e+00 6.27230e-01 1.80764e+02 60.262  6.30166e+00  1.10311e+01  0.00000e+00 0.00000e+00 9.78267e+01 60.262  8.29378e+01 240.262 0.9598 
1 1 1 -8  64  6  o 4  8.81445e+00 5.41086e-01 1.88813e+02 55.998  9.15300e+00  1.35690e+01  0.00000e+00 0.00000e+00 1.30907e+02 55.998  5.79064e+01 235.998 0.9690 
1 1 1 -8  64  7  o 2  1.00001e+01 5.26324e-01 1.69601e+02 198.302 -1.74603e+01 -5.77525e+00 0.00000e+00 0.00000e+00 1.94163e+02 198.302 2.45618e+01 198.302 0.9724 
1 1 1 -8  64  8  o 17 8.56748e+00 5.73642e-01 1.65249e+02 313.688 1.24895e+01  -1.30750e+01 0.00000e+00 0.00000e+00 1.46004e+02 313.688 1.92447e+01 133.688 0.9719 
1 1 1 -8  64  9  o 13 6.62856e+00 6.72999e-01 1.47195e+02 116.226 -5.89229e+00 1.19612e+01  0.00000e+00 0.00000e+00 9.08889e+01 116.226 5.63065e+01 296.226 0.9617 
1 1 1 -8  64  10 o 4  2.14540e+00 7.07557e-01 3.42539e+01 27.780  9.26178e-01  4.87909e-01  0.00000e+00 0.00000e+00 2.78922e+00 27.780  3.14647e+01 207.780 0.4627 
1 1 1 -8  64  11 o 6  3.98381e+00 9.54953e-01 7.28293e+01 221.161 -3.16093e+00 -2.76343e+00 0.00000e+00 0.00000e+00 5.64810e+01 221.161 1.63483e+01 41.161  0.8707 
1 1 1 -8  64  12 o 8  5.88559e+00 9.10817e-01 7.37681e+01 133.311 -4.84144e+00 5.13565e+00  0.00000e+00 0.00000e+00 1.29225e+02 133.311 5.54568e+01 133.311 0.9262 
1 1 1 -8  64  13 o 7  1.23659e+01 6.75690e-01 2.28834e+02 264.806 -5.15335e+00 -5.66902e+01 0.00000e+00 0.00000e+00 2.27103e+02 264.806 1.73048e+00 84.806  0.9912 
1 1 1 -8  64  14 o 12 1.00423e+01 8.92572e-01 2.10763e+02 327.201 3.64099e+01  -2.34634e+01 0.00000e+00 0.00000e+00 1.58036e+02 327.201 5.27275e+01 147.201 0.9884 
1 1 1 -8  64  15 o 13 3.50329e+00 1.09711e+00 7.28282e+01 88.221  1.54988e-01  4.99090e+00  0.00000e+00 0.00000e+00 4.33012e+01 88.221  2.95270e+01 268.221 0.8932 
1 1 1 -8  64  16 o 10 3.58487e+00 1.21518e+00 3.84242e+01 338.782 2.65856e+00  -1.03214e+00 0.00000e+00 0.00000e+00 6.76601e+01 338.782 2.92359e+01 338.782 0.7984 
1 1 1 -8  65  1  o 14 1.61769e+01 6.72752e-01 3.27257e+02 188.463 -4.00057e+01 -5.95242e+00 0.00000e+00 0.00000e+00 2.72285e+02 188.463 5.49716e+01 8.463   0.9876 
1 1 1 -8  65  2  o 19 2.42351e+01 6.22021e-01 3.79717e+02 49.199  4.62592e+01  5.35909e+01  0.00000e+00 0.00000e+00 5.22966e+02 49.199  1.43249e+02 49.199  0.9929 
1 1 1 -8  65  3  o 3  4.78150e+00 8.35644e-01 8.64070e+01 87.599  1.30057e-01  3.10223e+00  0.00000e+00 0.00000e+00 6.01482e+01 87.599  2.62588e+01 267.599 0.8175 
1 1 1 -8  65  4  o 9  8.26236e+00 6.69841e-01 1.61656e+02 153.976 -1.02846e+01 5.02143e+00  0.00000e+00 0.00000e+00 1.34123e+02 153.976 2.75325e+01 333.976 0.9553 
1 1 1 -8  65  5  o 2  3.34352e+00 8.36646e-01 6.55097e+01 15.536  1.81611e+00  5.04889e-01  0.00000e+00 0.00000e+00 1.93857e+01 15.536  4.61240e+01 195.536 0.6780 
1 1 1 -8  65  6  o 1  1.28985e+01 5.51016e-01 2.06700e+02 48.595  1.92288e+01  2.18071e+01  0.00000e+00 0.00000e+00 2.67686e+02 48.595  6.09862e+01 48.595  0.9826 
1 1 1 -8  65  7  o 4  4.37704e+00 7.77528e-01 8.26853e+01 178.629 -3.87137e+00 9.26777e-02  0.00000e+00 0.00000e+00 5.78448e+01 178.629 2.48406e+01 358.629 0.8584 
1 1 1 -8  65  8  o 14 3.47117e+00 7.99203e-01 6.02445e+01 121.144 -1.33941e+00 2.21653e+00  0.00000e+00 0.00000e+00 4.02163e+01 121.144 2.00282e+01 301.144 0.7744 
1 1 1 -8  65  9  o 5  7.19428e+00 6.54386e-01 1.56922e+02 52.931  9.39781e+00  1.24401e+01  0.00000e+00 0.00000e+00 1.02952e+02 52.931  5.39700e+01 232.931 0.9674 
1 1 1 -8  65  10 o 2  7.31178e+00 6.86625e-01 1.58705e+02 206.015 -1.68067e+01 -8.20251e+00 0.00000e+00 0.00000e+00 1.06677e+02 206.015 5.20276e+01 26.015  0.9729 
1 1 1 -8  65  11 o 10 6.91295e+00 7.58679e-01 2.06820e+02 108.004 -6.54327e+00 2.01329e+01  0.00000e+00 0.00000e+00 4.46693e+01 108.004 1.62151e+02 288.004 0.9761 
1 1 1 -8  65  12 o 4  1.51984e+01 6.19665e-01 2.61651e+02 252.878 -2.26577e+01 -7.35491e+01 0.00000e+00 0.00000e+00 3.00535e+02 252.878 3.88839e+01 252.878 0.9935 
1 1 1 -8  65  13 o 4  7.40874e+00 9.23167e-01 1.59625e+02 14.191  1.94873e+01  4.92766e+00  0.00000e+00 0.00000e+00 1.08978e+02 14.191  5.06471e+01 194.191 0.9748 
1 1 1 -8  65  14 o 9  3.00057e+00 9.21722e-01 3.54177e+01 227.209 -1.37595e+00 -1.48638e+00 0.00000e+00 0.00000e+00 4.28240e+01 227.209 7.40629e+00 227.209 0.7019 
1 1 1 -8  65  15 o 17 4.64378e+00 1.23555e+00 1.15822e+02 318.491 7.40626e+00  -6.55456e+00 0.00000e+00 0.00000e+00 4.75254e+01 318.491 6.82966e+01 138.491 0.9480 
1 1 1 -8  65  16 o 13 3.71343e+00 1.14670e+00 1.16369e+01 5.989   8.94384e-01  9.38351e-02  0.00000e+00 0.00000e+00 4.47241e+01 5.989   3.30872e+01 5.989   0.4096 
1 1 1 -8  66  1  o 16 1.23577e+01 8.47211e-01 2.32358e+02 120.096 -1.13970e+01 1.96643e+01  0.00000e+00 0.00000e+00 2.21006e+02 120.096 1.13514e+01 300.096 0.9777 
1 1 1 -8  66  2  o 6  1.58847e+01 5.82234e-01 2.61216e+02 59.576  1.66321e+01  2.83213e+01  0.00000e+00 0.00000e+00 3.25414e+02 59.576  6.41976e+01 59.576  0.9847 
1 1 1 -8  66  3  o 8  6.59065e+00 7.39277e-01 1.68326e+02 323.642 7.44415e+00  -5.47998e+00 0.00000e+00 0.00000e+00 6.49719e+01 323.642 1.03354e+02 143.642 0.9443 
1 1 1 -8  66  4  f 0  1.61117e+01 5.02526e-01 2.71916e+02 173.876 -4.04696e+01 4.34215e+00  0.00000e+00 0.00000e+00 3.24297e+02 173.876 5.23810e+01 173.876 0.9876 
1 1 1 -8  66  5  o 14 3.11154e+00 7.09621e-01 4.88792e+01 103.602 -3.34612e-01 1.38288e+00  0.00000e+00 0.00000e+00 1.82862e+01 103.602 3.05930e+01 283.602 0.5765 
1 1 1 -8  66  6  o 16 4.49684e+00 7.71641e-01 5.46212e+01 130.483 -1.60958e+00 1.88568e+00  0.00000e+00 0.00000e+00 7.37265e+01 130.483 1.91053e+01 130.483 0.7627 
1 1 1 -8  66  7  o 15 1.10162e+01 5.23204e-01 1.91508e+02 323.336 1.97291e+01  -1.46865e+01 0.00000e+00 0.00000e+00 2.11969e+02 323.336 2.04605e+01 323.336 0.9795 
1 1 1 -8  66  8  o 12 2.02188e+01 5.43831e-01 3.48430e+02 197.027 -8.50466e+01 -2.60447e+01 0.00000e+00 0.00000e+00 4.02786e+02 197.027 5.43559e+01 197.027 0.9944 
1 1 1 -8  66  9  o 17 6.44936e+00 7.38588e-01 1.03017e+02 102.452 -1.89069e+00 8.56261e+00  0.00000e+00 0.00000e+00 1.23585e+02 102.452 2.05677e+01 102.452 0.9411 
1 1 1 -8  66  10 o 6  1.68769e+01 5.47442e-01 2.81850e+02 181.860 -7.85171e+01 -2.55033e+00 0.00000e+00 0.00000e+00 3.43638e+02 181.860 6.17871e+01 181.860 0.9936 
1 1 1 -8  66  11 o 5  1.75234e+01 5.65413e-01 2.77666e+02 346.140 7.85391e+01  -1.93781e+01 0.00000e+00 0.00000e+00 3.71278e+02 346.140 9.36116e+01 346.140 0.9938 
1 1 1 -8  66  12 o 10 6.84149e+00 8.08513e-01 1.85973e+02 24.708  2.13122e+01  9.80602e+00  0.00000e+00 0.00000e+00 6.32188e+01 24.708  1.22754e+02 204.708 0.9784 
1 1 1 -8  66  13 o 8  4.17127e+00 1.06255e+00 9.05379e+01 292.651 2.30712e+00  -5.52872e+00 0.00000e+00 0.00000e+00 5.09559e+01 292.651 3.95819e+01 112.651 0.9122 
1 1 1 -8  66  14 o 6  2.98280e+00 9.47609e-01 3.68214e+01 134.912 -1.54728e+00 1.55201e+00  0.00000e+00 0.00000e+00 4.37058e+01 134.912 6.88441e+00 134.912 0.7268 
1 1 1 -8  66  15 o 8  4.59696e+00 1.23206e+00 6.25953e+01 306.679 3.17522e+00  -4.26314e+00 0.00000e+00 0.00000e+00 9.09263e+01 306.679 2.83310e+01 306.679 0.9002 
1 1 1 -8  66  16 o 5  4.14369e+00 1.24599e+00 6.14005e+01 323.603 3.96384e+00  -2.92210e+00 0.00000e+00 0.00000e+00 7.54845e+01 323.603 1.40841e+01 323.603 0.8916 
1 1 1 -8  67  1  o 1  2.04033e+01 7.46124e-01 3.56327e+02 107.297 -1.80293e+01 5.78943e+01  0.00000e+00 0.00000e+00 4.02758e+02 107.297 4.64311e+01 107.297 0.9917 
1 1 1 -8  67  2  o 7  9.86396e+00 5.83938e-01 1.35560e+02 131.230 -7.58586e+00 8.65612e+00  0.00000e+00 0.00000e+00 2.17878e+02 131.230 8.23174e+01 131.230 0.9555 
1 1 1 -8  67  3  o 11 1.79651e+01 5.67632e-01 3.44438e+02 267.319 -2.66406e+00 -5.68882e+01 0.00000e+00 0.00000e+00 3.22982e+02 267.319 2.14560e+01 87.319  0.9912 
1 1 1 -8  67  4  o 9  9.02380e+00 5.60055e-01 1.44972e+02 214.125 -9.93695e+00 -6.73411e+00 0.00000e+00 0.00000e+00 1.78669e+02 214.125 3.36965e+01 214.125 0.9574 
1 1 1 -8  67  5  o 18 1.15535e+01 5.17096e-01 2.43085e+02 82.671  3.54193e+00  2.75381e+01  0.00000e+00 0.00000e+00 1.81604e+02 82.671  6.14812e+01 262.671 0.9818 
1 1 1 -8  67  6  o 13 6.34096e+00 6.85824e-01 9.40447e+01 140.924 -4.82896e+00 3.92101e+00  0.00000e+00 0.00000e+00 1.23187e+02 140.924 2.91428e+01 140.924 0.9157 
1 1 1 -8  67  7  o 2  1.00815e+01 5.32818e-01 1.51906e+02 146.659 -1.56110e+01 1.02706e+01  0.00000e+00 0.00000e+00 2.14788e+02 146.659 6.28822e+01 146.659 0.9729 
1 1 1 -8  67  8  o 3  1.44494e+01 5.31668e-01 2.61719e+02 187.630 -5.22099e+01 -6.99422e+00 0.00000e+00 0.00000e+00 2.72938e+02 187.630 1.12197e+01 187.630 0.9905 
1 1 1 -8  67  9  o 5  2.06977e+01 5.70328e-01 3.92752e+02 315.253 8.34288e+01  -8.26947e+01 0.00000e+00 0.00000e+00 3.76531e+02 315.253 1.62215e+01 135.253 0.9957 
1 1 1 -8  67  10 o 7  3.10173e+00 8.33234e-01 6.54995e+01 148.236 -2.53849e+00 1.57174e+00  0.00000e+00 0.00000e+00 2.80707e+01 148.236 3.74288e+01 328.236 0.8089 
1 1 1 -8  67  11 o 10 2.51890e+00 7.92224e-01 5.61893e+01 333.246 1.98874e+00  -1.00256e+00 0.00000e+00 0.00000e+00 1.24845e+01 333.246 4.37048e+01 153.246 0.7318 
1 1 1 -8  67  12 o 17 1.02189e+01 1.09167e+00 1.50934e+02 311.292 1.53203e+01  -1.74436e+01 0.00000e+00 0.00000e+00 2.21118e+02 311.292 7.01837e+01 311.292 0.9782 
1 1 1 -8  67  13 o 3  1.05915e+01 7.57836e-01 2.06730e+02 138.175 -3.19486e+01 2.85901e+01  0.00000e+00 0.00000e+00 1.82428e+02 138.175 2.43017e+01 318.175 0.9883 
1 1 1 -8  67  14 o 14 6.03220e+00 1.18378e+00 1.12906e+02 233.923 -6.68468e+00 -9.17486e+00 0.00000e+00 0.00000e+00 1.00999e+02 233.923 1.19075e+01 53.923  0.9549 
1 1 1 -8  67  15 o 10 3.37930e+00 1.07684e+00 2.73086e+01 249.714 -6.66747e-01 -1.80383e+00 0.00000e+00 0.00000e+00 5.85175e+01 249.714 3.12089e+01 249.714 0.6847 
1 1 1 -8  68  1  o 15 1.18815e+01 6.78715e-01 2.25370e+02 341.571 2.17197e+01  -7.23720e+00 0.00000e+00 0.00000e+00 2.10434e+02 341.571 1.49357e+01 161.571 0.9779 
1 1 1 -8  68  2  o 15 1.75751e+01 5.44266e-01 3.10208e+02 136.440 -3.65159e+01 3.47253e+01  0.00000e+00 0.00000e+00 3.42151e+02 136.440 3.19433e+01 136.440 0.9900 
1 1 1 -8  68  3  o 17 4.08070e+00 8.32006e-01 9.10124e+01 112.689 -1.23480e+00 2.95350e+00  0.00000e+00 0.00000e+00 3.49691e+01 112.689 5.60433e+01 292.689 0.8238 
1 1 1 -8  68  4  o 3  6.76138e+00 6.66073e-01 1.55083e+02 22.626  9.27331e+00  3.86503e+00  0.00000e+00 0.00000e+00 8.52057e+01 22.626  6.98774e+01 202.626 0.9488 
1 1 1 -8  68  5  o 2  9.32036e+00 5.48185e-01 2.56716e+02 93.367  -1.50485e+00 2.55761e+01  0.00000e+00 0.00000e+00 8.52861e+01 93.367  1.71430e+02 273.367 0.9803 
1 1 1 -8  68  6  o 6  1.15083e+01 5.12166e-01 1.59285e+02 3.043   2.10156e+01  1.11710e+00  0.00000e+00 0.00000e+00 2.60856e+02 3.043   1.01571e+02 3.043   0.9759 
1 1 1 -8  68  7  o 9  1.59407e+01 5.07800e-01 2.71568e+02 218.793 -4.58829e+01 -3.68822e+01 0.00000e+00 0.00000e+00 3.19219e+02 218.793 4.76506e+01 218.793 0.9915 
1 1 1 -8  68  8  o 10 1.08564e+01 5.62129e-01 1.64950e+02 109.074 -8.28249e+00 2.39531e+01  0.00000e+00 0.00000e+00 2.32470e+02 109.074 6.75200e+01 109.074 0.9801 
1 1 1 -8  68  9  o 14 6.87665e+00 7.26208e-01 1.36686e+02 345.320 1.28727e+01  -3.37226e+00 0.00000e+00 0.00000e+00 1.10110e+02 345.320 2.65766e+01 165.320 0.9617 
1 1 1 -8  68  10 o 16 6.97797e+00 7.54904e-01 1.79927e+02 128.679 -1.20084e+01 1.50003e+01  0.00000e+00 0.00000e+00 7.33913e+01 128.679 1.06536e+02 308.679 0.9736 
1 1 1 -8  68  11 o 12 5.03312e+00 9.30151e-01 1.45502e+02 258.275 -2.35467e+00 -1.13455e+01 0.00000e+00 0.00000e+00 3.37009e+01 258.275 1.11801e+02 78.275  0.9558 
1 1 1 -8  68  12 o 2  4.49445e+00 1.02581e+00 7.00209e+01 37.520  3.65365e+00  2.80556e+00  0.00000e+00 0.00000e+00 7.77226e+01 37.520  7.70179e+00 37.520  0.8834 
1 1 1 -8  68  13 o 7  7.75965e+00 9.30505e-01 1.50876e+02 96.294  -2.30354e+00 2.08845e+01  0.00000e+00 0.00000e+00 1.30614e+02 96.294  2.02618e+01 276.294 0.9759 
1 1 1 -8  68  14 o 17 7.02151e+00 1.04618e+00 1.22280e+02 250.902 -5.10321e+00 -1.47387e+01 0.00000e+00 0.00000e+00 1.29921e+02 250.902 7.64095e+00 250.902 0.9674 
1 1 1 -8  68  15 o 9  4.08287e+00 1.20233e+00 4.12467e+01 12.620  3.05430e+00  6.83847e-01  0.00000e+00 0.00000e+00 8.27806e+01 12.620  4.15339e+01 12.620  0.8191 
1 1 1 -8  69  1  o 19 6.77781e+00 8.84064e-01 7.92685e+01 264.901 -4.06517e-01 -4.55559e+00 0.00000e+00 0.00000e+00 1.45028e+02 264.901 6.57600e+01 264.901 0.8825 
1 1 1 -8  69  2  o 16 1.40808e+01 6.19734e-01 2.26669e+02 125.108 -1.66683e+01 2.37098e+01  0.00000e+00 0.00000e+00 2.91964e+02 125.108 6.52951e+01 125.108 0.9826 
1 1 1 -8  69  3  o 8  1.46844e+01 5.55903e-01 2.77958e+02 355.227 3.94587e+01  -3.29493e+00 0.00000e+00 0.00000e+00 2.65236e+02 355.227 1.27222e+01 175.227 0.9873 
1 1 1 -8  69  4  o 16 9.57418e+00 5.43634e-01 1.66837e+02 22.090  1.45483e+01  5.90445e+00  0.00000e+00 0.00000e+00 1.80078e+02 22.090  1.32410e+01 22.090  0.9676 
1 1 1 -8  69  5  o 8  5.32635e+00 6.90477e-01 1.38537e+02 8.995   7.86614e+00  1.24522e+00  0.00000e+00 0.00000e+00 4.78307e+01 8.995   9.07064e+01 188.995 0.9349 
1 1 1 -8  69  6  o 16 1.59543e+01 5.11003e-01 2.81256e+02 127.085 -3.16100e+01 4.18182e+01  0.00000e+00 0.00000e+00 3.09719e+02 127.085 2.84633e+01 127.085 0.9904 
1 1 1 -8  69  7  o 10 1.99143e+01 5.36853e-01 3.27317e+02 163.735 -8.40861e+01 2.45324e+01  0.00000e+00 0.00000e+00 4.12688e+02 163.735 8.53705e+01 163.735 0.9943 
1 1 1 -8  69  8  o 12 1.10744e+01 5.57430e-01 1.86884e+02 243.736 -1.35699e+01 -2.75003e+01 0.00000e+00 0.00000e+00 2.19880e+02 243.736 3.29960e+01 243.736 0.9836 
1 1 1 -8  69  9  o 8  8.49377e+00 6.23628e-01 1.84902e+02 246.541 -1.03384e+01 -2.38231e+01 0.00000e+00 0.00000e+00 1.25862e+02 246.541 5.90406e+01 66.541  0.9806 
1 1 1 -8  69  10 o 7  8.34460e+00 6.73730e-01 1.62055e+02 173.722 -2.21768e+01 2.43955e+00  0.00000e+00 0.00000e+00 1.41971e+02 173.722 2.00834e+01 353.722 0.9773 
1 1 1 -8  69  11 o 16 4.79552e+00 9.13970e-01 1.06023e+02 62.030  3.87210e+00  7.29168e+00  0.00000e+00 0.00000e+00 6.13833e+01 62.030  4.46400e+01 242.030 0.9373 
1 1 1 -8  69  12 o 9  7.23800e+00 8.81409e-01 9.21645e+01 182.732 -1.13549e+01 -5.41796e-01 0.00000e+00 0.00000e+00 1.64994e+02 182.732 7.28297e+01 182.732 0.9549 
1 1 1 -8  69  13 o 18 3.28618e+00 9.77503e-01 3.00458e+01 253.513 -5.05839e-01 -1.70912e+00 0.00000e+00 0.00000e+00 5.03894e+01 253.513 2.03436e+01 253.513 0.6586 
1 1 1 -8  69  14 o 2  3.67436e+00 1.04877e+00 2.35031e+01 134.941 -1.17404e+00 1.17644e+00  0.00000e+00 0.00000e+00 6.29354e+01 134.941 3.94323e+01 134.941 0.6337 
1 1 1 -8  69  15 o 18 2.58355e+00 8.94931e-01 6.27369e+01 326.416 3.19253e+00  -2.11985e+00 0.00000e+00 0.00000e+00 1.93317e+01 326.416 4.34052e+01 146.416 0.8567 
1 1 1 -8  70  1  o 2  6.15798e+00 8.90493e-01 9.18240e+01 277.371 6.48104e-01  -5.01011e+00 0.00000e+00 0.00000e+00 1.14719e+02 277.371 2.28954e+01 277.371 0.8946 
1 1 1 -8  70  2  o 17 5.40817e+00 7.65242e-01 1.56915e+02 326.967 6.56950e+00  -4.27170e+00 0.00000e+00 0.00000e+00 3.23604e+01 326.967 1.24554e+02 146.967 0.9338 
1 1 1 -8  70  3  o 2  1.35164e+01 5.61870e-01 2.77037e+02 67.436  1.40987e+01  3.39304e+01  0.00000e+00 0.00000e+00 2.22354e+02 67.436  5.46828e+01 247.436 0.9863 
1 1 1 -8  70  4  o 1  1.08595e+01 5.18016e-01 2.41485e+02 319.423 2.14524e+01  -1.83719e+01 0.00000e+00 0.00000e+00 1.57835e+02 319.423 8.36496e+01 139.423 0.9821 
1 1 1 -8  70  5  o 14 1.14123e+01 5.25606e-01 1.65178e+02 182.191 -2.15915e+01 -8.25943e-01 0.00000e+00 0.00000e+00 2.51843e+02 182.191 8.66643e+01 182.191 0.9766 
1 1 1 -8  70  6  o 18 5.45740e+00 7.18265e-01 9.14619e+01 347.231 5.95540e+00  -1.34966e+00 0.00000e+00 0.00000e+00 9.50543e+01 347.231 3.59239e+00 347.231 0.9140 
1 1 1 -8  70  7  o 9  1.48481e+01 5.63333e-01 2.08672e+02 124.675 -2.43575e+01 3.52099e+01  0.00000e+00 0.00000e+00 3.39627e+02 124.675 1.30955e+02 124.675 0.9883 
1 1 1 -8  70  8  o 14 8.58475e+00 6.35012e-01 1.63390e+02 297.508 8.85219e+00  -1.69992e+01 0.00000e+00 0.00000e+00 1.48663e+02 297.508 1.47276e+01 117.508 0.9736 
1 1 1 -8  70  9  o 14 9.37490e+00 6.28603e-01 2.02244e+02 109.779 -1.02997e+01 2.86411e+01  0.00000e+00 0.00000e+00 1.41699e+02 109.779 6.05454e+01 289.779 0.9834 
1 1 1 -8  70  10 o 19 6.42641e+00 8.01922e-01 1.11544e+02 243.896 -5.15774e+00 -1.05264e+01 0.00000e+00 0.00000e+00 1.17526e+02 243.896 5.98187e+00 243.896 0.9563 
1 1 1 -8  70  11 o 15 4.06167e+00 9.22729e-01 1.18047e+01 276.837 8.72752e-02  -7.27915e-01 0.00000e+00 0.00000e+00 4.02156e+01 276.837 2.84109e+01 276.837 0.3440 
1 1 1 -8  70  12 o 5  6.39063e+00 9.11238e-01 8.01163e+01 162.618 -7.91565e+00 2.47791e+00  0.00000e+00 0.00000e+00 1.42775e+02 162.618 6.26583e+01 162.618 0.9376 
1 1 1 -8  70  13 o 19 4.40267e+00 1.07004e+00 5.81149e+01 245.229 -1.93811e+00 -4.20009e+00 0.00000e+00 0.00000e+00 8.64866e+01 245.229 2.83717e+01 245.229 0.8839 
1 1 1 -8  70  14 o 12 3.09995e+00 9.93322e-01 6.85728e+01 201.498 -3.96171e+00 -1.56044e+00 0.00000e+00 0.00000e+00 3.18418e+01 201.498 3.67310e+01 21.499  0.8728 
1 1 1 -8  70  15 o 10 3.33900e+00 1.06495e+00 5.38453e+01 344.756 3.74312e+00  -1.02004e+00 0.00000e+00 0.00000e+00 5.24458e+01 344.756 1.39951e+00 164.756 0.8587 
1 1 1 -8  71  1  o 6  5.96475e+00 9.03553e-01 1.24710e+02 64.809  2.84225e+00  6.04258e+00  0.00000e+00 0.00000e+00 8.13895e+01 64.809  4.33205e+01 244.809 0.9217 
1 1 1 -8  71  2  o 19 1.44038e+01 5.70101e-01 1.88056e+02 241.798 -1.25347e+01 -2.33754e+01 0.00000e+00 0.00000e+00 3.41392e+02 241.798 1.53336e+02 241.798 0.9810 
1 1 1 -8  71  3  o 7  1.34056e+01 5.52671e-01 2.31731e+02 16.727  3.23781e+01  9.73073e+00  0.00000e+00 0.00000e+00 2.62868e+02 16.727  3.11371e+01 16.727  0.9851 
1 1 1 -8  71  4  f 0  8.55405e+00 5.70561e-01 2.24385e+02 152.194 -1.82391e+01 9.61874e+00  0.00000e+00 0.00000e+00 8.79551e+01 152.194 1.36430e+02 332.194 0.9754 
1 1 1 -8  71  5  o 18 1.05972e+01 6.97683e-01 1.58607e+02 8.505   1.85295e+01  2.77085e+00  0.00000e+00 0.00000e+00 2.27111e+02 8.505   6.85045e+01 8.505   0.9729 
1 1 1 -8  71  6  o 14 1.14350e+01 5.27627e-01 2.17040e+02 293.392 1.33183e+01  -3.07880e+01 0.00000e+00 0.00000e+00 2.04048e+02 293.392 1.29918e+01 113.392 0.9850 
1 1 1 -8  71  7  o 18 4.41763e+00 7.90356e-01 8.44620e+01 68.171  1.81686e+00  4.53575e+00  0.00000e+00 0.00000e+00 6.25336e+01 68.171  2.19284e+01 248.171 0.8907 
1 1 1 -8  71  8  o 2  4.52406e+00 8.05840e-01 8.39265e+01 195.996 -5.12770e+00 -1.46998e+00 0.00000e+00 0.00000e+00 6.81692e+01 195.996 1.57573e+01 15.996  0.9006 
1 1 1 -8  71  9  o 3  2.94477e+00 8.23969e-01 4.77148e+01 312.595 1.40405e+00  -1.52714e+00 0.00000e+00 0.00000e+00 3.02286e+01 312.595 1.74861e+01 132.595 0.7096 
1 1 1 -8  71  10 o 8  1.38105e+01 5.95172e-01 2.44649e+02 170.007 -6.10244e+01 1.07520e+01  0.00000e+00 0.00000e+00 2.65829e+02 170.007 2.11795e+01 170.007 0.9919 
1 1 1 -8  71  11 o 1  3.39939e+00 9.13934e-01 4.28793e+01 227.902 -1.69647e+00 -1.87767e+00 0.00000e+00 0.00000e+00 5.43508e+01 227.902 1.14715e+01 227.902 0.7683 
1 1 1 -8  71  12 o 11 1.00804e+01 7.31921e-01 1.30180e+02 305.620 1.44108e+01  -2.01136e+01 0.00000e+00 0.00000e+00 2.37064e+02 305.620 1.06884e+02 305.620 0.9796 
1 1 1 -8  71  13 o 3  4.93047e+00 1.15615e+00 1.19674e+02 25.727  8.64200e+00  4.16413e+00  0.00000e+00 0.00000e+00 5.36680e+01 25.727  6.60059e+01 205.727 0.9463 
1 1 1 -8  71  14 o 15 3.68997e+00 1.03276e+00 7.99769e+01 137.934 -4.61915e+00 4.16867e+00  0.00000e+00 0.00000e+00 4.54041e+01 137.934 3.45728e+01 317.935 0.9157 
1 1 1 -8  71  15 o 2  4.22316e+00 1.14936e+00 8.97819e+01 209.112 -7.29439e+00 -4.06207e+00 0.00000e+00 0.00000e+00 5.70446e+01 209.112 3.27373e+01 29.112  0.9381 
1 1 1 -8  72  1  o 9  6.63954e+00 8.20777e-01 6.21048e+01 292.653 1.61070e+00  -3.85934e+00 0.00000e+00 0.00000e+00 1.54432e+02 292.653 9.23272e+01 292.653 0.8702 
1 1 1 -8  72  2  o 14 6.07284e+00 7.77773e-01 7.48488e+01 283.963 1.10764e+00  -4.45476e+00 0.00000e+00 0.00000e+00 1.26026e+02 283.963 5.11775e+01 283.963 0.8829 
1 1 1 -8  72  3  o 17 4.97890e+00 8.27573e-01 1.95359e+02 268.755 -2.18993e-01 -1.00800e+01 0.00000e+00 0.00000e+00 1.84227e+01 88.755  2.13782e+02 88.755  0.9490 
1 1 1 -8  72  4  o 9  1.23048e+01 5.20621e-01 2.32499e+02 332.694 2.91465e+01  -1.50472e+01 0.00000e+00 0.00000e+00 2.20940e+02 332.694 1.15582e+01 152.694 0.9846 
1 1 1 -8  72  5  o 15 1.10710e+01 5.30100e-01 2.24193e+02 302.357 1.62233e+01  -2.56066e+01 0.00000e+00 0.00000e+00 1.83009e+02 302.357 4.11838e+01 122.357 0.9834 
1 1 1 -8  72  6  o 8  7.96909e+00 5.88186e-01 1.87233e+02 354.418 1.85307e+01  -1.81099e+00 0.00000e+00 0.00000e+00 1.02528e+02 354.418 8.47049e+01 174.418 0.9728 
1 1 1 -8  72  7  o 4  5.62231e+00 7.65873e-01 9.14322e+01 320.142 5.23574e+00  -4.37119e+00 0.00000e+00 0.00000e+00 1.02500e+02 320.142 1.10678e+01 320.142 0.9235 
1 1 1 -8  72  8  o 9  6.26610e+00 7.41645e-01 6.76715e+01 349.126 5.76198e+00  -1.10689e+00 0.00000e+00 0.00000e+00 1.45205e+02 349.126 7.75339e+01 349.126 0.9102 
1 1 1 -8  72  9  o 4  9.43679e+00 6.46366e-01 1.39813e+02 240.720 -1.03272e+01 -1.84179e+01 0.00000e+00 0.00000e+00 2.03659e+02 240.720 6.38460e+01 240.720 0.9760 
1 1 1 -8  72  10 o 18 5.62887e+00 8.88020e-01 6.91730e+01 103.973 -1.41072e+00 5.66959e+00  0.00000e+00 0.00000e+00 1.21637e+02 103.973 5.24638e+01 103.973 0.9098 
1 1 1 -8  72  11 o 8  7.31127e+00 7.82739e-01 1.21313e+02 53.788  9.41461e+00  1.28578e+01  0.00000e+00 0.00000e+00 1.42143e+02 53.788  2.08295e+01 53.788  0.9681 
1 1 1 -8  72  12 o 4  3.18685e+00 9.29296e-01 9.04202e+01 353.296 4.99785e+00  -5.87502e-01 0.00000e+00 0.00000e+00 1.55321e+01 353.296 7.48881e+01 173.296 0.8941 
1 1 1 -8  72  13 o 10 1.15753e+01 8.08876e-01 2.19887e+02 155.122 -5.06409e+01 2.34835e+01  0.00000e+00 0.00000e+00 2.06187e+02 155.122 1.36997e+01 335.122 0.9910 
1 1 1 -8  72  14 o 7  3.30955e+00 1.00893e+00 9.16865e+01 216.985 -5.40963e+00 -4.07427e+00 0.00000e+00 0.00000e+00 2.16324e+01 216.985 7.00541e+01 36.985  0.9229 
1 1 1 -8  72  15 o 6  8.68969e+00 1.11720e+00 1.05552e+02 29.183  1.71025e+01  9.55145e+00  0.00000e+00 0.00000e+00 2.08121e+02 29.183  1.02569e+02 29.183  0.9741 
1 1 1 -8  73  1  o 4  1.18931e+01 7.36482e-01 1.53952e+02 206.272 -1.75296e+01 -8.65313e+00 0.00000e+00 0.00000e+00 2.80151e+02 206.272 1.26199e+02 206.272 0.9741 
1 1 1 -8  73  2  o 13 1.50388e+01 5.84455e-01 3.11821e+02 344.113 5.00715e+01  -1.42510e+01 0.00000e+00 0.00000e+00 2.46037e+02 344.113 6.57834e+01 164.113 0.9903 
1 1 1 -8  73  3  o 1  3.88877e+00 8.48454e-01 4.58307e+01 147.233 -1.56958e+00 1.01024e+00  0.00000e+00 0.00000e+00 5.23841e+01 147.233 6.55339e+00 147.233 0.6746 
1 1 1 -8  73  4  o 6  1.27482e+01 5.13989e-01 2.33008e+02 8.426   3.43143e+01  5.08320e+00  0.00000e+00 0.00000e+00 2.37080e+02 8.426   4.07264e+00 8.426   0.9855 
1 1 1 -8  73  5  o 7  1.08874e+01 5.34196e-01 1.63377e+02 263.594 -2.68012e+00 -2.38708e+01 0.00000e+00 0.00000e+00 2.35198e+02 263.594 7.18212e+01 263.594 0.9790 
1 1 1 -8  73  6  o 5  5.64267e+00 7.23330e-01 9.45419e+01 167.442 -6.54960e+00 1.45893e+00  0.00000e+00 0.00000e+00 9.99141e+01 167.442 5.37214e+00 167.442 0.9221 
1 1 1 -8  73  7  o 12 1.32671e+01 5.35073e-01 2.33152e+02 328.334 3.70981e+01  -2.28815e+01 0.00000e+00 0.00000e+00 2.56582e+02 328.334 2.34300e+01 328.334 0.9885 
1 1 1 -8  73  8  o 18 2.67545e+00 7.87416e-01 4.37113e+01 39.025  1.40123e+00  1.13569e+00  0.00000e+00 0.00000e+00 2.24544e+01 39.025  2.12568e+01 219.025 0.6628 
1 1 1 -8  73  9  o 14 5.93829e+00 7.68875e-01 7.19361e+01 13.611  6.57293e+00  1.59149e+00  0.00000e+00 0.00000e+00 1.32370e+02 13.611  6.04343e+01 13.611  0.9228 
1 1 1 -8  73  10 o 9  1.55068e+01 5.90512e-01 2.44531e+02 78.165  1.44502e+01  6.89566e+01  0.00000e+00 0.00000e+00 3.28986e+02 78.165  8.44555e+01 78.165  0.9929 
1 1 1 -8  73  11 o 2  6.72079e+00 8.75086e-01 8.14744e+01 283.313 2.00135e+00  -8.45765e+00 0.00000e+00 0.00000e+00 1.53773e+02 283.313 7.22987e+01 283.313 0.9406 
1 1 1 -8  73  12 o 10 5.72087e+00 1.04746e+00 6.51421e+01 255.251 -1.58260e+00 -6.01165e+00 0.00000e+00 0.00000e+00 1.29587e+02 255.251 6.44448e+01 255.251 0.9156 
1 1 1 -8  73  13 o 7  3.39145e+00 9.91829e-01 2.64204e+01 296.723 7.76205e-01  -1.54179e+00 0.00000e+00 0.00000e+00 5.51001e+01 296.723 2.86797e+01 296.723 0.6473 
1 1 1 -8  73  14 o 18 5.86514e+00 1.12931e+00 1.21743e+02 60.751  6.52751e+00  1.16561e+01  0.00000e+00 0.00000e+00 8.75064e+01 60.751  3.42362e+01 240.751 0.9618 
1 1 1 -8  73  15 o 10 2.93057e+00 9.75915e-01 7.37487e+01 244.076 -2.51425e+00 -5.17240e+00 0.00000e+00 0.00000e+00 2.48691e+01 244.076 4.88796e+01 64.076  0.9083 
1 1 1 -8  74  1  o 13 7.08802e+00 8.84589e-01 1.15025e+02 92.386  -3.33502e-01 8.00535e+00  0.00000e+00 0.00000e+00 1.33350e+02 92.386  1.83250e+01 92.386  0.9353 
1 1 1 -8  74  2  o 3  4.68766e+00 8.79873e-01 7.88447e+01 350.010 3.77033e+00  -6.64124e-01 0.00000e+00 0.00000e+00 7.15251e+01 350.010 7.31956e+00 170.010 0.8566 
1 1 1 -8  74  3  o 13 9.90258e+00 6.16249e-01 1.81370e+02 190.635 -2.01358e+01 -3.78115e+00 0.00000e+00 0.00000e+00 1.80129e+02 190.635 1.24153e+00 10.635  0.9753 
1 1 1 -8  74  4  o 18 1.04724e+01 5.47827e-01 1.97533e+02 267.269 -1.26848e+00 -2.65945e+01 0.00000e+00 0.00000e+00 1.86816e+02 267.269 1.07169e+01 87.269  0.9810 
1 1 1 -8  74  5  o 13 7.39566e+00 5.85594e-01 1.09662e+02 242.138 -4.73674e+00 -8.96040e+00 0.00000e+00 0.00000e+00 1.52832e+02 242.138 4.31691e+01 242.138 0.9493 
1 1 1 -8  74  6  o 6  8.10332e+00 6.17594e-01 1.97771e+02 26.473  1.99451e+01  9.93245e+00  0.00000e+00 0.00000e+00 9.81249e+01 26.473  9.96460e+01 206.473 0.9773 
1 1 1 -8  74  7  o 12 8.91542e+00 5.93869e-01 1.30455e+02 359.815 1.77229e+01  -5.72813e-02 0.00000e+00 0.00000e+00 1.92887e+02 359.815 6.24322e+01 359.815 0.9714 
1 1 1 -8  74  8  o 10 5.27858e+00 8.09068e-01 1.53602e+02 307.144 7.33576e+00  -9.68409e+00 0.00000e+00 0.00000e+00 3.50417e+01 307.144 1.18561e+02 127.144 0.9579 
1 1 1 -8  74  9  o 6  2.54801e+00 7.79841e-01 3.72115e+01 147.292 -1.31854e+00 8.46744e-01  0.00000e+00 0.00000e+00 2.09417e+01 147.292 1.62698e+01 327.292 0.6123 
1 1 1 -8  74  10 o 13 4.46256e+00 9.31440e-01 6.38714e+01 105.202 -1.13932e+00 4.19273e+00  0.00000e+00 0.00000e+00 8.16485e+01 105.202 1.77772e+01 105.202 0.8756 
1 1 1 -8  74  11 o 3  5.83304e+00 9.40526e-01 9.70273e+01 41.635  6.96760e+00  6.19363e+00  0.00000e+00 0.00000e+00 1.08008e+02 41.635  1.09808e+01 41.635  0.9447 
1 1 1 -8  74  12 o 9  4.75189e+00 1.05167e+00 6.92979e+01 268.516 -1.47461e-01 -5.69375e+00 0.00000e+00 0.00000e+00 9.09601e+01 268.516 2.16623e+01 268.516 0.9074 
1 1 1 -8  74  13 o 14 7.47162e+00 9.62213e-01 1.04588e+02 273.233 8.48264e-01  -1.50166e+01 0.00000e+00 0.00000e+00 1.63433e+02 273.233 5.88446e+01 273.233 0.9662 
1 1 1 -8  74  14 o 5  4.69148e+00 1.21607e+00 7.23943e+01 86.650  3.64867e-01  6.23420e+00  0.00000e+00 0.00000e+00 8.69783e+01 86.650  1.45840e+01 86.650  0.9160 
1 1 1 -8  74  15 o 2  3.48505e+00 1.07283e+00 5.60037e+00 139.159 -3.67758e-01 3.17899e-01  0.00000e+00 0.00000e+00 2.48839e+01 139.159 1.92836e+01 139.159 0.2361 
1 1 1 -8  75  1  o 6  1.28742e+01 7.20190e-01 2.36127e+02 228.852 -2.04479e+01 -2.33999e+01 0.00000e+00 0.00000e+00 2.38270e+02 228.852 2.14343e+00 228.852 0.9838 
1 1 1 -8  75  2  o 2  1.02070e+01 6.61683e-01 2.07387e+02 333.745 2.13792e+01  -1.05452e+01 0.00000e+00 0.00000e+00 1.66668e+02 333.745 4.07186e+01 153.745 0.9788 
1 1 1 -8  75  3  o 16 1.12068e+01 6.01956e-01 1.57019e+02 269.728 -1.00137e-01 -2.11059e+01 0.00000e+00 0.00000e+00 2.52316e+02 269.728 9.52966e+01 269.728 0.9760 
1 1 1 -8  75  4  o 9  2.13881e+01 6.08267e-01 3.38908e+02 93.337  -5.57312e+00 9.55826e+01  0.00000e+00 0.00000e+00 4.56881e+02 93.337  1.17973e+02 93.337  0.9948 
1 1 1 -8  75  5  o 7  1.29751e+01 5.17510e-01 2.74576e+02 327.503 4.20346e+01  -2.67761e+01 0.00000e+00 0.00000e+00 2.05552e+02 327.503 6.90238e+01 147.503 0.9899 
1 1 1 -8  75  6  o 13 9.13796e+00 5.78637e-01 1.85860e+02 1.178   2.49776e+01  5.13407e-01  0.00000e+00 0.00000e+00 1.48595e+02 1.178   3.72650e+01 181.177 0.9798 
1 1 1 -8  75  7  o 4  1.39981e+01 5.47920e-01 2.79896e+02 50.348  3.69855e+01  4.46252e+01  0.00000e+00 0.00000e+00 2.38115e+02 50.348  4.17807e+01 230.348 0.9913 
1 1 1 -8  75  8  o 14 6.42489e+00 6.92830e-01 1.19294e+02 181.639 -1.20299e+01 -3.44269e-01 0.00000e+00 0.00000e+00 1.10172e+02 181.639 9.12204e+00 1.639   0.9575 
1 1 1 -8  75  9  o 18 7.08241e+00 7.02122e-01 1.22975e+02 322.199 1.20459e+01  -9.34416e+00 0.00000e+00 0.00000e+00 1.32168e+02 322.199 9.19374e+00 322.199 0.9666 
1 1 1 -8  75  10 o 16 8.31085e+00 7.30969e-01 1.44971e+02 244.746 -9.41841e+00 -1.99662e+01 0.00000e+00 0.00000e+00 1.57392e+02 244.746 1.24217e+01 244.746 0.9771 
1 1 1 -8  75  11 o 4  3.46485e+00 9.17257e-01 4.71939e+01 307.031 1.58884e+00  -2.10612e+00 0.00000e+00 0.00000e+00 5.32407e+01 307.031 6.04681e+00 307.031 0.7792 
1 1 1 -8  75  12 o 4  4.21885e+00 1.07992e+00 3.60060e+01 161.233 -2.46992e+00 8.39233e-01  0.00000e+00 0.00000e+00 8.57018e+01 161.233 4.96958e+01 161.233 0.7763 
1 1 1 -8  75  13 o 9  3.65205e+00 1.01025e+00 5.64369e+01 306.656 2.43503e+00  -3.27204e+00 0.00000e+00 0.00000e+00 6.10288e+01 306.656 4.59185e+00 306.656 0.8665 
1 1 1 -8  75  14 o 5  4.47090e+00 1.11754e+00 9.00079e+01 126.209 -4.70004e+00 6.41974e+00  0.00000e+00 0.00000e+00 6.49670e+01 126.209 2.50410e+01 306.209 0.9349 
1 1 1 -8  75  15 o 4  2.97721e+00 9.96484e-01 5.34131e+01 55.717  2.22727e+00  3.26713e+00  0.00000e+00 0.00000e+00 4.15981e+01 55.717  1.18150e+01 235.717 0.8617 
1 1 1 -8  76  1  o 7  6.08107e+00 9.00564e-01 1.16870e+02 175.161 -7.72747e+00 6.54234e-01  0.00000e+00 0.00000e+00 9.56238e+01 175.161 2.12458e+01 355.161 0.9331 
1 1 1 -8  76  2  o 13 2.15558e+01 6.94661e-01 3.56509e+02 19.459  8.93977e+01  3.15855e+01  0.00000e+00 0.00000e+00 4.46127e+02 19.459  8.96176e+01 19.459  0.9947 
1 1 1 -8  76  3  o 11 6.60753e+00 7.49298e-01 1.42220e+02 147.940 -1.00557e+01 6.29809e+00  0.00000e+00 0.00000e+00 9.43443e+01 147.940 4.78754e+01 327.940 0.9569 
1 1 1 -8  76  4  o 5  1.47628e+01 5.86862e-01 2.24667e+02 77.096  9.24289e+00  4.03443e+01  0.00000e+00 0.00000e+00 3.20682e+02 77.096  9.60149e+01 77.096  0.9878 
1 1 1 -8  76  5  o 4  1.12420e+01 5.81151e-01 2.04232e+02 225.372 -2.26956e+01 -2.29924e+01 0.00000e+00 0.00000e+00 2.09360e+02 225.372 5.12778e+00 225.372 0.9844 
1 1 1 -8  76  6  o 11 7.12778e+00 6.46574e-01 1.30007e+02 140.359 -1.00735e+01 8.34579e+00  0.00000e+00 0.00000e+00 1.25817e+02 140.359 4.18933e+00 320.359 0.9610 
1 1 1 -8  76  7  o 12 6.18423e+00 7.31070e-01 1.43089e+02 2.563   1.39786e+01  6.25812e-01  0.00000e+00 0.00000e+00 7.93086e+01 2.563   6.37806e+01 182.563 0.9636 
1 1 1 -8  76  8  o 6  4.92873e+00 8.18417e-01 1.05382e+02 269.985 -2.10221e-03 -8.04740e+00 0.00000e+00 0.00000e+00 6.65907e+01 269.985 3.87916e+01 89.985  0.9356 
1 1 1 -8  76  9  o 9  3.76910e+00 8.73440e-01 7.79215e+01 284.022 1.16224e+00  -4.65370e+00 0.00000e+00 0.00000e+00 4.68517e+01 284.022 3.10697e+01 104.023 0.8884 
1 1 1 -8  76  10 o 15 4.45621e+00 9.68116e-01 8.54539e+01 63.132  2.73215e+00  5.39293e+00  0.00000e+00 0.00000e+00 6.60162e+01 63.132  1.94377e+01 243.132 0.9131 
1 1 1 -8  76  11 o 12 2.18209e+00 7.35605e-01 7.35590e+01 184.120 -3.07549e+00 -2.21554e-01 0.00000e+00 0.00000e+00 7.33890e+00 4.120   8.08979e+01 4.120   0.8160 
1 1 1 -8  76  12 o 4  4.19946e+00 1.08084e+00 9.75423e+01 322.804 5.59219e+00  -4.24413e+00 0.00000e+00 0.00000e+00 4.68981e+01 322.804 5.06442e+01 142.804 0.9258 
1 1 1 -8  76  13 f 0  8.02354e+00 1.01528e+00 1.37280e+02 294.512 9.54749e+00  -2.09385e+01 0.00000e+00 0.00000e+00 1.53954e+02 294.512 1.66740e+01 294.512 0.9780 
1 1 1 -8  76  14 o 2  4.39817e+00 1.19930e+00 9.38014e+01 22.864  7.31431e+00  3.08431e+00  0.00000e+00 0.00000e+00 5.85955e+01 22.864  3.52058e+01 202.864 0.9347 
1 1 1 -8  76  15 o 15 4.26858e+00 1.20995e+00 6.66950e+01 113.364 -2.39543e+00 5.54520e+00  0.00000e+00 0.00000e+00 7.75993e+01 113.364 1.09043e+01 113.364 0.9130 
1 1 1 -8  77  1  o 4  1.16053e+01 7.19384e-01 1.90989e+02 321.591 2.21872e+01  -1.75911e+01 0.00000e+00 0.00000e+00 2.35777e+02 321.591 4.47881e+01 321.591 0.9822 
1 1 1 -8  77  2  o 18 8.65369e+00 7.98011e-01 1.64032e+02 211.049 -1.50785e+01 -9.07781e+00 0.00000e+00 0.00000e+00 1.50495e+02 211.049 1.35362e+01 31.050  0.9712 
1 1 1 -8  77  3  o 6  8.39782e+00 6.51786e-01 9.93433e+01 326.440 8.52501e+00  -5.65552e+00 0.00000e+00 0.00000e+00 1.99025e+02 326.440 9.96821e+01 326.440 0.9498 
1 1 1 -8  77  4  f 0  6.00193e+00 8.00855e-01 1.55309e+02 138.081 -8.48372e+00 7.61699e+00  0.00000e+00 0.00000e+00 5.90088e+01 138.081 9.63005e+01 318.081 0.9551 
1 1 1 -8  77  5  o 13 7.32475e+00 6.50871e-01 1.56522e+02 264.650 -1.53561e+00 -1.63973e+01 0.00000e+00 0.00000e+00 1.08724e+02 264.650 4.77975e+01 84.650  0.9691 
1 1 1 -8  77  6  o 8  9.20513e+00 6.00441e-01 9.66739e+01 232.784 -7.97767e+00 -1.05040e+01 0.00000e+00 0.00000e+00 2.33752e+02 232.784 1.37078e+02 232.784 0.9613 
1 1 1 -8  77  7  o 8  1.45171e+01 5.61450e-01 2.47374e+02 4.131   5.92826e+01  4.28217e+00  0.00000e+00 0.00000e+00 2.89737e+02 4.131   4.23636e+01 4.131   0.9916 
1 1 1 -8  77  8  f 0  1.07288e+01 6.06875e-01 2.08075e+02 61.363  1.68071e+01  3.07791e+01  0.00000e+00 0.00000e+00 1.86197e+02 61.363  2.18776e+01 241.363 0.9856 
1 1 1 -8  77  9  o 5  7.74224e+00 7.79556e-01 1.45600e+02 276.333 2.11872e+00  -1.90899e+01 0.00000e+00 0.00000e+00 1.35211e+02 276.333 1.03885e+01 96.333  0.9736 
1 1 1 -8  77  10 o 8  2.51993e+00 7.93473e-01 4.67301e+01 194.003 -1.89147e+00 -4.71689e-01 0.00000e+00 0.00000e+00 1.79184e+01 194.003 2.88118e+01 14.003  0.6893 
1 1 1 -8  77  11 o 15 3.36775e+00 9.35752e-01 3.23214e+01 193.833 -1.86571e+00 -4.59390e-01 0.00000e+00 0.00000e+00 5.33879e+01 193.833 2.10665e+01 193.833 0.6844 
1 1 1 -8  77  12 o 8  4.59047e+00 1.05323e+00 9.47367e+01 102.013 -1.67517e+00 7.87238e+00  0.00000e+00 0.00000e+00 6.48050e+01 102.013 2.99317e+01 282.013 0.9356 
1 1 1 -8  77  13 o 8  3.42377e+00 1.05528e+00 3.60219e+01 197.577 -2.51661e+00 -7.97208e-01 0.00000e+00 0.00000e+00 6.29918e+01 197.577 2.69698e+01 197.577 0.7794 
1 1 1 -8  77  14 o 12 3.50897e+00 1.07892e+00 2.74006e+01 51.759  1.40009e+00  1.77659e+00  0.00000e+00 0.00000e+00 6.83735e+01 51.759  4.09729e+01 51.759  0.7364 
1 1 1 -8  77  15 o 11 2.88206e+00 9.69510e-01 1.37989e+01 246.120 -4.66725e-01 -1.05421e+00 0.00000e+00 0.00000e+00 3.93265e+01 246.120 2.55276e+01 246.120 0.4980 
1 1 1 -8  78  1  o 14 6.26054e+00 8.16642e-01 2.04058e+02 213.579 -1.23791e+01 -8.21810e+00 0.00000e+00 0.00000e+00 2.22626e+01 213.579 1.81796e+02 33.579  0.9657 
1 1 1 -8  78  2  o 13 1.61926e+01 7.48773e-01 2.85903e+02 2.171   5.49853e+01  2.08425e+00  0.00000e+00 0.00000e+00 3.14451e+02 2.171   2.85479e+01 2.171   0.9909 
1 1 1 -8  78  3  o 12 3.05280e+00 8.83966e-01 4.07561e+01 110.235 -5.10527e-01 1.38495e+00  0.00000e+00 0.00000e+00 2.66240e+01 110.235 1.41321e+01 290.235 0.5902 
1 1 1 -8  78  4  o 14 2.50905e+00 7.58037e-01 5.83643e+01 240.702 -9.54818e-01 -1.70163e+00 0.00000e+00 0.00000e+00 6.31095e+00 240.702 5.20533e+01 60.702  0.6896 
1 1 1 -8  78  5  o 18 1.40215e+01 5.94933e-01 2.82581e+02 110.913 -2.03156e+01 5.31663e+01  0.00000e+00 0.00000e+00 2.36601e+02 110.913 4.59802e+01 290.913 0.9912 
1 1 1 -8  78  6  o 18 8.43826e+00 6.20063e-01 1.41246e+02 286.990 5.76897e+00  -1.88816e+01 0.00000e+00 0.00000e+00 1.65691e+02 286.990 2.44450e+01 286.990 0.9743 
1 1 1 -8  78  7  o 10 9.28390e+00 6.02538e-01 1.71858e+02 195.362 -2.50059e+01 -6.86988e+00 0.00000e+00 0.00000e+00 1.67740e+02 195.362 4.11797e+00 15.362  0.9805 
1 1 1 -8  78  8  o 3  1.08009e+01 6.09383e-01 1.38393e+02 221.990 -1.81717e+01 -1.63564e+01 0.00000e+00 0.00000e+00 2.55905e+02 221.990 1.17512e+02 221.990 0.9793 
1 1 1 -8  78  9  o 3  5.17211e+00 9.31359e-01 8.58330e+01 137.807 -5.00885e+00 4.54071e+00  0.00000e+00 0.00000e+00 9.19237e+01 137.807 6.09069e+00 137.807 0.9228 
1 1 1 -8  78  10 o 12 6.27418e+00 8.68120e-01 1.00372e+02 31.428  9.22669e+00  5.63817e+00  0.00000e+00 0.00000e+00 1.22027e+02 31.428  2.16547e+01 31.428  0.9526 
1 1 1 -8  78  11 o 9  1.09520e+01 7.24566e-01 2.09929e+02 171.282 -4.60120e+01 7.05563e+00  0.00000e+00 0.00000e+00 1.92823e+02 171.282 1.71066e+01 351.282 0.9892 
1 1 1 -8  78  12 o 4  5.82148e+00 1.05639e+00 7.38312e+01 313.827 5.47524e+00  -5.70413e+00 0.00000e+00 0.00000e+00 1.28191e+02 313.827 5.43596e+01 313.827 0.9344 
1 1 1 -8  78  13 o 10 7.09867e+00 1.07905e+00 6.30322e+01 337.039 8.02881e+00  -3.40156e+00 0.00000e+00 0.00000e+00 1.84714e+02 337.039 1.21682e+02 337.039 0.9408 
1 1 1 -8  78  14 o 14 7.32684e+00 1.23837e+00 1.18896e+02 267.490 -7.32042e-01 -1.66970e+01 0.00000e+00 0.00000e+00 1.44346e+02 267.490 2.54503e+01 267.490 0.9696 
1 1 1 -8  78  15 o 2  3.90899e+00 1.18527e+00 7.70918e+01 88.450  1.92583e-01  7.11651e+00  0.00000e+00 0.00000e+00 5.69957e+01 88.450  2.00960e+01 268.450 0.9268 
1 1 1 -8  79  1  o 18 1.05500e+01 5.64802e-01 1.78320e+02 222.247 -1.92458e+01 -1.74797e+01 0.00000e+00 0.00000e+00 2.08842e+02 222.247 3.05224e+01 222.247 0.9806 
1 1 1 -8  79  2  o 8  8.64713e+00 9.59215e-01 1.43087e+02 94.717  -1.17026e+00 1.41833e+01  0.00000e+00 0.00000e+00 1.68814e+02 94.717  2.57270e+01 94.717  0.9642 
1 1 1 -8  79  3  o 6  1.17591e+01 7.44320e-01 2.46433e+02 181.164 -3.88325e+01 -7.89280e-01 0.00000e+00 0.00000e+00 1.87560e+02 181.164 5.88729e+01 1.164   0.9870 
1 1 1 -8  79  4  o 11 6.08503e+00 7.69086e-01 1.44050e+02 20.855  1.06981e+01  4.07568e+00  0.00000e+00 0.00000e+00 7.31855e+01 20.855  7.08642e+01 200.855 0.9553 
1 1 1 -8  79  5  o 12 8.04323e+00 6.90061e-01 1.32065e+02 245.966 -6.21471e+00 -1.39364e+01 0.00000e+00 0.00000e+00 1.58326e+02 245.966 2.62607e+01 245.966 0.9667 
1 1 1 -8  79  6  o 8  1.04252e+01 5.85220e-01 1.67731e+02 157.803 -2.64074e+01 1.07752e+01  0.00000e+00 0.00000e+00 2.14501e+02 157.803 4.67696e+01 157.803 0.9823 
1 1 1 -8  79  7  o 17 6.63504e+00 7.21199e-01 1.07648e+02 35.526  9.40924e+00  6.71788e+00  0.00000e+00 0.00000e+00 1.28867e+02 35.526  2.12193e+01 35.526  0.9557 
1 1 1 -8  79  8  o 5  3.53303e+00 8.59897e-01 7.14349e+01 291.897 1.43273e+00  -3.56460e+00 0.00000e+00 0.00000e+00 4.14266e+01 291.897 3.00083e+01 111.897 0.8571 
1 1 1 -8  79  9  o 4  5.84687e+00 9.05057e-01 6.33011e+01 169.094 -6.34300e+00 1.22210e+00  0.00000e+00 0.00000e+00 1.36775e+02 169.094 7.34740e+01 169.094 0.9190 
1 1 1 -8  79  10 o 5  1.27822e+01 6.36889e-01 2.31812e+02 275.175 4.96322e+00  -5.48034e+01 0.00000e+00 0.00000e+00 2.39392e+02 275.175 7.57949e+00 275.175 0.9909 
1 1 1 -8  79  11 o 2  1.28131e+01 6.65986e-01 1.89795e+02 68.281  1.96008e+01  4.92061e+01  0.00000e+00 0.00000e+00 2.81923e+02 68.281  9.21286e+01 68.281  0.9905 
1 1 1 -8  79  12 o 8  9.09519e+00 8.31661e-01 1.17984e+02 111.899 -8.40541e+00 2.09098e+01  0.00000e+00 0.00000e+00 2.12138e+02 111.899 9.41546e+01 111.899 0.9776 
1 1 1 -8  79  13 o 9  9.82003e+00 9.27987e-01 1.39216e+02 326.572 2.68511e+01  -1.77238e+01 0.00000e+00 0.00000e+00 2.19297e+02 326.572 8.00815e+01 326.572 0.9843 
1 1 1 -8  79  14 o 2  4.15620e+00 1.09152e+00 8.66331e+01 280.313 1.53393e+00  -8.42980e+00 0.00000e+00 0.00000e+00 5.80553e+01 280.313 2.85777e+01 100.313 0.9397 
1 1 1 -8  80  1  o 4  5.98452e+00 6.89395e-01 9.50500e+01 21.859  7.17507e+00  2.87844e+00  0.00000e+00 0.00000e+00 1.13842e+02 21.859  1.87917e+01 21.859  0.9329 
1 1 1 -8  80  2  o 17 9.00388e+00 1.02837e+00 7.78858e+01 305.193 4.80817e+00  -6.81787e+00 0.00000e+00 0.00000e+00 2.37991e+02 305.193 1.60105e+02 305.193 0.9380 
1 1 1 -8  80  3  o 6  1.36557e+01 7.02575e-01 2.76368e+02 285.853 1.45327e+01  -5.11754e+01 0.00000e+00 0.00000e+00 2.29305e+02 285.853 4.70632e+01 105.853 0.9906 
1 1 1 -8  80  4  o 13 3.74949e+00 8.74367e-01 6.64543e+01 62.301  1.58102e+00  3.01147e+00  0.00000e+00 0.00000e+00 5.06323e+01 62.301  1.58220e+01 242.301 0.8358 
1 1 1 -8  80  5  o 11 7.39558e+00 7.04062e-01 8.90466e+01 194.249 -1.02231e+01 -2.59606e+00 0.00000e+00 0.00000e+00 1.73675e+02 194.249 8.46283e+01 194.249 0.9513 
1 1 1 -8  80  6  o 18 2.35438e+00 7.28016e-01 8.47578e+01 53.416  1.83026e+00  2.46586e+00  0.00000e+00 0.00000e+00 1.31465e+01 233.416 9.79042e+01 233.416 0.8151 
1 1 1 -8  80  7  o 15 9.01942e+00 6.41396e-01 1.10372e+02 85.445  1.39201e+00  1.74715e+01  0.00000e+00 0.00000e+00 2.16218e+02 85.445  1.05845e+02 85.445  0.9710 
1 1 1 -8  80  8  o 7  1.25154e+01 5.94240e-01 2.24458e+02 203.148 -4.79313e+01 -2.04923e+01 0.00000e+00 0.00000e+00 2.37378e+02 203.148 1.29203e+01 203.148 0.9904 
1 1 1 -8  80  9  o 6  4.74854e+00 8.91845e-01 1.29774e+02 240.489 -5.13849e+00 -9.07815e+00 0.00000e+00 0.00000e+00 3.83103e+01 240.489 9.14634e+01 60.489  0.9508 
1 1 1 -8  80  10 o 2  2.20237e+01 6.26824e-01 3.07855e+02 49.599  8.91620e+01  1.04763e+02  0.00000e+00 0.00000e+00 5.08345e+02 49.599  2.00490e+02 49.599  0.9964 
1 1 1 -8  80  11 o 9  4.06946e+00 1.00218e+00 2.44903e+01 251.311 -6.05343e-01 -1.78950e+00 0.00000e+00 0.00000e+00 7.81421e+01 251.311 5.36518e+01 251.311 0.6787 
1 1 1 -8  80  12 o 1  6.88777e+00 1.07306e+00 1.25342e+02 252.925 -4.78462e+00 -1.55771e+01 0.00000e+00 0.00000e+00 1.22368e+02 252.925 2.97395e+00 72.925  0.9688 
1 1 1 -8  80  13 o 5  3.43786e+00 1.04553e+00 5.84662e+01 46.546  2.99417e+00  3.16024e+00  0.00000e+00 0.00000e+00 5.31884e+01 46.546  5.27775e+00 226.546 0.8759 
1 1 1 -8  80  14 o 14 3.55420e+00 1.11137e+00 6.21102e+01 211.175 -4.52571e+00 -2.73821e+00 0.00000e+00 0.00000e+00 5.63280e+01 211.175 5.78226e+00 31.175  0.8997 
1 1 1 -8  81  1  o 17 3.69401e+00 8.45500e-01 6.56022e+01 145.676 -2.66797e+00 1.82159e+00  0.00000e+00 0.00000e+00 4.84959e+01 145.676 1.71063e+01 325.676 0.8257 
1 1 1 -8  81  2  o 16 1.11102e+01 6.12446e-01 1.99432e+02 237.047 -1.66221e+01 -2.56421e+01 0.00000e+00 0.00000e+00 2.09156e+02 237.047 9.72392e+00 237.047 0.9835 
1 1 1 -8  81  3  o 7  1.13019e+01 7.35835e-01 1.68849e+02 26.837  2.32731e+01  1.17750e+01  0.00000e+00 0.00000e+00 2.45383e+02 26.837  7.65348e+01 26.837  0.9806 
1 1 1 -8  81  4  o 8  7.20630e+00 9.03426e-01 1.10131e+02 100.429 -1.86114e+00 1.01120e+01  0.00000e+00 0.00000e+00 1.45614e+02 100.429 3.54829e+01 100.429 0.9501 
1 1 1 -8  81  5  o 10 7.72796e+00 7.19151e-01 1.67929e+02 185.211 -2.01703e+01 -1.83949e+00 0.00000e+00 0.00000e+00 1.13362e+02 185.211 5.45673e+01 5.211   0.9750 
1 1 1 -8  81  6  o 15 6.83727e+00 7.77847e-01 1.55869e+02 67.745  6.10943e+00  1.49296e+01  0.00000e+00 0.00000e+00 9.11792e+01 67.745  6.46899e+01 247.745 0.9685 
1 1 1 -8  81  7  o 16 7.21911e+00 7.16062e-01 1.50013e+02 319.262 1.42773e+01  -1.22969e+01 0.00000e+00 0.00000e+00 1.11883e+02 319.262 3.81306e+01 139.262 0.9731 
1 1 1 -8  81  8  o 18 7.41121e+00 7.35763e-01 8.86806e+01 217.306 -8.78016e+00 -6.69021e+00 0.00000e+00 0.00000e+00 1.74584e+02 217.306 8.59038e+01 217.306 0.9536 
1 1 1 -8  81  9  o 13 6.01084e+00 9.27341e-01 9.04157e+01 236.857 -5.00896e+00 -7.67118e+00 0.00000e+00 0.00000e+00 1.20725e+02 236.857 3.03095e+01 236.857 0.9437 
1 1 1 -8  81  10 o 10 9.17167e+00 7.24899e-01 1.50882e+02 125.064 -1.58561e+01 2.25909e+01  0.00000e+00 0.00000e+00 1.83950e+02 125.064 3.30687e+01 125.064 0.9817 
1 1 1 -8  81  11 o 4  1.67046e+01 6.63557e-01 2.67864e+02 264.888 -8.80732e+00 -9.84514e+01 0.00000e+00 0.00000e+00 3.49588e+02 264.888 8.17235e+01 264.888 0.9949 
1 1 1 -8  81  12 o 8  8.73324e+00 9.21883e-01 1.17119e+02 93.692  -1.47901e+00 2.29212e+01  0.00000e+00 0.00000e+00 1.99865e+02 93.692  8.27465e+01 93.692  0.9780 
1 1 1 -8  81  13 o 19 2.72989e+00 9.07865e-01 4.14696e+01 96.819  -3.21655e-01 2.68975e+00  0.00000e+00 0.00000e+00 3.80708e+01 96.819  3.39878e+00 276.819 0.7859 
1 1 1 -8  81  14 o 11 8.75541e+00 1.14965e+00 1.63906e+02 242.713 -1.52719e+01 -2.96055e+01 0.00000e+00 0.00000e+00 1.55407e+02 242.713 8.49900e+00 62.713  0.9849 
1 1 1 -8  82  1  o 18 7.46386e+00 6.37532e-01 1.75680e+02 291.686 6.86611e+00  -1.72663e+01 0.00000e+00 0.00000e+00 9.58500e+01 291.686 7.98296e+01 111.686 0.9727 
1 1 1 -8  82  2  o 14 7.01733e+00 7.51726e-01 1.31145e+02 176.656 -1.32148e+01 7.72249e-01  0.00000e+00 0.00000e+00 1.21081e+02 176.656 1.00643e+01 356.655 0.9615 
1 1 1 -8  82  3  o 3  6.86111e+00 9.19981e-01 1.60431e+02 258.060 -2.97428e+00 -1.40650e+01 0.00000e+00 0.00000e+00 8.68624e+01 258.060 7.35683e+01 78.060  0.9646 
1 1 1 -8  82  4  o 3  5.98419e+00 1.00872e+00 1.07748e+02 32.086  7.56261e+00  4.74136e+00  0.00000e+00 0.00000e+00 1.02823e+02 32.086  4.92516e+00 212.086 0.9422 
1 1 1 -8  82  5  o 17 7.69762e+00 7.30730e-01 1.23168e+02 111.734 -5.39622e+00 1.35369e+01  0.00000e+00 0.00000e+00 1.54101e+02 111.734 3.09322e+01 111.734 0.9651 
1 1 1 -8  82  6  o 8  9.89885e+00 6.74440e-01 1.85502e+02 188.013 -2.78827e+01 -3.92522e+00 0.00000e+00 0.00000e+00 1.77107e+02 188.013 8.39508e+00 8.013   0.9821 
1 1 1 -8  82  7  o 12 7.41854e+00 7.04155e-01 1.08916e+02 24.289  1.30941e+01  5.90921e+00  0.00000e+00 0.00000e+00 1.57790e+02 24.289  4.88743e+01 24.289  0.9645 
1 1 1 -8  82  8  o 13 9.28081e+00 6.56606e-01 1.88594e+02 253.783 -9.76757e+00 -3.35838e+01 0.00000e+00 0.00000e+00 1.52082e+02 253.783 3.65121e+01 73.783  0.9856 
1 1 1 -8  82  9  o 10 1.39432e+01 6.20282e-01 2.37110e+02 127.538 -4.16764e+01 5.42384e+01  0.00000e+00 0.00000e+00 2.77946e+02 127.538 4.08357e+01 127.538 0.9927 
1 1 1 -8  82  10 o 15 1.04149e+01 7.25013e-01 1.52708e+02 341.832 3.05828e+01  -1.00361e+01 0.00000e+00 0.00000e+00 2.28446e+02 341.832 7.57384e+01 341.832 0.9843 
1 1 1 -8  82  11 o 2  2.69284e+00 8.45412e-01 6.15798e+01 203.996 -3.20952e+00 -1.42870e+00 0.00000e+00 0.00000e+00 2.26161e+01 203.996 3.89637e+01 23.996  0.8418 
1 1 1 -8  82  12 o 17 4.87479e+00 1.11416e+00 9.41494e+01 141.717 -7.33420e+00 5.78862e+00  0.00000e+00 0.00000e+00 7.67577e+01 141.717 1.73917e+01 321.717 0.9449 
1 1 1 -8  82  13 o 9  2.53522e+00 8.62894e-01 2.03248e+01 36.229  1.19728e+00  8.77212e-01  0.00000e+00 0.00000e+00 3.53240e+01 36.229  1.49992e+01 36.229  0.5922 
1 1 1 -8  82  14 o 3  3.66110e+00 1.12011e+00 6.11582e+01 206.712 -4.66586e+00 -2.34787e+00 0.00000e+00 0.00000e+00 6.06018e+01 206.712 5.56394e-01 26.712  0.8983 
1 1 1 -8  83  1  o 5  7.55894e+00 6.44327e-01 9.51184e+01 48.890  6.90647e+00  7.91416e+00  0.00000e+00 0.00000e+00 1.73711e+02 48.890  7.85928e+01 48.890  0.9511 
1 1 1 -8  83  2  o 7  7.95941e+00 6.93465e-01 1.11497e+02 138.295 -9.34205e+00 8.32489e+00  0.00000e+00 0.00000e+00 1.73847e+02 138.295 6.23497e+01 138.295 0.9592 
1 1 1 -8  83  3  o 4  3.27590e+00 9.34554e-01 9.38026e+01 170.908 -4.36492e+00 6.98512e-01  0.00000e+00 0.00000e+00 1.36419e+01 170.908 8.01607e+01 350.908 0.8779 
1 1 1 -8  83  4  o 9  6.57880e+00 1.06959e+00 1.15916e+02 59.135  5.15526e+00  8.62562e+00  0.00000e+00 0.00000e+00 1.17162e+02 59.135  1.24534e+00 59.135  0.9489 
1 1 1 -8  83  5  o 15 6.22458e+00 7.82460e-01 1.44584e+02 217.727 -1.07495e+01 -8.31631e+00 0.00000e+00 0.00000e+00 7.89761e+01 217.727 6.56080e+01 37.727  0.9625 
1 1 1 -8  83  6  o 9  8.77756e+00 7.19707e-01 1.97805e+02 12.978  2.65061e+01  6.10890e+00  0.00000e+00 0.00000e+00 1.23447e+02 12.978  7.43582e+01 192.978 0.9814 
1 1 1 -8  83  7  o 18 6.75688e+00 8.82503e-01 1.31363e+02 267.706 -5.87289e-01 -1.46608e+01 0.00000e+00 0.00000e+00 1.11691e+02 267.706 1.96727e+01 87.706  0.9653 
1 1 1 -8  83  8  o 2  3.72643e+00 9.21583e-01 7.86552e+01 345.123 4.71715e+00  -1.25306e+00 0.00000e+00 0.00000e+00 4.49121e+01 345.123 3.37430e+01 165.123 0.8905 
1 1 1 -8  83  9  o 14 8.27771e+00 7.68190e-01 1.60805e+02 209.796 -2.14040e+01 -1.22561e+01 0.00000e+00 0.00000e+00 1.40851e+02 209.796 1.99543e+01 29.796  0.9795 
1 1 1 -8  83  10 o 5  9.08562e+00 7.56369e-01 1.51140e+02 115.423 -1.21997e+01 2.56659e+01  0.00000e+00 0.00000e+00 1.80581e+02 115.423 2.94405e+01 115.423 0.9822 
1 1 1 -8  83  11 o 4  3.47172e+00 9.87087e-01 5.42844e+01 70.211  1.20836e+00  3.35838e+00  0.00000e+00 0.00000e+00 5.46073e+01 70.211  3.22887e-01 70.211  0.8446 
1 1 1 -8  83  12 o 19 3.11365e+00 9.65813e-01 9.18763e+01 207.378 -5.39661e+00 -2.79473e+00 0.00000e+00 0.00000e+00 1.36438e+01 207.378 7.82325e+01 27.378  0.9135 
1 1 1 -8  83  13 o 4  4.03243e+00 1.13092e+00 6.23189e+01 131.215 -3.49366e+00 3.98869e+00  0.00000e+00 0.00000e+00 7.21586e+01 131.215 9.83972e+00 131.215 0.9000 
1 1 1 -8  83  14 o 6  2.96306e+00 9.83298e-01 6.45144e+01 218.019 -4.12729e+00 -3.22681e+00 0.00000e+00 0.00000e+00 3.40441e+01 218.019 3.04703e+01 38.019  0.8986 
1 1 1 -8  84  1  o 11 8.19059e+00 6.43072e-01 1.08471e+02 102.684 -3.20427e+00 1.42370e+01  0.00000e+00 0.00000e+00 1.87032e+02 102.684 7.85611e+01 102.684 0.9651 
1 1 1 -8  84  2  o 1  9.65391e+00 5.88610e-01 1.77324e+02 196.035 -2.68593e+01 -7.71963e+00 0.00000e+00 0.00000e+00 1.76904e+02 196.035 4.19791e-01 16.035  0.9819 
1 1 1 -8  84  3  o 2  3.63317e+00 8.60177e-01 6.52761e+01 126.545 -2.06759e+00 2.78957e+00  0.00000e+00 0.00000e+00 4.86614e+01 126.545 1.66146e+01 306.545 0.8396 
1 1 1 -8  84  4  o 12 1.04597e+01 9.53579e-01 2.15120e+02 359.961 3.13654e+01  -2.15237e-02 0.00000e+00 0.00000e+00 1.69062e+02 359.961 4.60584e+01 179.961 0.9839 
1 1 1 -8  84  5  o 9  7.10200e+00 9.09759e-01 9.92230e+01 198.197 -9.27368e+00 -3.04849e+00 0.00000e+00 0.00000e+00 1.51772e+02 198.197 5.25495e+01 198.197 0.9473 
1 1 1 -8  84  6  o 15 3.87693e+00 9.11955e-01 4.03412e+01 351.875 2.29738e+00  -3.27991e-01 0.00000e+00 0.00000e+00 6.71987e+01 351.875 2.68576e+01 351.875 0.7440 
1 1 1 -8  84  7  o 6  2.50084e+00 7.78520e-01 6.60643e+01 272.705 1.39826e-01  -2.95890e+00 0.00000e+00 0.00000e+00 9.13897e+00 272.705 5.69253e+01 92.706  0.8072 
1 1 1 -8  84  8  f 0  3.50690e+00 8.92165e-01 4.82966e+01 35.669  2.36781e+00  1.69950e+00  0.00000e+00 0.00000e+00 5.65970e+01 35.669  8.30036e+00 35.669  0.8035 
1 1 1 -8  84  9  o 6  6.99520e+00 8.43550e-01 1.06237e+02 159.699 -1.28140e+01 4.74031e+00  0.00000e+00 0.00000e+00 1.44243e+02 159.699 3.80062e+01 159.699 0.9627 
1 1 1 -8  84  10 o 17 4.54032e+00 1.02889e+00 7.02459e+01 82.729  7.50428e-01  5.88129e+00  0.00000e+00 0.00000e+00 8.35056e+01 82.729  1.32596e+01 82.729  0.9112 
1 1 1 -8  84  11 o 1  4.01287e+00 1.05357e+00 9.78273e+01 250.320 -2.53418e+00 -7.08561e+00 0.00000e+00 0.00000e+00 4.08707e+01 250.320 5.69566e+01 70.320  0.9310 
1 1 1 -8  84  12 o 8  3.14105e+00 9.77259e-01 7.04403e+01 192.217 -4.84058e+00 -1.04810e+00 0.00000e+00 0.00000e+00 3.35061e+01 192.217 3.69342e+01 12.217  0.8923 
1 1 1 -8  84  13 o 4  2.79662e+00 9.29806e-01 5.18691e+01 94.286  -3.01464e-01 4.02211e+00  0.00000e+00 0.00000e+00 3.77313e+01 94.286  1.41378e+01 274.286 0.8648 
1 1 1 -8  84  14 o 17 3.23715e+00 1.03648e+00 6.09005e+01 36.974  4.00553e+00  3.01551e+00  0.00000e+00 0.00000e+00 4.61577e+01 36.974  1.47427e+01 216.974 0.8937 
1 1 1 -8  85  1  o 17 8.22070e+00 6.30861e-01 1.48172e+02 92.725  -9.36056e-01 1.96679e+01  0.00000e+00 0.00000e+00 1.51164e+02 92.725  2.99128e+00 92.725  0.9743 
1 1 1 -8  85  2  o 4  1.06241e+01 5.90023e-01 2.11965e+02 201.938 -3.39839e+01 -1.36874e+01 0.00000e+00 0.00000e+00 1.79486e+02 201.938 3.24787e+01 21.938  0.9863 
1 1 1 -8  85  3  o 15 5.57501e+00 7.65793e-01 5.04332e+01 271.245 9.30223e-02  -4.28047e+00 0.00000e+00 0.00000e+00 1.31417e+02 271.245 8.09834e+01 271.245 0.8735 
1 1 1 -8  85  4  o 10 4.87876e+00 1.13415e+00 1.03210e+02 235.978 -3.70179e+00 -5.48354e+00 0.00000e+00 0.00000e+00 6.44818e+01 235.978 3.87285e+01 55.978  0.9210 
1 1 1 -8  85  5  o 7  1.00328e+01 8.23800e-01 1.56317e+02 111.547 -8.61494e+00 2.18180e+01  0.00000e+00 0.00000e+00 2.09827e+02 111.547 5.35107e+01 111.547 0.9784 
1 1 1 -8  85  6  f 0  6.30219e+00 8.77285e-01 6.30253e+01 250.179 -2.18476e+00 -6.06130e+00 0.00000e+00 0.00000e+00 1.52794e+02 250.179 8.97686e+01 250.179 0.9187 
1 1 1 -8  85  7  o 11 4.75497e+00 9.67470e-01 5.32793e+01 299.780 2.00146e+00  -3.49754e+00 0.00000e+00 0.00000e+00 9.98599e+01 299.780 4.65806e+01 299.780 0.8647 
1 1 1 -8  85  8  o 12 3.69216e+00 8.07042e-01 7.72299e+01 335.728 4.87830e+00  -2.19972e+00 0.00000e+00 0.00000e+00 4.65734e+01 335.728 3.06566e+01 155.729 0.9009 
1 1 1 -8  85  9  o 19 5.79951e+00 9.62804e-01 5.78549e+01 137.079 -4.32722e+00 4.02405e+00  0.00000e+00 0.00000e+00 1.38601e+02 137.079 8.07458e+01 137.079 0.9109 
1 1 1 -8  85  10 o 19 3.11909e+00 8.98397e-01 3.55118e+01 214.962 -1.74152e+00 -1.21769e+00 0.00000e+00 0.00000e+00 4.76089e+01 214.962 1.20971e+01 214.962 0.7173 
1 1 1 -8  85  11 o 4  3.77404e+00 1.01279e+00 6.87921e+01 81.512  8.02241e-01  5.37588e+00  0.00000e+00 0.00000e+00 5.76456e+01 81.512  1.11464e+01 261.512 0.9026 
1 1 1 -8  85  12 o 1  2.72315e+00 8.92356e-01 5.35279e+01 148.707 -2.95109e+00 1.79380e+00  0.00000e+00 0.00000e+00 3.11522e+01 148.707 2.23757e+01 328.707 0.8386 
1 1 1 -8  85  13 o 15 2.46113e+00 8.39657e-01 7.58196e+01 65.173  2.45481e+00  5.30600e+00  0.00000e+00 0.00000e+00 7.12597e+00 65.173  6.86936e+01 245.173 0.9099 
1 1 1 -8  85  14 o 16 3.22155e+00 1.02744e+00 4.74347e+01 281.066 8.36221e-01  -4.27562e+00 0.00000e+00 0.00000e+00 5.69685e+01 281.066 9.53378e+00 281.066 0.8760 
1 1 1 -8  86  1  o 19 1.04131e+01 6.07848e-01 1.66596e+02 195.678 -2.71281e+01 -7.61407e+00 0.00000e+00 0.00000e+00 2.15527e+02 195.678 4.89307e+01 195.678 0.9821 
1 1 1 -8  86  2  f 0  1.39769e+01 5.52329e-01 1.52469e+02 261.673 -5.11508e+00 -3.49482e+01 0.00000e+00 0.00000e+00 3.62126e+02 261.673 2.09657e+02 261.673 0.9857 
1 1 1 -8  86  3  o 7  2.24367e+00 6.99770e-01 2.58046e+01 71.383  3.01978e-01  8.96412e-01  0.00000e+00 0.00000e+00 9.95274e+00 71.383  1.58519e+01 251.383 0.4269 
1 1 1 -8  86  4  o 7  4.72410e+00 1.01856e+00 1.23499e+02 48.368  5.65642e+00  6.36382e+00  0.00000e+00 0.00000e+00 4.20684e+01 48.368  8.14303e+01 228.368 0.9393 
1 1 1 -8  86  5  o 13 1.01524e+01 8.23117e-01 1.97066e+02 113.677 -1.24461e+01 2.83843e+01  0.00000e+00 0.00000e+00 1.75360e+02 113.677 2.17060e+01 293.677 0.9837 
1 1 1 -8  86  6  o 7  1.04547e+01 7.90671e-01 1.84972e+02 287.413 9.46902e+00  -3.01923e+01 0.00000e+00 0.00000e+00 1.98421e+02 287.413 1.34492e+01 287.413 0.9841 
1 1 1 -8  86  7  o 11 6.39135e+00 8.97133e-01 1.38799e+02 258.441 -2.79621e+00 -1.36724e+01 0.00000e+00 0.00000e+00 9.05140e+01 258.441 4.82846e+01 78.442  0.9635 
1 1 1 -8  86  8  o 6  8.03883e+00 8.36982e-01 1.16677e+02 43.893  1.20652e+01  1.16079e+01  0.00000e+00 0.00000e+00 1.73369e+02 43.893  5.66920e+01 43.893  0.9697 
1 1 1 -8  86  9  f 0  5.76446e+00 9.53094e-01 2.19766e+01 139.321 -1.76314e+00 1.51541e+00  0.00000e+00 0.00000e+00 1.37585e+02 139.321 1.15609e+02 139.321 0.7445 
1 1 1 -8  86  10 f 0  3.61492e+00 9.66117e-01 1.12647e+02 23.689  7.26822e+00  3.18883e+00  0.00000e+00 0.00000e+00 1.28595e+01 23.689  9.97879e+01 203.689 0.9347 
1 1 1 -8  86  11 o 2  1.20112e+01 7.72129e-01 1.53780e+02 153.353 -4.44625e+01 2.23107e+01  0.00000e+00 0.00000e+00 2.87438e+02 153.353 1.33658e+02 153.353 0.9899 
1 1 1 -8  86  12 o 19 4.00891e+00 1.09264e+00 8.22210e+01 19.908  6.52754e+00  2.36396e+00  0.00000e+00 0.00000e+00 5.52294e+01 19.908  2.69916e+01 199.908 0.9249 
1 1 1 -8  86  13 o 13 3.03805e+00 9.69049e-01 3.79527e+01 320.326 2.46502e+00  -2.04459e+00 0.00000e+00 0.00000e+00 5.47387e+01 320.326 1.67860e+01 320.326 0.8239 
1 1 1 -8  87  1  o 2  8.58874e+00 6.37795e-01 1.36561e+02 115.942 -8.60661e+00 1.76914e+01  0.00000e+00 0.00000e+00 1.76022e+02 115.942 3.94601e+01 115.942 0.9742 
1 1 1 -8  87  2  o 2  9.34647e+00 6.35425e-01 2.15379e+02 53.596  1.86212e+01  2.52532e+01  0.00000e+00 0.00000e+00 1.28021e+02 53.596  8.73580e+01 233.596 0.9839 
1 1 1 -8  87  3  o 1  5.46320e+00 8.45772e-01 1.37602e+02 110.952 -4.30208e+00 1.12356e+01  0.00000e+00 0.00000e+00 5.76360e+01 110.952 7.99661e+01 290.952 0.9575 
1 1 1 -8  87  4  o 1  1.30314e+01 6.04028e-01 2.59967e+02 294.603 2.57464e+01  -5.62278e+01 0.00000e+00 0.00000e+00 2.22203e+02 294.603 3.77645e+01 114.603 0.9919 
1 1 1 -8  87  5  o 10 6.47398e+00 1.06210e+00 8.70561e+01 154.561 -7.44434e+00 3.54098e+00  0.00000e+00 0.00000e+00 1.39150e+02 154.561 5.20939e+01 154.561 0.9372 
1 1 1 -8  87  6  o 19 4.97834e+00 1.07957e+00 9.94723e+01 59.255  3.97172e+00  6.67724e+00  0.00000e+00 0.00000e+00 7.36193e+01 59.255  2.58530e+01 239.255 0.9332 
1 1 1 -8  87  7  o 9  9.49092e+00 7.44422e-01 1.67023e+02 226.593 -1.99953e+01 -2.11396e+01 0.00000e+00 0.00000e+00 1.80196e+02 226.593 1.31733e+01 226.593 0.9827 
1 1 1 -8  87  8  o 12 3.88146e+00 9.92822e-01 4.24557e+01 315.560 1.97740e+00  -1.93914e+00 0.00000e+00 0.00000e+00 7.18159e+01 315.560 2.93602e+01 315.560 0.7914 
1 1 1 -8  87  9  o 15 3.28468e+00 9.45705e-01 2.64002e+01 26.869  1.52658e+00  7.73456e-01  0.00000e+00 0.00000e+00 5.22506e+01 26.869  2.58503e+01 26.869  0.6442 
1 1 1 -8  87  10 o 8  2.73141e+00 8.63315e-01 4.82867e+01 69.609  9.45315e-01  2.54315e+00  0.00000e+00 0.00000e+00 3.14727e+01 69.609  1.68140e+01 249.609 0.7863 
1 1 1 -8  87  11 f 0  3.44513e+00 9.59926e-01 6.92979e+01 190.447 -5.01203e+00 -9.24086e-01 0.00000e+00 0.00000e+00 4.51697e+01 190.447 2.41282e+01 10.446  0.8956 
1 1 1 -8  87  12 o 4  4.06608e+00 1.08525e+00 5.21779e+01 112.374 -1.84427e+00 4.48033e+00  0.00000e+00 0.00000e+00 8.18917e+01 112.374 2.97138e+01 112.374 0.8897 
1 1 1 -8  87  13 o 7  2.36828e+00 8.14646e-01 3.95236e+01 280.928 5.55506e-01  -2.87710e+00 0.00000e+00 0.00000e+00 3.10304e+01 280.928 8.49317e+00 100.928 0.8047 
1 1 1 -8  88  1  o 7  1.06396e+01 5.91669e-01 1.72495e+02 338.506 3.06969e+01  -1.20880e+01 0.00000e+00 0.00000e+00 2.18798e+02 338.506 4.63028e+01 338.506 0.9847 
1 1 1 -8  88  2  o 7  1.13811e+01 5.78694e-01 1.54107e+02 295.931 1.27129e+01  -2.61453e+01 0.00000e+00 0.00000e+00 2.63401e+02 295.931 1.09294e+02 295.931 0.9826 
1 1 1 -8  88  3  o 4  8.23069e+00 6.50084e-01 1.18988e+02 65.956  7.14721e+00  1.60196e+01  0.00000e+00 0.00000e+00 1.79250e+02 65.956  6.02619e+01 65.956  0.9711 
1 1 1 -8  88  4  o 1  3.14157e+00 8.37960e-01 7.47659e+01 78.605  7.69547e-01  3.81817e+00  0.00000e+00 0.00000e+00 2.59191e+01 78.605  4.88468e+01 258.605 0.8594 
1 1 1 -8  88  5  o 10 2.96542e+00 9.20586e-01 6.85605e+01 5.746   3.09744e+00  3.11686e-01  0.00000e+00 0.00000e+00 2.18521e+01 5.746   4.67084e+01 185.746 0.8180 
1 1 1 -8  88  6  o 8  8.20663e+00 9.87005e-01 1.23358e+02 321.819 1.27491e+01  -1.00257e+01 0.00000e+00 0.00000e+00 1.72740e+02 321.819 4.93820e+01 321.819 0.9687 
1 1 1 -8  88  7  o 19 6.94346e+00 8.80343e-01 9.51017e+01 154.802 -9.84564e+00 4.63249e+00  0.00000e+00 0.00000e+00 1.51162e+02 154.802 5.60598e+01 154.802 0.9529 
1 1 1 -8  88  8  o 1  2.44016e+00 7.94858e-01 5.14586e+01 230.769 -1.54779e+00 -1.89570e+00 0.00000e+00 0.00000e+00 1.74364e+01 230.769 3.40222e+01 50.769  0.7591 
1 1 1 -8  88  9  o 15 1.07392e+01 7.18482e-01 1.78193e+02 344.723 3.95713e+01  -1.08082e+01 0.00000e+00 0.00000e+00 2.15988e+02 344.723 3.77957e+01 344.723 0.9877 
1 1 1 -8  88  10 o 12 4.16319e+00 1.02329e+00 6.16546e+01 253.778 -1.40677e+00 -4.83533e+00 0.00000e+00 0.00000e+00 7.65599e+01 253.778 1.49053e+01 253.778 0.8942 
1 1 1 -8  88  11 o 13 4.29719e+00 1.08504e+00 7.48611e+01 112.752 -2.55001e+00 6.08062e+00  0.00000e+00 0.00000e+00 7.18865e+01 112.752 2.97464e+00 292.751 0.9207 
1 1 1 -8  88  12 o 14 2.90453e+00 9.11278e-01 2.03158e+01 335.482 1.40282e+00  -6.39843e-01 0.00000e+00 0.00000e+00 4.49365e+01 335.482 2.46208e+01 335.482 0.6063 
1 1 1 -8  88  13 o 9  3.59443e+00 1.07512e+00 7.78053e+01 332.944 6.22510e+00  -3.17947e+00 0.00000e+00 0.00000e+00 4.53132e+01 332.944 3.24921e+01 152.944 0.9254 
1 1 1 -8  89  1  o 7  5.20221e+00 8.21699e-01 5.58549e+01 228.182 -3.20175e+00 -3.57875e+00 0.00000e+00 0.00000e+00 1.16745e+02 228.182 6.08904e+01 228.182 0.8886 
1 1 1 -8  89  2  o 1  8.12029e+00 6.69966e-01 1.41403e+02 60.284  9.45550e+00  1.65662e+01  0.00000e+00 0.00000e+00 1.53617e+02 60.284  1.22146e+01 60.284  0.9734 
1 1 1 -8  89  3  o 8  4.69368e+00 8.12135e-01 5.52319e+01 216.639 -3.50495e+00 -2.60667e+00 0.00000e+00 0.00000e+00 9.82112e+01 216.639 4.29792e+01 216.639 0.8763 
1 1 1 -8  89  4  o 6  6.84403e+00 7.63250e-01 1.36912e+02 208.027 -1.37319e+01 -7.30953e+00 0.00000e+00 0.00000e+00 1.09927e+02 208.027 2.69843e+01 28.027  0.9673 
1 1 1 -8  89  5  o 17 4.01434e+00 9.06714e-01 5.34036e+01 52.606  2.14339e+00  2.80404e+00  0.00000e+00 0.00000e+00 7.26420e+01 52.606  1.92385e+01 52.606  0.8426 
1 1 1 -8  89  6  o 8  3.03277e+00 9.40165e-01 4.64180e+01 196.049 -2.26212e+00 -6.50736e-01 0.00000e+00 0.00000e+00 3.80718e+01 196.049 8.34624e+00 16.049  0.7481 
1 1 1 -8  89  7  o 16 4.56630e+00 1.08894e+00 9.79280e+01 57.088  3.79436e+00  5.86249e+00  0.00000e+00 0.00000e+00 5.93068e+01 57.088  3.86212e+01 237.088 0.9253 
1 1 1 -8  89  8  o 14 3.92969e+00 1.01718e+00 1.52121e+01 130.522 -6.83073e-01 7.99157e-01  0.00000e+00 0.00000e+00 5.26262e+01 130.522 3.74141e+01 130.522 0.4643 
1 1 1 -8  89  9  o 16 3.64964e+00 1.01340e+00 2.63144e+01 139.266 -1.37320e+00 1.18257e+00  0.00000e+00 0.00000e+00 6.37709e+01 139.266 3.74566e+01 139.266 0.6644 
1 1 1 -8  89  10 o 9  3.62503e+00 9.99622e-01 5.72609e+01 189.465 -4.43625e+00 -7.39576e-01 0.00000e+00 0.00000e+00 6.11809e+01 189.465 3.92003e+00 189.465 0.8803 
1 1 1 -8  89  11 o 8  7.32420e+00 1.02350e+00 1.42075e+02 74.131  6.07127e+00  2.13569e+01  0.00000e+00 0.00000e+00 1.23334e+02 74.131  1.87412e+01 254.131 0.9772 
1 1 1 -8  89  12 o 4  2.67635e+00 8.85766e-01 5.77008e+01 317.880 3.23206e+00  -2.92243e+00 0.00000e+00 0.00000e+00 2.91471e+01 317.880 2.85537e+01 137.880 0.8760 
1 1 1 -8  89  13 o 13 4.27554e+00 1.10046e+00 3.12419e+01 200.334 -2.99042e+00 -1.10821e+00 0.00000e+00 0.00000e+00 9.89748e+01 200.334 6.77329e+01 200.334 0.8231 
1 1 1 -8  90  1  o 3  1.06436e+01 5.96767e-01 2.23244e+02 138.866 -3.33523e+01 2.91296e+01  0.00000e+00 0.00000e+00 1.69562e+02 138.866 5.36824e+01 318.866 0.9886 
1 1 1 -8  90  2  o 4  4.14986e+00 8.74042e-01 6.49725e+01 334.858 3.96836e+00  -1.86247e+00 0.00000e+00 0.00000e+00 7.07996e+01 334.858 5.82703e+00 334.858 0.8768 
1 1 1 -8  90  3  o 7  3.12654e+00 8.56975e-01 5.00736e+01 242.015 -1.16529e+00 -2.19297e+00 0.00000e+00 0.00000e+00 3.89186e+01 242.015 1.11550e+01 62.015  0.7632 
1 1 1 -8  90  4  o 11 5.93748e+00 8.60429e-01 1.15371e+02 326.516 1.02443e+01  -6.77642e+00 0.00000e+00 0.00000e+00 9.67455e+01 326.516 1.86259e+01 146.516 0.9584 
1 1 1 -8  90  5  o 1  6.71771e+00 8.07193e-01 1.42701e+02 7.253   1.56609e+01  1.99311e+00  0.00000e+00 0.00000e+00 9.94998e+01 7.253   4.32014e+01 187.253 0.9678 
1 1 1 -8  90  6  o 11 4.12776e+00 1.04347e+00 5.39872e+01 349.129 3.55910e+00  -6.83497e-01 0.00000e+00 0.00000e+00 7.62263e+01 349.129 2.22391e+01 349.129 0.8473 
1 1 1 -8  90  7  o 1  3.64166e+00 1.02004e+00 3.33525e+01 118.283 -9.63283e-01 1.79030e+00  0.00000e+00 0.00000e+00 6.19059e+01 118.283 2.85534e+01 118.283 0.7031 
1 1 1 -8  90  8  o 1  1.34837e+01 7.09901e-01 2.31376e+02 154.953 -6.50570e+01 3.04010e+01  0.00000e+00 0.00000e+00 2.66359e+02 154.953 3.49826e+01 154.953 0.9930 
1 1 1 -8  90  9  o 18 1.14576e+01 8.05069e-01 1.47705e+02 345.267 3.50050e+01  -9.20469e+00 0.00000e+00 0.00000e+00 2.71937e+02 345.267 1.24232e+02 345.267 0.9861 
1 1 1 -8  90  10 o 2  1.09155e+01 7.89829e-01 1.49219e+02 261.795 -6.19885e+00 -4.29885e+01 0.00000e+00 0.00000e+00 2.51151e+02 261.795 1.01932e+02 261.795 0.9884 
1 1 1 -8  90  11 o 16 4.87449e+00 1.11752e+00 1.11311e+02 53.554  6.64508e+00  8.99802e+00  0.00000e+00 0.00000e+00 6.11239e+01 53.554  5.01873e+01 233.554 0.9542 
1 1 1 -8  90  12 o 3  4.99626e+00 1.16709e+00 3.92359e+01 279.123 6.60468e-01  -4.11289e+00 0.00000e+00 0.00000e+00 1.21672e+02 279.123 8.24363e+01 279.123 0.8696 
1 1 1 -8  90  13 o 12 3.25387e+00 1.00443e+00 4.08426e+01 170.254 -3.82558e+00 6.57045e-01  0.00000e+00 0.00000e+00 6.25380e+01 170.254 2.16954e+01 170.254 0.8588 
1 1 1 -8  91  1  o 8  5.82009e+00 8.07427e-01 1.46843e+02 66.485  5.86171e+00  1.34711e+01  0.00000e+00 0.00000e+00 6.28356e+01 66.485  8.40076e+01 246.485 0.9653 
1 1 1 -8  91  2  o 2  8.34968e+00 6.79511e-01 1.09074e+02 312.710 1.06425e+01  -1.15293e+01 0.00000e+00 0.00000e+00 1.92313e+02 312.710 8.32398e+01 312.710 0.9676 
1 1 1 -8  91  3  o 7  6.40978e+00 7.75494e-01 8.43210e+01 143.690 -8.19199e+00 6.01971e+00  0.00000e+00 0.00000e+00 1.42602e+02 143.690 5.82813e+01 143.690 0.9495 
1 1 1 -8  91  4  o 9  6.78975e+00 8.01244e-01 1.46426e+02 288.061 5.48654e+00  -1.68252e+01 0.00000e+00 0.00000e+00 9.93511e+01 288.061 4.70750e+01 108.061 0.9713 
1 1 1 -8  91  5  o 13 1.16852e+01 6.25018e-01 1.81330e+02 93.415  -2.45347e+00 4.11141e+01  0.00000e+00 0.00000e+00 2.48567e+02 93.415  6.72371e+01 93.415  0.9878 
1 1 1 -8  91  6  o 13 5.12872e+00 9.36319e-01 9.21032e+01 273.918 5.54137e-01  -8.09015e+00 0.00000e+00 0.00000e+00 8.65991e+01 273.918 5.50416e+00 93.918  0.9361 
1 1 1 -8  91  7  o 12 5.80559e+00 1.12679e+00 6.94987e+01 28.802  5.81469e+00  3.19686e+00  0.00000e+00 0.00000e+00 1.29421e+02 28.802  5.99221e+01 28.802  0.9212 
1 1 1 -8  91  8  f 0  3.53449e+00 9.83555e-01 5.10553e+01 288.926 1.06271e+00  -3.09940e+00 0.00000e+00 0.00000e+00 5.77767e+01 288.926 6.72142e+00 288.926 0.8285 
1 1 1 -8  91  9  o 14 7.42571e+00 9.79575e-01 1.00256e+02 36.016  1.21894e+01  8.86147e+00  0.00000e+00 0.00000e+00 1.66172e+02 36.016  6.59163e+01 36.016  0.9662 
1 1 1 -8  91  10 o 14 3.48575e+00 9.30728e-01 6.36335e+01 253.169 -1.50952e+00 -4.99018e+00 0.00000e+00 0.00000e+00 5.25100e+01 253.169 1.11235e+01 73.169  0.8981 
1 1 1 -8  91  11 o 4  2.84186e+00 8.85458e-01 7.79086e+01 31.322  5.18111e+00  3.15293e+00  0.00000e+00 0.00000e+00 1.82957e+01 31.322  5.96129e+01 211.322 0.9134 
1 1 1 -8  91  12 o 9  4.39994e+00 1.12592e+00 5.21190e+01 121.018 -2.74223e+00 4.56058e+00  0.00000e+00 0.00000e+00 9.45572e+01 121.018 4.24382e+01 121.018 0.9003 
1 1 1 -8  92  1  o 2  4.38712e+00 8.34357e-01 5.64551e+01 240.406 -2.22743e+00 -3.92188e+00 0.00000e+00 0.00000e+00 8.76929e+01 240.406 3.12378e+01 240.406 0.8806 
1 1 1 -8  92  2  o 5  7.07701e+00 7.34774e-01 1.14585e+02 177.836 -1.55612e+01 5.88071e-01  0.00000e+00 0.00000e+00 1.40734e+02 177.836 2.61495e+01 177.836 0.9673 
1 1 1 -8  92  3  o 19 8.27421e+00 6.69058e-01 1.07330e+02 3.508   1.68708e+01  1.03429e+00  0.00000e+00 0.00000e+00 1.91845e+02 3.508   8.45144e+01 3.508   0.9700 
1 1 1 -8  92  4  o 1  8.46573e+00 6.89326e-01 1.33577e+02 285.422 5.76652e+00  -2.09043e+01 0.00000e+00 0.00000e+00 1.74475e+02 285.422 4.08979e+01 285.422 0.9767 
1 1 1 -8  92  5  o 11 9.59459e+00 6.88134e-01 1.40442e+02 343.543 2.34494e+01  -6.92667e+00 0.00000e+00 0.00000e+00 2.09433e+02 343.543 6.89917e+01 343.543 0.9793 
1 1 1 -8  92  6  o 8  3.24596e+00 8.79251e-01 6.88124e+01 1.629   4.07845e+00  1.15962e-01  0.00000e+00 0.00000e+00 3.58520e+01 1.629   3.29604e+01 181.629 0.8665 
1 1 1 -8  92  7  o 9  6.60878e+00 1.14423e+00 8.17304e+01 323.286 7.11198e+00  -5.30379e+00 0.00000e+00 0.00000e+00 1.49717e+02 323.286 6.79865e+01 323.286 0.9418 
1 1 1 -8  92  8  o 8  3.04253e+00 9.48757e-01 6.06422e+01 93.565  -2.26379e-01 3.63364e+00  0.00000e+00 0.00000e+00 3.52348e+01 93.565  2.54074e+01 273.565 0.8481 
1 1 1 -8  92  9  o 9  6.68676e+00 1.02717e+00 9.11767e+01 4.178   1.25774e+01  9.18805e-01  0.00000e+00 0.00000e+00 1.47006e+02 4.178   5.58297e+01 4.178   0.9595 
1 1 1 -8  92  10 o 11 1.00498e+01 9.43146e-01 1.67495e+02 129.794 -2.54260e+01 3.05235e+01  0.00000e+00 0.00000e+00 2.00534e+02 129.794 3.30387e+01 129.794 0.9873 
1 1 1 -8  92  11 o 2  8.63656e+00 9.01507e-01 1.49884e+02 332.010 3.01125e+01  -1.60045e+01 0.00000e+00 0.00000e+00 1.65413e+02 332.010 1.55292e+01 332.010 0.9852 
1 1 1 -8  92  12 o 4  3.51563e+00 1.02659e+00 2.89036e+01 63.585  1.18664e+00  2.38890e+00  0.00000e+00 0.00000e+00 7.28687e+01 63.585  4.39651e+01 63.585  0.7820 
1 1 1 -8  93  1  o 15 5.59556e+00 8.80359e-01 1.49248e+02 296.361 6.32515e+00  -1.27635e+01 0.00000e+00 0.00000e+00 5.20089e+01 296.361 9.72391e+01 116.361 0.9642 
1 1 1 -8  93  2  o 13 8.31409e+00 6.81075e-01 1.16799e+02 103.180 -3.87293e+00 1.65385e+01  0.00000e+00 0.00000e+00 1.83931e+02 103.180 6.71320e+01 103.180 0.9701 
1 1 1 -8  93  3  o 11 6.45980e+00 7.73969e-01 7.49997e+01 163.756 -8.54357e+00 2.48933e+00  0.00000e+00 0.00000e+00 1.51786e+02 163.756 7.67860e+01 163.756 0.9420 
1 1 1 -8  93  4  o 13 3.70951e+00 9.38591e-01 6.32816e+01 39.035  3.16623e+00  2.56718e+00  0.00000e+00 0.00000e+00 5.64298e+01 39.035  6.85182e+00 219.035 0.8664 
1 1 1 -8  93  5  o 13 6.89387e+00 8.35302e-01 1.20108e+02 27.784  1.33199e+01  7.01806e+00  0.00000e+00 0.00000e+00 1.27848e+02 27.784  7.74023e+00 27.784  0.9662 
1 1 1 -8  93  6  f 0  6.34696e+00 9.21050e-01 1.37647e+02 15.262  1.59161e+01  4.34295e+00  0.00000e+00 0.00000e+00 9.11975e+01 15.262  4.64495e+01 195.262 0.9692 
1 1 1 -8  93  7  o 9  4.66506e+00 1.06834e+00 3.82529e+01 204.080 -2.81463e+00 -1.25785e+00 0.00000e+00 0.00000e+00 1.03248e+02 204.080 6.49951e+01 204.080 0.8159 
1 1 1 -8  93  8  f 0  4.22816e+00 1.13971e+00 7.14441e+01 80.263  8.76112e-01  5.10569e+00  0.00000e+00 0.00000e+00 6.95001e+01 80.263  1.94399e+00 260.263 0.8974 
1 1 1 -8  93  9  o 11 5.55253e+00 1.14032e+00 7.65666e+01 59.659  4.29206e+00  7.33280e+00  0.00000e+00 0.00000e+00 1.16976e+02 59.659  4.04090e+01 59.659  0.9392 
1 1 1 -8  93  10 o 18 8.13977e+00 1.00254e+00 1.30734e+02 296.520 1.05249e+01  -2.10913e+01 0.00000e+00 0.00000e+00 1.64623e+02 296.520 3.38887e+01 296.520 0.9786 
1 1 1 -8  93  11 o 14 2.41171e+00 8.22325e-01 5.37021e+01 7.480   4.09409e+00  5.37541e-01  0.00000e+00 0.00000e+00 2.38751e+01 7.480   2.98269e+01 187.480 0.8683 
1 1 1 -8  93  12 o 17 2.79411e+00 9.14186e-01 4.79960e+01 337.615 3.55130e+00  -1.46263e+00 0.00000e+00 0.00000e+00 4.06305e+01 337.615 7.36551e+00 157.615 0.8571 
1 1 1 -8  94  1  o 10 6.28055e+00 8.37114e-01 8.56245e+01 57.351  5.15081e+00  8.03905e+00  0.00000e+00 0.00000e+00 1.35961e+02 57.351  5.03363e+01 57.351  0.9461 
1 1 1 -8  94  2  o 18 1.49426e+01 6.01392e-01 2.35242e+02 188.713 -6.83076e+01 -1.04685e+01 0.00000e+00 0.00000e+00 3.17720e+02 188.713 8.24784e+01 188.713 0.9927 
1 1 1 -8  94  3  o 17 4.80633e+00 9.06947e-01 8.09652e+01 34.189  5.69787e+00  3.87072e+00  0.00000e+00 0.00000e+00 8.45493e+01 34.189  3.58417e+00 34.189  0.9243 
1 1 1 -8  94  4  o 14 9.58344e+00 6.70911e-01 1.47567e+02 292.666 1.05982e+01  -2.53784e+01 0.00000e+00 0.00000e+00 2.02758e+02 292.666 5.51909e+01 292.666 0.9816 
1 1 1 -8  94  5  o 4  3.24794e+00 9.01942e-01 5.91154e+01 199.554 -3.25553e+00 -1.15629e+00 0.00000e+00 0.00000e+00 4.22647e+01 199.554 1.68507e+01 19.554  0.8387 
1 1 1 -8  94  6  o 13 2.77103e+00 7.82514e-01 4.73551e+01 302.821 1.48446e+00  -2.30157e+00 0.00000e+00 0.00000e+00 3.39232e+01 302.821 1.34319e+01 122.821 0.7887 
1 1 1 -8  94  7  f 0  3.37213e+00 9.67039e-01 4.52543e+01 291.929 1.11201e+00  -2.76215e+00 0.00000e+00 0.00000e+00 5.60485e+01 291.929 1.07942e+01 291.929 0.8083 
1 1 1 -8  94  8  o 12 3.02196e+00 9.43975e-01 5.67877e+01 112.795 -1.38249e+00 3.28956e+00  0.00000e+00 0.00000e+00 3.79956e+01 112.795 1.87921e+01 292.795 0.8446 
1 1 1 -8  94  9  o 8  6.58795e+00 1.10906e+00 8.09622e+01 25.195  9.79331e+00  4.60738e+00  0.00000e+00 0.00000e+00 1.51901e+02 25.195  7.09385e+01 25.195  0.9526 
1 1 1 -8  94  10 o 5  2.87558e+00 9.16457e-01 2.19610e+01 211.510 -1.47510e+00 -9.04301e-01 0.00000e+00 0.00000e+00 4.71291e+01 211.510 2.51680e+01 211.510 0.6481 
1 1 1 -8  94  11 o 6  2.32084e+00 7.93212e-01 1.76818e+01 64.301  5.88145e-01  1.22213e+00  0.00000e+00 0.00000e+00 3.03277e+01 64.301  1.26459e+01 64.301  0.5585 
1 1 1 -8  94  12 o 15 3.06945e+00 9.62553e-01 4.70908e+01 299.615 2.18414e+00  -3.84249e+00 0.00000e+00 0.00000e+00 5.26092e+01 299.615 5.51841e+00 299.615 0.8779 
1 1 1 -8  95  1  o 12 5.76816e+00 8.79043e-01 7.57005e+01 254.088 -2.15477e+00 -7.55864e+00 0.00000e+00 0.00000e+00 1.25162e+02 254.088 4.94615e+01 254.088 0.9340 
1 1 1 -8  95  2  o 12 1.38167e+01 6.01062e-01 2.36331e+02 175.381 -6.14255e+01 4.96283e+00  0.00000e+00 0.00000e+00 2.74376e+02 175.381 3.80448e+01 175.381 0.9919 
1 1 1 -8  95  3  o 18 5.68673e+00 9.11342e-01 1.05086e+02 32.572  8.60866e+00  5.49955e+00  0.00000e+00 0.00000e+00 9.60880e+01 32.572  8.99755e+00 212.572 0.9497 
1 1 1 -8  95  4  o 12 2.84463e+00 8.46750e-01 9.40148e+01 251.632 -1.56983e+00 -4.72800e+00 0.00000e+00 0.00000e+00 5.51955e-01 251.632 9.34629e+01 71.632  0.8930 
1 1 1 -8  95  5  o 5  9.39390e+00 6.98074e-01 1.85343e+02 20.082  3.50675e+01  1.28206e+01  0.00000e+00 0.00000e+00 1.59461e+02 20.082  2.58813e+01 200.082 0.9865 
1 1 1 -8  95  6  o 13 6.08848e+00 9.18489e-01 1.03157e+02 54.618  6.94757e+00  9.78275e+00  0.00000e+00 0.00000e+00 1.13577e+02 54.618  1.04203e+01 54.618  0.9574 
1 1 1 -8  95  7  o 6  3.55599e+00 9.49252e-01 4.66653e+01 2.823   3.22314e+00  1.58928e-01  0.00000e+00 0.00000e+00 6.23990e+01 2.823   1.57337e+01 2.823   0.8255 
1 1 1 -8  95  8  o 4  3.38888e+00 9.55837e-01 6.32970e+01 75.397  1.21281e+00  4.65501e+00  0.00000e+00 0.00000e+00 4.85285e+01 75.397  1.47685e+01 255.397 0.8888 
1 1 1 -8  95  9  o 10 4.87785e+00 1.20926e+00 7.26230e+01 179.543 -6.68520e+00 5.33712e-02  0.00000e+00 0.00000e+00 9.41799e+01 179.543 2.15569e+01 179.543 0.9218 
1 1 1 -8  95  10 o 8  5.58818e+00 1.15774e+00 1.28603e+02 278.042 2.10831e+00  -1.49219e+01 0.00000e+00 0.00000e+00 7.15110e+01 278.042 5.70921e+01 98.042  0.9662 
1 1 1 -8  95  11 o 16 3.56179e+00 1.07062e+00 1.91430e+01 7.869   1.65222e+00  2.28368e-01  0.00000e+00 0.00000e+00 6.45988e+01 7.869   4.54558e+01 7.869   0.6350 
1 1 1 -8  95  12 o 10 2.54137e+00 8.53140e-01 5.57008e+01 102.228 -1.09640e+00 5.05897e+00  0.00000e+00 0.00000e+00 2.86477e+01 102.228 2.70531e+01 282.228 0.8973 
1 1 1 -8  96  1  o 18 7.26485e+00 7.88960e-01 1.08674e+02 206.068 -1.32611e+01 -6.48734e+00 0.00000e+00 0.00000e+00 1.52766e+02 206.068 4.40927e+01 206.068 0.9655 
1 1 1 -8  96  2  o 6  4.04917e+00 8.68426e-01 7.82461e+01 51.554  3.51580e+00  4.42850e+00  0.00000e+00 0.00000e+00 5.85281e+01 51.554  1.97180e+01 231.554 0.9066 
1 1 1 -8  96  3  o 15 3.60183e+00 9.50856e-01 3.41406e+01 161.004 -2.03394e+00 7.00200e-01  0.00000e+00 0.00000e+00 6.25785e+01 161.004 2.84379e+01 161.004 0.7211 
1 1 1 -8  96  4  o 8  6.32529e+00 8.50233e-01 1.13988e+02 241.495 -6.79834e+00 -1.25186e+01 0.00000e+00 0.00000e+00 1.13015e+02 241.495 9.72219e-01 61.495  0.9642 
1 1 1 -8  96  5  o 7  4.66383e+00 9.39447e-01 7.34444e+01 105.375 -1.80004e+00 6.54631e+00  0.00000e+00 0.00000e+00 8.66954e+01 105.375 1.32510e+01 105.375 0.9231 
1 1 1 -8  96  6  o 17 5.36832e+00 9.93829e-01 6.79573e+01 338.659 6.50627e+00  -2.54211e+00 0.00000e+00 0.00000e+00 1.16703e+02 338.659 4.87462e+01 338.659 0.9254 
1 1 1 -8  96  7  o 14 5.33739e+00 9.53783e-01 7.76281e+01 84.118  8.76221e-01  8.50517e+00  0.00000e+00 0.00000e+00 1.08651e+02 84.118  3.10229e+01 84.118  0.9396 
1 1 1 -8  96  8  o 7  3.11434e+00 9.80255e-01 3.36239e+01 184.936 -2.38233e+00 -2.05754e-01 0.00000e+00 0.00000e+00 5.33753e+01 184.936 1.97514e+01 184.936 0.7526 
1 1 1 -8  96  9  o 11 5.07337e+00 1.26058e+00 1.09304e+02 250.401 -3.32330e+00 -9.33342e+00 0.00000e+00 0.00000e+00 6.90803e+01 250.401 4.02241e+01 70.401  0.9481 
1 1 1 -8  96  10 o 15 2.77279e+00 8.95484e-01 2.09102e+01 108.665 -5.19216e-01 1.53704e+00  0.00000e+00 0.00000e+00 4.32967e+01 108.665 2.23864e+01 108.665 0.6250 
1 1 1 -8  96  11 o 16 3.37782e+00 9.99607e-01 1.32087e+01 96.986  -1.46178e-01 1.19294e+00  0.00000e+00 0.00000e+00 5.09787e+01 96.986  3.77700e+01 96.986  0.5134 
1 1 1 -8  97  1  o 9  8.01628e+00 7.35518e-01 1.26702e+02 53.754  1.19154e+01  1.62529e+01  0.00000e+00 0.00000e+00 1.64497e+02 53.754  3.77949e+01 53.754  0.9749 
1 1 1 -8  97  2  o 1  1.32360e+01 6.04595e-01 2.65367e+02 196.178 -7.29009e+01 -2.11490e+01 0.00000e+00 0.00000e+00 2.24375e+02 196.178 4.09912e+01 16.178  0.9934 
1 1 1 -8  97  3  o 4  4.40885e+00 1.01466e+00 1.05955e+02 248.006 -3.10613e+00 -7.69045e+00 0.00000e+00 0.00000e+00 4.79453e+01 248.006 5.80094e+01 68.006  0.9376 
1 1 1 -8  97  4  o 13 4.18622e+00 9.24356e-01 1.12541e+02 164.240 -8.65030e+00 2.44121e+00  0.00000e+00 0.00000e+00 3.42862e+01 164.240 7.82551e+01 344.240 0.9426 
1 1 1 -8  97  5  f 0  2.85901e+00 8.54595e-01 7.66405e+01 314.202 3.01608e+00  -3.10133e+00 0.00000e+00 0.00000e+00 1.63869e+01 314.202 6.02536e+01 134.202 0.8750 
1 1 1 -8  97  6  o 8  8.76697e+00 7.54479e-01 1.56923e+02 85.502  2.38386e+00  3.03024e+01  0.00000e+00 0.00000e+00 1.63476e+02 85.502  6.55252e+00 85.502  0.9834 
1 1 1 -8  97  7  o 3  8.10525e+00 8.29511e-01 1.17446e+02 307.050 1.38111e+01  -1.82949e+01 0.00000e+00 0.00000e+00 1.76910e+02 307.050 5.94646e+01 307.050 0.9779 
1 1 1 -8  97  8  o 2  3.57379e+00 9.62365e-01 1.10189e+02 231.351 -5.57870e+00 -6.97608e+00 0.00000e+00 0.00000e+00 1.47633e+01 231.351 9.54261e+01 51.351  0.9422 
1 1 1 -8  97  9  o 5  2.82899e+00 9.10233e-01 7.51453e+01 70.874  1.91935e+00  5.53456e+00  0.00000e+00 0.00000e+00 2.03117e+01 70.874  5.48337e+01 250.874 0.9101 
1 1 1 -8  97  10 o 19 2.65096e+00 8.80934e-01 3.09554e+01 139.837 -1.73273e+00 1.46235e+00  0.00000e+00 0.00000e+00 4.14299e+01 139.837 1.04745e+01 139.837 0.7371 
1 1 1 -8  97  11 o 18 4.33915e+00 1.10648e+00 8.04383e+01 335.374 7.92795e+00  -3.63406e+00 0.00000e+00 0.00000e+00 7.06313e+01 335.374 9.80702e+00 155.374 0.9408 
1 1 1 -8  98  1  o 13 1.02185e+01 6.63560e-01 1.49339e+02 327.462 2.83680e+01  -1.80987e+01 0.00000e+00 0.00000e+00 2.25625e+02 327.462 7.62859e+01 327.462 0.9850 
1 1 1 -8  98  2  o 3  4.15855e+00 8.29345e-01 6.73872e+01 156.378 -5.09792e+00 2.22957e+00  0.00000e+00 0.00000e+00 7.27551e+01 156.378 5.36781e+00 156.378 0.9050 
1 1 1 -8  98  3  o 18 4.34862e+00 9.51445e-01 9.02611e+01 236.773 -4.03030e+00 -6.15263e+00 0.00000e+00 0.00000e+00 6.01483e+01 236.773 3.01127e+01 56.773  0.9293 
1 1 1 -8  98  4  o 10 1.01578e+01 6.86983e-01 1.27230e+02 85.846  2.06011e+00  2.83664e+01  0.00000e+00 0.00000e+00 2.43931e+02 85.846  1.16701e+02 85.846  0.9823 
1 1 1 -8  98  5  o 5  4.41728e+00 9.14191e-01 5.52391e+01 53.305  2.94677e+00  3.95412e+00  0.00000e+00 0.00000e+00 9.12091e+01 53.305  3.59700e+01 53.305  0.8918 
1 1 1 -8  98  6  o 6  5.67944e+00 9.67990e-01 7.71472e+01 120.035 -4.47802e+00 7.74514e+00  0.00000e+00 0.00000e+00 1.21692e+02 120.035 4.45447e+01 120.035 0.9423 
1 1 1 -8  98  7  o 17 8.32519e+00 8.13932e-01 9.40600e+01 271.624 5.80788e-01  -2.04886e+01 0.00000e+00 0.00000e+00 2.07385e+02 271.624 1.13325e+02 271.624 0.9753 
1 1 1 -8  98  8  o 10 6.45490e+00 9.35186e-01 1.05393e+02 67.127  6.06020e+00  1.43651e+01  0.00000e+00 0.00000e+00 1.26254e+02 67.127  2.08609e+01 67.127  0.9674 
1 1 1 -8  98  9  o 9  5.74624e+00 1.22849e+00 7.53157e+01 170.543 -8.39947e+00 1.39917e+00  0.00000e+00 0.00000e+00 1.24746e+02 170.543 4.94300e+01 170.543 0.9393 
1 1 1 -8  98  10 o 6  2.47321e+00 8.46786e-01 3.59381e+01 285.224 7.00348e-01  -2.57337e+00 0.00000e+00 0.00000e+00 3.56845e+01 285.224 2.53552e-01 105.224 0.7820 
1 1 1 -8  98  11 o 5  2.81598e+00 9.26237e-01 5.08960e+01 67.377  1.78254e+00  4.27736e+00  0.00000e+00 0.00000e+00 4.12152e+01 67.377  9.68082e+00 247.377 0.8841 
1 1 1 -8  99  1  o 9  5.71414e+00 9.05729e-01 5.46741e+01 336.619 5.53720e+00  -2.39393e+00 0.00000e+00 0.00000e+00 1.39591e+02 336.619 8.49165e+01 336.619 0.9129 
1 1 1 -8  99  2  o 18 6.47082e+00 8.88001e-01 5.44625e+01 24.670  6.57372e+00  3.01941e+00  0.00000e+00 0.00000e+00 1.69096e+02 24.670  1.14634e+02 24.670  0.9281 
1 1 1 -8  99  3  o 18 3.97484e+00 9.43157e-01 7.32240e+01 108.134 -1.69202e+00 5.16633e+00  0.00000e+00 0.00000e+00 6.02724e+01 108.134 1.29516e+01 288.134 0.9026 
1 1 1 -8  99  4  o 9  4.30609e+00 9.27458e-01 7.36812e+01 150.073 -5.51372e+00 3.17395e+00  0.00000e+00 0.00000e+00 7.32705e+01 150.073 4.10713e-01 330.073 0.9176 
1 1 1 -8  99  5  o 9  2.81714e+00 8.56055e-01 6.91042e+01 112.687 -1.57039e+00 3.75647e+00  0.00000e+00 0.00000e+00 2.15933e+01 112.687 4.75109e+01 292.687 0.8662 
1 1 1 -8  99  6  o 15 3.88506e+00 9.79146e-01 9.03225e+01 178.643 -7.53389e+00 1.78400e-01  0.00000e+00 0.00000e+00 4.40325e+01 178.643 4.62899e+01 358.643 0.9311 
1 1 1 -8  99  7  o 14 6.03082e+00 9.61347e-01 7.34442e+01 52.487  6.18312e+00  8.05410e+00  0.00000e+00 0.00000e+00 1.39070e+02 52.487  6.56254e+01 52.487  0.9494 
1 1 1 -8  99  8  o 4  6.63542e+00 9.70861e-01 1.25151e+02 176.940 -1.93640e+01 1.03523e+00  0.00000e+00 0.00000e+00 1.14505e+02 176.940 1.06460e+01 356.940 0.9739 
1 1 1 -8  99  9  o 11 4.28102e+00 1.19041e+00 9.00891e+01 269.412 -8.38999e-02 -8.17975e+00 0.00000e+00 0.00000e+00 5.85091e+01 269.412 3.15799e+01 89.412  0.9367 
1 1 1 -8  99  10 o 19 3.51505e+00 1.09410e+00 8.02113e+01 74.689  1.82688e+00  6.67284e+00  0.00000e+00 0.00000e+00 4.01134e+01 74.689  4.00979e+01 254.689 0.9246 
1 1 1 -8  99  11 o 7  5.73166e+00 1.25490e+00 1.06925e+02 241.969 -6.57447e+00 -1.23486e+01 0.00000e+00 0.00000e+00 9.73471e+01 241.969 9.57768e+00 61.969  0.9636 
1 1 1 -8  100 1  o 1  6.06311e+00 8.81173e-01 4.40612e+01 7.512   5.14872e+00  6.78916e-01  0.00000e+00 0.00000e+00 1.58584e+02 7.512   1.14523e+02 7.512   0.8977 
1 1 1 -8  100 2  o 13 5.54982e+00 8.75247e-01 6.87077e+01 137.444 -5.90085e+00 5.41784e+00  0.00000e+00 0.00000e+00 1.24481e+02 137.444 5.57733e+01 137.444 0.9353 
1 1 1 -8  100 3  o 4  1.42644e+01 6.28245e-01 2.68707e+02 201.322 -8.66199e+01 -3.38102e+01 0.00000e+00 0.00000e+00 2.59055e+02 201.322 9.65174e+00 21.322  0.9946 
1 1 1 -8  100 4  o 12 5.22525e+00 9.56795e-01 7.22719e+01 253.335 -2.09391e+00 -6.99493e+00 0.00000e+00 0.00000e+00 1.08158e+02 253.335 3.58861e+01 253.335 0.9288 
1 1 1 -8  100 5  o 2  3.62141e+00 1.00593e+00 5.20884e+01 8.279   3.70625e+00  5.39307e-01  0.00000e+00 0.00000e+00 6.26867e+01 8.279   1.05983e+01 8.279   0.8530 
1 1 1 -8  100 6  f 0  7.71050e+00 8.70467e-01 1.26997e+02 138.461 -1.83298e+01 1.62392e+01  0.00000e+00 0.00000e+00 1.53406e+02 138.461 2.64087e+01 138.461 0.9794 
1 1 1 -8  100 7  o 3  6.86921e+00 9.31458e-01 1.04538e+02 111.872 -6.37167e+00 1.58721e+01  0.00000e+00 0.00000e+00 1.42782e+02 111.872 3.82442e+01 111.872 0.9703 
1 1 1 -8  100 8  o 10 7.74169e+00 8.80256e-01 1.22556e+02 308.287 1.54654e+01  -1.95918e+01 0.00000e+00 0.00000e+00 1.58672e+02 308.287 3.61165e+01 308.287 0.9798 
1 1 1 -8  100 9  o 12 2.45827e+00 8.18610e-01 2.12425e+01 167.521 -1.48871e+00 3.29472e-01  0.00000e+00 0.00000e+00 3.35977e+01 167.521 1.23552e+01 167.521 0.6022 
1 1 1 -8  100 10 o 10 2.59190e+00 8.80717e-01 2.28624e+01 21.642  1.62841e+00  6.46104e-01  0.00000e+00 0.00000e+00 3.97359e+01 21.642  1.68735e+01 21.642  0.6525 
1 1 1 -8  101 1  o 19 7.64698e+00 7.94699e-01 8.10054e+01 171.794 -1.34359e+01 1.93756e+00  0.00000e+00 0.00000e+00 1.92938e+02 171.794 1.11932e+02 171.794 0.9624 
1 1 1 -8  101 2  o 11 3.74746e+00 9.44909e-01 8.52982e+01 349.259 6.25369e+00  -1.18623e+00 0.00000e+00 0.00000e+00 4.26548e+01 349.259 4.26434e+01 169.259 0.9177 
1 1 1 -8  101 3  f 0  8.40430e+00 7.79659e-01 1.07767e+02 313.968 1.36653e+01  -1.41665e+01 0.00000e+00 0.00000e+00 1.96734e+02 313.968 8.89676e+01 313.968 0.9743 
1 1 1 -8  101 4  o 19 4.47662e+00 9.65749e-01 4.05294e+01 37.579  2.94449e+00  2.26588e+00  0.00000e+00 0.00000e+00 1.01171e+02 37.579  6.06421e+01 37.579  0.8516 
1 1 1 -8  101 5  o 17 6.81136e+00 9.62034e-01 5.52744e+01 290.529 3.05584e+00  -8.16082e+00 0.00000e+00 0.00000e+00 1.82752e+02 290.529 1.27478e+02 290.529 0.9407 
1 1 1 -8  101 6  o 9  7.07644e+00 9.07943e-01 1.32734e+02 101.660 -4.54302e+00 2.20140e+01  0.00000e+00 0.00000e+00 1.24049e+02 101.660 8.68559e+00 281.660 0.9775 
1 1 1 -8  101 7  o 1  7.44805e+00 9.03037e-01 1.44589e+02 352.267 2.63965e+01  -3.58444e+00 0.00000e+00 0.00000e+00 1.26465e+02 352.267 1.81244e+01 172.267 0.9810 
1 1 1 -8  101 8  o 3  8.30643e+00 8.53515e-01 1.50106e+02 182.831 -3.72472e+01 -1.84178e+00 0.00000e+00 0.00000e+00 1.53629e+02 182.831 3.52227e+00 182.831 0.9865 
1 1 1 -8  101 9  o 15 2.48022e+00 8.17159e-01 3.13662e+01 47.886  1.63015e+00  1.80327e+00  0.00000e+00 0.00000e+00 3.81933e+01 47.886  6.82714e+00 47.886  0.7573 
1 1 1 -8  101 10 o 15 3.35648e+00 1.07365e+00 5.78674e+01 222.176 -3.95829e+00 -3.58613e+00 0.00000e+00 0.00000e+00 5.40012e+01 222.176 3.86622e+00 42.176  0.9007 
1 1 1 -8  102 1  o 4  6.85974e+00 8.54643e-01 1.29545e+02 309.962 1.19607e+01  -1.42732e+01 0.00000e+00 0.00000e+00 1.18767e+02 309.962 1.07781e+01 129.962 0.9728 
1 1 1 -8  102 2  f 0  6.06824e+00 8.54261e-01 1.65574e+02 52.651  1.27518e+01  1.67096e+01  0.00000e+00 0.00000e+00 5.47058e+01 52.651  1.10868e+02 232.651 0.9759 
1 1 1 -8  102 3  o 18 4.54208e+00 9.55722e-01 1.48978e+02 110.493 -4.88556e+00 1.30718e+01  0.00000e+00 0.00000e+00 1.37229e+01 110.493 1.35255e+02 290.493 0.9635 
1 1 1 -8  102 4  o 4  4.21997e+00 9.46503e-01 1.07897e+02 203.140 -9.46197e+00 -4.04370e+00 0.00000e+00 0.00000e+00 4.10857e+01 203.140 6.68108e+01 23.140  0.9501 
1 1 1 -8  102 5  o 3  5.07050e+00 1.12565e+00 8.95779e+01 42.156  6.32337e+00  5.72480e+00  0.00000e+00 0.00000e+00 8.73137e+01 42.156  2.26416e+00 222.156 0.9394 
1 1 1 -8  102 6  o 18 1.14003e+01 7.03643e-01 1.79637e+02 145.696 -4.62601e+01 3.15615e+01  0.00000e+00 0.00000e+00 2.39655e+02 145.696 6.00173e+01 145.696 0.9910 
1 1 1 -8  102 7  o 13 4.83059e+00 9.76206e-01 6.26020e+01 90.434  -5.78782e-02 7.63284e+00  0.00000e+00 0.00000e+00 1.04358e+02 90.434  4.17558e+01 90.434  0.9320 
1 1 1 -8  102 8  o 15 2.27165e+00 7.62426e-01 2.79946e+01 56.661  1.17929e+00  1.79265e+00  0.00000e+00 0.00000e+00 3.26411e+01 56.661  4.64643e+00 56.661  0.7203 
1 1 1 -8  102 9  o 14 3.51241e+00 9.79915e-01 5.07382e+01 337.908 4.53729e+00  -1.84166e+00 0.00000e+00 0.00000e+00 6.51256e+01 337.908 1.43874e+01 337.908 0.8909 
1 1 1 -8  102 10 o 7  2.66672e+00 8.72805e-01 5.32447e+01 133.881 -3.42238e+00 3.55877e+00  0.00000e+00 0.00000e+00 3.47394e+01 133.881 1.85054e+01 313.881 0.8919 
1 1 1 -8  103 1  o 6  4.80768e+00 9.79811e-01 7.91995e+01 101.631 -1.55477e+00 7.55381e+00  0.00000e+00 0.00000e+00 8.76178e+01 101.631 8.41832e+00 101.631 0.9327 
1 1 1 -8  103 2  o 5  3.42674e+00 9.28048e-01 8.03276e+01 218.510 -4.82094e+00 -3.83611e+00 0.00000e+00 0.00000e+00 3.62406e+01 218.510 4.40870e+01 38.510  0.9148 
1 1 1 -8  103 3  o 10 8.42816e+00 7.67327e-01 1.38712e+02 209.708 -2.63354e+01 -1.50265e+01 0.00000e+00 0.00000e+00 1.69337e+02 209.708 3.06250e+01 209.708 0.9834 
1 1 1 -8  103 4  o 16 5.25177e+00 9.34053e-01 4.79666e+01 30.332  5.15816e+00  3.01806e+00  0.00000e+00 0.00000e+00 1.29957e+02 30.332  8.19902e+01 30.332  0.9120 
1 1 1 -8  103 5  o 5  3.88797e+00 9.89859e-01 8.72195e+01 208.392 -6.60750e+00 -3.57151e+00 0.00000e+00 0.00000e+00 4.71410e+01 208.392 4.00785e+01 28.392  0.9308 
1 1 1 -8  103 6  f 0  3.56488e+00 9.36090e-01 7.69720e+01 21.727  6.13022e+00  2.44282e+00  0.00000e+00 0.00000e+00 4.48104e+01 21.727  3.21616e+01 201.727 0.9208 
1 1 1 -8  103 7  o 4  7.43855e+00 8.84680e-01 1.00861e+02 294.569 8.34099e+00  -1.82448e+01 0.00000e+00 0.00000e+00 1.67959e+02 294.569 6.70979e+01 294.569 0.9747 
1 1 1 -8  103 8  o 5  6.39994e+00 9.95072e-01 1.37251e+02 103.092 -5.18987e+00 2.23166e+01  0.00000e+00 0.00000e+00 9.46080e+01 103.092 4.26430e+01 283.092 0.9779 
1 1 1 -8  103 9  o 18 2.51921e+00 7.73679e-01 2.13837e+01 98.184  -2.69614e-01 1.87468e+00  0.00000e+00 0.00000e+00 4.19848e+01 98.184  2.06012e+01 98.184  0.6796 
1 1 1 -8  104 1  o 15 3.23095e+00 8.80578e-01 5.40021e+01 275.209 3.76823e-01  -4.13312e+00 0.00000e+00 0.00000e+00 5.04254e+01 275.209 3.57671e+00 95.209  0.8691 
1 1 1 -8  104 2  o 18 4.28317e+00 9.72811e-01 8.37475e+01 8.161   8.13765e+00  1.16698e+00  0.00000e+00 0.00000e+00 6.54563e+01 8.161   1.82913e+01 188.161 0.9370 
1 1 1 -8  104 3  o 19 5.35205e+00 9.66330e-01 1.15552e+02 334.167 1.18371e+01  -5.73080e+00 0.00000e+00 0.00000e+00 7.56000e+01 334.167 3.99525e+01 154.167 0.9612 
1 1 1 -8  104 4  o 4  6.92099e+00 8.79007e-01 1.16179e+02 81.806  2.77797e+00  1.92922e+01  0.00000e+00 0.00000e+00 1.34168e+02 81.806  1.79886e+01 81.806  0.9740 
1 1 1 -8  104 5  o 7  6.53383e+00 9.12121e-01 1.11339e+02 249.210 -6.16420e+00 -1.62357e+01 0.00000e+00 0.00000e+00 1.24078e+02 249.210 1.27393e+01 249.210 0.9708 
1 1 1 -8  104 6  o 14 3.54753e+00 9.61796e-01 7.11438e+01 86.882  3.50852e-01  6.44121e+00  0.00000e+00 0.00000e+00 4.97584e+01 86.882  2.13854e+01 266.882 0.9188 
1 1 1 -8  104 7  o 12 4.54745e+00 9.23880e-01 8.95655e+01 232.008 -7.23285e+00 -9.26034e+00 0.00000e+00 0.00000e+00 7.16430e+01 232.008 1.79224e+01 52.008  0.9565 
1 1 1 -8  104 8  o 1  6.61965e+00 9.98457e-01 1.05583e+02 59.385  1.00081e+01  1.69127e+01  0.00000e+00 0.00000e+00 1.33258e+02 59.385  2.76747e+01 59.385  0.9742 
1 1 1 -8  104 9  o 6  3.32292e+00 9.79892e-01 4.44254e+01 82.336  5.99727e-01  4.45660e+00  0.00000e+00 0.00000e+00 6.38104e+01 82.336  1.93850e+01 82.336  0.8802 
1 1 1 -8  105 1  f 0  4.06823e+00 9.97389e-01 1.13864e+02 256.554 -2.23566e+00 -9.35100e+00 0.00000e+00 0.00000e+00 2.92963e+01 256.554 8.45677e+01 76.554  0.9465 
1 1 1 -8  105 2  o 15 4.51771e+00 8.24586e-01 9.67874e+01 38.856  8.72036e+00  7.02536e+00  0.00000e+00 0.00000e+00 6.34300e+01 38.856  3.33574e+01 218.856 0.9542 
1 1 1 -8  105 3  o 3  9.65398e+00 7.25693e-01 1.52541e+02 57.496  2.15602e+01  3.38370e+01  0.00000e+00 0.00000e+00 2.01577e+02 57.496  4.90364e+01 57.496  0.9875 
1 1 1 -8  105 4  o 5  4.83467e+00 9.99583e-01 7.51463e+01 216.525 -6.34985e+00 -4.70293e+00 0.00000e+00 0.00000e+00 9.25749e+01 216.525 1.74286e+01 216.525 0.9344 
1 1 1 -8  105 5  o 10 3.97679e+00 9.46475e-01 4.73582e+01 165.224 -4.85328e+00 1.28013e+00  0.00000e+00 0.00000e+00 8.45335e+01 165.224 3.71754e+01 165.224 0.8938 
1 1 1 -8  105 6  f 0  2.88718e+00 8.88960e-01 5.32396e+01 12.226  4.34427e+00  9.41348e-01  0.00000e+00 0.00000e+00 4.08315e+01 12.226  1.24081e+01 192.226 0.8787 
1 1 1 -8  105 7  o 15 6.48636e+00 9.72885e-01 9.04613e+01 235.505 -9.18990e+00 -1.33739e+01 0.00000e+00 0.00000e+00 1.42355e+02 235.505 5.18938e+01 235.505 0.9687 
1 1 1 -8  105 8  o 1  3.84995e+00 1.02696e+00 5.89579e+01 34.101  4.82550e+00  3.26717e+00  0.00000e+00 0.00000e+00 7.06989e+01 34.101  1.17411e+01 34.101  0.9096 
1 1 1 -8  105 9  o 8  2.39671e+00 7.95126e-01 2.76877e+01 327.248 2.04439e+00  -1.31510e+00 0.00000e+00 0.00000e+00 3.94533e+01 327.248 1.17655e+01 327.248 0.7573 
1 1 1 -8  106 1  o 12 4.76740e+00 9.25433e-01 2.30416e+01 252.947 -7.51749e-01 -2.45079e+00 0.00000e+00 0.00000e+00 1.13709e+02 252.947 9.06678e+01 252.947 0.7717 
1 1 1 -8  106 2  o 4  6.82191e+00 9.08089e-01 1.63490e+02 4.814   2.70029e+01  2.27430e+00  0.00000e+00 0.00000e+00 8.52484e+01 4.814   7.82421e+01 184.814 0.9814 
1 1 1 -8  106 3  o 3  3.23497e+00 9.27026e-01 6.28686e+01 196.825 -4.59400e+00 -1.38921e+00 0.00000e+00 0.00000e+00 4.38727e+01 196.825 1.89959e+01 16.825  0.8885 
1 1 1 -8  106 4  o 13 3.82334e+00 9.69020e-01 6.99279e+01 233.453 -4.15695e+00 -5.60819e+00 0.00000e+00 0.00000e+00 6.13822e+01 233.453 8.54567e+00 53.453  0.9253 
1 1 1 -8  106 5  o 1  3.25566e+00 9.18780e-01 1.97437e+01 113.636 -6.69518e-01 1.52988e+00  0.00000e+00 0.00000e+00 5.69942e+01 113.636 3.72505e+01 113.636 0.6354 
1 1 1 -8  106 6  o 1  4.79450e+00 1.00104e+00 8.17490e+01 132.151 -7.02503e+00 7.76082e+00  0.00000e+00 0.00000e+00 8.72666e+01 132.151 5.51761e+00 132.151 0.9510 
1 1 1 -8  106 7  o 13 3.30317e+00 9.54477e-01 3.45000e+01 340.316 3.15950e+00  -1.13024e+00 0.00000e+00 0.00000e+00 6.74485e+01 340.316 3.29485e+01 340.316 0.8332 
1 1 1 -8  106 8  o 4  4.91392e+00 1.05968e+00 5.50899e+01 55.740  4.19359e+00  6.15682e+00  0.00000e+00 0.00000e+00 1.14105e+02 55.740  5.90148e+01 55.740  0.9302 
1 1 1 -8  106 9  o 16 2.43487e+00 8.07546e-01 4.60612e+01 147.218 -3.72127e+00 2.39650e+00  0.00000e+00 0.00000e+00 3.30123e+01 147.218 1.30489e+01 327.218 0.8781 
1 1 1 -8  107 1  o 9  5.34690e+00 8.74938e-01 8.66396e+01 139.092 -8.61205e+00 7.46198e+00  0.00000e+00 0.00000e+00 1.03114e+02 139.092 1.64741e+01 139.092 0.9551 
1 1 1 -8  107 2  o 5  9.27471e+00 7.71930e-01 1.69135e+02 260.997 -6.75695e+00 -4.26452e+01 0.00000e+00 0.00000e+00 1.71342e+02 260.997 2.20706e+00 260.997 0.9884 
1 1 1 -8  107 3  o 13 4.41971e+00 8.90329e-01 4.98859e+01 189.628 -6.10648e+00 -1.03596e+00 0.00000e+00 0.00000e+00 1.00294e+02 189.628 5.04084e+01 189.628 0.9153 
1 1 1 -8  107 4  o 12 4.62377e+00 1.00763e+00 1.04812e+02 96.272  -1.24516e+00 1.13298e+01  0.00000e+00 0.00000e+00 5.90466e+01 96.272  4.57654e+01 276.272 0.9551 
1 1 1 -8  107 5  f 0  4.22720e+00 9.81252e-01 7.04837e+01 5.271   7.65891e+00  7.06568e-01  0.00000e+00 0.00000e+00 7.56972e+01 5.271   5.21350e+00 5.271   0.9325 
1 1 1 -8  107 6  o 9  5.92800e+00 1.00907e+00 1.23545e+02 22.480  1.74090e+01  7.20396e+00  0.00000e+00 0.00000e+00 9.02281e+01 22.480  3.33167e+01 202.480 0.9731 
1 1 1 -8  107 7  o 10 2.80900e+00 8.76222e-01 4.08924e+01 259.319 -6.96364e-01 -3.69209e+00 0.00000e+00 0.00000e+00 4.78907e+01 259.319 6.99831e+00 259.319 0.8535 
1 1 1 -8  107 8  o 13 2.07007e+00 7.06684e-01 2.07200e+01 323.865 1.45005e+00  -1.05875e+00 0.00000e+00 0.00000e+00 2.99240e+01 323.865 9.20405e+00 323.865 0.6612 
1 1 1 -8  108 1  o 9  3.72179e+00 9.42475e-01 7.12217e+01 12.311  6.92681e+00  1.51163e+00  0.00000e+00 0.00000e+00 5.68745e+01 12.311  1.43472e+01 192.311 0.9265 
1 1 1 -8  108 2  o 13 3.09986e+00 9.11630e-01 3.80315e+01 34.625  2.59704e+00  1.79327e+00  0.00000e+00 0.00000e+00 5.64563e+01 34.625  1.84248e+01 34.625  0.8209 
1 1 1 -8  108 3  o 1  5.21495e+00 9.71883e-01 1.06595e+02 241.555 -6.56299e+00 -1.21153e+01 0.00000e+00 0.00000e+00 7.97936e+01 241.555 2.68011e+01 61.555  0.9630 
1 1 1 -8  108 4  o 10 3.20694e+00 8.92801e-01 6.96631e+01 56.084  3.49786e+00  5.20229e+00  0.00000e+00 0.00000e+00 3.93452e+01 56.084  3.03179e+01 236.084 0.9163 
1 1 1 -8  108 5  o 18 2.84153e+00 8.63534e-01 2.88544e+01 282.719 5.57087e-01  -2.46813e+00 0.00000e+00 0.00000e+00 5.20743e+01 282.719 2.32199e+01 282.719 0.7682 
1 1 1 -8  108 6  o 18 2.84656e+00 8.71141e-01 5.87647e+01 58.518  2.67804e+00  4.37319e+00  0.00000e+00 0.00000e+00 3.57550e+01 58.518  2.30097e+01 238.518 0.8963 
1 1 1 -8  108 7  o 8  3.57332e+00 9.83929e-01 7.05818e+01 237.089 -4.09439e+00 -6.32636e+00 0.00000e+00 0.00000e+00 5.25880e+01 237.089 1.79938e+01 57.089  0.9311 
1 1 1 -8  108 8  o 13 2.46690e+00 8.04180e-01 4.56536e+01 75.526  1.07060e+00  4.14744e+00  0.00000e+00 0.00000e+00 3.40678e+01 75.526  1.15859e+01 255.526 0.8736 
1 1 1 -8  109 1  o 8  8.24805e+00 7.92321e-01 1.27684e+02 20.135  2.86757e+01  1.05137e+01  0.00000e+00 0.00000e+00 1.73562e+02 20.135  4.58784e+01 20.135  0.9835 
1 1 1 -8  109 2  o 9  4.55542e+00 1.03488e+00 5.15655e+01 200.818 -5.52040e+00 -2.09899e+00 0.00000e+00 0.00000e+00 1.02464e+02 200.818 5.08989e+01 200.818 0.9109 
1 1 1 -8  109 3  o 16 3.14485e+00 9.26097e-01 6.71262e+01 115.565 -2.47682e+00 5.17755e+00  0.00000e+00 0.00000e+00 3.88363e+01 115.565 2.82898e+01 295.565 0.9081 
1 1 1 -8  109 4  o 3  3.20269e+00 9.30763e-01 3.14317e+01 306.320 1.57435e+00  -2.14164e+00 0.00000e+00 0.00000e+00 6.13428e+01 306.320 2.99111e+01 306.320 0.7811 
1 1 1 -8  109 5  o 14 2.33247e+00 7.72676e-01 6.42306e+01 139.794 -3.72475e+00 3.14834e+00  0.00000e+00 0.00000e+00 1.27438e+01 139.794 5.14868e+01 319.794 0.8905 
1 1 1 -8  109 6  o 12 2.16353e+00 7.27434e-01 2.71073e+01 288.054 6.21404e-01  -1.90640e+00 0.00000e+00 0.00000e+00 2.88728e+01 288.054 1.76549e+00 288.054 0.6986 
1 1 1 -8  109 7  o 2  3.24472e+00 9.26390e-01 5.72898e+01 290.937 2.17625e+00  -5.68799e+00 0.00000e+00 0.00000e+00 5.24391e+01 290.937 4.85074e+00 110.937 0.9137 
1 1 1 -8  109 8  o 11 3.76898e+00 9.80119e-01 5.03768e+01 226.061 -4.30227e+00 -4.46462e+00 0.00000e+00 0.00000e+00 7.72082e+01 226.061 2.68314e+01 226.061 0.9154 
1 1 1 -8  110 1  o 13 5.61182e+00 9.57011e-01 9.66550e+01 141.472 -1.18538e+01 9.43844e+00  0.00000e+00 0.00000e+00 1.04688e+02 141.472 8.03349e+00 141.472 0.9664 
1 1 1 -8  110 2  o 8  7.52579e+00 8.70238e-01 1.07390e+02 273.836 1.64374e+00  -2.45153e+01 0.00000e+00 0.00000e+00 1.66147e+02 273.836 5.87568e+01 273.836 0.9794 
1 1 1 -8  110 3  o 16 6.29099e+00 9.33845e-01 6.36265e+01 109.528 -3.85096e+00 1.08576e+01  0.00000e+00 0.00000e+00 1.59351e+02 109.528 9.57241e+01 109.528 0.9556 
1 1 1 -8  110 4  o 7  2.49367e+00 8.25205e-01 6.76427e+01 28.834  4.58200e+00  2.52252e+00  0.00000e+00 0.00000e+00 1.54171e+01 28.834  5.22257e+01 208.834 0.8985 
1 1 1 -8  110 5  o 12 2.22548e+00 7.41960e-01 3.14247e+01 235.987 -1.47487e+00 -2.18550e+00 0.00000e+00 0.00000e+00 3.28134e+01 235.987 1.38868e+00 235.987 0.7791 
1 1 1 -8  110 6  o 4  3.60023e+00 9.40385e-01 5.10168e+01 350.161 5.76256e+00  -9.99379e-01 0.00000e+00 0.00000e+00 7.02795e+01 350.161 1.92627e+01 350.161 0.9099 
1 1 1 -8  110 7  o 5  4.26667e+00 1.05647e+00 5.65080e+01 100.951 -1.30961e+00 6.76816e+00  0.00000e+00 0.00000e+00 8.94090e+01 100.951 3.29010e+01 100.951 0.9243 
1 1 1 -8  110 8  f 0  2.09024e+00 7.16271e-01 2.14468e+01 213.454 -1.67428e+00 -1.10624e+00 0.00000e+00 0.00000e+00 3.25600e+01 213.454 1.11133e+01 213.454 0.6989 
1 1 1 -8  111 1  o 12 3.41892e+00 9.58281e-01 5.37455e+01 202.867 -4.75262e+00 -2.00436e+00 0.00000e+00 0.00000e+00 6.00647e+01 202.867 6.31919e+00 202.867 0.8969 
1 1 1 -8  111 2  o 12 4.86301e+00 1.02167e+00 9.74203e+01 26.162  1.08079e+01  5.30931e+00  0.00000e+00 0.00000e+00 7.53287e+01 26.162  2.20916e+01 206.162 0.9575 
1 1 1 -8  111 3  f 0  2.25610e+00 7.29095e-01 5.52230e+01 335.202 3.83362e+00  -1.77125e+00 0.00000e+00 0.00000e+00 1.76922e+01 335.202 3.75308e+01 155.202 0.8716 
1 1 1 -8  111 4  f 0  3.07266e+00 8.98605e-01 3.12516e+01 121.015 -1.58235e+00 2.63192e+00  0.00000e+00 0.00000e+00 6.15686e+01 121.015 3.03170e+01 121.015 0.8151 
1 1 1 -8  111 5  o 4  2.13982e+00 7.24052e-01 3.35893e+01 46.222  1.97078e+00  2.05666e+00  0.00000e+00 0.00000e+00 2.96676e+01 46.222  3.92164e+00 226.222 0.7981 
1 1 1 -8  111 6  o 1  2.90872e+00 8.76708e-01 3.69993e+01 12.278  3.63896e+00  7.91972e-01  0.00000e+00 0.00000e+00 5.47321e+01 12.278  1.77328e+01 12.278  0.8520 
1 1 1 -8  111 7  o 2  2.75161e+00 8.39560e-01 5.77116e+01 205.707 -5.52584e+00 -2.66023e+00 0.00000e+00 0.00000e+00 3.53504e+01 205.707 2.23612e+01 25.707  0.9144 
1 1 1 -8  112 1  o 14 3.19027e+00 9.13877e-01 6.81040e+01 78.244  1.35995e+00  6.53473e+00  0.00000e+00 0.00000e+00 4.09963e+01 78.244  2.71077e+01 258.244 0.9217 
1 1 1 -8  112 2  o 17 2.21738e+00 7.29700e-01 3.33637e+01 213.877 -2.16117e+00 -1.45097e+00 0.00000e+00 0.00000e+00 3.04321e+01 213.877 2.93154e+00 33.877  0.7758 
1 1 1 -8  112 3  o 13 5.12137e+00 1.02008e+00 9.72190e+01 296.269 6.18853e+00  -1.25385e+01 0.00000e+00 0.00000e+00 8.57085e+01 296.269 1.15105e+01 116.269 0.9636 
1 1 1 -8  112 4  o 7  2.58958e+00 8.30892e-01 4.05156e+01 109.240 -1.14604e+00 3.28354e+00  0.00000e+00 0.00000e+00 4.00705e+01 109.240 4.45040e-01 289.240 0.8399 
1 1 1 -8  112 5  o 14 3.70548e+00 9.90986e-01 8.34352e+01 218.449 -7.55536e+00 -5.99877e+00 0.00000e+00 0.00000e+00 4.64515e+01 218.449 3.69836e+01 38.449  0.9467 
1 1 1 -8  112 6  o 2  2.15616e+00 7.33721e-01 1.24980e+01 3.911   1.15753e+00  7.91293e-02  0.00000e+00 0.00000e+00 2.74176e+01 3.911   1.49196e+01 3.911   0.5003 
1 1 1 -8  112 7  o 7  1.91729e+00 6.61909e-01 6.51746e+01 47.439  4.03339e+00  4.39231e+00  0.00000e+00 0.00000e+00 5.33788e-01 227.439 6.57084e+01 227.439 0.9118 
1 1 1 -8  113 1  o 7  2.24097e+00 7.36144e-01 5.30507e+01 170.379 -3.98212e+00 6.75032e-01  0.00000e+00 0.00000e+00 1.88485e+01 170.379 3.42021e+01 350.379 0.8650 
1 1 1 -8  113 2  o 7  3.43851e+00 9.13120e-01 5.06706e+01 339.780 4.68516e+00  -1.72566e+00 0.00000e+00 0.00000e+00 6.32017e+01 339.780 1.25311e+01 339.780 0.8932 
1 1 1 -8  113 3  o 13 2.01148e+00 6.86309e-01 5.11234e+01 184.885 -4.22538e+00 -3.61127e-01 0.00000e+00 0.00000e+00 1.38905e+01 184.885 3.72329e+01 4.885   0.8722 
1 1 1 -8  113 4  o 18 2.33084e+00 7.84762e-01 5.47084e+01 258.764 -9.83781e-01 -4.95227e+00 0.00000e+00 0.00000e+00 2.25149e+01 258.764 3.21935e+01 78.764  0.8945 
1 1 1 -8  113 5  o 2  3.09668e+00 8.68609e-01 5.89397e+01 74.478  1.72761e+00  6.22012e+00  0.00000e+00 0.00000e+00 4.63916e+01 74.478  1.25480e+01 254.478 0.9189 
1 1 1 -8  113 6  f 0  3.39747e+00 9.64766e-01 6.28239e+01 150.218 -5.89273e+00 3.37240e+00  0.00000e+00 0.00000e+00 5.31903e+01 150.218 9.63362e+00 330.218 0.9231 
1 1 1 -8  114 1  o 10 2.21329e+00 7.35768e-01 4.51442e+01 20.917  3.65003e+00  1.39502e+00  0.00000e+00 0.00000e+00 2.54237e+01 20.917  1.97205e+01 200.917 0.8599 
1 1 1 -8  114 2  o 1  4.55677e+00 1.00218e+00 6.38389e+01 358.640 8.64446e+00  -2.05222e-01 0.00000e+00 0.00000e+00 9.49652e+01 358.640 3.11264e+01 358.640 0.9403 
1 1 1 -8  114 3  o 2  5.57678e+00 1.03588e+00 8.65558e+01 205.337 -1.29298e+01 -6.12217e+00 0.00000e+00 0.00000e+00 1.12688e+02 205.337 2.61326e+01 205.337 0.9644 
1 1 1 -8  114 4  o 3  5.91478e+00 9.38422e-01 1.09710e+02 45.691  1.48147e+01  1.51766e+01  0.00000e+00 0.00000e+00 1.04068e+02 45.691  5.64255e+00 225.691 0.9761 
1 1 1 -8  114 5  o 4  3.27371e+00 9.25863e-01 5.81236e+01 201.638 -6.16166e+00 -2.44432e+00 0.00000e+00 0.00000e+00 5.34655e+01 201.638 4.65806e+00 21.638  0.9211 
1 1 1 -8  114 6  o 10 3.38391e+00 1.00154e+00 6.91882e+01 84.385  7.70603e-01  7.83831e+00  0.00000e+00 0.00000e+00 4.77126e+01 84.385  2.14756e+01 264.385 0.9342 
1 1 1 -8  115 1  o 3  2.73776e+00 8.33571e-01 3.76677e+01 223.834 -2.70366e+00 -2.59584e+00 0.00000e+00 0.00000e+00 4.89060e+01 223.834 1.12383e+01 223.834 0.8531 
1 1 1 -8  115 2  o 15 2.45103e+00 7.78868e-01 1.51256e+01 100.503 -2.51968e-01 1.35913e+00  0.00000e+00 0.00000e+00 3.62460e+01 100.503 2.11204e+01 100.503 0.5657 
1 1 1 -8  115 3  o 19 3.46507e+00 9.33106e-01 3.04409e+01 0.066   3.46591e+00  4.00466e-03  0.00000e+00 0.00000e+00 7.72660e+01 0.066   4.68250e+01 0.066   0.8393 
1 1 1 -8  115 4  o 2  8.43775e+00 8.71103e-01 1.29706e+02 93.403  -2.39584e+00 4.02892e+01  0.00000e+00 0.00000e+00 1.78725e+02 93.403  4.90183e+01 93.403  0.9875 
1 1 1 -8  115 5  o 16 3.03897e+00 9.00719e-01 4.30750e+01 207.233 -4.17911e+00 -2.15082e+00 0.00000e+00 0.00000e+00 5.65219e+01 207.233 1.34469e+01 207.233 0.8859 
1 1 1 -8  116 1  o 12 2.18276e+00 7.28170e-01 2.11378e+01 235.174 -1.14259e+00 -1.64242e+00 0.00000e+00 0.00000e+00 3.53118e+01 235.174 1.41740e+01 235.174 0.6979 
1 1 1 -8  116 2  o 10 2.50918e+00 8.04522e-01 4.06189e+01 314.075 2.80702e+00  -2.89911e+00 0.00000e+00 0.00000e+00 3.97640e+01 314.075 8.54968e-01 134.075 0.8649 
1 1 1 -8  116 3  o 14 2.14177e+00 7.13968e-01 5.35408e+01 108.540 -1.63620e+00 4.87874e+00  0.00000e+00 0.00000e+00 1.75599e+01 108.540 3.59809e+01 288.540 0.8967 
1 1 1 -8  116 4  o 7  4.14137e+00 9.31595e-01 4.94522e+01 203.509 -6.50023e+00 -2.82755e+00 0.00000e+00 0.00000e+00 9.25306e+01 203.509 4.30784e+01 203.509 0.9265 
1 1 1 -8  116 5  o 9  3.46242e+00 9.45873e-01 6.77621e+01 323.313 6.98088e+00  -5.20082e+00 0.00000e+00 0.00000e+00 5.26869e+01 323.313 1.50752e+01 143.314 0.9407 
1 1 1 -8  117 1  o 12 2.42418e+00 7.80593e-01 2.08485e+01 145.793 -1.73079e+00 1.17654e+00  0.00000e+00 0.00000e+00 4.31304e+01 145.793 2.22819e+01 145.793 0.7124 
1 1 1 -8  117 2  o 7  2.88420e+00 8.76095e-01 5.73622e+01 54.009  3.41857e+00  4.70677e+00  0.00000e+00 0.00000e+00 3.97634e+01 54.009  1.75989e+01 234.009 0.9094 
1 1 1 -8  117 3  o 15 3.46876e+00 9.73348e-01 5.27523e+01 130.181 -4.11595e+00 4.87387e+00  0.00000e+00 0.00000e+00 6.50883e+01 130.181 1.23360e+01 130.181 0.9179 
1 1 1 -8  117 4  o 3  2.75081e+00 8.71325e-01 9.21830e+01 345.155 1.00285e+01  -2.65803e+00 0.00000e+00 0.00000e+00 4.53815e+00 345.155 8.76448e+01 165.155 0.9505 
1 1 1 -8  118 1  o 13 3.79188e+00 9.85089e-01 5.68347e+01 58.157  3.90327e+00  6.28490e+00  0.00000e+00 0.00000e+00 7.37204e+01 58.157  1.68857e+01 58.157  0.9297 
1 1 1 -8  118 2  o 16 2.68692e+00 8.24776e-01 2.56851e+01 155.056 -2.48957e+00 1.15794e+00  0.00000e+00 0.00000e+00 5.28175e+01 155.056 2.71324e+01 155.056 0.7893 
1 1 1 -8  118 3  o 8  2.38088e+00 7.80859e-01 2.70383e+01 289.320 9.81743e-01  -2.80031e+00 0.00000e+00 0.00000e+00 4.40998e+01 289.320 1.70615e+01 289.320 0.8075 
1 1 1 -8  118 4  o 1  2.20475e+00 7.37313e-01 4.16808e+01 44.357  2.87926e+00  2.81531e+00  0.00000e+00 0.00000e+00 2.88069e+01 44.357  1.28739e+01 224.357 0.8645 
1 1 1 -7  0   1  o 3  2.04411e+01 7.49448e-01 3.69830e+02 0.000   3.61280e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.99767e+02 0.000   2.99364e+01 0.000   0.9985 
1 1 1 -7  0   2  o 19 4.21482e+01 1.21583e+00 7.75017e+02 0.000   1.47345e+01  0.00000e+00  0.00000e+00 0.00000e+00 8.13558e+02 0.000   3.85410e+01 0.000   1.0000 
1 1 1 -7  0   3  o 10 1.16412e+01 7.14879e-01 1.04844e+02 0.000   6.45792e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.44626e+02 0.000   3.97824e+01 0.000   0.5688 
1 1 1 -7  0   4  o 14 1.48207e+01 6.96264e-01 5.04739e+02 180.000 -4.16583e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.30664e+01 180.000 4.51673e+02 0.000   0.9995 
1 1 1 -7  0   6  o 3  9.52629e+00 8.15717e-01 2.09548e+02 0.000   1.31512e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.00577e+02 0.000   1.08971e+02 180.000 0.8656 
1 1 1 -7  0   9  o 16 2.49263e+01 9.04438e-01 3.90993e+02 0.000   1.32922e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.44429e+02 0.000   1.53436e+02 0.000   1.0000 
1 1 1 -7  0   10 o 3  6.48200e+01 1.48352e+00 9.85090e+02 180.000 -1.00361e+02 0.00000e+00  0.00000e+00 0.00000e+00 1.44534e+03 180.000 4.60250e+02 180.000 1.0000 
1 1 1 -7  0   11 o 12 1.60512e+01 7.03178e-01 1.88903e+02 0.000   6.99343e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.12382e+02 0.000   2.23479e+02 0.000   1.0000 
1 1 1 -7  0   12 o 4  3.14500e+01 8.44492e-01 5.90156e+02 180.000 -5.78493e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.86815e+02 180.000 3.34155e+00 0.000   1.0000 
1 1 1 -7  0   13 o 4  7.80149e+00 8.07206e-01 6.12928e+01 180.000 -2.06259e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.21085e+02 180.000 1.59792e+02 180.000 0.9682 
1 1 1 -7  0   14 o 8  2.60676e+00 1.36959e+00 1.14788e+02 0.000   1.41551e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.82816e+01 180.000 1.43069e+02 180.000 0.8887 
1 1 1 -7  0   15 o 4  6.65072e+00 1.06747e+00 1.05498e+02 180.000 -4.54631e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.42515e+02 180.000 3.70170e+01 180.000 0.9998 
1 1 1 -7  0   16 o 12 8.43596e+00 1.24870e+00 1.05473e+02 0.000   6.39944e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.08795e+02 0.000   1.03322e+02 0.000   1.0000 
1 1 1 -7  0   17 o 18 1.52991e+01 1.17985e+00 1.18827e+02 0.000   1.50600e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.50383e+02 0.000   3.31556e+02 0.000   1.0000 
1 1 1 -7  0   18 o 13 1.68532e+01 1.33577e+00 2.20092e+02 0.000   3.16295e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.06097e+02 0.000   1.86005e+02 0.000   1.0000 
1 1 1 -7  0   19 o 7  6.39178e+00 2.75847e+00 5.26455e+01 180.000 -1.59652e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.65807e+02 180.000 1.13162e+02 180.000 0.9211 
1 1 1 -7  0   20 o 17 3.75412e+00 2.43073e+00 2.30267e+01 180.000 -5.71477e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.88021e+01 180.000 2.57754e+01 180.000 0.5164 
1 1 1 -7  1   1  o 1  3.71650e+01 7.75989e-01 6.62326e+02 282.726 5.15176e+00  -2.28118e+01 0.00000e+00 0.00000e+00 7.08658e+02 282.726 4.63319e+01 282.726 0.9784 
1 1 1 -7  1   2  o 18 2.62719e+01 6.02419e-01 3.53121e+02 264.433 -8.16904e-01 -8.38158e+00 0.00000e+00 0.00000e+00 5.76276e+02 264.433 2.23155e+02 264.433 0.9386 
1 1 1 -7  1   3  o 7  9.04147e+00 5.27990e-01 1.21958e+02 308.737 7.29714e-01  -9.09621e-01 0.00000e+00 0.00000e+00 4.90939e+01 308.737 7.28644e+01 128.737 0.5022 
1 1 1 -7  1   4  o 6  1.45522e+01 5.04609e-01 1.58395e+02 318.082 1.90951e+00  -1.71440e+00 0.00000e+00 0.00000e+00 2.64640e+02 318.082 1.06245e+02 318.082 0.7720 
1 1 1 -7  1   5  o 4  3.40689e+01 7.28630e-01 6.21006e+02 18.610  2.46189e+01  8.28977e+00  0.00000e+00 0.00000e+00 6.36218e+02 18.610  1.52117e+01 18.610  0.9806 
1 1 1 -7  1   6  o 18 2.54291e+01 6.03564e-01 5.90888e+02 324.569 1.61177e+01  -1.14673e+01 0.00000e+00 0.00000e+00 3.41025e+02 324.569 2.49863e+02 144.569 0.9744 
1 1 1 -7  1   7  o 1  3.22510e+01 7.06639e-01 6.76355e+02 3.465   3.80461e+01  2.30358e+00  0.00000e+00 0.00000e+00 5.19800e+02 3.465   1.56555e+02 183.465 0.9868 
1 1 1 -7  1   8  o 13 1.45210e+01 5.62499e-01 2.01026e+02 225.806 -4.41741e+00 -4.54355e+00 0.00000e+00 0.00000e+00 2.99242e+02 225.806 9.82153e+01 225.806 0.9173 
1 1 1 -7  1   9  o 9  1.03296e+01 7.75493e-01 1.20767e+02 101.323 -6.61572e-01 3.30386e+00  0.00000e+00 0.00000e+00 2.02518e+02 101.323 8.17510e+01 101.323 0.8340 
1 1 1 -7  1   10 o 14 2.13122e+01 5.15538e-01 2.81710e+02 343.361 1.90171e+01  -5.68345e+00 0.00000e+00 0.00000e+00 4.96993e+02 343.361 2.15283e+02 343.361 0.9745 
1 1 1 -7  1   11 o 3  3.31089e+01 6.18708e-01 5.25000e+02 206.725 -7.07841e+01 -3.56388e+01 0.00000e+00 0.00000e+00 7.07422e+02 206.725 1.82422e+02 206.725 0.9937 
1 1 1 -7  1   12 o 14 6.50479e+00 6.36863e-01 1.61818e+02 47.590  4.39994e+00  4.81681e+00  0.00000e+00 0.00000e+00 6.20905e+01 47.590  9.97277e+01 227.590 0.9198 
1 1 1 -7  1   13 o 6  1.06194e+01 4.98589e-01 1.77109e+02 127.220 -9.93772e+00 1.30829e+01  0.00000e+00 0.00000e+00 2.07611e+02 127.220 3.05020e+01 127.220 0.9691 
1 1 1 -7  1   14 o 2  4.88332e+00 7.79800e-01 1.71939e+02 284.894 2.16815e+00  -8.15170e+00 0.00000e+00 0.00000e+00 7.58870e-01 104.894 1.72698e+02 104.894 0.9387 
1 1 1 -7  1   15 o 3  8.94051e+00 5.93396e-01 1.81893e+02 27.397  1.97490e+01  1.02356e+01  0.00000e+00 0.00000e+00 1.43998e+02 27.397  3.78950e+01 207.397 0.9773 
1 1 1 -7  1   16 o 5  1.21930e+01 8.02134e-01 1.22584e+02 24.463  2.03109e+01  9.24054e+00  0.00000e+00 0.00000e+00 3.21353e+02 24.463  1.98769e+02 24.463  0.9773 
1 1 1 -7  1   17 o 12 5.98579e+00 1.31456e+00 8.87517e+01 175.679 -6.65857e+00 5.03141e-01  0.00000e+00 0.00000e+00 1.16525e+02 175.679 2.77737e+01 175.679 0.9217 
1 1 1 -7  1   18 o 9  3.98216e+00 1.24944e+00 3.11258e+01 101.521 -3.48344e-01 1.70900e+00  0.00000e+00 0.00000e+00 6.51884e+01 101.521 3.40626e+01 101.521 0.6510 
1 1 1 -7  1   19 o 14 5.88149e+00 1.58020e+00 6.30632e+01 22.212  4.23252e+00  1.72831e+00  0.00000e+00 0.00000e+00 1.29495e+02 22.212  6.64317e+01 22.212  0.8824 
1 1 1 -7  1   20 o 15 6.27687e+00 1.75223e+00 1.07476e+02 68.475  3.18211e+00  8.06807e+00  0.00000e+00 0.00000e+00 1.11223e+02 68.475  3.74743e+00 68.475  0.9404 
1 1 1 -7  2   1  o 10 2.50292e+01 5.83323e-01 5.89807e+02 47.871  9.44569e+00  1.04430e+01  0.00000e+00 0.00000e+00 3.19742e+02 47.871  2.70065e+02 227.870 0.9638 
1 1 1 -7  2   2  o 11 1.93180e+01 5.14365e-01 3.98335e+02 61.029  3.38680e+00  6.11720e+00  0.00000e+00 0.00000e+00 2.75476e+02 61.029  1.22859e+02 241.029 0.9254 
1 1 1 -7  2   3  o 7  2.00670e+01 5.31640e-01 4.75808e+02 321.907 7.94183e+00  -6.22560e+00 0.00000e+00 0.00000e+00 2.41691e+02 321.907 2.34116e+02 141.907 0.9491 
1 1 1 -7  2   4  o 14 4.24960e+01 8.68682e-01 8.84655e+02 140.749 -3.20604e+01 2.61956e+01  0.00000e+00 0.00000e+00 6.96082e+02 140.749 1.88574e+02 320.749 0.9878 
1 1 1 -7  2   5  o 3  2.06076e+01 6.52022e-01 1.97056e+02 33.771  4.15340e+00  2.77737e+00  0.00000e+00 0.00000e+00 4.95740e+02 33.771  2.98684e+02 33.771  0.8933 
1 1 1 -7  2   6  o 3  4.16940e+01 8.55525e-01 7.23766e+02 163.300 -3.76969e+01 1.13096e+01  0.00000e+00 0.00000e+00 8.24322e+02 163.300 1.00556e+02 163.300 0.9872 
1 1 1 -7  2   7  o 11 5.30979e+01 1.05846e+00 1.05056e+03 162.142 -9.09010e+01 2.92866e+01  0.00000e+00 0.00000e+00 9.34652e+02 162.142 1.15913e+02 342.142 0.9948 
1 1 1 -7  2   8  o 2  2.36164e+01 7.20669e-01 2.85315e+02 314.264 1.01239e+01  -1.03874e+01 0.00000e+00 0.00000e+00 5.70512e+02 314.264 2.85197e+02 314.264 0.9649 
1 1 1 -7  2   9  o 14 1.96509e+01 5.36299e-01 2.50610e+02 140.383 -1.04109e+01 8.61779e+00  0.00000e+00 0.00000e+00 4.59004e+02 140.383 2.08394e+02 140.383 0.9623 
1 1 1 -7  2   10 o 4  1.84747e+01 4.97467e-01 3.74653e+02 266.541 -1.38187e+00 -2.28629e+01 0.00000e+00 0.00000e+00 3.02758e+02 266.541 7.18949e+01 86.541  0.9779 
1 1 1 -7  2   11 o 18 1.72226e+01 4.85180e-01 3.06223e+02 144.635 -1.98552e+01 1.40920e+01  0.00000e+00 0.00000e+00 3.25550e+02 144.635 1.93276e+01 144.635 0.9792 
1 1 1 -7  2   12 o 15 2.22599e+01 5.04203e-01 3.76511e+02 71.534  1.67448e+01  5.01443e+01  0.00000e+00 0.00000e+00 4.48612e+02 71.534  7.21003e+01 71.534  0.9905 
1 1 1 -7  2   13 o 6  7.82423e+00 5.60998e-01 1.16057e+02 314.520 5.50161e+00  -5.59455e+00 0.00000e+00 0.00000e+00 1.57115e+02 314.520 4.10583e+01 314.520 0.9339 
1 1 1 -7  2   14 o 7  6.18148e+00 6.36033e-01 8.24203e+01 154.190 -4.79016e+00 2.31669e+00  0.00000e+00 0.00000e+00 1.25407e+02 154.190 4.29864e+01 154.190 0.9003 
1 1 1 -7  2   15 o 17 1.71583e+01 6.05204e-01 3.27452e+02 3.691   7.64100e+01  4.92928e+00  0.00000e+00 0.00000e+00 3.08346e+02 3.691   1.91059e+01 183.691 0.9934 
1 1 1 -7  2   16 o 19 8.84018e+00 8.75622e-01 1.75519e+02 308.943 1.40762e+01  -1.74184e+01 0.00000e+00 0.00000e+00 1.46370e+02 308.943 2.91492e+01 128.943 0.9774 
1 1 1 -7  2   17 o 13 9.61393e+00 1.09990e+00 1.05995e+02 333.664 1.30614e+01  -6.46565e+00 0.00000e+00 0.00000e+00 2.39197e+02 333.664 1.33202e+02 333.664 0.9651 
1 1 1 -7  2   18 o 17 7.02743e+00 1.42079e+00 6.69079e+01 314.756 4.16057e+00  -4.19620e+00 0.00000e+00 0.00000e+00 1.70939e+02 314.756 1.04031e+02 314.756 0.9109 
1 1 1 -7  2   19 o 15 1.04510e+01 1.50651e+00 1.72131e+02 179.402 -2.35678e+01 2.45922e-01  0.00000e+00 0.00000e+00 2.07313e+02 179.402 3.51827e+01 179.402 0.9786 
1 1 1 -7  2   20 o 5  7.24817e+00 1.80553e+00 1.38671e+02 4.640   1.23228e+01  1.00022e+00  0.00000e+00 0.00000e+00 1.18760e+02 4.640   1.99115e+01 184.640 0.9587 
1 1 1 -7  3   1  o 8  1.82102e+01 5.01311e-01 2.40381e+02 122.224 -2.22727e+00 3.53363e+00  0.00000e+00 0.00000e+00 3.56954e+02 122.224 1.16573e+02 122.224 0.8700 
1 1 1 -7  3   2  o 4  4.50128e+01 9.13591e-01 9.42216e+02 63.953  1.67402e+01  3.42513e+01  0.00000e+00 0.00000e+00 7.31902e+02 63.953  2.10314e+02 243.953 0.9868 
1 1 1 -7  3   3  o 12 1.36859e+01 4.94273e-01 1.57721e+02 217.389 -1.81229e+00 -1.38507e+00 0.00000e+00 0.00000e+00 2.23262e+02 217.389 6.55406e+01 217.389 0.7389 
1 1 1 -7  3   4  o 14 2.95178e+01 6.55389e-01 4.11106e+02 355.208 1.33973e+01  -1.12316e+00 0.00000e+00 0.00000e+00 6.58205e+02 355.208 2.47099e+02 355.208 0.9621 
1 1 1 -7  3   5  o 12 4.64190e+01 9.36504e-01 7.64530e+02 193.875 -4.19277e+01 -1.03568e+01 0.00000e+00 0.00000e+00 9.62044e+02 193.875 1.97514e+02 193.875 0.9884 
1 1 1 -7  3   6  o 19 4.11987e+01 8.45179e-01 5.54463e+02 251.803 -9.30344e+00 -2.83012e+01 0.00000e+00 0.00000e+00 9.68804e+02 251.803 4.14341e+02 251.803 0.9831 
1 1 1 -7  3   7  o 9  2.92692e+01 6.62098e-01 3.72426e+02 158.193 -1.77081e+01 7.08525e+00  0.00000e+00 0.00000e+00 6.98414e+02 158.193 3.25988e+02 158.193 0.9734 
1 1 1 -7  3   8  o 14 2.79340e+01 7.97246e-01 3.28263e+02 83.244  2.31055e+00  1.95045e+01  0.00000e+00 0.00000e+00 6.93789e+02 83.244  3.65526e+02 83.244  0.9742 
1 1 1 -7  3   9  o 9  2.16543e+01 5.48896e-01 3.19448e+02 240.733 -9.27227e+00 -1.65453e+01 0.00000e+00 0.00000e+00 4.71452e+02 240.733 1.52003e+02 240.733 0.9733 
1 1 1 -7  3   10 o 11 2.38556e+01 5.27009e-01 3.51193e+02 108.301 -8.68704e+00 2.62652e+01  0.00000e+00 0.00000e+00 5.26944e+02 108.301 1.75751e+02 108.301 0.9818 
1 1 1 -7  3   11 o 17 7.82400e+00 6.08515e-01 1.21658e+02 122.576 -2.33803e+00 3.65928e+00  0.00000e+00 0.00000e+00 1.34942e+02 122.576 1.32847e+01 122.576 0.8755 
1 1 1 -7  3   12 o 5  1.36500e+01 4.79170e-01 2.61245e+02 347.620 2.20295e+01  -4.83539e+00 0.00000e+00 0.00000e+00 2.38124e+02 347.620 2.31212e+01 167.620 0.9776 
1 1 1 -7  3   13 o 6  6.76248e+00 5.85227e-01 6.36515e+01 223.270 -2.69556e+00 -2.53751e+00 0.00000e+00 0.00000e+00 1.51488e+02 223.270 8.78367e+01 223.270 0.8510 
1 1 1 -7  3   14 o 1  1.00369e+01 5.18638e-01 1.97389e+02 159.937 -2.09588e+01 7.65462e+00  0.00000e+00 0.00000e+00 1.68919e+02 159.937 2.84691e+01 339.937 0.9773 
1 1 1 -7  3   15 o 2  8.84842e+00 6.55343e-01 1.87359e+02 274.605 1.78511e+00  -2.21609e+01 0.00000e+00 0.00000e+00 1.35169e+02 274.605 5.21903e+01 94.605  0.9772 
1 1 1 -7  3   16 o 4  7.97732e+00 9.34004e-01 1.14226e+02 43.433  9.28604e+00  8.79155e+00  0.00000e+00 0.00000e+00 1.71087e+02 43.433  5.68605e+01 43.433  0.9601 
1 1 1 -7  3   17 o 16 6.80560e+00 1.20348e+00 9.02197e+01 151.616 -7.26385e+00 3.92489e+00  0.00000e+00 0.00000e+00 1.47115e+02 151.616 5.68950e+01 151.616 0.9373 
1 1 1 -7  3   18 o 6  5.17840e+00 1.27509e+00 1.03220e+02 205.557 -6.67151e+00 -3.19028e+00 0.00000e+00 0.00000e+00 7.56559e+01 205.557 2.75645e+01 25.557  0.9297 
1 1 1 -7  3   19 o 17 7.02911e+00 1.37414e+00 6.39973e+01 344.102 6.24660e+00  -1.77921e+00 0.00000e+00 0.00000e+00 1.75786e+02 344.102 1.11789e+02 344.102 0.9194 
1 1 1 -7  4   1  o 9  2.43472e+01 5.72686e-01 3.47803e+02 78.673  1.58224e+00  7.89886e+00  0.00000e+00 0.00000e+00 5.11145e+02 78.673  1.63342e+02 78.673  0.9357 
1 1 1 -7  4   2  o 4  2.10004e+01 5.37138e-01 3.59824e+02 226.041 -4.75150e+00 -4.92746e+00 0.00000e+00 0.00000e+00 3.71324e+02 226.041 1.15005e+01 226.041 0.9238 
1 1 1 -7  4   3  o 5  2.90772e+01 6.46758e-01 6.04009e+02 310.896 1.20928e+01  -1.39623e+01 0.00000e+00 0.00000e+00 4.61338e+02 310.896 1.42671e+02 130.896 0.9725 
1 1 1 -7  4   4  o 6  1.38199e+01 4.81410e-01 3.98681e+02 342.034 5.82450e+00  -1.88870e+00 0.00000e+00 0.00000e+00 7.70635e+01 342.034 3.21618e+02 162.034 0.9142 
1 1 1 -7  4   5  f 0  1.60034e+01 7.39223e-01 5.42116e+01 255.819 -2.60415e-01 -1.03058e+00 0.00000e+00 0.00000e+00 2.27804e+02 255.819 1.73592e+02 255.819 0.4683 
1 1 1 -7  4   6  o 19 2.36958e+01 5.78950e-01 4.40096e+02 7.915   1.40791e+01  1.95727e+00  0.00000e+00 0.00000e+00 4.19160e+02 7.915   2.09361e+01 187.914 0.9642 
1 1 1 -7  4   7  o 15 3.04705e+01 6.79401e-01 5.32503e+02 317.121 2.07763e+01  -1.92923e+01 0.00000e+00 0.00000e+00 5.92335e+02 317.121 5.98322e+01 317.121 0.9822 
1 1 1 -7  4   8  o 6  2.18203e+01 8.89555e-01 2.26416e+02 44.170  7.53990e+00  7.32466e+00  0.00000e+00 0.00000e+00 5.53072e+02 44.170  3.26656e+02 44.170  0.9512 
1 1 1 -7  4   9  o 19 1.93007e+01 5.39629e-01 1.90873e+02 349.470 9.93298e+00  -1.84629e+00 0.00000e+00 0.00000e+00 4.96580e+02 349.470 3.05706e+02 349.470 0.9491 
1 1 1 -7  4   10 o 3  1.46363e+01 5.04685e-01 1.15848e+02 231.424 -3.49498e+00 -4.38178e+00 0.00000e+00 0.00000e+00 3.81205e+02 231.424 2.65357e+02 231.424 0.9057 
1 1 1 -7  4   11 o 17 2.23584e+01 5.11912e-01 4.17577e+02 314.884 3.21210e+01  -3.22511e+01 0.00000e+00 0.00000e+00 4.10710e+02 314.884 6.86672e+00 134.884 0.9890 
1 1 1 -7  4   12 o 11 1.16593e+01 6.38279e-01 2.21183e+02 347.474 1.55892e+01  -3.46345e+00 0.00000e+00 0.00000e+00 2.01248e+02 347.474 1.99346e+01 167.474 0.9682 
1 1 1 -7  4   13 o 18 1.77069e+01 4.77993e-01 2.25075e+02 323.681 2.81248e+01  -2.06743e+01 0.00000e+00 0.00000e+00 4.27321e+02 323.681 2.02246e+02 323.681 0.9856 
1 1 1 -7  4   14 o 14 1.17475e+01 5.00805e-01 2.13055e+02 26.739  2.52655e+01  1.27287e+01  0.00000e+00 0.00000e+00 2.17799e+02 26.739  4.74407e+00 26.739  0.9822 
1 1 1 -7  4   15 o 13 9.49789e+00 6.41436e-01 1.69170e+02 242.378 -1.00337e+01 -1.91748e+01 0.00000e+00 0.00000e+00 1.76805e+02 242.378 7.63525e+00 242.378 0.9766 
1 1 1 -7  4   16 o 14 9.68985e+00 8.67253e-01 1.54128e+02 237.729 -1.15520e+01 -1.82938e+01 0.00000e+00 0.00000e+00 1.98404e+02 237.729 4.42758e+01 237.729 0.9766 
1 1 1 -7  4   17 o 16 6.28447e+00 1.26993e+00 1.21209e+02 138.975 -7.42132e+00 6.45696e+00  0.00000e+00 0.00000e+00 1.00381e+02 138.975 2.08281e+01 318.975 0.9477 
1 1 1 -7  4   18 o 15 6.80993e+00 1.43541e+00 6.85048e+01 222.838 -4.25674e+00 -3.94697e+00 0.00000e+00 0.00000e+00 1.61546e+02 222.838 9.30409e+01 222.838 0.9092 
1 1 1 -7  4   19 o 12 9.13940e+00 1.49850e+00 5.53235e+01 52.080  4.09416e+00  5.25548e+00  0.00000e+00 0.00000e+00 2.57167e+02 52.080  2.01843e+02 52.080  0.9216 
1 1 1 -7  5   1  o 1  2.55485e+01 5.91238e-01 4.67285e+02 216.751 -9.07712e+00 -6.77835e+00 0.00000e+00 0.00000e+00 4.52422e+02 216.751 1.48633e+01 36.751  0.9548 
1 1 1 -7  5   2  o 7  2.66582e+01 6.10613e-01 4.68797e+02 298.958 5.46262e+00  -9.87198e+00 0.00000e+00 0.00000e+00 4.90306e+02 298.958 2.15086e+01 298.958 0.9546 
1 1 1 -7  5   3  o 10 2.44423e+01 5.80005e-01 5.19794e+02 152.710 -1.18507e+01 6.11387e+00  0.00000e+00 0.00000e+00 3.65782e+02 152.710 1.54012e+02 332.710 0.9617 
1 1 1 -7  5   4  o 10 1.73362e+01 6.20431e-01 4.13007e+02 140.923 -6.14908e+00 4.99313e+00  0.00000e+00 0.00000e+00 1.97050e+02 140.923 2.15957e+02 320.923 0.9346 
1 1 1 -7  5   5  o 16 2.66139e+01 7.17008e-01 5.07201e+02 147.037 -1.38724e+01 8.99614e+00  0.00000e+00 0.00000e+00 4.63578e+02 147.037 4.36233e+01 327.037 0.9693 
1 1 1 -7  5   6  o 8  3.57452e+01 7.55144e-01 8.05749e+02 101.635 -7.86367e+00 3.81904e+01  0.00000e+00 0.00000e+00 5.21260e+02 101.635 2.84489e+02 281.635 0.9871 
1 1 1 -7  5   7  o 14 8.98625e+00 8.43536e-01 1.29660e+02 88.844  4.07019e-02  2.01749e+00  0.00000e+00 0.00000e+00 1.06992e+02 88.844  2.26687e+01 268.844 0.7007 
1 1 1 -7  5   8  o 11 2.44352e+01 6.09505e-01 3.44032e+02 40.887  1.37455e+01  1.19014e+01  0.00000e+00 0.00000e+00 5.48058e+02 40.887  2.04026e+02 40.887  0.9721 
1 1 1 -7  5   9  o 5  1.50519e+01 5.32666e-01 3.24427e+02 111.129 -4.82748e+00 1.24918e+01  0.00000e+00 0.00000e+00 2.18898e+02 111.129 1.05529e+02 291.129 0.9619 
1 1 1 -7  5   10 o 6  3.29844e+01 6.17679e-01 5.84064e+02 115.486 -2.71747e+01 5.70100e+01  0.00000e+00 0.00000e+00 6.42814e+02 115.486 5.87500e+01 115.486 0.9921 
1 1 1 -7  5   11 o 6  3.56549e+01 6.43786e-01 6.66228e+02 320.014 8.74846e+01  -7.33726e+01 0.00000e+00 0.00000e+00 6.63511e+02 320.014 2.71740e+00 140.014 0.9956 
1 1 1 -7  5   12 o 9  1.93518e+01 4.90994e-01 4.56453e+02 134.804 -3.92866e+01 3.95569e+01  0.00000e+00 0.00000e+00 2.61211e+02 134.804 1.95241e+02 314.803 0.9910 
1 1 1 -7  5   13 o 3  1.82357e+01 4.84323e-01 2.67042e+02 302.446 2.28513e+01  -3.59437e+01 0.00000e+00 0.00000e+00 4.06617e+02 302.446 1.39575e+02 302.446 0.9882 
1 1 1 -7  5   14 o 11 1.28908e+01 5.04202e-01 2.22353e+02 311.543 2.14656e+01  -2.42255e+01 0.00000e+00 0.00000e+00 2.51518e+02 311.543 2.91649e+01 311.543 0.9844 
1 1 1 -7  5   15 f 0  7.29428e+00 7.29276e-01 1.17679e+02 41.798  8.36409e+00  7.47796e+00  0.00000e+00 0.00000e+00 1.41962e+02 41.798  2.42825e+01 41.798  0.9543 
1 1 1 -7  5   16 o 2  5.16708e+00 1.07310e+00 9.23968e+01 173.205 -6.19868e+00 7.38576e-01  0.00000e+00 0.00000e+00 8.39148e+01 173.205 8.48201e+00 353.205 0.9160 
1 1 1 -7  5   17 f 0  4.81426e+00 1.17100e+00 7.35918e+01 153.692 -4.35320e+00 2.15224e+00  0.00000e+00 0.00000e+00 8.58062e+01 153.692 1.22144e+01 153.692 0.8899 
1 1 1 -7  5   18 o 4  1.26269e+01 1.09703e+00 1.59788e+02 3.794   3.12333e+01  2.07136e+00  0.00000e+00 0.00000e+00 3.01799e+02 3.794   1.42011e+02 3.794   0.9839 
1 1 1 -7  5   19 o 1  8.57934e+00 1.48325e+00 8.81523e+01 65.577  4.16575e+00  9.17346e+00  0.00000e+00 0.00000e+00 2.13920e+02 65.577  1.25767e+02 65.577  0.9490 
1 1 1 -7  6   1  o 6  1.94682e+01 5.15774e-01 3.86710e+02 146.285 -5.93617e+00 3.96115e+00  0.00000e+00 0.00000e+00 2.93724e+02 146.285 9.29863e+01 326.285 0.9270 
1 1 1 -7  6   2  o 2  1.49511e+01 4.85168e-01 2.81110e+02 84.155  3.86420e-01  3.77458e+00  0.00000e+00 0.00000e+00 2.00735e+02 84.155  8.03748e+01 264.155 0.8551 
1 1 1 -7  6   3  o 6  1.63681e+01 5.05361e-01 2.49218e+02 95.056  -3.77138e-01 4.26276e+00  0.00000e+00 0.00000e+00 2.89378e+02 95.056  4.01596e+01 95.056  0.8735 
1 1 1 -7  6   4  o 9  1.96020e+01 6.08328e-01 8.17853e+01 180.457 -1.77120e+00 -1.41221e-02 0.00000e+00 0.00000e+00 4.02690e+02 180.457 3.20905e+02 180.457 0.6564 
1 1 1 -7  6   5  o 2  2.05384e+01 5.40208e-01 5.29508e+02 238.417 -7.00364e+00 -1.13919e+01 0.00000e+00 0.00000e+00 2.13914e+02 238.417 3.15593e+02 58.417  0.9619 
1 1 1 -7  6   6  o 5  4.44671e+01 9.01764e-01 9.13678e+02 141.321 -4.26335e+01 3.41303e+01  0.00000e+00 0.00000e+00 7.43302e+02 141.321 1.70377e+02 321.321 0.9908 
1 1 1 -7  6   7  o 11 1.40843e+01 5.27404e-01 1.47905e+02 146.078 -3.03376e+00 2.04030e+00  0.00000e+00 0.00000e+00 3.01427e+02 146.078 1.53523e+02 146.078 0.8489 
1 1 1 -7  6   8  o 16 2.45944e+01 6.06208e-01 4.54116e+02 79.771  4.40002e+00  2.43830e+01  0.00000e+00 0.00000e+00 4.50707e+02 79.771  3.40857e+00 259.771 0.9796 
1 1 1 -7  6   9  o 19 1.37592e+01 5.46287e-01 1.71457e+02 246.582 -2.63443e+00 -6.08247e+00 0.00000e+00 0.00000e+00 3.04144e+02 246.582 1.32687e+02 246.582 0.9211 
1 1 1 -7  6   10 o 7  2.41230e+01 5.25195e-01 4.30589e+02 149.035 -2.93726e+01 1.76241e+01  0.00000e+00 0.00000e+00 4.60559e+02 149.035 2.99701e+01 149.035 0.9853 
1 1 1 -7  6   11 o 8  1.21591e+01 5.04293e-01 9.99051e+01 233.434 -3.52794e+00 -4.75620e+00 0.00000e+00 0.00000e+00 3.15081e+02 233.434 2.15176e+02 233.434 0.9111 
1 1 1 -7  6   12 o 3  1.54178e+01 4.76308e-01 2.83323e+02 280.459 5.01081e+00  -2.71441e+01 0.00000e+00 0.00000e+00 2.83089e+02 280.459 2.33806e-01 100.459 0.9817 
1 1 1 -7  6   13 o 18 1.11438e+01 4.86698e-01 1.92057e+02 240.666 -9.16307e+00 -1.63055e+01 0.00000e+00 0.00000e+00 2.13234e+02 240.666 2.11779e+01 240.666 0.9729 
1 1 1 -7  6   14 o 8  1.49577e+01 4.80294e-01 2.30088e+02 298.540 1.86549e+01  -3.43000e+01 0.00000e+00 0.00000e+00 3.21250e+02 298.540 9.11622e+01 298.540 0.9871 
1 1 1 -7  6   15 f 0  1.62262e+01 5.75016e-01 2.36154e+02 197.494 -5.02166e+01 -1.58276e+01 0.00000e+00 0.00000e+00 3.63269e+02 197.494 1.27115e+02 197.494 0.9905 
1 1 1 -7  6   16 o 18 5.17332e+00 1.04492e+00 6.16305e+01 86.113  2.88625e-01  4.24763e+00  0.00000e+00 0.00000e+00 1.06560e+02 86.113  4.49295e+01 86.113  0.8727 
1 1 1 -7  6   17 o 17 5.39084e+00 1.22265e+00 9.69549e+01 81.521  1.04317e+00  6.99786e+00  0.00000e+00 0.00000e+00 8.88360e+01 81.521  8.11887e+00 261.521 0.9264 
1 1 1 -7  6   18 o 2  5.23537e+00 1.40862e+00 5.65061e+01 134.334 -2.61767e+00 2.67925e+00  0.00000e+00 0.00000e+00 1.09409e+02 134.334 5.29033e+01 134.334 0.8530 
1 1 1 -7  6   19 o 10 9.25945e+00 1.55403e+00 1.18087e+02 258.367 -2.78836e+00 -1.35447e+01 0.00000e+00 0.00000e+00 2.12785e+02 258.367 9.46974e+01 258.367 0.9631 
1 1 1 -7  7   1  o 9  2.12184e+01 5.38977e-01 4.25569e+02 237.450 -4.43345e+00 -6.94574e+00 0.00000e+00 0.00000e+00 3.24163e+02 237.450 1.01406e+02 57.450  0.9372 
1 1 1 -7  7   2  o 4  3.88837e+01 8.05194e-01 6.94126e+02 62.114  1.12860e+01  2.13284e+01  0.00000e+00 0.00000e+00 7.40616e+02 62.114  4.64905e+01 62.114  0.9791 
1 1 1 -7  7   3  o 10 1.88090e+01 5.10742e-01 4.60554e+02 283.422 2.10412e+00  -8.81706e+00 0.00000e+00 0.00000e+00 2.07696e+02 283.422 2.52859e+02 103.422 0.9431 
1 1 1 -7  7   4  o 7  1.95630e+01 5.22386e-01 2.99757e+02 99.021  -1.01602e+00 6.39986e+00  0.00000e+00 0.00000e+00 3.77343e+02 99.021  7.75864e+01 99.021  0.9192 
1 1 1 -7  7   5  o 7  2.02633e+01 5.40364e-01 4.13727e+02 87.968  3.65004e-01  1.02870e+01  0.00000e+00 0.00000e+00 3.10771e+02 87.968  1.02956e+02 267.968 0.9501 
1 1 1 -7  7   6  o 9  3.68524e+01 7.72461e-01 5.84719e+02 0.747   2.90888e+01  3.79367e-01  0.00000e+00 0.00000e+00 7.77205e+02 0.747   1.92486e+02 0.747   0.9827 
1 1 1 -7  7   7  o 15 1.99594e+01 5.51525e-01 3.85239e+02 14.397  1.30461e+01  3.34900e+00  0.00000e+00 0.00000e+00 3.36484e+02 14.397  4.87551e+01 194.397 0.9621 
1 1 1 -7  7   8  o 7  3.11091e+01 6.93738e-01 5.93668e+02 99.887  -6.99651e+00 4.01430e+01  0.00000e+00 0.00000e+00 5.60208e+02 99.887  3.34606e+01 279.887 0.9877 
1 1 1 -7  7   9  o 10 3.47991e+01 6.89068e-01 5.80971e+02 342.982 5.37832e+01  -1.64617e+01 0.00000e+00 0.00000e+00 7.13200e+02 342.982 1.32229e+02 342.982 0.9911 
1 1 1 -7  7   10 o 18 1.82910e+01 6.52490e-01 2.60969e+02 234.859 -8.97135e+00 -1.27457e+01 0.00000e+00 0.00000e+00 4.02429e+02 234.859 1.41460e+02 234.859 0.9674 
1 1 1 -7  7   11 o 19 1.77656e+01 4.86787e-01 1.80370e+02 227.546 -1.05553e+01 -1.15378e+01 0.00000e+00 0.00000e+00 4.63449e+02 227.546 2.83079e+02 227.546 0.9675 
1 1 1 -7  7   12 o 15 1.50188e+01 4.89710e-01 1.37042e+02 143.945 -1.04921e+01 7.63849e+00  0.00000e+00 0.00000e+00 4.02870e+02 143.945 2.65828e+02 143.945 0.9607 
1 1 1 -7  7   13 f 0  1.63950e+01 4.69326e-01 1.65554e+02 131.843 -1.58577e+01 1.77092e+01  0.00000e+00 0.00000e+00 4.34291e+02 131.843 2.68737e+02 131.843 0.9787 
1 1 1 -7  7   14 o 10 1.35763e+01 4.81005e-01 2.46705e+02 326.114 3.15276e+01  -2.11745e+01 0.00000e+00 0.00000e+00 2.53521e+02 326.114 6.81559e+00 326.114 0.9867 
1 1 1 -7  7   15 o 10 4.82475e+00 8.48499e-01 9.58086e+01 132.528 -3.75262e+00 4.09123e+00  0.00000e+00 0.00000e+00 6.70049e+01 132.528 2.88037e+01 312.528 0.9048 
1 1 1 -7  7   16 o 7  9.26642e+00 8.28981e-01 1.41185e+02 65.661  8.00303e+00  1.76928e+01  0.00000e+00 0.00000e+00 1.94991e+02 65.661  5.38053e+01 65.661  0.9739 
1 1 1 -7  7   17 o 7  4.51212e+00 1.17903e+00 6.46631e+01 221.433 -3.04070e+00 -2.68384e+00 0.00000e+00 0.00000e+00 8.06462e+01 221.433 1.59831e+01 221.433 0.8656 
1 1 1 -7  7   18 o 5  6.92608e+00 1.42338e+00 6.61634e+01 322.891 4.63643e+00  -3.50762e+00 0.00000e+00 0.00000e+00 1.67838e+02 322.891 1.01674e+02 322.891 0.9094 
1 1 1 -7  7   19 o 4  5.98403e+00 1.59937e+00 7.09445e+01 252.769 -1.53849e+00 -4.96067e+00 0.00000e+00 0.00000e+00 1.28352e+02 252.769 5.74073e+01 252.769 0.8977 
1 1 1 -7  8   1  o 11 2.63848e+01 6.06613e-01 4.08096e+02 293.672 3.92629e+00  -8.95640e+00 0.00000e+00 0.00000e+00 5.34315e+02 293.672 1.26219e+02 293.672 0.9474 
1 1 1 -7  8   2  o 3  1.95951e+01 5.15474e-01 2.74031e+02 76.176  1.37497e+00  5.58784e+00  0.00000e+00 0.00000e+00 3.96779e+02 76.176  1.22748e+02 76.176  0.9084 
1 1 1 -7  8   3  o 5  1.96680e+01 6.03058e-01 3.35796e+02 245.961 -2.80182e+00 -6.28164e+00 0.00000e+00 0.00000e+00 3.48907e+02 245.961 1.31109e+01 245.961 0.9241 
1 1 1 -7  8   4  o 5  2.04415e+01 5.34518e-01 2.84234e+02 151.984 -5.65452e+00 3.00856e+00  0.00000e+00 0.00000e+00 4.22488e+02 151.984 1.38254e+02 151.984 0.9182 
1 1 1 -7  8   5  o 5  2.74200e+01 6.21188e-01 3.44095e+02 4.138   1.15104e+01  8.32700e-01  0.00000e+00 0.00000e+00 6.41971e+02 4.138   2.97876e+02 4.138   0.9556 
1 1 1 -7  8   6  o 7  3.20109e+01 6.94314e-01 7.30155e+02 292.288 1.19870e+01  -2.92447e+01 0.00000e+00 0.00000e+00 4.54496e+02 292.288 2.75659e+02 112.288 0.9841 
1 1 1 -7  8   7  o 11 2.43070e+01 5.91439e-01 5.15554e+02 276.888 2.57222e+00  -2.12942e+01 0.00000e+00 0.00000e+00 3.76396e+02 276.888 1.39158e+02 96.888  0.9764 
1 1 1 -7  8   8  o 18 3.50234e+01 7.54686e-01 4.26349e+02 30.465  2.82705e+01  1.66296e+01  0.00000e+00 0.00000e+00 8.68719e+02 30.465  4.42370e+02 30.465  0.9846 
1 1 1 -7  8   9  f 0  2.07899e+01 5.37064e-01 2.42703e+02 269.878 -3.02500e-02 -1.41651e+01 0.00000e+00 0.00000e+00 5.09358e+02 269.878 2.66655e+02 269.878 0.9640 
1 1 1 -7  8   10 o 2  5.37906e+01 9.77377e-01 8.74218e+02 110.237 -5.55509e+01 1.50680e+02  0.00000e+00 0.00000e+00 1.13620e+03 110.237 2.61982e+02 110.237 0.9969 
1 1 1 -7  8   11 o 4  2.31872e+01 5.11899e-01 4.93066e+02 165.021 -5.37413e+01 1.43790e+01  0.00000e+00 0.00000e+00 3.67620e+02 165.021 1.25446e+02 345.021 0.9910 
1 1 1 -7  8   12 o 16 1.67734e+01 4.66100e-01 2.90914e+02 161.057 -2.91600e+01 1.00080e+01  0.00000e+00 0.00000e+00 3.26487e+02 161.057 3.55738e+01 161.057 0.9836 
1 1 1 -7  8   13 o 4  1.16429e+01 4.72081e-01 1.57536e+02 342.719 1.53222e+01  -4.76686e+00 0.00000e+00 0.00000e+00 2.63903e+02 342.719 1.06367e+02 342.719 0.9683 
1 1 1 -7  8   14 o 3  1.76549e+01 4.92218e-01 2.01135e+02 140.433 -3.09548e+01 2.55779e+01  0.00000e+00 0.00000e+00 4.49836e+02 140.433 2.48701e+02 140.433 0.9875 
1 1 1 -7  8   15 o 8  1.66405e+01 5.96219e-01 2.09419e+02 262.273 -6.12515e+00 -4.51401e+01 0.00000e+00 0.00000e+00 4.04359e+02 262.273 1.94940e+02 262.273 0.9890 
1 1 1 -7  8   16 o 12 1.03283e+01 7.98881e-01 1.43744e+02 129.590 -1.42312e+01 1.72085e+01  0.00000e+00 0.00000e+00 2.32274e+02 129.590 8.85298e+01 129.590 0.9773 
1 1 1 -7  8   17 o 1  7.36867e+00 1.18360e+00 8.14057e+01 265.229 -6.91438e-01 -8.28411e+00 0.00000e+00 0.00000e+00 1.75667e+02 265.229 9.42610e+01 265.229 0.9378 
1 1 1 -7  8   18 o 13 1.15399e+01 1.04401e+00 1.67460e+02 154.067 -2.82780e+01 1.37514e+01  0.00000e+00 0.00000e+00 2.54399e+02 154.067 8.69382e+01 154.067 0.9840 
1 1 1 -7  8   19 o 5  5.00436e+00 1.40867e+00 8.04654e+01 231.211 -3.54700e+00 -4.41330e+00 0.00000e+00 0.00000e+00 8.78849e+01 231.211 7.41946e+00 231.211 0.9068 
1 1 1 -7  9   1  o 3  2.37951e+01 5.68715e-01 4.21361e+02 77.313  1.99385e+00  8.85698e+00  0.00000e+00 0.00000e+00 4.24766e+02 77.313  3.40543e+00 77.313  0.9432 
1 1 1 -7  9   2  o 5  2.84757e+01 6.34895e-01 5.67978e+02 40.418  1.31142e+01  1.11681e+01  0.00000e+00 0.00000e+00 4.73525e+02 40.418  9.44530e+01 220.418 0.9705 
1 1 1 -7  9   3  o 13 3.20079e+01 8.18429e-01 5.47560e+02 232.907 -1.09097e+01 -1.44289e+01 0.00000e+00 0.00000e+00 6.24347e+02 232.907 7.67872e+01 232.907 0.9720 
1 1 1 -7  9   4  o 7  1.97307e+01 5.27752e-01 4.03528e+02 37.786  8.30954e+00  6.44230e+00  0.00000e+00 0.00000e+00 3.03091e+02 37.786  1.00437e+02 217.786 0.9512 
1 1 1 -7  9   5  o 9  3.02019e+01 6.63469e-01 6.89263e+02 269.379 -2.94252e-01 -2.71493e+01 0.00000e+00 0.00000e+00 4.26103e+02 269.379 2.63160e+02 89.379  0.9814 
1 1 1 -7  9   6  o 3  3.18219e+01 6.91890e-01 7.96636e+02 196.646 -3.27994e+01 -9.80678e+00 0.00000e+00 0.00000e+00 3.82470e+02 196.646 4.14166e+02 16.646  0.9853 
1 1 1 -7  9   7  o 12 4.22519e+01 8.69247e-01 8.27448e+02 351.638 5.83560e+01  -8.57772e+00 0.00000e+00 0.00000e+00 7.46908e+02 351.638 8.05407e+01 171.638 0.9915 
1 1 1 -7  9   8  o 19 1.74290e+01 8.62850e-01 3.06495e+02 357.808 1.16304e+01  -4.45198e-01 0.00000e+00 0.00000e+00 3.19239e+02 357.808 1.27440e+01 357.808 0.9560 
1 1 1 -7  9   9  o 4  4.82271e+01 8.83599e-01 1.01112e+03 206.748 -1.19061e+02 -6.00069e+01 0.00000e+00 0.00000e+00 7.91716e+02 206.748 2.19408e+02 26.748  0.9962 
1 1 1 -7  9   10 o 4  2.89234e+01 6.21739e-01 4.09076e+02 187.678 -4.15169e+01 -5.59685e+00 0.00000e+00 0.00000e+00 6.62266e+02 187.678 2.53190e+02 187.678 0.9880 
1 1 1 -7  9   11 o 16 1.73155e+01 4.78419e-01 3.86918e+02 4.219   3.25883e+01  2.40401e+00  0.00000e+00 0.00000e+00 2.51655e+02 4.219   1.35263e+02 184.219 0.9846 
1 1 1 -7  9   12 o 2  2.08516e+01 4.83290e-01 3.19241e+02 62.653  2.12420e+01  4.10732e+01  0.00000e+00 0.00000e+00 4.52530e+02 62.653  1.33289e+02 62.653  0.9891 
1 1 1 -7  9   13 o 14 1.10350e+01 4.74013e-01 1.24926e+02 289.598 4.10486e+00  -1.15289e+01 0.00000e+00 0.00000e+00 2.70335e+02 289.598 1.45409e+02 289.598 0.9582 
1 1 1 -7  9   14 o 4  1.00903e+01 4.92227e-01 2.19845e+02 235.053 -1.43615e+01 -2.05511e+01 0.00000e+00 0.00000e+00 1.49323e+02 235.053 7.05212e+01 55.054  0.9799 
1 1 1 -7  9   15 o 8  1.03449e+01 6.02856e-01 1.77809e+02 81.166  3.68363e+00  2.37022e+01  0.00000e+00 0.00000e+00 1.99876e+02 81.166  2.20671e+01 81.166  0.9789 
1 1 1 -7  9   16 o 16 1.05735e+01 6.96013e-01 1.64410e+02 268.155 -8.79257e-01 -2.72988e+01 0.00000e+00 0.00000e+00 2.22170e+02 268.155 5.77602e+01 268.155 0.9815 
1 1 1 -7  9   17 o 4  9.56108e+00 9.33146e-01 1.63038e+02 16.892  2.39347e+01  7.26810e+00  0.00000e+00 0.00000e+00 1.85464e+02 16.892  2.24259e+01 16.892  0.9798 
1 1 1 -7  9   18 o 11 7.85271e+00 1.24499e+00 8.28907e+01 326.530 7.75351e+00  -5.12614e+00 0.00000e+00 0.00000e+00 1.92676e+02 326.530 1.09786e+02 326.530 0.9446 
1 1 1 -7  9   19 o 6  4.43016e+00 1.51694e+00 8.97997e+01 111.308 -1.87695e+00 4.81223e+00  0.00000e+00 0.00000e+00 5.76388e+01 111.308 3.21609e+01 291.308 0.8971 
1 1 1 -7  10  1  o 18 1.94374e+01 5.13349e-01 2.53455e+02 181.124 -4.44624e+00 -8.72280e-02 0.00000e+00 0.00000e+00 3.90473e+02 181.124 1.37018e+02 181.124 0.8788 
1 1 1 -7  10  2  f 0  1.94279e+01 5.19714e-01 3.36278e+02 336.109 6.35490e+00  -2.81488e+00 0.00000e+00 0.00000e+00 3.40935e+02 336.109 4.65771e+00 336.109 0.9250 
1 1 1 -7  10  3  o 17 2.15736e+01 5.40608e-01 3.50612e+02 17.905  7.45899e+00  2.40988e+00  0.00000e+00 0.00000e+00 4.08275e+02 17.905  5.76633e+01 17.905  0.9338 
1 1 1 -7  10  4  o 7  1.87537e+01 5.15471e-01 2.94384e+02 338.748 6.77838e+00  -2.63624e+00 0.00000e+00 0.00000e+00 3.61180e+02 338.748 6.67964e+01 338.748 0.9285 
1 1 1 -7  10  5  o 5  2.65753e+01 7.02356e-01 4.70133e+02 302.500 8.72702e+00  -1.36989e+01 0.00000e+00 0.00000e+00 4.98580e+02 302.500 2.84474e+01 302.500 0.9687 
1 1 1 -7  10  6  o 2  2.67249e+01 6.15200e-01 5.56745e+02 140.108 -1.81862e+01 1.52015e+01  0.00000e+00 0.00000e+00 4.26829e+02 140.108 1.29917e+02 320.108 0.9787 
1 1 1 -7  10  7  o 2  1.48348e+01 5.46001e-01 4.02641e+02 273.092 5.50664e-01  -1.01940e+01 0.00000e+00 0.00000e+00 1.26802e+02 273.092 2.75839e+02 93.092  0.9497 
1 1 1 -7  10  8  o 4  1.47669e+01 5.81321e-01 2.30358e+02 107.161 -2.22151e+00 7.19401e+00  0.00000e+00 0.00000e+00 2.85914e+02 107.161 5.55554e+01 107.161 0.9310 
1 1 1 -7  10  9  o 8  2.78716e+01 5.99090e-01 4.94344e+02 150.195 -3.33810e+01 1.91212e+01  0.00000e+00 0.00000e+00 5.37778e+02 150.195 4.34345e+01 150.195 0.9869 
1 1 1 -7  10  10 o 13 2.04373e+01 5.84292e-01 3.48119e+02 74.712  6.65468e+00  2.43451e+01  0.00000e+00 0.00000e+00 4.02738e+02 74.712  5.46185e+01 74.712  0.9800 
1 1 1 -7  10  11 o 15 1.22145e+01 4.84800e-01 1.60620e+02 356.470 9.33949e+00  -5.76131e-01 0.00000e+00 0.00000e+00 2.71694e+02 356.470 1.11075e+02 356.470 0.9450 
1 1 1 -7  10  12 o 13 1.67485e+01 5.14317e-01 2.15552e+02 59.209  1.27749e+01  2.14380e+01  0.00000e+00 0.00000e+00 3.98463e+02 59.209  1.82911e+02 59.209  0.9798 
1 1 1 -7  10  13 o 9  1.39762e+01 5.39493e-01 1.16833e+02 250.064 -4.88519e+00 -1.34685e+01 0.00000e+00 0.00000e+00 3.87013e+02 250.064 2.70180e+02 250.064 0.9644 
1 1 1 -7  10  14 o 10 1.07984e+01 4.76538e-01 1.32161e+02 106.973 -4.55544e+00 1.49248e+01  0.00000e+00 0.00000e+00 2.57887e+02 106.973 1.25726e+02 106.973 0.9674 
1 1 1 -7  10  15 o 14 3.75351e+00 8.68995e-01 8.30334e+01 46.247  2.56495e+00  2.67914e+00  0.00000e+00 0.00000e+00 3.61382e+01 46.247  4.68952e+01 226.247 0.8513 
1 1 1 -7  10  16 o 12 1.04989e+01 7.07585e-01 1.64963e+02 329.710 2.33746e+01  -1.36535e+01 0.00000e+00 0.00000e+00 2.18814e+02 329.710 5.38510e+01 329.710 0.9814 
1 1 1 -7  10  17 o 13 1.43673e+01 7.59583e-01 2.22161e+02 133.089 -3.83368e+01 4.09829e+01  0.00000e+00 0.00000e+00 3.07527e+02 133.089 8.53662e+01 133.089 0.9910 
1 1 1 -7  10  18 o 6  5.79204e+00 1.74757e+00 4.97576e+01 353.357 2.92114e+00  -3.40194e-01 0.00000e+00 0.00000e+00 1.23570e+02 353.357 7.38126e+01 353.357 0.8055 
1 1 1 -7  10  19 o 10 4.18327e+00 1.45398e+00 1.08989e+02 111.815 -2.39372e+00 5.98013e+00  0.00000e+00 0.00000e+00 3.35866e+01 111.815 7.54024e+01 291.815 0.9187 
1 1 1 -7  11  1  o 16 1.38488e+01 4.67407e-01 2.86691e+02 253.434 -1.01815e+00 -3.42269e+00 0.00000e+00 0.00000e+00 1.54317e+02 253.434 1.32374e+02 73.434  0.8447 
1 1 1 -7  11  2  o 3  2.08412e+01 5.28333e-01 3.40495e+02 324.207 6.09794e+00  -4.39683e+00 0.00000e+00 0.00000e+00 3.90612e+02 324.207 5.01168e+01 324.207 0.9309 
1 1 1 -7  11  3  o 13 1.26709e+01 7.28715e-01 2.33946e+02 269.786 -1.32856e-02 -3.55642e+00 0.00000e+00 0.00000e+00 1.68878e+02 269.786 6.50687e+01 89.786  0.8440 
1 1 1 -7  11  4  o 19 3.54758e+01 7.45848e-01 6.66686e+02 258.986 -5.89247e+00 -3.02759e+01 0.00000e+00 0.00000e+00 6.47103e+02 258.986 1.95831e+01 78.986  0.9837 
1 1 1 -7  11  5  o 4  4.02812e+01 1.16981e+00 5.54261e+02 336.001 2.59071e+01  -1.15341e+01 0.00000e+00 0.00000e+00 9.34468e+02 336.001 3.80207e+02 336.001 0.9822 
1 1 1 -7  11  6  o 1  9.11326e+00 5.46013e-01 2.10282e+02 52.344  1.86528e+00  2.41724e+00  0.00000e+00 0.00000e+00 6.86238e+01 52.344  1.41658e+02 232.344 0.8138 
1 1 1 -7  11  7  o 19 6.63075e+01 1.30678e+00 1.16826e+03 255.167 -3.23720e+01 -1.22235e+02 0.00000e+00 0.00000e+00 1.31364e+03 255.167 1.45382e+02 255.167 0.9960 
1 1 1 -7  11  8  o 4  2.04721e+01 5.26832e-01 2.87550e+02 328.703 1.23482e+01  -7.50679e+00 0.00000e+00 0.00000e+00 4.54108e+02 328.703 1.66558e+02 328.703 0.9648 
1 1 1 -7  11  9  o 8  1.46127e+01 5.73748e-01 2.77723e+02 188.274 -1.21422e+01 -1.76571e+00 0.00000e+00 0.00000e+00 2.47721e+02 188.274 3.00019e+01 8.274   0.9583 
1 1 1 -7  11  10 o 11 1.35737e+01 5.24150e-01 2.49173e+02 204.242 -1.09753e+01 -4.94212e+00 0.00000e+00 0.00000e+00 2.38069e+02 204.242 1.11043e+01 24.242  0.9575 
1 1 1 -7  11  11 o 8  1.69366e+01 5.12040e-01 2.58367e+02 109.756 -7.02889e+00 1.95710e+01  0.00000e+00 0.00000e+00 3.60536e+02 109.756 1.02169e+02 109.756 0.9757 
1 1 1 -7  11  12 o 14 1.52985e+01 4.45169e-01 2.76025e+02 299.262 1.43775e+01  -2.56606e+01 0.00000e+00 0.00000e+00 2.86589e+02 299.262 1.05639e+01 299.262 0.9829 
1 1 1 -7  11  13 o 17 1.80628e+01 4.55331e-01 3.53485e+02 106.239 -1.58713e+01 5.44893e+01  0.00000e+00 0.00000e+00 3.15698e+02 106.239 3.77875e+01 286.239 0.9912 
1 1 1 -7  11  14 o 7  5.93494e+00 7.09267e-01 9.71436e+01 336.812 5.48236e+00  -2.34837e+00 0.00000e+00 0.00000e+00 1.04904e+02 336.812 7.76014e+00 336.812 0.9118 
1 1 1 -7  11  15 o 8  8.33241e+00 8.26573e-01 1.12751e+02 330.414 9.87501e+00  -5.60660e+00 0.00000e+00 0.00000e+00 1.83978e+02 330.414 7.12269e+01 330.414 0.9549 
1 1 1 -7  11  16 o 16 6.68277e+00 8.62343e-01 1.47171e+02 201.923 -1.32297e+01 -5.32438e+00 0.00000e+00 0.00000e+00 9.28528e+01 201.923 5.43185e+01 21.923  0.9643 
1 1 1 -7  11  17 o 11 1.07483e+01 1.63099e+00 2.37803e+02 336.436 2.36726e+01  -1.03243e+01 0.00000e+00 0.00000e+00 1.54208e+02 336.436 8.35948e+01 156.436 0.9804 
1 1 1 -7  11  18 o 1  5.03964e+00 1.62330e+00 6.67538e+01 312.305 2.50898e+00  -2.75687e+00 0.00000e+00 0.00000e+00 9.27875e+01 312.305 2.60337e+01 312.305 0.8522 
1 1 1 -7  11  19 o 3  4.58975e+00 1.57275e+00 1.06553e+02 190.367 -6.20961e+00 -1.13602e+00 0.00000e+00 0.00000e+00 4.95728e+01 190.367 5.69803e+01 10.367  0.9170 
1 1 1 -7  12  1  o 18 1.19374e+01 4.73355e-01 3.91906e+02 195.930 -4.81122e+00 -1.37320e+00 0.00000e+00 0.00000e+00 1.01518e+01 195.930 3.81754e+02 15.930  0.8935 
1 1 1 -7  12  2  o 6  1.98654e+01 5.16170e-01 2.63419e+02 306.963 3.32006e+00  -4.41176e+00 0.00000e+00 0.00000e+00 4.13464e+02 306.963 1.50045e+02 306.963 0.9042 
1 1 1 -7  12  3  o 18 2.70992e+01 6.14834e-01 5.43419e+02 13.675  1.71601e+01  4.17514e+00  0.00000e+00 0.00000e+00 4.47977e+02 13.675  9.54417e+01 193.675 0.9713 
1 1 1 -7  12  4  o 6  2.77033e+01 6.23921e-01 5.60382e+02 291.809 7.52906e+00  -1.88149e+01 0.00000e+00 0.00000e+00 4.56514e+02 291.809 1.03868e+02 111.810 0.9750 
1 1 1 -7  12  5  o 7  3.29552e+01 7.04349e-01 6.25871e+02 248.808 -9.65069e+00 -2.48918e+01 0.00000e+00 0.00000e+00 5.90674e+02 248.808 3.51973e+01 68.808  0.9811 
1 1 1 -7  12  6  o 18 1.53522e+01 5.05833e-01 3.39452e+02 10.139  8.16370e+00  1.45993e+00  0.00000e+00 0.00000e+00 2.01829e+02 10.139  1.37623e+02 190.139 0.9376 
1 1 1 -7  12  7  o 14 3.05736e+01 6.83406e-01 6.91503e+02 317.955 2.68735e+01  -2.42353e+01 0.00000e+00 0.00000e+00 4.41403e+02 317.955 2.50100e+02 137.955 0.9861 
1 1 1 -7  12  8  o 6  3.02973e+01 6.25762e-01 4.40036e+02 181.908 -3.24915e+01 -1.08255e+00 0.00000e+00 0.00000e+00 6.79993e+02 181.908 2.39957e+02 181.908 0.9845 
1 1 1 -7  12  9  o 7  2.39090e+01 6.09101e-01 3.37853e+02 314.406 1.70248e+01  -1.73817e+01 0.00000e+00 0.00000e+00 5.40582e+02 314.406 2.02729e+02 314.406 0.9792 
1 1 1 -7  12  10 f 0  1.57068e+01 5.21958e-01 2.11670e+02 127.512 -7.01732e+00 9.14132e+00  0.00000e+00 0.00000e+00 3.50983e+02 127.512 1.39313e+02 127.512 0.9556 
1 1 1 -7  12  11 o 6  2.06760e+01 4.90535e-01 3.60312e+02 307.079 2.13576e+01  -2.82610e+01 0.00000e+00 0.00000e+00 4.03057e+02 307.079 4.27450e+01 307.079 0.9858 
1 1 1 -7  12  12 o 13 1.27896e+01 4.43447e-01 1.87539e+02 94.220  -1.22834e+00 1.66472e+01  0.00000e+00 0.00000e+00 2.76434e+02 94.220  8.88948e+01 94.220  0.9696 
1 1 1 -7  12  13 o 10 1.34165e+01 4.27591e-01 1.65335e+02 62.426  9.15572e+00  1.75324e+01  0.00000e+00 0.00000e+00 3.23290e+02 62.426  1.57955e+02 62.426  0.9744 
1 1 1 -7  12  14 o 10 9.79197e+00 5.28176e-01 1.21577e+02 159.669 -1.20616e+01 4.46907e+00  0.00000e+00 0.00000e+00 2.29501e+02 159.669 1.07924e+02 159.669 0.9603 
1 1 1 -7  12  15 o 1  7.49287e+00 6.85665e-01 1.03899e+02 236.339 -5.86576e+00 -8.80827e+00 0.00000e+00 0.00000e+00 1.61977e+02 236.339 5.80772e+01 236.339 0.9515 
1 1 1 -7  12  16 o 12 5.95493e+00 8.66058e-01 8.33261e+01 309.067 4.52451e+00  -5.57394e+00 0.00000e+00 0.00000e+00 1.22388e+02 309.067 3.90621e+01 309.067 0.9275 
1 1 1 -7  12  17 o 8  6.44853e+00 1.66890e+00 1.16292e+02 54.711  4.27530e+00  6.04061e+00  0.00000e+00 0.00000e+00 1.06731e+02 54.711  9.56107e+00 234.711 0.9298 
1 1 1 -7  12  18 o 10 6.33152e+00 1.72119e+00 9.32531e+01 220.659 -4.69258e+00 -4.03040e+00 0.00000e+00 0.00000e+00 1.21994e+02 220.659 2.87410e+01 220.659 0.9152 
1 1 1 -7  12  19 o 15 6.12774e+00 1.81975e+00 6.92360e+01 247.539 -1.74220e+00 -4.21413e+00 0.00000e+00 0.00000e+00 1.31269e+02 247.539 6.20333e+01 247.539 0.8821 
1 1 1 -7  13  1  o 14 3.08181e+01 6.72715e-01 5.86184e+02 55.512  1.08362e+01  1.57736e+01  0.00000e+00 0.00000e+00 5.44749e+02 55.512  4.14358e+01 235.512 0.9735 
1 1 1 -7  13  2  o 9  1.55843e+01 4.80680e-01 3.77743e+02 49.803  3.98506e+00  4.71616e+00  0.00000e+00 0.00000e+00 1.59573e+02 49.803  2.18170e+02 229.803 0.9150 
1 1 1 -7  13  3  o 12 2.27421e+01 5.54668e-01 3.41722e+02 117.097 -4.23478e+00 8.27647e+00  0.00000e+00 0.00000e+00 4.67390e+02 117.097 1.25668e+02 117.097 0.9446 
1 1 1 -7  13  4  o 1  2.09038e+01 5.35089e-01 3.76299e+02 49.214  6.13880e+00  7.11538e+00  0.00000e+00 0.00000e+00 3.67525e+02 49.214  8.77457e+00 229.214 0.9452 
1 1 1 -7  13  5  o 7  2.98206e+01 6.50958e-01 6.44381e+02 192.170 -2.40571e+01 -5.18804e+00 0.00000e+00 0.00000e+00 4.54596e+02 192.170 1.89785e+02 12.170  0.9795 
1 1 1 -7  13  6  o 5  2.00908e+01 6.40193e-01 3.49548e+02 98.743  -1.68659e+00 1.09668e+01  0.00000e+00 0.00000e+00 3.71018e+02 98.743  2.14699e+01 98.743  0.9538 
1 1 1 -7  13  7  o 2  4.78949e+01 9.69337e-01 9.94699e+02 182.171 -8.01856e+01 -3.04010e+00 0.00000e+00 0.00000e+00 7.93779e+02 182.171 2.00920e+02 2.171   0.9937 
1 1 1 -7  13  8  o 19 2.45366e+01 5.61666e-01 2.92240e+02 180.408 -1.75188e+01 -1.24772e-01 0.00000e+00 0.00000e+00 6.02388e+02 180.408 3.10149e+02 180.408 0.9710 
1 1 1 -7  13  9  o 4  2.89341e+01 7.40135e-01 4.28278e+02 303.260 2.02372e+01  -3.08556e+01 0.00000e+00 0.00000e+00 6.42481e+02 303.260 2.14203e+02 303.260 0.9864 
1 1 1 -7  13  10 o 4  2.69408e+01 5.87802e-01 3.22302e+02 89.502  2.59893e-01  2.99210e+01  0.00000e+00 0.00000e+00 6.70587e+02 89.502  3.48285e+02 89.502  0.9831 
1 1 1 -7  13  11 o 3  5.31586e+00 7.42499e-01 1.57767e+02 61.378  1.85626e+00  3.40149e+00  0.00000e+00 0.00000e+00 1.31580e+01 61.378  1.44609e+02 241.378 0.8585 
1 1 1 -7  13  12 o 8  1.18618e+01 4.37196e-01 2.64369e+02 285.006 5.85803e+00  -2.18527e+01 0.00000e+00 0.00000e+00 1.69518e+02 285.006 9.48513e+01 105.006 0.9776 
1 1 1 -7  13  13 o 13 1.25883e+01 5.27863e-01 1.59855e+02 268.299 -5.52730e-01 -1.86187e+01 0.00000e+00 0.00000e+00 2.97833e+02 268.299 1.37977e+02 268.299 0.9728 
1 1 1 -7  13  14 f 0  7.35029e+00 5.78189e-01 1.40305e+02 115.409 -4.72464e+00 9.94609e+00  0.00000e+00 0.00000e+00 1.21340e+02 115.409 1.89645e+01 295.409 0.9535 
1 1 1 -7  13  15 o 12 8.39125e+00 1.07857e+00 1.13674e+02 224.911 -7.80597e+00 -7.78191e+00 0.00000e+00 0.00000e+00 1.84692e+02 224.911 7.10186e+01 224.911 0.9535 
1 1 1 -7  13  16 o 6  6.75840e+00 1.25118e+00 1.61840e+02 19.512  1.22244e+01  4.33187e+00  0.00000e+00 0.00000e+00 7.99686e+01 19.512  8.18718e+01 199.512 0.9606 
1 1 1 -7  13  17 o 14 1.32036e+01 1.47253e+00 1.92563e+02 228.586 -1.87080e+01 -2.12095e+01 0.00000e+00 0.00000e+00 2.89809e+02 228.586 9.72454e+01 228.586 0.9822 
1 1 1 -7  13  18 o 5  7.61364e+00 1.63091e+00 5.25267e+01 217.982 -3.50772e+00 -2.73875e+00 0.00000e+00 0.00000e+00 1.96032e+02 217.982 1.43505e+02 217.982 0.8789 
1 1 1 -7  13  19 o 14 6.17569e+00 1.90724e+00 1.32981e+02 86.373  5.24249e-01  8.26949e+00  0.00000e+00 0.00000e+00 8.17979e+01 86.373  5.11832e+01 266.373 0.9376 
1 1 1 -7  14  1  o 10 2.05426e+01 6.18014e-01 5.13652e+02 183.652 -1.11140e+01 -7.09426e-01 0.00000e+00 0.00000e+00 2.25054e+02 183.652 2.88598e+02 3.652   0.9540 
1 1 1 -7  14  2  o 9  1.75187e+01 4.99552e-01 4.00962e+02 357.038 7.31855e+00  -3.78678e-01 0.00000e+00 0.00000e+00 2.12292e+02 357.038 1.88670e+02 177.038 0.9290 
1 1 1 -7  14  3  o 11 2.49913e+01 5.79391e-01 5.54717e+02 184.772 -1.53494e+01 -1.28134e+00 0.00000e+00 0.00000e+00 3.55459e+02 184.772 1.99259e+02 4.772   0.9670 
1 1 1 -7  14  4  o 1  3.28222e+01 7.03412e-01 5.05393e+02 349.808 1.93418e+01  -3.47715e+00 0.00000e+00 0.00000e+00 6.98339e+02 349.808 1.92945e+02 349.808 0.9742 
1 1 1 -7  14  5  o 12 3.66024e+01 7.64360e-01 6.72266e+02 277.764 4.22916e+00  -3.10166e+01 0.00000e+00 0.00000e+00 6.82687e+02 277.764 1.04215e+01 277.764 0.9839 
1 1 1 -7  14  6  o 9  3.00451e+01 6.69589e-01 7.37578e+02 9.010   3.38068e+01  5.36059e+00  0.00000e+00 0.00000e+00 3.75514e+02 9.010   3.62064e+02 189.010 0.9853 
1 1 1 -7  14  7  o 11 3.37682e+01 7.32587e-01 6.29909e+02 200.634 -3.39259e+01 -1.27750e+01 0.00000e+00 0.00000e+00 6.21315e+02 200.634 8.59379e+00 20.634  0.9861 
1 1 1 -7  14  8  o 14 1.29585e+01 5.32802e-01 1.07060e+02 345.873 3.28640e+00  -8.27118e-01 0.00000e+00 0.00000e+00 2.99255e+02 345.873 1.92195e+02 345.873 0.8351 
1 1 1 -7  14  9  o 17 2.96857e+01 7.03829e-01 3.72922e+02 241.595 -1.57021e+01 -2.90347e+01 0.00000e+00 0.00000e+00 7.23803e+02 241.595 3.50881e+02 241.595 0.9847 
1 1 1 -7  14  10 f 0  2.27818e+01 5.49022e-01 4.71930e+02 112.691 -1.43155e+01 3.42381e+01  0.00000e+00 0.00000e+00 3.70460e+02 112.691 1.01470e+02 292.691 0.9864 
1 1 1 -7  14  11 f 0  1.92410e+01 4.70611e-01 4.14076e+02 208.270 -3.59374e+01 -1.93261e+01 0.00000e+00 0.00000e+00 2.97623e+02 208.270 1.16453e+02 28.270  0.9877 
1 1 1 -7  14  12 o 8  1.94745e+01 4.53168e-01 3.55978e+02 165.346 -4.82440e+01 1.26155e+01  0.00000e+00 0.00000e+00 3.65287e+02 165.346 9.30954e+00 165.346 0.9899 
1 1 1 -7  14  13 o 17 1.68906e+01 4.27083e-01 2.36988e+02 317.013 2.75292e+01  -2.56597e+01 0.00000e+00 0.00000e+00 3.85844e+02 317.013 1.48856e+02 317.013 0.9866 
1 1 1 -7  14  14 o 7  1.46381e+01 5.01989e-01 2.68150e+02 159.440 -4.22771e+01 1.58570e+01  0.00000e+00 0.00000e+00 2.72249e+02 159.440 4.09928e+00 159.440 0.9889 
1 1 1 -7  14  15 o 4  1.00834e+01 9.32243e-01 1.51746e+02 56.576  1.03917e+01  1.57451e+01  0.00000e+00 0.00000e+00 2.14152e+02 56.576  6.24065e+01 56.576  0.9731 
1 1 1 -7  14  16 o 9  9.06596e+00 1.15194e+00 1.68381e+02 142.383 -1.52126e+01 1.17223e+01  0.00000e+00 0.00000e+00 1.60357e+02 142.383 8.02346e+00 322.383 0.9736 
1 1 1 -7  14  17 o 19 8.04578e+00 1.67950e+00 1.29406e+02 180.052 -1.07321e+01 -9.72418e-03 0.00000e+00 0.00000e+00 1.55558e+02 180.052 2.61521e+01 180.052 0.9522 
1 1 1 -7  14  18 o 6  5.04503e+00 1.58395e+00 5.47372e+01 0.877   3.17015e+00  4.85340e-02  0.00000e+00 0.00000e+00 9.92756e+01 0.877   4.45384e+01 0.877   0.8218 
1 1 1 -7  14  19 o 12 4.13271e+00 1.44618e+00 1.87375e+01 337.077 1.01345e+00  -4.28584e-01 0.00000e+00 0.00000e+00 5.49692e+01 337.077 3.62317e+01 337.077 0.4808 
1 1 1 -7  15  1  o 9  3.06549e+01 6.73058e-01 5.81508e+02 62.988  8.47026e+00  1.66153e+01  0.00000e+00 0.00000e+00 5.42539e+02 62.988  3.89691e+01 242.988 0.9728 
1 1 1 -7  15  2  o 2  6.23484e+00 5.87142e-01 1.84268e+02 334.228 1.07188e+00  -5.17526e-01 0.00000e+00 0.00000e+00 6.45150e+01 154.228 2.48783e+02 154.228 0.5098 
1 1 1 -7  15  3  o 11 2.68455e+01 6.06692e-01 6.65101e+02 188.519 -1.95215e+01 -2.92429e+00 0.00000e+00 0.00000e+00 3.20006e+02 188.519 3.45095e+02 8.519   0.9743 
1 1 1 -7  15  4  o 12 2.61284e+01 6.00482e-01 3.96841e+02 101.950 -2.54135e+00 1.20071e+01  0.00000e+00 0.00000e+00 5.45762e+02 101.950 1.48921e+02 101.950 0.9584 
1 1 1 -7  15  5  o 2  2.08120e+01 5.40422e-01 4.13800e+02 186.997 -1.09183e+01 -1.34006e+00 0.00000e+00 0.00000e+00 3.32713e+02 186.997 8.10869e+01 6.997   0.9534 
1 1 1 -7  15  6  o 1  2.96240e+01 6.58114e-01 5.23677e+02 144.143 -1.93795e+01 1.40062e+01  0.00000e+00 0.00000e+00 5.66619e+02 144.143 4.29415e+01 144.143 0.9789 
1 1 1 -7  15  7  o 3  1.62885e+01 4.93794e-01 2.49424e+02 302.360 4.58481e+00  -7.23565e+00 0.00000e+00 0.00000e+00 3.25679e+02 302.360 7.62551e+01 302.360 0.9397 
1 1 1 -7  15  8  o 4  2.37344e+01 5.55723e-01 4.34803e+02 67.032  9.69255e+00  2.28692e+01  0.00000e+00 0.00000e+00 4.38201e+02 67.032  3.39836e+00 67.032  0.9797 
1 1 1 -7  15  9  o 19 3.69406e+01 7.18023e-01 7.26935e+02 204.017 -6.96940e+01 -3.10550e+01 0.00000e+00 0.00000e+00 6.49812e+02 204.017 7.71232e+01 24.017  0.9934 
1 1 1 -7  15  10 o 1  1.15551e+01 5.40320e-01 1.70892e+02 306.644 4.62825e+00  -6.22195e+00 0.00000e+00 0.00000e+00 2.33255e+02 306.644 6.23624e+01 306.644 0.9331 
1 1 1 -7  15  11 o 14 1.95111e+01 5.40579e-01 1.35491e+02 293.209 5.29035e+00  -1.23378e+01 0.00000e+00 0.00000e+00 5.67415e+02 293.209 4.31924e+02 293.209 0.9620 
1 1 1 -7  15  12 o 15 1.80525e+01 4.43964e-01 3.23457e+02 289.776 1.42105e+01  -3.95235e+01 0.00000e+00 0.00000e+00 3.43834e+02 289.776 2.03778e+01 289.776 0.9880 
1 1 1 -7  15  13 f 0  5.46318e+00 5.14419e-01 1.98472e+02 2.987   1.00221e+01  5.22875e-01  0.00000e+00 0.00000e+00 4.75304e+00 182.986 2.03225e+02 182.986 0.9488 
1 1 1 -7  15  14 o 3  9.66912e+00 6.80161e-01 1.55453e+02 124.764 -9.42418e+00 1.35779e+01  0.00000e+00 0.00000e+00 1.94415e+02 124.764 3.89620e+01 124.764 0.9693 
1 1 1 -7  15  15 o 11 3.95571e+00 1.05550e+00 5.09355e+01 58.365  1.24035e+00  2.01337e+00  0.00000e+00 0.00000e+00 5.96088e+01 58.365  8.67334e+00 58.365  0.7495 
1 1 1 -7  15  16 o 15 1.02382e+01 1.11349e+00 1.50255e+02 283.325 4.55060e+00  -1.92136e+01 0.00000e+00 0.00000e+00 2.21252e+02 283.325 7.09974e+01 283.325 0.9743 
1 1 1 -7  15  17 o 13 5.59104e+00 1.56973e+00 8.40169e+01 225.856 -3.61806e+00 -3.72784e+00 0.00000e+00 0.00000e+00 1.02666e+02 225.856 1.86495e+01 225.856 0.8977 
1 1 1 -7  15  18 f 0  7.43177e+00 1.77329e+00 6.80637e+01 326.735 4.31651e+00  -2.83159e+00 0.00000e+00 0.00000e+00 1.79553e+02 326.735 1.11490e+02 326.735 0.8970 
1 1 1 -7  15  19 o 3  7.03834e+00 2.02151e+00 4.45784e+01 271.130 5.76257e-02  -2.92062e+00 0.00000e+00 0.00000e+00 1.65312e+02 271.130 1.20733e+02 271.130 0.8040 
1 1 1 -7  16  1  o 10 2.68736e+01 5.85198e-01 3.85349e+02 120.615 -5.49796e+00 9.29102e+00  0.00000e+00 0.00000e+00 5.79428e+02 120.615 1.94079e+02 120.615 0.9525 
1 1 1 -7  16  2  o 2  2.10594e+01 5.34107e-01 3.43002e+02 266.864 -4.76225e-01 -8.69338e+00 0.00000e+00 0.00000e+00 4.03388e+02 266.864 6.03858e+01 266.864 0.9407 
1 1 1 -7  16  3  o 9  1.93001e+01 5.10473e-01 2.67022e+02 118.751 -2.73451e+00 4.98413e+00  0.00000e+00 0.00000e+00 3.92355e+02 118.751 1.25333e+02 118.751 0.9072 
1 1 1 -7  16  4  o 17 1.35356e+01 4.75602e-01 3.39857e+02 213.683 -4.73419e+00 -3.15526e+00 0.00000e+00 0.00000e+00 1.22389e+02 213.683 2.17467e+02 33.683  0.9072 
1 1 1 -7  16  5  o 18 1.45088e+01 7.41617e-01 2.50088e+02 194.877 -4.62507e+00 -1.22863e+00 0.00000e+00 0.00000e+00 2.34699e+02 194.877 1.53896e+01 14.877  0.8882 
1 1 1 -7  16  6  f 0  3.72675e+01 7.80564e-01 6.51738e+02 275.348 3.46211e+00  -3.69857e+01 0.00000e+00 0.00000e+00 7.30443e+02 275.348 7.87053e+01 275.348 0.9864 
1 1 1 -7  16  7  o 5  1.97497e+01 5.10667e-01 4.19835e+02 130.872 -1.14075e+01 1.31820e+01  0.00000e+00 0.00000e+00 3.00596e+02 130.872 1.19239e+02 310.872 0.9709 
1 1 1 -7  16  8  o 15 6.33249e+01 1.12596e+00 1.20693e+03 264.904 -1.56411e+01 -1.75382e+02 0.00000e+00 0.00000e+00 1.16380e+03 264.904 4.31329e+01 84.904  0.9972 
1 1 1 -7  16  9  o 4  6.35289e+00 7.96383e-01 1.58044e+02 97.371  -3.63041e-01 2.80629e+00  0.00000e+00 0.00000e+00 3.17957e+01 97.371  1.26248e+02 277.371 0.7966 
1 1 1 -7  16  10 f 0  1.49465e+01 5.13491e-01 1.00342e+02 199.854 -5.54271e+00 -2.00143e+00 0.00000e+00 0.00000e+00 4.09834e+02 199.854 3.09491e+02 199.854 0.9107 
1 1 1 -7  16  11 o 2  2.82785e+01 6.01344e-01 4.35403e+02 235.022 -3.55406e+01 -5.07987e+01 0.00000e+00 0.00000e+00 6.14974e+02 235.022 1.79571e+02 235.022 0.9919 
1 1 1 -7  16  12 o 8  1.43483e+01 4.07901e-01 2.62938e+02 175.322 -2.87332e+01 2.35127e+00  0.00000e+00 0.00000e+00 2.64445e+02 175.322 1.50710e+00 175.322 0.9825 
1 1 1 -7  16  13 o 6  9.47218e+00 3.79079e-01 1.90960e+02 236.969 -9.31981e+00 -1.43342e+01 0.00000e+00 0.00000e+00 1.52515e+02 236.969 3.84443e+01 56.969  0.9703 
1 1 1 -7  16  14 o 15 3.96507e+00 1.04640e+00 8.41234e+01 293.186 1.27711e+00  -2.98174e+00 0.00000e+00 0.00000e+00 3.82126e+01 293.186 4.59108e+01 113.186 0.8265 
1 1 1 -7  16  15 o 18 7.74576e+00 1.10395e+00 8.80385e+01 86.736  4.45283e-01  7.80788e+00  0.00000e+00 0.00000e+00 1.81621e+02 86.736  9.35824e+01 86.736  0.9337 
1 1 1 -7  16  16 o 15 1.06490e+01 1.15425e+00 1.91532e+02 359.020 2.55937e+01  -4.37912e-01 0.00000e+00 0.00000e+00 1.97217e+02 359.020 5.68559e+00 359.020 0.9803 
1 1 1 -7  16  17 o 15 5.81353e+00 1.57798e+00 1.88397e+02 152.750 -1.07057e+01 5.51385e+00  0.00000e+00 0.00000e+00 1.86411e+01 152.750 1.69756e+02 332.750 0.9575 
1 1 1 -7  16  18 o 4  8.36200e+00 1.78422e+00 1.43895e+02 41.701  9.09795e+00  8.10619e+00  0.00000e+00 0.00000e+00 1.53658e+02 41.701  9.76322e+00 41.701  0.9580 
1 1 1 -7  16  19 f 0  4.66244e+00 1.59121e+00 4.13828e+01 316.661 1.78508e+00  -1.68448e+00 0.00000e+00 0.00000e+00 9.00335e+01 316.661 4.86507e+01 316.661 0.7599 
1 1 1 -7  17  1  o 4  1.73272e+01 4.77915e-01 2.81670e+02 260.431 -8.42732e-01 -4.99922e+00 0.00000e+00 0.00000e+00 3.02796e+02 260.431 2.11260e+01 260.431 0.8950 
1 1 1 -7  17  2  o 5  2.41105e+01 5.43887e-01 5.00550e+02 265.744 -1.07333e+00 -1.44235e+01 0.00000e+00 0.00000e+00 3.75831e+02 265.744 1.24719e+02 85.744  0.9648 
1 1 1 -7  17  3  o 16 4.15088e+01 7.97486e-01 8.82680e+02 51.175  3.00027e+01  3.72819e+01  0.00000e+00 0.00000e+00 6.64073e+02 51.175  2.18607e+02 231.174 0.9895 
1 1 1 -7  17  4  o 19 1.85459e+01 5.02698e-01 4.97963e+02 336.705 1.04439e+01  -4.49674e+00 0.00000e+00 0.00000e+00 1.68667e+02 336.705 3.29296e+02 156.705 0.9550 
1 1 1 -7  17  5  f 0  1.98068e+01 6.17024e-01 3.16196e+02 215.745 -6.70982e+00 -4.82955e+00 0.00000e+00 0.00000e+00 3.82285e+02 215.745 6.60888e+01 215.745 0.9374 
1 1 1 -7  17  6  o 3  1.71533e+01 5.20213e-01 1.89237e+02 82.604  7.92533e-01  6.10521e+00  0.00000e+00 0.00000e+00 4.00664e+02 82.604  2.11427e+02 82.604  0.9147 
1 1 1 -7  17  7  o 6  5.50027e+01 9.89911e-01 9.84063e+02 81.298  1.67051e+01  1.09141e+02  0.00000e+00 0.00000e+00 1.07303e+03 81.298  8.89715e+01 81.298  0.9955 
1 1 1 -7  17  8  o 4  1.57515e+01 6.88028e-01 4.59935e+02 193.192 -1.87557e+01 -4.39634e+00 0.00000e+00 0.00000e+00 1.15858e+02 193.192 3.44078e+02 13.192  0.9737 
1 1 1 -7  17  9  o 1  8.88092e+00 8.87202e-01 1.47927e+02 235.360 -2.34218e+00 -3.39013e+00 0.00000e+00 0.00000e+00 1.41244e+02 235.360 6.68261e+00 55.360  0.8680 
1 1 1 -7  17  10 o 3  2.84287e+01 6.62532e-01 3.77273e+02 82.747  5.24470e+00  4.12079e+01  0.00000e+00 0.00000e+00 6.75337e+02 82.747  2.98063e+02 82.747  0.9879 
1 1 1 -7  17  11 o 8  3.46782e+01 6.62976e-01 6.73807e+02 233.825 -7.41003e+01 -1.01339e+02 0.00000e+00 0.00000e+00 6.19558e+02 233.825 5.42491e+01 53.825  0.9960 
1 1 1 -7  17  12 o 14 1.13504e+01 4.30949e-01 2.06404e+02 292.701 6.87943e+00  -1.64448e+01 0.00000e+00 0.00000e+00 2.06113e+02 292.701 2.91467e-01 112.701 0.9715 
1 1 1 -7  17  13 o 7  1.97412e+01 4.46679e-01 3.31734e+02 281.648 1.23629e+01  -5.99699e+01 0.00000e+00 0.00000e+00 3.99938e+02 281.648 6.82042e+01 281.648 0.9918 
1 1 1 -7  17  14 o 18 2.22360e+01 8.37927e-01 3.78951e+02 91.212  -1.75704e+00 8.30500e+01  0.00000e+00 0.00000e+00 4.46069e+02 91.212  6.71183e+01 91.212  0.9940 
1 1 1 -7  17  15 o 13 5.49409e+00 1.09368e+00 1.02825e+02 81.138  1.00244e+00  6.42906e+00  0.00000e+00 0.00000e+00 8.55459e+01 81.138  1.72792e+01 261.138 0.9196 
1 1 1 -7  17  16 o 15 9.56066e+00 1.19060e+00 2.17876e+02 148.464 -2.18727e+01 1.34223e+01  0.00000e+00 0.00000e+00 1.31146e+02 148.464 8.67297e+01 328.464 0.9803 
1 1 1 -7  17  17 o 5  7.89655e+00 1.58823e+00 1.05428e+02 65.355  3.90221e+00  8.50540e+00  0.00000e+00 0.00000e+00 1.72086e+02 65.355  6.66585e+01 65.355  0.9450 
1 1 1 -7  17  18 o 8  5.02493e+00 1.63244e+00 8.90698e+01 157.491 -4.63756e+00 1.92180e+00  0.00000e+00 0.00000e+00 7.77478e+01 157.491 1.13220e+01 337.491 0.8938 
1 1 1 -7  17  19 o 15 5.52050e+00 1.75413e+00 1.06774e+02 306.736 4.10851e+00  -5.50472e+00 0.00000e+00 0.00000e+00 8.24184e+01 306.736 2.43558e+01 126.736 0.9240 
1 1 1 -7  18  1  f 0  1.62449e+01 4.72861e-01 2.89255e+02 288.582 1.80674e+00  -5.37416e+00 0.00000e+00 0.00000e+00 2.65978e+02 288.582 2.32765e+01 108.582 0.9069 
1 1 1 -7  18  2  o 15 1.11845e+01 4.45009e-01 2.14713e+02 267.476 -1.17872e-01 -2.67392e+00 0.00000e+00 0.00000e+00 1.15171e+02 267.476 9.95415e+01 87.476  0.7829 
1 1 1 -7  18  3  o 9  3.15091e+01 8.57747e-01 3.41300e+02 74.891  3.63470e+00  1.34620e+01  0.00000e+00 0.00000e+00 8.01867e+02 74.891  4.60567e+02 74.891  0.9634 
1 1 1 -7  18  4  o 10 3.28223e+01 6.64401e-01 6.64195e+02 140.137 -2.04342e+01 1.70631e+01  0.00000e+00 0.00000e+00 5.47754e+02 140.137 1.16440e+02 320.137 0.9810 
1 1 1 -7  18  5  o 19 3.30043e+01 6.69925e-01 5.07478e+02 267.073 -1.12306e+00 -2.19686e+01 0.00000e+00 0.00000e+00 7.05502e+02 267.073 1.98023e+02 267.073 0.9770 
1 1 1 -7  18  6  o 10 2.74316e+01 5.97207e-01 3.16033e+02 79.523  2.97130e+00  1.60684e+01  0.00000e+00 0.00000e+00 6.83164e+02 79.523  3.67131e+02 79.523  0.9689 
1 1 1 -7  18  7  o 15 1.05906e+01 5.04116e-01 2.43054e+02 86.947  2.87427e-01  5.38983e+00  0.00000e+00 0.00000e+00 1.15769e+02 86.947  1.27285e+02 266.947 0.9019 
1 1 1 -7  18  8  o 11 1.83069e+01 4.88641e-01 3.56946e+02 235.594 -9.91741e+00 -1.44807e+01 0.00000e+00 0.00000e+00 3.10437e+02 235.594 4.65089e+01 55.594  0.9711 
1 1 1 -7  18  9  f 0  1.11081e+01 6.61898e-01 2.29439e+02 109.543 -2.72471e+00 7.67613e+00  0.00000e+00 0.00000e+00 1.60748e+02 109.543 6.86913e+01 289.543 0.9364 
1 1 1 -7  18  10 o 2  1.24990e+01 5.43467e-01 2.60742e+02 262.057 -1.94037e+00 -1.39068e+01 0.00000e+00 0.00000e+00 1.90698e+02 262.057 7.00442e+01 82.057  0.9637 
1 1 1 -7  18  11 o 9  1.61589e+01 4.82968e-01 1.26514e+02 194.843 -1.08230e+01 -2.86833e+00 0.00000e+00 0.00000e+00 4.50851e+02 194.843 3.24337e+02 194.843 0.9542 
1 1 1 -7  18  12 o 4  7.94538e+00 4.85323e-01 9.83485e+01 238.151 -3.11035e+00 -5.00691e+00 0.00000e+00 0.00000e+00 1.72319e+02 238.151 7.39701e+01 238.151 0.9107 
1 1 1 -7  18  13 o 10 1.49717e+01 5.94866e-01 2.29320e+02 140.146 -2.39691e+01 2.00086e+01  0.00000e+00 0.00000e+00 3.21108e+02 140.146 9.17874e+01 140.146 0.9839 
1 1 1 -7  18  14 o 14 9.43064e+00 9.13793e-01 6.65791e+01 116.022 -2.64756e+00 5.42314e+00  0.00000e+00 0.00000e+00 2.54773e+02 116.022 1.88194e+02 116.022 0.9129 
1 1 1 -7  18  15 o 3  5.93810e+00 1.25452e+00 1.31443e+02 132.677 -5.80501e+00 6.29597e+00  0.00000e+00 0.00000e+00 7.65886e+01 132.677 5.48542e+01 312.677 0.9397 
1 1 1 -7  18  16 o 4  4.96769e+00 1.20487e+00 7.80720e+01 20.919  4.42454e+00  1.69124e+00  0.00000e+00 0.00000e+00 8.59884e+01 20.919  7.91643e+00 20.919  0.8869 
1 1 1 -7  18  17 o 9  7.09227e+00 1.65055e+00 8.83602e+01 331.932 5.96169e+00  -3.17902e+00 0.00000e+00 0.00000e+00 1.55008e+02 331.932 6.66480e+01 331.932 0.9227 
1 1 1 -7  18  18 o 16 6.88113e+00 1.89460e+00 3.37149e+01 225.837 -1.55591e+00 -1.60206e+00 0.00000e+00 0.00000e+00 1.53504e+02 225.837 1.19789e+02 225.837 0.7326 
1 1 1 -7  18  19 o 3  6.17919e+00 1.86322e+00 4.87846e+01 317.487 2.38518e+00  -2.18657e+00 0.00000e+00 0.00000e+00 1.40507e+02 317.487 9.17224e+01 317.487 0.8260 
1 1 1 -7  19  1  o 1  7.95677e+00 4.96888e-01 4.00907e+02 296.532 1.70798e+00  -3.42091e+00 0.00000e+00 0.00000e+00 1.44117e+02 116.532 5.45025e+02 116.532 0.8564 
1 1 1 -7  19  2  o 16 1.76392e+01 6.10997e-01 3.01927e+01 65.128  2.47379e-01  5.33625e-01  0.00000e+00 0.00000e+00 1.57237e+02 65.128  1.27044e+02 65.128  0.2821 
1 1 1 -7  19  3  o 8  3.08800e+01 8.40159e-01 6.28970e+02 284.410 5.72127e+00  -2.22669e+01 0.00000e+00 0.00000e+00 5.08244e+02 284.410 1.20726e+02 104.410 0.9780 
1 1 1 -7  19  4  o 4  2.75043e+01 7.82099e-01 3.12116e+02 211.277 -9.50678e+00 -5.77492e+00 0.00000e+00 0.00000e+00 6.75360e+02 211.277 3.63244e+02 211.277 0.9539 
1 1 1 -7  19  5  o 2  1.76187e+01 4.80721e-01 1.67086e+02 311.913 2.68168e+00  -2.98743e+00 0.00000e+00 0.00000e+00 4.05570e+02 311.913 2.38484e+02 311.913 0.8641 
1 1 1 -7  19  6  o 18 2.06059e+01 6.68972e-01 2.19478e+02 137.113 -5.81168e+00 5.39800e+00  0.00000e+00 0.00000e+00 5.04527e+02 137.113 2.85049e+02 137.113 0.9347 
1 1 1 -7  19  7  o 14 4.63897e+01 8.10552e-01 7.43202e+02 40.503  5.39893e+01  4.61166e+01  0.00000e+00 0.00000e+00 9.87192e+02 40.503  2.43990e+02 40.503  0.9929 
1 1 1 -7  19  8  o 10 1.28183e+01 5.08267e-01 2.37468e+02 169.015 -8.00353e+00 1.55352e+00  0.00000e+00 0.00000e+00 2.13161e+02 169.015 2.43069e+01 349.015 0.9365 
1 1 1 -7  19  9  o 5  2.30813e+01 5.38327e-01 4.03457e+02 69.319  1.05833e+01  2.80355e+01  0.00000e+00 0.00000e+00 4.47727e+02 69.319  4.42695e+01 69.319  0.9832 
1 1 1 -7  19  10 o 3  2.14856e+01 6.38069e-01 3.01763e+02 254.342 -7.45715e+00 -2.66039e+01 0.00000e+00 0.00000e+00 4.88734e+02 254.342 1.86971e+02 254.342 0.9817 
1 1 1 -7  19  11 o 4  1.06261e+01 6.29883e-01 2.17059e+02 142.036 -1.07824e+01 8.41329e+00  0.00000e+00 0.00000e+00 1.65968e+02 142.036 5.10913e+01 322.036 0.9627 
1 1 1 -7  19  12 o 13 8.69344e+00 3.93131e-01 6.68421e+01 270.738 5.75158e-02  -4.46392e+00 0.00000e+00 0.00000e+00 2.19078e+02 270.738 1.52236e+02 270.738 0.8793 
1 1 1 -7  19  13 o 17 1.42251e+01 5.26522e-01 2.27732e+02 12.508  2.91449e+01  6.46572e+00  0.00000e+00 0.00000e+00 2.94823e+02 12.508  6.70912e+01 12.508  0.9831 
1 1 1 -7  19  14 o 13 8.69361e+00 9.81915e-01 1.45924e+02 186.951 -1.27438e+01 -1.55361e+00 0.00000e+00 0.00000e+00 1.65656e+02 186.951 1.97320e+01 186.951 0.9602 
1 1 1 -7  19  15 o 14 1.11909e+01 9.88803e-01 1.64705e+02 25.373  2.07961e+01  9.86288e+00  0.00000e+00 0.00000e+00 2.43336e+02 25.373  7.86307e+01 25.373  0.9780 
1 1 1 -7  19  16 f 0  1.07347e+01 1.11757e+00 1.54200e+02 37.578  1.67800e+01  1.29120e+01  0.00000e+00 0.00000e+00 2.35951e+02 37.578  8.17514e+01 37.578  0.9761 
1 1 1 -7  19  17 o 12 7.43004e+00 1.70473e+00 1.33661e+02 253.773 -2.88564e+00 -9.91493e+00 0.00000e+00 0.00000e+00 1.28901e+02 253.773 4.75993e+00 73.773  0.9503 
1 1 1 -7  19  18 o 15 4.15016e+00 1.42563e+00 6.79831e+01 152.321 -3.33076e+00 1.74717e+00  0.00000e+00 0.00000e+00 6.35880e+01 152.321 4.39502e+00 332.320 0.8537 
1 1 1 -7  19  19 o 16 4.41610e+00 1.52552e+00 7.48600e+01 119.835 -2.32319e+00 4.05082e+00  0.00000e+00 0.00000e+00 7.00945e+01 119.835 4.76550e+00 299.835 0.8851 
1 1 1 -7  20  1  o 2  1.98970e+01 4.99938e-01 2.40622e+02 139.664 -4.05709e+00 3.44507e+00  0.00000e+00 0.00000e+00 4.34460e+02 139.664 1.93838e+02 139.664 0.9004 
1 1 1 -7  20  2  o 1  2.50885e+01 6.21967e-01 4.93025e+02 352.355 1.61544e+01  -2.16826e+00 0.00000e+00 0.00000e+00 4.22578e+02 352.355 7.04472e+01 172.355 0.9688 
1 1 1 -7  20  3  o 14 1.67013e+01 4.63024e-01 3.82616e+02 196.612 -7.28931e+00 -2.17465e+00 0.00000e+00 0.00000e+00 2.03315e+02 196.612 1.79301e+02 16.612  0.9317 
1 1 1 -7  20  4  o 19 4.11548e+01 7.90820e-01 8.51702e+02 121.604 -2.37033e+01 3.85229e+01  0.00000e+00 0.00000e+00 6.79918e+02 121.604 1.71784e+02 301.604 0.9889 
1 1 1 -7  20  5  o 12 2.57233e+01 7.38328e-01 5.99648e+02 160.890 -1.96516e+01 6.80864e+00  0.00000e+00 0.00000e+00 3.44339e+02 160.890 2.55309e+02 340.890 0.9757 
1 1 1 -7  20  6  o 3  3.96760e+01 8.72553e-01 6.66695e+02 319.876 3.49974e+01  -2.94953e+01 0.00000e+00 0.00000e+00 8.08350e+02 319.876 1.41656e+02 319.876 0.9890 
1 1 1 -7  20  7  o 2  1.34253e+01 4.81704e-01 1.28915e+02 12.422  3.69300e+00  8.13416e-01  0.00000e+00 0.00000e+00 3.02055e+02 12.422  1.73141e+02 12.422  0.8546 
1 1 1 -7  20  8  o 1  1.37725e+01 6.84069e-01 2.95833e+02 117.615 -4.89632e+00 9.35969e+00  0.00000e+00 0.00000e+00 1.96031e+02 117.615 9.98020e+01 297.615 0.9514 
1 1 1 -7  20  9  o 5  3.39116e+01 6.45201e-01 5.91175e+02 211.171 -5.29824e+01 -3.20503e+01 0.00000e+00 0.00000e+00 6.70427e+02 211.171 7.92520e+01 211.171 0.9919 
1 1 1 -7  20  10 o 3  2.46213e+01 5.64519e-01 3.74569e+02 348.775 3.87055e+01  -7.68129e+00 0.00000e+00 0.00000e+00 5.36334e+02 348.775 1.61765e+02 348.775 0.9872 
1 1 1 -7  20  11 o 8  1.02872e+01 5.15021e-01 1.87871e+02 217.129 -9.25486e+00 -7.00668e+00 0.00000e+00 0.00000e+00 1.80297e+02 217.129 7.57449e+00 37.129  0.9559 
1 1 1 -7  20  12 o 7  1.18744e+01 5.35248e-01 2.08380e+02 291.164 6.72653e+00  -1.73739e+01 0.00000e+00 0.00000e+00 2.23672e+02 291.164 1.52919e+01 291.164 0.9728 
1 1 1 -7  20  13 o 4  2.47862e+01 8.39911e-01 3.38924e+02 89.526  5.95678e-01  7.20207e+01  0.00000e+00 0.00000e+00 5.80733e+02 89.526  2.41810e+02 89.526  0.9930 
1 1 1 -7  20  14 o 16 1.30971e+01 8.40113e-01 2.05086e+02 154.454 -2.57538e+01 1.23093e+01  0.00000e+00 0.00000e+00 2.75092e+02 154.454 7.00064e+01 154.454 0.9823 
1 1 1 -7  20  15 o 11 9.47180e+00 1.05338e+00 1.55205e+02 87.158  8.44287e-01  1.70055e+01  0.00000e+00 0.00000e+00 1.87363e+02 87.158  3.21575e+01 87.158  0.9702 
1 1 1 -7  20  16 o 3  5.03126e+00 1.29399e+00 8.57602e+01 267.325 -2.41655e-01 -5.17148e+00 0.00000e+00 0.00000e+00 8.23376e+01 267.325 3.42254e+00 87.325  0.8973 
1 1 1 -7  20  17 o 15 8.86568e+00 1.73139e+00 1.38361e+02 190.703 -1.18996e+01 -2.24900e+00 0.00000e+00 0.00000e+00 1.77392e+02 190.703 3.90304e+01 190.703 0.9578 
1 1 1 -7  20  18 o 10 6.70984e+00 1.85031e+00 8.04343e+01 232.200 -3.26815e+00 -4.21336e+00 0.00000e+00 0.00000e+00 1.43958e+02 232.200 6.35232e+01 232.200 0.9006 
1 1 1 -7  20  19 o 8  4.65228e+00 1.57641e+00 4.62686e+01 142.836 -2.32572e+00 1.76300e+00  0.00000e+00 0.00000e+00 9.23962e+01 142.836 4.61276e+01 142.836 0.8038 
1 1 1 -7  21  1  o 10 1.55607e+01 5.28126e-01 3.69797e+02 125.513 -3.69172e+00 5.17303e+00  0.00000e+00 0.00000e+00 1.68208e+02 125.513 2.01589e+02 305.513 0.9175 
1 1 1 -7  21  2  o 7  3.51289e+01 6.98770e-01 5.36604e+02 307.758 1.50839e+01  -1.94752e+01 0.00000e+00 0.00000e+00 7.59466e+02 307.758 2.22862e+02 307.758 0.9795 
1 1 1 -7  21  3  o 14 1.78036e+01 6.11470e-01 1.67483e+02 294.398 1.51963e+00  -3.35024e+00 0.00000e+00 0.00000e+00 4.02241e+02 294.398 2.34758e+02 294.398 0.8499 
1 1 1 -7  21  4  o 17 2.57233e+01 7.38623e-01 2.24777e+02 138.618 -5.53095e+00 4.87318e+00  0.00000e+00 0.00000e+00 6.74968e+02 138.618 4.50191e+02 138.618 0.9295 
1 1 1 -7  21  5  f 0  3.02613e+01 8.22557e-01 5.76808e+02 255.400 -6.93154e+00 -2.66104e+01 0.00000e+00 0.00000e+00 5.40471e+02 255.400 3.63366e+01 75.400  0.9816 
1 1 1 -7  21  6  o 19 4.30705e+01 7.57344e-01 8.09279e+02 249.780 -2.04844e+01 -5.56142e+01 0.00000e+00 0.00000e+00 7.95946e+02 249.780 1.33330e+01 69.780  0.9915 
1 1 1 -7  21  7  f 0  3.84806e+01 6.98837e-01 7.17366e+02 9.566   5.87075e+01  9.89353e+00  0.00000e+00 0.00000e+00 7.15876e+02 9.566   1.49011e+00 189.566 0.9916 
1 1 1 -7  21  8  o 15 3.34507e+01 6.36003e-01 6.59418e+02 118.626 -2.74441e+01 5.02818e+01  0.00000e+00 0.00000e+00 5.85140e+02 118.626 7.42781e+01 298.626 0.9912 
1 1 1 -7  21  9  o 12 1.37970e+01 6.48800e-01 2.63706e+02 279.073 1.76803e+00  -1.10710e+01 0.00000e+00 0.00000e+00 2.30101e+02 279.073 3.36048e+01 99.073  0.9543 
1 1 1 -7  21  10 o 17 2.02187e+01 5.90479e-01 2.98892e+02 221.012 -1.94223e+01 -1.68908e+01 0.00000e+00 0.00000e+00 4.43883e+02 221.012 1.44991e+02 221.012 0.9804 
1 1 1 -7  21  11 o 12 1.57558e+01 5.49556e-01 2.20803e+02 167.974 -1.95499e+01 4.16476e+00  0.00000e+00 0.00000e+00 3.54110e+02 167.974 1.33308e+02 167.974 0.9747 
1 1 1 -7  21  12 o 13 8.76062e+00 3.74005e-01 2.10139e+02 274.980 1.20455e+00  -1.38239e+01 0.00000e+00 0.00000e+00 1.05480e+02 274.980 1.04659e+02 94.980  0.9633 
1 1 1 -7  21  13 o 14 4.28697e+00 1.05092e+00 6.42335e+01 196.774 -2.23172e+00 -6.72679e-01 0.00000e+00 0.00000e+00 5.51373e+01 196.774 9.09619e+00 16.774  0.7453 
1 1 1 -7  21  14 o 6  7.38566e+00 1.03857e+00 1.74937e+02 166.780 -1.29953e+01 3.05278e+00  0.00000e+00 0.00000e+00 9.01658e+01 166.780 8.47708e+01 346.780 0.9618 
1 1 1 -7  21  15 o 3  1.30867e+01 9.91035e-01 1.75699e+02 65.842  1.11958e+01  2.49608e+01  0.00000e+00 0.00000e+00 3.03131e+02 65.842  1.27432e+02 65.842  0.9815 
1 1 1 -7  21  16 o 6  1.16966e+01 1.48713e+00 1.46915e+02 204.283 -1.67704e+01 -7.56619e+00 0.00000e+00 0.00000e+00 2.76559e+02 204.283 1.29644e+02 204.283 0.9724 
1 1 1 -7  21  17 o 1  7.72038e+00 1.56766e+00 9.28322e+01 356.140 7.83199e+00  -5.28376e-01 0.00000e+00 0.00000e+00 1.75273e+02 356.140 8.24407e+01 356.140 0.9339 
1 1 1 -7  21  18 o 16 6.07519e+00 1.76447e+00 3.94605e+01 270.123 5.39038e-03  -2.51015e+00 0.00000e+00 0.00000e+00 1.33363e+02 270.123 9.39024e+01 270.123 0.7661 
1 1 1 -7  21  19 o 3  4.57427e+00 1.55694e+00 7.66439e+01 22.395  4.56441e+00  1.88086e+00  0.00000e+00 0.00000e+00 7.46358e+01 22.395  2.00807e+00 202.395 0.8919 
1 1 1 -7  22  1  o 14 2.04795e+01 5.04245e-01 5.22470e+02 158.233 -1.31040e+01 5.23240e+00  0.00000e+00 0.00000e+00 2.21315e+02 158.233 3.01155e+02 338.233 0.9639 
1 1 1 -7  22  2  o 2  1.42583e+01 4.50704e-01 2.97599e+02 158.404 -4.72752e+00 1.87135e+00  0.00000e+00 0.00000e+00 1.83218e+02 158.404 1.14381e+02 338.404 0.8953 
1 1 1 -7  22  3  o 8  4.17117e+01 1.06050e+00 9.02046e+02 243.199 -2.04714e+01 -4.05240e+01 0.00000e+00 0.00000e+00 6.50959e+02 243.199 2.51087e+02 63.199  0.9889 
1 1 1 -7  22  4  o 10 3.31721e+01 6.66386e-01 6.10825e+02 70.715  8.51501e+00  2.43349e+01  0.00000e+00 0.00000e+00 6.12994e+02 70.715  2.16962e+00 70.715  0.9804 
1 1 1 -7  22  5  o 14 3.56963e+01 7.06291e-01 8.05620e+02 275.705 4.50720e+00  -4.51153e+01 0.00000e+00 0.00000e+00 5.22000e+02 275.705 2.83620e+02 95.705  0.9889 
1 1 1 -7  22  6  o 13 2.65575e+01 6.15193e-01 4.18863e+02 2.520   1.89444e+01  8.33890e-01  0.00000e+00 0.00000e+00 5.52640e+02 2.520   1.33777e+02 2.520   0.9733 
1 1 1 -7  22  7  o 17 1.99305e+01 4.93786e-01 4.26437e+02 146.825 -1.58626e+01 1.03703e+01  0.00000e+00 0.00000e+00 3.02134e+02 146.825 1.24304e+02 326.825 0.9732 
1 1 1 -7  22  8  o 17 1.71350e+01 4.87001e-01 2.54536e+02 213.020 -1.00753e+01 -6.54805e+00 0.00000e+00 0.00000e+00 3.61214e+02 213.020 1.06678e+02 213.020 0.9574 
1 1 1 -7  22  9  o 5  1.91032e+01 6.04466e-01 3.06928e+02 268.194 -5.89465e-01 -1.86971e+01 0.00000e+00 0.00000e+00 3.90072e+02 268.194 8.31440e+01 268.194 0.9729 
1 1 1 -7  22  10 o 3  1.99146e+01 5.71035e-01 4.27449e+02 318.837 2.81939e+01  -2.46494e+01 0.00000e+00 0.00000e+00 3.08724e+02 318.837 1.18726e+02 138.837 0.9866 
1 1 1 -7  22  11 o 19 6.18647e+00 6.42826e-01 1.22346e+02 66.274  1.72509e+00  3.92507e+00  0.00000e+00 0.00000e+00 8.00045e+01 66.274  4.23420e+01 246.274 0.8737 
1 1 1 -7  22  12 o 8  1.22062e+01 5.17906e-01 2.16193e+02 104.936 -5.02498e+00 1.88382e+01  0.00000e+00 0.00000e+00 2.28437e+02 104.936 1.22437e+01 104.936 0.9740 
1 1 1 -7  22  13 o 12 1.20966e+01 8.06913e-01 1.80903e+02 328.289 1.69498e+01  -1.04729e+01 0.00000e+00 0.00000e+00 2.59532e+02 328.289 7.86282e+01 328.289 0.9746 
1 1 1 -7  22  14 o 9  9.33134e+00 9.28002e-01 1.77117e+02 89.547  1.40818e-01  1.78003e+01  0.00000e+00 0.00000e+00 1.61186e+02 89.547  1.59313e+01 269.547 0.9715 
1 1 1 -7  22  15 o 8  6.81481e+00 1.22190e+00 9.10341e+01 150.663 -5.94723e+00 3.34254e+00  0.00000e+00 0.00000e+00 1.43551e+02 150.663 5.25170e+01 150.663 0.9235 
1 1 1 -7  22  16 o 11 1.00962e+01 1.25231e+00 1.48182e+02 190.912 -1.70819e+01 -3.29312e+00 0.00000e+00 0.00000e+00 2.16722e+02 190.912 6.85397e+01 190.912 0.9708 
1 1 1 -7  22  17 o 18 8.00439e+00 1.49658e+00 1.60936e+02 63.762  6.62533e+00  1.34417e+01  0.00000e+00 0.00000e+00 1.26567e+02 63.762  3.43699e+01 243.762 0.9660 
1 1 1 -7  22  18 o 18 6.91134e+00 1.76880e+00 6.78335e+01 221.108 -3.73290e+00 -3.25740e+00 0.00000e+00 0.00000e+00 1.61154e+02 221.108 9.33210e+01 221.108 0.8923 
1 1 1 -7  23  1  o 17 1.89049e+01 6.33068e-01 3.33654e+02 189.855 -8.11497e+00 -1.40974e+00 0.00000e+00 0.00000e+00 3.33872e+02 189.855 2.18565e-01 189.855 0.9372 
1 1 1 -7  23  2  o 6  1.56125e+01 4.59915e-01 4.15824e+02 84.968  6.77989e-01  7.69958e+00  0.00000e+00 0.00000e+00 1.32716e+02 84.968  2.83108e+02 264.968 0.9329 
1 1 1 -7  23  3  o 5  1.96807e+01 4.94456e-01 2.47410e+02 261.995 -8.88935e-01 -6.32076e+00 0.00000e+00 0.00000e+00 4.32690e+02 261.995 1.85279e+02 261.995 0.9179 
1 1 1 -7  23  4  o 11 2.01955e+01 4.93536e-01 5.69537e+02 43.989  1.09797e+01  1.05990e+01  0.00000e+00 0.00000e+00 1.65040e+02 43.989  4.04497e+02 223.989 0.9667 
1 1 1 -7  23  5  o 9  5.12802e+01 9.55521e-01 9.22244e+02 201.955 -6.67738e+01 -2.69170e+01 0.00000e+00 0.00000e+00 9.92801e+02 201.955 7.05570e+01 201.955 0.9930 
1 1 1 -7  23  6  o 3  1.42922e+01 4.61051e-01 1.67110e+02 228.819 -2.71400e+00 -3.10227e+00 0.00000e+00 0.00000e+00 2.99164e+02 228.819 1.32053e+02 228.819 0.8681 
1 1 1 -7  23  7  o 12 2.68250e+01 5.48406e-01 5.17707e+02 264.291 -3.06560e+00 -3.06639e+01 0.00000e+00 0.00000e+00 4.73305e+02 264.291 4.44027e+01 84.291  0.9836 
1 1 1 -7  23  8  o 18 2.04286e+01 5.02693e-01 3.13367e+02 51.865  1.08619e+01  1.38352e+01  0.00000e+00 0.00000e+00 4.31199e+02 51.865  1.17832e+02 51.865  0.9711 
1 1 1 -7  23  9  f 0  2.01919e+01 5.18442e-01 3.08825e+02 298.404 9.49242e+00  -1.75531e+01 0.00000e+00 0.00000e+00 4.29152e+02 298.404 1.20327e+02 298.404 0.9746 
1 1 1 -7  23  10 o 19 8.63162e+00 6.06823e-01 1.40272e+02 203.647 -4.85250e+00 -2.12479e+00 0.00000e+00 0.00000e+00 1.50746e+02 203.647 1.04741e+01 203.647 0.8998 
1 1 1 -7  23  11 o 14 2.50492e+01 5.58980e-01 4.92675e+02 118.868 -3.43964e+01 6.23909e+01  0.00000e+00 0.00000e+00 4.38396e+02 118.868 5.42790e+01 298.868 0.9930 
1 1 1 -7  23  12 o 16 2.51849e+00 5.38330e-01 1.46361e+01 115.312 -1.22760e-01 2.59555e-01  0.00000e+00 0.00000e+00 1.25259e+00 295.312 1.58887e+01 295.312 0.1421 
1 1 1 -7  23  13 o 12 1.36578e+01 7.96573e-01 2.74337e+02 320.727 2.68034e+01  -2.19175e+01 0.00000e+00 0.00000e+00 2.28459e+02 320.727 4.58780e+01 140.727 0.9855 
1 1 1 -7  23  14 o 5  1.56845e+01 8.34253e-01 3.01544e+02 73.118  1.61123e+01  5.30929e+01  0.00000e+00 0.00000e+00 2.78440e+02 73.118  2.31038e+01 253.118 0.9909 
1 1 1 -7  23  15 o 1  1.07246e+01 1.04796e+00 1.45364e+02 66.684  7.37549e+00  1.71124e+01  0.00000e+00 0.00000e+00 2.43489e+02 66.684  9.81250e+01 66.684  0.9728 
1 1 1 -7  23  16 f 0  1.06232e+01 1.23093e+00 1.18940e+02 170.962 -1.46657e+01 2.33271e+00  0.00000e+00 0.00000e+00 2.62970e+02 170.962 1.44030e+02 170.962 0.9657 
1 1 1 -7  23  17 o 14 6.39560e+00 1.47307e+00 5.41413e+01 229.226 -2.66911e+00 -3.09501e+00 0.00000e+00 0.00000e+00 1.51962e+02 229.226 9.78211e+01 229.226 0.8668 
1 1 1 -7  23  18 o 4  1.00093e+01 1.83774e+00 9.61315e+01 247.348 -3.73198e+00 -8.94274e+00 0.00000e+00 0.00000e+00 2.55766e+02 247.348 1.59635e+02 247.348 0.9469 
1 1 1 -7  24  1  o 1  3.38007e+01 6.78934e-01 6.04260e+02 170.771 -2.39317e+01 3.88845e+00  0.00000e+00 0.00000e+00 6.42620e+02 170.771 3.83596e+01 170.771 0.9792 
1 1 1 -7  24  2  o 15 3.32367e+01 6.70234e-01 7.13762e+02 45.730  2.03826e+01  2.09088e+01  0.00000e+00 0.00000e+00 5.16323e+02 45.730  1.97439e+02 225.730 0.9827 
1 1 1 -7  24  3  o 15 3.11250e+01 6.40105e-01 5.73122e+02 293.557 9.26419e+00  -2.12478e+01 0.00000e+00 0.00000e+00 5.72991e+02 293.557 1.30731e-01 113.558 0.9782 
1 1 1 -7  24  4  o 3  1.89445e+01 6.23529e-01 1.61029e+02 248.558 -1.46751e+00 -3.73651e+00 0.00000e+00 0.00000e+00 4.54876e+02 248.558 2.93848e+02 248.558 0.8641 
1 1 1 -7  24  5  o 15 4.58195e+01 1.14939e+00 8.65374e+02 352.671 5.89427e+01  -7.58109e+00 0.00000e+00 0.00000e+00 8.43084e+02 352.671 2.22896e+01 172.671 0.9916 
1 1 1 -7  24  6  o 15 2.18063e+01 5.19650e-01 3.19374e+02 106.487 -3.39823e+00 1.14817e+01  0.00000e+00 0.00000e+00 4.65129e+02 106.487 1.45754e+02 106.487 0.9573 
1 1 1 -7  24  7  o 6  4.34101e+01 7.64016e-01 8.24884e+02 161.027 -8.19311e+01 2.81673e+01  0.00000e+00 0.00000e+00 7.95977e+02 161.027 2.89070e+01 341.027 0.9942 
1 1 1 -7  24  8  o 1  1.52799e+01 4.87588e-01 2.73351e+02 276.100 1.24924e+00  -1.16897e+01 0.00000e+00 0.00000e+00 2.75112e+02 276.100 1.76101e+00 276.100 0.9565 
1 1 1 -7  24  9  o 19 1.23720e+01 5.19248e-01 1.66621e+02 99.327  -1.10420e+00 6.72272e+00  0.00000e+00 0.00000e+00 2.61755e+02 99.327  9.51334e+01 99.327  0.9234 
1 1 1 -7  24  10 o 1  1.60751e+01 4.97262e-01 1.26325e+02 341.087 8.89176e+00  -3.04656e+00 0.00000e+00 0.00000e+00 4.42936e+02 341.087 3.16612e+02 341.087 0.9452 
1 1 1 -7  24  11 o 6  6.10254e+00 9.26559e-01 1.33524e+02 243.759 -1.96057e+00 -3.97731e+00 0.00000e+00 0.00000e+00 6.71156e+01 243.759 6.64084e+01 63.760  0.8784 
1 1 1 -7  24  12 o 8  8.60923e+00 4.37106e-01 6.98733e+01 45.359  3.33446e+00  3.37651e+00  0.00000e+00 0.00000e+00 2.15722e+02 45.359  1.45849e+02 45.359  0.8871 
1 1 1 -7  24  13 o 19 5.69317e+00 1.08893e+00 6.85665e+01 222.307 -2.43350e+00 -2.21486e+00 0.00000e+00 0.00000e+00 1.07812e+02 222.307 3.92460e+01 222.307 0.8294 
1 1 1 -7  24  14 o 18 1.05736e+01 9.35628e-01 1.39091e+02 220.046 -1.26962e+01 -1.06708e+01 0.00000e+00 0.00000e+00 2.43361e+02 220.046 1.04270e+02 220.046 0.9694 
1 1 1 -7  24  15 o 3  9.47140e+00 1.16543e+00 1.23366e+02 210.791 -1.18866e+01 -7.08341e+00 0.00000e+00 0.00000e+00 2.16628e+02 210.791 9.32616e+01 210.791 0.9632 
1 1 1 -7  24  16 o 11 1.11295e+01 1.29143e+00 2.02905e+02 80.663  4.56379e+00  2.77569e+01  0.00000e+00 0.00000e+00 2.03951e+02 80.663  1.04673e+00 80.663  0.9821 
1 1 1 -7  24  17 o 4  5.21248e+00 1.41573e+00 1.27853e+02 26.307  6.94739e+00  3.43462e+00  0.00000e+00 0.00000e+00 5.29553e+01 26.307  7.48974e+01 206.307 0.9331 
1 1 1 -7  24  18 o 10 8.44982e+00 2.03729e+00 1.96302e+02 308.509 9.29279e+00  -1.16788e+01 0.00000e+00 0.00000e+00 1.06707e+02 308.509 8.95955e+01 128.509 0.9659 
1 1 1 -7  25  1  o 7  3.18502e+01 6.51160e-01 6.10226e+02 99.736  -3.87947e+00 2.26114e+01  0.00000e+00 0.00000e+00 5.63187e+02 99.736  4.70392e+01 279.736 0.9780 
1 1 1 -7  25  2  o 8  1.12864e+01 5.58613e-01 1.30924e+02 207.722 -1.60607e+00 -8.44003e-01 0.00000e+00 0.00000e+00 1.51631e+02 207.722 2.07070e+01 207.722 0.6648 
1 1 1 -7  25  3  o 3  1.82183e+01 7.77867e-01 4.34177e+02 193.176 -9.81487e+00 -2.29764e+00 0.00000e+00 0.00000e+00 2.16628e+02 193.176 2.17549e+02 13.176  0.9490 
1 1 1 -7  25  4  o 4  2.01669e+01 6.37135e-01 3.18810e+02 0.422   8.72320e+00  6.43105e-02  0.00000e+00 0.00000e+00 3.95015e+02 0.422   7.62050e+01 0.422   0.9408 
1 1 1 -7  25  5  o 5  1.73691e+01 6.08785e-01 2.28263e+02 164.800 -7.22045e+00 1.96173e+00  0.00000e+00 0.00000e+00 3.79491e+02 164.800 1.51228e+02 164.800 0.9306 
1 1 1 -7  25  6  o 18 3.42066e+01 7.05076e-01 5.74890e+02 249.826 -1.41413e+01 -3.84885e+01 0.00000e+00 0.00000e+00 6.94774e+02 249.826 1.19885e+02 249.826 0.9877 
1 1 1 -7  25  7  o 8  8.23287e+00 5.38818e-01 3.50413e+02 350.006 6.94579e+00  -1.22393e+00 0.00000e+00 0.00000e+00 6.40853e+01 170.006 4.14498e+02 170.006 0.9261 
1 1 1 -7  25  8  o 1  2.52536e+01 5.35328e-01 4.99114e+02 256.691 -8.12665e+00 -3.43541e+01 0.00000e+00 0.00000e+00 4.35014e+02 256.691 6.41003e+01 76.691  0.9857 
1 1 1 -7  25  9  o 4  8.59792e+00 5.89714e-01 1.05337e+02 245.469 -1.23358e+00 -2.70292e+00 0.00000e+00 0.00000e+00 1.55092e+02 245.469 4.97548e+01 245.469 0.8078 
1 1 1 -7  25  10 o 1  2.23865e+01 5.18666e-01 3.86698e+02 148.966 -3.41749e+01 2.05619e+01  0.00000e+00 0.00000e+00 4.41386e+02 148.966 5.46879e+01 148.966 0.9874 
1 1 1 -7  25  11 o 11 9.47710e+00 4.92826e-01 1.57456e+02 51.753  5.72297e+00  7.26038e+00  0.00000e+00 0.00000e+00 1.77484e+02 51.753  2.00280e+01 51.753  0.9443 
1 1 1 -7  25  12 o 8  1.40682e+01 3.68590e-01 2.47375e+02 216.803 -2.40709e+01 -1.80091e+01 0.00000e+00 0.00000e+00 2.69831e+02 216.803 2.24563e+01 216.803 0.9832 
1 1 1 -7  25  13 o 8  1.35466e+01 7.98035e-01 2.31229e+02 49.872  1.86460e+01  2.21208e+01  0.00000e+00 0.00000e+00 2.65944e+02 49.872  3.47153e+01 49.872  0.9826 
1 1 1 -7  25  14 o 1  1.28245e+01 8.85300e-01 2.00210e+02 292.690 1.18661e+01  -2.83804e+01 0.00000e+00 0.00000e+00 2.70442e+02 292.690 7.02313e+01 292.690 0.9836 
1 1 1 -7  25  15 o 8  1.35146e+01 9.62889e-01 1.86046e+02 85.605  2.51965e+00  3.27800e+01  0.00000e+00 0.00000e+00 3.09890e+02 85.605  1.23845e+02 85.605  0.9847 
1 1 1 -7  25  16 o 5  1.09241e+01 1.23240e+00 1.67141e+02 131.903 -1.47878e+01 1.64797e+01  0.00000e+00 0.00000e+00 2.30181e+02 131.903 6.30400e+01 131.903 0.9772 
1 1 1 -7  25  17 o 11 9.54632e+00 1.51200e+00 1.83653e+02 242.655 -9.38264e+00 -1.81435e+01 0.00000e+00 0.00000e+00 1.62421e+02 242.655 2.12317e+01 62.655  0.9752 
1 1 1 -7  25  18 o 5  4.75235e+00 1.58630e+00 4.12408e+01 88.593  5.95067e-02  2.42307e+00  0.00000e+00 0.00000e+00 9.22148e+01 88.593  5.09740e+01 88.593  0.7564 
1 1 1 -7  26  1  o 1  3.32747e+01 8.17358e-01 4.20799e+02 93.293  -9.81302e-01 1.70539e+01  0.00000e+00 0.00000e+00 7.95376e+02 93.293  3.74577e+02 93.293  0.9703 
1 1 1 -7  26  2  o 14 8.33151e+00 4.68503e-01 1.81073e+02 172.129 -1.95684e+00 2.70537e-01  0.00000e+00 0.00000e+00 3.65592e+01 172.129 1.44513e+02 352.129 0.6937 
1 1 1 -7  26  3  o 14 3.15022e+01 6.45307e-01 4.68236e+02 308.409 1.16700e+01  -1.47189e+01 0.00000e+00 0.00000e+00 6.85464e+02 308.409 2.17228e+02 308.409 0.9730 
1 1 1 -7  26  4  o 12 3.60294e+01 8.00414e-01 7.10148e+02 284.148 9.88619e+00  -3.92180e+01 0.00000e+00 0.00000e+00 6.28423e+02 284.148 8.17249e+01 104.148 0.9876 
1 1 1 -7  26  5  o 4  2.38559e+01 5.11404e-01 4.36658e+02 258.691 -3.60639e+00 -1.80336e+01 0.00000e+00 0.00000e+00 4.35567e+02 258.691 1.09174e+00 78.691  0.9724 
1 1 1 -7  26  6  o 3  3.72768e+01 7.32702e-01 7.29901e+02 258.893 -1.08744e+01 -5.53926e+01 0.00000e+00 0.00000e+00 6.58351e+02 258.893 7.15493e+01 78.893  0.9911 
1 1 1 -7  26  7  o 15 3.06541e+01 5.92844e-01 4.66024e+02 292.344 1.30445e+01  -3.17364e+01 0.00000e+00 0.00000e+00 6.68152e+02 292.344 2.02128e+02 292.344 0.9853 
1 1 1 -7  26  8  o 4  3.73893e+01 6.89635e-01 5.96353e+02 147.125 -5.59999e+01 3.61935e+01  0.00000e+00 0.00000e+00 7.96033e+02 147.125 1.99680e+02 147.125 0.9925 
1 1 1 -7  26  9  o 9  2.16040e+01 7.63195e-01 5.10404e+02 77.497  8.33349e+00  3.75805e+01  0.00000e+00 0.00000e+00 2.88997e+02 77.497  2.21407e+02 257.497 0.9869 
1 1 1 -7  26  10 o 6  2.05327e+01 5.08409e-01 2.41244e+02 257.239 -5.33096e+00 -2.35388e+01 0.00000e+00 0.00000e+00 5.11809e+02 257.239 2.70565e+02 257.239 0.9791 
1 1 1 -7  26  11 o 13 7.29015e+00 5.63323e-01 1.12821e+02 279.489 8.30828e-01  -4.97052e+00 0.00000e+00 0.00000e+00 1.31176e+02 279.489 1.83551e+01 279.489 0.8943 
1 1 1 -7  26  12 o 3  1.06162e+01 3.52242e-01 2.24957e+02 129.467 -1.23833e+01 1.50398e+01  0.00000e+00 0.00000e+00 1.61644e+02 129.467 6.33130e+01 309.467 0.9740 
1 1 1 -7  26  13 o 2  9.53828e+00 8.91289e-01 1.78170e+02 298.169 7.93977e+00  -1.48270e+01 0.00000e+00 0.00000e+00 1.67324e+02 298.169 1.08460e+01 118.169 0.9698 
1 1 1 -7  26  14 o 11 4.76264e+00 1.04093e+00 1.19936e+02 164.669 -6.17853e+00 1.69381e+00  0.00000e+00 0.00000e+00 4.32236e+01 164.669 7.67129e+01 344.669 0.9182 
1 1 1 -7  26  15 o 14 7.83660e+00 1.19792e+00 1.28205e+02 44.504  8.17812e+00  8.03783e+00  0.00000e+00 0.00000e+00 1.50786e+02 44.504  2.25812e+01 44.504  0.9553 
1 1 1 -7  26  16 o 4  2.07285e+01 1.07189e+00 2.95618e+02 351.719 8.01331e+01  -1.16628e+01 0.00000e+00 0.00000e+00 4.71099e+02 351.719 1.75481e+02 351.719 0.9938 
1 1 1 -7  26  17 o 19 5.52579e+00 1.33305e+00 8.44248e+01 35.344  4.97804e+00  3.53038e+00  0.00000e+00 0.00000e+00 1.03296e+02 35.344  1.88711e+01 35.344  0.9139 
1 1 1 -7  26  18 o 16 6.47768e+00 1.89108e+00 8.05249e+01 267.244 -2.43330e-01 -5.05566e+00 0.00000e+00 0.00000e+00 1.34634e+02 267.244 5.41092e+01 267.244 0.8948 
1 1 1 -7  27  1  o 19 1.62730e+01 4.69204e-01 3.54478e+02 251.669 -2.37902e+00 -7.18049e+00 0.00000e+00 0.00000e+00 2.16386e+02 251.669 1.38091e+02 71.669  0.9313 
1 1 1 -7  27  2  o 18 2.61838e+01 5.46598e-01 3.32234e+02 92.722  -5.37078e-01 1.12976e+01  0.00000e+00 0.00000e+00 6.09006e+02 92.722  2.76772e+02 92.722  0.9547 
1 1 1 -7  27  3  o 14 5.69045e+01 1.19364e+00 1.09970e+03 212.162 -6.82312e+01 -4.29039e+01 0.00000e+00 0.00000e+00 1.02863e+03 212.162 7.10689e+01 32.162  0.9938 
1 1 1 -7  27  4  o 10 2.48094e+01 7.15228e-01 5.84556e+02 165.306 -2.21356e+01 5.80468e+00  0.00000e+00 0.00000e+00 3.28085e+02 165.306 2.56471e+02 345.306 0.9779 
1 1 1 -7  27  5  o 5  1.45962e+01 5.75555e-01 2.14808e+02 213.379 -4.59120e+00 -3.02496e+00 0.00000e+00 0.00000e+00 2.81156e+02 213.379 6.63483e+01 213.379 0.9038 
1 1 1 -7  27  6  o 11 1.00738e+01 1.04614e+00 1.56476e+02 171.964 -3.16401e+00 4.46681e-01  0.00000e+00 0.00000e+00 1.55205e+02 171.964 1.27077e+00 351.964 0.8235 
1 1 1 -7  27  7  o 9  1.77688e+01 5.05626e-01 2.08124e+02 317.010 6.51006e+00  -6.06863e+00 0.00000e+00 0.00000e+00 4.20373e+02 317.010 2.12249e+02 317.010 0.9420 
1 1 1 -7  27  8  o 19 1.82700e+01 4.86465e-01 2.13081e+02 110.928 -4.01226e+00 1.04915e+01  0.00000e+00 0.00000e+00 4.41144e+02 110.928 2.28063e+02 110.928 0.9544 
1 1 1 -7  27  9  o 12 1.34396e+01 5.17864e-01 3.19610e+02 276.713 1.74001e+00  -1.47837e+01 0.00000e+00 0.00000e+00 1.67008e+02 276.713 1.52602e+02 96.713  0.9658 
1 1 1 -7  27  10 o 5  9.74466e+00 5.52296e-01 1.93854e+02 74.348  2.46753e+00  8.80665e+00  0.00000e+00 0.00000e+00 1.50584e+02 74.348  4.32693e+01 254.348 0.9436 
1 1 1 -7  27  11 o 6  5.73537e+00 6.60715e-01 7.56233e+01 155.805 -2.44020e+00 1.09642e+00  0.00000e+00 0.00000e+00 9.23893e+01 155.805 1.67659e+01 155.805 0.7828 
1 1 1 -7  27  12 o 18 1.20737e+01 5.02389e-01 2.56708e+02 322.725 1.96856e+01  -1.49831e+01 0.00000e+00 0.00000e+00 1.85462e+02 322.725 7.12458e+01 142.725 0.9796 
1 1 1 -7  27  13 o 7  1.51594e+01 7.95829e-01 2.77720e+02 144.511 -3.49051e+01 2.48878e+01  0.00000e+00 0.00000e+00 2.81797e+02 144.511 4.07716e+00 144.511 0.9883 
1 1 1 -7  27  14 o 12 7.50038e+00 1.03682e+00 7.30786e+01 359.557 6.14727e+00  -4.75068e-02 0.00000e+00 0.00000e+00 1.82831e+02 359.557 1.09752e+02 359.557 0.9146 
1 1 1 -7  27  15 o 10 1.02208e+01 1.08167e+00 1.71194e+02 129.238 -1.31921e+01 1.61532e+01  0.00000e+00 0.00000e+00 2.00409e+02 129.238 2.92157e+01 129.238 0.9757 
1 1 1 -7  27  16 o 6  1.43551e+01 1.12521e+00 2.37963e+02 12.918  4.65191e+01  1.06700e+01  0.00000e+00 0.00000e+00 2.90655e+02 12.918  5.26921e+01 12.918  0.9895 
1 1 1 -7  27  17 o 14 1.35006e+01 1.38963e+00 1.60182e+02 163.932 -2.59284e+01 7.46829e+00  0.00000e+00 0.00000e+00 3.32228e+02 163.932 1.72046e+02 163.932 0.9813 
1 1 1 -7  27  18 o 17 7.12917e+00 2.07271e+00 9.15947e+01 255.505 -1.39926e+00 -5.41244e+00 0.00000e+00 0.00000e+00 1.48017e+02 255.505 5.64223e+01 255.505 0.9055 
1 1 1 -7  28  1  o 12 3.31273e+01 6.39163e-01 6.60836e+02 37.024  2.26899e+01  1.71129e+01  0.00000e+00 0.00000e+00 5.64711e+02 37.024  9.61250e+01 217.024 0.9822 
1 1 1 -7  28  2  o 15 3.81347e+01 9.09684e-01 4.42654e+02 316.626 1.55076e+01  -1.46517e+01 0.00000e+00 0.00000e+00 9.59041e+02 316.626 5.16387e+02 316.626 0.9763 
1 1 1 -7  28  3  o 5  1.62454e+01 6.03383e-01 3.36197e+02 274.259 5.52605e-01  -7.42066e+00 0.00000e+00 0.00000e+00 2.32469e+02 274.259 1.03728e+02 94.259  0.9302 
1 1 1 -7  28  4  o 3  4.61617e+01 8.71284e-01 9.44702e+02 35.556  5.42582e+01  3.87815e+01  0.00000e+00 0.00000e+00 7.78588e+02 35.556  1.66114e+02 215.556 0.9925 
1 1 1 -7  28  5  o 7  1.70084e+01 5.60347e-01 1.85653e+02 305.819 3.16215e+00  -4.38140e+00 0.00000e+00 0.00000e+00 3.91071e+02 305.819 2.05418e+02 305.819 0.9020 
1 1 1 -7  28  6  o 10 8.25255e+00 1.11472e+00 2.57227e+02 221.198 -3.35094e+00 -2.93335e+00 0.00000e+00 0.00000e+00 1.52929e+01 221.198 2.41934e+02 41.198  0.8789 
1 1 1 -7  28  7  o 8  1.83340e+01 4.76907e-01 2.46322e+02 127.956 -7.46027e+00 9.56379e+00  0.00000e+00 0.00000e+00 4.13012e+02 127.956 1.66689e+02 127.956 0.9578 
1 1 1 -7  28  8  o 13 2.88754e+01 7.28643e-01 3.78555e+02 66.429  1.23739e+01  2.83618e+01  0.00000e+00 0.00000e+00 6.87117e+02 66.429  3.08562e+02 66.429  0.9837 
1 1 1 -7  28  9  o 14 1.60857e+01 4.93231e-01 3.28918e+02 350.883 1.80883e+01  -2.90286e+00 0.00000e+00 0.00000e+00 2.57394e+02 350.883 7.15247e+01 170.883 0.9723 
1 1 1 -7  28  10 o 9  2.21246e+01 5.20528e-01 2.76655e+02 203.174 -2.66788e+01 -1.14203e+01 0.00000e+00 0.00000e+00 5.37610e+02 203.174 2.60955e+02 203.174 0.9826 
1 1 1 -7  28  11 o 12 7.29324e+00 5.84915e-01 1.16703e+02 289.589 1.95444e+00  -5.49194e+00 0.00000e+00 0.00000e+00 1.31546e+02 289.589 1.48426e+01 289.589 0.9096 
1 1 1 -7  28  12 o 19 1.11175e+01 5.28526e-01 1.32220e+02 235.940 -7.14941e+00 -1.05755e+01 0.00000e+00 0.00000e+00 2.66762e+02 235.940 1.34541e+02 235.940 0.9600 
1 1 1 -7  28  13 o 18 1.12612e+01 8.55274e-01 1.33094e+02 68.934  5.29681e+00  1.37512e+01  0.00000e+00 0.00000e+00 2.72917e+02 68.934  1.39823e+02 68.934  0.9654 
1 1 1 -7  28  14 o 7  8.49116e+00 1.05001e+00 1.05939e+02 266.270 -6.20359e-01 -9.51491e+00 0.00000e+00 0.00000e+00 1.93706e+02 266.270 8.77668e+01 266.270 0.9460 
1 1 1 -7  28  15 o 1  4.26402e+00 1.18080e+00 1.10714e+02 34.058  4.43647e+00  2.99897e+00  0.00000e+00 0.00000e+00 3.24341e+01 34.058  7.82801e+01 214.058 0.9010 
1 1 1 -7  28  16 o 1  6.17790e+00 1.41272e+00 5.96898e+01 290.433 1.51052e+00  -4.05460e+00 0.00000e+00 0.00000e+00 1.41477e+02 290.433 8.17870e+01 290.433 0.8750 
1 1 1 -7  28  17 o 13 1.27907e+01 1.48152e+00 1.51395e+02 330.583 1.98166e+01  -1.11740e+01 0.00000e+00 0.00000e+00 3.13410e+02 330.583 1.62015e+02 330.583 0.9778 
1 1 1 -7  28  18 o 8  4.80781e+00 1.60642e+00 1.01661e+02 208.098 -5.07015e+00 -2.70696e+00 0.00000e+00 0.00000e+00 6.04107e+01 208.098 4.12500e+01 28.098  0.9082 
1 1 1 -7  29  1  o 7  3.52975e+01 8.57418e-01 3.81229e+02 252.853 -5.03034e+00 -1.63036e+01 0.00000e+00 0.00000e+00 9.08541e+02 252.853 5.27312e+02 252.853 0.9702 
1 1 1 -7  29  2  o 14 2.01885e+01 4.90912e-01 5.12818e+02 40.689  1.04290e+01  8.96696e+00  0.00000e+00 0.00000e+00 2.19038e+02 40.689  2.93780e+02 220.689 0.9629 
1 1 1 -7  29  3  o 3  4.62416e+01 8.28856e-01 8.26589e+02 155.235 -4.66693e+01 2.15291e+01  0.00000e+00 0.00000e+00 8.96486e+02 155.235 6.98968e+01 155.235 0.9902 
1 1 1 -7  29  4  o 15 2.31006e+01 6.88516e-01 2.37701e+02 167.010 -8.20997e+00 1.89394e+00  0.00000e+00 0.00000e+00 5.77836e+02 167.010 3.40135e+02 167.010 0.9386 
1 1 1 -7  29  5  o 18 1.84099e+01 6.82568e-01 2.23904e+02 83.236  8.31442e-01  7.00986e+00  0.00000e+00 0.00000e+00 4.17055e+02 83.236  1.93151e+02 83.236  0.9262 
1 1 1 -7  29  6  o 2  2.78838e+01 7.82719e-01 3.23946e+02 309.418 1.22963e+01  -1.49603e+01 0.00000e+00 0.00000e+00 6.96162e+02 309.418 3.72216e+02 309.418 0.9738 
1 1 1 -7  29  7  o 6  1.22135e+01 5.09657e-01 2.72263e+02 216.594 -6.99438e+00 -5.19337e+00 0.00000e+00 0.00000e+00 1.59077e+02 216.594 1.13185e+02 36.594  0.9407 
1 1 1 -7  29  8  o 5  3.43098e+01 6.42208e-01 5.07158e+02 277.698 7.45849e+00  -5.51750e+01 0.00000e+00 0.00000e+00 7.68335e+02 277.698 2.61178e+02 277.698 0.9910 
1 1 1 -7  29  9  o 16 2.08672e+01 5.16451e-01 1.86719e+02 171.833 -1.51426e+01 2.17318e+00  0.00000e+00 0.00000e+00 5.69457e+02 171.833 3.82739e+02 171.833 0.9667 
1 1 1 -7  29  10 o 17 1.76227e+01 5.35732e-01 4.02396e+02 13.414  3.50885e+01  8.36823e+00  0.00000e+00 0.00000e+00 2.48394e+02 13.414  1.54001e+02 193.414 0.9860 
1 1 1 -7  29  11 o 14 2.51274e+01 5.31802e-01 4.03410e+02 31.001  5.98046e+01  3.59360e+01  0.00000e+00 0.00000e+00 5.30026e+02 31.001  1.26616e+02 31.001  0.9928 
1 1 1 -7  29  12 o 17 1.97115e+01 4.68505e-01 3.66875e+02 123.946 -3.58831e+01 5.33079e+01  0.00000e+00 0.00000e+00 3.64194e+02 123.946 2.68082e+00 303.946 0.9922 
1 1 1 -7  29  13 f 0  8.31950e+00 9.75772e-01 1.17758e+02 210.543 -8.30768e+00 -4.90208e+00 0.00000e+00 0.00000e+00 1.76331e+02 210.543 5.85726e+01 210.543 0.9467 
1 1 1 -7  29  14 o 10 1.36634e+01 9.06648e-01 2.30979e+02 73.441  1.00806e+01  3.39029e+01  0.00000e+00 0.00000e+00 2.71409e+02 73.441  4.04296e+01 73.441  0.9858 
1 1 1 -7  29  15 o 11 9.71018e+00 1.20502e+00 1.63543e+02 253.205 -5.70921e+00 -1.89162e+01 0.00000e+00 0.00000e+00 1.88947e+02 253.205 2.54043e+01 253.205 0.9744 
1 1 1 -7  29  16 o 8  6.44618e+00 1.43347e+00 1.10765e+02 42.987  5.78852e+00  5.39552e+00  0.00000e+00 0.00000e+00 1.13390e+02 42.987  2.62556e+00 42.987  0.9345 
1 1 1 -7  29  17 o 19 6.12913e+00 1.55621e+00 1.09197e+02 349.728 7.63384e+00  -1.38345e+00 0.00000e+00 0.00000e+00 1.03347e+02 349.728 5.85074e+00 169.728 0.9331 
1 1 1 -7  29  18 o 8  8.12725e+00 1.93712e+00 6.36780e+01 333.854 4.50584e+00  -2.21190e+00 0.00000e+00 0.00000e+00 2.05922e+02 333.854 1.42244e+02 333.854 0.8938 
1 1 1 -7  30  1  f 0  1.68913e+01 5.17985e-01 3.25107e+02 68.418  2.68384e+00  6.78500e+00  0.00000e+00 0.00000e+00 2.65630e+02 68.418  5.94772e+01 248.418 0.9287 
1 1 1 -7  30  2  o 2  3.27628e+01 6.33324e-01 6.62412e+02 15.269  2.75433e+01  7.51879e+00  0.00000e+00 0.00000e+00 5.49108e+02 15.269  1.13304e+02 195.269 0.9823 
1 1 1 -7  30  3  o 7  1.13524e+01 6.17764e-01 2.18746e+02 151.445 -3.46333e+00 1.88477e+00  0.00000e+00 0.00000e+00 1.49164e+02 151.445 6.95821e+01 331.445 0.8613 
1 1 1 -7  30  4  o 17 2.64996e+01 5.75423e-01 3.64344e+02 81.785  2.60307e+00  1.80306e+01  0.00000e+00 0.00000e+00 6.04520e+02 81.785  2.40176e+02 81.785  0.9722 
1 1 1 -7  30  5  o 3  2.26131e+01 6.83457e-01 1.81641e+02 32.477  5.91964e+00  3.76796e+00  0.00000e+00 0.00000e+00 6.05200e+02 32.477  4.23559e+02 32.477  0.9257 
1 1 1 -7  30  6  o 17 4.18322e+01 8.84654e-01 8.11073e+02 299.566 3.64448e+01  -6.42429e+01 0.00000e+00 0.00000e+00 7.49658e+02 299.566 6.14146e+01 119.566 0.9932 
1 1 1 -7  30  7  o 2  3.10546e+01 5.97471e-01 4.34187e+02 32.944  2.94442e+01  1.90801e+01  0.00000e+00 0.00000e+00 7.14836e+02 32.944  2.80648e+02 32.944  0.9856 
1 1 1 -7  30  8  o 15 1.78858e+01 4.89712e-01 2.95561e+02 138.918 -1.24417e+01 1.08466e+01  0.00000e+00 0.00000e+00 3.54705e+02 138.918 5.91444e+01 138.918 0.9692 
1 1 1 -7  30  9  o 7  1.92102e+01 5.00092e-01 3.99200e+02 14.666  3.20772e+01  8.39486e+00  0.00000e+00 0.00000e+00 3.09880e+02 14.666  8.93198e+01 194.666 0.9848 
1 1 1 -7  30  10 o 14 2.00133e+01 5.07200e-01 3.12501e+02 184.996 -3.41430e+01 -2.98456e+00 0.00000e+00 0.00000e+00 4.25955e+02 184.996 1.13454e+02 184.996 0.9853 
1 1 1 -7  30  11 o 12 5.98145e+00 6.63125e-01 1.52394e+02 34.348  5.24709e+00  3.58582e+00  0.00000e+00 0.00000e+00 5.29451e+01 34.348  9.94493e+01 214.348 0.9175 
1 1 1 -7  30  12 o 19 5.19685e+00 7.97036e-01 1.51247e+02 243.735 -2.88475e+00 -5.84579e+00 0.00000e+00 0.00000e+00 2.74069e+01 243.735 1.23840e+02 63.735  0.9197 
1 1 1 -7  30  13 o 14 1.37466e+01 8.47183e-01 2.09205e+02 106.512 -8.39748e+00 2.83269e+01  0.00000e+00 0.00000e+00 2.95306e+02 106.512 8.61002e+01 106.512 0.9829 
1 1 1 -7  30  14 o 9  1.57607e+01 8.95318e-01 2.33412e+02 261.523 -6.65272e+00 -4.46379e+01 0.00000e+00 0.00000e+00 3.47865e+02 261.523 1.14452e+02 261.523 0.9889 
1 1 1 -7  30  15 o 19 6.28183e+00 1.30763e+00 5.75897e+01 341.285 3.94829e+00  -1.33760e+00 0.00000e+00 0.00000e+00 1.45940e+02 341.285 8.83499e+01 341.285 0.8697 
1 1 1 -7  30  16 o 15 1.10147e+01 1.31443e+00 1.86247e+02 18.893  2.44905e+01  8.38178e+00  0.00000e+00 0.00000e+00 2.15590e+02 18.893  2.93435e+01 18.893  0.9805 
1 1 1 -7  30  17 o 12 8.72935e+00 1.48769e+00 1.34095e+02 187.750 -1.32578e+01 -1.80429e+00 0.00000e+00 0.00000e+00 1.77917e+02 187.750 4.38216e+01 187.750 0.9619 
1 1 1 -7  30  18 o 12 3.98202e+00 1.37242e+00 9.80490e+01 213.668 -4.71782e+00 -3.14256e+00 0.00000e+00 0.00000e+00 3.59617e+01 213.668 6.20873e+01 33.668  0.9069 
1 1 1 -7  31  1  o 1  3.09784e+01 8.07379e-01 6.26127e+02 86.735  1.44519e+00  2.53338e+01  0.00000e+00 0.00000e+00 5.17131e+02 86.735  1.08996e+02 266.735 0.9801 
1 1 1 -7  31  2  o 16 2.28834e+01 6.51587e-01 2.61761e+02 174.513 -8.07848e+00 7.76039e-01  0.00000e+00 0.00000e+00 5.44627e+02 174.513 2.82865e+02 174.513 0.9362 
1 1 1 -7  31  3  o 10 2.46043e+01 5.33146e-01 6.35649e+02 72.244  7.40657e+00  2.31295e+01  0.00000e+00 0.00000e+00 2.70805e+02 72.244  3.64844e+02 252.244 0.9792 
1 1 1 -7  31  4  o 11 3.84956e+01 6.64942e-01 7.62639e+02 197.841 -4.89298e+01 -1.57483e+01 0.00000e+00 0.00000e+00 6.70856e+02 197.841 9.17830e+01 17.841  0.9902 
1 1 1 -7  31  5  o 16 1.34188e+01 4.43959e-01 2.34690e+02 28.509  5.83289e+00  3.16817e+00  0.00000e+00 0.00000e+00 2.29932e+02 28.509  4.75888e+00 208.509 0.9213 
1 1 1 -7  31  6  o 18 2.68980e+01 6.07016e-01 4.06060e+02 162.830 -2.54965e+01 7.87776e+00  0.00000e+00 0.00000e+00 5.85151e+02 162.830 1.79090e+02 162.830 0.9811 
1 1 1 -7  31  7  o 14 9.56373e+00 5.55841e-01 1.61008e+02 236.817 -2.31050e+00 -3.53315e+00 0.00000e+00 0.00000e+00 1.51857e+02 236.817 9.15090e+00 56.817  0.8715 
1 1 1 -7  31  8  o 17 1.97178e+01 4.96170e-01 2.65952e+02 207.891 -1.44207e+01 -7.63242e+00 0.00000e+00 0.00000e+00 4.50591e+02 207.891 1.84639e+02 207.891 0.9689 
1 1 1 -7  31  9  o 5  2.26879e+01 5.69900e-01 3.82577e+02 158.750 -3.46522e+01 1.34754e+01  0.00000e+00 0.00000e+00 4.56207e+02 158.750 7.36300e+01 158.750 0.9865 
1 1 1 -7  31  10 o 14 1.53719e+01 4.89972e-01 2.32572e+02 208.567 -1.71842e+01 -9.35650e+00 0.00000e+00 0.00000e+00 3.28130e+02 208.567 9.55577e+01 208.567 0.9741 
1 1 1 -7  31  11 f 0  1.74466e+01 4.42090e-01 2.61370e+02 341.041 3.28107e+01  -1.12712e+01 0.00000e+00 0.00000e+00 3.81850e+02 341.041 1.20480e+02 341.041 0.9855 
1 1 1 -7  31  12 o 3  8.12534e+00 4.38943e-01 7.40141e+01 85.201  4.72079e-01  5.62344e+00  0.00000e+00 0.00000e+00 2.01250e+02 85.201  1.27236e+02 85.201  0.9064 
1 1 1 -7  31  13 o 1  4.56606e+00 1.08963e+00 8.38938e+01 235.667 -1.97337e+00 -2.88924e+00 0.00000e+00 0.00000e+00 5.94829e+01 235.667 2.44109e+01 55.667  0.8410 
1 1 1 -7  31  14 o 6  4.80711e+00 1.18081e+00 9.32524e+01 12.475  4.56451e+00  1.00985e+00  0.00000e+00 0.00000e+00 6.54523e+01 12.475  2.78002e+01 192.475 0.8853 
1 1 1 -7  31  15 o 18 6.09499e+00 1.30087e+00 5.88457e+01 345.982 4.02151e+00  -1.00400e+00 0.00000e+00 0.00000e+00 1.38424e+02 345.982 7.95778e+01 345.982 0.8689 
1 1 1 -7  31  16 o 10 7.04441e+00 1.43169e+00 9.47354e+01 320.047 5.98640e+00  -5.01475e+00 0.00000e+00 0.00000e+00 1.49943e+02 320.047 5.52078e+01 320.047 0.9336 
1 1 1 -7  31  17 o 12 6.10183e+00 1.47233e+00 1.06776e+02 16.007  7.51838e+00  2.15686e+00  0.00000e+00 0.00000e+00 1.04914e+02 16.007  1.86171e+00 196.007 0.9337 
1 1 1 -7  31  18 o 10 8.77631e+00 1.87085e+00 1.00629e+02 190.850 -8.76712e+00 -1.68041e+00 0.00000e+00 0.00000e+00 2.06206e+02 190.850 1.05577e+02 190.850 0.9422 
1 1 1 -7  32  1  o 5  5.93784e+01 1.15404e+00 1.19451e+03 173.348 -9.33289e+01 1.08836e+01  0.00000e+00 0.00000e+00 1.02924e+03 173.348 1.65263e+02 353.348 0.9947 
1 1 1 -7  32  2  o 10 5.20126e+01 9.20252e-01 1.04052e+03 18.801  8.02844e+01  2.73332e+01  0.00000e+00 0.00000e+00 9.05514e+02 18.801  1.35010e+02 198.801 0.9941 
1 1 1 -7  32  3  o 5  2.69789e+01 5.58729e-01 5.33307e+02 337.186 2.04649e+01  -8.60848e+00 0.00000e+00 0.00000e+00 4.58537e+02 337.186 7.47698e+01 157.186 0.9772 
1 1 1 -7  32  4  o 1  3.48164e+01 6.48153e-01 5.86293e+02 193.337 -3.39222e+01 -8.04193e+00 0.00000e+00 0.00000e+00 7.03967e+02 193.337 1.17675e+02 193.337 0.9856 
1 1 1 -7  32  5  o 19 1.37192e+01 4.61487e-01 2.37157e+02 166.718 -6.65288e+00 1.57043e+00  0.00000e+00 0.00000e+00 2.39064e+02 166.718 1.90689e+00 166.718 0.9237 
1 1 1 -7  32  6  o 18 4.80431e+01 8.31068e-01 8.23564e+02 316.908 6.93015e+01  -6.48327e+01 0.00000e+00 0.00000e+00 9.71312e+02 316.908 1.47747e+02 316.908 0.9947 
1 1 1 -7  32  7  o 10 2.26858e+01 5.11088e-01 5.19043e+02 142.000 -2.60841e+01 2.03794e+01  0.00000e+00 0.00000e+00 3.19454e+02 142.000 1.99589e+02 322.000 0.9848 
1 1 1 -7  32  8  o 2  8.13611e+00 5.59686e-01 2.29198e+02 193.815 -5.78493e+00 -1.42250e+00 0.00000e+00 0.00000e+00 4.89978e+01 193.815 1.80201e+02 13.815  0.9117 
1 1 1 -7  32  9  o 13 9.03520e+00 5.96747e-01 1.23718e+02 257.503 -1.02911e+00 -4.64318e+00 0.00000e+00 0.00000e+00 1.76747e+02 257.503 5.30297e+01 257.503 0.8874 
1 1 1 -7  32  10 o 11 8.91217e+00 5.29343e-01 1.85827e+02 135.396 -7.07444e+00 6.97728e+00  0.00000e+00 0.00000e+00 1.30601e+02 135.396 5.52254e+01 315.396 0.9483 
1 1 1 -7  32  11 o 15 1.26469e+01 4.23510e-01 1.75002e+02 209.479 -1.46492e+01 -8.28113e+00 0.00000e+00 0.00000e+00 2.83811e+02 209.479 1.08809e+02 209.479 0.9698 
1 1 1 -7  32  12 o 11 1.11764e+01 5.54769e-01 2.51621e+02 343.881 2.48136e+01  -7.17111e+00 0.00000e+00 0.00000e+00 1.57884e+02 343.881 9.37370e+01 163.881 0.9804 
1 1 1 -7  32  13 o 2  2.14831e+01 8.53371e-01 4.12701e+02 88.833  1.88439e+00  9.25016e+01  0.00000e+00 0.00000e+00 3.84958e+02 88.833  2.77428e+01 268.833 0.9946 
1 1 1 -7  32  14 o 17 3.87400e+00 1.05896e+00 1.01874e+02 329.044 3.94963e+00  -2.36900e+00 0.00000e+00 0.00000e+00 2.57388e+01 329.044 7.61353e+01 149.044 0.8834 
1 1 1 -7  32  15 o 11 1.01031e+01 1.08873e+00 2.17150e+02 212.529 -2.41201e+01 -1.53832e+01 0.00000e+00 0.00000e+00 1.52525e+02 212.529 6.46249e+01 32.529  0.9824 
1 1 1 -7  32  16 o 18 7.08771e+00 1.41492e+00 1.15160e+02 291.832 3.58530e+00  -8.94914e+00 0.00000e+00 0.00000e+00 1.34439e+02 291.832 1.92792e+01 291.832 0.9466 
1 1 1 -7  32  17 o 4  1.31980e+01 1.39513e+00 1.72391e+02 98.591  -4.28724e+00 2.83768e+01  0.00000e+00 0.00000e+00 3.09340e+02 98.591  1.36949e+02 98.591  0.9824 
1 1 1 -7  32  18 o 11 6.61230e+00 1.88393e+00 1.07283e+02 176.653 -7.11276e+00 4.15988e-01  0.00000e+00 0.00000e+00 1.20122e+02 176.653 1.28390e+01 176.653 0.9269 
1 1 1 -7  33  1  o 11 2.22737e+01 5.81151e-01 4.00020e+02 134.450 -9.92884e+00 1.01214e+01  0.00000e+00 0.00000e+00 4.08403e+02 134.450 8.38321e+00 134.450 0.9641 
1 1 1 -7  33  2  o 14 4.13554e+01 8.57780e-01 8.19796e+02 7.040   5.15820e+01  6.37001e+00  0.00000e+00 0.00000e+00 7.21523e+02 7.040   9.82725e+01 187.040 0.9903 
1 1 1 -7  33  3  o 18 2.82272e+01 5.79355e-01 4.32539e+02 320.574 1.77999e+01  -1.46346e+01 0.00000e+00 0.00000e+00 6.05997e+02 320.574 1.73458e+02 320.574 0.9781 
1 1 1 -7  33  4  o 7  9.83184e+00 4.49770e-01 1.97891e+02 205.391 -3.00637e+00 -1.42694e+00 0.00000e+00 0.00000e+00 1.09516e+02 205.391 8.83745e+01 25.391  0.8316 
1 1 1 -7  33  5  o 11 1.85938e+01 4.63338e-01 3.58162e+02 97.181  -1.74186e+00 1.38258e+01  0.00000e+00 0.00000e+00 3.14998e+02 97.181  4.31634e+01 277.181 0.9634 
1 1 1 -7  33  6  o 16 2.05323e+01 6.74766e-01 4.01091e+02 159.316 -1.83964e+01 6.94564e+00  0.00000e+00 0.00000e+00 3.50126e+02 159.316 5.09648e+01 339.316 0.9742 
1 1 1 -7  33  7  o 16 1.59581e+01 4.70500e-01 2.14854e+02 191.688 -1.02073e+01 -2.11166e+00 0.00000e+00 0.00000e+00 3.54547e+02 191.688 1.39693e+02 191.688 0.9507 
1 1 1 -7  33  8  o 2  1.48569e+01 4.81717e-01 2.71170e+02 232.933 -8.04295e+00 -1.06476e+01 0.00000e+00 0.00000e+00 2.64682e+02 232.933 6.48801e+00 52.933  0.9618 
1 1 1 -7  33  9  o 9  1.36805e+01 6.88482e-01 3.08727e+02 118.548 -8.76047e+00 1.61023e+01  0.00000e+00 0.00000e+00 1.89716e+02 118.548 1.19011e+02 298.548 0.9723 
1 1 1 -7  33  10 o 5  8.97252e+00 5.54109e-01 1.16295e+02 107.642 -1.81491e+00 5.70670e+00  0.00000e+00 0.00000e+00 1.90126e+02 107.642 7.38307e+01 107.642 0.9122 
1 1 1 -7  33  11 o 6  1.33835e+01 4.31225e-01 2.66585e+02 347.155 2.65776e+01  -6.06019e+00 0.00000e+00 0.00000e+00 2.24748e+02 347.155 4.18374e+01 167.155 0.9815 
1 1 1 -7  33  12 o 1  2.01452e+01 4.40130e-01 3.15948e+02 313.646 4.11159e+01  -4.31069e+01 0.00000e+00 0.00000e+00 4.30488e+02 313.646 1.14540e+02 313.646 0.9916 
1 1 1 -7  33  13 o 12 1.31549e+01 8.63499e-01 2.41174e+02 249.631 -1.08089e+01 -2.91132e+01 0.00000e+00 0.00000e+00 2.41908e+02 249.631 7.34314e-01 249.631 0.9838 
1 1 1 -7  33  14 f 0  5.98065e+00 1.08271e+00 9.82223e+01 297.333 3.10857e+00  -6.01416e+00 0.00000e+00 0.00000e+00 1.07580e+02 297.333 9.35791e+00 297.333 0.9229 
1 1 1 -7  33  15 o 11 5.04612e+00 1.22039e+00 1.08514e+02 171.614 -6.53652e+00 9.63619e-01  0.00000e+00 0.00000e+00 6.45499e+01 171.614 4.39646e+01 351.614 0.9209 
1 1 1 -7  33  16 o 3  9.82531e+00 1.36968e+00 1.48756e+02 324.163 1.46266e+01  -1.05635e+01 0.00000e+00 0.00000e+00 2.06450e+02 324.163 5.76939e+01 324.163 0.9719 
1 1 1 -7  33  17 o 7  5.86020e+00 1.48072e+00 5.95545e+01 23.168  3.87470e+00  1.65814e+00  0.00000e+00 0.00000e+00 1.30132e+02 23.168  7.05777e+01 23.168  0.8713 
1 1 1 -7  33  18 o 18 5.10134e+00 1.64075e+00 7.99993e+01 222.312 -3.56409e+00 -3.24441e+00 0.00000e+00 0.00000e+00 8.82571e+01 222.312 8.25781e+00 222.312 0.8890 
1 1 1 -7  34  1  o 12 4.68073e+01 9.37185e-01 7.63294e+02 112.273 -2.06756e+01 5.04793e+01  0.00000e+00 0.00000e+00 9.82521e+02 112.273 2.19227e+02 112.273 0.9908 
1 1 1 -7  34  2  o 18 4.88550e+01 8.70580e-01 8.29300e+02 0.656   6.17099e+01  7.06345e-01  0.00000e+00 0.00000e+00 9.94180e+02 0.656   1.64880e+02 0.656   0.9919 
1 1 1 -7  34  3  o 15 4.50674e+01 8.13873e-01 8.88659e+02 262.738 -8.79946e+00 -6.90521e+01 0.00000e+00 0.00000e+00 7.94293e+02 262.738 9.43660e+01 82.738  0.9928 
1 1 1 -7  34  4  f 0  2.34156e+01 4.89992e-01 3.31691e+02 118.242 -6.32570e+00 1.17767e+01  0.00000e+00 0.00000e+00 5.15037e+02 118.242 1.83346e+02 118.242 0.9618 
1 1 1 -7  34  5  o 11 1.32372e+01 4.51939e-01 2.76090e+02 226.147 -5.52108e+00 -5.74673e+00 0.00000e+00 0.00000e+00 1.88951e+02 226.147 8.71394e+01 46.147  0.9350 
1 1 1 -7  34  6  o 15 3.35230e+01 6.31687e-01 6.76641e+02 168.703 -5.92667e+01 1.18397e+01  0.00000e+00 0.00000e+00 5.71734e+02 168.703 1.04907e+02 348.703 0.9917 
1 1 1 -7  34  7  o 13 1.35286e+01 4.79265e-01 2.40766e+02 110.036 -3.22514e+00 8.84367e+00  0.00000e+00 0.00000e+00 2.39130e+02 110.036 1.63604e+00 290.036 0.9453 
1 1 1 -7  34  8  o 2  2.74423e+01 5.63283e-01 4.21470e+02 23.195  3.78346e+01  1.62121e+01  0.00000e+00 0.00000e+00 5.94985e+02 23.195  1.73515e+02 23.195  0.9878 
1 1 1 -7  34  9  o 16 1.75748e+01 5.42622e-01 3.52923e+02 236.594 -1.57361e+01 -2.38598e+01 0.00000e+00 0.00000e+00 2.93946e+02 236.594 5.89770e+01 56.594  0.9823 
1 1 1 -7  34  10 o 7  1.66064e+01 4.93658e-01 2.94763e+02 101.225 -5.54400e+00 2.79358e+01  0.00000e+00 0.00000e+00 3.15895e+02 101.225 2.11321e+01 101.225 0.9823 
1 1 1 -7  34  11 o 11 3.40134e+00 7.08793e-01 1.20970e+02 224.856 -2.09014e+00 -2.07968e+00 0.00000e+00 0.00000e+00 1.84226e+01 44.856  1.39393e+02 44.856  0.8061 
1 1 1 -7  34  12 o 5  2.05944e+01 4.98144e-01 3.78429e+02 235.148 -4.12096e+01 -5.91785e+01 0.00000e+00 0.00000e+00 3.85712e+02 235.148 7.28277e+00 235.148 0.9930 
1 1 1 -7  34  13 o 12 1.46498e+01 8.50209e-01 2.02108e+02 1.163   2.90299e+01  5.89086e-01  0.00000e+00 0.00000e+00 3.35199e+02 1.163   1.33091e+02 1.163   0.9826 
1 1 1 -7  34  14 o 13 6.87265e+00 1.17958e+00 1.27029e+02 323.076 7.71762e+00  -5.79954e+00 0.00000e+00 0.00000e+00 1.15553e+02 323.076 1.14761e+01 143.076 0.9467 
1 1 1 -7  34  15 o 9  5.55176e+00 1.24273e+00 1.38085e+02 113.784 -3.70051e+00 8.39650e+00  0.00000e+00 0.00000e+00 5.70511e+01 113.784 8.10334e+01 293.784 0.9438 
1 1 1 -7  34  16 o 18 1.05861e+01 1.37576e+00 2.19578e+02 155.126 -2.48897e+01 1.15396e+01  0.00000e+00 0.00000e+00 1.66924e+02 155.126 5.26542e+01 335.126 0.9816 
1 1 1 -7  34  17 o 17 7.99822e+00 1.63611e+00 1.33474e+02 325.143 9.63151e+00  -6.70832e+00 0.00000e+00 0.00000e+00 1.50680e+02 325.143 1.72059e+01 325.143 0.9564 
1 1 1 -7  34  18 o 6  6.08542e+00 1.87388e+00 7.93573e+01 110.989 -1.74069e+00 4.53734e+00  0.00000e+00 0.00000e+00 1.21564e+02 110.989 4.22072e+01 110.989 0.8900 
1 1 1 -7  35  1  o 4  3.91786e+01 9.28599e-01 2.98708e+02 104.924 -5.61477e+00 2.10664e+01  0.00000e+00 0.00000e+00 1.14179e+03 104.924 8.43077e+02 104.924 0.9768 
1 1 1 -7  35  2  o 11 3.57927e+01 6.78316e-01 6.13692e+02 322.941 3.29231e+01  -2.48625e+01 0.00000e+00 0.00000e+00 7.16652e+02 322.941 1.02960e+02 322.941 0.9878 
1 1 1 -7  35  3  o 17 2.51825e+01 5.76029e-01 4.82960e+02 22.905  1.91766e+01  8.10246e+00  0.00000e+00 0.00000e+00 4.41134e+02 22.905  4.18257e+01 202.905 0.9757 
1 1 1 -7  35  4  o 14 4.06503e+01 6.95448e-01 7.60812e+02 260.760 -1.03450e+01 -6.35912e+01 0.00000e+00 0.00000e+00 7.55403e+02 260.760 5.40954e+00 80.760  0.9922 
1 1 1 -7  35  5  o 5  3.04366e+01 6.31920e-01 3.99353e+02 42.362  1.98592e+01  1.81096e+01  0.00000e+00 0.00000e+00 7.22701e+02 42.362  3.23348e+02 42.362  0.9812 
1 1 1 -7  35  6  o 13 1.22712e+01 5.55527e-01 1.42188e+02 294.144 1.86539e+00  -4.16152e+00 0.00000e+00 0.00000e+00 2.64237e+02 294.144 1.22049e+02 294.144 0.8821 
1 1 1 -7  35  7  o 8  3.56453e+01 6.65292e-01 6.10231e+02 154.134 -5.56890e+01 2.70000e+01  0.00000e+00 0.00000e+00 7.16412e+02 154.134 1.06181e+02 154.134 0.9919 
1 1 1 -7  35  8  o 9  1.34566e+01 6.39636e-01 7.60882e+01 3.277   3.51267e+00  2.01156e-01  0.00000e+00 0.00000e+00 3.48772e+02 3.277   2.72684e+02 3.277   0.8421 
1 1 1 -7  35  9  o 9  2.77079e+01 6.23275e-01 6.11764e+02 310.634 5.32068e+01  -6.20038e+01 0.00000e+00 0.00000e+00 4.19925e+02 310.634 1.91839e+02 130.634 0.9939 
1 1 1 -7  35  10 f 0  2.11862e+01 5.72613e-01 4.97946e+02 95.716  -6.04173e+00 6.03600e+01  0.00000e+00 0.00000e+00 2.88535e+02 95.716  2.09412e+02 275.716 0.9917 
1 1 1 -7  35  11 o 14 8.54396e+00 4.65734e-01 2.25876e+02 242.429 -7.03340e+00 -1.34703e+01 0.00000e+00 0.00000e+00 8.29484e+01 242.429 1.42927e+02 62.429  0.9665 
1 1 1 -7  35  12 o 17 1.99134e+01 4.48702e-01 3.97044e+02 276.069 8.24857e+00  -7.75758e+01 0.00000e+00 0.00000e+00 3.42151e+02 276.069 5.48933e+01 96.069  0.9936 
1 1 1 -7  35  13 o 14 9.73423e+00 9.34644e-01 1.33295e+02 43.430  9.69128e+00  9.17415e+00  0.00000e+00 0.00000e+00 2.16114e+02 43.430  8.28189e+01 43.430  0.9618 
1 1 1 -7  35  14 o 3  1.41834e+01 8.90291e-01 2.49126e+02 137.489 -3.40040e+01 3.11714e+01  0.00000e+00 0.00000e+00 2.73872e+02 137.489 2.47461e+01 137.489 0.9891 
1 1 1 -7  35  15 o 9  7.03354e+00 1.23611e+00 8.79005e+01 356.527 7.40378e+00  -4.49375e-01 0.00000e+00 0.00000e+00 1.55652e+02 356.527 6.77510e+01 356.527 0.9299 
1 1 1 -7  35  16 o 2  8.22899e+00 1.40705e+00 1.24861e+02 247.882 -4.75301e+00 -1.16946e+01 0.00000e+00 0.00000e+00 1.68800e+02 247.882 4.39384e+01 247.882 0.9595 
1 1 1 -7  35  17 o 1  1.04346e+01 1.58199e+00 1.60291e+02 239.895 -9.65295e+00 -1.66489e+01 0.00000e+00 0.00000e+00 2.17076e+02 239.895 5.67849e+01 239.895 0.9737 
1 1 1 -7  35  18 o 4  1.09107e+01 2.07226e+00 1.90492e+02 172.379 -1.80731e+01 2.41811e+00  0.00000e+00 0.00000e+00 2.02958e+02 172.379 1.24661e+01 172.379 0.9722 
1 1 1 -7  36  1  o 11 3.29173e+01 7.28015e-01 6.65483e+02 198.503 -3.89095e+01 -1.30215e+01 0.00000e+00 0.00000e+00 5.58245e+02 198.503 1.07238e+02 18.503  0.9877 
1 1 1 -7  36  2  o 16 1.42349e+01 4.57483e-01 3.71839e+02 244.839 -3.96729e+00 -8.44585e+00 0.00000e+00 0.00000e+00 1.34156e+02 244.839 2.37683e+02 64.839  0.9448 
1 1 1 -7  36  3  o 11 3.45071e+01 6.17570e-01 3.92285e+02 358.888 2.32417e+01  -4.51278e-01 0.00000e+00 0.00000e+00 8.77192e+02 358.888 4.84908e+02 358.888 0.9782 
1 1 1 -7  36  4  o 15 3.01232e+01 7.69897e-01 5.33492e+02 242.576 -1.53080e+01 -2.95012e+01 0.00000e+00 0.00000e+00 5.81622e+02 242.576 4.81298e+01 242.576 0.9848 
1 1 1 -7  36  5  o 2  1.39434e+01 4.45280e-01 3.30089e+02 75.616  2.81309e+00  1.09689e+01  0.00000e+00 0.00000e+00 1.70034e+02 75.616  1.60055e+02 255.616 0.9548 
1 1 1 -7  36  6  o 11 1.74074e+01 7.27738e-01 3.20601e+02 232.189 -9.29416e+00 -1.19772e+01 0.00000e+00 0.00000e+00 3.11009e+02 232.189 9.59213e+00 52.189  0.9664 
1 1 1 -7  36  7  o 14 1.37278e+01 4.80222e-01 3.32501e+02 147.420 -1.24374e+01 7.94805e+00  0.00000e+00 0.00000e+00 1.64781e+02 147.420 1.67720e+02 327.419 0.9655 
1 1 1 -7  36  8  o 19 9.72032e+00 8.61179e-01 1.81882e+02 16.209  5.69375e+00  1.65520e+00  0.00000e+00 0.00000e+00 1.50198e+02 16.209  3.16840e+01 196.209 0.9112 
1 1 1 -7  36  9  o 4  1.34159e+01 6.73790e-01 1.86218e+02 253.534 -3.38373e+00 -1.14480e+01 0.00000e+00 0.00000e+00 2.94820e+02 253.534 1.08602e+02 253.534 0.9572 
1 1 1 -7  36  10 o 14 2.87737e+01 5.64931e-01 5.35132e+02 93.233  -5.32402e+00 9.42500e+01  0.00000e+00 0.00000e+00 5.36105e+02 93.233  9.72731e-01 93.233  0.9947 
1 1 1 -7  36  11 f 0  1.59029e+01 4.47768e-01 1.33545e+02 224.512 -1.29658e+01 -1.27468e+01 0.00000e+00 0.00000e+00 4.44535e+02 224.512 3.10990e+02 224.512 0.9721 
1 1 1 -7  36  12 o 13 6.60312e+00 4.52336e-01 1.72038e+02 5.619   1.12831e+01  1.11004e+00  0.00000e+00 0.00000e+00 6.34920e+01 5.619   1.08546e+02 185.619 0.9548 
1 1 1 -7  36  13 o 18 1.99990e+01 8.47067e-01 3.80531e+02 186.336 -8.39216e+01 -9.31870e+00 0.00000e+00 0.00000e+00 3.61361e+02 186.336 1.91702e+01 6.336   0.9941 
1 1 1 -7  36  14 o 9  7.51668e+00 1.16322e+00 9.34601e+01 223.863 -5.57246e+00 -5.35567e+00 0.00000e+00 0.00000e+00 1.67926e+02 223.863 7.44663e+01 223.863 0.9329 
1 1 1 -7  36  15 o 12 5.61316e+00 1.28173e+00 1.20486e+02 70.109  2.69200e+00  7.44002e+00  0.00000e+00 0.00000e+00 7.48184e+01 70.109  4.56671e+01 250.108 0.9345 
1 1 1 -7  36  16 o 4  4.59363e+00 1.33529e+00 7.12777e+01 238.603 -2.19142e+00 -3.59048e+00 0.00000e+00 0.00000e+00 7.75140e+01 238.603 6.23627e+00 238.603 0.8710 
1 1 1 -7  36  17 o 8  6.40044e+00 1.65104e+00 6.72864e+01 240.005 -2.38697e+00 -4.13522e+00 0.00000e+00 0.00000e+00 1.43772e+02 240.005 7.64852e+01 240.005 0.8879 
1 1 1 -7  36  18 o 4  4.38185e+00 1.44998e+00 5.67987e+01 122.814 -1.90985e+00 2.96186e+00  0.00000e+00 0.00000e+00 8.01015e+01 122.814 2.33028e+01 122.814 0.8424 
1 1 1 -7  37  1  o 2  5.02313e+01 1.14847e+00 9.43364e+02 213.869 -6.68731e+01 -4.48836e+01 0.00000e+00 0.00000e+00 9.35246e+02 213.869 8.11794e+00 33.869  0.9938 
1 1 1 -7  37  2  o 15 7.26780e+00 5.86818e-01 1.32362e+02 268.509 -4.27686e-02 -1.64355e+00 0.00000e+00 0.00000e+00 3.98298e+01 268.509 9.25318e+01 88.509  0.6298 
1 1 1 -7  37  3  o 17 2.84999e+01 7.44461e-01 4.14716e+02 302.732 1.08828e+01  -1.69310e+01 0.00000e+00 0.00000e+00 6.29997e+02 302.732 2.15281e+02 302.732 0.9748 
1 1 1 -7  37  4  o 4  1.70862e+01 4.54930e-01 2.29804e+02 277.835 1.17033e+00  -8.50476e+00 0.00000e+00 0.00000e+00 3.73725e+02 277.835 1.43921e+02 277.835 0.9398 
1 1 1 -7  37  5  o 8  2.32216e+01 4.92982e-01 5.43672e+02 286.489 8.65470e+00  -2.92389e+01 0.00000e+00 0.00000e+00 3.14187e+02 286.489 2.29486e+02 106.489 0.9835 
1 1 1 -7  37  6  o 7  2.16168e+01 5.85925e-01 3.75184e+02 156.593 -2.08737e+01 9.03594e+00  0.00000e+00 0.00000e+00 4.18274e+02 156.593 4.30899e+01 156.593 0.9778 
1 1 1 -7  37  7  o 4  1.31195e+01 4.73038e-01 2.13687e+02 157.871 -8.10732e+00 3.29677e+00  0.00000e+00 0.00000e+00 2.49455e+02 157.871 3.57674e+01 157.871 0.9410 
1 1 1 -7  37  8  o 6  2.04319e+01 5.66511e-01 2.37001e+02 59.278  9.66615e+00  1.62656e+01  0.00000e+00 0.00000e+00 5.08408e+02 59.278  2.71407e+02 59.278  0.9732 
1 1 1 -7  37  9  o 7  1.46624e+01 4.81888e-01 1.43660e+02 223.833 -7.22423e+00 -6.93568e+00 0.00000e+00 0.00000e+00 3.77364e+02 223.833 2.33704e+02 223.833 0.9487 
1 1 1 -7  37  10 o 3  2.08407e+01 4.94799e-01 3.64395e+02 271.904 1.59099e+00  -4.78671e+01 0.00000e+00 0.00000e+00 4.07377e+02 271.904 4.29824e+01 271.904 0.9895 
1 1 1 -7  37  11 o 7  1.38015e+01 4.50737e-01 2.30449e+02 210.271 -2.21475e+01 -1.29272e+01 0.00000e+00 0.00000e+00 2.75429e+02 210.271 4.49808e+01 210.271 0.9803 
1 1 1 -7  37  12 o 8  1.77878e+01 4.43918e-01 3.13184e+02 309.176 3.51953e+01  -4.31912e+01 0.00000e+00 0.00000e+00 3.45259e+02 309.176 3.20747e+01 309.176 0.9910 
1 1 1 -7  37  13 o 18 3.37500e+00 1.00296e+00 9.55798e+01 245.622 -1.46230e+00 -3.22697e+00 0.00000e+00 0.00000e+00 1.06231e+01 245.622 8.49568e+01 65.622  0.8433 
1 1 1 -7  37  14 o 17 6.88451e+00 1.17666e+00 9.13596e+01 152.931 -6.29948e+00 3.21936e+00  0.00000e+00 0.00000e+00 1.46349e+02 152.931 5.49897e+01 152.931 0.9264 
1 1 1 -7  37  15 o 9  3.36474e+00 1.06742e+00 1.67454e+01 27.495  6.80838e-01  3.54351e-01  0.00000e+00 0.00000e+00 2.81036e+01 27.495  1.13582e+01 27.495  0.3580 
1 1 1 -7  37  16 o 6  3.77325e+00 1.19494e+00 9.06784e+01 129.982 -3.20106e+00 3.81736e+00  0.00000e+00 0.00000e+00 3.46071e+01 129.982 5.60713e+01 309.982 0.8930 
1 1 1 -7  37  17 o 3  9.04337e+00 1.67737e+00 1.61835e+02 184.495 -1.58733e+01 -1.24797e+00 0.00000e+00 0.00000e+00 1.63275e+02 184.495 1.44009e+00 184.495 0.9681 
1 1 1 -7  38  1  o 17 1.58963e+01 8.21372e-01 1.02478e+02 89.808  9.20231e-03  2.75317e+00  0.00000e+00 0.00000e+00 3.70043e+02 89.808  2.67566e+02 89.808  0.7899 
1 1 1 -7  38  2  o 12 4.39119e+01 8.00045e-01 8.49727e+02 238.498 -3.31856e+01 -5.41503e+01 0.00000e+00 0.00000e+00 7.88989e+02 238.498 6.07378e+01 58.498  0.9921 
1 1 1 -7  38  3  o 10 2.36042e+01 5.33803e-01 2.84600e+02 84.554  1.33639e+00  1.40174e+01  0.00000e+00 0.00000e+00 5.70780e+02 84.554  2.86180e+02 84.554  0.9638 
1 1 1 -7  38  4  o 4  9.87752e+00 5.62141e-01 1.81911e+02 344.430 3.84893e+00  -1.07245e+00 0.00000e+00 0.00000e+00 1.38568e+02 344.430 4.33432e+01 164.430 0.8634 
1 1 1 -7  38  5  f 0  1.08296e+01 7.64484e-01 2.79445e+02 203.696 -7.32772e+00 -3.21611e+00 0.00000e+00 0.00000e+00 1.00978e+02 203.696 1.78466e+02 23.697  0.9353 
1 1 1 -7  38  6  o 5  1.69716e+01 5.24775e-01 2.92952e+02 103.160 -3.17420e+00 1.35763e+01  0.00000e+00 0.00000e+00 3.20811e+02 103.160 2.78593e+01 103.160 0.9634 
1 1 1 -7  38  7  o 7  8.67327e+00 5.50502e-01 1.73945e+02 87.753  1.89398e-01  4.82685e+00  0.00000e+00 0.00000e+00 1.15383e+02 87.753  5.85620e+01 267.753 0.8893 
1 1 1 -7  38  8  o 5  1.05783e+01 5.25405e-01 3.06398e+02 72.192  4.26907e+00  1.32901e+01  0.00000e+00 0.00000e+00 7.56334e+01 72.192  2.30764e+02 252.192 0.9635 
1 1 1 -7  38  9  o 18 2.30868e+01 5.32686e-01 4.70186e+02 97.343  -7.04657e+00 5.46838e+01  0.00000e+00 0.00000e+00 3.86611e+02 97.343  8.35755e+01 277.343 0.9909 
1 1 1 -7  38  10 o 15 1.60425e+01 4.63057e-01 3.10892e+02 339.573 3.25075e+01  -1.21067e+01 0.00000e+00 0.00000e+00 2.80716e+02 339.573 3.01760e+01 159.573 0.9855 
1 1 1 -7  38  11 o 11 2.04326e+01 4.78476e-01 3.97818e+02 165.404 -6.29624e+01 1.63954e+01  0.00000e+00 0.00000e+00 3.60187e+02 165.404 3.76315e+01 345.404 0.9923 
1 1 1 -7  38  12 o 4  2.68426e+01 5.31051e-01 4.69262e+02 340.598 1.29858e+02  -4.57352e+01 0.00000e+00 0.00000e+00 5.29651e+02 340.598 6.03887e+01 340.598 0.9964 
1 1 1 -7  38  13 o 2  1.49877e+01 8.25252e-01 2.65300e+02 132.910 -3.32010e+01 3.57163e+01  0.00000e+00 0.00000e+00 2.88137e+02 132.910 2.28371e+01 132.910 0.9897 
1 1 1 -7  38  14 o 2  1.01594e+01 9.85424e-01 1.78893e+02 227.902 -1.49787e+01 -1.65784e+01 0.00000e+00 0.00000e+00 1.91167e+02 227.902 1.22742e+01 227.902 0.9774 
1 1 1 -7  38  15 o 18 1.15573e+01 1.10047e+00 1.61820e+02 323.142 1.88549e+01  -1.41353e+01 0.00000e+00 0.00000e+00 2.59179e+02 323.142 9.73597e+01 323.142 0.9785 
1 1 1 -7  38  16 o 18 8.86231e+00 1.42743e+00 1.18401e+02 183.041 -1.25523e+01 -6.66884e-01 0.00000e+00 0.00000e+00 1.97708e+02 183.041 7.93080e+01 183.041 0.9594 
1 1 1 -7  38  17 o 12 7.59750e+00 1.70263e+00 9.09211e+01 54.930  4.35650e+00  6.20560e+00  0.00000e+00 0.00000e+00 1.71867e+02 54.930  8.09460e+01 54.930  0.9315 
1 1 1 -7  39  1  o 8  1.78452e+01 4.96335e-01 3.09970e+02 203.826 -8.72062e+00 -3.85104e+00 0.00000e+00 0.00000e+00 3.25211e+02 203.826 1.52411e+01 203.826 0.9460 
1 1 1 -7  39  2  o 1  2.67971e+01 6.95460e-01 5.48865e+02 46.688  2.10613e+01  2.23401e+01  0.00000e+00 0.00000e+00 4.42467e+02 46.688  1.06398e+02 226.688 0.9836 
1 1 1 -7  39  3  f 0  3.78067e+01 7.29694e-01 6.32114e+02 323.702 3.98555e+01  -2.92750e+01 0.00000e+00 0.00000e+00 7.74793e+02 323.702 1.42679e+02 323.702 0.9898 
1 1 1 -7  39  4  o 7  1.47962e+01 7.14995e-01 1.88890e+02 298.131 3.20248e+00  -5.98980e+00 0.00000e+00 0.00000e+00 3.24365e+02 298.131 1.35475e+02 298.131 0.9231 
1 1 1 -7  39  5  o 8  1.81528e+01 6.13399e-01 3.36300e+02 337.888 1.47478e+01  -5.99215e+00 0.00000e+00 0.00000e+00 3.23669e+02 337.888 1.26307e+01 157.888 0.9681 
1 1 1 -7  39  6  o 13 5.58849e+00 1.01294e+00 7.25783e+01 209.752 -1.02068e+00 -5.83418e-01 0.00000e+00 0.00000e+00 3.33824e+01 209.752 3.91959e+01 29.752  0.5052 
1 1 1 -7  39  7  o 12 2.32888e+01 5.13835e-01 4.72126e+02 218.566 -2.84419e+01 -2.26777e+01 0.00000e+00 0.00000e+00 3.89277e+02 218.566 8.28495e+01 38.566  0.9862 
1 1 1 -7  39  8  o 16 9.87538e+00 7.90016e-01 1.46826e+02 147.841 -5.11684e+00 3.21714e+00  0.00000e+00 0.00000e+00 1.91111e+02 147.841 4.42851e+01 147.841 0.9130 
1 1 1 -7  39  9  o 18 3.33052e+01 6.49431e-01 4.71986e+02 327.956 7.16405e+01  -4.48417e+01 0.00000e+00 0.00000e+00 7.67867e+02 327.956 2.95882e+02 327.956 0.9941 
1 1 1 -7  39  10 o 1  1.13131e+01 4.66318e-01 2.51569e+02 186.269 -2.03257e+01 -2.23268e+00 0.00000e+00 0.00000e+00 1.61248e+02 186.269 9.03219e+01 6.269   0.9752 
1 1 1 -7  39  11 o 11 6.66297e+00 5.18496e-01 1.50827e+02 66.984  3.41273e+00  8.03354e+00  0.00000e+00 0.00000e+00 8.35150e+01 66.984  6.73123e+01 246.984 0.9408 
1 1 1 -7  39  12 o 16 1.13923e+01 4.21244e-01 2.36206e+02 337.169 2.71694e+01  -1.14384e+01 0.00000e+00 0.00000e+00 1.81966e+02 337.169 5.42395e+01 157.169 0.9829 
1 1 1 -7  39  13 o 5  1.26945e+01 8.41752e-01 2.35812e+02 188.780 -3.59576e+01 -5.55367e+00 0.00000e+00 0.00000e+00 2.31222e+02 188.780 4.59084e+00 8.780   0.9862 
1 1 1 -7  39  14 o 10 5.14669e+00 1.06270e+00 1.09576e+02 261.702 -1.01417e+00 -6.95339e+00 0.00000e+00 0.00000e+00 6.79916e+01 261.702 4.15846e+01 81.702  0.9258 
1 1 1 -7  39  15 o 6  1.11689e+01 1.14586e+00 2.12173e+02 31.354  2.74708e+01  1.67378e+01  0.00000e+00 0.00000e+00 1.97041e+02 31.354  1.51326e+01 211.354 0.9843 
1 1 1 -7  39  16 o 5  4.69313e+00 1.30828e+00 3.79524e+01 128.098 -1.44277e+00 1.84017e+00  0.00000e+00 0.00000e+00 9.22398e+01 128.098 5.42874e+01 128.098 0.7462 
1 1 1 -7  39  17 o 4  5.94761e+00 1.72880e+00 3.32961e+01 82.159  2.89917e-01  2.10521e+00  0.00000e+00 0.00000e+00 1.25096e+02 82.159  9.18003e+01 82.159  0.7173 
1 1 1 -7  40  1  o 5  2.29777e+01 6.63746e-01 3.92671e+02 325.046 1.54521e+01  -1.08012e+01 0.00000e+00 0.00000e+00 4.48539e+02 325.046 5.58688e+01 325.046 0.9731 
1 1 1 -7  40  2  f 0  2.23256e+01 4.98026e-01 3.91202e+02 250.178 -6.21712e+00 -1.72482e+01 0.00000e+00 0.00000e+00 4.25182e+02 250.178 3.39801e+01 250.178 0.9723 
1 1 1 -7  40  3  o 3  2.43387e+01 5.10132e-01 4.58803e+02 133.213 -1.66437e+01 1.77154e+01  0.00000e+00 0.00000e+00 4.37098e+02 133.213 2.17050e+01 313.213 0.9792 
1 1 1 -7  40  4  o 12 1.76367e+01 5.66277e-01 4.79354e+02 264.543 -1.96140e+00 -2.05316e+01 0.00000e+00 0.00000e+00 1.67032e+02 264.543 3.12321e+02 84.543  0.9754 
1 1 1 -7  40  5  o 17 1.62637e+01 4.54880e-01 2.85836e+02 5.233   1.21392e+01  1.11191e+00  0.00000e+00 0.00000e+00 2.99280e+02 5.233   1.34447e+01 5.233   0.9581 
1 1 1 -7  40  6  o 1  2.66873e+01 6.00676e-01 5.06255e+02 50.735  2.44495e+01  2.99090e+01  0.00000e+00 0.00000e+00 4.82227e+02 50.735  2.40288e+01 230.735 0.9870 
1 1 1 -7  40  7  o 13 1.40993e+01 4.79682e-01 2.61955e+02 212.355 -1.11707e+01 -7.07677e+00 0.00000e+00 0.00000e+00 2.46406e+02 212.355 1.55486e+01 32.355  0.9614 
1 1 1 -7  40  8  o 1  3.53378e+01 6.47787e-01 6.75072e+02 234.370 -6.05838e+01 -8.45287e+01 0.00000e+00 0.00000e+00 6.42836e+02 234.370 3.22361e+01 54.370  0.9952 
1 1 1 -7  40  9  o 19 3.47182e+01 6.63865e-01 6.71717e+02 307.924 8.44638e+01  -1.08406e+02 0.00000e+00 0.00000e+00 6.23574e+02 307.924 4.81429e+01 127.924 0.9964 
1 1 1 -7  40  10 o 7  1.66299e+01 4.61650e-01 2.85657e+02 71.905  1.11957e+01  3.42644e+01  0.00000e+00 0.00000e+00 3.27824e+02 71.905  4.21661e+01 71.905  0.9860 
1 1 1 -7  40  11 o 12 1.12287e+01 4.58071e-01 1.58750e+02 76.152  3.78830e+00  1.53673e+01  0.00000e+00 0.00000e+00 2.47477e+02 76.152  8.87266e+01 76.152  0.9679 
1 1 1 -7  40  12 o 17 1.00184e+01 4.33276e-01 1.50181e+02 59.529  8.74141e+00  1.48574e+01  0.00000e+00 0.00000e+00 2.12902e+02 59.529  6.27207e+01 59.529  0.9705 
1 1 1 -7  40  13 o 6  1.23093e+01 8.41535e-01 2.08232e+02 241.877 -1.38929e+01 -2.59938e+01 0.00000e+00 0.00000e+00 2.43078e+02 241.877 3.48453e+01 241.877 0.9829 
1 1 1 -7  40  14 o 2  7.15090e+00 1.16900e+00 7.30608e+01 20.190  5.67577e+00  2.08716e+00  0.00000e+00 0.00000e+00 1.70233e+02 20.190  9.71721e+01 20.190  0.9131 
1 1 1 -7  40  15 o 6  6.59313e+00 1.39963e+00 1.47753e+02 30.818  9.22436e+00  5.50277e+00  0.00000e+00 0.00000e+00 8.59103e+01 30.818  6.18429e+01 210.818 0.9522 
1 1 1 -7  40  16 o 9  6.18308e+00 1.44934e+00 8.34588e+01 237.405 -3.16625e+00 -4.95193e+00 0.00000e+00 0.00000e+00 1.25789e+02 237.405 4.23297e+01 237.405 0.9104 
1 1 1 -7  40  17 o 10 6.47345e+00 2.04307e+00 1.48110e+02 52.937  5.06558e+00  6.70691e+00  0.00000e+00 0.00000e+00 7.74251e+01 52.937  7.06851e+01 232.937 0.9385 
1 1 1 -7  41  1  o 14 2.99673e+01 1.01526e+00 3.40675e+02 295.938 9.08655e+00  -1.86812e+01 0.00000e+00 0.00000e+00 7.59142e+02 295.938 4.18467e+02 295.938 0.9756 
1 1 1 -7  41  2  f 0  3.51636e+01 6.32151e-01 6.54107e+02 236.895 -2.72765e+01 -4.18338e+01 0.00000e+00 0.00000e+00 6.54858e+02 236.895 7.51374e-01 236.895 0.9899 
1 1 1 -7  41  3  o 5  3.22284e+01 5.95169e-01 6.67264e+02 334.584 4.30247e+01  -2.04441e+01 0.00000e+00 0.00000e+00 5.31321e+02 334.584 1.35944e+02 154.584 0.9894 
1 1 1 -7  41  4  o 14 1.89300e+01 4.67223e-01 4.08472e+02 62.413  8.63811e+00  1.65320e+01  0.00000e+00 0.00000e+00 2.83364e+02 62.413  1.25108e+02 242.412 0.9728 
1 1 1 -7  41  5  o 11 6.30575e+00 7.43997e-01 1.01195e+02 312.350 1.16328e+00  -1.27620e+00 0.00000e+00 0.00000e+00 5.20898e+01 312.350 4.91051e+01 132.350 0.6474 
1 1 1 -7  41  6  o 7  1.29493e+01 4.79501e-01 2.84452e+02 100.823 -2.23655e+00 1.16993e+01  0.00000e+00 0.00000e+00 1.80595e+02 100.823 1.03857e+02 280.823 0.9571 
1 1 1 -7  41  7  o 9  1.51973e+01 4.84555e-01 2.38386e+02 163.085 -1.20416e+01 3.66199e+00  0.00000e+00 0.00000e+00 3.08365e+02 163.085 6.99789e+01 163.085 0.9594 
1 1 1 -7  41  8  o 18 1.16339e+01 5.92495e-01 9.44135e+01 183.806 -5.02169e+00 -3.34068e-01 0.00000e+00 0.00000e+00 2.95373e+02 183.806 2.00960e+02 183.806 0.8941 
1 1 1 -7  41  9  o 9  1.61043e+01 5.08262e-01 2.09450e+02 155.956 -1.77530e+01 7.92047e+00  0.00000e+00 0.00000e+00 3.77794e+02 155.956 1.68344e+02 155.956 0.9739 
1 1 1 -7  41  10 o 9  1.71323e+01 4.70561e-01 2.38273e+02 336.411 2.84845e+01  -1.24383e+01 0.00000e+00 0.00000e+00 3.92229e+02 336.411 1.53956e+02 336.411 0.9838 
1 1 1 -7  41  11 o 19 9.15684e+00 4.68115e-01 1.68050e+02 311.631 9.53944e+00  -1.07330e+01 0.00000e+00 0.00000e+00 1.62039e+02 311.631 6.01105e+00 131.631 0.9645 
1 1 1 -7  41  12 o 14 1.08434e+01 4.54880e-01 1.65262e+02 80.545  3.23276e+00  1.94122e+01  0.00000e+00 0.00000e+00 2.29176e+02 80.545  6.39138e+01 80.545  0.9743 
1 1 1 -7  41  13 o 11 7.24440e+00 8.32545e-01 1.11284e+02 197.853 -9.66417e+00 -3.11265e+00 0.00000e+00 0.00000e+00 1.45247e+02 197.853 3.39627e+01 197.853 0.9494 
1 1 1 -7  41  14 o 15 1.93181e+01 1.80007e+00 3.43297e+02 124.983 -3.10241e+01 4.43348e+01  0.00000e+00 0.00000e+00 3.69758e+02 124.983 2.64611e+01 124.983 0.9907 
1 1 1 -7  41  15 o 13 1.18803e+01 1.15189e+00 1.51779e+02 357.622 2.47805e+01  -1.02906e+00 0.00000e+00 0.00000e+00 2.81323e+02 357.622 1.29544e+02 357.622 0.9796 
1 1 1 -7  41  16 o 9  5.75948e+00 1.81192e+00 1.12892e+02 63.920  2.73755e+00  5.59306e+00  0.00000e+00 0.00000e+00 8.31396e+01 63.920  2.97529e+01 243.920 0.9157 
1 1 1 -7  41  17 o 9  6.57904e+00 2.09540e+00 6.78305e+01 206.349 -3.45876e+00 -1.71309e+00 0.00000e+00 0.00000e+00 1.41681e+02 206.349 7.38507e+01 206.349 0.8579 
1 1 1 -7  42  1  o 8  3.59858e+01 6.96375e-01 5.10677e+02 335.583 3.61749e+01  -1.64226e+01 0.00000e+00 0.00000e+00 8.25718e+02 335.583 3.15041e+02 335.583 0.9873 
1 1 1 -7  42  2  o 8  1.08895e+01 5.73356e-01 2.03052e+02 99.395  -8.02566e-01 4.85043e+00  0.00000e+00 0.00000e+00 1.61923e+02 99.395  4.11289e+01 279.395 0.8914 
1 1 1 -7  42  3  o 8  2.23195e+01 5.01649e-01 3.98844e+02 47.822  1.46561e+01  1.61759e+01  0.00000e+00 0.00000e+00 4.20537e+02 47.822  2.16933e+01 47.822  0.9768 
1 1 1 -7  42  4  o 18 2.40621e+01 5.08473e-01 3.26012e+02 72.672  6.26117e+00  2.00674e+01  0.00000e+00 0.00000e+00 5.56091e+02 72.672  2.30080e+02 72.672  0.9759 
1 1 1 -7  42  5  o 16 1.78263e+01 4.67947e-01 3.19354e+02 295.625 6.92554e+00  -1.44385e+01 0.00000e+00 0.00000e+00 3.28657e+02 295.625 9.30264e+00 295.625 0.9683 
1 1 1 -7  42  6  o 12 1.53080e+01 4.74972e-01 2.82595e+02 282.024 2.81157e+00  -1.32002e+01 0.00000e+00 0.00000e+00 2.70056e+02 282.024 1.25398e+01 102.024 0.9622 
1 1 1 -7  42  7  o 15 1.54476e+01 4.80848e-01 4.21702e+02 71.676  8.07609e+00  2.43854e+01  0.00000e+00 0.00000e+00 1.46109e+02 71.676  2.75592e+02 251.676 0.9803 
1 1 1 -7  42  8  o 2  3.37916e+01 6.29832e-01 6.32766e+02 154.105 -9.25440e+01 4.49274e+01  0.00000e+00 0.00000e+00 6.27126e+02 154.105 5.63950e+00 334.105 0.9951 
1 1 1 -7  42  9  o 18 6.33917e+00 6.66525e-01 1.54588e+02 272.295 2.23162e-01  -5.56817e+00 0.00000e+00 0.00000e+00 6.02231e+01 272.295 9.43648e+01 92.295  0.9052 
1 1 1 -7  42  10 o 4  1.20796e+01 4.69313e-01 1.92151e+02 51.152  1.08581e+01  1.34817e+01  0.00000e+00 0.00000e+00 2.46429e+02 51.152  5.42784e+01 51.152  0.9707 
1 1 1 -7  42  11 o 12 4.46896e+00 7.09410e-01 5.32495e+01 60.831  1.02937e+00  1.84421e+00  0.00000e+00 0.00000e+00 6.62158e+01 60.831  1.29662e+01 60.831  0.7153 
1 1 1 -7  42  12 f 0  1.32450e+01 4.57842e-01 1.62031e+02 309.273 1.48715e+01  -1.81869e+01 0.00000e+00 0.00000e+00 3.21806e+02 309.273 1.59774e+02 309.273 0.9785 
1 1 1 -7  42  13 o 10 1.57081e+01 6.55033e-01 2.59919e+02 124.375 -3.08827e+01 4.51459e+01  0.00000e+00 0.00000e+00 3.20520e+02 124.375 6.06012e+01 124.375 0.9908 
1 1 1 -7  42  14 o 9  4.49620e+00 1.19906e+00 9.50952e+01 331.701 4.69791e+00  -2.52944e+00 0.00000e+00 0.00000e+00 5.57560e+01 331.701 3.93391e+01 151.701 0.9006 
1 1 1 -7  42  15 o 10 7.72009e+00 1.61290e+00 1.13471e+02 337.148 8.04392e+00  -3.39001e+00 0.00000e+00 0.00000e+00 1.56796e+02 337.148 4.33252e+01 337.148 0.9408 
1 1 1 -7  42  16 f 0  4.92241e+00 1.65201e+00 7.89339e+01 255.367 -1.03319e+00 -3.95728e+00 0.00000e+00 0.00000e+00 7.96510e+01 255.367 7.17109e-01 255.367 0.8669 
1 1 1 -7  42  17 f 0  5.08477e+00 1.73767e+00 1.14847e+02 161.872 -5.98494e+00 1.95943e+00  0.00000e+00 0.00000e+00 5.81660e+01 161.872 5.66812e+01 341.872 0.9167 
1 1 1 -7  43  1  o 5  2.80071e+01 5.94553e-01 5.65918e+02 290.001 1.20312e+01  -3.30530e+01 0.00000e+00 0.00000e+00 4.72314e+02 290.001 9.36041e+01 110.001 0.9857 
1 1 1 -7  43  2  o 18 1.15712e+01 4.77709e-01 1.67522e+02 100.559 -8.74493e-01 4.69139e+00  0.00000e+00 0.00000e+00 2.18693e+02 100.559 5.11709e+01 100.559 0.8878 
1 1 1 -7  43  3  o 13 4.96183e+01 8.21618e-01 8.46408e+02 257.374 -2.17221e+01 -9.69751e+01 0.00000e+00 0.00000e+00 1.00876e+03 257.374 1.62356e+02 257.374 0.9950 
1 1 1 -7  43  4  o 16 9.35403e+00 5.27520e-01 1.18486e+02 20.492  2.71390e+00  1.01423e+00  0.00000e+00 0.00000e+00 1.63316e+02 20.492  4.48297e+01 20.492  0.8021 
1 1 1 -7  43  5  o 3  2.84514e+01 6.44508e-01 3.10967e+02 264.462 -2.55902e+00 -2.63911e+01 0.00000e+00 0.00000e+00 7.36727e+02 264.462 4.25760e+02 264.462 0.9810 
1 1 1 -7  43  6  o 6  3.08612e+01 5.83721e-01 4.09198e+02 251.471 -1.28044e+01 -3.82035e+01 0.00000e+00 0.00000e+00 7.34121e+02 251.471 3.24923e+02 251.471 0.9875 
1 1 1 -7  43  7  o 11 3.17654e+01 6.13128e-01 5.94289e+02 30.333  6.97718e+01  4.08252e+01  0.00000e+00 0.00000e+00 5.89211e+02 30.333  5.07807e+00 210.333 0.9938 
1 1 1 -7  43  8  o 19 2.28176e+01 5.82347e-01 4.31427e+02 227.979 -3.10885e+01 -3.45021e+01 0.00000e+00 0.00000e+00 4.14121e+02 227.979 1.73056e+01 47.979  0.9892 
1 1 1 -7  43  9  o 5  9.31096e+00 4.87249e-01 1.47437e+02 205.443 -7.67964e+00 -3.65359e+00 0.00000e+00 0.00000e+00 1.79913e+02 205.443 3.24761e+01 205.443 0.9392 
1 1 1 -7  43  10 o 12 1.11214e+01 4.68479e-01 9.48872e+01 144.299 -6.74855e+00 4.84959e+00  0.00000e+00 0.00000e+00 2.95163e+02 144.299 2.00275e+02 144.299 0.9377 
1 1 1 -7  43  11 o 8  2.79013e+01 5.47867e-01 4.67682e+02 226.242 -8.27782e+01 -8.64486e+01 0.00000e+00 0.00000e+00 5.70501e+02 226.242 1.02819e+02 226.242 0.9958 
1 1 1 -7  43  12 o 13 1.56613e+01 4.59076e-01 2.51758e+02 325.186 3.74922e+01  -2.60715e+01 0.00000e+00 0.00000e+00 3.26422e+02 325.186 7.46636e+01 325.186 0.9890 
1 1 1 -7  43  13 o 10 1.03238e+01 7.42176e-01 1.65348e+02 270.956 3.79522e-01  -2.27412e+01 0.00000e+00 0.00000e+00 2.11063e+02 270.956 4.57151e+01 270.956 0.9778 
1 1 1 -7  43  14 o 9  1.13538e+01 1.07881e+00 1.67890e+02 53.461  1.47987e+01  1.99708e+01  0.00000e+00 0.00000e+00 2.46425e+02 53.461  7.85354e+01 53.461  0.9797 
1 1 1 -7  43  15 o 8  7.19575e+00 1.91643e+00 1.89356e+02 214.479 -9.73056e+00 -6.68244e+00 0.00000e+00 0.00000e+00 6.67585e+01 214.479 1.22597e+02 34.479  0.9567 
1 1 1 -7  43  16 o 7  6.37960e+00 1.99464e+00 8.10556e+01 119.186 -2.18926e+00 3.91944e+00  0.00000e+00 0.00000e+00 1.27563e+02 119.186 4.65077e+01 119.186 0.8800 
1 1 1 -7  43  17 o 17 5.34946e+00 1.79618e+00 7.23420e+01 354.545 3.97157e+00  -3.79245e-01 0.00000e+00 0.00000e+00 9.90103e+01 354.545 2.66683e+01 354.545 0.8631 
1 1 1 -7  44  1  o 11 1.78341e+01 4.79590e-01 3.15653e+02 23.342  1.27091e+01  5.48452e+00  0.00000e+00 0.00000e+00 3.30287e+02 23.342  1.46335e+01 23.342  0.9632 
1 1 1 -7  44  2  o 3  3.71492e+01 6.61877e-01 4.76413e+02 174.223 -4.21987e+01 4.26932e+00  0.00000e+00 0.00000e+00 9.03472e+02 174.223 4.27058e+02 174.223 0.9881 
1 1 1 -7  44  3  o 13 2.13444e+01 4.96350e-01 2.86968e+02 173.728 -1.63448e+01 1.79636e+00  0.00000e+00 0.00000e+00 4.90240e+02 173.728 2.03272e+02 173.728 0.9691 
1 1 1 -7  44  4  o 6  2.24842e+01 6.30718e-01 3.70766e+02 185.481 -2.26397e+01 -2.17255e+00 0.00000e+00 0.00000e+00 4.54857e+02 185.481 8.40913e+01 185.481 0.9778 
1 1 1 -7  44  5  o 7  1.58117e+01 4.75422e-01 4.00659e+02 332.634 1.61895e+01  -8.37977e+00 0.00000e+00 0.00000e+00 1.76308e+02 332.634 2.24351e+02 152.634 0.9722 
1 1 1 -7  44  6  o 10 1.94096e+01 5.24443e-01 2.93675e+02 197.592 -1.79350e+01 -5.68657e+00 0.00000e+00 0.00000e+00 4.14783e+02 197.592 1.21108e+02 197.592 0.9731 
1 1 1 -7  44  7  f 0  1.97220e+01 5.05177e-01 2.78630e+02 62.081  1.10628e+01  2.08773e+01  0.00000e+00 0.00000e+00 4.44846e+02 62.081  1.66216e+02 62.081  0.9786 
1 1 1 -7  44  8  o 19 1.57026e+01 6.02039e-01 2.72817e+02 254.694 -5.70742e+00 -2.08546e+01 0.00000e+00 0.00000e+00 3.01602e+02 254.694 2.87845e+01 254.694 0.9766 
1 1 1 -7  44  9  o 7  1.64670e+01 4.61719e-01 2.19875e+02 79.793  4.06265e+00  2.25639e+01  0.00000e+00 0.00000e+00 3.82857e+02 79.793  1.62982e+02 79.793  0.9779 
1 1 1 -7  44  10 o 19 1.02801e+01 4.79314e-01 1.67507e+02 223.632 -1.06190e+01 -1.01237e+01 0.00000e+00 0.00000e+00 2.03584e+02 223.632 3.60774e+01 223.632 0.9653 
1 1 1 -7  44  11 o 15 4.32281e+00 6.53072e-01 1.31315e+02 144.737 -4.38922e+00 3.10354e+00  0.00000e+00 0.00000e+00 1.42692e+01 144.737 1.17046e+02 324.736 0.9014 
1 1 1 -7  44  12 o 4  1.06467e+01 4.83427e-01 1.50676e+02 224.453 -1.34486e+01 -1.31940e+01 0.00000e+00 0.00000e+00 2.36011e+02 224.453 8.53346e+01 224.453 0.9731 
1 1 1 -7  44  13 o 15 1.36837e+01 4.79263e-01 2.11007e+02 321.108 3.27056e+01  -2.63829e+01 0.00000e+00 0.00000e+00 2.93086e+02 321.108 8.20790e+01 321.108 0.9880 
1 1 1 -7  44  14 o 3  1.15029e+01 1.90222e+00 8.90590e+01 191.346 -8.23061e+00 -1.65151e+00 0.00000e+00 0.00000e+00 3.12965e+02 191.346 2.23906e+02 191.346 0.9384 
1 1 1 -7  44  15 o 17 1.00916e+01 2.13519e+00 1.23705e+02 96.471  -1.06450e+00 9.38553e+00  0.00000e+00 0.00000e+00 2.31243e+02 96.471  1.07538e+02 96.471  0.9455 
1 1 1 -7  44  16 o 19 6.36891e+00 1.97519e+00 5.21347e+01 284.411 6.95132e-01  -2.70516e+00 0.00000e+00 0.00000e+00 1.35622e+02 284.411 8.34872e+01 284.411 0.7934 
1 1 1 -7  44  17 o 8  4.29271e+00 1.39440e+00 6.79103e+01 107.443 -1.25614e+00 3.99771e+00  0.00000e+00 0.00000e+00 7.07453e+01 107.443 2.83503e+00 107.443 0.8705 
1 1 1 -7  45  1  o 11 2.93769e+01 5.76520e-01 5.16065e+02 302.257 1.94675e+01  -3.08455e+01 0.00000e+00 0.00000e+00 5.73250e+02 302.257 5.71849e+01 302.257 0.9862 
1 1 1 -7  45  2  o 5  3.71481e+01 8.41368e-01 6.35689e+02 145.077 -5.09033e+01 3.55416e+01  0.00000e+00 0.00000e+00 7.49255e+02 145.077 1.13566e+02 145.077 0.9919 
1 1 1 -7  45  3  o 14 1.13332e+01 4.89969e-01 2.50873e+02 340.322 7.01661e+00  -2.50923e+00 0.00000e+00 0.00000e+00 1.45211e+02 340.322 1.05662e+02 160.322 0.9303 
1 1 1 -7  45  4  o 15 1.97057e+01 5.11033e-01 2.91222e+02 234.209 -9.41870e+00 -1.30638e+01 0.00000e+00 0.00000e+00 4.25386e+02 234.209 1.34164e+02 234.209 0.9684 
1 1 1 -7  45  5  o 7  3.75533e+01 7.77254e-01 5.34840e+02 149.661 -5.47417e+01 3.20386e+01  0.00000e+00 0.00000e+00 8.63372e+02 149.661 3.28531e+02 149.661 0.9921 
1 1 1 -7  45  6  o 9  1.84812e+01 7.70310e-01 3.81820e+02 103.194 -5.61641e+00 2.39566e+01  0.00000e+00 0.00000e+00 2.97111e+02 103.194 8.47097e+01 283.194 0.9795 
1 1 1 -7  45  7  o 1  3.20985e+01 6.09029e-01 5.84864e+02 59.224  4.20886e+01  7.06710e+01  0.00000e+00 0.00000e+00 6.10886e+02 59.224  2.60216e+01 59.224  0.9939 
1 1 1 -7  45  8  f 0  2.63243e+01 5.28341e-01 4.34497e+02 84.623  5.84879e+00  6.21380e+01  0.00000e+00 0.00000e+00 5.43504e+02 84.623  1.09007e+02 84.623  0.9920 
1 1 1 -7  45  9  o 2  1.35593e+01 4.66756e-01 2.43857e+02 255.929 -5.58664e+00 -2.22900e+01 0.00000e+00 0.00000e+00 2.52412e+02 255.929 8.55500e+00 255.929 0.9780 
1 1 1 -7  45  10 o 2  1.43171e+01 4.57808e-01 3.24461e+02 275.940 3.86867e+00  -3.71847e+01 0.00000e+00 0.00000e+00 2.03664e+02 275.940 1.20797e+02 95.940  0.9865 
1 1 1 -7  45  11 o 19 1.01044e+01 4.76172e-01 2.44503e+02 192.745 -2.39329e+01 -5.41344e+00 0.00000e+00 0.00000e+00 1.25188e+02 192.745 1.19316e+02 12.745  0.9794 
1 1 1 -7  45  12 o 12 1.12453e+01 4.89507e-01 2.05294e+02 287.843 8.72019e+00  -2.70897e+01 0.00000e+00 0.00000e+00 2.06937e+02 287.843 1.64291e+00 287.843 0.9823 
1 1 1 -7  45  13 o 12 5.82484e+00 7.30397e-01 8.93258e+01 359.961 7.25337e+00  -4.87601e-03 0.00000e+00 0.00000e+00 1.12249e+02 359.961 2.29237e+01 359.961 0.9283 
1 1 1 -7  45  14 o 4  8.61151e+00 1.93898e+00 1.09725e+02 194.071 -7.31987e+00 -1.83468e+00 0.00000e+00 0.00000e+00 1.88890e+02 194.071 7.91646e+01 194.071 0.9312 
1 1 1 -7  45  15 o 12 1.16160e+01 2.27909e+00 1.99837e+02 48.619  1.07534e+01  1.22057e+01  0.00000e+00 0.00000e+00 2.18734e+02 48.619  1.88963e+01 48.619  0.9688 
1 1 1 -7  45  16 o 2  8.00380e+00 2.22626e+00 1.34001e+02 23.277  7.28900e+00  3.13561e+00  0.00000e+00 0.00000e+00 1.43921e+02 23.277  9.91947e+00 23.277  0.9347 
1 1 1 -7  45  17 o 15 5.19051e+00 1.57852e+00 6.77901e+01 154.173 -3.94879e+00 1.91118e+00  0.00000e+00 0.00000e+00 1.01086e+02 154.173 3.32959e+01 154.173 0.8769 
1 1 1 -7  46  1  o 18 1.60461e+01 4.88742e-01 3.50583e+02 253.693 -4.24681e+00 -1.45163e+01 0.00000e+00 0.00000e+00 2.32375e+02 253.693 1.18209e+02 73.693  0.9664 
1 1 1 -7  46  2  o 12 2.45898e+01 5.66031e-01 3.80510e+02 138.738 -1.83895e+01 1.61338e+01  0.00000e+00 0.00000e+00 5.24509e+02 138.738 1.43999e+02 138.738 0.9793 
1 1 1 -7  46  3  o 16 2.79922e+01 5.57162e-01 5.73207e+02 35.589  3.57838e+01  2.56087e+01  0.00000e+00 0.00000e+00 4.66294e+02 35.589  1.06913e+02 215.589 0.9886 
1 1 1 -7  46  4  f 0  5.17881e+01 8.54530e-01 9.55082e+02 175.217 -1.38711e+02 1.16070e+01  0.00000e+00 0.00000e+00 9.82354e+02 175.217 2.72717e+01 175.217 0.9964 
1 1 1 -7  46  5  o 2  4.49574e+01 8.02266e-01 6.35939e+02 20.020  8.44548e+01  3.07723e+01  0.00000e+00 0.00000e+00 1.04168e+03 20.020  4.05741e+02 20.020  0.9944 
1 1 1 -7  46  6  o 11 2.53358e+01 5.36770e-01 4.29680e+02 93.295  -2.16132e+00 3.75426e+01  0.00000e+00 0.00000e+00 5.07740e+02 93.295  7.80592e+01 93.295  0.9866 
1 1 1 -7  46  7  o 19 1.53815e+01 5.23526e-01 2.93846e+02 313.637 1.43964e+01  -1.50981e+01 0.00000e+00 0.00000e+00 2.68607e+02 313.637 2.52390e+01 133.637 0.9757 
1 1 1 -7  46  8  o 12 2.66884e+01 5.32777e-01 5.41307e+02 99.160  -1.37882e+01 8.55048e+01  0.00000e+00 0.00000e+00 4.52351e+02 99.160  8.89560e+01 279.160 0.9942 
1 1 1 -7  46  9  o 4  3.09428e+01 5.81069e-01 5.51864e+02 318.439 9.02676e+01  -8.00344e+01 0.00000e+00 0.00000e+00 6.01164e+02 318.439 4.92992e+01 318.439 0.9958 
1 1 1 -7  46  10 o 17 7.49955e+00 5.59166e-01 1.31388e+02 168.426 -8.33943e+00 1.70794e+00  0.00000e+00 0.00000e+00 1.31970e+02 168.426 5.81292e-01 168.426 0.9393 
1 1 1 -7  46  11 o 2  2.01136e+01 5.00192e-01 3.25780e+02 343.472 6.21020e+01  -1.84283e+01 0.00000e+00 0.00000e+00 4.19681e+02 343.472 9.39006e+01 343.472 0.9923 
1 1 1 -7  46  12 f 0  1.64220e+01 4.84965e-01 2.58086e+02 142.130 -4.36532e+01 3.39464e+01  0.00000e+00 0.00000e+00 3.49137e+02 142.130 9.10513e+01 142.130 0.9909 
1 1 1 -7  46  13 o 12 7.72776e+00 7.16345e-01 1.11977e+02 8.738   1.13692e+01  1.74754e+00  0.00000e+00 0.00000e+00 1.63263e+02 8.738   5.12863e+01 8.738   0.9555 
1 1 1 -7  46  14 o 7  8.38773e+00 1.85865e+00 1.19401e+02 158.966 -7.84045e+00 3.01502e+00  0.00000e+00 0.00000e+00 1.73689e+02 158.966 5.42884e+01 158.966 0.9384 
1 1 1 -7  46  15 o 19 5.86246e+00 1.81319e+00 7.13894e+01 163.021 -3.61651e+00 1.10419e+00  0.00000e+00 0.00000e+00 1.14932e+02 163.021 4.35423e+01 163.021 0.8546 
1 1 1 -7  46  16 o 19 7.13983e+00 1.59994e+00 9.31322e+01 71.820  2.31437e+00  7.04729e+00  0.00000e+00 0.00000e+00 1.53496e+02 71.820  6.03633e+01 71.820  0.9299 
1 1 1 -7  46  17 o 18 4.02087e+00 1.36990e+00 4.88940e+01 261.531 -4.22389e-01 -2.83664e+00 0.00000e+00 0.00000e+00 7.03975e+01 261.531 2.15035e+01 261.531 0.7997 
1 1 1 -7  47  1  o 13 1.37800e+01 4.89710e-01 1.41633e+02 263.597 -5.70963e-01 -5.08757e+00 0.00000e+00 0.00000e+00 3.22530e+02 263.597 1.80897e+02 263.597 0.8961 
1 1 1 -7  47  2  o 18 2.83451e+01 6.64208e-01 6.20028e+02 106.199 -1.33785e+01 4.60528e+01  0.00000e+00 0.00000e+00 4.33908e+02 106.199 1.86120e+02 286.199 0.9895 
1 1 1 -7  47  3  o 1  2.98840e+01 5.79222e-01 5.57729e+02 259.941 -8.14296e+00 -4.59023e+01 0.00000e+00 0.00000e+00 5.52606e+02 259.941 5.12266e+00 79.941  0.9892 
1 1 1 -7  47  4  o 1  2.06523e+01 4.98118e-01 4.98603e+02 144.569 -2.71816e+01 1.93390e+01  0.00000e+00 0.00000e+00 2.64996e+02 144.569 2.33607e+02 324.569 0.9849 
1 1 1 -7  47  5  o 6  2.00406e+01 4.89890e-01 4.06928e+02 202.078 -2.50631e+01 -1.01656e+01 0.00000e+00 0.00000e+00 3.30969e+02 202.078 7.59589e+01 22.078  0.9813 
1 1 1 -7  47  6  o 1  1.84728e+01 4.85821e-01 4.82870e+02 325.750 2.89797e+01  -1.97315e+01 0.00000e+00 0.00000e+00 1.99855e+02 325.750 2.83015e+02 145.750 0.9856 
1 1 1 -7  47  7  o 17 1.77237e+01 5.42524e-01 2.03088e+02 324.744 1.42748e+01  -1.00907e+01 0.00000e+00 0.00000e+00 4.41763e+02 324.744 2.38675e+02 324.744 0.9710 
1 1 1 -7  47  8  o 18 1.85111e+01 4.68966e-01 2.91203e+02 280.837 5.85989e+00  -3.06098e+01 0.00000e+00 0.00000e+00 3.90712e+02 280.837 9.95091e+01 280.837 0.9838 
1 1 1 -7  47  9  o 13 1.68562e+01 4.71191e-01 2.91968e+02 125.854 -2.18110e+01 3.01811e+01  0.00000e+00 0.00000e+00 3.30163e+02 125.854 3.81955e+01 125.854 0.9865 
1 1 1 -7  47  10 o 15 1.24303e+01 4.56509e-01 2.36916e+02 259.572 -4.73909e+00 -2.57512e+01 0.00000e+00 0.00000e+00 2.18788e+02 259.572 1.81284e+01 79.572  0.9807 
1 1 1 -7  47  11 o 9  2.49183e+01 5.31260e-01 3.92219e+02 100.809 -1.99860e+01 1.04679e+02  0.00000e+00 0.00000e+00 5.34033e+02 100.809 1.41815e+02 100.809 0.9953 
1 1 1 -7  47  12 o 6  6.22325e+00 7.00471e-01 1.27432e+02 358.295 1.01636e+01  -3.02451e-01 0.00000e+00 0.00000e+00 9.30283e+01 358.295 3.44039e+01 178.296 0.9495 
1 1 1 -7  47  13 o 15 1.00211e+01 6.38012e-01 1.42229e+02 345.373 1.95013e+01  -5.08962e+00 0.00000e+00 0.00000e+00 2.21885e+02 345.373 7.96565e+01 345.373 0.9749 
1 1 1 -7  47  14 o 11 6.89815e+00 1.86759e+00 1.53478e+02 154.986 -8.19602e+00 3.82439e+00  0.00000e+00 0.00000e+00 8.86976e+01 154.986 6.47802e+01 334.986 0.9430 
1 1 1 -7  47  15 o 6  1.00687e+01 1.74555e+00 1.45365e+02 271.524 3.84319e-01  -1.44460e+01 0.00000e+00 0.00000e+00 2.15861e+02 271.524 7.04964e+01 271.524 0.9648 
1 1 1 -7  47  16 o 12 6.57255e+00 1.60557e+00 9.64150e+01 177.040 -7.09702e+00 3.67008e-01  0.00000e+00 0.00000e+00 1.29803e+02 177.040 3.33881e+01 177.040 0.9267 
1 1 1 -7  47  17 o 12 5.49006e+00 1.70150e+00 1.32248e+02 297.007 3.72592e+00  -7.31015e+00 0.00000e+00 0.00000e+00 5.85485e+01 297.007 7.36998e+01 117.007 0.9369 
1 1 1 -7  48  1  o 1  1.51188e+01 6.28965e-01 3.20845e+02 65.635  5.46803e+00  1.20737e+01  0.00000e+00 0.00000e+00 2.25526e+02 65.635  9.53181e+01 245.635 0.9615 
1 1 1 -7  48  2  o 3  1.86103e+01 5.69482e-01 2.48271e+02 264.288 -1.28947e+00 -1.28906e+01 0.00000e+00 0.00000e+00 4.23387e+02 264.288 1.75116e+02 264.288 0.9606 
1 1 1 -7  48  3  o 8  9.95764e+00 6.23727e-01 1.17781e+02 64.849  1.42913e+00  3.04375e+00  0.00000e+00 0.00000e+00 1.93947e+02 64.849  7.61660e+01 64.849  0.8336 
1 1 1 -7  48  4  o 10 1.56775e+01 5.61687e-01 2.58261e+02 102.160 -2.65237e+00 1.23095e+01  0.00000e+00 0.00000e+00 3.06340e+02 102.160 4.80790e+01 102.160 0.9594 
1 1 1 -7  48  5  o 19 1.96653e+01 5.75217e-01 2.79800e+02 142.303 -1.54846e+01 1.19668e+01  0.00000e+00 0.00000e+00 4.38848e+02 142.303 1.59048e+02 142.303 0.9741 
1 1 1 -7  48  6  o 5  1.94425e+01 4.91970e-01 4.38335e+02 349.982 3.61547e+01  -6.38697e+00 0.00000e+00 0.00000e+00 2.80612e+02 349.982 1.57723e+02 169.982 0.9863 
1 1 1 -7  48  7  o 10 2.14638e+01 5.07398e-01 4.88300e+02 304.453 2.81640e+01  -4.10509e+01 0.00000e+00 0.00000e+00 3.07761e+02 304.453 1.80539e+02 124.453 0.9899 
1 1 1 -7  48  8  o 12 2.07315e+01 4.81831e-01 3.73295e+02 52.067  2.76478e+01  3.54724e+01  0.00000e+00 0.00000e+00 3.94196e+02 52.067  2.09006e+01 52.067  0.9888 
1 1 1 -7  48  9  o 7  1.83501e+01 4.63223e-01 2.93648e+02 221.078 -3.09041e+01 -2.69386e+01 0.00000e+00 0.00000e+00 3.84387e+02 221.078 9.07399e+01 221.078 0.9877 
1 1 1 -7  48  10 o 15 1.42290e+01 4.59718e-01 2.64020e+02 110.722 -1.24291e+01 3.28537e+01  0.00000e+00 0.00000e+00 2.60190e+02 110.722 3.83028e+00 290.722 0.9857 
1 1 1 -7  48  11 o 18 9.09797e+00 5.79630e-01 1.66686e+02 98.822  -2.58239e+00 1.66396e+01  0.00000e+00 0.00000e+00 1.62805e+02 98.822  3.88028e+00 278.822 0.9698 
1 1 1 -7  48  12 o 1  5.31837e+00 7.64447e-01 1.06073e+02 297.256 3.22984e+00  -6.26948e+00 0.00000e+00 0.00000e+00 7.76719e+01 297.256 2.84016e+01 117.256 0.9261 
1 1 1 -7  48  13 o 2  7.13135e+00 8.17926e-01 1.70454e+02 96.509  -1.92412e+00 1.68629e+01  0.00000e+00 0.00000e+00 8.73539e+01 96.509  8.31005e+01 276.509 0.9701 
1 1 1 -7  48  14 o 10 1.65159e+01 1.82377e+00 2.41714e+02 295.647 1.45588e+01  -3.03227e+01 0.00000e+00 0.00000e+00 3.63884e+02 295.647 1.22170e+02 295.647 0.9850 
1 1 1 -7  48  15 o 7  7.49930e+00 1.71668e+00 1.40492e+02 120.342 -5.49246e+00 9.38329e+00  0.00000e+00 0.00000e+00 1.25196e+02 120.342 1.52960e+01 300.342 0.9528 
1 1 1 -7  48  16 o 15 7.55929e+00 1.82929e+00 5.65114e+01 188.131 -4.11920e+00 -5.88501e-01 0.00000e+00 0.00000e+00 1.87560e+02 188.131 1.31049e+02 188.131 0.8694 
1 1 1 -7  49  1  o 9  3.22802e+01 6.12908e-01 6.28971e+02 121.080 -2.92707e+01 4.85609e+01  0.00000e+00 0.00000e+00 5.73385e+02 121.080 5.55861e+01 301.080 0.9911 
1 1 1 -7  49  2  o 15 1.39385e+01 6.53118e-01 2.82963e+02 26.800  1.05647e+01  5.33671e+00  0.00000e+00 0.00000e+00 2.18021e+02 26.800  6.49419e+01 206.800 0.9568 
1 1 1 -7  49  3  o 4  1.08334e+01 8.69174e-01 1.52437e+02 131.574 -3.44453e+00 3.88320e+00  0.00000e+00 0.00000e+00 2.12713e+02 131.574 6.02755e+01 131.574 0.8976 
1 1 1 -7  49  4  f 0  4.25881e+01 7.34751e-01 7.45371e+02 103.991 -2.42392e+01 9.72792e+01  0.00000e+00 0.00000e+00 8.45026e+02 103.991 9.96542e+01 103.991 0.9950 
1 1 1 -7  49  5  o 16 2.79607e+01 5.65281e-01 5.28580e+02 242.039 -2.39286e+01 -4.50770e+01 0.00000e+00 0.00000e+00 5.09911e+02 242.039 1.86694e+01 62.039  0.9902 
1 1 1 -7  49  6  o 15 1.18014e+01 5.83258e-01 2.97353e+02 262.593 -1.98790e+00 -1.52920e+01 0.00000e+00 0.00000e+00 1.30455e+02 262.593 1.66898e+02 82.593  0.9670 
1 1 1 -7  49  7  o 9  8.47913e+00 5.08736e-01 2.21315e+02 346.345 9.28444e+00  -2.25559e+00 0.00000e+00 0.00000e+00 7.92158e+01 346.345 1.42099e+02 166.345 0.9461 
1 1 1 -7  49  8  o 19 2.36140e+01 5.06862e-01 3.57055e+02 140.753 -4.02788e+01 3.29060e+01  0.00000e+00 0.00000e+00 5.18374e+02 140.753 1.61318e+02 140.753 0.9903 
1 1 1 -7  49  9  o 4  7.87627e+00 5.47124e-01 2.15910e+02 333.420 1.11844e+01  -5.59585e+00 0.00000e+00 0.00000e+00 6.66594e+01 333.420 1.49250e+02 153.420 0.9591 
1 1 1 -7  49  10 o 8  2.52025e+01 5.26837e-01 4.30399e+02 108.529 -3.17831e+01 9.48298e+01  0.00000e+00 0.00000e+00 5.06744e+02 108.529 7.63450e+01 108.529 0.9950 
1 1 1 -7  49  11 o 12 9.68616e+00 5.63946e-01 2.30165e+02 353.608 2.37742e+01  -2.66348e+00 0.00000e+00 0.00000e+00 1.23849e+02 353.608 1.06316e+02 173.608 0.9789 
1 1 1 -7  49  12 f 0  5.05452e+00 8.61342e-01 1.16843e+02 77.271  1.48424e+00  6.57053e+00  0.00000e+00 0.00000e+00 5.70741e+01 77.271  5.97692e+01 257.271 0.9225 
1 1 1 -7  49  13 o 6  9.65635e+00 6.99702e-01 1.63427e+02 49.897  1.45183e+01  1.72393e+01  0.00000e+00 0.00000e+00 1.88308e+02 49.897  2.48805e+01 49.897  0.9776 
1 1 1 -7  49  14 o 3  1.51679e+01 1.11514e+00 2.32662e+02 284.968 1.25956e+01  -4.71130e+01 0.00000e+00 0.00000e+00 3.26074e+02 284.968 9.34111e+01 284.968 0.9897 
1 1 1 -7  49  15 o 16 5.15316e+00 1.50984e+00 1.65921e+02 106.391 -2.74243e+00 9.32311e+00  0.00000e+00 0.00000e+00 1.55149e+01 106.391 1.50406e+02 286.391 0.9471 
1 1 1 -7  49  16 o 7  4.31087e+00 1.38281e+00 9.52786e+01 267.174 -2.78551e-01 -5.64195e+00 0.00000e+00 0.00000e+00 4.98281e+01 267.174 4.54505e+01 87.173  0.9065 
1 1 1 -7  50  1  o 11 3.22830e+01 6.15016e-01 7.27029e+02 208.404 -5.92436e+01 -3.20381e+01 0.00000e+00 0.00000e+00 4.76973e+02 208.404 2.50055e+02 28.404  0.9925 
1 1 1 -7  50  2  o 3  5.23972e+01 1.05913e+00 7.04567e+02 189.880 -9.99472e+01 -1.74077e+01 0.00000e+00 0.00000e+00 1.25381e+03 189.880 5.49240e+02 189.880 0.9951 
1 1 1 -7  50  3  o 7  2.22065e+01 5.16786e-01 3.37599e+02 111.693 -8.64237e+00 2.17251e+01  0.00000e+00 0.00000e+00 4.78112e+02 111.693 1.40513e+02 111.693 0.9784 
1 1 1 -7  50  4  o 9  1.44538e+01 5.81337e-01 2.43541e+02 249.400 -4.07558e+00 -1.08432e+01 0.00000e+00 0.00000e+00 2.74887e+02 249.400 3.13457e+01 249.400 0.9558 
1 1 1 -7  50  5  o 11 2.33296e+01 5.26423e-01 4.46514e+02 30.847  3.50976e+01  2.09615e+01  0.00000e+00 0.00000e+00 4.17700e+02 30.847  2.88138e+01 210.847 0.9877 
1 1 1 -7  50  6  o 4  1.97027e+01 4.96945e-01 3.10947e+02 95.979  -2.95272e+00 2.81906e+01  0.00000e+00 0.00000e+00 4.14407e+02 95.979  1.03460e+02 95.979  0.9822 
1 1 1 -7  50  7  o 17 2.66379e+01 5.32878e-01 5.10915e+02 298.801 3.57118e+01  -6.49567e+01 0.00000e+00 0.00000e+00 4.80099e+02 298.801 3.08155e+01 118.801 0.9932 
1 1 1 -7  50  8  o 12 1.29029e+01 4.66544e-01 1.54045e+02 206.348 -1.23995e+01 -6.14113e+00 0.00000e+00 0.00000e+00 3.11106e+02 206.348 1.57061e+02 206.348 0.9632 
1 1 1 -7  50  9  o 13 1.51315e+01 4.65927e-01 1.62347e+02 148.821 -1.79515e+01 1.08630e+01  0.00000e+00 0.00000e+00 3.89903e+02 148.821 2.27555e+02 148.821 0.9759 
1 1 1 -7  50  10 o 7  2.77323e+01 6.29568e-01 4.61761e+02 11.675  1.13118e+02  2.33749e+01  0.00000e+00 0.00000e+00 5.70008e+02 11.675  1.08247e+02 11.675  0.9957 
1 1 1 -7  50  11 o 6  6.74349e+00 6.60768e-01 1.37199e+02 49.817  6.60208e+00  7.81714e+00  0.00000e+00 0.00000e+00 1.01913e+02 49.817  3.52864e+01 229.817 0.9498 
1 1 1 -7  50  12 o 15 9.28051e+00 6.35409e-01 1.50690e+02 164.710 -1.82005e+01 4.97560e+00  0.00000e+00 0.00000e+00 1.86131e+02 164.710 3.54412e+01 164.710 0.9731 
1 1 1 -7  50  13 o 17 7.43198e+00 7.85147e-01 7.48675e+01 23.934  6.90319e+00  3.06397e+00  0.00000e+00 0.00000e+00 1.82980e+02 23.934  1.08112e+02 23.934  0.9312 
1 1 1 -7  50  14 o 5  6.15477e+00 1.53284e+00 1.31363e+02 205.085 -7.47322e+00 -3.49827e+00 0.00000e+00 0.00000e+00 8.33241e+01 205.085 4.80388e+01 25.085  0.9373 
1 1 1 -7  50  15 o 3  9.20434e+00 1.67431e+00 1.41860e+02 322.684 1.07613e+01  -8.20251e+00 0.00000e+00 0.00000e+00 1.87386e+02 322.684 4.55260e+01 322.684 0.9623 
1 1 1 -7  50  16 o 14 1.27687e+01 1.89635e+00 2.46892e+02 129.273 -1.91119e+01 2.33730e+01  0.00000e+00 0.00000e+00 2.19243e+02 129.273 2.76487e+01 309.272 0.9833 
1 1 1 -7  51  1  o 7  2.17101e+01 5.19570e-01 3.46805e+02 240.795 -1.18892e+01 -2.12686e+01 0.00000e+00 0.00000e+00 4.51927e+02 240.795 1.05122e+02 240.795 0.9793 
1 1 1 -7  51  2  o 6  3.11382e+01 6.55237e-01 5.54418e+02 339.267 4.99622e+01  -1.89115e+01 0.00000e+00 0.00000e+00 6.04011e+02 339.267 4.95921e+01 339.267 0.9906 
1 1 1 -7  51  3  o 18 3.34588e+01 6.27399e-01 6.95766e+02 19.662  6.98187e+01  2.49459e+01  0.00000e+00 0.00000e+00 5.51764e+02 19.662  1.44002e+02 199.662 0.9932 
1 1 1 -7  51  4  o 13 1.94550e+01 4.96447e-01 2.89173e+02 197.649 -1.91322e+01 -6.08694e+00 0.00000e+00 0.00000e+00 4.22380e+02 197.649 1.33207e+02 197.649 0.9748 
1 1 1 -7  51  5  o 13 1.39705e+01 5.24478e-01 1.92277e+02 275.299 1.06832e+00  -1.15180e+01 0.00000e+00 0.00000e+00 3.08434e+02 275.299 1.16157e+02 275.299 0.9557 
1 1 1 -7  51  6  o 9  2.49348e+01 5.36241e-01 2.96411e+02 98.255  -5.15534e+00 3.55356e+01  0.00000e+00 0.00000e+00 6.24963e+02 98.255  3.28553e+02 98.255  0.9860 
1 1 1 -7  51  7  o 5  1.22339e+01 4.69177e-01 2.39763e+02 314.928 1.20131e+01  -1.20435e+01 0.00000e+00 0.00000e+00 2.04736e+02 314.928 3.50273e+01 134.928 0.9701 
1 1 1 -7  51  8  o 9  1.36793e+01 5.29560e-01 1.95350e+02 262.677 -2.42716e+00 -1.88867e+01 0.00000e+00 0.00000e+00 3.02952e+02 262.677 1.07602e+02 262.677 0.9734 
1 1 1 -7  51  9  f 0  1.59099e+01 5.39337e-01 2.47027e+02 188.122 -3.09309e+01 -4.41408e+00 0.00000e+00 0.00000e+00 3.38305e+02 188.122 9.12780e+01 188.122 0.9839 
1 1 1 -7  51  10 o 5  6.68800e+00 7.30039e-01 1.19827e+02 28.003  6.65968e+00  3.54143e+00  0.00000e+00 0.00000e+00 1.12839e+02 28.003  6.98786e+00 208.003 0.9311 
1 1 1 -7  51  11 o 16 7.30866e+00 6.36838e-01 9.92711e+01 328.674 6.45668e+00  -3.92977e+00 0.00000e+00 0.00000e+00 1.54793e+02 328.674 5.55223e+01 328.674 0.9313 
1 1 1 -7  51  12 o 6  8.48951e+00 7.29149e-01 7.68607e+01 9.903   8.04331e+00  1.40420e+00  0.00000e+00 0.00000e+00 2.19644e+02 9.903   1.42783e+02 9.903   0.9366 
1 1 1 -7  51  13 o 9  8.78957e+00 7.12043e-01 1.38734e+02 118.278 -9.19755e+00 1.70974e+01  0.00000e+00 0.00000e+00 1.80142e+02 118.278 4.14083e+01 118.278 0.9739 
1 1 1 -7  51  14 o 1  7.04441e+00 1.54856e+00 1.37221e+02 247.526 -3.98719e+00 -9.63808e+00 0.00000e+00 0.00000e+00 1.12001e+02 247.526 2.52202e+01 67.526  0.9508 
1 1 1 -7  51  15 o 9  5.15845e+00 1.47751e+00 8.85016e+01 253.548 -1.54056e+00 -5.21698e+00 0.00000e+00 0.00000e+00 8.45607e+01 253.548 3.94097e+00 73.548  0.9027 
1 1 1 -7  51  16 f 0  7.01657e+00 1.67780e+00 7.51099e+01 0.972   5.93224e+00  1.00641e-01  0.00000e+00 0.00000e+00 1.62251e+02 0.972   8.71411e+01 0.972   0.9113 
1 1 1 -7  52  1  o 10 2.60764e+01 8.55396e-01 4.70846e+02 67.849  1.40541e+01  3.45235e+01  0.00000e+00 0.00000e+00 4.95474e+02 67.849  2.46285e+01 67.849  0.9865 
1 1 1 -7  52  2  o 16 3.21316e+01 6.49308e-01 5.48966e+02 170.492 -5.54109e+01 9.28028e+00  0.00000e+00 0.00000e+00 6.46812e+02 170.492 9.78467e+01 170.492 0.9911 
1 1 1 -7  52  3  f 0  2.70908e+01 5.61304e-01 5.22889e+02 314.663 3.27995e+01  -3.31880e+01 0.00000e+00 0.00000e+00 4.82991e+02 314.663 3.98979e+01 134.663 0.9892 
1 1 1 -7  52  4  o 17 2.50130e+01 5.39015e-01 4.85861e+02 65.619  1.97209e+01  4.35125e+01  0.00000e+00 0.00000e+00 4.42645e+02 65.619  4.32164e+01 245.619 0.9895 
1 1 1 -7  52  5  o 3  1.59444e+01 5.16775e-01 3.42609e+02 206.715 -2.15918e+01 -1.08664e+01 0.00000e+00 0.00000e+00 2.42724e+02 206.715 9.98847e+01 26.715  0.9791 
1 1 1 -7  52  6  f 0  9.77786e+00 8.80644e-01 4.98456e+01 198.032 -2.10250e+00 -6.84454e-01 0.00000e+00 0.00000e+00 2.17462e+02 198.032 1.67617e+02 198.032 0.7296 
1 1 1 -7  52  7  o 10 7.69279e+00 5.39100e-01 1.77485e+02 163.878 -7.58864e+00 2.19353e+00  0.00000e+00 0.00000e+00 9.16768e+01 163.878 8.58080e+01 343.878 0.9344 
1 1 1 -7  52  8  o 14 1.71953e+01 5.45495e-01 2.31033e+02 86.591  1.76986e+00  2.97093e+01  0.00000e+00 0.00000e+00 4.01486e+02 86.591  1.70452e+02 86.591  0.9831 
1 1 1 -7  52  9  o 19 1.45024e+01 5.26716e-01 2.36548e+02 171.574 -2.94667e+01 4.36498e+00  0.00000e+00 0.00000e+00 2.96494e+02 171.574 5.99458e+01 171.574 0.9831 
1 1 1 -7  52  10 o 13 8.65977e+00 6.12860e-01 1.39230e+02 83.954  1.22916e+00  1.16051e+01  0.00000e+00 0.00000e+00 1.70079e+02 83.954  3.08490e+01 83.954  0.9561 
1 1 1 -7  52  11 o 13 1.48936e+01 5.66349e-01 2.29513e+02 340.065 3.69531e+01  -1.34027e+01 0.00000e+00 0.00000e+00 3.19226e+02 340.065 8.97125e+01 340.065 0.9872 
1 1 1 -7  52  12 o 11 3.79659e+00 8.10065e-01 1.01751e+02 35.653  4.09407e+00  2.93677e+00  0.00000e+00 0.00000e+00 2.48376e+01 35.653  7.69136e+01 215.653 0.8943 
1 1 1 -7  52  13 o 17 1.00303e+01 6.67807e-01 9.52921e+01 186.312 -1.51119e+01 -1.67161e+00 0.00000e+00 0.00000e+00 2.65794e+02 186.312 1.70501e+02 186.312 0.9665 
1 1 1 -7  52  14 o 15 8.06058e+00 1.01617e+00 9.25384e+01 165.195 -1.01217e+01 2.67517e+00  0.00000e+00 0.00000e+00 1.92651e+02 165.195 1.00112e+02 165.195 0.9510 
1 1 1 -7  52  15 o 12 4.65287e+00 1.38523e+00 5.50792e+01 79.224  5.99489e-01  3.14979e+00  0.00000e+00 0.00000e+00 8.74229e+01 79.224  3.23438e+01 79.224  0.8242 
1 1 1 -7  52  16 o 16 5.27237e+00 1.47639e+00 9.39069e+01 68.352  2.44870e+00  6.16960e+00  0.00000e+00 0.00000e+00 8.63706e+01 68.352  7.53638e+00 248.352 0.9213 
1 1 1 -7  53  1  o 12 6.90644e+00 8.02633e-01 1.12763e+02 231.368 -1.52500e+00 -1.90813e+00 0.00000e+00 0.00000e+00 8.40224e+01 231.368 2.87403e+01 51.368  0.7586 
1 1 1 -7  53  2  o 3  1.13122e+01 5.55882e-01 3.09855e+02 307.950 7.11335e+00  -9.12116e+00 0.00000e+00 0.00000e+00 9.60668e+01 307.950 2.13788e+02 127.950 0.9557 
1 1 1 -7  53  3  o 5  2.38960e+01 7.58822e-01 3.90976e+02 279.491 5.37519e+00  -3.21525e+01 0.00000e+00 0.00000e+00 4.91952e+02 279.491 1.00976e+02 279.491 0.9845 
1 1 1 -7  53  4  o 5  4.07783e+01 7.15091e-01 7.23056e+02 69.980  4.27692e+01  1.17382e+02  0.00000e+00 0.00000e+00 8.00417e+02 69.980  7.73607e+01 69.980  0.9960 
1 1 1 -7  53  5  o 3  2.91681e+01 6.42127e-01 4.41058e+02 135.070 -4.15711e+01 4.14697e+01  0.00000e+00 0.00000e+00 6.43084e+02 135.070 2.02026e+02 135.070 0.9914 
1 1 1 -7  53  6  o 9  1.13285e+01 6.42921e-01 1.85862e+02 322.649 9.03101e+00  -6.89256e+00 0.00000e+00 0.00000e+00 2.19441e+02 322.649 3.35788e+01 322.649 0.9549 
1 1 1 -7  53  7  o 15 1.64668e+01 5.38247e-01 3.27934e+02 35.530  2.70588e+01  1.93221e+01  0.00000e+00 0.00000e+00 2.79254e+02 35.530  4.86796e+01 215.530 0.9848 
1 1 1 -7  53  8  o 7  1.41895e+01 7.69232e-01 2.26380e+02 301.189 1.20143e+01  -1.98462e+01 0.00000e+00 0.00000e+00 2.92923e+02 301.189 6.65435e+01 301.189 0.9782 
1 1 1 -7  53  9  o 11 1.79985e+01 6.46735e-01 2.77918e+02 6.553   4.26511e+01  4.89945e+00  0.00000e+00 0.00000e+00 3.87039e+02 6.553   1.09122e+02 6.553   0.9883 
1 1 1 -7  53  10 o 6  1.03050e+01 6.33472e-01 1.41067e+02 28.876  1.35692e+01  7.48331e+00  0.00000e+00 0.00000e+00 2.31198e+02 28.876  9.01313e+01 28.876  0.9672 
1 1 1 -7  53  11 o 9  8.75136e+00 6.18045e-01 1.61059e+02 171.772 -1.75758e+01 2.54143e+00  0.00000e+00 0.00000e+00 1.56179e+02 171.772 4.88005e+00 351.772 0.9714 
1 1 1 -7  53  12 o 7  6.58716e+00 7.32563e-01 1.00432e+02 33.888  7.64642e+00  5.13591e+00  0.00000e+00 0.00000e+00 1.31395e+02 33.888  3.09628e+01 33.888  0.9440 
1 1 1 -7  53  13 o 11 5.38011e+00 9.11093e-01 8.92510e+01 220.429 -5.17667e+00 -4.41018e+00 0.00000e+00 0.00000e+00 9.57274e+01 220.429 6.47640e+00 220.429 0.9232 
1 1 1 -7  53  14 o 10 5.99294e+00 9.89546e-01 5.70279e+01 175.893 -5.20005e+00 3.73413e-01  0.00000e+00 0.00000e+00 1.43191e+02 175.893 8.61634e+01 175.893 0.8981 
1 1 1 -7  53  15 o 13 8.84312e+00 1.42543e+00 1.23170e+02 75.219  3.51666e+00  1.33275e+01  0.00000e+00 0.00000e+00 1.93252e+02 75.219  7.00816e+01 75.219  0.9630 
1 1 1 -7  53  16 o 4  5.34329e+00 1.44249e+00 9.30791e+01 3.660   6.58739e+00  4.21384e-01  0.00000e+00 0.00000e+00 8.95052e+01 3.660   3.57398e+00 183.660 0.9208 
1 1 1 -7  54  1  o 8  2.05229e+01 6.40601e-01 3.07789e+02 104.070 -5.02634e+00 2.00546e+01  0.00000e+00 0.00000e+00 4.44047e+02 104.070 1.36258e+02 104.070 0.9755 
1 1 1 -7  54  2  o 14 2.06876e+01 5.24108e-01 2.52662e+02 262.691 -2.37022e+00 -1.84805e+01 0.00000e+00 0.00000e+00 5.02809e+02 262.691 2.50147e+02 262.691 0.9728 
1 1 1 -7  54  3  o 11 2.06699e+01 5.84257e-01 3.14069e+02 350.858 2.50816e+01  -4.03630e+00 0.00000e+00 0.00000e+00 4.46116e+02 350.858 1.32048e+02 350.858 0.9801 
1 1 1 -7  54  4  o 14 8.03975e+00 7.51134e-01 2.01546e+02 110.291 -2.35554e+00 6.37078e+00  0.00000e+00 0.00000e+00 7.68070e+01 110.291 1.24739e+02 290.291 0.9231 
1 1 1 -7  54  5  o 15 3.04780e+01 6.00824e-01 5.73047e+02 151.109 -7.38202e+01 4.07360e+01  0.00000e+00 0.00000e+00 5.62591e+02 151.109 1.04561e+01 331.109 0.9941 
1 1 1 -7  54  6  o 1  6.97612e+00 5.77526e-01 1.48703e+02 35.802  5.02380e+00  3.62348e+00  0.00000e+00 0.00000e+00 9.04868e+01 35.802  5.82161e+01 215.801 0.9153 
1 1 1 -7  54  7  o 10 1.10530e+01 5.63020e-01 2.20038e+02 22.418  1.40498e+01  5.79602e+00  0.00000e+00 0.00000e+00 1.79881e+02 22.418  4.01561e+01 202.418 0.9665 
1 1 1 -7  54  8  o 17 1.52738e+01 5.97015e-01 2.61336e+02 343.621 2.95820e+01  -8.69479e+00 0.00000e+00 0.00000e+00 3.00677e+02 343.621 3.93407e+01 343.621 0.9836 
1 1 1 -7  54  9  o 8  7.39791e+00 7.27552e-01 1.01545e+02 136.610 -4.83310e+00 4.56891e+00  0.00000e+00 0.00000e+00 1.53241e+02 136.610 5.16966e+01 136.610 0.9214 
1 1 1 -7  54  10 o 19 1.52394e+01 5.48693e-01 2.53868e+02 83.417  4.72951e+00  4.09833e+01  0.00000e+00 0.00000e+00 3.08313e+02 83.417  5.44455e+01 83.417  0.9878 
1 1 1 -7  54  11 o 1  2.00428e+01 5.52870e-01 3.53509e+02 124.818 -5.42611e+01 7.80196e+01  0.00000e+00 0.00000e+00 3.90360e+02 124.818 3.68504e+01 124.818 0.9947 
1 1 1 -7  54  12 o 3  7.44936e+00 6.89099e-01 9.02826e+01 166.507 -8.76745e+00 2.10381e+00  0.00000e+00 0.00000e+00 1.71503e+02 166.507 8.12201e+01 166.507 0.9428 
1 1 1 -7  54  13 o 15 7.17112e+00 8.34663e-01 1.24288e+02 50.587  8.34164e+00  1.01507e+01  0.00000e+00 0.00000e+00 1.32358e+02 50.587  8.07055e+00 50.587  0.9612 
1 1 1 -7  54  14 o 11 4.91046e+00 1.02283e+00 3.85099e+01 160.866 -2.72511e+00 9.45456e-01  0.00000e+00 0.00000e+00 1.07797e+02 160.866 6.92870e+01 160.866 0.8011 
1 1 1 -7  54  15 o 6  9.74378e+00 1.48051e+00 2.08880e+02 27.701  2.06725e+01  1.08537e+01  0.00000e+00 0.00000e+00 1.45269e+02 27.701  6.36114e+01 207.701 0.9783 
1 1 1 -7  54  16 o 1  5.34848e+00 1.54566e+00 8.61835e+01 207.080 -5.27662e+00 -2.69789e+00 0.00000e+00 0.00000e+00 9.46487e+01 207.080 8.46519e+00 207.080 0.9112 
1 1 1 -7  55  1  o 15 1.52939e+01 5.23817e-01 2.30013e+02 260.763 -1.95866e+00 -1.20441e+01 0.00000e+00 0.00000e+00 3.20185e+02 260.763 9.01723e+01 260.763 0.9581 
1 1 1 -7  55  2  o 15 9.92460e+00 5.56463e-01 1.13648e+02 354.124 4.40603e+00  -4.53451e-01 0.00000e+00 0.00000e+00 2.13497e+02 354.124 9.98493e+01 354.124 0.8782 
1 1 1 -7  55  3  o 10 2.17969e+01 5.25346e-01 4.64017e+02 198.029 -4.14802e+01 -1.35011e+01 0.00000e+00 0.00000e+00 3.44327e+02 198.029 1.19690e+02 18.029  0.9885 
1 1 1 -7  55  4  o 13 1.23075e+01 5.93166e-01 1.46013e+02 104.443 -1.96385e+00 7.62498e+00  0.00000e+00 0.00000e+00 2.85118e+02 104.443 1.39105e+02 104.443 0.9342 
1 1 1 -7  55  5  o 9  2.21796e+01 5.70163e-01 3.46859e+02 185.095 -3.61484e+01 -3.22287e+00 0.00000e+00 0.00000e+00 4.72863e+02 185.095 1.26005e+02 185.095 0.9861 
1 1 1 -7  55  6  o 5  2.53464e+01 6.23496e-01 4.28098e+02 82.569  7.97483e+00  6.11440e+01  0.00000e+00 0.00000e+00 5.13526e+02 82.569  8.54284e+01 82.569  0.9919 
1 1 1 -7  55  7  o 8  1.91739e+01 5.68587e-01 3.43120e+02 276.577 5.34449e+00  -4.63511e+01 0.00000e+00 0.00000e+00 3.66822e+02 276.577 2.37019e+01 276.577 0.9892 
1 1 1 -7  55  8  o 13 6.94939e+00 7.30916e-01 9.15152e+01 349.573 5.08131e+00  -9.35047e-01 0.00000e+00 0.00000e+00 1.41662e+02 349.573 5.01473e+01 349.573 0.8971 
1 1 1 -7  55  9  o 19 1.42633e+01 6.67631e-01 1.45060e+02 27.375  1.64592e+01  8.52253e+00  0.00000e+00 0.00000e+00 3.73403e+02 27.375  2.28343e+02 27.375  0.9726 
1 1 1 -7  55  10 o 5  1.20117e+01 5.01860e-01 2.15931e+02 55.684  1.59075e+01  2.33060e+01  0.00000e+00 0.00000e+00 2.24562e+02 55.684  8.63053e+00 55.684  0.9821 
1 1 1 -7  55  11 o 9  6.00911e+00 7.09063e-01 7.21972e+01 220.884 -4.17829e+00 -3.61732e+00 0.00000e+00 0.00000e+00 1.30525e+02 220.884 5.83274e+01 220.884 0.9043 
1 1 1 -7  55  12 o 1  1.08185e+01 5.96173e-01 1.58889e+02 282.619 5.37582e+00  -2.40117e+01 0.00000e+00 0.00000e+00 2.36021e+02 282.619 7.71323e+01 282.619 0.9795 
1 1 1 -7  55  13 o 6  6.13307e+00 9.26412e-01 1.08636e+02 356.219 9.37662e+00  -6.19593e-01 0.00000e+00 0.00000e+00 1.07182e+02 356.219 1.45444e+00 176.219 0.9452 
1 1 1 -7  55  14 o 11 6.13160e+00 1.04085e+00 7.53770e+01 174.067 -6.59317e+00 6.85211e-01  0.00000e+00 0.00000e+00 1.34665e+02 174.067 5.92880e+01 174.067 0.9211 
1 1 1 -7  55  15 o 10 8.58262e+00 1.47647e+00 7.38410e+01 54.330  4.47802e+00  6.23864e+00  0.00000e+00 0.00000e+00 2.23414e+02 54.330  1.49573e+02 54.330  0.9324 
1 1 1 -7  55  16 o 18 4.07040e+00 1.28851e+00 8.10227e+01 25.652  4.59031e+00  2.20442e+00  0.00000e+00 0.00000e+00 5.42029e+01 25.652  2.68198e+01 205.652 0.8955 
1 1 1 -7  56  1  o 12 2.41308e+01 5.51008e-01 3.73305e+02 288.856 1.14151e+01  -3.34251e+01 0.00000e+00 0.00000e+00 5.19705e+02 288.856 1.46400e+02 288.856 0.9857 
1 1 1 -7  56  2  o 4  2.53840e+01 5.57596e-01 5.31556e+02 56.743  3.18610e+01  4.85838e+01  0.00000e+00 0.00000e+00 4.12833e+02 56.743  1.18722e+02 236.743 0.9914 
1 1 1 -7  56  3  o 5  8.96098e+00 5.74533e-01 1.79538e+02 170.400 -6.76542e+00 1.14423e+00  0.00000e+00 0.00000e+00 1.31044e+02 170.400 4.84942e+01 350.400 0.9240 
1 1 1 -7  56  4  f 0  4.01128e+00 8.75597e-01 9.25024e+01 339.337 1.61915e+00  -6.10628e-01 0.00000e+00 0.00000e+00 4.97928e+00 339.337 8.75232e+01 159.337 0.6482 
1 1 1 -7  56  5  o 4  1.09396e+01 5.57803e-01 1.42655e+02 140.932 -6.60413e+00 5.36089e+00  0.00000e+00 0.00000e+00 2.42371e+02 140.932 9.97154e+01 140.932 0.9392 
1 1 1 -7  56  6  f 0  8.94411e+00 5.88130e-01 1.47107e+02 305.442 4.38004e+00  -6.15381e+00 0.00000e+00 0.00000e+00 1.64812e+02 305.442 1.77048e+01 305.442 0.9312 
1 1 1 -7  56  7  o 13 1.29212e+01 5.38623e-01 1.74362e+02 304.305 9.52948e+00  -1.39669e+01 0.00000e+00 0.00000e+00 2.94677e+02 304.305 1.20315e+02 304.305 0.9700 
1 1 1 -7  56  8  o 1  1.91110e+01 5.58098e-01 3.19330e+02 83.947  5.09450e+00  4.80460e+01  0.00000e+00 0.00000e+00 3.87917e+02 83.947  6.85868e+01 83.947  0.9896 
1 1 1 -7  56  9  o 12 1.91618e+01 4.87207e-01 3.04085e+02 260.075 -9.84356e+00 -5.62585e+01 0.00000e+00 0.00000e+00 4.05626e+02 260.075 1.01541e+02 260.075 0.9912 
1 1 1 -7  56  10 o 4  4.30732e+00 7.99578e-01 4.96424e+01 268.611 -5.50041e-02 -2.26918e+00 0.00000e+00 0.00000e+00 6.89496e+01 268.611 1.93072e+01 268.611 0.7375 
1 1 1 -7  56  11 o 5  9.82171e+00 5.60885e-01 1.98816e+02 325.704 2.02209e+01  -1.37916e+01 0.00000e+00 0.00000e+00 1.59967e+02 325.704 3.88492e+01 145.704 0.9794 
1 1 1 -7  56  12 o 3  1.01835e+01 6.03179e-01 1.56164e+02 42.142  1.74342e+01  1.57762e+01  0.00000e+00 0.00000e+00 2.15142e+02 42.142  5.89782e+01 42.142  0.9785 
1 1 1 -7  56  13 o 11 7.59744e+00 7.83963e-01 9.77630e+01 60.448  5.36938e+00  9.47036e+00  0.00000e+00 0.00000e+00 1.71725e+02 60.448  7.39615e+01 60.448  0.9529 
1 1 1 -7  56  14 o 10 9.79352e+00 7.94626e-01 1.92214e+02 205.411 -3.01326e+01 -1.43154e+01 0.00000e+00 0.00000e+00 1.66436e+02 205.411 2.57784e+01 25.411  0.9849 
1 1 1 -7  56  15 o 16 8.74520e+00 1.57644e+00 1.76095e+02 299.279 8.61655e+00  -1.53674e+01 0.00000e+00 0.00000e+00 1.39340e+02 299.279 3.67555e+01 119.279 0.9712 
1 1 1 -7  56  16 o 15 8.00855e+00 1.69841e+00 1.41847e+02 104.666 -3.29655e+00 1.25958e+01  0.00000e+00 0.00000e+00 1.43574e+02 104.666 1.72757e+00 104.666 0.9608 
1 1 1 -7  57  1  o 15 1.49098e+01 5.49409e-01 3.18666e+02 13.020  1.98995e+01  4.60156e+00  0.00000e+00 0.00000e+00 2.27119e+02 13.020  9.15473e+01 193.020 0.9752 
1 1 1 -7  57  2  o 11 2.95444e+01 6.23356e-01 4.66475e+02 13.876  5.68546e+01  1.40453e+01  0.00000e+00 0.00000e+00 6.32601e+02 13.876  1.66126e+02 13.876  0.9914 
1 1 1 -7  57  3  o 2  1.04419e+01 6.41122e-01 2.30235e+02 194.865 -1.06149e+01 -2.81744e+00 0.00000e+00 0.00000e+00 1.43123e+02 194.865 8.71125e+01 14.865  0.9533 
1 1 1 -7  57  4  o 1  1.93768e+01 6.90124e-01 3.37194e+02 30.014  2.63881e+01  1.52439e+01  0.00000e+00 0.00000e+00 3.77178e+02 30.014  3.99838e+01 30.014  0.9835 
1 1 1 -7  57  5  o 1  1.08922e+01 5.77583e-01 1.43062e+02 274.107 6.66016e-01  -9.27560e+00 0.00000e+00 0.00000e+00 2.42423e+02 274.107 9.93611e+01 274.107 0.9446 
1 1 1 -7  57  6  o 1  7.46839e+00 6.30676e-01 1.70548e+02 275.016 6.90996e-01  -7.87329e+00 0.00000e+00 0.00000e+00 9.07547e+01 275.016 7.97930e+01 95.016  0.9344 
1 1 1 -7  57  7  o 1  1.01898e+01 5.99059e-01 1.59752e+02 329.277 1.04380e+01  -6.20334e+00 0.00000e+00 0.00000e+00 2.05479e+02 329.277 4.57269e+01 329.277 0.9579 
1 1 1 -7  57  8  o 1  1.14594e+01 5.90487e-01 1.68962e+02 14.103  1.60966e+01  4.04403e+00  0.00000e+00 0.00000e+00 2.46395e+02 14.103  7.74331e+01 14.103  0.9694 
1 1 1 -7  57  9  o 8  3.68775e+00 8.44816e-01 4.10320e+01 281.612 2.78090e-01  -1.35327e+00 0.00000e+00 0.00000e+00 3.68746e+01 281.612 4.15745e+00 101.612 0.5655 
1 1 1 -7  57  10 o 10 1.16233e+01 5.28490e-01 1.74627e+02 7.514   2.14825e+01  2.83363e+00  0.00000e+00 0.00000e+00 2.49117e+02 7.514   7.44894e+01 7.514   0.9766 
1 1 1 -7  57  11 f 0  9.31109e+00 5.75645e-01 2.30723e+02 111.012 -1.01261e+01 2.63630e+01  0.00000e+00 0.00000e+00 1.10320e+02 111.012 1.20403e+02 291.012 0.9821 
1 1 1 -7  57  12 o 3  1.50511e+01 5.90958e-01 2.47956e+02 251.847 -1.69317e+01 -5.16398e+01 0.00000e+00 0.00000e+00 3.07621e+02 251.847 5.96651e+01 251.847 0.9908 
1 1 1 -7  57  13 o 11 5.42291e+00 9.00281e-01 6.55793e+01 67.533  2.11244e+00  5.10828e+00  0.00000e+00 0.00000e+00 1.16944e+02 67.533  5.13648e+01 67.533  0.9043 
1 1 1 -7  57  14 o 7  5.95865e+00 1.01859e+00 1.26641e+02 304.480 6.58850e+00  -9.59362e+00 0.00000e+00 0.00000e+00 8.51415e+01 304.480 4.15000e+01 124.480 0.9560 
1 1 1 -7  57  15 o 8  4.88344e+00 1.40927e+00 8.13821e+01 353.166 5.09854e+00  -6.11023e-01 0.00000e+00 0.00000e+00 8.11749e+01 353.166 2.07193e-01 173.166 0.8964 
1 1 1 -7  57  16 o 8  1.03436e+01 1.61709e+00 8.32347e+01 200.691 -9.73474e+00 -3.67662e+00 0.00000e+00 0.00000e+00 2.81462e+02 200.691 1.98227e+02 200.691 0.9507 
1 1 1 -7  58  1  o 11 9.36346e+00 1.02537e+00 1.40650e+02 118.239 -2.58858e+00 4.81973e+00  0.00000e+00 0.00000e+00 1.76774e+02 118.239 3.61244e+01 118.239 0.9033 
1 1 1 -7  58  2  o 3  7.79045e+00 7.69751e-01 8.17358e+01 346.331 2.78582e+00  -6.77491e-01 0.00000e+00 0.00000e+00 1.51980e+02 346.331 7.02441e+01 346.331 0.7997 
1 1 1 -7  58  3  o 16 1.63877e+01 6.76198e-01 3.14924e+02 264.045 -2.56327e+00 -2.45740e+01 0.00000e+00 0.00000e+00 2.87052e+02 264.045 2.78726e+01 84.045  0.9795 
1 1 1 -7  58  4  o 3  3.24842e+01 7.55108e-01 6.44916e+02 300.495 5.25685e+01  -8.92600e+01 0.00000e+00 0.00000e+00 5.66757e+02 300.495 7.81594e+01 120.495 0.9952 
1 1 1 -7  58  5  o 17 1.27249e+01 5.61653e-01 2.11384e+02 141.716 -1.20812e+01 9.53563e+00  0.00000e+00 0.00000e+00 2.49548e+02 141.716 3.81640e+01 141.716 0.9669 
1 1 1 -7  58  6  o 16 6.63102e+00 6.81621e-01 1.17389e+02 170.836 -5.17560e+00 8.34957e-01  0.00000e+00 0.00000e+00 1.05719e+02 170.836 1.16701e+01 350.836 0.8987 
1 1 1 -7  58  7  o 13 8.01734e+00 6.33874e-01 1.26845e+02 266.638 -4.57715e-01 -7.79108e+00 0.00000e+00 0.00000e+00 1.53169e+02 266.638 2.63242e+01 266.638 0.9335 
1 1 1 -7  58  8  o 1  9.32498e+00 5.26985e-01 2.07709e+02 237.459 -9.64048e+00 -1.51086e+01 0.00000e+00 0.00000e+00 1.31032e+02 237.459 7.66773e+01 57.459  0.9717 
1 1 1 -7  58  9  o 10 9.70661e+00 5.32157e-01 1.28905e+02 203.109 -1.25714e+01 -5.36454e+00 0.00000e+00 0.00000e+00 2.20156e+02 203.109 9.12515e+01 203.109 0.9627 
1 1 1 -7  58  10 f 0  9.61901e+00 5.65009e-01 1.58003e+02 103.218 -4.20657e+00 1.79097e+01  0.00000e+00 0.00000e+00 1.91104e+02 103.218 3.31011e+01 103.218 0.9724 
1 1 1 -7  58  11 o 12 7.91834e+00 6.40628e-01 1.19920e+02 238.541 -6.83163e+00 -1.11662e+01 0.00000e+00 0.00000e+00 1.63827e+02 238.541 4.39067e+01 238.541 0.9610 
1 1 1 -7  58  12 o 16 5.63862e+00 7.84618e-01 6.06617e+01 326.839 4.41658e+00  -2.88583e+00 0.00000e+00 0.00000e+00 1.28256e+02 326.839 6.75939e+01 326.839 0.8994 
1 1 1 -7  58  13 o 16 1.66538e+01 6.11466e-01 2.65915e+02 338.830 6.73765e+01  -2.60933e+01 0.00000e+00 0.00000e+00 3.49509e+02 338.830 8.35932e+01 338.830 0.9931 
1 1 1 -7  58  14 o 3  5.31099e+00 1.10034e+00 8.51918e+01 253.014 -1.97672e+00 -6.47140e+00 0.00000e+00 0.00000e+00 9.69893e+01 253.014 1.17975e+01 253.014 0.9228 
1 1 1 -7  58  15 o 12 3.28646e+00 1.09788e+00 4.58333e+01 13.543  2.45697e+00  5.91795e-01  0.00000e+00 0.00000e+00 4.78682e+01 13.543  2.03494e+00 13.543  0.7679 
1 1 1 -7  58  16 o 17 4.79495e+00 1.45114e+00 8.65501e+01 239.569 -2.97516e+00 -5.06477e+00 0.00000e+00 0.00000e+00 7.53175e+01 239.569 1.12326e+01 59.569  0.9104 
1 1 1 -7  59  1  o 19 4.31741e+01 9.22792e-01 7.77616e+02 281.998 3.06730e+01  -1.44325e+02 0.00000e+00 0.00000e+00 8.36979e+02 281.998 5.93631e+01 281.998 0.9966 
1 1 1 -7  59  2  o 17 8.74065e+00 6.94611e-01 1.60379e+02 118.004 -3.14605e+00 5.91589e+00  0.00000e+00 0.00000e+00 1.41923e+02 118.004 1.84558e+01 298.004 0.9220 
1 1 1 -7  59  3  o 3  3.61525e+01 8.03086e-01 6.96090e+02 69.106  4.11681e+01  1.07841e+02  0.00000e+00 0.00000e+00 6.53539e+02 69.106  4.25515e+01 249.106 0.9957 
1 1 1 -7  59  4  o 5  7.18345e+00 7.27666e-01 1.63154e+02 40.148  5.23831e+00  4.41856e+00  0.00000e+00 0.00000e+00 8.55518e+01 40.148  7.76025e+01 220.148 0.9239 
1 1 1 -7  59  5  o 7  9.32439e+00 5.87560e-01 1.57052e+02 286.480 2.54587e+00  -8.60566e+00 0.00000e+00 0.00000e+00 1.72118e+02 286.480 1.50658e+01 286.480 0.9425 
1 1 1 -7  59  6  o 10 9.94611e+00 5.70715e-01 1.23417e+02 234.297 -5.06492e+00 -7.04781e+00 0.00000e+00 0.00000e+00 2.26728e+02 234.297 1.03310e+02 234.297 0.9405 
1 1 1 -7  59  7  f 0  7.80958e+00 5.65250e-01 1.23710e+02 340.170 7.62912e+00  -2.75115e+00 0.00000e+00 0.00000e+00 1.49766e+02 340.170 2.60561e+01 340.170 0.9361 
1 1 1 -7  59  8  o 15 1.47325e+01 5.05785e-01 1.97638e+02 210.470 -2.32305e+01 -1.36677e+01 0.00000e+00 0.00000e+00 3.42727e+02 210.470 1.45089e+02 210.470 0.9813 
1 1 1 -7  59  9  o 8  8.97061e+00 5.62475e-01 2.10524e+02 34.503  1.65509e+01  1.13763e+01  0.00000e+00 0.00000e+00 1.16066e+02 34.503  9.44587e+01 214.503 0.9748 
1 1 1 -7  59  10 o 12 6.54797e+00 6.69642e-01 1.17268e+02 353.834 9.46319e+00  -1.02236e+00 0.00000e+00 0.00000e+00 1.13864e+02 353.834 3.40373e+00 173.834 0.9459 
1 1 1 -7  59  11 o 2  3.92545e+00 7.65024e-01 5.90542e+01 64.874  1.35415e+00  2.88733e+00  0.00000e+00 0.00000e+00 6.13979e+01 64.874  2.34363e+00 64.874  0.8230 
1 1 1 -7  59  12 o 9  4.14711e+00 8.70481e-01 1.38865e+02 247.462 -3.21331e+00 -7.74312e+00 0.00000e+00 0.00000e+00 6.06688e+00 247.462 1.32798e+02 67.462  0.9383 
1 1 1 -7  59  13 o 16 6.79654e+00 8.42613e-01 8.70415e+01 77.823  1.91465e+00  8.87319e+00  0.00000e+00 0.00000e+00 1.51469e+02 77.823  6.44271e+01 77.823  0.9432 
1 1 1 -7  59  14 o 1  6.99128e+00 9.93467e-01 1.45647e+02 131.243 -1.08822e+01 1.24118e+01  0.00000e+00 0.00000e+00 1.06188e+02 131.243 3.94590e+01 311.243 0.9692 
1 1 1 -7  59  15 o 18 6.49283e+00 1.39391e+00 1.14588e+02 232.768 -6.10267e+00 -8.03078e+00 0.00000e+00 0.00000e+00 1.14158e+02 232.768 4.30346e-01 52.768  0.9491 
1 1 1 -7  59  16 o 3  4.08929e+00 1.30239e+00 8.09019e+01 251.999 -1.62038e+00 -4.98657e+00 0.00000e+00 0.00000e+00 5.53602e+01 251.999 2.55417e+01 71.999  0.8987 
1 1 1 -7  60  1  o 8  2.68001e+01 6.84379e-01 4.14790e+02 167.227 -5.07313e+01 1.15007e+01  0.00000e+00 0.00000e+00 5.80998e+02 167.227 1.66208e+02 167.227 0.9903 
1 1 1 -7  60  2  o 2  2.09649e+01 6.32094e-01 3.61781e+02 93.846  -2.38549e+00 3.54872e+01  0.00000e+00 0.00000e+00 4.13365e+02 93.846  5.15841e+01 93.846  0.9858 
1 1 1 -7  60  3  o 7  2.48534e+01 6.60598e-01 3.86523e+02 181.051 -5.16661e+01 -9.47626e-01 0.00000e+00 0.00000e+00 5.36128e+02 181.051 1.49605e+02 181.051 0.9903 
1 1 1 -7  60  4  o 11 2.52996e+01 6.18982e-01 4.34700e+02 298.870 3.02014e+01  -5.47764e+01 0.00000e+00 0.00000e+00 5.05657e+02 298.870 7.09574e+01 298.870 0.9920 
1 1 1 -7  60  5  o 6  6.24289e+00 8.62713e-01 4.67337e+01 153.897 -1.56084e+00 7.64753e-01  0.00000e+00 0.00000e+00 1.05166e+02 153.897 5.84322e+01 153.897 0.6497 
1 1 1 -7  60  6  f 0  1.51233e+01 4.76230e-01 2.15783e+02 149.876 -2.14760e+01 1.24611e+01  0.00000e+00 0.00000e+00 3.38697e+02 149.876 1.22913e+02 149.876 0.9797 
1 1 1 -7  60  7  o 12 2.00635e+01 5.22170e-01 2.87440e+02 122.765 -2.48344e+01 3.85871e+01  0.00000e+00 0.00000e+00 4.54716e+02 122.765 1.67276e+02 122.765 0.9890 
1 1 1 -7  60  8  f 0  9.45553e+00 5.36079e-01 2.53406e+02 249.604 -8.12466e+00 -2.18515e+01 0.00000e+00 0.00000e+00 9.23074e+01 249.604 1.61098e+02 69.604  0.9783 
1 1 1 -7  60  9  o 8  8.16256e+00 6.05917e-01 1.39016e+02 58.025  6.38760e+00  1.02321e+01  0.00000e+00 0.00000e+00 1.52874e+02 58.025  1.38580e+01 58.025  0.9576 
1 1 1 -7  60  10 o 15 9.52146e+00 5.59005e-01 1.33573e+02 355.333 1.69519e+01  -1.38389e+00 0.00000e+00 0.00000e+00 2.11069e+02 355.333 7.74960e+01 355.333 0.9701 
1 1 1 -7  60  11 o 19 7.92894e+00 5.95683e-01 1.27431e+02 156.707 -1.28320e+01 5.52447e+00  0.00000e+00 0.00000e+00 1.57345e+02 156.707 2.99147e+01 156.707 0.9635 
1 1 1 -7  60  12 o 16 3.59912e+00 9.03399e-01 8.94414e+01 260.347 -7.66823e-01 -4.50859e+00 0.00000e+00 0.00000e+00 2.88317e+01 260.347 6.06097e+01 80.347  0.8824 
1 1 1 -7  60  13 o 14 6.27880e+00 9.20309e-01 1.35569e+02 325.321 1.11265e+01  -7.69844e+00 0.00000e+00 0.00000e+00 8.91998e+01 325.321 4.63691e+01 145.321 0.9623 
1 1 1 -7  60  14 o 11 1.17219e+01 7.87458e-01 2.03307e+02 183.567 -4.26211e+01 -2.65657e+00 0.00000e+00 0.00000e+00 2.27139e+02 183.567 2.38320e+01 183.567 0.9882 
1 1 1 -7  60  15 o 11 7.84664e+00 1.13394e+00 1.08297e+02 239.811 -7.06290e+00 -1.21407e+01 0.00000e+00 0.00000e+00 1.72370e+02 239.811 6.40727e+01 239.811 0.9637 
1 1 1 -7  60  16 o 13 5.13857e+00 1.54790e+00 9.61333e+01 170.115 -6.75328e+00 1.17676e+00  0.00000e+00 0.00000e+00 7.98537e+01 170.115 1.62796e+01 350.115 0.9239 
1 1 1 -7  61  1  o 12 1.11470e+01 7.00388e-01 2.29362e+02 202.849 -1.17638e+01 -4.95699e+00 0.00000e+00 0.00000e+00 1.72061e+02 202.849 5.73005e+01 22.849  0.9600 
1 1 1 -7  61  2  o 17 2.28625e+01 6.58308e-01 2.89035e+02 1.672   3.55622e+01  1.03838e+00  0.00000e+00 0.00000e+00 5.56136e+02 1.672   2.67101e+02 1.672   0.9858 
1 1 1 -7  61  3  o 16 1.63542e+01 5.53727e-01 2.64792e+02 26.224  2.32351e+01  1.14450e+01  0.00000e+00 0.00000e+00 3.36244e+02 26.224  7.14526e+01 26.224  0.9805 
1 1 1 -7  61  4  o 19 1.89486e+01 6.45488e-01 3.76794e+02 30.960  3.72487e+01  2.23458e+01  0.00000e+00 0.00000e+00 3.24868e+02 30.960  5.19255e+01 210.960 0.9884 
1 1 1 -7  61  5  o 12 1.20997e+01 4.80553e-01 2.46340e+02 263.884 -2.28131e+00 -2.12894e+01 0.00000e+00 0.00000e+00 1.95992e+02 263.884 5.03478e+01 83.884  0.9764 
1 1 1 -7  61  6  o 4  1.81614e+01 5.66898e-01 3.33512e+02 91.107  -8.58622e-01 4.44508e+01  0.00000e+00 0.00000e+00 3.38389e+02 91.107  4.87649e+00 91.107  0.9887 
1 1 1 -7  61  7  o 18 1.41609e+01 4.98181e-01 2.35244e+02 303.599 1.62964e+01  -2.45289e+01 0.00000e+00 0.00000e+00 2.85219e+02 303.599 4.99752e+01 303.599 0.9829 
1 1 1 -7  61  8  o 9  1.12291e+01 5.20440e-01 1.62316e+02 209.518 -1.56365e+01 -8.85305e+00 0.00000e+00 0.00000e+00 2.45425e+02 209.518 8.31083e+01 209.518 0.9718 
1 1 1 -7  61  9  o 13 8.70978e+00 5.66673e-01 1.92831e+02 171.351 -1.88059e+01 2.86043e+00  0.00000e+00 0.00000e+00 1.23694e+02 171.351 6.91372e+01 351.351 0.9733 
1 1 1 -7  61  10 o 7  4.28820e+00 7.74176e-01 4.41152e+01 39.434  1.71933e+00  1.41400e+00  0.00000e+00 0.00000e+00 7.29204e+01 39.434  2.88052e+01 39.434  0.7316 
1 1 1 -7  61  11 o 2  1.04798e+01 5.47577e-01 1.69382e+02 281.021 4.93142e+00  -2.53194e+01 0.00000e+00 0.00000e+00 2.13552e+02 281.021 4.41704e+01 281.021 0.9804 
1 1 1 -7  61  12 o 4  1.03662e+01 6.16771e-01 1.27940e+02 184.713 -2.13640e+01 -1.76132e+00 0.00000e+00 0.00000e+00 2.48913e+02 184.713 1.20973e+02 184.713 0.9764 
1 1 1 -7  61  13 o 16 1.17191e+01 6.67200e-01 1.88787e+02 25.965  3.65936e+01  1.78202e+01  0.00000e+00 0.00000e+00 2.41707e+02 25.965  5.29195e+01 25.965  0.9876 
1 1 1 -7  61  14 o 11 9.77432e+00 8.86845e-01 1.29721e+02 105.477 -6.05125e+00 2.18538e+01  0.00000e+00 0.00000e+00 2.25324e+02 105.477 9.56034e+01 105.477 0.9777 
1 1 1 -7  61  15 o 18 3.94568e+00 1.18489e+00 8.05005e+01 209.572 -4.40351e+00 -2.49866e+00 0.00000e+00 0.00000e+00 5.05222e+01 209.572 2.99783e+01 29.572  0.8948 
1 1 1 -7  61  16 o 6  6.00454e+00 1.61628e+00 1.19633e+02 300.109 4.83482e+00  -8.33742e+00 0.00000e+00 0.00000e+00 9.10366e+01 300.109 2.85962e+01 120.109 0.9466 
1 1 1 -7  62  1  o 2  1.05412e+01 7.07168e-01 1.56286e+02 235.224 -5.01207e+00 -7.21795e+00 0.00000e+00 0.00000e+00 2.15846e+02 235.224 5.95601e+01 235.224 0.9413 
1 1 1 -7  62  2  o 15 1.55649e+01 7.16152e-01 2.82311e+02 92.331  -1.04507e+00 2.56784e+01  0.00000e+00 0.00000e+00 2.89782e+02 92.331  7.47097e+00 92.331  0.9803 
1 1 1 -7  62  3  o 3  1.02367e+01 6.45435e-01 2.07347e+02 190.927 -1.19064e+01 -2.29874e+00 0.00000e+00 0.00000e+00 1.60105e+02 190.927 4.72420e+01 10.927  0.9578 
1 1 1 -7  62  4  o 16 1.92994e+01 4.91834e-01 3.77198e+02 3.165   4.59051e+01  2.53869e+00  0.00000e+00 0.00000e+00 3.37795e+02 3.165   3.94034e+01 183.165 0.9891 
1 1 1 -7  62  5  o 19 1.57660e+01 5.03333e-01 2.21903e+02 213.214 -2.20794e+01 -1.44563e+01 0.00000e+00 0.00000e+00 3.57025e+02 213.214 1.35121e+02 213.214 0.9809 
1 1 1 -7  62  6  o 9  1.13871e+01 5.75014e-01 1.74731e+02 322.253 1.31978e+01  -1.02177e+01 0.00000e+00 0.00000e+00 2.38328e+02 322.253 6.35968e+01 322.253 0.9696 
1 1 1 -7  62  7  o 16 5.20253e+00 6.82616e-01 6.72378e+01 294.058 1.27613e+00  -2.85842e+00 0.00000e+00 0.00000e+00 9.21010e+01 294.058 2.48632e+01 294.058 0.8192 
1 1 1 -7  62  8  o 9  8.10163e+00 5.63310e-01 7.44966e+01 250.324 -2.20696e+00 -6.17188e+00 0.00000e+00 0.00000e+00 2.04026e+02 250.324 1.29529e+02 250.324 0.9202 
1 1 1 -7  62  9  o 14 1.33373e+01 4.90268e-01 1.97180e+02 134.716 -2.17014e+01 2.19173e+01  0.00000e+00 0.00000e+00 2.92563e+02 134.716 9.53831e+01 134.716 0.9837 
1 1 1 -7  62  10 o 8  5.49599e+00 7.13657e-01 5.41671e+01 46.337  2.70090e+00  2.82998e+00  0.00000e+00 0.00000e+00 1.22134e+02 46.337  6.79669e+01 46.337  0.8601 
1 1 1 -7  62  11 o 7  7.44403e+00 6.42438e-01 1.83609e+02 144.389 -1.62077e+01 1.16085e+01  0.00000e+00 0.00000e+00 8.67328e+01 144.389 9.68759e+01 324.389 0.9746 
1 1 1 -7  62  12 o 15 8.66855e+00 6.48217e-01 1.06592e+02 26.037  1.38323e+01  6.75763e+00  0.00000e+00 0.00000e+00 2.05447e+02 26.037  9.88554e+01 26.037  0.9670 
1 1 1 -7  62  13 o 18 5.42021e+00 1.00669e+00 9.79974e+01 279.894 1.33412e+00  -7.64865e+00 0.00000e+00 0.00000e+00 9.01008e+01 279.894 7.89653e+00 99.894  0.9332 
1 1 1 -7  62  14 f 0  5.16917e+00 1.09661e+00 1.07550e+02 81.148  1.30798e+00  8.39844e+00  0.00000e+00 0.00000e+00 7.27907e+01 81.148  3.47595e+01 261.148 0.9392 
1 1 1 -7  62  15 o 7  4.00371e+00 1.13390e+00 8.61863e+01 135.517 -4.03404e+00 3.96188e+00  0.00000e+00 0.00000e+00 4.84941e+01 135.517 3.76922e+01 315.517 0.9066 
1 1 1 -7  62  16 o 17 6.08614e+00 1.64653e+00 1.48455e+02 333.929 1.01463e+01  -4.96422e+00 0.00000e+00 0.00000e+00 6.68566e+01 333.929 8.15984e+01 153.929 0.9547 
1 1 1 -7  63  1  o 14 2.43395e+01 6.73798e-01 4.14572e+02 354.872 5.68171e+01  -5.09905e+00 0.00000e+00 0.00000e+00 4.90112e+02 354.872 7.55403e+01 354.872 0.9912 
1 1 1 -7  63  2  o 10 1.53591e+01 8.39270e-01 2.34916e+02 157.549 -1.84877e+01 7.63915e+00  0.00000e+00 0.00000e+00 3.26247e+02 157.549 9.13311e+01 157.549 0.9747 
1 1 1 -7  63  3  f 0  9.89901e+00 5.96345e-01 1.03513e+02 314.427 4.38337e+00  -4.47197e+00 0.00000e+00 0.00000e+00 2.36331e+02 314.427 1.32818e+02 314.427 0.9162 
1 1 1 -7  63  4  o 6  1.44190e+01 5.15684e-01 3.06266e+02 327.545 2.57124e+01  -1.63522e+01 0.00000e+00 0.00000e+00 2.24798e+02 327.545 8.14682e+01 147.545 0.9835 
1 1 1 -7  63  5  o 4  1.14516e+01 5.11258e-01 1.69202e+02 216.071 -1.18386e+01 -8.62369e+00 0.00000e+00 0.00000e+00 2.44526e+02 216.071 7.53239e+01 216.071 0.9652 
1 1 1 -7  63  6  o 11 1.74485e+01 5.01250e-01 3.62380e+02 2.868   5.04456e+01  2.52686e+00  0.00000e+00 0.00000e+00 2.83815e+02 2.868   7.85651e+01 182.868 0.9901 
1 1 1 -7  63  7  o 7  1.13572e+01 5.15079e-01 2.38991e+02 155.729 -2.28676e+01 1.03110e+01  0.00000e+00 0.00000e+00 1.77007e+02 155.729 6.19831e+01 335.729 0.9799 
1 1 1 -7  63  8  o 12 1.43660e+01 4.99959e-01 3.08060e+02 141.518 -3.73642e+01 2.97022e+01  0.00000e+00 0.00000e+00 2.22909e+02 141.518 8.51508e+01 321.517 0.9895 
1 1 1 -7  63  9  o 12 5.31289e+00 7.32266e-01 4.82954e+01 336.419 2.71096e+00  -1.18330e+00 0.00000e+00 0.00000e+00 1.11696e+02 336.419 6.34004e+01 336.419 0.8068 
1 1 1 -7  63  10 o 3  1.25715e+01 5.12987e-01 1.88518e+02 96.670  -3.94774e+00 3.37579e+01  0.00000e+00 0.00000e+00 2.73343e+02 96.670  8.48249e+01 96.670  0.9852 
1 1 1 -7  63  11 o 18 1.54501e+01 5.42814e-01 2.83341e+02 255.848 -1.58130e+01 -6.27121e+01 0.00000e+00 0.00000e+00 2.87817e+02 255.848 4.47621e+00 255.848 0.9922 
1 1 1 -7  63  12 o 16 6.05674e+00 8.26418e-01 1.00059e+02 350.999 9.66908e+00  -1.53166e+00 0.00000e+00 0.00000e+00 1.13531e+02 350.999 1.34726e+01 350.999 0.9475 
1 1 1 -7  63  13 o 11 3.93104e+00 9.76153e-01 4.77358e+01 244.324 -1.36011e+00 -2.82916e+00 0.00000e+00 0.00000e+00 7.20826e+01 244.324 2.43469e+01 244.324 0.8198 
1 1 1 -7  63  14 f 0  4.24573e+00 1.12586e+00 1.55830e+02 10.464  9.90838e+00  1.83002e+00  0.00000e+00 0.00000e+00 6.18441e+00 190.464 1.62014e+02 190.464 0.9490 
1 1 1 -7  63  15 o 15 5.73083e+00 1.22905e+00 1.02136e+02 116.852 -4.26572e+00 8.42571e+00  0.00000e+00 0.00000e+00 9.88682e+01 116.852 3.26805e+00 296.852 0.9455 
1 1 1 -7  63  16 o 17 3.79381e+00 1.25930e+00 4.26625e+01 64.105  1.26436e+00  2.60447e+00  0.00000e+00 0.00000e+00 7.00608e+01 64.105  2.73983e+01 64.105  0.8019 
1 1 1 -7  64  1  o 8  8.08874e+00 7.41646e-01 1.62901e+02 108.471 -2.34723e+00 7.02711e+00  0.00000e+00 0.00000e+00 1.19090e+02 108.471 4.38109e+01 288.471 0.9298 
1 1 1 -7  64  2  o 7  2.21129e+01 5.45895e-01 3.63900e+02 286.723 1.42478e+01  -4.74225e+01 0.00000e+00 0.00000e+00 4.56459e+02 286.723 9.25593e+01 286.723 0.9899 
1 1 1 -7  64  3  o 13 2.35957e+01 5.92501e-01 3.77716e+02 268.310 -1.79949e+00 -6.09957e+01 0.00000e+00 0.00000e+00 4.98971e+02 268.310 1.21255e+02 268.310 0.9918 
1 1 1 -7  64  4  o 5  7.31296e+00 5.95187e-01 1.12268e+02 345.308 5.90844e+00  -1.54919e+00 0.00000e+00 0.00000e+00 1.38013e+02 345.308 2.57449e+01 345.308 0.9140 
1 1 1 -7  64  5  o 4  1.19846e+01 5.04965e-01 2.01786e+02 328.243 1.61056e+01  -9.96931e+00 0.00000e+00 0.00000e+00 2.34712e+02 328.243 3.29261e+01 328.243 0.9732 
1 1 1 -7  64  6  o 9  7.83608e+00 6.87317e-01 1.19176e+02 92.529  -3.51397e-01 7.95595e+00  0.00000e+00 0.00000e+00 1.54824e+02 92.529  3.56483e+01 92.529  0.9349 
1 1 1 -7  64  7  o 14 1.56517e+01 5.13985e-01 2.43601e+02 67.148  1.44423e+01  3.42699e+01  0.00000e+00 0.00000e+00 3.33459e+02 67.148  8.98577e+01 67.148  0.9865 
1 1 1 -7  64  8  o 2  1.25538e+01 4.74948e-01 2.11942e+02 171.850 -2.88212e+01 4.12763e+00  0.00000e+00 0.00000e+00 2.48782e+02 171.850 3.68397e+01 171.850 0.9827 
1 1 1 -7  64  9  f 0  1.19537e+01 4.97731e-01 1.13156e+02 55.100  1.05420e+01  1.51115e+01  0.00000e+00 0.00000e+00 3.20645e+02 55.100  2.07489e+02 55.100  0.9725 
1 1 1 -7  64  10 o 15 1.10360e+01 5.37336e-01 2.58878e+02 48.944  2.68456e+01  3.08218e+01  0.00000e+00 0.00000e+00 1.47534e+02 48.944  1.11345e+02 228.944 0.9877 
1 1 1 -7  64  11 o 15 1.09430e+01 5.74710e-01 1.68174e+02 345.924 2.92100e+01  -7.32401e+00 0.00000e+00 0.00000e+00 2.32632e+02 345.924 6.44581e+01 345.924 0.9833 
1 1 1 -7  64  12 o 3  6.47710e+00 8.31654e-01 1.36805e+02 285.642 3.55816e+00  -1.27075e+01 0.00000e+00 0.00000e+00 9.49121e+01 285.642 4.18932e+01 105.642 0.9613 
1 1 1 -7  64  13 o 9  4.49551e+00 1.01632e+00 6.97669e+01 19.354  4.56779e+00  1.60446e+00  0.00000e+00 0.00000e+00 7.88985e+01 19.354  9.13165e+00 19.354  0.8896 
1 1 1 -7  64  14 o 16 1.35965e+01 7.66570e-01 2.27939e+02 113.699 -2.42485e+01 5.52436e+01  0.00000e+00 0.00000e+00 2.72749e+02 113.699 4.48105e+01 113.699 0.9917 
1 1 1 -7  64  15 o 14 4.19492e+00 1.21302e+00 7.77187e+01 293.402 2.12112e+00  -4.90102e+00 0.00000e+00 0.00000e+00 6.24258e+01 293.402 1.52929e+01 113.403 0.9007 
1 1 1 -7  64  16 o 18 4.10366e+00 1.33105e+00 1.10665e+02 289.136 2.53675e+00  -7.31094e+00 0.00000e+00 0.00000e+00 3.11623e+01 289.136 7.95028e+01 109.136 0.9330 
1 1 1 -7  65  1  o 18 1.18222e+01 5.83542e-01 2.58114e+02 288.950 6.19152e+00  -1.80321e+01 0.00000e+00 0.00000e+00 1.73274e+02 288.950 8.48397e+01 108.950 0.9734 
1 1 1 -7  65  2  o 15 3.04343e+01 6.29953e-01 5.53771e+02 230.622 -7.27962e+01 -8.86921e+01 0.00000e+00 0.00000e+00 5.81695e+02 230.622 2.79242e+01 230.622 0.9956 
1 1 1 -7  65  3  o 2  1.19869e+01 5.31903e-01 2.85917e+02 147.775 -2.06444e+01 1.30130e+01  0.00000e+00 0.00000e+00 1.53767e+02 147.775 1.32150e+02 327.775 0.9793 
1 1 1 -7  65  4  o 15 1.00349e+01 6.20587e-01 1.26369e+02 139.323 -7.14565e+00 6.14121e+00  0.00000e+00 0.00000e+00 2.28780e+02 139.323 1.02411e+02 139.323 0.9453 
1 1 1 -7  65  5  o 6  5.70069e+00 8.17176e-01 1.46963e+02 145.420 -5.48027e+00 3.77782e+00  0.00000e+00 0.00000e+00 4.95893e+01 145.420 9.73739e+01 325.420 0.9215 
1 1 1 -7  65  6  o 5  6.50183e+00 6.05315e-01 1.95533e+02 172.768 -1.14794e+01 1.45668e+00  0.00000e+00 0.00000e+00 3.68387e+01 172.768 1.58694e+02 352.768 0.9558 
1 1 1 -7  65  7  o 3  3.34310e+00 6.86550e-01 7.66216e+01 0.746   2.43798e+00  3.17427e-02  0.00000e+00 0.00000e+00 1.80847e+01 0.746   5.85369e+01 180.746 0.7581 
1 1 1 -7  65  8  o 4  6.92170e+00 5.98787e-01 2.03458e+02 18.378  1.50213e+01  4.99057e+00  0.00000e+00 0.00000e+00 4.66994e+01 18.378  1.56759e+02 198.378 0.9679 
1 1 1 -7  65  9  o 2  6.39821e+00 6.44237e-01 8.49383e+01 199.868 -6.65118e+00 -2.40348e+00 0.00000e+00 0.00000e+00 1.36196e+02 199.868 5.12576e+01 199.868 0.9263 
1 1 1 -7  65  10 o 1  1.62042e+01 5.11899e-01 2.36551e+02 329.421 4.67643e+01  -2.76334e+01 0.00000e+00 0.00000e+00 3.61931e+02 329.421 1.25380e+02 329.421 0.9908 
1 1 1 -7  65  11 o 14 6.66100e+00 7.53523e-01 1.16921e+02 144.190 -9.68285e+00 6.98597e+00  0.00000e+00 0.00000e+00 1.20534e+02 144.190 3.61309e+00 144.190 0.9572 
1 1 1 -7  65  12 o 19 9.84587e+00 6.70503e-01 1.50993e+02 54.380  1.43595e+01  2.00426e+01  0.00000e+00 0.00000e+00 2.07837e+02 54.380  5.68440e+01 54.380  0.9795 
1 1 1 -7  65  13 o 5  3.34008e+00 9.29433e-01 5.12984e+01 209.755 -2.29788e+00 -1.31361e+00 0.00000e+00 0.00000e+00 4.55437e+01 209.755 5.75464e+00 29.755  0.7801 
1 1 1 -7  65  14 f 0  2.98024e+00 9.48393e-01 4.54899e+01 10.440  2.36488e+00  4.35741e-01  0.00000e+00 0.00000e+00 3.79631e+01 10.440  7.52686e+00 190.440 0.7542 
1 1 1 -7  65  15 o 14 5.46478e+00 1.40454e+00 6.36327e+01 218.120 -3.86086e+00 -3.02947e+00 0.00000e+00 0.00000e+00 1.16973e+02 218.120 5.33400e+01 218.120 0.8912 
1 1 1 -7  65  16 o 2  7.44298e+00 1.85324e+00 6.99903e+01 300.791 2.92777e+00  -4.91313e+00 0.00000e+00 0.00000e+00 1.80259e+02 300.791 1.10268e+02 300.791 0.9078 
1 1 1 -7  66  1  o 4  1.03736e+01 5.46723e-01 2.15720e+02 275.436 1.45736e+00  -1.53153e+01 0.00000e+00 0.00000e+00 1.60223e+02 275.436 5.54975e+01 95.436  0.9669 
1 1 1 -7  66  2  o 3  3.78490e+00 8.35683e-01 1.03786e+02 45.033  1.87309e+00  1.87527e+00  0.00000e+00 0.00000e+00 6.88027e+00 45.033  9.69061e+01 225.033 0.7804 
1 1 1 -7  66  3  o 11 1.02792e+01 5.46675e-01 2.23893e+02 239.308 -8.85483e+00 -1.49179e+01 0.00000e+00 0.00000e+00 1.49792e+02 239.308 7.41011e+01 59.308  0.9707 
1 1 1 -7  66  4  o 18 3.27955e+00 7.91999e-01 7.21226e+01 159.400 -1.64442e+00 6.18085e-01  0.00000e+00 0.00000e+00 8.09865e+00 159.400 6.40239e+01 339.400 0.6535 
1 1 1 -7  66  5  o 6  7.07137e+00 6.30585e-01 7.79665e+01 45.786  3.27644e+00  3.36759e+00  0.00000e+00 0.00000e+00 1.56386e+02 45.786  7.84192e+01 45.786  0.8859 
1 1 1 -7  66  6  o 10 1.30823e+01 4.77000e-01 2.75777e+02 169.425 -3.29912e+01 6.15891e+00  0.00000e+00 0.00000e+00 2.05985e+02 169.425 6.97917e+01 349.426 0.9850 
1 1 1 -7  66  7  o 16 1.52562e+01 4.72489e-01 3.24453e+02 122.315 -2.92295e+01 4.62091e+01  0.00000e+00 0.00000e+00 2.40305e+02 122.315 8.41475e+01 302.315 0.9908 
1 1 1 -7  66  8  o 15 3.77070e+00 7.73996e-01 3.67613e+01 342.359 1.43644e+00  -4.56806e-01 0.00000e+00 0.00000e+00 4.74134e+01 342.359 1.06521e+01 342.359 0.5979 
1 1 1 -7  66  9  o 2  6.51350e+00 6.48936e-01 8.68694e+01 109.084 -2.48882e+00 7.19374e+00  0.00000e+00 0.00000e+00 1.39536e+02 109.084 5.26666e+01 109.084 0.9318 
1 1 1 -7  66  10 o 13 1.12730e+01 5.53392e-01 1.89872e+02 14.654  3.00421e+01  7.85553e+00  0.00000e+00 0.00000e+00 2.23471e+02 14.654  3.35995e+01 14.654  0.9838 
1 1 1 -7  66  11 o 17 1.38343e+01 5.61116e-01 2.09218e+02 173.857 -4.74155e+01 5.10305e+00  0.00000e+00 0.00000e+00 3.00506e+02 173.857 9.12877e+01 173.857 0.9895 
1 1 1 -7  66  12 o 12 7.87797e+00 7.75639e-01 1.33560e+02 277.182 2.25498e+00  -1.78939e+01 0.00000e+00 0.00000e+00 1.51262e+02 277.182 1.77019e+01 277.182 0.9719 
1 1 1 -7  66  13 o 19 1.17217e+01 7.26753e-01 1.71662e+02 245.974 -1.53903e+01 -3.45245e+01 0.00000e+00 0.00000e+00 2.58137e+02 245.974 8.64747e+01 245.974 0.9867 
1 1 1 -7  66  14 o 7  4.46715e+00 1.15508e+00 7.33498e+01 198.153 -4.98609e+00 -1.63482e+00 0.00000e+00 0.00000e+00 7.56952e+01 198.153 2.34543e+00 198.153 0.8988 
1 1 1 -7  66  15 o 2  4.09478e+00 1.16644e+00 2.59039e+01 293.969 7.57609e-01  -1.70410e+00 0.00000e+00 0.00000e+00 7.64698e+01 293.969 5.05658e+01 293.969 0.6743 
1 1 1 -7  66  16 o 15 3.38374e+00 1.08921e+00 5.83628e+01 53.162  2.50275e+00  3.34082e+00  0.00000e+00 0.00000e+00 5.06413e+01 53.162  7.72152e+00 233.162 0.8699 
1 1 1 -7  67  1  o 5  5.17861e+00 7.92607e-01 1.33625e+02 71.622  1.56393e+00  4.70727e+00  0.00000e+00 0.00000e+00 3.95616e+01 71.622  9.40638e+01 251.622 0.8925 
1 1 1 -7  67  2  o 8  6.29479e+00 7.65130e-01 1.31235e+02 238.107 -3.16216e+00 -5.08164e+00 0.00000e+00 0.00000e+00 8.38408e+01 238.107 4.73940e+01 58.107  0.9121 
1 1 1 -7  67  3  o 17 1.61947e+01 5.08025e-01 2.47252e+02 116.106 -1.30517e+01 2.66348e+01  0.00000e+00 0.00000e+00 3.48809e+02 116.106 1.01556e+02 116.106 0.9830 
1 1 1 -7  67  4  o 12 8.90645e+00 6.57811e-01 6.14310e+01 215.412 -3.47734e+00 -2.47231e+00 0.00000e+00 0.00000e+00 2.29568e+02 215.412 1.68137e+02 215.412 0.8730 
1 1 1 -7  67  5  o 14 1.62336e+01 4.90455e-01 3.00561e+02 154.942 -4.12186e+01 1.92710e+01  0.00000e+00 0.00000e+00 2.99915e+02 154.942 6.46060e-01 334.942 0.9889 
1 1 1 -7  67  6  o 10 2.23901e+01 4.99206e-01 4.81452e+02 174.573 -1.04929e+02 9.96915e+00  0.00000e+00 0.00000e+00 3.51509e+02 174.573 1.29943e+02 354.573 0.9952 
1 1 1 -7  67  7  o 6  1.57972e+01 4.74865e-01 2.72826e+02 222.381 -3.61659e+01 -3.30021e+01 0.00000e+00 0.00000e+00 3.11214e+02 222.381 3.83879e+01 222.381 0.9897 
1 1 1 -7  67  8  o 2  1.44973e+01 4.91718e-01 2.36346e+02 4.666   4.20188e+01  3.42985e+00  0.00000e+00 0.00000e+00 2.98338e+02 4.666   6.19920e+01 4.666   0.9881 
1 1 1 -7  67  9  o 8  6.20120e+00 6.61185e-01 1.64114e+02 166.322 -1.26607e+01 3.08113e+00  0.00000e+00 0.00000e+00 5.81123e+01 166.322 1.06002e+02 346.322 0.9608 
1 1 1 -7  67  10 o 12 1.37131e+01 5.35547e-01 1.79253e+02 357.610 3.70864e+01  -1.54805e+00 0.00000e+00 0.00000e+00 3.24835e+02 357.610 1.45581e+02 357.610 0.9864 
1 1 1 -7  67  11 o 2  7.39173e+00 7.36499e-01 1.40703e+02 217.445 -1.26981e+01 -9.72442e+00 0.00000e+00 0.00000e+00 1.25748e+02 217.445 1.49554e+01 37.446  0.9682 
1 1 1 -7  67  12 o 11 4.21207e+00 9.69431e-01 2.39562e+01 159.981 -1.49159e+00 5.43456e-01  0.00000e+00 0.00000e+00 7.27101e+01 159.981 4.87539e+01 159.981 0.6170 
1 1 1 -7  67  13 o 2  6.91270e+00 9.45106e-01 1.35520e+02 354.875 1.61358e+01  -1.44723e+00 0.00000e+00 0.00000e+00 1.13264e+02 354.875 2.22555e+01 174.875 0.9686 
1 1 1 -7  67  14 o 5  1.01359e+01 9.12190e-01 9.30241e+01 261.336 -2.72735e+00 -1.78976e+01 0.00000e+00 0.00000e+00 2.72617e+02 261.336 1.79593e+02 261.336 0.9720 
1 1 1 -7  67  15 o 6  6.90799e+00 1.23475e+00 1.19216e+02 100.320 -2.58681e+00 1.42061e+01  0.00000e+00 0.00000e+00 1.27834e+02 100.320 8.61814e+00 100.320 0.9647 
1 1 1 -7  67  16 o 9  3.84090e+00 1.15435e+00 5.72458e+01 224.071 -3.46326e+00 -3.35274e+00 0.00000e+00 0.00000e+00 6.91843e+01 224.071 1.19384e+01 224.071 0.8890 
1 1 1 -7  68  1  o 7  1.01981e+01 6.79112e-01 1.12703e+02 73.573  2.34905e+00  7.96771e+00  0.00000e+00 0.00000e+00 2.45584e+02 73.573  1.32881e+02 73.573  0.9377 
1 1 1 -7  68  2  o 11 4.35757e+00 7.49826e-01 1.11543e+02 349.193 3.39309e+00  -6.47719e-01 0.00000e+00 0.00000e+00 2.53292e+01 349.193 8.62143e+01 169.193 0.8387 
1 1 1 -7  68  3  o 5  6.30756e+00 6.49060e-01 8.52591e+01 207.888 -3.93059e+00 -2.08006e+00 0.00000e+00 0.00000e+00 1.22239e+02 207.888 3.69798e+01 207.888 0.8788 
1 1 1 -7  68  4  o 18 1.12756e+01 4.78418e-01 1.92774e+02 345.183 1.83963e+01  -4.86642e+00 0.00000e+00 0.00000e+00 2.17887e+02 345.183 2.51124e+01 345.183 0.9734 
1 1 1 -7  68  5  o 12 7.93409e+00 5.48155e-01 1.84208e+02 53.471  7.99502e+00  1.07934e+01  0.00000e+00 0.00000e+00 1.01229e+02 53.471  8.29790e+01 233.471 0.9620 
1 1 1 -7  68  6  o 15 6.96683e+00 5.86992e-01 1.61416e+02 351.660 1.08300e+01  -1.58764e+00 0.00000e+00 0.00000e+00 8.67615e+01 351.660 7.46543e+01 171.660 0.9532 
1 1 1 -7  68  7  o 12 5.44461e+00 6.68960e-01 7.92234e+01 214.630 -3.70646e+00 -2.55978e+00 0.00000e+00 0.00000e+00 9.98132e+01 214.630 2.05898e+01 214.630 0.8805 
1 1 1 -7  68  8  o 9  7.63496e+00 5.89840e-01 7.47137e+01 183.329 -7.56145e+00 -4.39797e-01 0.00000e+00 0.00000e+00 1.90687e+02 183.329 1.15973e+02 183.329 0.9314 
1 1 1 -7  68  9  o 16 1.09506e+01 5.48827e-01 1.71387e+02 192.194 -2.61829e+01 -5.65825e+00 0.00000e+00 0.00000e+00 2.29268e+02 192.194 5.78803e+01 192.194 0.9812 
1 1 1 -7  68  10 o 9  1.21899e+01 5.46955e-01 1.93012e+02 19.207  3.77433e+01  1.31491e+01  0.00000e+00 0.00000e+00 2.55440e+02 19.207  6.24279e+01 19.207  0.9874 
1 1 1 -7  68  11 o 1  9.40054e+00 6.33907e-01 1.53787e+02 153.072 -2.00429e+01 1.01805e+01  0.00000e+00 0.00000e+00 1.88261e+02 153.072 3.44742e+01 153.072 0.9775 
1 1 1 -7  68  12 o 1  6.30221e+00 9.00096e-01 1.13478e+02 151.795 -9.74656e+00 5.22709e+00  0.00000e+00 0.00000e+00 1.10022e+02 151.795 3.45629e+00 331.795 0.9537 
1 1 1 -7  68  13 f 0  9.26593e+00 8.39866e-01 1.74392e+02 206.450 -2.42961e+01 -1.20873e+01 0.00000e+00 0.00000e+00 1.63417e+02 206.450 1.09743e+01 26.450  0.9814 
1 1 1 -7  68  14 o 8  4.73886e+00 1.18981e+00 6.32979e+01 66.443  1.90382e+00  4.36653e+00  0.00000e+00 0.00000e+00 9.27810e+01 66.443  2.94831e+01 66.443  0.8876 
1 1 1 -7  68  15 o 4  6.08261e+00 1.27597e+00 1.48053e+02 261.323 -2.41537e+00 -1.58270e+01 0.00000e+00 0.00000e+00 7.02325e+01 261.323 7.78207e+01 81.323  0.9682 
1 1 1 -7  68  16 o 8  4.01191e+00 1.25189e+00 4.60746e+01 81.633  5.10273e-01  3.46932e+00  0.00000e+00 0.00000e+00 7.88921e+01 81.633  3.28176e+01 81.633  0.8415 
1 1 1 -7  69  1  f 0  1.14509e+01 6.10560e-01 9.23204e+01 114.086 -3.32145e+00 7.43006e+00  0.00000e+00 0.00000e+00 3.09330e+02 114.086 2.17009e+02 114.086 0.9364 
1 1 1 -7  69  2  o 2  1.35694e+01 5.18029e-01 1.86773e+02 291.872 7.99515e+00  -1.99163e+01 0.00000e+00 0.00000e+00 3.09349e+02 291.872 1.22576e+02 291.872 0.9764 
1 1 1 -7  69  3  f 0  1.03588e+01 5.02859e-01 2.09554e+02 5.483   1.88899e+01  1.81318e+00  0.00000e+00 0.00000e+00 1.67803e+02 5.483   4.17515e+01 185.483 0.9733 
1 1 1 -7  69  4  o 11 2.06380e+01 5.05819e-01 3.52411e+02 64.428  2.91814e+01  6.09830e+01  0.00000e+00 0.00000e+00 4.13926e+02 64.428  6.15144e+01 64.428  0.9926 
1 1 1 -7  69  5  o 10 8.40942e+00 5.29513e-01 1.36185e+02 229.941 -7.17924e+00 -8.53802e+00 0.00000e+00 0.00000e+00 1.63794e+02 229.941 2.76084e+01 229.941 0.9541 
1 1 1 -7  69  6  o 10 1.06212e+01 4.92409e-01 1.98839e+02 142.279 -1.80709e+01 1.39772e+01  0.00000e+00 0.00000e+00 1.89249e+02 142.279 9.58940e+00 322.279 0.9779 
1 1 1 -7  69  7  o 3  8.49525e+00 5.39722e-01 1.34077e+02 197.518 -1.15774e+01 -3.65425e+00 0.00000e+00 0.00000e+00 1.69783e+02 197.518 3.57059e+01 197.518 0.9579 
1 1 1 -7  69  8  o 10 1.27968e+01 5.06478e-01 2.29909e+02 235.657 -2.24524e+01 -3.28616e+01 0.00000e+00 0.00000e+00 2.41541e+02 235.657 1.16328e+01 235.657 0.9874 
1 1 1 -7  69  9  o 8  6.31998e+00 6.50269e-01 7.08976e+01 313.112 4.38991e+00  -4.68926e+00 0.00000e+00 0.00000e+00 1.45521e+02 313.112 7.46237e+01 313.112 0.9185 
1 1 1 -7  69  10 o 6  5.31549e+00 7.84696e-01 6.13191e+01 136.607 -3.56354e+00 3.36910e+00  0.00000e+00 0.00000e+00 1.15127e+02 136.607 5.38079e+01 136.607 0.8911 
1 1 1 -7  69  11 o 4  8.55126e+00 6.80697e-01 1.91010e+02 120.815 -1.33160e+01 2.23245e+01  0.00000e+00 0.00000e+00 1.21056e+02 120.815 6.99547e+01 300.815 0.9806 
1 1 1 -7  69  12 o 7  4.24429e+00 9.61563e-01 4.85146e+01 40.854  2.62708e+00  2.27200e+00  0.00000e+00 0.00000e+00 8.39914e+01 40.854  3.54769e+01 40.854  0.8397 
1 1 1 -7  69  13 o 9  1.51223e+01 6.86462e-01 2.62273e+02 269.023 -1.33109e+00 -7.80267e+01 0.00000e+00 0.00000e+00 2.95777e+02 269.023 3.35045e+01 269.023 0.9936 
1 1 1 -7  69  14 o 12 5.57209e+00 1.22391e+00 7.94245e+01 229.813 -4.66239e+00 -5.51972e+00 0.00000e+00 0.00000e+00 1.12409e+02 229.813 3.29846e+01 229.813 0.9280 
1 1 1 -7  69  15 o 3  5.06756e+00 1.35906e+00 1.28626e+02 84.972  9.48707e-01  1.07824e+01  0.00000e+00 0.00000e+00 5.02649e+01 84.972  7.83608e+01 264.972 0.9526 
1 1 1 -7  69  16 o 2  5.27017e+00 1.41159e+00 1.18708e+02 234.583 -6.06279e+00 -8.52576e+00 0.00000e+00 0.00000e+00 6.67768e+01 234.583 5.19310e+01 54.583  0.9509 
1 1 1 -7  70  1  o 13 5.07858e+00 8.42317e-01 8.21096e+01 60.044  1.55990e+00  2.70661e+00  0.00000e+00 0.00000e+00 7.36172e+01 60.044  8.49243e+00 240.044 0.8187 
1 1 1 -7  70  2  o 2  1.35163e+01 4.91140e-01 2.28147e+02 17.749  2.57180e+01  8.23202e+00  0.00000e+00 0.00000e+00 2.68413e+02 17.749  4.02663e+01 17.749  0.9813 
1 1 1 -7  70  3  o 3  9.65982e+00 5.19939e-01 1.72653e+02 72.078  4.51757e+00  1.39687e+01  0.00000e+00 0.00000e+00 1.76295e+02 72.078  3.64193e+00 72.078  0.9653 
1 1 1 -7  70  4  o 12 7.88361e+00 5.59783e-01 7.79504e+01 110.228 -1.94747e+00 5.28504e+00  0.00000e+00 0.00000e+00 1.89273e+02 110.228 1.11322e+02 110.228 0.9062 
1 1 1 -7  70  5  o 10 1.07120e+01 4.96724e-01 2.81866e+02 254.560 -7.95668e+00 -2.88077e+01 0.00000e+00 0.00000e+00 1.11814e+02 254.560 1.70051e+02 74.560  0.9831 
1 1 1 -7  70  6  o 19 2.28075e+00 6.54774e-01 4.58277e+01 151.163 -9.96444e-01 5.48644e-01  0.00000e+00 0.00000e+00 3.82146e+00 331.163 4.96492e+01 331.163 0.4930 
1 1 1 -7  70  7  o 12 1.26704e+01 4.78015e-01 1.81901e+02 234.554 -1.65168e+01 -2.32021e+01 0.00000e+00 0.00000e+00 2.82750e+02 234.554 1.00849e+02 234.554 0.9823 
1 1 1 -7  70  8  o 9  1.65591e+01 4.98385e-01 2.80054e+02 94.157  -4.72281e+00 6.49857e+01  0.00000e+00 0.00000e+00 3.32941e+02 94.157  5.28866e+01 94.157  0.9923 
1 1 1 -7  70  9  o 15 1.55148e+01 5.34187e-01 1.65423e+02 93.948  -2.58016e+00 3.73880e+01  0.00000e+00 0.00000e+00 4.05139e+02 93.948  2.39716e+02 93.948  0.9866 
1 1 1 -7  70  10 o 18 4.40484e+00 8.33758e-01 7.32735e+01 156.747 -4.35550e+00 1.87151e+00  0.00000e+00 0.00000e+00 7.22415e+01 156.747 1.03194e+00 336.747 0.8870 
1 1 1 -7  70  11 o 1  8.35078e+00 7.07335e-01 1.16824e+02 357.202 1.69801e+01  -8.29821e-01 0.00000e+00 0.00000e+00 1.84623e+02 357.202 6.77990e+01 357.202 0.9701 
1 1 1 -7  70  12 o 6  5.83894e+00 9.80123e-01 1.29290e+02 140.334 -9.35090e+00 7.75379e+00  0.00000e+00 0.00000e+00 7.86254e+01 140.334 5.06642e+01 320.334 0.9579 
1 1 1 -7  70  13 o 1  4.42847e+00 1.09640e+00 9.18061e+01 139.995 -4.96314e+00 4.16538e+00  0.00000e+00 0.00000e+00 5.93564e+01 139.995 3.24497e+01 319.994 0.9192 
1 1 1 -7  70  14 o 14 8.40727e+00 1.01799e+00 1.05620e+02 322.139 1.31707e+01  -1.02388e+01 0.00000e+00 0.00000e+00 1.96734e+02 322.139 9.11147e+01 322.139 0.9695 
1 1 1 -7  70  15 o 6  3.88196e+00 1.17682e+00 6.88513e+01 203.831 -4.68696e+00 -2.07022e+00 0.00000e+00 0.00000e+00 6.00416e+01 203.831 8.80966e+00 23.831  0.8962 
1 1 1 -7  70  16 o 2  3.79465e+00 1.21080e+00 5.68870e+01 191.915 -4.39632e+00 -9.27634e-01 0.00000e+00 0.00000e+00 6.66988e+01 191.915 9.81184e+00 191.915 0.8801 
1 1 1 -7  71  1  o 16 9.96752e+00 5.90854e-01 1.24579e+02 268.983 -1.91944e-01 -1.08160e+01 0.00000e+00 0.00000e+00 2.30957e+02 268.983 1.06377e+02 268.983 0.9526 
1 1 1 -7  71  2  o 2  1.26299e+01 4.97136e-01 2.36139e+02 47.824  1.76891e+01  1.95249e+01  0.00000e+00 0.00000e+00 2.27543e+02 47.824  8.59665e+00 227.824 0.9808 
1 1 1 -7  71  3  f 0  1.18270e+01 4.90774e-01 2.63312e+02 264.593 -2.72836e+00 -2.88276e+01 0.00000e+00 0.00000e+00 1.71477e+02 264.593 9.18346e+01 84.593  0.9826 
1 1 1 -7  71  4  o 6  5.65128e+00 7.55110e-01 1.50046e+02 321.904 6.16981e+00  -4.83708e+00 0.00000e+00 0.00000e+00 4.73095e+01 321.904 1.02736e+02 141.904 0.9339 
1 1 1 -7  71  5  o 3  8.96328e+00 5.43234e-01 1.55089e+02 45.789  1.05597e+01  1.08545e+01  0.00000e+00 0.00000e+00 1.68655e+02 45.789  1.35658e+01 45.789  0.9664 
1 1 1 -7  71  6  o 19 1.20380e+01 5.01404e-01 2.08859e+02 82.202  3.92481e+00  2.86592e+01  0.00000e+00 0.00000e+00 2.32937e+02 82.202  2.40783e+01 82.202  0.9826 
1 1 1 -7  71  7  o 18 9.06117e+00 5.24803e-01 1.92186e+02 215.951 -1.81929e+01 -1.31940e+01 0.00000e+00 0.00000e+00 1.38422e+02 215.951 5.37632e+01 35.951  0.9775 
1 1 1 -7  71  8  o 18 1.45711e+01 5.01759e-01 2.43243e+02 106.194 -1.42250e+01 4.89824e+01  0.00000e+00 0.00000e+00 2.94887e+02 106.194 5.16435e+01 106.194 0.9901 
1 1 1 -7  71  9  o 2  1.50883e+01 5.19351e-01 2.55374e+02 187.563 -5.79864e+01 -7.69911e+00 0.00000e+00 0.00000e+00 3.02122e+02 187.563 4.67481e+01 187.563 0.9914 
1 1 1 -7  71  10 o 3  7.17061e+00 6.99941e-01 1.06341e+02 305.031 6.83587e+00  -9.75155e+00 0.00000e+00 0.00000e+00 1.49201e+02 305.031 4.28600e+01 305.031 0.9570 
1 1 1 -7  71  11 o 8  4.98781e+00 8.96107e-01 8.76087e+01 341.674 6.68335e+00  -2.21359e+00 0.00000e+00 0.00000e+00 8.42147e+01 341.674 3.39398e+00 161.675 0.9260 
1 1 1 -7  71  12 f 0  5.26867e+00 9.62141e-01 1.22121e+02 192.331 -9.52626e+00 -2.08248e+00 0.00000e+00 0.00000e+00 6.33632e+01 192.331 5.87578e+01 12.331  0.9472 
1 1 1 -7  71  13 o 8  4.92839e+00 1.11905e+00 4.16605e+01 26.142  2.92963e+00  1.43786e+00  0.00000e+00 0.00000e+00 1.09793e+02 26.142  6.81321e+01 26.142  0.8277 
1 1 1 -7  71  14 o 18 6.18602e+00 1.16497e+00 8.95890e+01 317.317 6.79761e+00  -6.26880e+00 0.00000e+00 0.00000e+00 1.27040e+02 317.317 3.74507e+01 317.317 0.9443 
1 1 1 -7  71  15 o 10 4.60911e+00 1.12058e+00 1.02885e+02 171.350 -9.32200e+00 1.41817e+00  0.00000e+00 0.00000e+00 5.85235e+01 171.350 4.43616e+01 351.350 0.9454 
1 1 1 -7  72  1  o 14 3.28414e+00 8.82767e-01 8.27072e+01 350.574 2.28059e+00  -3.78592e-01 0.00000e+00 0.00000e+00 8.62903e+00 350.574 7.40781e+01 170.574 0.7429 
1 1 1 -7  72  2  o 11 4.53086e+00 7.97670e-01 8.95766e+01 155.469 -3.21136e+00 1.46561e+00  0.00000e+00 0.00000e+00 5.33032e+01 155.469 3.62734e+01 335.469 0.8427 
1 1 1 -7  72  3  o 15 1.04273e+01 4.97910e-01 1.71599e+02 239.402 -8.93534e+00 -1.51103e+01 0.00000e+00 0.00000e+00 2.07175e+02 239.402 3.55757e+01 239.402 0.9711 
1 1 1 -7  72  4  o 18 1.66951e+01 4.96056e-01 2.57169e+02 94.376  -3.24938e+00 4.24634e+01  0.00000e+00 0.00000e+00 3.59662e+02 94.376  1.02494e+02 94.376  0.9882 
1 1 1 -7  72  5  o 7  7.41398e+00 5.61146e-01 1.30026e+02 209.158 -9.38954e+00 -5.23857e+00 0.00000e+00 0.00000e+00 1.33801e+02 209.158 3.77494e+00 209.158 0.9523 
1 1 1 -7  72  6  o 11 1.89794e+01 4.97552e-01 2.87457e+02 35.907  5.17568e+01  3.74748e+01  0.00000e+00 0.00000e+00 4.15750e+02 35.907  1.28294e+02 35.907  0.9921 
1 1 1 -7  72  7  f 0  9.85615e+00 5.19960e-01 1.92114e+02 268.052 -8.68179e-01 -2.55254e+01 0.00000e+00 0.00000e+00 1.68434e+02 268.052 2.36799e+01 88.052  0.9802 
1 1 1 -7  72  8  o 4  6.60597e+00 6.57252e-01 7.07990e+01 168.645 -6.31878e+00 1.26893e+00  0.00000e+00 0.00000e+00 1.55534e+02 168.645 8.47352e+01 168.645 0.9188 
1 1 1 -7  72  9  o 5  6.02489e+00 7.33124e-01 1.32189e+02 209.246 -9.62268e+00 -5.38819e+00 0.00000e+00 0.00000e+00 8.18747e+01 209.246 5.03140e+01 29.247  0.9535 
1 1 1 -7  72  10 o 8  3.63981e+00 8.42336e-01 3.46446e+01 321.708 1.51308e+00  -1.19462e+00 0.00000e+00 0.00000e+00 5.82541e+01 321.708 2.36095e+01 321.708 0.6856 
1 1 1 -7  72  11 o 3  6.23287e+00 8.51094e-01 1.29006e+02 206.374 -1.20972e+01 -5.99832e+00 0.00000e+00 0.00000e+00 9.40684e+01 206.374 3.49381e+01 26.374  0.9622 
1 1 1 -7  72  12 o 14 7.26910e+00 8.55932e-01 1.05942e+02 272.286 5.30718e-01  -1.32919e+01 0.00000e+00 0.00000e+00 1.53806e+02 272.286 4.78638e+01 272.286 0.9616 
1 1 1 -7  72  13 o 8  1.25415e+01 7.68497e-01 1.90453e+02 122.074 -2.60733e+01 4.16058e+01  0.00000e+00 0.00000e+00 2.70315e+02 122.074 7.98618e+01 122.074 0.9898 
1 1 1 -7  72  14 o 12 4.20449e+00 1.08072e+00 8.77926e+01 217.487 -5.50152e+00 -4.21944e+00 0.00000e+00 0.00000e+00 5.63768e+01 217.487 3.14158e+01 37.487  0.9248 
1 1 1 -7  72  15 o 17 5.65139e+00 1.34180e+00 7.86347e+01 230.862 -4.61132e+00 -5.66662e+00 0.00000e+00 0.00000e+00 1.15763e+02 230.862 3.71283e+01 230.862 0.9288 
1 1 1 -7  73  1  o 13 2.47762e+00 7.21878e-01 1.00967e+02 191.943 -2.16724e+00 -4.58410e-01 0.00000e+00 0.00000e+00 3.32580e+01 11.943  1.34225e+02 11.943  0.7301 
1 1 1 -7  73  2  o 10 6.61610e+00 6.68432e-01 1.40873e+02 168.529 -8.64242e+00 1.75368e+00  0.00000e+00 0.00000e+00 9.21835e+01 168.529 4.86897e+01 348.529 0.9415 
1 1 1 -7  73  3  o 2  1.93863e+01 4.97610e-01 2.92809e+02 48.025  3.76041e+01  4.17998e+01  0.00000e+00 0.00000e+00 4.25753e+02 48.025  1.32944e+02 48.025  0.9911 
1 1 1 -7  73  4  o 2  1.97384e+01 5.08975e-01 2.70114e+02 284.955 1.48414e+01  -5.55640e+01 0.00000e+00 0.00000e+00 4.61281e+02 284.955 1.91166e+02 284.955 0.9913 
1 1 1 -7  73  5  f 0  7.13386e+00 5.99156e-01 1.79475e+02 40.689  1.09291e+01  9.39692e+00  0.00000e+00 0.00000e+00 7.76282e+01 40.689  1.01847e+02 220.689 0.9647 
1 1 1 -7  73  6  o 6  1.29206e+01 5.86315e-01 2.70969e+02 36.371  3.38856e+01  2.49567e+01  0.00000e+00 0.00000e+00 2.05681e+02 36.371  6.52877e+01 216.371 0.9880 
1 1 1 -7  73  7  o 19 1.04855e+01 5.22231e-01 2.09277e+02 142.776 -2.44084e+01 1.85432e+01  0.00000e+00 0.00000e+00 1.75520e+02 142.776 3.37569e+01 322.776 0.9836 
1 1 1 -7  73  8  o 12 8.50553e+00 6.26158e-01 9.69533e+01 118.392 -5.36929e+00 9.93377e+00  0.00000e+00 0.00000e+00 2.05782e+02 118.392 1.08829e+02 118.392 0.9546 
1 1 1 -7  73  9  o 6  6.91773e+00 6.61006e-01 1.20194e+02 122.423 -7.06239e+00 1.11186e+01  0.00000e+00 0.00000e+00 1.27536e+02 122.423 7.34187e+00 122.423 0.9613 
1 1 1 -7  73  10 o 17 1.18064e+01 5.78025e-01 2.10577e+02 239.738 -2.25984e+01 -3.87309e+01 0.00000e+00 0.00000e+00 2.23953e+02 239.738 1.33755e+01 239.738 0.9888 
1 1 1 -7  73  11 o 2  8.03270e+00 7.42513e-01 1.07329e+02 76.430  3.37945e+00  1.40006e+01  0.00000e+00 0.00000e+00 1.80824e+02 76.430  7.34947e+01 76.430  0.9646 
1 1 1 -7  73  12 o 18 3.38838e+00 9.30727e-01 6.03960e+01 291.473 1.19980e+00  -3.05015e+00 0.00000e+00 0.00000e+00 4.39081e+01 291.473 1.64879e+01 111.473 0.8286 
1 1 1 -7  73  13 o 14 6.84832e+00 1.08322e+00 1.08442e+02 33.159  1.11292e+01  7.27147e+00  0.00000e+00 0.00000e+00 1.35960e+02 33.159  2.75183e+01 33.159  0.9616 
1 1 1 -7  73  14 o 14 5.65363e+00 1.24106e+00 1.02205e+02 157.230 -8.84867e+00 3.71422e+00  0.00000e+00 0.00000e+00 9.61409e+01 157.230 6.06435e+00 337.230 0.9464 
1 1 1 -7  73  15 o 12 9.15230e+00 1.15237e+00 1.53646e+02 43.895  2.02868e+01  1.95193e+01  0.00000e+00 0.00000e+00 1.79170e+02 43.895  2.55234e+01 43.895  0.9821 
1 1 1 -7  74  1  o 6  7.46755e+00 6.97059e-01 1.15796e+02 317.389 6.04638e+00  -5.56207e+00 0.00000e+00 0.00000e+00 1.46051e+02 317.389 3.02557e+01 317.389 0.9370 
1 1 1 -7  74  2  o 3  4.24707e+00 7.54142e-01 4.58124e+01 322.021 1.43343e+00  -1.11909e+00 0.00000e+00 0.00000e+00 5.99361e+01 322.021 1.41237e+01 322.021 0.6656 
1 1 1 -7  74  3  o 12 1.19972e+01 5.00258e-01 2.50079e+02 234.540 -1.91510e+01 -2.68887e+01 0.00000e+00 0.00000e+00 1.91671e+02 234.540 5.84074e+01 54.540  0.9847 
1 1 1 -7  74  4  o 15 2.60702e+00 7.31758e-01 1.04910e+02 88.823  5.98711e-02  2.91334e+00  0.00000e+00 0.00000e+00 2.66310e+01 268.823 1.31541e+02 268.823 0.8034 
1 1 1 -7  74  5  o 19 1.56093e+01 4.96424e-01 2.87375e+02 125.773 -2.81938e+01 3.91308e+01  0.00000e+00 0.00000e+00 2.89595e+02 125.773 2.21915e+00 125.773 0.9896 
1 1 1 -7  74  6  o 15 7.67746e+00 6.91234e-01 8.87807e+01 294.963 3.69894e+00  -7.94578e+00 0.00000e+00 0.00000e+00 1.80933e+02 294.963 9.21519e+01 294.963 0.9411 
1 1 1 -7  74  7  o 15 6.87286e+00 6.43875e-01 1.81143e+02 126.565 -1.02305e+01 1.37928e+01  0.00000e+00 0.00000e+00 6.76628e+01 126.565 1.13480e+02 306.565 0.9704 
1 1 1 -7  74  8  o 12 9.42472e+00 5.58034e-01 2.02957e+02 128.559 -1.83612e+01 2.30348e+01  0.00000e+00 0.00000e+00 1.42347e+02 128.559 6.06098e+01 308.558 0.9829 
1 1 1 -7  74  9  o 2  1.10106e+01 5.58231e-01 1.54009e+02 310.396 1.80321e+01  -2.11910e+01 0.00000e+00 0.00000e+00 2.48662e+02 310.396 9.46527e+01 310.396 0.9819 
1 1 1 -7  74  10 o 12 7.46850e+00 7.33931e-01 9.78871e+01 112.271 -4.77583e+00 1.16616e+01  0.00000e+00 0.00000e+00 1.68783e+02 112.271 7.08958e+01 112.271 0.9595 
1 1 1 -7  74  11 o 7  5.64950e+00 9.40099e-01 9.31263e+01 162.996 -8.59410e+00 2.62820e+00  0.00000e+00 0.00000e+00 1.04867e+02 162.996 1.17406e+01 162.996 0.9426 
1 1 1 -7  74  12 o 2  7.08309e+00 9.37875e-01 1.19089e+02 105.991 -3.90715e+00 1.36336e+01  0.00000e+00 0.00000e+00 1.34550e+02 105.991 1.54609e+01 105.991 0.9641 
1 1 1 -7  74  13 o 4  7.52621e+00 1.05623e+00 1.69933e+02 152.632 -1.97742e+01 1.02359e+01  0.00000e+00 0.00000e+00 1.02981e+02 152.632 6.69521e+01 332.632 0.9773 
1 1 1 -7  74  14 o 2  5.89947e+00 1.25203e+00 9.53596e+01 15.612  9.54923e+00  2.66832e+00  0.00000e+00 0.00000e+00 1.11958e+02 15.612  1.65985e+01 15.612  0.9481 
1 1 1 -7  74  15 f 0  5.24512e+00 1.30905e+00 3.78326e+01 207.559 -3.27741e+00 -1.71042e+00 0.00000e+00 0.00000e+00 1.27366e+02 207.559 8.95330e+01 207.559 0.8508 
1 1 1 -7  75  1  o 10 4.15729e+00 9.05953e-01 1.23291e+02 165.912 -4.45049e+00 1.11688e+00  0.00000e+00 0.00000e+00 1.40337e+01 165.912 1.09258e+02 345.912 0.8829 
1 1 1 -7  75  2  o 7  1.46664e+01 6.27680e-01 2.51578e+02 104.683 -9.98973e+00 3.81249e+01  0.00000e+00 0.00000e+00 2.89950e+02 104.683 3.83723e+01 104.683 0.9872 
1 1 1 -7  75  3  o 13 8.23493e+00 6.10915e-01 1.63509e+02 192.314 -1.45038e+01 -3.16605e+00 0.00000e+00 0.00000e+00 1.33791e+02 192.314 2.97176e+01 12.314  0.9657 
1 1 1 -7  75  4  o 11 1.69038e+01 5.02980e-01 2.84213e+02 59.327  2.81878e+01  4.75247e+01  0.00000e+00 0.00000e+00 3.41669e+02 59.327  5.74561e+01 59.327  0.9909 
1 1 1 -7  75  5  o 4  1.14744e+01 5.04510e-01 1.78221e+02 254.357 -6.76961e+00 -2.41765e+01 0.00000e+00 0.00000e+00 2.41667e+02 254.357 6.34450e+01 254.357 0.9799 
1 1 1 -7  75  6  o 7  8.00375e+00 5.61364e-01 2.05684e+02 326.324 1.72022e+01  -1.14621e+01 0.00000e+00 0.00000e+00 8.57128e+01 326.324 1.19972e+02 146.324 0.9755 
1 1 1 -7  75  7  o 8  1.54576e+01 5.10246e-01 2.40224e+02 43.216  3.90194e+01  3.66621e+01  0.00000e+00 0.00000e+00 3.30879e+02 43.216  9.06552e+01 43.216  0.9906 
1 1 1 -7  75  8  o 4  1.06765e+01 5.56446e-01 1.54512e+02 35.963  1.96759e+01  1.42762e+01  0.00000e+00 0.00000e+00 2.35118e+02 35.963  8.06064e+01 35.963  0.9792 
1 1 1 -7  75  9  o 11 2.89883e+00 8.22581e-01 3.78478e+01 179.068 -1.62829e+00 2.64967e-02  0.00000e+00 0.00000e+00 2.97646e+01 179.068 8.08323e+00 359.068 0.6263 
1 1 1 -7  75  10 o 4  1.72083e+01 6.00912e-01 2.71284e+02 221.932 -5.91137e+01 -5.30997e+01 0.00000e+00 0.00000e+00 3.64941e+02 221.932 9.36574e+01 221.932 0.9937 
1 1 1 -7  75  11 o 17 6.42321e+00 8.46168e-01 1.00601e+02 75.139  2.87558e+00  1.08368e+01  0.00000e+00 0.00000e+00 1.27256e+02 75.139  2.66555e+01 75.139  0.9543 
1 1 1 -7  75  12 o 14 5.95441e+00 1.03870e+00 1.14325e+02 175.906 -1.10743e+01 7.92559e-01  0.00000e+00 0.00000e+00 9.65917e+01 175.906 1.77333e+01 355.906 0.9538 
1 1 1 -7  75  13 o 6  6.77111e+00 1.08050e+00 6.96364e+01 245.922 -3.48734e+00 -7.80418e+00 0.00000e+00 0.00000e+00 1.66367e+02 245.922 9.67306e+01 245.922 0.9395 
1 1 1 -7  75  14 o 6  6.78521e+00 1.20584e+00 6.66898e+01 25.048  7.74724e+00  3.62056e+00  0.00000e+00 0.00000e+00 1.69550e+02 25.048  1.02860e+02 25.048  0.9396 
1 1 1 -7  75  15 o 1  3.20535e+00 1.03909e+00 6.90813e+01 257.317 -1.11176e+00 -4.94020e+00 0.00000e+00 0.00000e+00 3.70818e+01 257.317 3.19995e+01 77.317  0.8948 
1 1 1 -7  76  1  o 19 1.47576e+01 6.57952e-01 1.81798e+02 42.973  2.04284e+01  1.90316e+01  0.00000e+00 0.00000e+00 3.60256e+02 42.973  1.78458e+02 42.973  0.9819 
1 1 1 -7  76  2  o 14 1.07640e+01 6.86611e-01 2.79501e+02 227.333 -2.20252e+01 -2.38960e+01 0.00000e+00 0.00000e+00 1.16753e+02 227.333 1.62748e+02 47.333  0.9845 
1 1 1 -7  76  3  o 12 6.24343e+00 7.24422e-01 5.62243e+01 304.059 2.13930e+00  -3.16456e+00 0.00000e+00 0.00000e+00 1.43581e+02 304.059 8.73566e+01 304.059 0.8562 
1 1 1 -7  76  4  o 19 8.80856e+00 5.20614e-01 1.76096e+02 70.936  5.90222e+00  1.70789e+01  0.00000e+00 0.00000e+00 1.43735e+02 70.936  3.23607e+01 250.936 0.9719 
1 1 1 -7  76  5  o 15 2.15712e+01 5.46819e-01 3.41117e+02 240.689 -4.84283e+01 -8.62581e+01 0.00000e+00 0.00000e+00 4.60209e+02 240.689 1.19093e+02 240.689 0.9949 
1 1 1 -7  76  6  o 1  1.17121e+01 5.05041e-01 1.86751e+02 111.797 -1.08900e+01 2.72314e+01  0.00000e+00 0.00000e+00 2.42760e+02 111.797 5.60091e+01 111.797 0.9828 
1 1 1 -7  76  7  o 16 6.37734e+00 6.94421e-01 9.44940e+01 238.889 -4.16799e+00 -6.90637e+00 0.00000e+00 0.00000e+00 1.28040e+02 238.889 3.35462e+01 238.889 0.9358 
1 1 1 -7  76  8  o 12 4.82415e+00 7.61461e-01 1.14462e+02 103.002 -1.93656e+00 8.38668e+00  0.00000e+00 0.00000e+00 5.45029e+01 103.002 5.99587e+01 283.002 0.9400 
1 1 1 -7  76  9  o 16 8.74434e+00 6.32984e-01 1.77699e+02 337.855 2.41133e+01  -9.81325e+00 0.00000e+00 0.00000e+00 1.41549e+02 337.855 3.61496e+01 157.855 0.9806 
1 1 1 -7  76  10 o 2  7.13129e+00 7.77640e-01 1.42714e+02 164.380 -1.67103e+01 4.67201e+00  0.00000e+00 0.00000e+00 1.14803e+02 164.380 2.79118e+01 344.380 0.9707 
1 1 1 -7  76  11 o 2  6.20316e+00 9.36786e-01 1.07903e+02 68.621  4.08954e+00  1.04465e+01  0.00000e+00 0.00000e+00 1.12108e+02 68.621  4.20509e+00 68.621  0.9543 
1 1 1 -7  76  12 f 0  7.68993e+00 9.01672e-01 8.35249e+01 28.031  1.03603e+01  5.51580e+00  0.00000e+00 0.00000e+00 1.89541e+02 28.031  1.06016e+02 28.031  0.9564 
1 1 1 -7  76  13 o 14 4.82190e+00 1.15015e+00 9.80017e+01 189.308 -8.00592e+00 -1.31214e+00 0.00000e+00 0.00000e+00 6.94248e+01 189.308 2.85770e+01 9.308   0.9362 
1 1 1 -7  76  14 o 8  6.22608e+00 1.24514e+00 1.40526e+02 48.001  1.06021e+01  1.17754e+01  0.00000e+00 0.00000e+00 8.27385e+01 48.001  5.77878e+01 228.001 0.9679 
1 1 1 -7  76  15 o 11 6.58592e+00 1.27065e+00 1.05913e+02 122.718 -7.56248e+00 1.17718e+01  0.00000e+00 0.00000e+00 1.28922e+02 122.718 2.30087e+01 122.718 0.9636 
1 1 1 -7  77  1  o 18 6.59282e+00 8.48808e-01 8.80256e+01 206.588 -5.15562e+00 -2.58040e+00 0.00000e+00 0.00000e+00 1.35991e+02 206.588 4.79649e+01 206.588 0.9086 
1 1 1 -7  77  2  o 5  1.07380e+01 6.62154e-01 1.74714e+02 39.237  1.60859e+01  1.31365e+01  0.00000e+00 0.00000e+00 2.16937e+02 39.237  4.22231e+01 39.237  0.9756 
1 1 1 -7  77  3  o 18 4.88357e+00 7.76043e-01 6.88807e+01 61.172  1.62777e+00  2.95755e+00  0.00000e+00 0.00000e+00 8.33819e+01 61.172  1.45011e+01 61.172  0.8343 
1 1 1 -7  77  4  o 4  2.48142e+00 7.35298e-01 6.89568e+01 20.466  1.94835e+00  7.27151e-01  0.00000e+00 0.00000e+00 3.11362e+00 200.466 7.20705e+01 200.466 0.7104 
1 1 1 -7  77  5  o 3  8.47288e+00 5.58279e-01 2.25166e+02 128.137 -1.48133e+01 1.88671e+01  0.00000e+00 0.00000e+00 8.44567e+01 128.137 1.40709e+02 308.137 0.9789 
1 1 1 -7  77  6  o 18 3.29263e+00 7.42731e-01 9.13741e+01 347.615 3.90829e+00  -8.58221e-01 0.00000e+00 0.00000e+00 1.47041e+01 347.615 7.66701e+01 167.615 0.8636 
1 1 1 -7  77  7  o 2  5.56035e+00 7.25843e-01 6.99583e+01 180.774 -5.64076e+00 -7.61936e-02 0.00000e+00 0.00000e+00 1.17934e+02 180.774 4.79753e+01 180.774 0.9064 
1 1 1 -7  77  8  o 8  1.81026e+01 5.29860e-01 2.92666e+02 291.148 3.19361e+01  -8.25594e+01 0.00000e+00 0.00000e+00 3.77897e+02 291.148 8.52309e+01 291.148 0.9943 
1 1 1 -7  77  9  o 18 7.66956e+00 6.70455e-01 1.19290e+02 32.936  1.33251e+01  8.63235e+00  0.00000e+00 0.00000e+00 1.57056e+02 32.936  3.77659e+01 32.936  0.9680 
1 1 1 -7  77  10 o 3  3.90138e+00 9.13099e-01 6.09763e+01 182.785 -3.65284e+00 -1.77683e-01 0.00000e+00 0.00000e+00 6.21987e+01 182.785 1.22239e+00 182.785 0.8489 
1 1 1 -7  77  11 o 8  1.09149e+01 7.06460e-01 2.47005e+02 91.595  -1.39956e+00 5.02685e+01  0.00000e+00 0.00000e+00 1.54508e+02 91.595  9.24973e+01 271.595 0.9900 
1 1 1 -7  77  12 o 9  1.17418e+01 7.56770e-01 2.16445e+02 249.856 -1.81235e+01 -4.94084e+01 0.00000e+00 0.00000e+00 2.15253e+02 249.856 1.19244e+00 69.856  0.9905 
1 1 1 -7  77  13 o 14 7.86710e+00 1.05011e+00 1.32023e+02 35.980  1.53623e+01  1.11530e+01  0.00000e+00 0.00000e+00 1.51912e+02 35.980  1.98898e+01 35.980  0.9733 
1 1 1 -7  77  14 o 10 7.12817e+00 1.22494e+00 1.48207e+02 161.000 -1.82201e+01 6.27377e+00  0.00000e+00 0.00000e+00 1.08880e+02 161.000 3.93269e+01 341.000 0.9737 
1 1 1 -7  77  15 o 6  2.93988e+00 9.92933e-01 3.91924e+01 221.959 -2.30830e+00 -2.07543e+00 0.00000e+00 0.00000e+00 4.97142e+01 221.959 1.05218e+01 221.959 0.8174 
1 1 1 -7  78  1  o 3  1.13031e+01 6.88131e-01 1.69169e+02 263.806 -2.12549e+00 -1.95851e+01 0.00000e+00 0.00000e+00 2.42596e+02 263.806 7.34270e+01 263.806 0.9743 
1 1 1 -7  78  2  o 15 1.17324e+01 1.12442e+00 2.42546e+02 109.790 -9.23404e+00 2.56632e+01  0.00000e+00 0.00000e+00 1.87861e+02 109.790 5.46856e+01 289.789 0.9815 
1 1 1 -7  78  3  o 19 5.35247e+00 7.69621e-01 8.68388e+01 119.391 -2.59907e+00 4.61430e+00  0.00000e+00 0.00000e+00 9.31005e+01 119.391 6.26176e+00 119.391 0.8998 
1 1 1 -7  78  4  o 17 7.62909e+00 6.75091e-01 1.63587e+02 280.319 2.88818e+00  -1.58629e+01 0.00000e+00 0.00000e+00 1.12319e+02 280.319 5.12680e+01 100.319 0.9685 
1 1 1 -7  78  5  o 9  1.01618e+01 5.22248e-01 1.93665e+02 109.186 -9.02334e+00 2.59316e+01  0.00000e+00 0.00000e+00 1.78615e+02 109.186 1.50498e+01 289.186 0.9816 
1 1 1 -7  78  6  o 2  3.85885e+00 8.15179e-01 5.70248e+01 200.132 -2.78355e+00 -1.02040e+00 0.00000e+00 0.00000e+00 5.91748e+01 200.132 2.15001e+00 200.132 0.8073 
1 1 1 -7  78  7  o 4  5.78913e+00 7.01825e-01 6.14583e+01 25.726  4.49651e+00  2.16651e+00  0.00000e+00 0.00000e+00 1.31270e+02 25.726  6.98120e+01 25.726  0.8932 
1 1 1 -7  78  8  o 10 8.61929e+00 6.28100e-01 9.96053e+01 176.628 -1.37825e+01 8.12069e-01  0.00000e+00 0.00000e+00 2.09570e+02 176.628 1.09964e+02 176.628 0.9631 
1 1 1 -7  78  9  o 18 5.71123e+00 8.34793e-01 9.97523e+01 298.232 4.41769e+00  -8.22782e+00 0.00000e+00 0.00000e+00 1.01070e+02 298.232 1.31767e+00 298.232 0.9448 
1 1 1 -7  78  10 o 9  4.50144e+00 9.41330e-01 8.63390e+01 174.023 -6.60138e+00 6.91188e-01  0.00000e+00 0.00000e+00 6.78586e+01 174.023 1.84804e+01 354.023 0.9212 
1 1 1 -7  78  11 o 8  1.03990e+01 6.89209e-01 2.05150e+02 325.258 3.17213e+01  -2.19991e+01 0.00000e+00 0.00000e+00 1.76127e+02 325.258 2.90231e+01 145.258 0.9870 
1 1 1 -7  78  12 o 9  4.67185e+00 1.08370e+00 9.08184e+01 319.354 5.76181e+00  -4.94652e+00 0.00000e+00 0.00000e+00 7.07101e+01 319.354 2.01083e+01 139.354 0.9316 
1 1 1 -7  78  13 o 10 5.00946e+00 1.16076e+00 7.14409e+01 5.586   6.29786e+00  6.16004e-01  0.00000e+00 0.00000e+00 9.88960e+01 5.586   2.74551e+01 5.586   0.9172 
1 1 1 -7  78  14 o 4  2.72762e+00 9.17540e-01 4.96530e+01 103.691 -7.43924e-01 3.05379e+00  0.00000e+00 0.00000e+00 3.31794e+01 103.691 1.64736e+01 283.691 0.8200 
1 1 1 -7  78  15 o 5  4.29473e+00 1.28256e+00 1.12084e+02 236.009 -5.48685e+00 -8.13733e+00 0.00000e+00 0.00000e+00 3.84510e+01 236.009 7.36334e+01 56.009  0.9476 
1 1 1 -7  79  1  o 16 1.46256e+01 6.63556e-01 1.61441e+02 107.873 -8.54620e+00 2.65021e+01  0.00000e+00 0.00000e+00 3.75396e+02 107.873 2.13955e+02 107.873 0.9819 
1 1 1 -7  79  2  o 17 9.29187e+00 8.83329e-01 1.93876e+02 253.307 -5.96738e+00 -1.98996e+01 0.00000e+00 0.00000e+00 1.44889e+02 253.307 4.89864e+01 73.307  0.9756 
1 1 1 -7  79  3  o 6  4.11247e+00 8.22120e-01 1.02472e+02 334.462 4.66943e+00  -2.23101e+00 0.00000e+00 0.00000e+00 3.53626e+01 334.462 6.71092e+01 154.462 0.8973 
1 1 1 -7  79  4  o 4  5.80066e+00 7.83010e-01 1.19104e+02 172.386 -8.03129e+00 1.07353e+00  0.00000e+00 0.00000e+00 8.36178e+01 172.386 3.54867e+01 352.386 0.9361 
1 1 1 -7  79  5  o 9  1.83427e+01 4.98395e-01 3.49676e+02 150.054 -7.99578e+01 4.60623e+01  0.00000e+00 0.00000e+00 3.31032e+02 150.054 1.86443e+01 330.054 0.9946 
1 1 1 -7  79  6  o 14 1.32765e+01 5.25187e-01 2.11732e+02 346.186 3.99715e+01  -9.82831e+00 0.00000e+00 0.00000e+00 2.77300e+02 346.186 6.55682e+01 346.186 0.9878 
1 1 1 -7  79  7  o 8  8.85472e+00 5.74198e-01 1.50558e+02 235.361 -1.24099e+01 -1.79632e+01 0.00000e+00 0.00000e+00 1.71765e+02 235.361 2.12072e+01 235.361 0.9768 
1 1 1 -7  79  8  o 17 7.37647e+00 7.03629e-01 1.73488e+02 223.263 -1.51838e+01 -1.42898e+01 0.00000e+00 0.00000e+00 9.45222e+01 223.263 7.89663e+01 43.263  0.9757 
1 1 1 -7  79  9  o 9  1.57668e+01 5.54396e-01 3.02285e+02 298.989 4.37206e+01  -7.89095e+01 0.00000e+00 0.00000e+00 2.81097e+02 298.989 2.11884e+01 118.989 0.9944 
1 1 1 -7  79  10 o 10 6.25411e+00 8.45369e-01 1.12699e+02 53.095  7.35056e+00  9.78823e+00  0.00000e+00 0.00000e+00 1.10091e+02 53.095  2.60756e+00 233.095 0.9582 
1 1 1 -7  79  11 o 16 9.67335e+00 8.85696e-01 1.52778e+02 93.603  -1.63894e+00 2.60283e+01  0.00000e+00 0.00000e+00 1.99544e+02 93.603  4.67661e+01 93.603  0.9806 
1 1 1 -7  79  12 o 13 5.19423e+00 1.10732e+00 4.07916e+01 177.826 -3.55894e+00 1.35105e-01  0.00000e+00 0.00000e+00 1.21921e+02 177.826 8.11295e+01 177.826 0.8443 
1 1 1 -7  79  13 o 18 7.91241e+00 1.08126e+00 1.71026e+02 192.637 -2.61584e+01 -5.86509e+00 0.00000e+00 0.00000e+00 1.16731e+02 192.637 5.42954e+01 12.638  0.9812 
1 1 1 -7  79  14 o 14 5.40591e+00 1.28193e+00 7.37964e+01 88.637  1.70050e-01  7.14610e+00  0.00000e+00 0.00000e+00 1.11775e+02 88.637  3.79790e+01 88.637  0.9272 
1 1 1 -7  79  15 o 18 4.41655e+00 1.25964e+00 9.18236e+01 3.757   8.25955e+00  5.42385e-01  0.00000e+00 0.00000e+00 6.12979e+01 3.757   3.05257e+01 183.757 0.9375 
1 1 1 -7  80  1  o 17 3.53954e+00 8.64103e-01 7.94259e+01 308.374 2.11139e+00  -2.66637e+00 0.00000e+00 0.00000e+00 3.11370e+01 308.374 4.82889e+01 128.374 0.8358 
1 1 1 -7  80  2  o 2  8.52590e+00 7.29053e-01 1.35383e+02 346.365 1.42384e+01  -3.45373e+00 0.00000e+00 0.00000e+00 1.72081e+02 346.365 3.66983e+01 346.365 0.9652 
1 1 1 -7  80  3  o 6  4.81678e+00 7.81134e-01 9.94709e+01 285.014 1.45804e+00  -5.43618e+00 0.00000e+00 0.00000e+00 6.35308e+01 285.014 3.59401e+01 105.014 0.9062 
1 1 1 -7  80  4  o 11 1.03361e+01 6.84329e-01 1.73334e+02 176.417 -2.27373e+01 1.42387e+00  0.00000e+00 0.00000e+00 2.03907e+02 176.417 3.05736e+01 176.417 0.9778 
1 1 1 -7  80  5  o 14 1.49920e+01 5.63698e-01 2.60392e+02 42.385  4.25648e+01  3.88462e+01  0.00000e+00 0.00000e+00 2.94015e+02 42.385  3.36229e+01 42.385  0.9913 
1 1 1 -7  80  6  o 8  9.23315e+00 5.62618e-01 1.50448e+02 250.171 -7.05868e+00 -1.95749e+01 0.00000e+00 0.00000e+00 1.85408e+02 250.171 3.49594e+01 250.171 0.9757 
1 1 1 -7  80  7  o 7  5.35038e+00 7.36470e-01 6.42301e+01 286.100 1.47157e+00  -5.09851e+00 0.00000e+00 0.00000e+00 1.15182e+02 286.100 5.09521e+01 286.100 0.9000 
1 1 1 -7  80  8  o 15 1.23236e+01 5.48640e-01 1.94104e+02 140.391 -3.36256e+01 2.78264e+01  0.00000e+00 0.00000e+00 2.59410e+02 140.391 6.53057e+01 140.391 0.9885 
1 1 1 -7  80  9  o 15 1.03773e+01 6.06476e-01 1.59778e+02 27.670  2.77465e+01  1.45486e+01  0.00000e+00 0.00000e+00 2.20042e+02 27.670  6.02638e+01 27.670  0.9839 
1 1 1 -7  80  10 o 1  1.03136e+01 6.69380e-01 1.51164e+02 181.715 -2.72677e+01 -8.16689e-01 0.00000e+00 0.00000e+00 2.25073e+02 181.715 7.39095e+01 181.715 0.9815 
1 1 1 -7  80  11 o 5  3.62125e+00 9.86117e-01 5.32549e+01 37.598  2.61024e+00  2.00998e+00  0.00000e+00 0.00000e+00 5.82997e+01 37.598  5.04482e+00 37.598  0.8296 
1 1 1 -7  80  12 o 4  7.83723e+00 9.47110e-01 7.58809e+01 158.266 -1.10135e+01 4.39035e+00  0.00000e+00 0.00000e+00 2.02308e+02 158.266 1.26428e+02 158.266 0.9569 
1 1 1 -7  80  13 o 18 7.16714e+00 1.14800e+00 1.61012e+02 228.644 -1.50826e+01 -1.71344e+01 0.00000e+00 0.00000e+00 9.87020e+01 228.644 6.23097e+01 48.644  0.9778 
1 1 1 -7  80  14 o 1  6.94219e+00 1.18904e+00 1.02065e+02 52.356  8.98713e+00  1.16516e+01  0.00000e+00 0.00000e+00 1.46020e+02 52.356  4.39545e+01 52.356  0.9654 
1 1 1 -7  80  15 o 8  2.75195e+00 9.39824e-01 3.39078e+01 209.593 -2.32288e+00 -1.31919e+00 0.00000e+00 0.00000e+00 4.57024e+01 209.593 1.17946e+01 209.593 0.7824 
1 1 1 -7  81  1  o 19 3.00434e+00 8.00876e-01 2.96133e+01 252.800 -3.07303e-01 -9.92716e-01 0.00000e+00 0.00000e+00 2.20388e+01 252.800 7.57447e+00 72.800  0.4601 
1 1 1 -7  81  2  o 4  4.67730e+00 9.83077e-01 9.67988e+01 235.044 -2.82467e+00 -4.04067e+00 0.00000e+00 0.00000e+00 5.89955e+01 235.044 3.78033e+01 55.044  0.8917 
1 1 1 -7  81  3  o 18 2.97853e+00 8.40225e-01 2.52053e+01 112.616 -3.47845e-01 8.34967e-01  0.00000e+00 0.00000e+00 2.05609e+01 112.616 4.64444e+00 292.616 0.4115 
1 1 1 -7  81  4  o 19 3.86509e+00 9.12376e-01 8.96291e+01 67.060  1.68848e+00  3.98938e+00  0.00000e+00 0.00000e+00 3.66034e+01 67.060  5.30257e+01 247.060 0.8752 
1 1 1 -7  81  5  o 19 1.34528e+01 6.10969e-01 2.30460e+02 64.345  1.91478e+01  3.98659e+01  0.00000e+00 0.00000e+00 2.65585e+02 64.345  3.51257e+01 64.345  0.9886 
1 1 1 -7  81  6  f 0  8.28726e+00 6.02643e-01 1.73251e+02 223.376 -1.73751e+01 -1.64171e+01 0.00000e+00 0.00000e+00 1.29116e+02 223.376 4.41355e+01 43.376  0.9789 
1 1 1 -7  81  7  o 9  3.05672e+00 8.06316e-01 1.46492e+02 149.032 -5.73156e+00 3.43947e+00  0.00000e+00 0.00000e+00 4.15339e+01 329.032 1.88026e+02 329.032 0.9218 
1 1 1 -7  81  8  o 16 4.29019e+00 8.56432e-01 7.58532e+01 315.919 3.79267e+00  -3.67284e+00 0.00000e+00 0.00000e+00 6.77819e+01 315.919 8.07129e+00 135.920 0.8995 
1 1 1 -7  81  9  o 11 4.89524e+00 8.82562e-01 1.13446e+02 192.359 -9.18508e+00 -2.01250e+00 0.00000e+00 0.00000e+00 5.86426e+01 192.359 5.48031e+01 12.359  0.9452 
1 1 1 -7  81  10 o 3  6.62865e+00 8.76145e-01 1.25820e+02 304.688 8.10050e+00  -1.17037e+01 0.00000e+00 0.00000e+00 1.11679e+02 304.688 1.41408e+01 124.688 0.9642 
1 1 1 -7  81  11 o 5  1.05317e+01 7.38321e-01 1.88911e+02 98.257  -6.03180e+00 4.15624e+01  0.00000e+00 0.00000e+00 1.97394e+02 98.257  8.48330e+00 98.257  0.9880 
1 1 1 -7  81  12 o 2  1.72102e+01 6.90873e-01 2.87704e+02 299.768 5.77104e+01  -1.00899e+02 0.00000e+00 0.00000e+00 3.47841e+02 299.768 6.01370e+01 299.768 0.9957 
1 1 1 -7  81  13 o 18 3.93524e+00 1.13151e+00 8.41355e+01 188.667 -6.11412e+00 -9.31946e-01 0.00000e+00 0.00000e+00 4.92905e+01 188.667 3.48450e+01 8.667   0.9151 
1 1 1 -7  81  14 o 13 5.96252e+00 1.22848e+00 8.66986e+01 341.124 9.62411e+00  -3.29063e+00 0.00000e+00 0.00000e+00 1.22820e+02 341.124 3.61214e+01 341.124 0.9495 
1 1 1 -7  81  15 o 18 3.38346e+00 1.08511e+00 3.76471e+01 311.702 2.22118e+00  -2.49285e+00 0.00000e+00 0.00000e+00 6.64394e+01 311.702 2.87923e+01 311.702 0.8322 
1 1 1 -7  82  1  f 0  6.46913e+00 6.85302e-01 1.78090e+02 17.170  1.46188e+01  4.51692e+00  0.00000e+00 0.00000e+00 5.55490e+01 17.170  1.22541e+02 197.170 0.9667 
1 1 1 -7  82  2  o 3  9.15156e+00 7.51371e-01 1.91805e+02 256.802 -4.98340e+00 -2.12508e+01 0.00000e+00 0.00000e+00 1.42029e+02 256.802 4.97762e+01 76.802  0.9768 
1 1 1 -7  82  3  o 5  8.86016e+00 7.43852e-01 9.26037e+01 33.473  9.16096e+00  6.05731e+00  0.00000e+00 0.00000e+00 2.22691e+02 33.473  1.30087e+02 33.473  0.9533 
1 1 1 -7  82  4  f 0  4.27150e+00 9.25236e-01 3.89527e+01 6.754   2.02405e+00  2.39721e-01  0.00000e+00 0.00000e+00 7.32338e+01 6.754   3.42811e+01 6.754   0.7039 
1 1 1 -7  82  5  o 10 9.07510e+00 6.25475e-01 1.59655e+02 232.052 -1.30744e+01 -1.67660e+01 0.00000e+00 0.00000e+00 1.70687e+02 232.052 1.10313e+01 232.052 0.9762 
1 1 1 -7  82  6  o 2  1.03947e+01 5.68113e-01 1.67313e+02 23.198  2.63928e+01  1.13111e+01  0.00000e+00 0.00000e+00 2.13247e+02 23.198  4.59345e+01 23.198  0.9824 
1 1 1 -7  82  7  o 13 5.16361e+00 7.79681e-01 1.09455e+02 157.730 -8.23321e+00 3.37171e+00  0.00000e+00 0.00000e+00 7.16870e+01 157.730 3.77679e+01 337.730 0.9420 
1 1 1 -7  82  8  o 12 3.21728e+00 8.60681e-01 6.23570e+01 122.946 -1.79279e+00 2.76635e+00  0.00000e+00 0.00000e+00 3.69806e+01 122.946 2.53764e+01 302.946 0.8297 
1 1 1 -7  82  9  o 3  7.63362e+00 7.36658e-01 1.05404e+02 247.269 -5.59103e+00 -1.33453e+01 0.00000e+00 0.00000e+00 1.68445e+02 247.269 6.30404e+01 247.269 0.9648 
1 1 1 -7  82  10 o 15 6.74254e+00 9.00147e-01 6.57751e+01 118.580 -3.44995e+00 6.33282e+00  0.00000e+00 0.00000e+00 1.66636e+02 118.580 1.00861e+02 118.580 0.9278 
1 1 1 -7  82  11 o 9  8.94525e+00 8.00356e-01 1.25228e+02 0.565   2.31137e+01  2.27968e-01  0.00000e+00 0.00000e+00 1.99526e+02 0.565   7.42985e+01 0.565   0.9781 
1 1 1 -7  82  12 o 5  5.16139e+00 1.10665e+00 4.84867e+01 172.654 -4.35307e+00 5.61200e-01  0.00000e+00 0.00000e+00 1.19353e+02 172.654 7.08667e+01 172.654 0.8770 
1 1 1 -7  82  13 o 2  3.19251e+00 9.65905e-01 5.10571e+01 183.442 -3.67446e+00 -2.20982e-01 0.00000e+00 0.00000e+00 4.94632e+01 183.442 1.59399e+00 3.442   0.8500 
1 1 1 -7  82  14 o 14 3.83106e+00 1.14986e+00 5.81932e+01 328.910 4.20819e+00  -2.53751e+00 0.00000e+00 0.00000e+00 6.81561e+01 328.910 9.96284e+00 328.910 0.8914 
1 1 1 -7  83  1  o 3  4.85567e+00 7.84905e-01 1.46862e+02 248.475 -3.42757e+00 -8.69040e+00 0.00000e+00 0.00000e+00 2.44958e+01 248.475 1.22366e+02 68.475  0.9449 
1 1 1 -7  83  2  f 0  1.11445e+01 6.89469e-01 2.21566e+02 256.027 -8.13505e+00 -3.26938e+01 0.00000e+00 0.00000e+00 1.88300e+02 256.027 3.32662e+01 76.027  0.9850 
1 1 1 -7  83  3  o 4  9.83052e+00 7.33834e-01 1.65476e+02 112.095 -8.08908e+00 1.99258e+01  0.00000e+00 0.00000e+00 1.92761e+02 112.095 2.72850e+01 112.095 0.9765 
1 1 1 -7  83  4  o 12 7.10451e+00 8.42678e-01 1.48761e+02 214.210 -1.20799e+01 -8.21266e+00 0.00000e+00 0.00000e+00 1.07006e+02 214.210 4.17546e+01 34.210  0.9651 
1 1 1 -7  83  5  o 3  6.97862e+00 7.12128e-01 1.24790e+02 299.112 6.75236e+00  -1.21255e+01 0.00000e+00 0.00000e+00 1.25820e+02 299.112 1.03007e+00 299.112 0.9633 
1 1 1 -7  83  6  o 17 6.73812e+00 7.43244e-01 1.15914e+02 127.408 -7.29114e+00 9.53351e+00  0.00000e+00 0.00000e+00 1.24432e+02 127.408 8.51845e+00 127.408 0.9574 
1 1 1 -7  83  7  o 17 5.12271e+00 8.21052e-01 7.51610e+01 113.998 -2.53364e+00 5.69128e+00  0.00000e+00 0.00000e+00 9.95056e+01 113.998 2.43445e+01 113.998 0.9158 
1 1 1 -7  83  8  o 18 4.21631e+00 8.49127e-01 4.92859e+01 81.095  5.40951e-01  3.45240e+00  0.00000e+00 0.00000e+00 8.26090e+01 81.095  3.33231e+01 81.095  0.8408 
1 1 1 -7  83  9  o 6  4.68649e+00 8.85166e-01 1.04038e+02 170.425 -7.60428e+00 1.28272e+00  0.00000e+00 0.00000e+00 5.84563e+01 170.425 4.55822e+01 350.425 0.9327 
1 1 1 -7  83  10 f 0  5.14479e+00 9.99575e-01 8.16342e+01 121.090 -3.57455e+00 5.92801e+00  0.00000e+00 0.00000e+00 9.50583e+01 121.090 1.34241e+01 121.090 0.9247 
1 1 1 -7  83  11 o 15 3.36074e+00 9.74992e-01 6.27637e+01 301.099 2.00599e+00  -3.32553e+00 0.00000e+00 0.00000e+00 4.43501e+01 301.099 1.84136e+01 121.099 0.8589 
1 1 1 -7  83  12 o 12 4.82889e+00 1.09430e+00 5.83145e+01 46.253  3.61748e+00  3.77927e+00  0.00000e+00 0.00000e+00 1.02529e+02 46.253  4.42141e+01 46.253  0.8985 
1 1 1 -7  83  13 o 15 1.13333e+01 9.06607e-01 1.71791e+02 200.644 -4.26704e+01 -1.60761e+01 0.00000e+00 0.00000e+00 2.43287e+02 200.644 7.14966e+01 200.644 0.9890 
1 1 1 -7  83  14 o 9  3.42689e+00 1.05351e+00 4.33424e+01 25.043  3.17735e+00  1.48449e+00  0.00000e+00 0.00000e+00 6.33284e+01 25.043  1.99860e+01 25.043  0.8415 
1 1 1 -7  84  1  o 13 4.32858e+00 7.97216e-01 9.39237e+01 271.958 1.88646e-01  -5.51714e+00 0.00000e+00 0.00000e+00 5.22255e+01 271.958 4.16982e+01 91.958  0.9042 
1 1 1 -7  84  2  o 18 2.59153e+00 7.62815e-01 2.61310e+01 275.923 9.13317e-02  -8.80273e-01 0.00000e+00 0.00000e+00 1.29655e+01 275.923 1.31655e+01 95.923  0.4042 
1 1 1 -7  84  3  o 3  2.71227e+00 8.39010e-01 2.50504e+01 244.506 -4.05079e-01 -8.49488e-01 0.00000e+00 0.00000e+00 1.79727e+01 244.506 7.07769e+00 64.506  0.4251 
1 1 1 -7  84  4  o 18 4.39711e+00 9.05068e-01 8.45987e+01 206.489 -4.30319e+00 -2.14449e+00 0.00000e+00 0.00000e+00 6.11344e+01 206.489 2.34643e+01 26.489  0.8887 
1 1 1 -7  84  5  o 5  7.47601e+00 6.93163e-01 1.35598e+02 104.820 -4.08202e+00 1.54284e+01  0.00000e+00 0.00000e+00 1.34169e+02 104.820 1.42938e+00 284.820 0.9681 
1 1 1 -7  84  6  o 10 5.47561e+00 8.43823e-01 1.27096e+02 257.864 -2.23758e+00 -1.04053e+01 0.00000e+00 0.00000e+00 6.70313e+01 257.864 6.00644e+01 77.864  0.9518 
1 1 1 -7  84  7  o 7  1.48242e+01 5.43308e-01 2.62854e+02 72.094  2.23739e+01  6.92474e+01  0.00000e+00 0.00000e+00 2.85149e+02 72.094  2.22948e+01 72.094  0.9931 
1 1 1 -7  84  8  o 6  2.79117e+00 8.01736e-01 9.41766e+01 180.611 -4.26911e+00 -4.54989e-02 0.00000e+00 0.00000e+00 3.52776e+00 0.611   9.77043e+01 0.611   0.8731 
1 1 1 -7  84  9  o 3  4.51926e+00 8.94572e-01 1.10213e+02 112.522 -3.27090e+00 7.88790e+00  0.00000e+00 0.00000e+00 4.75847e+01 112.522 6.26284e+01 292.522 0.9395 
1 1 1 -7  84  10 o 18 3.08861e+00 9.11085e-01 6.12634e+01 356.194 3.37606e+00  -2.24563e-01 0.00000e+00 0.00000e+00 3.44794e+01 356.194 2.67840e+01 176.194 0.8348 
1 1 1 -7  84  11 o 8  8.10558e+00 8.72764e-01 1.46750e+02 15.657  2.40611e+01  6.74385e+00  0.00000e+00 0.00000e+00 1.47885e+02 15.657  1.13545e+00 15.657  0.9798 
1 1 1 -7  84  12 o 18 3.44030e+00 1.02655e+00 3.45709e+01 5.443   2.50790e+00  2.38955e-01  0.00000e+00 0.00000e+00 6.32376e+01 5.443   2.86667e+01 5.443   0.7671 
1 1 1 -7  84  13 o 1  4.42611e+00 1.14660e+00 7.73321e+01 243.146 -3.10999e+00 -6.14234e+00 0.00000e+00 0.00000e+00 7.41238e+01 243.146 3.20831e+00 63.146  0.9242 
1 1 1 -7  84  14 o 16 4.62134e+00 1.16128e+00 9.76539e+01 292.326 3.81206e+00  -9.28250e+00 0.00000e+00 0.00000e+00 6.45055e+01 292.326 3.31485e+01 112.327 0.9488 
1 1 1 -7  85  1  o 11 1.15762e+01 5.45475e-01 1.78380e+02 213.717 -2.50081e+01 -1.66894e+01 0.00000e+00 0.00000e+00 2.46539e+02 213.717 6.81586e+01 213.717 0.9832 
1 1 1 -7  85  2  o 18 1.02114e+01 5.40590e-01 1.95684e+02 63.483  1.38196e+01  2.76969e+01  0.00000e+00 0.00000e+00 1.79184e+02 63.483  1.64999e+01 243.483 0.9837 
1 1 1 -7  85  3  o 13 4.91899e+00 9.07757e-01 1.38043e+02 197.173 -8.38016e+00 -2.58984e+00 0.00000e+00 0.00000e+00 3.46465e+01 197.173 1.03397e+02 17.173  0.9411 
1 1 1 -7  85  4  o 11 9.05824e+00 7.82602e-01 1.66181e+02 83.686  2.49518e+00  2.25521e+01  0.00000e+00 0.00000e+00 1.64017e+02 83.686  2.16457e+00 263.686 0.9777 
1 1 1 -7  85  5  f 0  9.69834e+00 6.27591e-01 5.15676e+01 333.198 7.18338e+00  -3.62891e+00 0.00000e+00 0.00000e+00 2.86562e+02 333.198 2.34994e+02 333.198 0.9356 
1 1 1 -7  85  6  o 14 5.85693e+00 8.18441e-01 8.67117e+01 247.602 -3.13843e+00 -7.61537e+00 0.00000e+00 0.00000e+00 1.17697e+02 247.602 3.09851e+01 247.602 0.9372 
1 1 1 -7  85  7  o 8  2.77812e+00 8.11294e-01 4.66992e+01 15.717  2.10284e+00  5.91737e-01  0.00000e+00 0.00000e+00 2.83456e+01 15.717  1.83536e+01 195.717 0.7259 
1 1 1 -7  85  8  o 11 6.69959e+00 7.83635e-01 1.18902e+02 6.441   1.47799e+01  1.66859e+00  0.00000e+00 0.00000e+00 1.21710e+02 6.441   2.80858e+00 6.441   0.9658 
1 1 1 -7  85  9  o 16 7.36731e+00 7.78209e-01 1.40038e+02 79.487  3.58137e+00  1.92989e+01  0.00000e+00 0.00000e+00 1.26645e+02 79.487  1.33931e+01 259.487 0.9742 
1 1 1 -7  85  10 o 16 3.70309e+00 9.64072e-01 1.77008e+01 82.195  1.63215e-01  1.19067e+00  0.00000e+00 0.00000e+00 5.28723e+01 82.195  3.51715e+01 82.195  0.5133 
1 1 1 -7  85  11 o 11 4.54969e+00 1.10992e+00 7.18831e+01 351.677 5.72283e+00  -8.37237e-01 0.00000e+00 0.00000e+00 8.14901e+01 351.677 9.60694e+00 351.677 0.9089 
1 1 1 -7  85  12 o 10 7.20911e+00 1.05016e+00 1.23597e+02 236.809 -1.05084e+01 -1.60638e+01 0.00000e+00 0.00000e+00 1.36480e+02 236.809 1.28827e+01 236.809 0.9736 
1 1 1 -7  85  13 o 4  5.74499e+00 1.04397e+00 8.07865e+01 56.407  6.09152e+00  9.17073e+00  0.00000e+00 0.00000e+00 1.21968e+02 56.407  4.11818e+01 56.407  0.9534 
1 1 1 -7  85  14 o 16 3.78973e+00 1.14519e+00 7.57687e+01 230.373 -4.42804e+00 -5.34751e+00 0.00000e+00 0.00000e+00 5.38311e+01 230.373 2.19376e+01 50.373  0.9249 
1 1 1 -7  86  1  o 18 3.15198e+00 8.21751e-01 9.61214e+01 220.704 -3.12728e+00 -2.69024e+00 0.00000e+00 0.00000e+00 6.01332e+00 220.704 9.01080e+01 40.704  0.8682 
1 1 1 -7  86  2  o 3  5.52009e+00 7.94033e-01 9.22204e+01 306.678 4.11692e+00  -5.52776e+00 0.00000e+00 0.00000e+00 9.81445e+01 306.678 5.92410e+00 306.678 0.9243 
1 1 1 -7  86  3  o 19 4.91801e+00 7.96027e-01 4.65571e+01 21.101  3.20253e+00  1.23579e+00  0.00000e+00 0.00000e+00 1.07051e+02 21.101  6.04936e+01 21.101  0.8375 
1 1 1 -7  86  4  o 10 1.48426e+01 6.70258e-01 2.05271e+02 223.229 -3.49673e+01 -3.28697e+01 0.00000e+00 0.00000e+00 3.42191e+02 223.229 1.36920e+02 223.229 0.9895 
1 1 1 -7  86  5  o 7  7.87867e+00 8.09689e-01 8.79607e+01 23.813  9.85109e+00  4.34750e+00  0.00000e+00 0.00000e+00 1.91573e+02 23.813  1.03612e+02 23.813  0.9524 
1 1 1 -7  86  6  o 5  6.20449e+00 8.01693e-01 1.16504e+02 134.637 -8.47178e+00 8.57980e+00  0.00000e+00 0.00000e+00 1.04701e+02 134.637 1.18031e+01 314.637 0.9576 
1 1 1 -7  86  7  o 12 6.37210e+00 8.49452e-01 1.09140e+02 318.792 8.78635e+00  -7.69410e+00 0.00000e+00 0.00000e+00 1.17552e+02 318.792 8.41181e+00 318.792 0.9562 
1 1 1 -7  86  8  o 11 8.37325e+00 6.88652e-01 1.49624e+02 53.432  1.40282e+01  1.89110e+01  0.00000e+00 0.00000e+00 1.54996e+02 53.432  5.37159e+00 53.432  0.9785 
1 1 1 -7  86  9  o 18 9.36173e+00 6.74459e-01 1.71098e+02 188.520 -3.13912e+01 -4.70280e+00 0.00000e+00 0.00000e+00 1.71155e+02 188.520 5.72538e-02 188.520 0.9841 
1 1 1 -7  86  10 o 8  6.44212e+00 9.45419e-01 6.01413e+01 174.498 -7.24840e+00 6.98219e-01  0.00000e+00 0.00000e+00 1.61885e+02 174.498 1.01744e+02 174.498 0.9286 
1 1 1 -7  86  11 o 17 4.23719e+00 1.05980e+00 7.79372e+01 273.440 3.59684e-01  -5.98283e+00 0.00000e+00 0.00000e+00 6.54015e+01 273.440 1.25357e+01 93.440  0.9123 
1 1 1 -7  86  12 o 12 4.00961e+00 1.09577e+00 5.96582e+01 224.339 -3.50815e+00 -3.42811e+00 0.00000e+00 0.00000e+00 7.27100e+01 224.339 1.30518e+01 224.339 0.8911 
1 1 1 -7  86  13 o 17 4.50185e+00 1.16633e+00 8.63647e+01 5.524   8.04961e+00  7.78485e-01  0.00000e+00 0.00000e+00 6.95673e+01 5.524   1.67974e+01 185.524 0.9360 
1 1 1 -7  86  14 o 4  6.56292e+00 1.11649e+00 9.92728e+01 175.482 -1.64859e+01 1.30272e+00  0.00000e+00 0.00000e+00 1.35880e+02 175.482 3.66071e+01 175.482 0.9693 
1 1 1 -7  87  1  o 9  3.62501e+00 8.72936e-01 9.06158e+01 128.277 -3.01466e+00 3.82036e+00  0.00000e+00 0.00000e+00 2.97978e+01 128.277 6.08180e+01 308.277 0.8902 
1 1 1 -7  87  2  o 12 6.18047e+00 7.31833e-01 6.69097e+01 232.772 -3.85371e+00 -5.07194e+00 0.00000e+00 0.00000e+00 1.44666e+02 232.772 7.77559e+01 232.772 0.9177 
1 1 1 -7  87  3  o 6  1.12147e+01 5.52867e-01 2.26532e+02 237.227 -2.26282e+01 -3.51491e+01 0.00000e+00 0.00000e+00 1.86572e+02 237.227 3.99601e+01 57.227  0.9880 
1 1 1 -7  87  4  o 6  9.73079e+00 7.31972e-01 2.01420e+02 127.115 -1.82551e+01 2.41244e+01  0.00000e+00 0.00000e+00 1.55166e+02 127.115 4.62540e+01 307.115 0.9833 
1 1 1 -7  87  5  o 5  9.01131e+00 8.06032e-01 1.14503e+02 152.111 -1.48748e+01 7.87205e+00  0.00000e+00 0.00000e+00 2.10998e+02 152.111 9.64956e+01 152.111 0.9698 
1 1 1 -7  87  6  o 10 5.99121e+00 8.43173e-01 9.15480e+01 337.148 8.37960e+00  -3.53148e+00 0.00000e+00 0.00000e+00 1.18815e+02 337.148 2.72669e+01 337.148 0.9433 
1 1 1 -7  87  7  o 10 9.94453e+00 7.03038e-01 1.16191e+02 245.894 -8.76515e+00 -1.95895e+01 0.00000e+00 0.00000e+00 2.44993e+02 245.894 1.28802e+02 245.894 0.9764 
1 1 1 -7  87  8  o 9  4.38743e+00 9.03502e-01 1.08011e+02 17.883  7.59244e+00  2.44982e+00  0.00000e+00 0.00000e+00 4.44764e+01 17.883  6.35341e+01 197.883 0.9350 
1 1 1 -7  87  9  o 15 4.55745e+00 9.65077e-01 6.80109e+01 187.923 -5.31915e+00 -7.40239e-01 0.00000e+00 0.00000e+00 8.45490e+01 187.923 1.65381e+01 187.923 0.9013 
1 1 1 -7  87  10 f 0  5.79987e+00 9.93471e-01 1.01713e+02 99.354  -1.74198e+00 1.05747e+01  0.00000e+00 0.00000e+00 1.03207e+02 99.354  1.49346e+00 99.354  0.9521 
1 1 1 -7  87  11 o 19 3.25058e+00 9.92588e-01 5.18613e+01 201.727 -3.14025e+00 -1.25140e+00 0.00000e+00 0.00000e+00 4.87174e+01 201.727 3.14390e+00 21.728  0.8346 
1 1 1 -7  87  12 o 9  3.73701e+00 1.07517e+00 5.60593e+01 331.093 3.87522e+00  -2.13986e+00 0.00000e+00 0.00000e+00 6.54823e+01 331.093 9.42296e+00 331.093 0.8781 
1 1 1 -7  87  13 o 10 6.35790e+00 1.15522e+00 9.98417e+01 91.151  -2.79599e-01 1.39147e+01  0.00000e+00 0.00000e+00 1.26775e+02 91.151  2.69333e+01 91.151  0.9634 
1 1 1 -7  87  14 o 2  2.69832e+00 9.12319e-01 6.70840e+01 196.761 -5.28722e+00 -1.59239e+00 0.00000e+00 0.00000e+00 2.30880e+01 196.761 4.39960e+01 16.761  0.9042 
1 1 1 -7  88  1  o 19 1.10510e+01 5.71900e-01 1.52223e+02 208.193 -2.42574e+01 -1.30029e+01 0.00000e+00 0.00000e+00 2.52485e+02 208.193 1.00262e+02 208.193 0.9817 
1 1 1 -7  88  2  o 11 6.97788e+00 7.01820e-01 1.61801e+02 333.322 1.56869e+01  -7.88229e+00 0.00000e+00 0.00000e+00 9.08943e+01 333.322 7.09072e+01 153.322 0.9711 
1 1 1 -7  88  3  o 8  1.11154e+01 5.58797e-01 1.51794e+02 145.327 -2.29072e+01 1.58456e+01  0.00000e+00 0.00000e+00 2.55036e+02 145.327 1.03242e+02 145.327 0.9819 
1 1 1 -7  88  4  o 2  7.50340e+00 8.54922e-01 1.25810e+02 345.341 1.29727e+01  -3.39329e+00 0.00000e+00 0.00000e+00 1.43111e+02 345.341 1.73018e+01 345.341 0.9620 
1 1 1 -7  88  5  o 16 6.75609e+00 8.87726e-01 8.36273e+01 303.713 5.00224e+00  -7.49678e+00 0.00000e+00 0.00000e+00 1.53549e+02 303.713 6.99215e+01 303.713 0.9428 
1 1 1 -7  88  6  o 4  1.30675e+01 6.55460e-01 2.38546e+02 283.991 1.39392e+01  -5.59424e+01 0.00000e+00 0.00000e+00 2.43507e+02 283.991 4.96020e+00 283.991 0.9913 
1 1 1 -7  88  7  o 10 8.04318e+00 7.72996e-01 1.21332e+02 92.079  -6.24188e-01 1.71974e+01  0.00000e+00 0.00000e+00 1.68955e+02 92.079  4.76229e+01 92.079  0.9705 
1 1 1 -7  88  8  o 19 3.51057e+00 9.40842e-01 9.70269e+01 9.203   5.35583e+00  8.67712e-01  0.00000e+00 0.00000e+00 2.06961e+01 9.203   7.63308e+01 189.203 0.9024 
1 1 1 -7  88  9  o 3  3.51927e+00 9.39523e-01 6.20361e+01 189.984 -4.01108e+00 -7.06109e-01 0.00000e+00 0.00000e+00 5.11617e+01 189.984 1.08745e+01 9.984   0.8663 
1 1 1 -7  88  10 o 3  1.21513e+01 6.77002e-01 2.05058e+02 149.662 -5.11664e+01 2.99447e+01  0.00000e+00 0.00000e+00 2.41923e+02 149.662 3.68643e+01 149.662 0.9915 
1 1 1 -7  88  11 o 10 6.08748e+00 1.08144e+00 1.33211e+02 270.249 7.13095e-02  -1.64339e+01 0.00000e+00 0.00000e+00 8.54437e+01 270.249 4.77669e+01 90.249  0.9691 
1 1 1 -7  88  12 o 19 4.80226e+00 1.13774e+00 5.45536e+01 77.400  1.13148e+00  5.06200e+00  0.00000e+00 0.00000e+00 1.05047e+02 77.400  5.04932e+01 77.400  0.8975 
1 1 1 -7  88  13 o 18 4.14585e+00 1.17446e+00 9.49234e+01 97.456  -1.07825e+00 8.23944e+00  0.00000e+00 0.00000e+00 4.88822e+01 97.456  4.60412e+01 277.456 0.9377 
1 1 1 -7  89  1  o 2  1.05147e+01 5.81860e-01 1.68064e+02 72.640  8.64251e+00  2.76464e+01  0.00000e+00 0.00000e+00 2.17271e+02 72.640  4.92072e+01 72.640  0.9826 
1 1 1 -7  89  2  o 12 8.07381e+00 6.55300e-01 1.81298e+02 17.230  2.22449e+01  6.89854e+00  0.00000e+00 0.00000e+00 1.13182e+02 17.230  6.81165e+01 197.230 0.9783 
1 1 1 -7  89  3  o 19 6.05936e+00 7.32086e-01 8.27285e+01 329.484 6.47126e+00  -3.81428e+00 0.00000e+00 0.00000e+00 1.27466e+02 329.484 4.47377e+01 329.484 0.9308 
1 1 1 -7  89  4  o 9  4.23522e+00 8.01740e-01 6.82945e+01 48.519  2.89334e+00  3.27250e+00  0.00000e+00 0.00000e+00 6.99494e+01 48.519  1.65492e+00 48.519  0.8763 
1 1 1 -7  89  5  o 11 8.98863e+00 7.93533e-01 1.31777e+02 173.198 -1.99885e+01 2.38435e+00  0.00000e+00 0.00000e+00 1.94427e+02 173.198 6.26504e+01 173.198 0.9748 
1 1 1 -7  89  6  o 5  3.81306e+00 1.00667e+00 8.92997e+01 166.390 -5.21609e+00 1.26286e+00  0.00000e+00 0.00000e+00 3.85540e+01 166.390 5.07457e+01 346.390 0.9012 
1 1 1 -7  89  7  o 18 3.55110e+00 9.06173e-01 4.42797e+01 115.840 -1.06983e+00 2.20907e+00  0.00000e+00 0.00000e+00 5.60550e+01 115.840 1.17753e+01 115.840 0.7600 
1 1 1 -7  89  8  o 16 1.21327e+01 7.06689e-01 1.94888e+02 282.953 1.03298e+01  -4.49095e+01 0.00000e+00 0.00000e+00 2.50945e+02 282.953 5.60574e+01 282.953 0.9891 
1 1 1 -7  89  9  o 4  8.49034e+00 8.26056e-01 1.22379e+02 118.571 -1.00956e+01 1.85389e+01  0.00000e+00 0.00000e+00 1.85240e+02 118.571 6.28610e+01 118.571 0.9760 
1 1 1 -7  89  10 o 4  4.38062e+00 9.78477e-01 1.24549e+02 113.068 -4.14849e+00 9.74085e+00  0.00000e+00 0.00000e+00 3.00535e+01 113.068 9.44953e+01 293.068 0.9515 
1 1 1 -7  89  11 o 7  5.58455e+00 1.10304e+00 8.04376e+01 295.672 4.01038e+00  -8.34349e+00 0.00000e+00 0.00000e+00 1.14983e+02 295.672 3.45453e+01 295.672 0.9443 
1 1 1 -7  89  12 o 8  5.99039e+00 1.14833e+00 5.97377e+01 72.315  2.39663e+00  7.51663e+00  0.00000e+00 0.00000e+00 1.47450e+02 72.315  8.77123e+01 72.315  0.9343 
1 1 1 -7  89  13 o 8  3.03989e+00 9.17825e-01 2.58121e+01 278.074 3.09242e-01  -2.17981e+00 0.00000e+00 0.00000e+00 5.60561e+01 278.074 3.02440e+01 278.074 0.7283 
1 1 1 -7  90  1  o 9  5.65376e+00 7.52125e-01 8.20502e+01 357.368 6.89176e+00  -3.16816e-01 0.00000e+00 0.00000e+00 1.12825e+02 357.368 3.07748e+01 357.368 0.9244 
1 1 1 -7  90  2  o 8  6.83187e+00 6.88967e-01 1.60966e+02 110.210 -5.78554e+00 1.57158e+01  0.00000e+00 0.00000e+00 8.59599e+01 110.210 7.50060e+01 290.210 0.9697 
1 1 1 -7  90  3  o 7  8.47502e+00 7.01936e-01 1.69616e+02 200.526 -2.12380e+01 -7.95144e+00 0.00000e+00 0.00000e+00 1.39101e+02 200.526 3.05151e+01 20.526  0.9777 
1 1 1 -7  90  4  o 16 3.21692e+00 8.48248e-01 5.41446e+01 269.425 -2.67442e-02 -2.66414e+00 0.00000e+00 0.00000e+00 3.95045e+01 269.425 1.46401e+01 89.425  0.7817 
1 1 1 -7  90  5  o 6  9.29347e+00 7.99923e-01 1.83238e+02 177.356 -2.93190e+01 1.35386e+00  0.00000e+00 0.00000e+00 1.56705e+02 177.356 2.65332e+01 357.356 0.9828 
1 1 1 -7  90  6  o 18 1.08058e+01 7.65582e-01 1.94929e+02 156.571 -3.42328e+01 1.48347e+01  0.00000e+00 0.00000e+00 2.01572e+02 156.571 6.64275e+00 156.571 0.9865 
1 1 1 -7  90  7  o 19 6.41512e+00 8.59206e-01 1.37163e+02 301.128 8.28243e+00  -1.37148e+01 0.00000e+00 0.00000e+00 9.37224e+01 301.128 4.34401e+01 121.128 0.9683 
1 1 1 -7  90  8  o 1  7.40970e+00 8.52582e-01 1.38825e+02 356.039 1.90218e+01  -1.31720e+00 0.00000e+00 0.00000e+00 1.29074e+02 356.039 9.75130e+00 176.039 0.9734 
1 1 1 -7  90  9  o 1  8.03969e+00 8.44324e-01 1.39685e+02 119.377 -1.10396e+01 1.96104e+01  0.00000e+00 0.00000e+00 1.51984e+02 119.377 1.22999e+01 119.377 0.9775 
1 1 1 -7  90  10 o 18 4.88918e+00 1.06784e+00 6.00277e+01 24.918  5.04891e+00  2.34560e+00  0.00000e+00 0.00000e+00 1.04056e+02 24.918  4.40279e+01 24.918  0.9051 
1 1 1 -7  90  11 o 3  4.13256e+00 9.86237e-01 3.87652e+01 220.214 -2.74617e+00 -2.32181e+00 0.00000e+00 0.00000e+00 9.07509e+01 220.214 5.19857e+01 220.214 0.8460 
1 1 1 -7  90  12 o 6  5.27173e+00 1.07737e+00 8.48248e+01 112.925 -3.85145e+00 9.10672e+00  0.00000e+00 0.00000e+00 1.00136e+02 112.925 1.53116e+01 112.925 0.9480 
1 1 1 -7  90  13 o 16 4.48753e+00 1.18521e+00 9.24509e+01 18.744  9.11275e+00  3.09237e+00  0.00000e+00 0.00000e+00 6.45871e+01 18.744  2.78637e+01 198.744 0.9465 
1 1 1 -7  91  1  o 18 3.77295e+00 8.41230e-01 9.38278e+01 265.367 -4.24547e-01 -5.23911e+00 0.00000e+00 0.00000e+00 3.26170e+01 265.367 6.12107e+01 85.367  0.8990 
1 1 1 -7  91  2  o 9  3.40970e+00 8.56372e-01 5.89003e+01 351.023 3.22049e+00  -5.08739e-01 0.00000e+00 0.00000e+00 4.62472e+01 351.023 1.26530e+01 171.023 0.8275 
1 1 1 -7  91  3  f 0  6.56110e+00 7.59165e-01 1.59953e+02 262.731 -2.11831e+00 -1.66077e+01 0.00000e+00 0.00000e+00 7.70227e+01 262.731 8.29299e+01 82.731  0.9697 
1 1 1 -7  91  4  o 18 4.54399e+00 9.16905e-01 6.00109e+01 346.763 4.20974e+00  -9.90209e-01 0.00000e+00 0.00000e+00 8.80044e+01 346.763 2.79936e+01 346.763 0.8749 
1 1 1 -7  91  5  o 14 3.41700e+00 8.38710e-01 7.57077e+01 328.033 3.80101e+00  -2.37212e+00 0.00000e+00 0.00000e+00 3.61474e+01 328.033 3.95603e+01 148.033 0.8798 
1 1 1 -7  91  6  o 12 6.27651e+00 1.00436e+00 9.55415e+01 122.835 -4.81675e+00 7.46409e+00  0.00000e+00 0.00000e+00 1.24299e+02 122.835 2.87578e+01 122.835 0.9419 
1 1 1 -7  91  7  o 1  4.00966e+00 1.05238e+00 1.28642e+02 54.248  4.73747e+00  6.58037e+00  0.00000e+00 0.00000e+00 1.08442e+01 54.248  1.17798e+02 234.248 0.9361 
1 1 1 -7  91  8  o 12 8.11028e+00 8.45555e-01 1.38782e+02 276.379 2.47503e+00  -2.21397e+01 0.00000e+00 0.00000e+00 1.55541e+02 276.379 1.67590e+01 276.379 0.9773 
1 1 1 -7  91  9  f 0  4.55474e+00 1.07709e+00 6.22024e+01 57.427  2.77280e+00  4.34023e+00  0.00000e+00 0.00000e+00 8.93470e+01 57.427  2.71447e+01 57.427  0.8968 
1 1 1 -7  91  10 o 14 6.37207e+00 9.52075e-01 1.21502e+02 35.791  1.37854e+01  9.93922e+00  0.00000e+00 0.00000e+00 1.07662e+02 35.791  1.38397e+01 215.791 0.9701 
1 1 1 -7  91  11 o 16 3.36652e+00 9.19150e-01 2.84998e+01 94.263  -1.71528e-01 2.30134e+00  0.00000e+00 0.00000e+00 6.40630e+01 94.263  3.55632e+01 94.263  0.7424 
1 1 1 -7  91  12 o 15 3.44677e+00 1.03542e+00 3.03248e+01 294.246 1.07755e+00  -2.39255e+00 0.00000e+00 0.00000e+00 6.88760e+01 294.246 3.85512e+01 294.246 0.7778 
1 1 1 -7  91  13 o 2  2.96256e+00 9.72489e-01 7.58145e+01 57.916  3.52237e+00  5.61872e+00  0.00000e+00 0.00000e+00 2.50567e+01 57.916  5.07578e+01 237.916 0.9212 
1 1 1 -7  92  1  o 13 4.38383e+00 8.27392e-01 9.21386e+01 248.750 -2.26395e+00 -5.82178e+00 0.00000e+00 0.00000e+00 5.75231e+01 248.750 3.46156e+01 68.750  0.9160 
1 1 1 -7  92  2  o 16 2.19460e+00 7.05237e-01 4.14026e+01 118.680 -7.74380e-01 1.41558e+00  0.00000e+00 0.00000e+00 9.53189e+00 118.680 3.18708e+01 298.680 0.6230 
1 1 1 -7  92  3  o 12 3.49500e+00 7.97483e-01 1.28883e+02 355.393 7.58146e+00  -6.10914e-01 0.00000e+00 0.00000e+00 7.61822e+00 175.393 1.36502e+02 175.393 0.9317 
1 1 1 -7  92  4  o 5  5.42371e+00 7.98900e-01 6.20469e+01 12.103  5.83303e+00  1.25077e+00  0.00000e+00 0.00000e+00 1.22025e+02 12.103  5.99785e+01 12.103  0.9118 
1 1 1 -7  92  5  o 18 5.78246e+00 7.92437e-01 6.34753e+01 323.459 5.27133e+00  -3.90641e+00 0.00000e+00 0.00000e+00 1.34482e+02 323.459 7.10069e+01 323.459 0.9203 
1 1 1 -7  92  6  o 8  5.28764e+00 1.08180e+00 1.12218e+02 133.844 -6.22201e+00 6.47836e+00  0.00000e+00 0.00000e+00 7.30711e+01 133.844 3.91465e+01 313.844 0.9426 
1 1 1 -7  92  7  o 4  6.14714e+00 1.05441e+00 1.40176e+02 132.745 -9.45134e+00 1.02260e+01  0.00000e+00 0.00000e+00 7.98401e+01 132.745 6.03360e+01 312.745 0.9634 
1 1 1 -7  92  8  o 9  1.11623e+01 7.52622e-01 1.99699e+02 340.731 4.46670e+01  -1.56145e+01 0.00000e+00 0.00000e+00 2.10287e+02 340.731 1.05881e+01 340.731 0.9894 
1 1 1 -7  92  9  o 1  6.46892e+00 1.02148e+00 6.18785e+01 138.742 -5.66820e+00 4.97223e+00  0.00000e+00 0.00000e+00 1.61550e+02 138.742 9.96718e+01 138.742 0.9311 
1 1 1 -7  92  10 o 8  2.35651e+00 7.66762e-01 9.53033e+01 302.789 3.28734e+00  -5.10317e+00 0.00000e+00 0.00000e+00 1.55258e+01 122.789 1.10829e+02 122.789 0.9134 
1 1 1 -7  92  11 o 5  8.67069e+00 9.47160e-01 1.03588e+02 145.410 -1.71270e+01 1.18108e+01  0.00000e+00 0.00000e+00 2.09658e+02 145.410 1.06070e+02 145.410 0.9757 
1 1 1 -7  92  12 o 2  2.71136e+00 8.92146e-01 4.79223e+01 169.192 -3.49342e+00 6.66879e-01  0.00000e+00 0.00000e+00 3.67292e+01 169.192 1.11931e+01 349.192 0.8440 
1 1 1 -7  92  13 o 17 4.28334e+00 1.13494e+00 8.20239e+01 268.214 -2.78213e-01 -8.92108e+00 0.00000e+00 0.00000e+00 6.71084e+01 268.214 1.49155e+01 88.214  0.9422 
1 1 1 -7  93  1  o 7  6.07643e+00 7.25253e-01 9.96919e+01 12.798  1.03377e+01  2.34829e+00  0.00000e+00 0.00000e+00 1.15755e+02 12.798  1.60632e+01 12.798  0.9516 
1 1 1 -7  93  2  o 14 2.82334e+00 7.99824e-01 2.21742e+01 334.366 9.73784e-01  -4.67271e-01 0.00000e+00 0.00000e+00 2.76757e+01 334.366 5.50144e+00 334.366 0.4741 
1 1 1 -7  93  3  f 0  4.07889e+00 7.82136e-01 3.01472e+01 160.659 -1.90332e+00 6.68070e-01  0.00000e+00 0.00000e+00 7.62385e+01 160.659 4.60913e+01 160.659 0.7006 
1 1 1 -7  93  4  o 14 2.76088e+00 7.99697e-01 5.98921e+01 298.432 1.37143e+00  -2.53306e+00 0.00000e+00 0.00000e+00 2.23729e+01 298.432 3.75192e+01 118.432 0.8007 
1 1 1 -7  93  5  o 17 5.69523e+00 8.49111e-01 7.62082e+01 334.882 6.92476e+00  -3.24648e+00 0.00000e+00 0.00000e+00 1.21223e+02 334.882 4.50145e+01 334.882 0.9321 
1 1 1 -7  93  6  o 13 8.23629e+00 7.74031e-01 1.40428e+02 162.769 -2.04031e+01 6.32795e+00  0.00000e+00 0.00000e+00 1.58440e+02 162.769 1.80117e+01 162.769 0.9763 
1 1 1 -7  93  7  o 5  5.20309e+00 1.09874e+00 6.83110e+01 14.074  5.55602e+00  1.39292e+00  0.00000e+00 0.00000e+00 1.07147e+02 14.074  3.88357e+01 14.074  0.9079 
1 1 1 -7  93  8  o 9  3.05890e+00 9.17663e-01 5.19953e+01 286.511 8.63428e-01  -2.91281e+00 0.00000e+00 0.00000e+00 4.02774e+01 286.511 1.17179e+01 106.511 0.8128 
1 1 1 -7  93  9  o 5  9.59324e+00 8.47048e-01 1.67136e+02 279.613 5.62073e+00  -3.31849e+01 0.00000e+00 0.00000e+00 1.83303e+02 279.613 1.61668e+01 279.613 0.9850 
1 1 1 -7  93  10 o 9  2.69824e+00 8.85654e-01 4.50868e+01 248.593 -1.00154e+00 -2.55468e+00 0.00000e+00 0.00000e+00 3.38078e+01 248.593 1.12790e+01 68.593  0.7891 
1 1 1 -7  93  11 f 0  3.86594e+00 1.07197e+00 6.66560e+01 209.231 -5.20246e+00 -2.91122e+00 0.00000e+00 0.00000e+00 6.38276e+01 209.231 2.82835e+00 29.231  0.9118 
1 1 1 -7  93  12 o 17 3.18915e+00 9.89161e-01 6.58196e+01 324.607 4.48756e+00  -3.18836e+00 0.00000e+00 0.00000e+00 4.07893e+01 324.607 2.50303e+01 144.607 0.9039 
1 1 1 -7  93  13 o 18 3.10289e+00 9.83163e-01 4.90602e+01 301.203 2.48480e+00  -4.10235e+00 0.00000e+00 0.00000e+00 5.27824e+01 301.203 3.72222e+00 301.203 0.8884 
1 1 1 -7  94  1  o 12 1.09497e+01 5.96695e-01 2.17169e+02 180.632 -4.23335e+01 -4.67331e-01 0.00000e+00 0.00000e+00 1.85862e+02 180.632 3.13070e+01 0.632   0.9881 
1 1 1 -7  94  2  o 6  2.78891e+00 8.11220e-01 3.43006e+01 242.871 -7.67401e-01 -1.49777e+00 0.00000e+00 0.00000e+00 3.19760e+01 242.871 2.32461e+00 62.871  0.6382 
1 1 1 -7  94  3  o 7  8.00292e+00 8.28270e-01 1.87228e+02 285.177 6.73358e+00  -2.48228e+01 0.00000e+00 0.00000e+00 1.04792e+02 285.177 8.24356e+01 105.177 0.9804 
1 1 1 -7  94  4  o 14 8.16417e+00 6.67478e-01 1.00221e+02 349.715 1.41284e+01  -2.56362e+00 0.00000e+00 0.00000e+00 1.92724e+02 349.715 9.25027e+01 349.715 0.9645 
1 1 1 -7  94  5  o 16 5.48456e+00 8.38621e-01 6.00588e+01 121.399 -3.16012e+00 5.17729e+00  0.00000e+00 0.00000e+00 1.26195e+02 121.399 6.61363e+01 121.399 0.9134 
1 1 1 -7  94  6  o 10 9.28283e+00 6.50178e-01 1.56575e+02 288.004 9.15702e+00  -2.81748e+01 0.00000e+00 0.00000e+00 1.82483e+02 288.004 2.59082e+01 288.004 0.9830 
1 1 1 -7  94  7  o 19 7.62954e+00 9.96281e-01 1.81238e+02 99.805  -4.19478e+00 2.42720e+01  0.00000e+00 0.00000e+00 9.62548e+01 99.805  8.49833e+01 279.805 0.9795 
1 1 1 -7  94  8  f 0  7.77741e+00 1.02448e+00 1.25969e+02 279.431 3.00636e+00  -1.81001e+01 0.00000e+00 0.00000e+00 1.54635e+02 279.431 2.86665e+01 279.431 0.9724 
1 1 1 -7  94  9  o 17 3.58484e+00 1.00751e+00 6.89474e+01 164.552 -5.00989e+00 1.38445e+00  0.00000e+00 0.00000e+00 5.03750e+01 164.552 1.85724e+01 344.552 0.8978 
1 1 1 -7  94  10 o 10 7.19513e+00 1.02720e+00 6.70097e+01 75.024  2.67606e+00  1.00040e+01  0.00000e+00 0.00000e+00 1.86307e+02 75.024  1.19298e+02 75.024  0.9504 
1 1 1 -7  94  11 o 16 2.62403e+00 8.42906e-01 4.75296e+01 79.416  6.35654e-01  3.40201e+00  0.00000e+00 0.00000e+00 3.39519e+01 79.416  1.35776e+01 259.417 0.8390 
1 1 1 -7  94  12 o 4  6.49719e+00 1.19746e+00 9.00998e+01 75.189  3.42946e+00  1.29698e+01  0.00000e+00 0.00000e+00 1.40985e+02 75.189  5.08854e+01 75.189  0.9620 
1 1 1 -7  95  1  o 15 6.89464e+00 8.83988e-01 9.92896e+01 337.041 1.05036e+01  -4.44970e+00 0.00000e+00 0.00000e+00 1.45944e+02 337.041 4.66541e+01 337.041 0.9551 
1 1 1 -7  95  2  o 17 6.95993e+00 7.41990e-01 1.46491e+02 122.287 -9.75868e+00 1.54442e+01  0.00000e+00 0.00000e+00 1.05409e+02 122.287 4.10812e+01 302.287 0.9722 
1 1 1 -7  95  3  o 4  5.43680e+00 8.18150e-01 8.49419e+01 233.916 -4.44913e+00 -6.10493e+00 0.00000e+00 0.00000e+00 1.03454e+02 233.916 1.85116e+01 233.916 0.9312 
1 1 1 -7  95  4  o 9  1.12293e+01 5.92008e-01 1.96955e+02 45.893  3.03075e+01  3.12676e+01  0.00000e+00 0.00000e+00 2.15859e+02 45.893  1.89046e+01 45.893  0.9885 
1 1 1 -7  95  5  o 11 3.49905e+00 9.14506e-01 5.54876e+01 234.011 -1.94580e+00 -2.67925e+00 0.00000e+00 0.00000e+00 5.25438e+01 234.011 2.94379e+00 54.011  0.8306 
1 1 1 -7  95  6  o 11 3.63046e+00 9.14257e-01 4.88932e+01 42.230  2.38349e+00  2.16349e+00  0.00000e+00 0.00000e+00 6.23643e+01 42.230  1.34711e+01 42.230  0.8250 
1 1 1 -7  95  7  o 6  3.05372e+00 9.42192e-01 6.53985e+01 316.810 2.87502e+00  -2.69887e+00 0.00000e+00 0.00000e+00 3.22420e+01 316.810 3.31564e+01 136.810 0.8613 
1 1 1 -7  95  8  o 6  4.96150e+00 1.15731e+00 4.72094e+01 159.299 -3.67782e+00 1.38978e+00  0.00000e+00 0.00000e+00 1.11228e+02 159.299 6.40184e+01 159.299 0.8608 
1 1 1 -7  95  9  o 14 3.53808e+00 9.90015e-01 6.25710e+01 151.012 -4.37579e+00 2.42435e+00  0.00000e+00 0.00000e+00 5.45965e+01 151.012 7.97452e+00 331.012 0.8934 
1 1 1 -7  95  10 o 5  6.79618e+00 1.13647e+00 1.15203e+02 315.399 1.10604e+01  -1.09073e+01 0.00000e+00 0.00000e+00 1.28245e+02 315.399 1.30419e+01 315.399 0.9673 
1 1 1 -7  95  11 o 14 6.45812e+00 1.09301e+00 1.22612e+02 227.201 -1.25060e+01 -1.35059e+01 0.00000e+00 0.00000e+00 1.09752e+02 227.201 1.28596e+01 47.201  0.9724 
1 1 1 -7  95  12 o 10 3.48929e+00 1.05023e+00 3.07298e+01 120.976 -1.50105e+00 2.50055e+00  0.00000e+00 0.00000e+00 7.29170e+01 120.976 4.21872e+01 120.976 0.8036 
1 1 1 -7  96  1  o 7  1.51519e+01 5.73113e-01 2.71246e+02 140.396 -5.78198e+01 4.78403e+01  0.00000e+00 0.00000e+00 2.89098e+02 140.396 1.78512e+01 140.396 0.9933 
1 1 1 -7  96  2  o 1  7.59040e+00 7.09057e-01 1.05064e+02 258.515 -3.01537e+00 -1.48413e+01 0.00000e+00 0.00000e+00 1.67934e+02 258.515 6.28705e+01 258.515 0.9664 
1 1 1 -7  96  3  f 0  8.96904e+00 6.67238e-01 1.87317e+02 85.996  2.23284e+00  3.18972e+01  0.00000e+00 0.00000e+00 1.41077e+02 85.996  4.62408e+01 265.996 0.9842 
1 1 1 -7  96  4  o 10 9.56049e+00 6.44288e-01 1.43046e+02 205.956 -2.27111e+01 -1.10556e+01 0.00000e+00 0.00000e+00 2.05324e+02 205.956 6.22775e+01 205.956 0.9800 
1 1 1 -7  96  5  o 16 1.12578e+01 6.91257e-01 1.84369e+02 298.051 1.94521e+01  -3.65049e+01 0.00000e+00 0.00000e+00 2.28899e+02 298.051 4.45300e+01 298.051 0.9878 
1 1 1 -7  96  6  o 9  1.03735e+01 6.46796e-01 1.66054e+02 186.099 -3.76700e+01 -4.02479e+00 0.00000e+00 0.00000e+00 2.14083e+02 186.099 4.80285e+01 186.099 0.9867 
1 1 1 -7  96  7  o 8  2.68111e+00 8.25899e-01 4.51835e+01 196.969 -2.51254e+00 -7.66684e-01 0.00000e+00 0.00000e+00 3.22435e+01 196.969 1.29400e+01 16.969  0.7781 
1 1 1 -7  96  8  o 14 4.60035e+00 1.12743e+00 1.14782e+02 233.538 -5.68700e+00 -7.69614e+00 0.00000e+00 0.00000e+00 4.66493e+01 233.538 6.81322e+01 53.538  0.9462 
1 1 1 -7  96  9  o 10 3.12922e+00 9.61287e-01 3.71542e+01 26.075  2.22589e+00  1.08926e+00  0.00000e+00 0.00000e+00 5.12738e+01 26.075  1.41196e+01 26.075  0.7626 
1 1 1 -7  96  10 o 15 5.40578e+00 1.18605e+00 1.26377e+02 298.190 6.87154e+00  -1.28209e+01 0.00000e+00 0.00000e+00 6.67603e+01 298.190 5.96167e+01 118.190 0.9650 
1 1 1 -7  96  11 o 11 3.81065e+00 1.09133e+00 8.24684e+01 114.369 -2.95477e+00 6.52320e+00  0.00000e+00 0.00000e+00 4.82384e+01 114.369 3.42300e+01 294.369 0.9273 
1 1 1 -7  96  12 o 18 3.92329e+00 1.05355e+00 5.80999e+01 326.603 5.27635e+00  -3.47870e+00 0.00000e+00 0.00000e+00 7.48547e+01 326.603 1.67547e+01 326.603 0.9171 
1 1 1 -7  97  1  o 11 2.93090e+00 8.25456e-01 2.92015e+01 207.448 -1.33440e+00 -6.93096e-01 0.00000e+00 0.00000e+00 3.59297e+01 207.448 6.72818e+00 207.448 0.5970 
1 1 1 -7  97  2  o 6  2.59541e+00 7.76017e-01 6.24492e+01 317.298 2.27294e+00  -2.09754e+00 0.00000e+00 0.00000e+00 1.64099e+01 317.298 4.60393e+01 137.298 0.8166 
1 1 1 -7  97  3  o 11 9.09471e+00 6.59417e-01 1.46059e+02 197.487 -2.32459e+01 -7.32362e+00 0.00000e+00 0.00000e+00 1.85166e+02 197.487 3.91069e+01 197.487 0.9793 
1 1 1 -7  97  4  o 1  1.14479e+01 6.11318e-01 1.95363e+02 303.469 2.56229e+01  -3.87572e+01 0.00000e+00 0.00000e+00 2.25576e+02 303.469 3.02135e+01 303.469 0.9892 
1 1 1 -7  97  5  o 16 1.73126e+01 6.57384e-01 3.10171e+02 43.015  8.67930e+01  8.09775e+01  0.00000e+00 0.00000e+00 3.30306e+02 43.015  2.01355e+01 43.015  0.9958 
1 1 1 -7  97  6  o 7  7.26549e+00 7.78170e-01 1.43629e+02 216.127 -1.76092e+01 -1.28535e+01 0.00000e+00 0.00000e+00 1.19868e+02 216.127 2.37615e+01 36.127  0.9768 
1 1 1 -7  97  7  o 7  8.04397e+00 7.53065e-01 1.38522e+02 288.167 7.85350e+00  -2.39329e+01 0.00000e+00 0.00000e+00 1.53951e+02 288.167 1.54287e+01 288.167 0.9799 
1 1 1 -7  97  8  o 3  3.67588e+00 1.05171e+00 5.75045e+01 133.440 -2.94818e+00 3.11330e+00  0.00000e+00 0.00000e+00 6.15747e+01 133.440 4.07022e+00 133.440 0.8737 
1 1 1 -7  97  9  o 2  3.60738e+00 1.07472e+00 8.42312e+01 292.395 2.39139e+00  -5.80347e+00 0.00000e+00 0.00000e+00 3.82441e+01 292.395 4.59871e+01 112.395 0.9165 
1 1 1 -7  97  10 o 16 4.27987e+00 1.09250e+00 4.95015e+01 324.004 3.74151e+00  -2.71792e+00 0.00000e+00 0.00000e+00 9.05195e+01 324.004 4.10180e+01 324.004 0.8839 
1 1 1 -7  97  11 o 7  4.29094e+00 1.07776e+00 6.15903e+01 211.309 -5.49018e+00 -3.33928e+00 0.00000e+00 0.00000e+00 8.41580e+01 211.309 2.25677e+01 211.309 0.9185 
1 1 1 -7  97  12 o 9  4.26393e+00 1.16169e+00 6.08570e+01 112.980 -2.61027e+00 6.15533e+00  0.00000e+00 0.00000e+00 8.43576e+01 112.980 2.35006e+01 112.980 0.9218 
1 1 1 -7  98  1  o 4  2.70006e+00 8.21215e-01 3.06107e+01 17.037  1.42375e+00  4.36283e-01  0.00000e+00 0.00000e+00 2.90118e+01 17.037  1.59884e+00 197.037 0.5934 
1 1 1 -7  98  2  o 1  3.21130e+00 8.54586e-01 7.12823e+01 123.283 -2.21746e+00 3.37788e+00  0.00000e+00 0.00000e+00 3.20507e+01 123.283 3.92316e+01 303.283 0.8651 
1 1 1 -7  98  3  f 0  7.75019e+00 7.70085e-01 2.35668e+02 52.929  2.10875e+01  2.79117e+01  0.00000e+00 0.00000e+00 4.83407e+01 52.929  1.87328e+02 232.929 0.9856 
1 1 1 -7  98  4  o 9  2.88122e+00 8.56318e-01 2.17010e+01 87.200  5.73810e-02  1.17310e+00  0.00000e+00 0.00000e+00 3.23509e+01 87.200  1.06499e+01 87.200  0.5048 
1 1 1 -7  98  5  o 8  5.01843e+00 9.46656e-01 5.81473e+01 47.908  3.67583e+00  4.06932e+00  0.00000e+00 0.00000e+00 1.10260e+02 47.908  5.21131e+01 47.908  0.9035 
1 1 1 -7  98  6  o 3  4.84856e+00 9.48670e-01 7.99336e+01 200.255 -7.24834e+00 -2.67483e+00 0.00000e+00 0.00000e+00 8.79518e+01 200.255 8.01819e+00 200.255 0.9328 
1 1 1 -7  98  7  o 10 8.38064e+00 7.80750e-01 1.35240e+02 141.141 -1.93405e+01 1.55830e+01  0.00000e+00 0.00000e+00 1.69304e+02 141.141 3.40640e+01 141.141 0.9797 
1 1 1 -7  98  8  o 17 4.57572e+00 1.09051e+00 9.51566e+01 244.183 -3.95163e+00 -8.16823e+00 0.00000e+00 0.00000e+00 6.48092e+01 244.183 3.03474e+01 64.183  0.9432 
1 1 1 -7  98  9  o 2  4.02851e+00 9.98178e-01 1.16418e+02 272.666 4.85450e-01  -1.04243e+01 0.00000e+00 0.00000e+00 2.54436e+01 272.666 9.09748e+01 92.666  0.9508 
1 1 1 -7  98  10 o 8  3.37436e+00 1.03626e+00 4.94739e+01 163.771 -4.02154e+00 1.17054e+00  0.00000e+00 0.00000e+00 5.92092e+01 163.771 9.73534e+00 163.771 0.8704 
1 1 1 -7  98  11 o 15 3.46120e+00 1.06718e+00 7.61401e+01 254.669 -1.75618e+00 -6.40608e+00 0.00000e+00 0.00000e+00 4.17520e+01 254.669 3.43881e+01 74.669  0.9213 
1 1 1 -7  99  1  o 19 1.01482e+01 6.38030e-01 1.65943e+02 97.765  -4.66806e+00 3.42315e+01  0.00000e+00 0.00000e+00 2.06075e+02 97.765  4.01326e+01 97.765  0.9854 
1 1 1 -7  99  2  o 3  1.45710e+01 6.01653e-01 2.34067e+02 165.400 -7.00658e+01 1.82505e+01  0.00000e+00 0.00000e+00 3.04028e+02 165.400 6.99609e+01 165.400 0.9931 
1 1 1 -7  99  3  o 16 5.46837e+00 8.47982e-01 9.41947e+01 77.485  2.10702e+00  9.49263e+00  0.00000e+00 0.00000e+00 9.83148e+01 77.485  4.12005e+00 77.485  0.9471 
1 1 1 -7  99  4  o 5  1.17810e+01 6.10061e-01 1.75853e+02 303.464 2.56047e+01  -3.87378e+01 0.00000e+00 0.00000e+00 2.57100e+02 303.464 8.12472e+01 303.464 0.9892 
1 1 1 -7  99  5  o 6  7.70592e+00 7.88961e-01 7.60103e+01 114.351 -5.00312e+00 1.10543e+01  0.00000e+00 0.00000e+00 1.98066e+02 114.351 1.22056e+02 114.351 0.9579 
1 1 1 -7  99  6  o 3  6.12551e+00 8.64147e-01 6.34110e+01 90.652  -9.29469e-02 8.16306e+00  0.00000e+00 0.00000e+00 1.49484e+02 90.652  8.60729e+01 90.652  0.9366 
1 1 1 -7  99  7  o 10 8.05773e+00 7.55359e-01 1.53839e+02 213.057 -2.64233e+01 -1.71970e+01 0.00000e+00 0.00000e+00 1.40192e+02 213.057 1.36472e+01 33.057  0.9840 
1 1 1 -7  99  8  o 14 5.87115e+00 9.82697e-01 7.14695e+01 5.930   9.39943e+00  9.76366e-01  0.00000e+00 0.00000e+00 1.34237e+02 5.930   6.27678e+01 5.930   0.9455 
1 1 1 -7  99  9  o 13 3.27393e+00 1.01493e+00 4.56765e+01 320.801 2.89718e+00  -2.36277e+00 0.00000e+00 0.00000e+00 5.76837e+01 320.801 1.20072e+01 320.801 0.8527 
1 1 1 -7  99  10 o 9  2.60431e+00 8.73432e-01 2.85142e+01 225.253 -1.45520e+00 -1.46810e+00 0.00000e+00 0.00000e+00 3.97454e+01 225.253 1.12312e+01 225.253 0.7085 
1 1 1 -7  99  11 o 10 3.87498e+00 1.14092e+00 3.11598e+01 1.341   2.77155e+00  6.48770e-02  0.00000e+00 0.00000e+00 8.22182e+01 1.341   5.10585e+01 1.341   0.7916 
1 1 1 -7  100 1  o 18 8.40828e+00 7.33619e-01 1.44697e+02 29.011  2.14498e+01  1.18950e+01  0.00000e+00 0.00000e+00 1.61570e+02 29.011  1.68738e+01 29.011  0.9794 
1 1 1 -7  100 2  o 6  5.95967e+00 8.47267e-01 9.64563e+01 161.375 -1.07763e+01 3.63189e+00  0.00000e+00 0.00000e+00 1.15127e+02 161.375 1.86709e+01 161.375 0.9550 
1 1 1 -7  100 3  o 8  3.52596e+00 9.04181e-01 6.52555e+01 348.700 4.26572e+00  -8.52346e-01 0.00000e+00 0.00000e+00 4.94915e+01 348.700 1.57640e+01 168.700 0.8758 
1 1 1 -7  100 4  o 17 3.55388e+00 8.37899e-01 3.63782e+01 270.495 2.24772e-02  -2.60265e+00 0.00000e+00 0.00000e+00 6.60168e+01 270.495 2.96386e+01 270.495 0.7757 
1 1 1 -7  100 5  f 0  3.39931e+00 8.52322e-01 2.38692e+01 66.105  6.93209e-01  1.56466e+00  0.00000e+00 0.00000e+00 5.74216e+01 66.105  3.35524e+01 66.105  0.6442 
1 1 1 -7  100 6  o 5  2.27924e+00 7.53585e-01 8.23831e+01 137.117 -3.06590e+00 2.84732e+00  0.00000e+00 0.00000e+00 8.79818e+00 317.117 9.11813e+01 317.117 0.8702 
1 1 1 -7  100 7  o 15 6.51310e+00 9.00848e-01 9.42323e+01 331.640 1.31261e+01  -7.08528e+00 0.00000e+00 0.00000e+00 1.38990e+02 331.640 4.47580e+01 331.640 0.9659 
1 1 1 -7  100 8  o 3  2.82789e+00 8.70627e-01 5.03729e+01 71.435  1.13475e+00  3.37868e+00  0.00000e+00 0.00000e+00 3.80865e+01 71.435  1.22864e+01 251.435 0.8444 
1 1 1 -7  100 9  o 16 4.18152e+00 1.08981e+00 1.08517e+02 217.237 -7.90185e+00 -6.00589e+00 0.00000e+00 0.00000e+00 3.82499e+01 217.237 7.02668e+01 37.237  0.9482 
1 1 1 -7  100 10 o 5  5.54492e+00 1.20660e+00 1.14162e+02 162.123 -1.28261e+01 4.13698e+00  0.00000e+00 0.00000e+00 8.31517e+01 162.123 3.10101e+01 342.123 0.9622 
1 1 1 -7  100 11 o 9  4.11709e+00 1.18149e+00 5.76301e+01 8.219   5.74887e+00  8.30408e-01  0.00000e+00 0.00000e+00 8.06958e+01 8.219   2.30657e+01 8.219   0.9093 
1 1 1 -7  101 1  o 1  6.20796e+00 8.19355e-01 1.20551e+02 332.767 1.35901e+01  -6.99413e+00 0.00000e+00 0.00000e+00 1.02580e+02 332.767 1.79715e+01 152.767 0.9667 
1 1 1 -7  101 2  o 19 7.77852e+00 7.48617e-01 9.31621e+01 262.249 -2.07982e+00 -1.52812e+01 0.00000e+00 0.00000e+00 1.86402e+02 262.249 9.32403e+01 262.249 0.9670 
1 1 1 -7  101 3  o 6  1.96786e+00 6.69564e-01 3.65688e+01 107.885 -4.91482e-01 1.52305e+00  0.00000e+00 0.00000e+00 8.75639e+00 107.885 2.78124e+01 287.885 0.6200 
1 1 1 -7  101 4  o 13 6.98368e+00 7.39264e-01 1.31763e+02 216.893 -1.68716e+01 -1.26644e+01 0.00000e+00 0.00000e+00 1.21332e+02 216.893 1.04302e+01 36.893  0.9760 
1 1 1 -7  101 5  o 6  5.33827e+00 9.38091e-01 1.53491e+02 64.738  6.84463e+00  1.45051e+01  0.00000e+00 0.00000e+00 3.83403e+01 64.738  1.15151e+02 244.738 0.9683 
1 1 1 -7  101 6  o 10 4.81878e+00 9.84153e-01 5.85910e+01 325.329 4.97079e+00  -3.43819e+00 0.00000e+00 0.00000e+00 1.04587e+02 325.329 4.59964e+01 325.329 0.9130 
1 1 1 -7  101 7  o 19 1.12730e+01 6.93535e-01 1.36917e+02 147.083 -3.34473e+01 2.16524e+01  0.00000e+00 0.00000e+00 2.75621e+02 147.083 1.38704e+02 147.083 0.9874 
1 1 1 -7  101 8  o 1  2.78708e+00 8.74113e-01 6.21453e+01 233.122 -2.63228e+00 -3.50866e+00 0.00000e+00 0.00000e+00 2.83687e+01 233.122 3.37766e+01 53.122  0.8769 
1 1 1 -7  101 9  o 15 3.42704e+00 9.67513e-01 7.66305e+01 166.700 -6.68829e+00 1.58100e+00  0.00000e+00 0.00000e+00 4.05626e+01 166.700 3.60679e+01 346.700 0.9241 
1 1 1 -7  101 10 o 18 3.31119e+00 1.00125e+00 3.80779e+01 149.323 -3.03927e+00 1.80293e+00  0.00000e+00 0.00000e+00 6.51109e+01 149.323 2.70331e+01 149.323 0.8428 
1 1 1 -7  102 1  o 4  6.26089e+00 8.50651e-01 1.22642e+02 30.388  1.32259e+01  7.75575e+00  0.00000e+00 0.00000e+00 1.02354e+02 30.388  2.02877e+01 210.388 0.9668 
1 1 1 -7  102 2  o 17 8.52464e+00 7.05392e-01 1.08746e+02 168.755 -1.96390e+01 3.90454e+00  0.00000e+00 0.00000e+00 1.99983e+02 168.755 9.12374e+01 168.755 0.9747 
1 1 1 -7  102 3  o 4  3.10311e+00 8.85470e-01 3.27885e+01 131.157 -1.39395e+00 1.59469e+00  0.00000e+00 0.00000e+00 4.97578e+01 131.157 1.69693e+01 131.157 0.7162 
1 1 1 -7  102 4  o 9  2.81727e+00 7.78760e-01 3.45032e+01 210.289 -1.86492e+00 -1.08928e+00 0.00000e+00 0.00000e+00 4.10400e+01 210.289 6.53682e+00 210.289 0.7223 
1 1 1 -7  102 5  o 15 4.61919e+00 9.46754e-01 1.23646e+02 61.233  5.69418e+00  1.03717e+01  0.00000e+00 0.00000e+00 4.03203e+01 61.233  8.33254e+01 241.233 0.9568 
1 1 1 -7  102 6  o 6  3.31737e+00 9.27009e-01 2.45307e+01 267.564 -8.22634e-02 -1.93346e+00 0.00000e+00 0.00000e+00 5.99519e+01 267.564 3.54212e+01 267.564 0.6868 
1 1 1 -7  102 7  o 7  2.77256e+00 8.41888e-01 3.73382e+01 143.308 -2.12790e+00 1.58564e+00  0.00000e+00 0.00000e+00 4.28675e+01 143.308 5.52925e+00 143.308 0.7807 
1 1 1 -7  102 8  o 13 2.94109e+00 8.95332e-01 6.10624e+01 355.414 4.86192e+00  -3.89962e-01 0.00000e+00 0.00000e+00 3.59046e+01 355.414 2.51578e+01 175.414 0.8905 
1 1 1 -7  102 9  o 7  3.87385e+00 1.00278e+00 9.02567e+01 224.918 -6.12270e+00 -6.10512e+00 0.00000e+00 0.00000e+00 4.44975e+01 224.918 4.57592e+01 44.918  0.9403 
1 1 1 -7  102 10 o 8  3.12254e+00 9.91484e-01 4.16992e+01 43.283  2.51835e+00  2.37176e+00  0.00000e+00 0.00000e+00 5.51337e+01 43.283  1.34345e+01 43.283  0.8390 
1 1 1 -7  103 1  o 3  7.81019e+00 7.82054e-01 1.27310e+02 253.507 -6.29567e+00 -2.12637e+01 0.00000e+00 0.00000e+00 1.56293e+02 253.507 2.89833e+01 253.507 0.9772 
1 1 1 -7  103 2  o 6  4.77923e+00 9.05679e-01 8.14516e+01 344.111 7.61308e+00  -2.16701e+00 0.00000e+00 0.00000e+00 8.44511e+01 344.111 2.99957e+00 344.111 0.9345 
1 1 1 -7  103 3  o 15 7.98266e+00 7.03651e-01 1.44142e+02 77.737  5.56913e+00  2.56219e+01  0.00000e+00 0.00000e+00 1.46543e+02 77.737  2.40141e+00 77.737  0.9807 
1 1 1 -7  103 4  o 6  3.59673e+00 9.28057e-01 4.17618e+01 71.304  1.01232e+00  2.99144e+00  0.00000e+00 0.00000e+00 6.78277e+01 71.304  2.60658e+01 71.304  0.8210 
1 1 1 -7  103 5  o 11 6.82040e+00 8.42018e-01 1.31994e+02 32.114  1.86880e+01  1.17294e+01  0.00000e+00 0.00000e+00 1.15177e+02 32.114  1.68168e+01 212.114 0.9771 
1 1 1 -7  103 6  o 11 3.49612e+00 9.39393e-01 6.42996e+01 304.699 2.98712e+00  -4.31403e+00 0.00000e+00 0.00000e+00 5.21808e+01 304.699 1.21188e+01 124.699 0.8988 
1 1 1 -7  103 7  o 8  3.32021e+00 9.37062e-01 7.85881e+01 161.577 -5.78408e+00 1.92665e+00  0.00000e+00 0.00000e+00 3.38028e+01 161.577 4.47853e+01 341.577 0.9138 
1 1 1 -7  103 8  o 4  2.38623e+00 7.85143e-01 1.09252e+01 99.176  -1.21089e-01 7.49599e-01  0.00000e+00 0.00000e+00 2.04031e+01 99.176  9.47791e+00 99.176  0.3547 
1 1 1 -7  103 9  o 5  6.60391e+00 9.95763e-01 1.12733e+02 100.359 -3.48525e+00 1.90666e+01  0.00000e+00 0.00000e+00 1.25128e+02 100.359 1.23947e+01 100.359 0.9739 
1 1 1 -7  103 10 o 7  4.61378e+00 1.12003e+00 6.23523e+01 250.765 -2.44475e+00 -7.00657e+00 0.00000e+00 0.00000e+00 9.61999e+01 250.765 3.38477e+01 250.765 0.9300 
1 1 1 -7  104 1  o 6  8.63597e+00 7.23697e-01 1.46746e+02 12.929  2.78063e+01  6.38318e+00  0.00000e+00 0.00000e+00 1.68399e+02 12.929  2.16530e+01 12.929  0.9823 
1 1 1 -7  104 2  o 13 6.90510e+00 8.15368e-01 1.06775e+02 173.168 -1.57277e+01 1.88422e+00  0.00000e+00 0.00000e+00 1.41416e+02 173.168 3.46411e+01 173.168 0.9679 
1 1 1 -7  104 3  f 0  4.16927e+00 9.61376e-01 9.41674e+01 138.944 -6.07359e+00 5.29016e+00  0.00000e+00 0.00000e+00 5.06396e+01 138.944 4.35278e+01 318.944 0.9357 
1 1 1 -7  104 4  o 18 8.82939e+00 7.37196e-01 1.15571e+02 98.438  -3.85292e+00 2.59728e+01  0.00000e+00 0.00000e+00 2.05706e+02 98.438  9.01355e+01 98.438  0.9808 
1 1 1 -7  104 5  o 15 3.69406e+00 9.32106e-01 6.41948e+01 307.875 3.45803e+00  -4.44598e+00 0.00000e+00 0.00000e+00 5.99381e+01 307.875 4.25666e+00 127.875 0.9062 
1 1 1 -7  104 6  o 14 5.66628e+00 9.38465e-01 9.76253e+01 92.110  -4.82425e-01 1.30913e+01  0.00000e+00 0.00000e+00 1.04170e+02 92.110  6.54461e+00 92.110  0.9610 
1 1 1 -7  104 7  o 8  2.98975e+00 8.95406e-01 3.93276e+01 68.777  1.15671e+00  2.97869e+00  0.00000e+00 0.00000e+00 5.18418e+01 68.777  1.25142e+01 68.777  0.8235 
1 1 1 -7  104 8  o 12 2.67128e+00 7.95991e-01 5.11136e+01 170.151 -4.39691e+00 7.63369e-01  0.00000e+00 0.00000e+00 3.57970e+01 170.151 1.53166e+01 350.151 0.8792 
1 1 1 -7  104 9  o 5  4.31672e+00 1.06799e+00 7.95344e+01 292.132 3.25727e+00  -8.00881e+00 0.00000e+00 0.00000e+00 7.05396e+01 292.132 8.99479e+00 112.132 0.9403 
1 1 1 -7  104 10 o 9  2.56150e+00 8.48391e-01 4.75497e+01 199.321 -4.10932e+00 -1.44072e+00 0.00000e+00 0.00000e+00 3.53355e+01 199.321 1.22142e+01 19.321  0.8759 
1 1 1 -7  105 1  o 19 5.06556e+00 9.73104e-01 7.33398e+01 246.111 -3.05939e+00 -6.90739e+00 0.00000e+00 0.00000e+00 1.01853e+02 246.111 2.85132e+01 246.111 0.9312 
1 1 1 -7  105 2  o 14 3.99585e+00 9.72460e-01 5.10998e+01 139.717 -3.16988e+00 2.68659e+00  0.00000e+00 0.00000e+00 7.78465e+01 139.717 2.67467e+01 139.717 0.8692 
1 1 1 -7  105 3  o 11 8.58332e+00 7.23191e-01 1.53470e+02 73.764  9.86991e+00  3.38937e+01  0.00000e+00 0.00000e+00 1.60499e+02 73.764  7.02937e+00 73.764  0.9857 
1 1 1 -7  105 4  o 14 1.22898e+01 6.84674e-01 1.91625e+02 264.674 -6.31052e+00 -6.76916e+01 0.00000e+00 0.00000e+00 2.60837e+02 264.674 6.92115e+01 264.674 0.9926 
1 1 1 -7  105 5  o 2  3.26072e+00 9.11140e-01 7.43691e+01 17.834  5.45160e+00  1.75385e+00  0.00000e+00 0.00000e+00 3.53703e+01 17.834  3.89989e+01 197.834 0.9079 
1 1 1 -7  105 6  o 6  6.35120e+00 8.45831e-01 8.57545e+01 157.824 -1.30729e+01 5.32850e+00  0.00000e+00 0.00000e+00 1.41042e+02 157.824 5.52875e+01 157.824 0.9639 
1 1 1 -7  105 7  f 0  5.02987e+00 1.00362e+00 4.74512e+01 359.675 5.74476e+00  -3.25312e-02 0.00000e+00 0.00000e+00 1.21667e+02 359.675 7.42159e+01 359.675 0.9082 
1 1 1 -7  105 8  o 15 2.92598e+00 9.08620e-01 2.66085e+01 110.656 -8.09609e-01 2.14755e+00  0.00000e+00 0.00000e+00 5.35722e+01 110.656 2.69637e+01 110.656 0.7407 
1 1 1 -7  105 9  o 3  3.17069e+00 9.37800e-01 4.84172e+01 295.901 1.87506e+00  -3.86143e+00 0.00000e+00 0.00000e+00 5.40058e+01 295.901 5.58858e+00 295.901 0.8739 
1 1 1 -7  106 1  o 12 5.81320e+00 8.51818e-01 1.43542e+02 324.871 1.66109e+01  -1.16871e+01 0.00000e+00 0.00000e+00 6.69064e+01 324.871 7.66358e+01 144.870 0.9751 
1 1 1 -7  106 2  o 8  2.55399e+00 7.93929e-01 5.06066e+01 257.313 -7.52184e-01 -3.34133e+00 0.00000e+00 0.00000e+00 2.87394e+01 257.313 2.18673e+01 77.313  0.8371 
1 1 1 -7  106 3  o 5  5.25914e+00 8.55487e-01 7.14700e+01 63.647  4.22042e+00  8.51949e+00  0.00000e+00 0.00000e+00 1.13067e+02 63.647  4.15972e+01 63.647  0.9459 
1 1 1 -7  106 4  o 5  4.54336e+00 1.01717e+00 9.50497e+01 317.922 7.01286e+00  -6.33179e+00 0.00000e+00 0.00000e+00 6.42334e+01 317.922 3.08163e+01 137.922 0.9455 
1 1 1 -7  106 5  o 19 2.72743e+00 8.33758e-01 5.01425e+01 344.146 3.25922e+00  -9.25553e-01 0.00000e+00 0.00000e+00 3.42589e+01 344.146 1.58836e+01 164.146 0.8350 
1 1 1 -7  106 6  o 7  5.83510e+00 9.88780e-01 9.31980e+01 256.484 -3.17095e+00 -1.31919e+01 0.00000e+00 0.00000e+00 1.14786e+02 256.484 2.15881e+01 256.484 0.9624 
1 1 1 -7  106 7  f 0  4.44591e+00 1.00257e+00 1.05050e+02 72.021  3.84895e+00  1.18608e+01  0.00000e+00 0.00000e+00 5.27529e+01 72.021  5.22973e+01 252.021 0.9590 
1 1 1 -7  106 8  o 13 4.09261e+00 1.01778e+00 4.51750e+01 73.582  1.44088e+00  4.88986e+00  0.00000e+00 0.00000e+00 9.03810e+01 73.582  4.52060e+01 73.582  0.8956 
1 1 1 -7  106 9  o 2  2.54120e+00 8.25379e-01 4.96533e+01 179.007 -4.56113e+00 7.90325e-02  0.00000e+00 0.00000e+00 3.31833e+01 179.007 1.64700e+01 359.007 0.8821 
1 1 1 -7  107 1  o 11 8.87645e+00 7.21039e-01 1.38233e+02 274.239 2.54700e+00  -3.43608e+01 0.00000e+00 0.00000e+00 1.86416e+02 274.239 4.81834e+01 274.239 0.9854 
1 1 1 -7  107 2  o 12 9.22717e+00 7.49295e-01 1.65518e+02 91.987  -1.31804e+00 3.79891e+01  0.00000e+00 0.00000e+00 1.72304e+02 91.987  6.78601e+00 91.987  0.9868 
1 1 1 -7  107 3  o 6  3.93399e+00 9.35016e-01 2.54863e+01 328.033 1.97198e+00  -1.23067e+00 0.00000e+00 0.00000e+00 8.31327e+01 328.033 5.76464e+01 328.033 0.7445 
1 1 1 -7  107 4  o 18 4.34790e+00 1.05892e+00 1.24191e+02 173.750 -1.11324e+01 1.21927e+00  0.00000e+00 0.00000e+00 2.96058e+01 173.750 9.45850e+01 353.750 0.9543 
1 1 1 -7  107 5  o 11 3.67570e+00 9.60029e-01 4.94064e+01 102.243 -1.01377e+00 4.67189e+00  0.00000e+00 0.00000e+00 7.15229e+01 102.243 2.21165e+01 102.243 0.8880 
1 1 1 -7  107 6  o 7  4.48365e+00 1.00479e+00 9.65473e+01 333.820 1.00560e+01  -4.94377e+00 0.00000e+00 0.00000e+00 6.18693e+01 333.820 3.46780e+01 153.820 0.9543 
1 1 1 -7  107 7  o 15 2.85627e+00 8.83738e-01 2.72340e+01 175.609 -2.34431e+00 1.80032e-01  0.00000e+00 0.00000e+00 5.17939e+01 175.609 2.45600e+01 175.609 0.7478 
1 1 1 -7  107 8  o 10 3.08965e+00 9.09905e-01 3.10282e+01 236.267 -1.68014e+00 -2.51609e+00 0.00000e+00 0.00000e+00 6.17110e+01 236.267 3.06827e+01 236.267 0.8119 
1 1 1 -7  107 9  o 13 2.97799e+00 9.19587e-01 4.00416e+01 176.414 -3.92422e+00 2.45926e-01  0.00000e+00 0.00000e+00 5.46652e+01 176.414 1.46237e+01 176.414 0.8609 
1 1 1 -7  108 1  o 12 4.84205e+00 9.49267e-01 4.22061e+01 35.788  3.79793e+00  2.73792e+00  0.00000e+00 0.00000e+00 1.16880e+02 35.788  7.46743e+01 35.788  0.8854 
1 1 1 -7  108 2  o 13 7.60029e+00 8.22782e-01 7.20489e+01 205.171 -1.29086e+01 -6.06640e+00 0.00000e+00 0.00000e+00 1.99792e+02 205.171 1.27743e+02 205.171 0.9643 
1 1 1 -7  108 3  o 16 4.74263e+00 9.90971e-01 1.01590e+02 70.961  3.44233e+00  9.97541e+00  0.00000e+00 0.00000e+00 6.56959e+01 70.961  3.58944e+01 250.961 0.9514 
1 1 1 -7  108 4  o 4  4.96506e+00 9.51906e-01 8.93626e+01 273.304 6.06314e-01  -1.05034e+01 0.00000e+00 0.00000e+00 8.56549e+01 273.304 3.70774e+00 93.304  0.9512 
1 1 1 -7  108 5  o 12 3.08430e+00 8.67182e-01 7.05836e+01 355.094 5.75992e+00  -4.94365e-01 0.00000e+00 0.00000e+00 3.32333e+01 355.094 3.73503e+01 175.094 0.9088 
1 1 1 -7  108 6  o 12 6.54231e+00 8.87230e-01 9.05259e+01 192.715 -1.72717e+01 -3.89705e+00 0.00000e+00 0.00000e+00 1.44690e+02 192.715 5.41641e+01 192.715 0.9713 
1 1 1 -7  108 7  o 9  3.05495e+00 9.13592e-01 5.04369e+01 38.571  3.70259e+00  2.95267e+00  0.00000e+00 0.00000e+00 4.97789e+01 38.571  6.57966e-01 218.571 0.8869 
1 1 1 -7  108 8  o 8  2.34306e+00 7.78301e-01 8.06138e+00 67.416  2.71005e-01  6.51556e-01  0.00000e+00 0.00000e+00 2.07385e+01 67.416  1.26771e+01 67.416  0.3326 
1 1 1 -7  108 9  o 5  2.45252e+00 8.12359e-01 4.98902e+01 59.376  2.44631e+00  4.13256e+00  0.00000e+00 0.00000e+00 3.05948e+01 59.376  1.92955e+01 239.376 0.8886 
1 1 1 -7  109 1  o 10 3.12084e+00 8.86229e-01 9.33295e+01 240.590 -3.40293e+00 -6.03665e+00 0.00000e+00 0.00000e+00 1.37248e+01 240.590 7.96047e+01 60.589  0.9247 
1 1 1 -7  109 2  o 9  2.81391e+00 8.39056e-01 3.41292e+01 329.843 2.09908e+00  -1.21957e+00 0.00000e+00 0.00000e+00 4.48468e+01 329.843 1.07176e+01 329.843 0.7569 
1 1 1 -7  109 3  o 4  4.38112e+00 9.66933e-01 7.50748e+01 109.047 -2.80821e+00 8.13377e+00  0.00000e+00 0.00000e+00 7.75612e+01 109.047 2.48640e+00 109.047 0.9400 
1 1 1 -7  109 4  o 11 6.51398e+00 8.86967e-01 9.55045e+01 56.091  9.06919e+00  1.34920e+01  0.00000e+00 0.00000e+00 1.38271e+02 56.091  4.27669e+01 56.091  0.9687 
1 1 1 -7  109 5  o 6  7.01150e+00 8.53777e-01 1.07393e+02 244.277 -9.50191e+00 -1.97237e+01 0.00000e+00 0.00000e+00 1.46214e+02 244.277 3.88210e+01 244.277 0.9769 
1 1 1 -7  109 6  o 11 3.17617e+00 9.12301e-01 4.04228e+01 291.750 1.34324e+00  -3.36681e+00 0.00000e+00 0.00000e+00 5.91665e+01 291.750 1.87437e+01 291.750 0.8474 
1 1 1 -7  109 7  o 2  2.41781e+00 7.83090e-01 1.63826e+01 89.546  1.13193e-02  1.42944e+00  0.00000e+00 0.00000e+00 3.53126e+01 89.546  1.89300e+01 89.546  0.5782 
1 1 1 -7  109 8  o 2  2.78406e+00 8.64564e-01 3.43925e+01 120.426 -1.74962e+00 2.97899e+00  0.00000e+00 0.00000e+00 5.18871e+01 120.426 1.74946e+01 120.426 0.8387 
1 1 1 -7  110 1  o 18 4.94092e+00 9.21613e-01 4.45611e+01 53.120  3.60525e+00  4.80520e+00  0.00000e+00 0.00000e+00 1.22629e+02 53.120  7.80681e+01 53.120  0.9125 
1 1 1 -7  110 2  o 6  4.96059e+00 9.54055e-01 4.24280e+01 282.943 1.21473e+00  -5.28566e+00 0.00000e+00 0.00000e+00 1.23505e+02 282.943 8.10771e+01 282.943 0.9024 
1 1 1 -7  110 3  o 1  3.01226e+00 8.82603e-01 3.32964e+01 325.948 2.17854e+00  -1.47229e+00 0.00000e+00 0.00000e+00 5.35814e+01 325.948 2.02849e+01 325.948 0.7784 
1 1 1 -7  110 4  o 5  2.94874e+00 8.85484e-01 4.46214e+01 144.596 -3.03066e+00 2.15406e+00  0.00000e+00 0.00000e+00 4.83950e+01 144.596 3.77366e+00 144.596 0.8517 
1 1 1 -7  110 5  o 14 5.65688e+00 9.45001e-01 8.69802e+01 269.191 -1.97810e-01 -1.40066e+01 0.00000e+00 0.00000e+00 1.14790e+02 269.191 2.78095e+01 269.191 0.9636 
1 1 1 -7  110 6  o 3  3.34130e+00 9.49050e-01 7.72292e+01 117.144 -3.48391e+00 6.79540e+00  0.00000e+00 0.00000e+00 3.79690e+01 117.144 3.92602e+01 297.144 0.9320 
1 1 1 -7  110 7  o 16 4.38769e+00 1.02358e+00 5.73238e+01 265.170 -6.06335e-01 -7.17509e+00 0.00000e+00 0.00000e+00 9.31490e+01 265.170 3.58252e+01 265.170 0.9277 
1 1 1 -7  110 8  o 5  4.42731e+00 9.47464e-01 6.85873e+01 97.594  -1.29746e+00 9.73220e+00  0.00000e+00 0.00000e+00 8.63880e+01 97.594  1.78007e+01 97.594  0.9476 
1 1 1 -7  111 1  f 0  6.78206e+00 8.53404e-01 1.01313e+02 140.635 -1.46181e+01 1.19923e+01  0.00000e+00 0.00000e+00 1.43373e+02 140.635 4.20604e+01 140.635 0.9732 
1 1 1 -7  111 2  o 3  4.84404e+00 9.77160e-01 1.05473e+02 258.346 -2.54282e+00 -1.23292e+01 0.00000e+00 0.00000e+00 6.67560e+01 258.346 3.87168e+01 78.346  0.9594 
1 1 1 -7  111 3  o 12 5.02518e+00 9.42217e-01 7.30858e+01 247.724 -3.72972e+00 -9.10471e+00 0.00000e+00 0.00000e+00 1.03330e+02 247.724 3.02443e+01 247.724 0.9477 
1 1 1 -7  111 4  o 8  9.28960e+00 7.35343e-01 1.06995e+02 78.737  6.09775e+00  3.06187e+01  0.00000e+00 0.00000e+00 2.31391e+02 78.737  1.24396e+02 78.737  0.9839 
1 1 1 -7  111 5  o 9  7.49219e+00 8.26045e-01 1.02057e+02 196.674 -2.26789e+01 -6.79287e+00 0.00000e+00 0.00000e+00 1.69261e+02 196.674 6.72045e+01 196.674 0.9786 
1 1 1 -7  111 6  o 15 3.77207e+00 9.93323e-01 7.41254e+01 358.071 7.40986e+00  -2.49544e-01 0.00000e+00 0.00000e+00 5.55877e+01 358.071 1.85377e+01 178.071 0.9299 
1 1 1 -7  111 7  o 7  3.88565e+00 1.00886e+00 4.06568e+01 270.541 4.55959e-02  -4.82970e+00 0.00000e+00 0.00000e+00 8.70410e+01 270.541 4.63842e+01 270.541 0.8893 
1 1 1 -7  111 8  o 2  3.35762e+00 9.29864e-01 5.84330e+01 84.431  6.60091e-01  6.77039e+00  0.00000e+00 0.00000e+00 5.60424e+01 84.431  2.39057e+00 264.431 0.9233 
1 1 1 -7  112 1  o 13 5.89751e+00 9.06838e-01 7.68527e+01 335.634 1.14257e+01  -5.17482e+00 0.00000e+00 0.00000e+00 1.32813e+02 335.634 5.59605e+01 335.634 0.9593 
1 1 1 -7  112 2  o 7  2.51283e+00 7.94436e-01 5.55652e+01 179.998 -4.57087e+00 1.78889e-04  0.00000e+00 0.00000e+00 2.65786e+01 179.998 2.89866e+01 359.998 0.8824 
1 1 1 -7  112 3  o 14 7.64796e+00 8.17850e-01 1.24212e+02 42.226  2.27118e+01  2.06129e+01  0.00000e+00 0.00000e+00 1.54345e+02 42.226  3.01322e+01 42.226  0.9836 
1 1 1 -7  112 4  o 5  2.80786e+00 8.06400e-01 3.81352e+01 211.015 -2.89678e+00 -1.74160e+00 0.00000e+00 0.00000e+00 4.86002e+01 211.015 1.04650e+01 211.015 0.8346 
1 1 1 -7  112 5  o 11 2.18632e+00 7.35679e-01 5.53846e+01 107.290 -1.36550e+00 4.38688e+00  0.00000e+00 0.00000e+00 1.60331e+01 107.290 3.93516e+01 287.290 0.8830 
1 1 1 -7  112 6  o 17 3.50021e+00 1.01199e+00 5.94115e+01 62.605  2.81572e+00  5.43328e+00  0.00000e+00 0.00000e+00 5.88835e+01 62.605  5.27948e-01 242.605 0.9142 
1 1 1 -7  112 7  o 5  2.98912e+00 9.06880e-01 4.63302e+01 157.095 -4.31888e+00 1.82480e+00  0.00000e+00 0.00000e+00 5.14697e+01 157.095 5.13952e+00 157.095 0.8856 
1 1 1 -7  112 8  o 7  3.18540e+00 9.31782e-01 2.61013e+01 324.527 2.34296e+00  -1.66953e+00 0.00000e+00 0.00000e+00 6.80288e+01 324.527 4.19275e+01 324.527 0.8005 
1 1 1 -7  113 1  o 6  3.59888e+00 8.62456e-01 4.49808e+01 276.599 5.74573e-01  -4.96653e+00 0.00000e+00 0.00000e+00 7.41396e+01 276.599 2.91588e+01 276.599 0.8934 
1 1 1 -7  113 2  o 15 3.37338e+00 9.32076e-01 8.09676e+01 101.681 -1.53235e+00 7.41193e+00  0.00000e+00 0.00000e+00 3.53954e+01 101.681 4.55722e+01 281.681 0.9314 
1 1 1 -7  113 3  o 4  3.02425e+00 9.10451e-01 8.78676e+01 223.019 -5.54955e+00 -5.17857e+00 0.00000e+00 0.00000e+00 1.64302e+01 223.019 7.14374e+01 43.019  0.9316 
1 1 1 -7  113 4  o 14 8.61258e+00 7.87417e-01 1.56736e+02 117.343 -2.05912e+01 3.98216e+01  0.00000e+00 0.00000e+00 1.58367e+02 117.343 1.63045e+00 117.343 0.9888 
1 1 1 -7  113 5  o 10 7.83555e+00 8.33010e-01 9.70922e+01 338.618 2.34161e+01  -9.16824e+00 0.00000e+00 0.00000e+00 1.86852e+02 338.618 8.97595e+01 338.618 0.9799 
1 1 1 -7  113 6  o 13 2.36569e+00 7.89144e-01 7.24666e+01 295.132 2.77887e+00  -5.92373e+00 0.00000e+00 0.00000e+00 7.97408e+00 295.132 6.44925e+01 115.132 0.9200 
1 1 1 -7  113 7  f 0  3.38273e+00 9.70151e-01 8.59072e+01 215.470 -7.82200e+00 -5.57329e+00 0.00000e+00 0.00000e+00 3.23319e+01 215.470 5.35753e+01 35.470  0.9464 
1 1 1 -7  114 1  o 6  2.79054e+00 8.51350e-01 1.62086e+01 298.717 7.12660e-01  -1.30078e+00 0.00000e+00 0.00000e+00 4.49738e+01 298.717 2.87652e+01 298.717 0.5920 
1 1 1 -7  114 2  o 5  3.36714e+00 9.33403e-01 4.52653e+01 1.067   4.58337e+00  8.53885e-02  0.00000e+00 0.00000e+00 6.47842e+01 1.067   1.95190e+01 1.067   0.8828 
1 1 1 -7  114 3  o 17 3.30301e+00 9.06229e-01 4.56549e+01 223.137 -3.48921e+00 -3.26943e+00 0.00000e+00 0.00000e+00 6.29004e+01 223.137 1.72455e+01 223.137 0.8881 
1 1 1 -7  114 4  o 18 3.40075e+00 9.32695e-01 5.43135e+01 88.884  1.07378e-01  5.51430e+00  0.00000e+00 0.00000e+00 5.94170e+01 88.884  5.10351e+00 88.884  0.9041 
1 1 1 -7  114 5  o 19 2.28684e+00 7.44671e-01 4.61431e+01 245.113 -1.83992e+00 -3.96606e+00 0.00000e+00 0.00000e+00 2.79541e+01 245.113 1.81891e+01 65.113  0.8764 
1 1 1 -7  114 6  o 2  1.97063e+00 6.80995e-01 4.12768e+00 242.725 -1.70576e-01 -3.30844e-01 0.00000e+00 0.00000e+00 9.19347e+00 242.725 5.06579e+00 242.725 0.1830 
1 1 1 -7  114 7  o 5  2.24059e+00 7.51563e-01 7.80794e+00 162.972 -7.17845e-01 2.19852e-01  0.00000e+00 0.00000e+00 2.12450e+01 162.972 1.34371e+01 162.972 0.3512 
1 1 1 -7  115 1  o 15 6.39358e+00 9.08617e-01 1.06725e+02 153.103 -1.92351e+01 9.75720e+00  0.00000e+00 0.00000e+00 1.24452e+02 153.103 1.77269e+01 153.103 0.9765 
1 1 1 -7  115 2  o 10 3.48155e+00 9.25732e-01 4.40449e+01 30.386  3.74514e+00  2.19606e+00  0.00000e+00 0.00000e+00 6.87708e+01 30.386  2.47259e+01 30.386  0.8755 
1 1 1 -7  115 3  o 9  3.30169e+00 9.48518e-01 8.94401e+01 63.891  4.03786e+00  8.23912e+00  0.00000e+00 0.00000e+00 2.58491e+01 63.891  6.35910e+01 243.891 0.9438 
1 1 1 -7  115 4  o 19 3.42438e+00 9.14489e-01 5.58364e+01 305.505 3.78582e+00  -5.30646e+00 0.00000e+00 0.00000e+00 6.06268e+01 305.505 4.79043e+00 305.505 0.9197 
1 1 1 -7  115 5  o 4  2.45908e+00 7.83228e-01 1.40951e+01 217.977 -1.06449e+00 -8.30995e-01 0.00000e+00 0.00000e+00 3.65196e+01 217.977 2.24246e+01 217.977 0.5569 
1 1 1 -7  115 6  o 17 2.86504e+00 8.89988e-01 5.67767e+01 212.238 -4.76545e+00 -3.00544e+00 0.00000e+00 0.00000e+00 3.91246e+01 212.238 1.76522e+01 32.239  0.9063 
1 1 1 -7  115 7  o 17 2.44711e+00 7.84634e-01 2.30083e+01 27.453  2.29249e+00  1.19103e+00  0.00000e+00 0.00000e+00 4.68807e+01 27.453  2.38724e+01 27.453  0.7738 
1 1 1 -7  116 1  o 1  2.18512e+00 7.27226e-01 5.88470e+01 39.368  3.92287e+00  3.21858e+00  0.00000e+00 0.00000e+00 1.35484e+01 39.368  4.52985e+01 219.368 0.8951 
1 1 1 -7  116 2  f 0  2.74548e+00 8.51618e-01 2.75979e+01 126.624 -1.58789e+00 2.13620e+00  0.00000e+00 0.00000e+00 5.17911e+01 126.624 2.41933e+01 126.624 0.7815 
1 1 1 -7  116 3  o 18 5.57022e+00 9.97922e-01 8.94544e+01 325.107 1.26529e+01  -8.82442e+00 0.00000e+00 0.00000e+00 1.09766e+02 325.107 2.03119e+01 325.107 0.9670 
1 1 1 -7  116 4  f 0  2.86093e+00 8.65949e-01 4.61128e+01 252.903 -1.37654e+00 -4.47539e+00 0.00000e+00 0.00000e+00 4.75318e+01 252.903 1.41905e+00 252.903 0.8855 
1 1 1 -7  116 5  o 12 2.95970e+00 8.90883e-01 5.88441e+01 100.418 -1.14410e+00 6.22251e+00  0.00000e+00 0.00000e+00 4.14460e+01 100.418 1.73981e+01 280.418 0.9172 
1 1 1 -7  116 6  o 4  2.57215e+00 8.32399e-01 4.62292e+01 259.131 -9.34587e-01 -4.86758e+00 0.00000e+00 0.00000e+00 3.85203e+01 259.131 7.70889e+00 79.131  0.8924 
1 1 1 -7  117 1  o 12 4.07617e+00 9.92408e-01 9.39473e+01 63.142  5.26219e+00  1.03913e+01  0.00000e+00 0.00000e+00 5.02556e+01 63.142  4.36917e+01 243.142 0.9561 
1 1 1 -7  117 2  o 4  3.16869e+00 8.54187e-01 4.06840e+01 348.270 4.33782e+00  -9.00664e-01 0.00000e+00 0.00000e+00 6.22529e+01 348.270 2.15689e+01 348.270 0.8782 
1 1 1 -7  117 3  o 10 2.61310e+00 8.24110e-01 6.26798e+01 285.530 1.63092e+00  -5.86899e+00 0.00000e+00 0.00000e+00 2.56023e+01 285.530 3.70775e+01 105.530 0.9138 
1 1 1 -7  117 4  o 10 2.26509e+00 7.49817e-01 2.45654e+01 29.884  2.05444e+00  1.18057e+00  0.00000e+00 0.00000e+00 3.82158e+01 29.884  1.36504e+01 29.884  0.7500 
1 1 1 -7  117 5  f 0  3.47357e+00 9.77057e-01 8.71220e+01 236.139 -5.52885e+00 -8.24001e+00 0.00000e+00 0.00000e+00 3.45242e+01 236.139 5.25978e+01 56.139  0.9482 
1 1 1 -7  117 6  o 15 4.77246e+00 1.07363e+00 1.05727e+02 304.074 8.62545e+00  -1.27523e+01 0.00000e+00 0.00000e+00 6.46103e+01 304.074 4.11166e+01 124.074 0.9670 
1 1 1 -7  118 1  o 8  2.30207e+00 7.51937e-01 6.19613e+01 281.332 1.18189e+00  -5.89775e+00 0.00000e+00 0.00000e+00 1.57514e+01 281.332 4.62099e+01 101.332 0.9126 
1 1 1 -7  118 2  o 11 3.29997e+00 9.35993e-01 4.13157e+01 120.072 -2.31683e+00 4.00118e+00  0.00000e+00 0.00000e+00 6.65354e+01 120.072 2.52197e+01 120.072 0.8839 
1 1 1 -7  118 3  o 14 3.33352e+00 9.26052e-01 3.52224e+01 301.565 2.14015e+00  -3.48350e+00 0.00000e+00 0.00000e+00 7.15811e+01 301.565 3.63587e+01 301.565 0.8668 
1 1 1 -7  118 4  f 0  2.74002e+00 8.51897e-01 8.65808e+01 277.069 1.11159e+00  -8.96436e+00 0.00000e+00 0.00000e+00 8.86397e+00 277.069 7.77168e+01 97.069  0.9429 
1 1 1 -7  118 5  o 14 3.65134e+00 9.65875e-01 1.94641e+01 153.963 -2.30938e+00 1.12820e+00  0.00000e+00 0.00000e+00 8.46710e+01 153.963 6.52069e+01 153.963 0.7724 
1 1 1 -7  119 1  o 11 2.52131e+00 8.03410e-01 5.13239e+01 16.614  4.99620e+00  1.49078e+00  0.00000e+00 0.00000e+00 3.24125e+01 16.614  1.89114e+01 196.614 0.8981 
1 1 1 -7  119 2  o 15 1.90673e+00 6.53090e-01 9.88517e+00 348.560 8.34486e-01  -1.68869e-01 0.00000e+00 0.00000e+00 1.76927e+01 348.560 7.80756e+00 348.560 0.3913 
1 1 1 -7  119 3  o 18 2.81065e+00 8.57321e-01 5.31512e+01 351.015 5.96163e+00  -9.42658e-01 0.00000e+00 0.00000e+00 4.16555e+01 351.015 1.14958e+01 171.015 0.9129 
1 1 1 -7  119 4  f 0  2.23988e+00 7.53751e-01 3.59135e+01 285.133 1.00430e+00  -3.71345e+00 0.00000e+00 0.00000e+00 3.50082e+01 285.133 9.05312e-01 105.133 0.8574 
1 1 1 -7  119 5  o 13 2.79530e+00 8.69881e-01 5.34071e+01 122.423 -2.98958e+00 4.70669e+00  0.00000e+00 0.00000e+00 3.99894e+01 122.423 1.34177e+01 302.423 0.9052 
1 1 1 -7  120 1  o 19 2.15163e+00 7.08247e-01 3.62984e+01 151.942 -3.36976e+00 1.79614e+00  0.00000e+00 0.00000e+00 3.18002e+01 151.942 4.49819e+00 331.942 0.8562 
1 1 1 -7  120 2  o 2  4.32078e+00 9.91791e-01 7.04744e+01 314.217 6.90738e+00  -7.09885e+00 0.00000e+00 0.00000e+00 8.09036e+01 314.217 1.04292e+01 314.217 0.9481 
1 1 1 -7  120 3  o 18 2.85104e+00 8.51990e-01 7.26024e+01 155.975 -7.93011e+00 3.53488e+00  0.00000e+00 0.00000e+00 2.64425e+01 155.975 4.61599e+01 335.975 0.9405 
1 1 1 -7  120 4  o 3  4.25989e+00 1.04777e+00 7.08771e+01 57.041  4.96812e+00  7.66233e+00  0.00000e+00 0.00000e+00 7.75141e+01 57.041  6.63701e+00 57.041  0.9435 
1 1 1 -7  121 3  o 2  2.86289e+00 8.69972e-01 3.72745e+01 329.776 3.44105e+00  -2.00467e+00 0.00000e+00 0.00000e+00 5.39382e+01 329.776 1.66638e+01 329.776 0.8628 
1 1 1 -6  0   1  o 18 9.55487e+00 5.58009e-01 4.00818e+01 180.000 -1.44074e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.14165e+01 180.000 2.86653e+01 0.000   0.1431 
1 1 1 -6  0   2  o 15 2.11101e+01 7.07976e-01 2.73989e+02 180.000 -2.48844e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.10033e+02 180.000 2.36044e+02 180.000 0.9863 
1 1 1 -6  0   3  o 5  2.81919e+01 8.60462e-01 7.12105e+02 0.000   8.67632e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.49053e+02 0.000   3.63052e+02 180.000 1.0000 
1 1 1 -6  0   4  o 15 1.21008e+01 5.99513e-01 1.73614e+02 0.000   1.00727e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.74502e+02 0.000   8.88259e-01 0.000   0.7646 
1 1 1 -6  0   5  o 16 2.96825e+01 9.02310e-01 3.02148e+02 0.000   4.66781e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.13835e+02 0.000   5.11687e+02 0.000   0.9998 
1 1 1 -6  0   6  o 18 7.44237e+01 2.03814e+00 1.43986e+03 180.000 -6.13178e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.35715e+03 180.000 8.27150e+01 0.000   1.0000 
1 1 1 -6  0   7  o 3  2.01393e+01 7.15606e-01 6.39130e+02 0.000   8.48693e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.17268e+02 0.000   5.21862e+02 180.000 1.0000 
1 1 1 -6  0   8  o 9  6.68226e+00 8.02923e-01 7.75021e+01 180.000 -4.42999e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.68619e+01 180.000 5.06402e+01 0.000   0.4161 
1 1 1 -6  0   9  o 19 4.22515e+01 1.00073e+00 6.27774e+02 180.000 -3.21630e+01 0.00000e+00  0.00000e+00 0.00000e+00 9.56799e+02 180.000 3.29025e+02 180.000 1.0000 
1 1 1 -6  0   10 f 0  3.27761e+01 8.27651e-01 4.16146e+02 0.000   2.04812e+01  0.00000e+00  0.00000e+00 0.00000e+00 8.12056e+02 0.000   3.95910e+02 0.000   1.0000 
1 1 1 -6  0   11 o 8  2.63235e+01 7.15039e-01 4.88719e+02 180.000 -2.52474e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.96819e+02 180.000 8.09980e+00 180.000 1.0000 
1 1 1 -6  0   12 o 19 1.02405e+01 6.53943e-01 2.66460e+02 0.000   7.47529e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.16575e+02 0.000   1.49885e+02 180.000 1.0000 
1 1 1 -6  0   13 o 11 6.27598e+00 8.96539e-01 7.03538e+01 180.000 -1.63404e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.46952e+02 180.000 7.65985e+01 180.000 0.9266 
1 1 1 -6  0   14 o 7  1.40860e+01 7.79356e-01 2.33302e+02 0.000   1.58944e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.92481e+02 0.000   5.91799e+01 0.000   1.0000 
1 1 1 -6  0   15 o 3  1.01579e+01 9.96473e-01 1.76305e+02 0.000   1.09747e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.02427e+02 0.000   2.61222e+01 0.000   1.0000 
1 1 1 -6  0   16 o 6  8.14747e+00 1.34058e+00 1.50904e+02 0.000   8.09372e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.52510e+02 0.000   1.60614e+00 0.000   1.0000 
1 1 1 -6  0   17 o 9  8.24169e+00 1.79782e+00 2.25039e+02 180.000 -1.09901e+01 0.00000e+00  0.00000e+00 0.00000e+00 8.15005e+01 180.000 1.43538e+02 0.000   1.0000 
1 1 1 -6  0   18 o 10 2.34152e+00 1.63132e+00 8.85061e+01 180.000 -1.50135e+00 0.00000e+00  0.00000e+00 0.00000e+00 9.75870e+00 0.000   9.82648e+01 0.000   0.9054 
1 1 1 -6  0   19 o 14 2.51766e+00 1.77136e+00 6.92014e+01 180.000 -1.39257e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.33309e+01 180.000 5.58705e+01 0.000   0.8837 
1 1 1 -6  0   20 o 2  3.23108e+00 2.18733e+00 3.20149e+00 0.000   7.36781e-02  0.00000e+00  0.00000e+00 0.00000e+00 5.60053e+00 0.000   2.39904e+00 0.000   0.0735 
1 1 1 -6  1   1  o 15 1.98459e+01 4.80976e-01 1.59447e+02 221.345 -1.78470e+00 -1.57041e+00 0.00000e+00 0.00000e+00 4.01936e+02 221.345 2.42488e+02 221.345 0.7510 
1 1 1 -6  1   2  o 16 1.61876e+01 4.38332e-01 3.43969e+02 261.068 -7.44274e-01 -4.73560e+00 0.00000e+00 0.00000e+00 1.97537e+02 261.068 1.46432e+02 81.068  0.8884 
1 1 1 -6  1   3  o 13 9.70779e+00 4.28890e-01 2.60465e+02 168.881 -2.15037e+00 4.22632e-01  0.00000e+00 0.00000e+00 5.12837e+00 168.881 2.55337e+02 348.881 0.7268 
1 1 1 -6  1   4  o 10 1.92920e+01 4.80108e-01 4.15927e+02 76.894  1.74267e+00  7.48523e+00  0.00000e+00 0.00000e+00 2.60885e+02 76.894  1.55041e+02 256.894 0.9325 
1 1 1 -6  1   5  o 14 4.41119e+00 6.88512e-01 1.25970e+02 300.870 2.96339e-01  -4.95740e-01 0.00000e+00 0.00000e+00 7.99601e+01 120.870 2.05930e+02 120.870 0.2774 
1 1 1 -6  1   6  o 16 1.77969e+01 4.73439e-01 2.79824e+02 264.062 -6.13979e-01 -5.90305e+00 0.00000e+00 0.00000e+00 3.29719e+02 264.062 4.98952e+01 264.062 0.9113 
1 1 1 -6  1   7  o 18 2.91238e+01 6.28144e-01 5.15601e+02 333.265 1.76230e+01  -8.87674e+00 0.00000e+00 0.00000e+00 5.50149e+02 333.265 3.45485e+01 333.265 0.9743 
1 1 1 -6  1   8  o 4  5.46048e+01 1.07574e+00 1.07096e+03 354.921 9.70433e+01  -8.62493e+00 0.00000e+00 0.00000e+00 9.67920e+02 354.921 1.03035e+02 174.921 0.9949 
1 1 1 -6  1   9  o 8  5.43709e+01 8.81193e-01 1.12793e+03 175.586 -1.46441e+02 1.13039e+01  0.00000e+00 0.00000e+00 9.04201e+02 175.586 2.23732e+02 355.586 0.9966 
1 1 1 -6  1   10 o 14 3.34024e+01 5.89152e-01 6.74134e+02 61.477  3.22808e+01  5.93981e+01  0.00000e+00 0.00000e+00 5.68243e+02 61.477  1.05891e+02 241.477 0.9926 
1 1 1 -6  1   11 o 6  1.19102e+01 4.26591e-01 1.91762e+02 333.441 8.06170e+00  -4.02984e+00 0.00000e+00 0.00000e+00 2.28629e+02 333.441 3.68672e+01 333.441 0.9428 
1 1 1 -6  1   12 o 7  1.47682e+01 4.21242e-01 3.10573e+02 16.417  2.41947e+01  7.12856e+00  0.00000e+00 0.00000e+00 2.30754e+02 16.417  7.98190e+01 196.417 0.9800 
1 1 1 -6  1   13 f 0  1.35740e+01 4.48364e-01 2.50756e+02 243.095 -1.17254e+01 -2.31072e+01 0.00000e+00 0.00000e+00 2.46569e+02 243.095 4.18758e+00 63.095  0.9805 
1 1 1 -6  1   14 o 12 1.07055e+01 6.14772e-01 2.55582e+02 51.055  1.64158e+01  2.03119e+01  0.00000e+00 0.00000e+00 1.36293e+02 51.055  1.19289e+02 231.055 0.9807 
1 1 1 -6  1   15 o 8  1.09744e+01 6.64649e-01 1.98015e+02 91.526  -7.18150e-01 2.69608e+01  0.00000e+00 0.00000e+00 2.03501e+02 91.526  5.48622e+00 91.526  0.9813 
1 1 1 -6  1   16 o 5  3.79748e+00 1.06663e+00 9.65356e+01 308.415 2.83292e+00  -3.57226e+00 0.00000e+00 0.00000e+00 2.82023e+01 308.415 6.83334e+01 128.415 0.8820 
1 1 1 -6  1   17 o 7  5.55359e+00 1.19157e+00 1.01901e+02 224.877 -4.96723e+00 -4.94598e+00 0.00000e+00 0.00000e+00 8.92984e+01 224.877 1.26021e+01 44.877  0.9256 
1 1 1 -6  1   18 o 2  3.98358e+00 1.20649e+00 1.05443e+02 24.654  5.35110e+00  2.45608e+00  0.00000e+00 0.00000e+00 2.92953e+01 24.654  7.61477e+01 204.654 0.9106 
1 1 1 -6  1   19 o 7  6.15893e+00 1.62175e+00 7.26100e+01 173.617 -5.40409e+00 6.04579e-01  0.00000e+00 0.00000e+00 1.33605e+02 173.617 6.09952e+01 173.617 0.9026 
1 1 1 -6  1   20 o 7  4.51735e+00 1.44427e+00 8.49690e+01 327.445 5.01376e+00  -3.20091e+00 0.00000e+00 0.00000e+00 6.75577e+01 327.445 1.74113e+01 147.445 0.9116 
1 1 1 -6  2   1  o 19 2.25677e+01 5.18641e-01 4.37258e+02 142.915 -5.90291e+00 4.46195e+00  0.00000e+00 0.00000e+00 3.53090e+02 142.915 8.41684e+01 322.915 0.9297 
1 1 1 -6  2   2  o 1  1.35766e+01 4.20130e-01 3.17117e+02 339.266 3.46331e+00  -1.31102e+00 0.00000e+00 0.00000e+00 1.17966e+02 339.266 1.99151e+02 159.266 0.8511 
1 1 1 -6  2   3  o 8  2.30772e+01 5.29644e-01 6.45624e+02 301.593 6.74782e+00  -1.09714e+01 0.00000e+00 0.00000e+00 1.88578e+02 301.593 4.57046e+02 121.593 0.9604 
1 1 1 -6  2   4  o 17 1.11626e+01 4.21024e-01 4.18136e+02 25.705  4.02897e+00  1.93941e+00  0.00000e+00 0.00000e+00 4.87770e+01 205.705 4.66913e+02 205.705 0.8795 
1 1 1 -6  2   5  o 1  2.32365e+01 5.40100e-01 4.75081e+02 58.619  5.99278e+00  9.82523e+00  0.00000e+00 0.00000e+00 3.59827e+02 58.619  1.15254e+02 238.619 0.9555 
1 1 1 -6  2   6  o 1  3.03631e+01 6.45504e-01 5.14487e+02 285.137 4.83855e+00  -1.78862e+01 0.00000e+00 0.00000e+00 5.95386e+02 285.137 8.08991e+01 285.137 0.9726 
1 1 1 -6  2   7  o 3  3.75520e+01 7.66786e-01 7.81108e+02 347.456 3.74350e+01  -8.32907e+00 0.00000e+00 0.00000e+00 6.10759e+02 347.456 1.70349e+02 167.456 0.9869 
1 1 1 -6  2   8  o 14 2.47499e+01 5.21816e-01 3.96834e+02 210.711 -1.44644e+01 -8.59204e+00 0.00000e+00 0.00000e+00 5.04027e+02 210.711 1.07193e+02 210.711 0.9698 
1 1 1 -6  2   9  o 19 4.67089e+01 7.70298e-01 7.82683e+02 252.062 -2.71854e+01 -8.39754e+01 0.00000e+00 0.00000e+00 9.59098e+02 252.062 1.76414e+02 252.062 0.9943 
1 1 1 -6  2   10 o 7  3.94705e+01 6.69802e-01 6.15622e+02 28.064  6.11487e+01  3.26015e+01  0.00000e+00 0.00000e+00 8.52719e+02 28.064  2.37097e+02 28.064  0.9928 
1 1 1 -6  2   11 o 16 1.94993e+01 4.43707e-01 3.89262e+02 114.734 -1.25171e+01 2.71713e+01  0.00000e+00 0.00000e+00 3.28470e+02 114.734 6.07921e+01 294.734 0.9831 
1 1 1 -6  2   12 o 10 5.13763e+00 6.65177e-01 1.29314e+02 229.216 -2.32287e+00 -2.69258e+00 0.00000e+00 0.00000e+00 3.28712e+01 229.216 9.64427e+01 49.216  0.8440 
1 1 1 -6  2   13 o 11 9.37194e+00 4.81912e-01 2.15222e+02 6.511   1.51872e+01  1.73341e+00  0.00000e+00 0.00000e+00 1.23316e+02 6.511   9.19057e+01 186.511 0.9667 
1 1 1 -6  2   14 o 5  9.84003e+00 6.63205e-01 1.56074e+02 334.060 1.30368e+01  -6.34153e+00 0.00000e+00 0.00000e+00 1.98316e+02 334.060 4.22423e+01 334.060 0.9649 
1 1 1 -6  2   15 o 15 8.84706e+00 7.58936e-01 2.17459e+02 252.807 -6.84485e+00 -2.21218e+01 0.00000e+00 0.00000e+00 1.05196e+02 252.807 1.12263e+02 72.807  0.9782 
1 1 1 -6  2   16 o 13 7.74010e+00 9.42400e-01 1.11333e+02 326.339 9.46686e+00  -6.30432e+00 0.00000e+00 0.00000e+00 1.63930e+02 326.339 5.25969e+01 326.339 0.9550 
1 1 1 -6  2   17 o 14 4.49837e+00 1.18203e+00 9.20394e+01 133.606 -3.55531e+00 3.73267e+00  0.00000e+00 0.00000e+00 5.80138e+01 133.606 3.40257e+01 313.606 0.8969 
1 1 1 -6  2   18 o 6  5.13946e+00 1.39005e+00 4.90695e+01 138.781 -2.36539e+00 2.07215e+00  0.00000e+00 0.00000e+00 1.07498e+02 138.781 5.84283e+01 138.781 0.8201 
1 1 1 -6  2   19 o 2  3.62776e+00 1.21905e+00 7.11207e+01 307.185 2.55533e+00  -3.36835e+00 0.00000e+00 0.00000e+00 4.61884e+01 307.185 2.49323e+01 127.185 0.8717 
1 1 1 -6  2   20 o 8  5.65958e+00 1.65861e+00 7.96274e+01 122.895 -3.18489e+00 4.92406e+00  0.00000e+00 0.00000e+00 1.11182e+02 122.895 3.15545e+01 122.895 0.9102 
1 1 1 -6  3   1  o 17 1.05100e+01 3.99445e-01 1.18613e+02 57.877  4.96742e-01  7.91174e-01  0.00000e+00 0.00000e+00 4.86817e+01 57.877  6.99315e+01 237.877 0.4226 
1 1 1 -6  3   2  f 0  2.39005e+01 5.42051e-01 5.31799e+02 206.502 -9.74558e+00 -4.85946e+00 0.00000e+00 0.00000e+00 3.25800e+02 206.502 2.05999e+02 26.502  0.9529 
1 1 1 -6  3   3  o 12 1.53295e+01 4.39134e-01 4.40384e+02 190.850 -5.73073e+00 -1.09838e+00 0.00000e+00 0.00000e+00 8.45269e+01 190.850 3.55857e+02 10.850  0.9097 
1 1 1 -6  3   4  f 0  2.13309e+01 5.05302e-01 3.99201e+02 103.585 -1.91106e+00 7.90856e+00  0.00000e+00 0.00000e+00 3.52259e+02 103.585 4.69426e+01 283.585 0.9364 
1 1 1 -6  3   5  f 0  3.96886e+01 8.06359e-01 7.94949e+02 221.422 -2.44701e+01 -2.15899e+01 0.00000e+00 0.00000e+00 6.74432e+02 221.422 1.20518e+02 41.422  0.9846 
1 1 1 -6  3   6  o 3  1.19728e+01 4.37600e-01 3.17956e+02 265.188 -3.80427e-01 -4.51908e+00 0.00000e+00 0.00000e+00 7.86161e+01 265.188 2.39340e+02 85.188  0.8814 
1 1 1 -6  3   7  o 19 2.60088e+01 5.80854e-01 4.46455e+02 142.238 -1.20706e+01 9.35026e+00  0.00000e+00 0.00000e+00 4.97826e+02 142.238 5.13709e+01 142.238 0.9667 
1 1 1 -6  3   8  o 3  3.16571e+01 6.14226e-01 4.91473e+02 320.700 2.05453e+01  -1.68163e+01 0.00000e+00 0.00000e+00 6.74072e+02 320.700 1.82599e+02 320.700 0.9810 
1 1 1 -6  3   9  o 15 4.39110e+01 7.30465e-01 8.70624e+02 97.346  -1.18296e+01 9.17647e+01  0.00000e+00 0.00000e+00 7.67242e+02 97.346  1.03383e+02 277.346 0.9946 
1 1 1 -6  3   10 o 12 9.31911e+00 4.69591e-01 2.00342e+02 90.160  -1.50761e-02 5.38843e+00  0.00000e+00 0.00000e+00 1.14529e+02 90.160  8.58127e+01 270.160 0.9017 
1 1 1 -6  3   11 o 17 3.16576e+01 5.70641e-01 6.40890e+02 259.659 -1.42157e+01 -7.79072e+01 0.00000e+00 0.00000e+00 5.36833e+02 259.659 1.04057e+02 79.659  0.9937 
1 1 1 -6  3   12 o 13 7.42640e+00 5.21977e-01 6.19787e+01 3.528   2.50096e+00  1.54195e-01  0.00000e+00 0.00000e+00 1.50690e+02 3.528   8.87112e+01 3.528   0.7656 
1 1 1 -6  3   13 o 3  9.09073e+00 4.83929e-01 2.40494e+02 296.743 7.32150e+00  -1.45297e+01 0.00000e+00 0.00000e+00 8.85807e+01 296.743 1.51913e+02 116.743 0.9688 
1 1 1 -6  3   14 o 9  5.71244e+00 7.55429e-01 1.21063e+02 23.183  5.86487e+00  2.51157e+00  0.00000e+00 0.00000e+00 7.46522e+01 23.183  4.64109e+01 203.183 0.9179 
1 1 1 -6  3   15 o 3  1.72821e+01 6.02585e-01 2.98894e+02 316.004 4.69660e+01  -4.53474e+01 0.00000e+00 0.00000e+00 3.40500e+02 316.004 4.16063e+01 316.004 0.9923 
1 1 1 -6  3   16 o 12 9.85147e+00 8.17986e-01 1.27121e+02 125.283 -1.00899e+01 1.42592e+01  0.00000e+00 0.00000e+00 2.29086e+02 125.283 1.01965e+02 125.283 0.9709 
1 1 1 -6  3   17 o 4  6.85889e+00 1.22867e+00 8.80778e+01 137.261 -5.38356e+00 4.97453e+00  0.00000e+00 0.00000e+00 1.48925e+02 137.261 6.08476e+01 137.261 0.9290 
1 1 1 -6  3   18 o 13 6.71837e+00 1.45194e+00 1.30999e+02 48.443  6.99451e+00  7.89007e+00  0.00000e+00 0.00000e+00 1.06406e+02 48.443  2.45935e+01 228.443 0.9513 
1 1 1 -6  3   19 o 10 3.64826e+00 1.22703e+00 1.77484e+01 208.148 -9.29973e-01 -4.97561e-01 0.00000e+00 0.00000e+00 4.52383e+01 208.148 2.74899e+01 208.148 0.4654 
1 1 1 -6  3   20 o 18 4.32386e+00 1.42863e+00 6.07409e+01 259.909 -7.22324e-01 -4.05898e+00 0.00000e+00 0.00000e+00 7.82891e+01 259.909 1.75482e+01 259.909 0.8681 
1 1 1 -6  4   1  o 6  1.67870e+01 4.44419e-01 2.47473e+02 172.526 -3.07569e+00 4.03503e-01  0.00000e+00 0.00000e+00 2.69293e+02 172.526 2.18208e+01 172.526 0.8173 
1 1 1 -6  4   2  o 15 2.96253e+01 6.29617e-01 6.80597e+02 8.191   1.70238e+01  2.45059e+00  0.00000e+00 0.00000e+00 4.02000e+02 8.191   2.78598e+02 188.191 0.9705 
1 1 1 -6  4   3  o 15 3.33451e+01 6.93404e-01 6.80902e+02 207.525 -1.72834e+01 -9.00684e+00 0.00000e+00 0.00000e+00 5.41561e+02 207.525 1.39341e+02 27.525  0.9740 
1 1 1 -6  4   4  o 10 2.25819e+01 5.22331e-01 4.79006e+02 232.147 -6.32928e+00 -8.14402e+00 0.00000e+00 0.00000e+00 3.28283e+02 232.147 1.50723e+02 52.147  0.9502 
1 1 1 -6  4   5  o 19 2.24835e+01 5.25424e-01 3.51848e+02 147.596 -6.95000e+00 4.41126e+00  0.00000e+00 0.00000e+00 4.40448e+02 147.596 8.86005e+01 147.596 0.9371 
1 1 1 -6  4   6  o 9  3.94320e+01 7.98482e-01 9.63909e+02 157.493 -4.13783e+01 1.71456e+01  0.00000e+00 0.00000e+00 5.01363e+02 157.493 4.62545e+02 337.493 0.9888 
1 1 1 -6  4   7  o 19 2.21307e+01 5.27234e-01 5.34408e+02 50.411  9.91834e+00  1.19941e+01  0.00000e+00 0.00000e+00 2.69602e+02 50.411  2.64806e+02 230.411 0.9673 
1 1 1 -6  4   8  o 11 4.36492e+01 7.90754e-01 8.97543e+02 141.982 -5.22221e+01 4.08265e+01  0.00000e+00 0.00000e+00 7.28255e+02 141.982 1.69288e+02 321.982 0.9924 
1 1 1 -6  4   9  o 16 3.63500e+01 6.26149e-01 5.95434e+02 214.923 -4.32086e+01 -3.01686e+01 0.00000e+00 0.00000e+00 7.54788e+02 214.923 1.59354e+02 214.923 0.9905 
1 1 1 -6  4   10 o 15 2.66134e+01 5.07663e-01 3.64652e+02 329.222 2.40055e+01  -1.42978e+01 0.00000e+00 0.00000e+00 6.14585e+02 329.222 2.49932e+02 329.222 0.9819 
1 1 1 -6  4   11 o 4  1.67143e+01 4.25515e-01 2.92977e+02 285.381 5.12207e+00  -1.86198e+01 0.00000e+00 0.00000e+00 3.16361e+02 285.381 2.33834e+01 285.381 0.9738 
1 1 1 -6  4   12 f 0  3.75054e+00 7.58525e-01 2.06631e+02 120.157 -2.26249e+00 3.89412e+00  0.00000e+00 0.00000e+00 8.31210e+01 300.157 2.89752e+02 300.157 0.8804 
1 1 1 -6  4   13 o 5  2.43618e+01 5.02293e-01 4.06044e+02 301.545 3.84039e+01  -6.25590e+01 0.00000e+00 0.00000e+00 4.98031e+02 301.545 9.19866e+01 301.545 0.9932 
1 1 1 -6  4   14 o 13 2.80336e+00 7.96217e-01 1.06876e+02 300.584 1.39085e+00  -2.35333e+00 0.00000e+00 0.00000e+00 2.44017e+01 120.584 1.31278e+02 120.584 0.7882 
1 1 1 -6  4   15 o 14 5.60990e+00 9.56180e-01 1.18332e+02 116.456 -3.30776e+00 6.64705e+00  0.00000e+00 0.00000e+00 7.61826e+01 116.456 4.21496e+01 296.456 0.9300 
1 1 1 -6  4   16 o 3  6.66531e+00 1.05429e+00 1.15787e+02 199.616 -9.09387e+00 -3.24101e+00 0.00000e+00 0.00000e+00 1.19196e+02 199.616 3.40955e+00 199.616 0.9467 
1 1 1 -6  4   17 o 4  1.11948e+01 9.30205e-01 1.87426e+02 148.155 -2.53006e+01 1.57149e+01  0.00000e+00 0.00000e+00 2.21892e+02 148.155 3.44662e+01 148.155 0.9831 
1 1 1 -6  4   18 o 14 5.47967e+00 1.38522e+00 1.40891e+02 286.061 2.67120e+00  -9.27807e+00 0.00000e+00 0.00000e+00 5.17992e+01 286.061 8.90917e+01 106.061 0.9467 
1 1 1 -6  4   19 f 0  9.27291e+00 1.59901e+00 1.61436e+02 160.330 -1.74251e+01 6.22866e+00  0.00000e+00 0.00000e+00 1.73100e+02 160.330 1.16645e+01 160.330 0.9726 
1 1 1 -6  4   20 o 15 4.51888e+00 1.47888e+00 2.63137e+01 354.764 1.78287e+00  -1.63381e-01 0.00000e+00 0.00000e+00 8.41838e+01 354.764 5.78701e+01 354.764 0.6602 
1 1 1 -6  5   1  o 9  2.95554e+01 6.28979e-01 5.36415e+02 333.081 1.04857e+01  -5.32413e+00 0.00000e+00 0.00000e+00 5.28401e+02 333.081 8.01468e+00 153.081 0.9565 
1 1 1 -6  5   2  o 13 3.15896e+01 6.62166e-01 6.36547e+02 198.027 -1.62429e+01 -5.28600e+00 0.00000e+00 0.00000e+00 5.17570e+02 198.027 1.18977e+02 18.027  0.9703 
1 1 1 -6  5   3  o 2  2.47617e+01 5.53201e-01 5.01296e+02 343.015 1.01902e+01  -3.11249e+00 0.00000e+00 0.00000e+00 3.85837e+02 343.015 1.15459e+02 163.015 0.9518 
1 1 1 -6  5   4  o 1  1.98853e+01 4.90198e-01 4.68642e+02 225.778 -6.18765e+00 -6.35808e+00 0.00000e+00 0.00000e+00 2.35969e+02 225.778 2.32673e+02 45.778  0.9418 
1 1 1 -6  5   5  o 2  3.01092e+01 7.69806e-01 5.32636e+02 18.203  1.57301e+01  5.17266e+00  0.00000e+00 0.00000e+00 5.64812e+02 18.203  3.21756e+01 18.203  0.9693 
1 1 1 -6  5   6  o 6  1.33614e+01 4.40177e-01 1.96605e+02 5.400   3.10865e+00  2.93866e-01  0.00000e+00 0.00000e+00 2.14467e+02 5.400   1.78612e+01 5.400   0.8186 
1 1 1 -6  5   7  o 8  3.37811e+01 7.02934e-01 6.27688e+02 49.842  1.85281e+01  2.19581e+01  0.00000e+00 0.00000e+00 6.18746e+02 49.842  8.94263e+00 229.842 0.9824 
1 1 1 -6  5   8  o 15 9.20842e+00 4.61320e-01 1.65080e+02 5.044   2.59404e+00  2.28980e-01  0.00000e+00 0.00000e+00 1.03057e+02 5.044   6.20222e+01 185.044 0.7759 
1 1 1 -6  5   9  o 9  2.64494e+01 5.02527e-01 5.60931e+02 104.381 -9.02444e+00 3.51958e+01  0.00000e+00 0.00000e+00 4.17232e+02 104.381 1.43699e+02 284.381 0.9861 
1 1 1 -6  5   10 o 9  3.71090e+01 6.36452e-01 6.83342e+02 11.861  7.08486e+01  1.48792e+01  0.00000e+00 0.00000e+00 6.97540e+02 11.861  1.41979e+01 11.861  0.9931 
1 1 1 -6  5   11 o 14 3.03274e+01 5.52172e-01 5.74936e+02 212.899 -5.71865e+01 -3.69943e+01 0.00000e+00 0.00000e+00 5.52100e+02 212.899 2.28361e+01 32.899  0.9926 
1 1 1 -6  5   12 o 17 8.61518e+00 4.74245e-01 1.17438e+02 115.362 -2.61708e+00 5.52091e+00  0.00000e+00 0.00000e+00 1.77092e+02 115.362 5.96545e+01 115.362 0.9140 
1 1 1 -6  5   13 o 16 9.00705e+00 4.80093e-01 8.65386e+01 206.001 -5.21223e+00 -2.54234e+00 0.00000e+00 0.00000e+00 2.19426e+02 206.001 1.32888e+02 206.001 0.9091 
1 1 1 -6  5   14 o 14 1.43029e+01 5.19720e-01 2.78258e+02 229.606 -2.54326e+01 -2.98898e+01 0.00000e+00 0.00000e+00 2.48758e+02 229.606 2.94998e+01 49.606  0.9872 
1 1 1 -6  5   15 o 17 9.38793e+00 6.90758e-01 1.02237e+02 177.046 -1.17932e+01 6.08564e-01  0.00000e+00 0.00000e+00 2.32611e+02 177.046 1.30374e+02 177.046 0.9567 
1 1 1 -6  5   16 o 10 6.48158e+00 1.08547e+00 1.67443e+02 251.853 -4.16304e+00 -1.27017e+01 0.00000e+00 0.00000e+00 6.47124e+01 251.853 1.02731e+02 71.853  0.9618 
1 1 1 -6  5   17 o 9  9.52266e+00 9.92947e-01 2.23464e+02 19.319  2.76194e+01  9.68258e+00  0.00000e+00 0.00000e+00 1.24603e+02 19.319  9.88605e+01 199.319 0.9828 
1 1 1 -6  5   18 o 14 4.89402e+00 1.34078e+00 5.14501e+01 356.463 3.23347e+00  -1.99857e-01 0.00000e+00 0.00000e+00 9.87477e+01 356.463 4.72976e+01 356.463 0.8263 
1 1 1 -6  5   19 o 7  4.66763e+00 1.43926e+00 6.43474e+01 97.035  -5.11624e-01 4.14566e+00  0.00000e+00 0.00000e+00 8.62810e+01 97.035  2.19337e+01 97.035  0.8700 
1 1 1 -6  5   20 o 6  4.25224e+00 1.41237e+00 7.63526e+01 293.023 2.01988e+00  -4.75325e+00 0.00000e+00 0.00000e+00 6.49367e+01 293.023 1.14159e+01 113.023 0.8971 
1 1 1 -6  6   1  o 19 9.86012e+00 4.03225e-01 9.97408e+01 276.970 1.04264e-01  -8.52862e-01 0.00000e+00 0.00000e+00 4.66954e+01 276.970 5.30454e+01 96.970  0.3943 
1 1 1 -6  6   2  o 19 2.56626e+01 5.66481e-01 5.78851e+02 292.686 4.85538e+00  -1.16154e+01 0.00000e+00 0.00000e+00 3.48226e+02 292.686 2.30625e+02 112.686 0.9594 
1 1 1 -6  6   3  o 4  1.76303e+01 4.57478e-01 3.52397e+02 228.724 -3.51155e+00 -4.00048e+00 0.00000e+00 0.00000e+00 2.45073e+02 228.724 1.07324e+02 48.724  0.9004 
1 1 1 -6  6   4  o 9  2.30519e+01 5.30952e-01 5.60538e+02 141.775 -9.63150e+00 7.58599e+00  0.00000e+00 0.00000e+00 2.70551e+02 141.775 2.89987e+02 321.775 0.9583 
1 1 1 -6  6   5  o 5  8.85485e+00 4.32937e-01 2.26694e+02 105.772 -5.66711e-01 2.00652e+00  0.00000e+00 0.00000e+00 1.01247e+01 105.772 2.16570e+02 285.771 0.7113 
1 1 1 -6  6   6  o 15 4.40400e+01 8.80040e-01 8.46859e+02 37.700  3.45769e+01  2.67243e+01  0.00000e+00 0.00000e+00 7.89133e+02 37.700  5.77264e+01 217.700 0.9885 
1 1 1 -6  6   7  o 5  2.57979e+01 6.71517e-01 6.03175e+02 186.191 -2.09637e+01 -2.27393e+00 0.00000e+00 0.00000e+00 3.42439e+02 186.191 2.60736e+02 6.191   0.9760 
1 1 1 -6  6   8  o 4  1.96292e+01 4.65904e-01 4.00961e+02 358.954 1.34663e+01  -2.45899e-01 0.00000e+00 0.00000e+00 3.07827e+02 358.954 9.31343e+01 178.954 0.9621 
1 1 1 -6  6   9  o 7  1.55746e+01 4.14053e-01 2.68144e+02 1.537   1.02552e+01  2.75082e-01  0.00000e+00 0.00000e+00 2.86687e+02 1.537   1.85431e+01 1.537   0.9499 
1 1 1 -6  6   10 o 3  2.89411e+01 5.33612e-01 4.40680e+02 229.216 -2.39218e+01 -2.77291e+01 0.00000e+00 0.00000e+00 6.28851e+02 229.216 1.88170e+02 229.216 0.9863 
1 1 1 -6  6   11 o 18 1.66873e+01 4.30174e-01 3.87992e+02 290.710 9.01810e+00  -2.38527e+01 0.00000e+00 0.00000e+00 2.24365e+02 290.710 1.63626e+02 110.710 0.9802 
1 1 1 -6  6   12 o 8  2.97721e+00 7.14672e-01 9.62901e+01 285.514 4.48348e-01  -1.61512e+00 0.00000e+00 0.00000e+00 2.53832e+01 105.514 1.21673e+02 105.514 0.6368 
1 1 1 -6  6   13 o 7  1.50414e+01 4.36929e-01 2.85023e+02 101.253 -6.25549e+00 3.14398e+01  0.00000e+00 0.00000e+00 2.68158e+02 101.253 1.68653e+01 281.253 0.9843 
1 1 1 -6  6   14 o 10 5.28860e+00 7.99325e-01 1.22471e+02 205.641 -5.39060e+00 -2.58749e+00 0.00000e+00 0.00000e+00 5.75622e+01 205.641 6.49084e+01 25.641  0.9120 
1 1 1 -6  6   15 o 14 3.19989e+00 9.15887e-01 3.60840e+01 83.576  1.46739e-01  1.30326e+00  0.00000e+00 0.00000e+00 2.90498e+01 83.576  7.03417e+00 263.576 0.5460 
1 1 1 -6  6   16 f 0  9.30501e+00 8.25835e-01 1.17830e+02 86.840  8.21350e-01  1.48790e+01  0.00000e+00 0.00000e+00 2.16838e+02 86.840  9.90079e+01 86.840  0.9658 
1 1 1 -6  6   17 o 14 5.32665e+00 1.22962e+00 9.15282e+01 353.752 6.36533e+00  -6.96838e-01 0.00000e+00 0.00000e+00 9.03754e+01 353.752 1.15280e+00 173.752 0.9182 
1 1 1 -6  6   18 o 2  5.02258e+00 1.36721e+00 8.09855e+01 134.829 -3.62677e+00 3.64850e+00  0.00000e+00 0.00000e+00 8.62846e+01 134.829 5.29911e+00 134.829 0.8966 
1 1 1 -6  6   19 o 10 5.43224e+00 1.51327e+00 1.13005e+02 60.076  4.03104e+00  7.00348e+00  0.00000e+00 0.00000e+00 7.55744e+01 60.076  3.74310e+01 240.076 0.9359 
1 1 1 -6  6   20 o 11 4.81623e+00 1.47072e+00 5.70078e+01 217.151 -3.31616e+00 -2.51267e+00 0.00000e+00 0.00000e+00 9.80878e+01 217.151 4.10800e+01 217.151 0.8694 
1 1 1 -6  7   1  o 12 2.64059e+01 5.78909e-01 2.95432e+02 296.537 3.01992e+00  -6.04732e+00 0.00000e+00 0.00000e+00 6.22320e+02 296.537 3.26889e+02 296.537 0.9227 
1 1 1 -6  7   2  o 10 1.81380e+01 4.60559e-01 2.52289e+02 108.301 -1.12613e+00 3.40483e+00  0.00000e+00 0.00000e+00 3.25131e+02 108.301 7.28426e+01 108.301 0.8455 
1 1 1 -6  7   3  o 7  8.19295e+00 4.29031e-01 1.72428e+02 258.243 -2.45754e-01 -1.18075e+00 0.00000e+00 0.00000e+00 1.37264e+01 78.243  1.86154e+02 78.243  0.5147 
1 1 1 -6  7   4  o 9  1.92712e+01 4.79890e-01 4.03733e+02 225.595 -5.15464e+00 -5.26277e+00 0.00000e+00 0.00000e+00 2.70089e+02 225.595 1.33645e+02 45.595  0.9294 
1 1 1 -6  7   5  o 3  1.39738e+01 5.23462e-01 4.07773e+02 162.821 -5.63233e+00 1.74118e+00  0.00000e+00 0.00000e+00 7.07407e+01 162.821 3.37032e+02 342.822 0.9107 
1 1 1 -6  7   6  o 8  1.57931e+01 4.55821e-01 2.78581e+02 123.112 -2.84692e+00 4.36514e+00  0.00000e+00 0.00000e+00 2.54422e+02 123.112 2.41586e+01 303.112 0.8981 
1 1 1 -6  7   7  o 9  2.77572e+01 6.07255e-01 5.96479e+02 292.823 8.71102e+00  -2.06993e+01 0.00000e+00 0.00000e+00 4.22481e+02 292.823 1.73998e+02 112.823 0.9775 
1 1 1 -6  7   8  o 10 2.41769e+01 5.11908e-01 4.78029e+02 56.728  1.08226e+01  1.64934e+01  0.00000e+00 0.00000e+00 4.06010e+02 56.728  7.20189e+01 236.728 0.9743 
1 1 1 -6  7   9  o 10 1.34140e+01 4.35358e-01 2.52395e+02 159.093 -7.75649e+00 2.96301e+00  0.00000e+00 0.00000e+00 2.19299e+02 159.093 3.30964e+01 339.093 0.9377 
1 1 1 -6  7   10 o 18 3.55020e+01 6.14819e-01 6.58804e+02 327.282 5.61786e+01  -3.60907e+01 0.00000e+00 0.00000e+00 6.61458e+02 327.282 2.65372e+00 327.282 0.9925 
1 1 1 -6  7   11 o 19 9.36140e+00 4.54041e-01 1.42936e+02 105.511 -1.55187e+00 5.59151e+00  0.00000e+00 0.00000e+00 1.75698e+02 105.511 3.27626e+01 105.511 0.9092 
1 1 1 -6  7   12 o 18 1.90436e+01 4.47113e-01 4.29248e+02 146.574 -4.12684e+01 2.72381e+01  0.00000e+00 0.00000e+00 2.75773e+02 146.574 1.53475e+02 326.574 0.9898 
1 1 1 -6  7   13 o 3  7.51244e+00 5.86098e-01 1.36019e+02 60.813  3.64594e+00  6.52713e+00  0.00000e+00 0.00000e+00 1.25166e+02 60.813  1.08525e+01 240.813 0.9305 
1 1 1 -6  7   14 o 14 1.57500e+01 5.03791e-01 2.36708e+02 60.324  1.82450e+01  3.20183e+01  0.00000e+00 0.00000e+00 3.43117e+02 60.324  1.06409e+02 60.324  0.9863 
1 1 1 -6  7   15 o 11 3.41732e+00 9.23415e-01 7.34122e+01 295.896 1.24051e+00  -2.55518e+00 0.00000e+00 0.00000e+00 2.81874e+01 295.896 4.52248e+01 115.896 0.7975 
1 1 1 -6  7   16 o 13 7.42683e+00 1.00664e+00 1.00761e+02 243.273 -4.21939e+00 -8.37955e+00 0.00000e+00 0.00000e+00 1.60615e+02 243.273 5.98540e+01 243.273 0.9451 
1 1 1 -6  7   17 o 9  4.73607e+00 1.21937e+00 9.71968e+01 38.551  4.75636e+00  3.79031e+00  0.00000e+00 0.00000e+00 6.37275e+01 38.551  3.34693e+01 218.551 0.9136 
1 1 1 -6  7   18 o 13 4.78557e+00 1.35403e+00 8.48569e+01 107.493 -1.62148e+00 5.14493e+00  0.00000e+00 0.00000e+00 7.54349e+01 107.493 9.42200e+00 287.493 0.9018 
1 1 1 -6  7   19 o 18 7.97865e+00 1.68230e+00 8.61046e+01 87.342  3.70386e-01  7.97991e+00  0.00000e+00 0.00000e+00 1.90641e+02 87.342  1.04536e+02 87.342  0.9351 
1 1 1 -6  8   1  o 2  1.52593e+01 4.28012e-01 3.29894e+02 13.872  4.21902e+00  1.04193e+00  0.00000e+00 0.00000e+00 1.73355e+02 13.872  1.56538e+02 193.872 0.8756 
1 1 1 -6  8   2  o 6  1.03568e+01 3.97602e-01 6.32928e+01 123.574 -2.82759e-01 4.26013e-01  0.00000e+00 0.00000e+00 3.32792e+01 123.574 3.00136e+01 303.574 0.2476 
1 1 1 -6  8   3  o 3  1.21639e+01 6.35258e-01 7.34096e+01 320.845 5.86438e-01  -4.77518e-01 0.00000e+00 0.00000e+00 8.84032e+01 320.845 1.49936e+01 320.845 0.3534 
1 1 1 -6  8   4  o 17 2.92020e+01 7.57587e-01 5.56812e+02 331.028 1.28891e+01  -7.13620e+00 0.00000e+00 0.00000e+00 5.03805e+02 331.028 5.30067e+01 151.028 0.9654 
1 1 1 -6  8   5  o 17 1.13899e+01 4.09845e-01 5.51045e+01 324.664 6.18761e-01  -4.38694e-01 0.00000e+00 0.00000e+00 9.66541e+01 324.664 4.15496e+01 324.664 0.3544 
1 1 1 -6  8   6  o 5  1.04005e+01 4.37164e-01 2.83681e+02 268.239 -1.07204e-01 -3.48771e+00 0.00000e+00 0.00000e+00 4.48385e+01 268.239 2.38842e+02 88.239  0.8405 
1 1 1 -6  8   7  o 7  1.50655e+01 6.23067e-01 3.79978e+02 29.219  6.76474e+00  3.78368e+00  0.00000e+00 0.00000e+00 1.47934e+02 29.219  2.32044e+02 209.219 0.9331 
1 1 1 -6  8   8  o 10 4.34548e+01 7.86005e-01 8.39536e+02 145.514 -5.06866e+01 3.48177e+01  0.00000e+00 0.00000e+00 7.77949e+02 145.514 6.15874e+01 325.514 0.9918 
1 1 1 -6  8   9  o 13 1.40130e+01 5.13734e-01 2.42513e+02 192.938 -8.08763e+00 -1.85803e+00 0.00000e+00 0.00000e+00 2.50215e+02 192.938 7.70239e+00 192.938 0.9377 
1 1 1 -6  8   10 o 16 9.38051e+00 4.49955e-01 1.46914e+02 209.468 -3.45474e+00 -1.95208e+00 0.00000e+00 0.00000e+00 1.56162e+02 209.468 9.24757e+00 209.468 0.8623 
1 1 1 -6  8   11 o 13 2.88831e+01 5.32820e-01 4.87671e+02 201.968 -5.62481e+01 -2.26887e+01 0.00000e+00 0.00000e+00 5.84651e+02 201.968 9.69801e+01 201.968 0.9917 
1 1 1 -6  8   12 o 16 1.25632e+01 4.16828e-01 2.34166e+02 297.837 8.32839e+00  -1.57713e+01 0.00000e+00 0.00000e+00 2.22339e+02 297.837 1.18262e+01 117.837 0.9715 
1 1 1 -6  8   13 o 12 1.74708e+01 4.78659e-01 2.94552e+02 214.963 -3.13238e+01 -2.19032e+01 0.00000e+00 0.00000e+00 3.49615e+02 214.963 5.50628e+01 214.963 0.9868 
1 1 1 -6  8   14 o 13 6.28322e+00 7.25970e-01 8.40762e+01 78.474  9.92935e-01  4.86923e+00  0.00000e+00 0.00000e+00 1.25265e+02 78.474  4.11885e+01 78.474  0.8927 
1 1 1 -6  8   15 o 16 9.05415e+00 6.96853e-01 2.12308e+02 110.876 -8.79166e+00 2.30521e+01  0.00000e+00 0.00000e+00 1.18329e+02 110.876 9.39789e+01 290.876 0.9795 
1 1 1 -6  8   16 o 1  2.34612e+01 7.00845e-01 4.47531e+02 266.335 -9.57843e+00 -1.49551e+02 0.00000e+00 0.00000e+00 4.23174e+02 266.335 2.43569e+01 86.335  0.9967 
1 1 1 -6  8   17 o 4  1.48013e+01 8.21873e-01 2.58361e+02 99.564  -1.04810e+01 6.22046e+01  0.00000e+00 0.00000e+00 2.87725e+02 99.564  2.93642e+01 99.564  0.9920 
1 1 1 -6  8   18 o 13 4.65990e+00 1.32426e+00 7.70583e+01 288.806 1.56813e+00  -4.60480e+00 0.00000e+00 0.00000e+00 7.70048e+01 288.806 5.34428e-02 108.806 0.8901 
1 1 1 -6  8   19 o 4  4.68758e+00 1.40586e+00 9.84378e+01 23.140  6.04587e+00  2.58379e+00  0.00000e+00 0.00000e+00 6.15983e+01 23.140  3.68394e+01 203.140 0.9205 
1 1 1 -6  9   1  o 10 9.42645e+00 4.07041e-01 1.92981e+02 150.524 -1.35828e+00 7.67732e-01  0.00000e+00 0.00000e+00 2.38300e+01 150.524 1.69151e+02 330.524 0.6107 
1 1 1 -6  9   2  o 4  9.70891e+00 4.01100e-01 2.62592e+02 319.274 1.49787e+00  -1.28958e+00 0.00000e+00 0.00000e+00 8.94268e+00 139.273 2.71535e+02 139.273 0.6939 
1 1 1 -6  9   3  o 11 1.86052e+01 5.59751e-01 2.82410e+02 58.335  2.47333e+00  4.01008e+00  0.00000e+00 0.00000e+00 3.38159e+02 58.335  5.57485e+01 58.335  0.8862 
1 1 1 -6  9   4  o 15 2.17731e+01 5.13131e-01 3.58167e+02 276.778 8.35185e-01  -7.02667e+00 0.00000e+00 0.00000e+00 4.00612e+02 276.778 4.24444e+01 276.778 0.9264 
1 1 1 -6  9   5  o 15 2.56631e+01 5.66915e-01 5.97342e+02 263.198 -2.18033e+00 -1.82786e+01 0.00000e+00 0.00000e+00 3.40998e+02 263.198 2.56344e+02 83.198  0.9724 
1 1 1 -6  9   6  o 5  1.25670e+01 4.30110e-01 2.56086e+02 82.490  5.19323e-01  3.93915e+00  0.00000e+00 0.00000e+00 1.51217e+02 82.490  1.04869e+02 262.490 0.8625 
1 1 1 -6  9   7  o 3  2.99831e+01 5.85615e-01 5.80922e+02 356.477 2.35323e+01  -1.44872e+00 0.00000e+00 0.00000e+00 5.20922e+02 356.477 6.00002e+01 176.477 0.9786 
1 1 1 -6  9   8  o 6  2.20111e+01 4.83778e-01 4.41991e+02 277.151 2.08561e+00  -1.66245e+01 0.00000e+00 0.00000e+00 3.58992e+02 277.151 8.29999e+01 97.151  0.9697 
1 1 1 -6  9   9  o 19 2.20653e+01 4.92042e-01 3.37035e+02 129.069 -1.13074e+01 1.39290e+01  0.00000e+00 0.00000e+00 4.66994e+02 129.069 1.29959e+02 129.069 0.9717 
1 1 1 -6  9   10 o 15 2.20375e+01 4.56510e-01 4.78019e+02 318.968 2.28500e+01  -1.98856e+01 0.00000e+00 0.00000e+00 3.33943e+02 318.968 1.44076e+02 138.968 0.9834 
1 1 1 -6  9   11 o 14 2.66415e+01 5.05686e-01 4.48478e+02 64.273  2.23630e+01  4.64107e+01  0.00000e+00 0.00000e+00 5.39127e+02 64.273  9.06490e+01 64.273  0.9902 
1 1 1 -6  9   12 o 5  1.09079e+01 4.15610e-01 1.33988e+02 129.280 -5.60590e+00 6.85384e+00  0.00000e+00 0.00000e+00 2.50190e+02 129.280 1.16201e+02 129.280 0.9417 
1 1 1 -6  9   13 o 8  1.56926e+01 4.67043e-01 3.82219e+02 340.894 4.21253e+01  -1.45924e+01 0.00000e+00 0.00000e+00 1.97479e+02 340.894 1.84740e+02 160.894 0.9887 
1 1 1 -6  9   14 f 0  8.65960e+00 5.61140e-01 2.32028e+02 56.662  1.07849e+01  1.63949e+01  0.00000e+00 0.00000e+00 8.28245e+01 56.662  1.49204e+02 236.662 0.9742 
1 1 1 -6  9   15 o 3  1.49107e+01 5.81870e-01 2.52777e+02 245.148 -2.10628e+01 -4.54754e+01 0.00000e+00 0.00000e+00 2.97528e+02 245.148 4.47508e+01 245.148 0.9900 
1 1 1 -6  9   16 o 12 6.73132e+00 1.02032e+00 1.46634e+02 162.650 -1.17288e+01 3.66429e+00  0.00000e+00 0.00000e+00 9.35883e+01 162.650 5.30456e+01 342.650 0.9584 
1 1 1 -6  9   17 o 5  8.11220e+00 1.06102e+00 1.18365e+02 66.351  5.58076e+00  1.27440e+01  0.00000e+00 0.00000e+00 1.72272e+02 66.351  5.39068e+01 66.351  0.9634 
1 1 1 -6  9   18 o 17 3.40989e+00 1.11678e+00 2.39478e+01 197.266 -1.21024e+00 -3.76170e-01 0.00000e+00 0.00000e+00 4.35736e+01 197.266 1.96258e+01 197.266 0.5332 
1 1 1 -6  9   19 o 5  4.74523e+00 1.61556e+00 2.23377e+02 292.513 4.95250e+00  -1.19488e+01 0.00000e+00 0.00000e+00 5.43230e+01 112.513 2.77700e+02 112.513 0.9605 
1 1 1 -6  10  1  o 8  1.65441e+01 4.42014e-01 3.47942e+02 291.827 1.82126e+00  -4.54730e+00 0.00000e+00 0.00000e+00 2.07222e+02 291.827 1.40720e+02 111.827 0.8910 
1 1 1 -6  10  2  o 18 1.69745e+01 4.46343e-01 3.38922e+02 234.845 -2.54975e+00 -3.62057e+00 0.00000e+00 0.00000e+00 2.22322e+02 234.845 1.16599e+02 54.845  0.8782 
1 1 1 -6  10  3  o 4  1.51879e+01 4.29755e-01 2.77858e+02 28.074  3.32791e+00  1.77502e+00  0.00000e+00 0.00000e+00 2.10365e+02 28.074  6.74932e+01 208.074 0.8541 
1 1 1 -6  10  4  o 4  3.80481e+00 5.83929e-01 5.42378e+01 256.841 -4.23949e-02 -1.81330e-01 0.00000e+00 0.00000e+00 4.09684e+01 76.841  9.52062e+01 76.841  0.0927 
1 1 1 -6  10  5  o 12 3.14585e+01 6.60545e-01 6.26774e+02 21.238  2.19427e+01  8.52791e+00  0.00000e+00 0.00000e+00 5.30628e+02 21.238  9.61461e+01 201.238 0.9785 
1 1 1 -6  10  6  o 17 1.87822e+01 4.84065e-01 2.89229e+02 11.339  6.55386e+00  1.31427e+00  0.00000e+00 0.00000e+00 3.61379e+02 11.339  7.21501e+01 11.339  0.9218 
1 1 1 -6  10  7  o 2  1.53362e+01 4.91483e-01 4.14132e+02 94.383  -6.57660e-01 8.58046e+00  0.00000e+00 0.00000e+00 1.27215e+02 94.383  2.86918e+02 274.383 0.9400 
1 1 1 -6  10  8  o 17 2.73914e+01 5.52840e-01 4.34711e+02 78.727  3.99634e+00  2.00490e+01  0.00000e+00 0.00000e+00 5.67735e+02 78.727  1.33024e+02 78.727  0.9752 
1 1 1 -6  10  9  o 2  4.23547e+01 7.70676e-01 6.96997e+02 68.733  2.54051e+01  6.52727e+01  0.00000e+00 0.00000e+00 8.79849e+02 68.733  1.82853e+02 68.733  0.9928 
1 1 1 -6  10  10 o 11 1.32197e+01 4.41773e-01 2.26447e+02 246.309 -3.90171e+00 -8.89223e+00 0.00000e+00 0.00000e+00 2.42619e+02 246.309 1.61716e+01 246.309 0.9470 
1 1 1 -6  10  11 o 19 5.31715e+00 6.01879e-01 8.58820e+01 298.866 9.41457e-01  -1.70786e+00 0.00000e+00 0.00000e+00 5.13424e+01 298.866 3.45396e+01 118.866 0.6894 
1 1 1 -6  10  12 o 7  2.81857e+00 7.02791e-01 1.02912e+02 271.625 4.62749e-02  -1.63116e+00 0.00000e+00 0.00000e+00 3.68119e+01 91.625  1.39724e+02 91.625  0.6271 
1 1 1 -6  10  13 o 10 8.09934e+00 5.15081e-01 1.29797e+02 333.687 7.36691e+00  -3.64308e+00 0.00000e+00 0.00000e+00 1.53750e+02 333.687 2.39528e+01 333.687 0.9370 
1 1 1 -6  10  14 o 18 1.49825e+01 4.89971e-01 1.57419e+02 293.316 9.23914e+00  -2.14362e+01 0.00000e+00 0.00000e+00 3.89640e+02 293.316 2.32221e+02 293.316 0.9783 
1 1 1 -6  10  15 o 4  3.66966e+00 9.38015e-01 5.62709e+01 12.783  2.35987e+00  5.35399e-01  0.00000e+00 0.00000e+00 4.71506e+01 12.783  9.12025e+00 192.783 0.7560 
1 1 1 -6  10  16 o 6  1.34394e+01 6.72487e-01 2.67949e+02 231.424 -3.23596e+01 -4.05705e+01 0.00000e+00 0.00000e+00 2.27624e+02 231.424 4.03248e+01 51.424  0.9903 
1 1 1 -6  10  17 o 19 1.88619e+01 1.72538e+00 2.52569e+02 27.388  4.08825e+01  2.11811e+01  0.00000e+00 0.00000e+00 4.41219e+02 27.388  1.88650e+02 27.388  0.9891 
1 1 1 -6  10  18 o 5  4.37840e+00 1.47340e+00 1.17459e+02 309.866 4.03938e+00  -4.83679e+00 0.00000e+00 0.00000e+00 3.16263e+01 309.866 8.58323e+01 129.866 0.9168 
1 1 1 -6  10  19 o 10 5.85652e+00 1.80886e+00 1.20571e+02 138.417 -5.58122e+00 4.95226e+00  0.00000e+00 0.00000e+00 8.15134e+01 138.417 3.90571e+01 318.417 0.9304 
1 1 1 -6  11  1  o 3  2.25694e+01 5.22891e-01 5.75961e+02 29.523  8.84832e+00  5.01089e+00  0.00000e+00 0.00000e+00 2.31097e+02 29.523  3.44864e+02 209.523 0.9495 
1 1 1 -6  11  2  o 13 1.73560e+01 4.53811e-01 3.17152e+02 203.093 -3.86961e+00 -1.64997e+00 0.00000e+00 0.00000e+00 2.52007e+02 203.093 6.51449e+01 23.093  0.8710 
1 1 1 -6  11  3  o 15 5.71578e+00 8.07357e-01 1.45324e+02 51.682  4.54065e-01  5.74577e-01  0.00000e+00 0.00000e+00 7.14059e+01 231.682 2.16730e+02 231.682 0.3436 
1 1 1 -6  11  4  o 3  1.75120e+01 5.64015e-01 4.00938e+02 190.451 -6.20513e+00 -1.14458e+00 0.00000e+00 0.00000e+00 2.03083e+02 190.451 1.97855e+02 10.451  0.9169 
1 1 1 -6  11  5  o 5  2.03629e+01 4.92144e-01 5.19640e+02 141.396 -9.88252e+00 7.89019e+00  0.00000e+00 0.00000e+00 2.15036e+02 141.396 3.04604e+02 321.396 0.9596 
1 1 1 -6  11  6  o 6  3.68185e+00 6.75716e-01 1.24538e+02 246.262 -2.25427e-01 -5.12621e-01 0.00000e+00 0.00000e+00 8.72435e+01 66.262  2.11781e+02 66.262  0.2696 
1 1 1 -6  11  7  o 1  7.79787e+00 4.43046e-01 2.09298e+02 173.282 -2.58768e+00 3.04804e-01  0.00000e+00 0.00000e+00 1.79373e+01 173.282 1.91360e+02 353.282 0.7760 
1 1 1 -6  11  8  o 7  8.11500e+00 5.89549e-01 2.62984e+02 232.528 -2.22421e+00 -2.90159e+00 0.00000e+00 0.00000e+00 4.48991e+00 52.528  2.67474e+02 52.528  0.8489 
1 1 1 -6  11  9  o 1  2.08287e+01 4.73273e-01 2.93885e+02 325.908 1.22171e+01  -8.26900e+00 0.00000e+00 0.00000e+00 4.60177e+02 325.908 1.66292e+02 325.908 0.9655 
1 1 1 -6  11  10 o 15 1.87849e+01 4.30732e-01 3.99876e+02 243.527 -1.08554e+01 -2.17980e+01 0.00000e+00 0.00000e+00 2.89321e+02 243.527 1.10555e+02 63.527  0.9792 
1 1 1 -6  11  11 o 14 2.50842e+01 4.83696e-01 4.42921e+02 28.085  4.22461e+01  2.25428e+01  0.00000e+00 0.00000e+00 4.86206e+02 28.085  4.32841e+01 28.085  0.9895 
1 1 1 -6  11  12 o 15 2.41784e+01 4.72998e-01 5.20816e+02 263.701 -7.99086e+00 -7.23894e+01 0.00000e+00 0.00000e+00 3.77176e+02 263.701 1.43640e+02 83.701  0.9931 
1 1 1 -6  11  13 o 2  1.26785e+01 4.55107e-01 2.03302e+02 261.565 -2.97880e+00 -2.00873e+01 0.00000e+00 0.00000e+00 2.58557e+02 261.565 5.52545e+01 261.565 0.9751 
1 1 1 -6  11  14 o 7  1.17223e+01 4.80120e-01 2.19475e+02 240.382 -1.26331e+01 -2.22226e+01 0.00000e+00 0.00000e+00 2.09360e+02 240.382 1.01151e+01 60.383  0.9802 
1 1 1 -6  11  15 o 19 5.69854e+00 8.40550e-01 2.10070e+02 116.861 -6.58452e+00 1.30007e+01  0.00000e+00 0.00000e+00 5.06116e+00 296.861 2.15131e+02 296.861 0.9651 
1 1 1 -6  11  16 o 11 3.81121e+00 1.20730e+00 8.35564e+01 267.084 -1.81479e-01 -3.56226e+00 0.00000e+00 0.00000e+00 3.62871e+01 267.084 4.72693e+01 87.084  0.8445 
1 1 1 -6  11  17 o 16 1.26227e+01 1.48343e+00 2.43677e+02 19.877  3.11433e+01  1.12597e+01  0.00000e+00 0.00000e+00 2.18590e+02 19.877  2.50874e+01 199.877 0.9848 
1 1 1 -6  11  18 o 3  6.82190e+00 1.77493e+00 1.21341e+02 200.054 -7.78965e+00 -2.84350e+00 0.00000e+00 0.00000e+00 1.16209e+02 200.054 5.13245e+00 20.054  0.9376 
1 1 1 -6  11  19 o 8  5.39920e+00 1.74593e+00 9.98172e+01 281.980 1.23593e+00  -5.82481e+00 0.00000e+00 0.00000e+00 8.27356e+01 281.980 1.70816e+01 101.980 0.9116 
1 1 1 -6  12  1  o 7  1.53767e+01 6.50272e-01 3.16232e+02 307.202 2.27588e+00  -2.99808e+00 0.00000e+00 0.00000e+00 1.78195e+02 307.202 1.38037e+02 127.203 0.8538 
1 1 1 -6  12  2  o 8  1.57572e+01 4.34086e-01 3.91649e+02 222.030 -3.95978e+00 -3.56920e+00 0.00000e+00 0.00000e+00 1.42570e+02 222.030 2.49079e+02 42.030  0.9005 
1 1 1 -6  12  3  o 6  1.90549e+01 4.68860e-01 2.38240e+02 45.396  2.81330e+00  2.85249e+00  0.00000e+00 0.00000e+00 3.81165e+02 45.396  1.42925e+02 45.396  0.8638 
1 1 1 -6  12  4  o 9  2.18332e+01 5.09914e-01 4.52476e+02 327.037 8.86530e+00  -5.74904e+00 0.00000e+00 0.00000e+00 3.28914e+02 327.037 1.23562e+02 147.037 0.9514 
1 1 1 -6  12  5  o 14 1.59915e+01 4.38193e-01 3.49277e+02 40.904  4.69593e+00  4.06836e+00  0.00000e+00 0.00000e+00 2.01175e+02 40.904  1.48102e+02 220.904 0.9155 
1 1 1 -6  12  6  o 10 4.39024e+01 8.79832e-01 7.49271e+02 331.620 3.50027e+01  -1.89097e+01 0.00000e+00 0.00000e+00 8.79486e+02 331.620 1.30215e+02 331.620 0.9874 
1 1 1 -6  12  7  o 18 1.23177e+01 4.08895e-01 4.46921e+02 228.857 -5.77327e+00 -6.60798e+00 0.00000e+00 0.00000e+00 1.15936e+01 48.857  4.58515e+02 48.857  0.9412 
1 1 1 -6  12  8  o 1  2.43799e+01 5.10011e-01 4.58202e+02 254.038 -5.27268e+00 -1.84347e+01 0.00000e+00 0.00000e+00 4.32458e+02 254.038 2.57435e+01 74.038  0.9736 
1 1 1 -6  12  9  o 14 1.92971e+01 4.59593e-01 4.19494e+02 263.353 -2.25726e+00 -1.93694e+01 0.00000e+00 0.00000e+00 2.85266e+02 263.353 1.34227e+02 83.353  0.9740 
1 1 1 -6  12  10 f 0  1.02962e+01 4.65886e-01 2.69670e+02 60.359  4.43743e+00  7.79819e+00  0.00000e+00 0.00000e+00 9.39019e+01 60.359  1.75768e+02 240.359 0.9425 
1 1 1 -6  12  11 o 7  1.40791e+01 3.87048e-01 3.17204e+02 164.203 -1.86069e+01 5.26425e+00  0.00000e+00 0.00000e+00 1.95992e+02 164.203 1.21212e+02 344.203 0.9738 
1 1 1 -6  12  12 o 14 1.44649e+01 3.84203e-01 3.37388e+02 39.327  2.19865e+01  1.80129e+01  0.00000e+00 0.00000e+00 1.93949e+02 39.327  1.43439e+02 219.327 0.9822 
1 1 1 -6  12  13 o 6  2.38285e+01 4.98975e-01 3.97141e+02 216.469 -5.95362e+01 -4.40044e+01 0.00000e+00 0.00000e+00 4.87038e+02 216.469 8.98971e+01 216.469 0.9932 
1 1 1 -6  12  14 o 11 6.13015e+00 7.44517e-01 1.52490e+02 146.075 -7.26464e+00 4.88626e+00  0.00000e+00 0.00000e+00 6.27912e+01 146.075 8.96993e+01 326.075 0.9410 
1 1 1 -6  12  15 f 0  4.24735e+00 1.55344e+00 2.07219e+02 1.999   7.71576e+00  2.69300e-01  0.00000e+00 0.00000e+00 5.95307e+01 181.999 2.66750e+02 181.999 0.9328 
1 1 1 -6  12  16 o 5  4.01803e+00 1.25544e+00 1.13968e+02 57.414  2.69471e+00  4.21584e+00  0.00000e+00 0.00000e+00 1.96972e+01 57.414  9.42704e+01 237.414 0.8935 
1 1 1 -6  12  17 o 16 1.68090e+01 1.40169e+00 2.73436e+02 300.413 2.62812e+01  -4.47724e+01 0.00000e+00 0.00000e+00 3.45582e+02 300.413 7.21457e+01 300.413 0.9903 
1 1 1 -6  12  18 o 16 5.23544e+00 1.64552e+00 1.13600e+02 94.889  -5.24414e-01 6.13118e+00  0.00000e+00 0.00000e+00 6.42431e+01 94.889  4.93572e+01 274.889 0.9147 
1 1 1 -6  12  19 o 1  6.36285e+00 1.90205e+00 1.00646e+02 86.398  3.97928e-01  6.32213e+00  0.00000e+00 0.00000e+00 1.15808e+02 86.398  1.51625e+01 86.398  0.9173 
1 1 1 -6  13  1  o 3  1.23924e+01 4.12838e-01 1.97174e+02 71.380  6.00890e-01  1.78341e+00  0.00000e+00 0.00000e+00 1.18959e+02 71.380  7.82148e+01 251.380 0.6774 
1 1 1 -6  13  2  o 18 2.23244e+01 5.18225e-01 5.68538e+02 30.159  9.39332e+00  5.45815e+00  0.00000e+00 0.00000e+00 2.32234e+02 30.159  3.36304e+02 210.159 0.9528 
1 1 1 -6  13  3  o 6  2.02292e+01 4.84696e-01 4.80392e+02 246.784 -3.69555e+00 -8.61570e+00 0.00000e+00 0.00000e+00 2.39046e+02 246.784 2.41346e+02 66.784  0.9451 
1 1 1 -6  13  4  o 15 2.26071e+01 5.20433e-01 4.88549e+02 101.895 -2.42211e+00 1.14986e+01  0.00000e+00 0.00000e+00 3.24781e+02 101.895 1.63769e+02 281.895 0.9565 
1 1 1 -6  13  5  o 17 2.81461e+01 6.99586e-01 5.34311e+02 71.889  5.14903e+00  1.57431e+01  0.00000e+00 0.00000e+00 4.91392e+02 71.889  4.29194e+01 251.889 0.9693 
1 1 1 -6  13  6  o 19 1.23333e+01 4.23001e-01 1.71815e+02 212.392 -2.34130e+00 -1.48536e+00 0.00000e+00 0.00000e+00 1.95048e+02 212.392 2.32329e+01 212.392 0.7917 
1 1 1 -6  13  7  o 5  2.70757e+01 7.03305e-01 4.14887e+02 206.985 -1.57601e+01 -8.02486e+00 0.00000e+00 0.00000e+00 5.72618e+02 206.985 1.57731e+02 206.985 0.9713 
1 1 1 -6  13  8  o 1  1.74853e+01 4.41194e-01 4.05562e+02 148.529 -1.27525e+01 7.80596e+00  0.00000e+00 0.00000e+00 2.28208e+02 148.529 1.77354e+02 328.529 0.9660 
1 1 1 -6  13  9  o 15 1.01895e+01 5.09663e-01 9.59715e+01 34.514  2.16170e+00  1.48646e+00  0.00000e+00 0.00000e+00 2.01182e+02 34.514  1.05210e+02 34.514  0.7778 
1 1 1 -6  13  10 o 17 1.10036e+01 4.19837e-01 1.85405e+02 322.487 5.23482e+00  -4.01874e+00 0.00000e+00 0.00000e+00 1.94169e+02 322.487 8.76400e+00 322.487 0.9208 
1 1 1 -6  13  11 o 17 3.98802e+00 6.65901e-01 8.68687e+01 138.785 -1.10072e+00 9.64121e-01  0.00000e+00 0.00000e+00 7.43159e-01 138.785 8.61255e+01 318.785 0.5869 
1 1 1 -6  13  12 o 7  1.29987e+01 3.68819e-01 3.45689e+02 36.600  2.10073e+01  1.56015e+01  0.00000e+00 0.00000e+00 1.31022e+02 36.600  2.14667e+02 216.600 0.9807 
1 1 1 -6  13  13 o 5  1.16255e+01 6.17606e-01 2.04824e+02 159.041 -1.70496e+01 6.53067e+00  0.00000e+00 0.00000e+00 2.17414e+02 159.041 1.25905e+01 159.041 0.9722 
1 1 1 -6  13  14 o 11 5.87456e+00 1.02320e+00 8.89189e+01 30.421  3.88128e+00  2.27906e+00  0.00000e+00 0.00000e+00 1.04079e+02 30.421  1.51605e+01 30.421  0.8804 
1 1 1 -6  13  15 o 12 9.66572e+00 8.71871e-01 1.14288e+02 124.179 -7.44973e+00 1.09705e+01  0.00000e+00 0.00000e+00 2.32148e+02 124.179 1.17860e+02 124.179 0.9615 
1 1 1 -6  13  16 o 6  5.50501e+00 1.48312e+00 8.25616e+01 33.482  3.67445e+00  2.43044e+00  0.00000e+00 0.00000e+00 9.72887e+01 33.482  1.47271e+01 33.482  0.8775 
1 1 1 -6  13  17 f 0  1.06543e+01 1.45884e+00 1.87792e+02 215.429 -1.77964e+01 -1.26607e+01 0.00000e+00 0.00000e+00 1.99212e+02 215.429 1.14200e+01 215.429 0.9768 
1 1 1 -6  13  18 f 0  6.08329e+00 1.76590e+00 1.17105e+01 90.722  -8.60165e-03 6.82846e-01  0.00000e+00 0.00000e+00 6.12539e+01 90.722  4.95434e+01 90.722  0.3230 
1 1 1 -6  13  19 o 15 4.32567e+00 1.50046e+00 5.90295e+01 234.909 -1.94610e+00 -2.76998e+00 0.00000e+00 0.00000e+00 7.49015e+01 234.909 1.58720e+01 234.909 0.8349 
1 1 1 -6  14  1  o 19 2.26261e+01 5.02116e-01 3.36868e+02 50.635  3.68547e+00  4.49231e+00  0.00000e+00 0.00000e+00 4.37910e+02 50.635  1.01042e+02 50.635  0.9093 
1 1 1 -6  14  2  o 6  1.13400e+01 4.04024e-01 4.68039e+02 272.534 1.99599e-01  -4.50932e+00 0.00000e+00 0.00000e+00 9.20564e+01 92.534  5.60095e+02 92.534  0.8807 
1 1 1 -6  14  3  o 5  1.18773e+01 3.98465e-01 2.71205e+02 120.717 -1.57859e+00 2.65681e+00  0.00000e+00 0.00000e+00 9.37074e+01 120.717 1.77498e+02 300.717 0.8165 
1 1 1 -6  14  4  o 8  2.01380e+01 6.66225e-01 1.97300e+02 183.042 -4.18486e+00 -2.22392e-01 0.00000e+00 0.00000e+00 4.62048e+02 183.042 2.64748e+02 183.042 0.8705 
1 1 1 -6  14  5  o 8  1.68172e+01 6.81849e-01 3.84208e+02 293.911 2.87478e+00  -6.48390e+00 0.00000e+00 0.00000e+00 2.01581e+02 293.911 1.82627e+02 113.911 0.9266 
1 1 1 -6  14  6  o 10 7.97794e+00 4.55520e-01 2.99967e+02 239.440 -1.58670e+00 -2.68721e+00 0.00000e+00 0.00000e+00 5.46149e+01 59.440  3.54582e+02 59.440  0.8185 
1 1 1 -6  14  7  o 9  2.39601e+01 5.06263e-01 5.60843e+02 280.559 3.82073e+00  -2.04966e+01 0.00000e+00 0.00000e+00 3.16967e+02 280.559 2.43876e+02 100.559 0.9757 
1 1 1 -6  14  8  o 5  5.56585e+00 7.87215e-01 6.41542e+01 8.066   7.31748e-01  1.03699e-01  0.00000e+00 0.00000e+00 8.18816e+00 8.066   5.59660e+01 188.066 0.3464 
1 1 1 -6  14  9  o 19 2.62427e+01 5.37518e-01 4.34758e+02 129.837 -1.95531e+01 2.34372e+01  0.00000e+00 0.00000e+00 5.32912e+02 129.837 9.81536e+01 129.837 0.9835 
1 1 1 -6  14  10 o 19 5.74052e+01 9.28194e-01 1.03654e+03 247.670 -6.80128e+01 -1.65585e+02 0.00000e+00 0.00000e+00 1.10798e+03 247.670 7.14371e+01 247.670 0.9972 
1 1 1 -6  14  11 o 2  1.01018e+01 3.81128e-01 1.35049e+02 10.797  5.78844e+00  1.10389e+00  0.00000e+00 0.00000e+00 2.09276e+02 10.797  7.42273e+01 10.797  0.9107 
1 1 1 -6  14  12 o 5  1.97611e+01 5.14357e-01 2.87465e+02 316.870 2.40311e+01  -2.25112e+01 0.00000e+00 0.00000e+00 4.40175e+02 316.870 1.52710e+02 316.870 0.9847 
1 1 1 -6  14  13 o 5  1.07428e+01 4.58211e-01 1.83414e+02 144.489 -1.36961e+01 9.77320e+00  0.00000e+00 0.00000e+00 2.05785e+02 144.489 2.23702e+01 144.489 0.9698 
1 1 1 -6  14  14 o 19 4.94840e+00 1.05890e+00 7.43942e+01 322.949 2.74128e+00  -2.06950e+00 0.00000e+00 0.00000e+00 8.02790e+01 322.949 5.88480e+00 322.949 0.8376 
1 1 1 -6  14  15 o 2  8.04403e+00 1.03710e+00 1.77173e+02 83.573  1.78793e+00  1.58729e+01  0.00000e+00 0.00000e+00 1.13122e+02 83.573  6.40514e+01 263.573 0.9682 
1 1 1 -6  14  16 o 1  1.01215e+01 1.39025e+00 1.42592e+02 230.433 -9.35799e+00 -1.13250e+01 0.00000e+00 0.00000e+00 2.21173e+02 230.433 7.85811e+01 230.433 0.9653 
1 1 1 -6  14  17 o 16 5.53424e+00 1.48111e+00 7.47141e+01 248.602 -1.62446e+00 -4.14546e+00 0.00000e+00 0.00000e+00 1.06152e+02 248.602 3.14382e+01 248.602 0.8789 
1 1 1 -6  14  18 o 2  5.02250e+00 1.61956e+00 7.97741e+01 75.559  1.04997e+00  4.07725e+00  0.00000e+00 0.00000e+00 8.27043e+01 75.559  2.93020e+00 75.559  0.8711 
1 1 1 -6  14  19 o 3  6.17119e+00 1.83929e+00 7.30225e+01 230.511 -2.97140e+00 -3.60600e+00 0.00000e+00 0.00000e+00 1.29556e+02 230.511 5.65335e+01 230.511 0.8852 
1 1 1 -6  15  1  o 14 2.13601e+01 4.86720e-01 3.85209e+02 151.134 -6.19713e+00 3.41625e+00  0.00000e+00 0.00000e+00 3.59915e+02 151.134 2.52939e+01 331.134 0.9264 
1 1 1 -6  15  2  o 3  2.93067e+01 5.93967e-01 5.51494e+02 324.102 1.16952e+01  -8.46530e+00 0.00000e+00 0.00000e+00 5.12802e+02 324.102 3.86920e+01 144.102 0.9647 
1 1 1 -6  15  3  o 12 1.04128e+01 4.48936e-01 2.52404e+02 69.549  8.74142e-01  2.34410e+00  0.00000e+00 0.00000e+00 4.74147e+01 69.549  2.04989e+02 249.549 0.7652 
1 1 1 -6  15  4  o 13 1.93041e+01 4.77482e-01 4.33445e+02 59.706  4.43817e+00  7.59699e+00  0.00000e+00 0.00000e+00 2.50017e+02 59.706  1.83428e+02 239.706 0.9413 
1 1 1 -6  15  5  o 14 2.00289e+01 4.85004e-01 2.67495e+02 140.662 -5.46557e+00 4.47964e+00  0.00000e+00 0.00000e+00 4.29926e+02 140.662 1.62431e+02 140.662 0.9263 
1 1 1 -6  15  6  o 1  5.53655e+01 9.80470e-01 8.07672e+02 58.748  2.96226e+01  4.88134e+01  0.00000e+00 0.00000e+00 1.25415e+03 58.748  4.46475e+02 58.748  0.9912 
1 1 1 -6  15  7  o 1  2.03585e+01 5.77644e-01 4.65653e+02 117.693 -6.80281e+00 1.29611e+01  0.00000e+00 0.00000e+00 2.72150e+02 117.693 1.93503e+02 297.693 0.9652 
1 1 1 -6  15  8  o 8  3.46659e+01 6.55944e-01 6.83966e+02 199.040 -4.66422e+01 -1.60969e+01 0.00000e+00 0.00000e+00 6.03461e+02 199.040 8.05048e+01 19.040  0.9898 
1 1 1 -6  15  9  o 19 2.49656e+01 5.20126e-01 3.34663e+02 101.960 -4.62951e+00 2.18560e+01  0.00000e+00 0.00000e+00 5.80147e+02 101.960 2.45484e+02 101.960 0.9774 
1 1 1 -6  15  10 o 13 2.25258e+01 4.58851e-01 3.42973e+02 245.561 -9.96681e+00 -2.19325e+01 0.00000e+00 0.00000e+00 4.83162e+02 245.561 1.40189e+02 245.561 0.9790 
1 1 1 -6  15  11 o 1  8.47571e+00 4.17811e-01 1.52126e+02 57.520  3.07998e+00  4.83839e+00  0.00000e+00 0.00000e+00 1.35931e+02 57.520  1.61951e+01 237.520 0.9080 
1 1 1 -6  15  12 f 0  2.13732e+01 5.11286e-01 2.06576e+02 343.234 2.44857e+01  -7.37661e+00 0.00000e+00 0.00000e+00 5.76838e+02 343.234 3.70262e+02 343.234 0.9802 
1 1 1 -6  15  13 o 12 1.04575e+01 7.83678e-01 1.57691e+02 220.726 -1.00114e+01 -8.61922e+00 0.00000e+00 0.00000e+00 2.17858e+02 220.726 6.01663e+01 220.726 0.9614 
1 1 1 -6  15  14 o 5  8.21637e+00 9.54408e-01 1.40677e+02 52.118  6.86740e+00  8.82740e+00  0.00000e+00 0.00000e+00 1.51873e+02 52.118  1.11964e+01 52.118  0.9542 
1 1 1 -6  15  15 o 15 9.12758e+00 9.96299e-01 1.40491e+02 244.151 -6.37358e+00 -1.31557e+01 0.00000e+00 0.00000e+00 1.87871e+02 244.151 4.73807e+01 244.151 0.9652 
1 1 1 -6  15  16 o 5  7.53057e+00 1.33580e+00 1.25160e+02 61.111  5.26005e+00  9.53275e+00  0.00000e+00 0.00000e+00 1.41992e+02 61.111  1.68317e+01 61.111  0.9529 
1 1 1 -6  15  17 o 12 4.20655e+00 1.35992e+00 1.14865e+02 344.131 5.70097e+00  -1.62064e+00 0.00000e+00 0.00000e+00 2.76558e+01 344.131 8.72093e+01 164.131 0.9112 
1 1 1 -6  15  18 o 8  4.60978e+00 1.53903e+00 1.16721e+02 70.200  2.09398e+00  5.81629e+00  0.00000e+00 0.00000e+00 3.99222e+01 70.200  7.67990e+01 250.200 0.9151 
1 1 1 -6  15  19 o 1  6.31653e+00 1.91986e+00 1.30741e+02 282.924 1.80908e+00  -7.88389e+00 0.00000e+00 0.00000e+00 8.84957e+01 282.924 4.22454e+01 102.924 0.9360 
1 1 1 -6  16  1  o 1  2.47365e+01 5.56256e-01 5.83031e+02 94.906  -1.04943e+00 1.22266e+01  0.00000e+00 0.00000e+00 3.09617e+02 94.906  2.73414e+02 274.906 0.9583 
1 1 1 -6  16  2  o 15 3.00057e+01 8.02010e-01 3.32967e+02 190.218 -8.66551e+00 -1.56191e+00 0.00000e+00 0.00000e+00 7.30299e+02 190.218 3.97332e+02 190.218 0.9414 
1 1 1 -6  16  3  f 0  8.72962e+00 3.79040e-01 7.88542e+01 186.046 -6.25483e-01 -6.62476e-02 0.00000e+00 0.00000e+00 1.96543e+01 186.046 5.91999e+01 6.046   0.2999 
1 1 1 -6  16  4  o 3  3.39511e+01 8.84237e-01 5.97775e+02 140.605 -1.62190e+01 1.33200e+01  0.00000e+00 0.00000e+00 6.48331e+02 140.605 5.05553e+01 140.605 0.9759 
1 1 1 -6  16  5  o 4  2.11838e+01 5.93488e-01 2.84613e+02 95.592  -7.69223e-01 7.85713e+00  0.00000e+00 0.00000e+00 4.59411e+02 95.592  1.74798e+02 95.592  0.9343 
1 1 1 -6  16  6  o 8  2.44367e+01 5.10739e-01 3.03789e+02 49.881  6.13127e+00  7.27610e+00  0.00000e+00 0.00000e+00 5.64602e+02 49.881  2.60813e+02 49.881  0.9459 
1 1 1 -6  16  7  f 0  2.57070e+01 6.14699e-01 4.18739e+02 233.319 -9.88947e+00 -1.32771e+01 0.00000e+00 0.00000e+00 5.16811e+02 233.319 9.80711e+01 233.319 0.9693 
1 1 1 -6  16  8  o 17 1.02544e+01 6.13623e-01 2.09634e+02 158.290 -4.16320e+00 1.65760e+00  0.00000e+00 0.00000e+00 1.28841e+02 158.290 8.07928e+01 338.290 0.8798 
1 1 1 -6  16  9  o 1  2.66115e+01 5.20950e-01 5.57478e+02 302.586 2.08971e+01  -3.26928e+01 0.00000e+00 0.00000e+00 4.27252e+02 302.586 1.30227e+02 122.587 0.9870 
1 1 1 -6  16  10 o 8  3.74953e+01 6.65636e-01 7.02843e+02 146.322 -6.96812e+01 4.64335e+01  0.00000e+00 0.00000e+00 6.93295e+02 146.322 9.54746e+00 326.322 0.9940 
1 1 1 -6  16  11 o 10 1.15125e+01 3.93614e-01 1.29185e+02 286.822 1.91491e+00  -6.33379e+00 0.00000e+00 0.00000e+00 2.67643e+02 286.822 1.38458e+02 286.822 0.9210 
1 1 1 -6  16  12 o 18 9.54667e+00 7.93185e-01 2.13470e+02 320.787 8.78503e+00  -7.16814e+00 0.00000e+00 0.00000e+00 1.27366e+02 320.787 8.61041e+01 140.787 0.9548 
1 1 1 -6  16  13 o 2  1.48591e+01 7.23972e-01 2.75688e+02 30.445  2.86358e+01  1.68306e+01  0.00000e+00 0.00000e+00 2.70930e+02 30.445  4.75773e+00 210.445 0.9848 
1 1 1 -6  16  14 o 16 2.94383e+00 9.06632e-01 7.35474e+01 216.072 -1.71924e+00 -1.25241e+00 0.00000e+00 0.00000e+00 5.27418e+00 216.072 6.82732e+01 36.072  0.7176 
1 1 1 -6  16  15 o 5  3.77893e+00 1.00913e+00 4.72225e+01 345.436 1.86037e+00  -4.83333e-01 0.00000e+00 0.00000e+00 4.91955e+01 345.436 1.97304e+00 345.436 0.6846 
1 1 1 -6  16  16 o 11 6.11239e+00 1.49723e+00 1.08838e+02 91.924  -2.34834e-01 6.99084e+00  0.00000e+00 0.00000e+00 1.01751e+02 91.924  7.08608e+00 271.924 0.9255 
1 1 1 -6  16  17 o 4  1.30286e+01 1.65421e+00 2.11437e+02 286.844 8.14052e+00  -2.68888e+01 0.00000e+00 0.00000e+00 2.64273e+02 286.844 5.28361e+01 286.844 0.9820 
1 1 1 -6  16  18 o 13 4.73059e+00 1.52837e+00 1.20716e+02 295.007 2.79144e+00  -5.98441e+00 0.00000e+00 0.00000e+00 4.10316e+01 295.007 7.96842e+01 115.007 0.9208 
1 1 1 -6  16  19 o 7  6.17519e+00 1.94179e+00 1.23029e+02 108.450 -2.29782e+00 6.88750e+00  0.00000e+00 0.00000e+00 8.95438e+01 108.450 3.34848e+01 288.450 0.9283 
1 1 1 -6  17  1  o 6  1.56963e+01 5.36915e-01 1.52931e+02 327.546 1.81426e+00  -1.15377e+00 0.00000e+00 0.00000e+00 2.73153e+02 327.546 1.20222e+02 327.546 0.7209 
1 1 1 -6  17  2  o 15 1.39709e+01 3.99474e-01 3.55316e+02 255.066 -1.12659e+00 -4.22407e+00 0.00000e+00 0.00000e+00 1.05575e+02 255.066 2.49741e+02 75.066  0.8764 
1 1 1 -6  17  3  o 18 1.35259e+01 3.93190e-01 2.44080e+02 200.898 -2.79666e+00 -1.06783e+00 0.00000e+00 0.00000e+00 1.67898e+02 200.898 7.61819e+01 20.898  0.8095 
1 1 1 -6  17  4  o 17 3.34268e+01 6.54558e-01 6.33072e+02 59.348  1.11676e+01  1.88440e+01  0.00000e+00 0.00000e+00 5.95018e+02 59.348  3.80536e+01 239.348 0.9769 
1 1 1 -6  17  5  o 12 2.11769e+01 6.21926e-01 2.93822e+02 239.207 -4.14881e+00 -6.96157e+00 0.00000e+00 0.00000e+00 4.51333e+02 239.207 1.57511e+02 239.207 0.9361 
1 1 1 -6  17  6  o 17 2.35386e+01 4.74051e-01 5.57418e+02 66.001  6.82243e+00  1.53241e+01  0.00000e+00 0.00000e+00 3.00087e+02 66.001  2.57331e+02 246.001 0.9697 
1 1 1 -6  17  7  o 3  1.09467e+01 3.94753e-01 3.36698e+02 87.144  3.49307e-01  7.00267e+00  0.00000e+00 0.00000e+00 4.37248e+01 87.144  2.92973e+02 267.144 0.9257 
1 1 1 -6  17  8  o 3  2.59603e+01 5.58161e-01 5.05964e+02 191.631 -2.68316e+01 -5.52273e+00 0.00000e+00 0.00000e+00 4.50044e+02 191.631 5.59195e+01 11.631  0.9816 
1 1 1 -6  17  9  o 8  1.55329e+01 5.02362e-01 2.75547e+02 334.866 1.01321e+01  -4.75364e+00 0.00000e+00 0.00000e+00 2.80102e+02 334.866 4.55570e+00 334.866 0.9542 
1 1 1 -6  17  10 o 10 2.01893e+01 4.48441e-01 3.63097e+02 291.268 8.55483e+00  -2.19786e+01 0.00000e+00 0.00000e+00 3.76938e+02 291.268 1.38405e+01 291.268 0.9786 
1 1 1 -6  17  11 o 14 8.86738e+00 3.77657e-01 1.11185e+02 19.418  4.13484e+00  1.45756e+00  0.00000e+00 0.00000e+00 1.79798e+02 19.418  6.86130e+01 19.418  0.8768 
1 1 1 -6  17  12 o 1  2.79506e+01 8.07859e-01 4.99723e+02 298.850 3.98245e+01  -7.22904e+01 0.00000e+00 0.00000e+00 5.38978e+02 298.850 3.92548e+01 298.850 0.9939 
1 1 1 -6  17  13 o 16 7.80863e+00 8.82336e-01 1.26933e+02 102.658 -1.60863e+00 7.16259e+00  0.00000e+00 0.00000e+00 1.44070e+02 102.658 1.71372e+01 102.658 0.9292 
1 1 1 -6  17  14 o 6  8.64025e+00 9.56298e-01 1.42488e+02 182.035 -1.17046e+01 -4.15947e-01 0.00000e+00 0.00000e+00 1.65810e+02 182.035 2.33219e+01 182.035 0.9563 
1 1 1 -6  17  15 o 6  2.48617e+00 8.30892e-01 8.71778e+01 21.068  2.33016e+00  8.97645e-01  0.00000e+00 0.00000e+00 1.63233e+01 201.068 1.03501e+02 201.068 0.7647 
1 1 1 -6  17  16 o 19 5.09022e+00 1.34487e+00 8.96688e+01 272.905 2.60976e-01  -5.14304e+00 0.00000e+00 0.00000e+00 8.02512e+01 272.905 9.41764e+00 92.905  0.8967 
1 1 1 -6  17  17 o 7  5.47486e+00 1.53372e+00 1.10787e+02 305.192 3.83743e+00  -5.44156e+00 0.00000e+00 0.00000e+00 7.67858e+01 305.192 3.40016e+01 125.192 0.9215 
1 1 1 -6  17  18 o 13 4.67704e+00 1.51253e+00 1.83423e+01 74.420  2.69073e-01  9.64989e-01  0.00000e+00 0.00000e+00 5.92884e+01 74.420  4.09461e+01 74.420  0.4470 
1 1 1 -6  17  19 o 15 4.59885e+00 1.52850e+00 1.17772e+02 147.303 -5.83705e+00 3.74695e+00  0.00000e+00 0.00000e+00 3.99289e+01 147.303 7.78435e+01 327.303 0.9248 
1 1 1 -6  18  1  o 13 1.46827e+01 4.12112e-01 2.54262e+02 328.639 2.83304e+00  -1.72667e+00 0.00000e+00 0.00000e+00 2.05126e+02 328.639 4.91364e+01 148.639 0.8310 
1 1 1 -6  18  2  o 8  2.51677e+01 6.08853e-01 5.89300e+02 45.258  9.99077e+00  1.00811e+01  0.00000e+00 0.00000e+00 3.23974e+02 45.258  2.65326e+02 225.258 0.9641 
1 1 1 -6  18  3  o 6  9.76163e+00 4.62421e-01 2.36481e+02 280.286 3.70597e-01  -2.04208e+00 0.00000e+00 0.00000e+00 2.41999e+01 280.286 2.12282e+02 100.286 0.7098 
1 1 1 -6  18  4  o 8  7.92751e+00 3.89087e-01 2.06330e+02 258.295 -4.01182e-01 -1.93640e+00 0.00000e+00 0.00000e+00 5.84924e-01 258.295 2.05745e+02 78.295  0.6940 
1 1 1 -6  18  5  o 2  2.27670e+01 6.46559e-01 3.16748e+02 188.570 -8.46222e+00 -1.27522e+00 0.00000e+00 0.00000e+00 4.87327e+02 188.570 1.70578e+02 188.570 0.9396 
1 1 1 -6  18  6  o 19 1.49281e+01 3.85211e-01 2.06388e+02 246.570 -1.63011e+00 -3.76158e+00 0.00000e+00 0.00000e+00 2.79948e+02 246.570 7.35598e+01 246.570 0.8672 
1 1 1 -6  18  7  o 10 2.67260e+01 5.13077e-01 4.19672e+02 78.743  4.13611e+00  2.07808e+01  0.00000e+00 0.00000e+00 5.59693e+02 78.743  1.40021e+02 78.743  0.9761 
1 1 1 -6  18  8  o 8  2.80943e+01 6.22567e-01 5.67391e+02 173.837 -3.28858e+01 3.55115e+00  0.00000e+00 0.00000e+00 4.70518e+02 173.837 9.68731e+01 353.837 0.9848 
1 1 1 -6  18  9  o 4  9.54981e+00 4.47495e-01 2.63872e+02 108.727 -2.11843e+00 6.24904e+00  0.00000e+00 0.00000e+00 6.57496e+01 108.727 1.98122e+02 288.727 0.9208 
1 1 1 -6  18  10 o 3  1.23254e+01 4.84151e-01 1.67753e+02 206.647 -5.92094e+00 -2.97113e+00 0.00000e+00 0.00000e+00 2.57473e+02 206.647 8.97194e+01 206.647 0.9211 
1 1 1 -6  18  11 o 12 4.98973e+00 4.33468e-01 1.16576e+02 327.610 2.28070e+00  -1.44683e+00 0.00000e+00 0.00000e+00 3.00425e+01 327.610 8.65337e+01 147.610 0.7852 
1 1 1 -6  18  12 o 1  1.00193e+01 7.59102e-01 2.36048e+02 225.911 -9.79015e+00 -1.01064e+01 0.00000e+00 0.00000e+00 1.24981e+02 225.911 1.11067e+02 45.911  0.9638 
1 1 1 -6  18  13 o 11 7.63030e+00 8.95349e-01 1.38659e+02 1.385   7.79738e+00  1.88551e-01  0.00000e+00 0.00000e+00 1.27380e+02 1.385   1.12793e+01 181.385 0.9335 
1 1 1 -6  18  14 o 6  1.43317e+01 7.74871e-01 1.93507e+02 133.290 -1.91370e+01 2.03148e+01  0.00000e+00 0.00000e+00 3.31542e+02 133.290 1.38035e+02 133.290 0.9819 
1 1 1 -6  18  15 o 4  3.86145e+00 1.07409e+00 7.93713e+01 0.151   3.48104e+00  9.16401e-03  0.00000e+00 0.00000e+00 4.15273e+01 0.151   3.78439e+01 180.151 0.8401 
1 1 1 -6  18  16 o 4  6.44045e+00 1.40620e+00 4.97785e+01 205.497 -3.15160e+00 -1.50303e+00 0.00000e+00 0.00000e+00 1.51761e+02 205.497 1.01983e+02 205.497 0.8407 
1 1 1 -6  18  17 o 5  1.02296e+01 1.52305e+00 2.22212e+02 186.927 -2.49234e+01 -3.02796e+00 0.00000e+00 0.00000e+00 1.50443e+02 186.927 7.17695e+01 6.927   0.9799 
1 1 1 -6  18  18 o 7  3.95840e+00 1.34294e+00 1.95943e+01 221.531 -7.68493e-01 -6.80641e-01 0.00000e+00 0.00000e+00 4.73836e+01 221.531 2.77893e+01 221.531 0.4557 
1 1 1 -6  18  19 o 2  5.14984e+00 1.63801e+00 1.41344e+02 71.329  2.75582e+00  8.15516e+00  0.00000e+00 0.00000e+00 3.81406e+01 71.329  1.03203e+02 251.329 0.9400 
1 1 1 -6  19  1  o 16 9.90795e+00 3.83713e-01 2.06268e+02 81.378  2.69713e-01  1.77881e+00  0.00000e+00 0.00000e+00 4.06291e+01 81.378  1.65639e+02 261.378 0.6619 
1 1 1 -6  19  2  o 19 1.23352e+01 4.99333e-01 2.60465e+02 18.241  2.90021e+00  9.55828e-01  0.00000e+00 0.00000e+00 1.17381e+02 18.241  1.43084e+02 198.241 0.8139 
1 1 1 -6  19  3  o 4  1.82848e+01 5.67746e-01 7.86376e+01 181.279 -1.52929e+00 -3.41321e-02 0.00000e+00 0.00000e+00 3.36433e+02 181.279 2.57796e+02 181.279 0.6034 
1 1 1 -6  19  4  o 1  2.91077e+01 7.74150e-01 6.83306e+02 247.855 -8.91766e+00 -2.19123e+01 0.00000e+00 0.00000e+00 3.87892e+02 247.855 2.95415e+02 67.855  0.9786 
1 1 1 -6  19  5  o 13 3.07471e+01 6.14073e-01 6.07837e+02 190.753 -2.17005e+01 -4.12098e+00 0.00000e+00 0.00000e+00 5.21333e+02 190.753 8.65046e+01 10.753  0.9771 
1 1 1 -6  19  6  o 17 1.62679e+01 3.96526e-01 3.10625e+02 37.253  5.33080e+00  4.05405e+00  0.00000e+00 0.00000e+00 2.52782e+02 37.253  5.78427e+01 217.253 0.9220 
1 1 1 -6  19  7  o 18 2.71467e+01 6.41176e-01 6.58126e+02 121.960 -1.65880e+01 2.65872e+01  0.00000e+00 0.00000e+00 3.44558e+02 121.960 3.13567e+02 301.960 0.9839 
1 1 1 -6  19  8  o 8  4.24554e+01 7.34052e-01 7.12023e+02 41.524  4.86951e+01  4.31177e+01  0.00000e+00 0.00000e+00 8.68331e+02 41.524  1.56308e+02 41.524  0.9923 
1 1 1 -6  19  9  o 18 3.97222e+01 6.94173e-01 8.58913e+02 241.238 -4.45929e+01 -8.12414e+01 0.00000e+00 0.00000e+00 6.22011e+02 241.238 2.36902e+02 61.238  0.9946 
1 1 1 -6  19  10 o 10 9.98575e+00 5.41958e-01 1.29446e+02 353.271 4.23461e+00  -4.99655e-01 0.00000e+00 0.00000e+00 1.97046e+02 353.271 6.75998e+01 353.271 0.8730 
1 1 1 -6  19  11 o 13 1.73990e+01 3.63236e-01 2.70254e+02 231.936 -1.34987e+01 -1.72376e+01 0.00000e+00 0.00000e+00 3.65786e+02 231.936 9.55314e+01 231.936 0.9769 
1 1 1 -6  19  12 o 14 2.16874e+01 7.38897e-01 3.84748e+02 338.915 4.74450e+01  -1.82932e+01 0.00000e+00 0.00000e+00 4.18034e+02 338.915 3.32854e+01 338.915 0.9901 
1 1 1 -6  19  13 o 17 3.95219e+00 1.00597e+00 6.72469e+01 154.094 -1.85549e+00 9.01209e-01  0.00000e+00 0.00000e+00 3.72316e+01 154.094 3.00153e+01 334.094 0.7078 
1 1 1 -6  19  14 o 17 1.20823e+01 7.52512e-01 2.36661e+02 55.148  1.65304e+01  2.37381e+01  0.00000e+00 0.00000e+00 2.06246e+02 55.148  3.04143e+01 235.148 0.9826 
1 1 1 -6  19  15 o 1  1.20753e+01 8.64350e-01 1.71230e+02 242.648 -1.17953e+01 -2.28019e+01 0.00000e+00 0.00000e+00 2.69918e+02 242.648 9.86882e+01 242.648 0.9803 
1 1 1 -6  19  16 o 3  4.75091e+00 1.31201e+00 6.17340e+01 6.210   3.34756e+00  3.64243e-01  0.00000e+00 0.00000e+00 8.57242e+01 6.210   2.39902e+01 6.210   0.8339 
1 1 1 -6  19  17 o 1  9.12430e+00 1.46505e+00 1.03557e+02 207.498 -9.59257e+00 -4.99321e+00 0.00000e+00 0.00000e+00 2.19557e+02 207.498 1.15999e+02 207.498 0.9526 
1 1 1 -6  19  18 o 2  4.44661e+00 1.39384e+00 8.64303e+01 270.578 4.95846e-02  -4.91467e+00 0.00000e+00 0.00000e+00 6.07243e+01 270.578 2.57060e+01 90.578  0.8914 
1 1 1 -6  19  19 o 11 3.88722e+00 1.35927e+00 2.93203e+01 173.879 -1.65358e+00 1.77339e-01  0.00000e+00 0.00000e+00 6.20434e+01 173.879 3.27231e+01 173.879 0.6339 
1 1 1 -6  20  1  o 2  2.13797e+01 4.83346e-01 5.46056e+02 204.416 -1.01823e+01 -4.62232e+00 0.00000e+00 0.00000e+00 2.21955e+02 204.416 3.24101e+02 24.416  0.9542 
1 1 1 -6  20  2  o 18 1.35761e+01 5.11615e-01 1.16056e+02 78.939  2.74970e-01  1.40656e+00  0.00000e+00 0.00000e+00 1.79864e+02 78.939  6.38088e+01 78.939  0.5792 
1 1 1 -6  20  3  o 5  7.73911e+00 3.77558e-01 2.97122e+01 343.088 2.33121e-01  -7.08788e-02 0.00000e+00 0.00000e+00 5.49701e+00 343.088 2.42152e+01 163.088 0.1209 
1 1 1 -6  20  4  o 6  1.22255e+01 3.86278e-01 3.31941e+02 104.048 -1.09746e+00 4.38598e+00  0.00000e+00 0.00000e+00 7.30424e+01 104.048 2.58899e+02 284.048 0.8810 
1 1 1 -6  20  5  o 13 3.90377e+01 9.81973e-01 7.26613e+02 87.413  1.55348e+00  3.43822e+01  0.00000e+00 0.00000e+00 7.19080e+02 87.413  7.53328e+00 267.413 0.9854 
1 1 1 -6  20  6  o 3  1.91552e+01 4.23547e-01 4.08028e+02 328.493 8.79330e+00  -5.39010e+00 0.00000e+00 0.00000e+00 2.75649e+02 328.493 1.32379e+02 148.493 0.9502 
1 1 1 -6  20  7  o 3  4.52198e+01 7.70447e-01 8.80764e+02 66.730  2.73447e+01  6.35859e+01  0.00000e+00 0.00000e+00 8.04374e+02 66.730  7.63892e+01 246.730 0.9927 
1 1 1 -6  20  8  o 5  2.59817e+01 5.10029e-01 5.05431e+02 37.790  2.25285e+01  1.74685e+01  0.00000e+00 0.00000e+00 4.51929e+02 37.790  5.35025e+01 217.790 0.9823 
1 1 1 -6  20  9  o 19 3.29354e+01 5.98529e-01 6.57705e+02 268.917 -1.11736e+00 -5.91063e+01 0.00000e+00 0.00000e+00 5.66320e+02 268.917 9.13843e+01 88.917  0.9915 
1 1 1 -6  20  10 o 12 2.85242e+01 6.10783e-01 3.65712e+02 75.560  8.52183e+00  3.30938e+01  0.00000e+00 0.00000e+00 6.86828e+02 75.560  3.21116e+02 75.560  0.9853 
1 1 1 -6  20  11 o 13 2.59042e+01 6.21418e-01 5.17378e+02 336.240 5.90350e+01  -2.59885e+01 0.00000e+00 0.00000e+00 4.44386e+02 336.240 7.29926e+01 156.240 0.9922 
1 1 1 -6  20  12 o 9  2.12166e+01 7.36495e-01 4.55994e+02 177.415 -5.88200e+01 2.65518e+00  0.00000e+00 0.00000e+00 3.30394e+02 177.415 1.25599e+02 357.415 0.9915 
1 1 1 -6  20  13 o 11 1.62202e+01 7.05534e-01 3.42111e+02 37.274  3.69733e+01  2.81394e+01  0.00000e+00 0.00000e+00 2.57093e+02 37.274  8.50175e+01 217.274 0.9892 
1 1 1 -6  20  14 o 9  3.89460e+00 1.04113e+00 1.29346e+02 106.661 -1.38661e+00 4.63331e+00  0.00000e+00 0.00000e+00 1.16118e-01 286.661 1.29462e+02 286.661 0.8894 
1 1 1 -6  20  15 o 16 7.05181e+00 1.16509e+00 1.26005e+02 198.267 -8.86376e+00 -2.92577e+00 0.00000e+00 0.00000e+00 1.22272e+02 198.267 3.73268e+00 18.267  0.9448 
1 1 1 -6  20  16 o 3  6.08758e+00 1.42220e+00 1.30028e+02 198.197 -8.14973e+00 -2.67902e+00 0.00000e+00 0.00000e+00 8.29046e+01 198.197 4.71231e+01 18.197  0.9398 
1 1 1 -6  20  17 o 3  5.02845e+00 1.40507e+00 6.44439e+01 347.150 3.81453e+00  -8.70139e-01 0.00000e+00 0.00000e+00 9.63247e+01 347.150 3.18808e+01 347.150 0.8601 
1 1 1 -6  20  18 o 9  4.64655e+00 1.51496e+00 7.50694e+01 50.125  2.66727e+00  3.19286e+00  0.00000e+00 0.00000e+00 7.49064e+01 50.125  1.62937e-01 230.125 0.8694 
1 1 1 -6  20  19 o 14 4.53607e+00 1.52884e+00 4.56561e+01 1.761   2.66527e+00  8.19273e-02  0.00000e+00 0.00000e+00 8.58451e+01 1.761   4.01889e+01 1.761   0.7820 
1 1 1 -6  21  1  o 10 6.51828e+00 4.18002e-01 9.63296e+01 290.186 2.05711e-01  -5.59536e-01 0.00000e+00 0.00000e+00 2.62552e+01 110.186 1.22585e+02 110.186 0.2856 
1 1 1 -6  21  2  o 16 1.13502e+01 3.86398e-01 3.94132e+02 187.975 -4.00118e+00 -5.60578e-01 0.00000e+00 0.00000e+00 2.46334e+01 7.975   4.18765e+02 7.975   0.8651 
1 1 1 -6  21  3  o 1  1.78761e+01 4.31544e-01 2.91112e+02 325.426 4.49289e+00  -3.09642e+00 0.00000e+00 0.00000e+00 3.16116e+02 325.426 2.50038e+01 325.426 0.9030 
1 1 1 -6  21  4  o 18 2.91778e+01 5.86417e-01 7.03219e+02 215.174 -1.84971e+01 -1.30356e+01 0.00000e+00 0.00000e+00 3.69363e+02 215.174 3.33857e+02 35.174  0.9776 
1 1 1 -6  21  5  o 6  2.01506e+01 6.33749e-01 4.31447e+02 168.904 -1.04370e+01 2.04688e+00  0.00000e+00 0.00000e+00 2.89307e+02 168.904 1.42140e+02 348.904 0.9518 
1 1 1 -6  21  6  o 7  6.84816e+00 4.09280e-01 2.86000e+02 217.171 -2.12695e+00 -1.61277e+00 0.00000e+00 0.00000e+00 8.48026e+01 37.171  3.70803e+02 37.171  0.7822 
1 1 1 -6  21  7  o 19 2.70785e+01 7.42705e-01 4.11359e+02 165.248 -1.83088e+01 4.82086e+00  0.00000e+00 0.00000e+00 5.77827e+02 165.248 1.66468e+02 165.248 0.9732 
1 1 1 -6  21  8  o 13 1.52221e+01 4.82060e-01 1.80599e+02 174.126 -6.08551e+00 6.26039e-01  0.00000e+00 0.00000e+00 3.41353e+02 174.126 1.60753e+02 174.126 0.9141 
1 1 1 -6  21  9  o 15 3.32038e+01 6.11108e-01 6.65754e+02 267.776 -2.39487e+00 -6.16636e+01 0.00000e+00 0.00000e+00 5.68623e+02 267.776 9.71310e+01 87.776  0.9919 
1 1 1 -6  21  10 o 11 2.20157e+01 4.66329e-01 3.94214e+02 100.333 -5.57241e+00 3.05617e+01  0.00000e+00 0.00000e+00 4.16890e+02 100.333 2.26760e+01 100.333 0.9838 
1 1 1 -6  21  11 o 16 1.53350e+01 5.01683e-01 2.71361e+02 161.190 -1.91587e+01 6.52574e+00  0.00000e+00 0.00000e+00 2.88065e+02 161.190 1.67044e+01 161.190 0.9750 
1 1 1 -6  21  12 o 1  1.32814e+01 7.20168e-01 1.54054e+02 183.622 -1.36676e+01 -8.65181e-01 0.00000e+00 0.00000e+00 3.23939e+02 183.622 1.69885e+02 183.622 0.9628 
1 1 1 -6  21  13 o 18 2.10232e+01 7.25672e-01 3.61814e+02 285.091 1.67273e+01  -6.20332e+01 0.00000e+00 0.00000e+00 4.17142e+02 285.091 5.53280e+01 285.091 0.9922 
1 1 1 -6  21  14 o 7  1.11697e+01 8.15975e-01 2.59010e+02 61.872  1.41391e+01  2.64485e+01  0.00000e+00 0.00000e+00 1.50658e+02 61.872  1.08351e+02 241.872 0.9832 
1 1 1 -6  21  15 o 19 1.26705e+01 8.76214e-01 2.07334e+02 211.791 -2.64893e+01 -1.64185e+01 0.00000e+00 0.00000e+00 2.57157e+02 211.791 4.98235e+01 211.791 0.9838 
1 1 1 -6  21  16 o 15 3.76656e+00 1.20336e+00 4.99293e+01 200.086 -2.16341e+00 -7.91117e-01 0.00000e+00 0.00000e+00 5.40620e+01 200.086 4.13269e+00 200.086 0.7418 
1 1 1 -6  21  17 f 0  3.96475e+00 1.28026e+00 3.67178e+01 78.119  3.91031e-01  1.85869e+00  0.00000e+00 0.00000e+00 6.35762e+01 78.119  2.68584e+01 78.119  0.6805 
1 1 1 -6  21  18 o 11 5.13735e+00 1.57778e+00 6.64710e+01 297.114 1.77845e+00  -3.47330e+00 0.00000e+00 0.00000e+00 9.74747e+01 297.114 3.10037e+01 297.114 0.8597 
1 1 1 -6  21  19 o 7  4.94002e+00 1.60951e+00 7.19702e+01 138.173 -3.32760e+00 2.97800e+00  0.00000e+00 0.00000e+00 8.90623e+01 138.173 1.70921e+01 138.173 0.8793 
1 1 1 -6  22  1  f 0  2.98015e+01 6.42724e-01 5.57657e+02 322.488 1.19224e+01  -9.15238e+00 0.00000e+00 0.00000e+00 5.26175e+02 322.488 3.14817e+01 142.488 0.9661 
1 1 1 -6  22  2  o 4  1.58593e+01 4.17555e-01 3.26219e+02 125.684 -3.22676e+00 4.49313e+00  0.00000e+00 0.00000e+00 2.13525e+02 125.684 1.12695e+02 305.684 0.9044 
1 1 1 -6  22  3  o 7  2.93425e+01 5.88842e-01 7.50197e+02 77.455  4.95869e+00  2.22841e+01  0.00000e+00 0.00000e+00 3.29085e+02 77.455  4.21112e+02 257.455 0.9778 
1 1 1 -6  22  4  o 5  1.63519e+01 5.37391e-01 2.63732e+02 202.857 -5.23568e+00 -2.20698e+00 0.00000e+00 0.00000e+00 2.93968e+02 202.857 3.02363e+01 202.857 0.9071 
1 1 1 -6  22  5  o 19 1.06832e+01 5.73545e-01 1.27897e+02 236.248 -9.90567e-01 -1.48240e+00 0.00000e+00 0.00000e+00 1.36547e+02 236.248 8.64974e+00 236.248 0.6587 
1 1 1 -6  22  6  o 13 2.13006e+01 4.48557e-01 4.18587e+02 130.152 -7.80025e+00 9.24611e+00  0.00000e+00 0.00000e+00 3.47590e+02 130.152 7.09973e+01 310.152 0.9577 
1 1 1 -6  22  7  o 13 2.49518e+01 4.91983e-01 5.02712e+02 286.444 6.07280e+00  -2.05754e+01 0.00000e+00 0.00000e+00 4.11716e+02 286.444 9.09959e+01 106.444 0.9764 
1 1 1 -6  22  8  o 15 2.43612e+01 4.97959e-01 4.16916e+02 59.607  1.14005e+01  1.94374e+01  0.00000e+00 0.00000e+00 4.76292e+02 59.607  5.93762e+01 59.607  0.9776 
1 1 1 -6  22  9  o 2  3.86039e+01 7.42613e-01 6.61105e+02 315.030 4.98367e+01  -4.97842e+01 0.00000e+00 0.00000e+00 7.75405e+02 315.030 1.14300e+02 315.030 0.9929 
1 1 1 -6  22  10 o 5  1.80693e+01 5.43273e-01 4.00319e+02 112.379 -9.78218e+00 2.37585e+01  0.00000e+00 0.00000e+00 2.63034e+02 112.379 1.37285e+02 292.379 0.9803 
1 1 1 -6  22  11 o 10 3.33087e+01 7.35342e-01 6.28517e+02 256.497 -2.26511e+01 -9.43298e+01 0.00000e+00 0.00000e+00 6.11274e+02 256.497 1.72431e+01 76.497  0.9948 
1 1 1 -6  22  12 o 19 1.29198e+01 6.91571e-01 2.90072e+02 159.905 -2.36310e+01 8.64540e+00  0.00000e+00 0.00000e+00 1.83163e+02 159.905 1.06909e+02 339.905 0.9799 
1 1 1 -6  22  13 o 9  1.03695e+01 7.65928e-01 1.44962e+02 13.958  1.21865e+01  3.02894e+00  0.00000e+00 0.00000e+00 2.26501e+02 13.958  8.15387e+01 13.958  0.9593 
1 1 1 -6  22  14 o 16 3.69640e+00 1.00115e+00 1.55018e+02 40.497  4.10775e+00  3.50801e+00  0.00000e+00 0.00000e+00 3.06562e+01 220.497 1.85674e+02 220.497 0.9019 
1 1 1 -6  22  15 o 7  9.16886e+00 1.02568e+00 1.93656e+02 171.744 -2.08115e+01 3.01985e+00  0.00000e+00 0.00000e+00 1.39750e+02 171.744 5.39060e+01 351.744 0.9759 
1 1 1 -6  22  16 o 18 5.46885e+00 1.42849e+00 8.19010e+01 325.936 3.98302e+00  -2.69307e+00 0.00000e+00 0.00000e+00 9.89794e+01 325.936 1.70784e+01 325.936 0.8887 
1 1 1 -6  22  17 o 15 4.60103e+00 1.41328e+00 4.35607e+01 313.793 1.60006e+00  -1.66891e+00 0.00000e+00 0.00000e+00 8.34884e+01 313.793 3.99277e+01 313.793 0.7429 
1 1 1 -6  22  18 f 0  4.83961e+00 1.56684e+00 7.24226e+01 205.647 -3.67298e+00 -1.76348e+00 0.00000e+00 0.00000e+00 8.32107e+01 205.647 1.07881e+01 205.647 0.8663 
1 1 1 -6  22  19 o 4  4.94910e+00 1.63795e+00 2.13837e+01 280.307 2.32692e-01  -1.27955e+00 0.00000e+00 0.00000e+00 7.82027e+01 280.307 5.68190e+01 280.307 0.5428 
1 1 1 -6  23  1  o 12 2.60019e+01 5.90327e-01 6.81175e+02 298.912 7.67834e+00  -1.39027e+01 0.00000e+00 0.00000e+00 2.66220e+02 298.912 4.14956e+02 118.912 0.9680 
1 1 1 -6  23  2  o 4  3.45821e+01 7.14867e-01 6.88922e+02 223.529 -1.81849e+01 -1.72744e+01 0.00000e+00 0.00000e+00 5.86128e+02 223.529 1.02795e+02 43.529  0.9799 
1 1 1 -6  23  3  o 14 3.33952e+01 6.49694e-01 6.76283e+02 31.631  2.30738e+01  1.42124e+01  0.00000e+00 0.00000e+00 5.56423e+02 31.631  1.19860e+02 211.631 0.9814 
1 1 1 -6  23  4  o 14 4.86110e+01 8.99853e-01 1.24621e+03 244.400 -3.38349e+01 -7.06176e+01 0.00000e+00 0.00000e+00 5.69670e+02 244.400 6.76536e+02 64.400  0.9936 
1 1 1 -6  23  5  o 12 2.60997e+01 5.03494e-01 3.47278e+02 128.778 -7.38789e+00 9.19584e+00  0.00000e+00 0.00000e+00 5.90923e+02 128.778 2.43645e+02 128.778 0.9566 
1 1 1 -6  23  6  o 10 2.41926e+01 4.80113e-01 3.52328e+02 21.859  1.25885e+01  5.05020e+00  0.00000e+00 0.00000e+00 5.22064e+02 21.859  1.69736e+02 21.859  0.9624 
1 1 1 -6  23  7  o 3  1.23085e+01 4.13795e-01 4.04359e+02 274.380 6.55971e-01  -8.56515e+00 0.00000e+00 0.00000e+00 2.98071e+01 274.380 3.74552e+02 94.379  0.9399 
1 1 1 -6  23  8  o 11 2.71602e+01 5.24566e-01 6.15409e+02 97.752  -5.51949e+00 4.05434e+01  0.00000e+00 0.00000e+00 3.90700e+02 97.752  2.24709e+02 277.752 0.9877 
1 1 1 -6  23  9  f 0  3.24933e+01 5.94835e-01 4.57272e+02 252.933 -1.31260e+01 -4.27538e+01 0.00000e+00 0.00000e+00 7.46759e+02 252.933 2.89487e+02 252.933 0.9888 
1 1 1 -6  23  10 o 16 8.20889e+00 4.38669e-01 1.03205e+02 181.492 -2.94601e+00 -7.67375e-02 0.00000e+00 0.00000e+00 1.44544e+02 181.492 4.13392e+01 181.492 0.8060 
1 1 1 -6  23  11 o 18 1.12478e+01 5.06838e-01 1.39670e+02 213.948 -6.17514e+00 -4.15697e+00 0.00000e+00 0.00000e+00 2.51754e+02 213.948 1.12084e+02 213.948 0.9302 
1 1 1 -6  23  12 o 7  3.81931e+00 9.59408e-01 4.54756e+01 149.615 -9.83426e-01 5.76619e-01  0.00000e+00 0.00000e+00 2.50169e+01 149.615 2.04588e+01 329.615 0.4938 
1 1 1 -6  23  13 o 9  5.69071e+00 9.90963e-01 1.09542e+02 224.686 -3.65475e+00 -3.61495e+00 0.00000e+00 0.00000e+00 8.09630e+01 224.686 2.85786e+01 44.686  0.8965 
1 1 1 -6  23  14 o 11 8.46436e+00 9.43451e-01 2.11663e+02 252.670 -5.12579e+00 -1.64267e+01 0.00000e+00 0.00000e+00 9.47387e+01 252.670 1.16924e+02 72.670  0.9705 
1 1 1 -6  23  15 o 13 3.44314e+00 1.01820e+00 8.28401e+01 25.471  3.05684e+00  1.45613e+00  0.00000e+00 0.00000e+00 2.42653e+01 25.471  5.85748e+01 205.471 0.8349 
1 1 1 -6  23  16 o 13 1.26552e+01 1.21009e+00 1.80875e+02 253.384 -7.93438e+00 -2.65880e+01 0.00000e+00 0.00000e+00 2.81499e+02 253.384 1.00624e+02 253.384 0.9818 
1 1 1 -6  23  17 o 8  8.62993e+00 1.51124e+00 7.94910e+01 150.034 -6.45365e+00 3.72085e+00  0.00000e+00 0.00000e+00 2.18878e+02 150.034 1.39387e+02 150.034 0.9302 
1 1 1 -6  23  18 o 17 6.03714e+00 1.70557e+00 3.88877e+01 213.282 -2.07656e+00 -1.36309e+00 0.00000e+00 0.00000e+00 1.32145e+02 213.282 9.32572e+01 213.282 0.7632 
1 1 1 -6  23  19 o 1  4.24423e+00 1.45759e+00 8.82268e+01 99.718  -8.90417e-01 5.19943e+00  0.00000e+00 0.00000e+00 5.32674e+01 99.718  3.49594e+01 279.718 0.8994 
1 1 1 -6  24  1  o 7  2.26206e+01 5.39205e-01 5.59357e+02 338.019 1.24616e+01  -5.03000e+00 0.00000e+00 0.00000e+00 2.59725e+02 338.019 2.99632e+02 158.019 0.9620 
1 1 1 -6  24  2  o 13 1.80101e+01 4.26962e-01 3.08863e+02 133.409 -4.00733e+00 4.23628e+00  0.00000e+00 0.00000e+00 3.07558e+02 133.409 1.30522e+00 313.409 0.9097 
1 1 1 -6  24  3  o 18 7.98460e+00 3.82267e-01 7.78097e+01 282.882 1.65950e-01  -7.25624e-01 0.00000e+00 0.00000e+00 2.68703e+01 282.882 5.09394e+01 102.882 0.3486 
1 1 1 -6  24  4  o 1  1.39039e+01 6.43558e-01 3.14557e+02 309.596 3.31214e+00  -4.00427e+00 0.00000e+00 0.00000e+00 1.54695e+02 309.596 1.59862e+02 129.596 0.8978 
1 1 1 -6  24  5  o 9  1.91393e+01 4.26359e-01 4.16192e+02 234.442 -5.95103e+00 -8.32516e+00 0.00000e+00 0.00000e+00 2.66857e+02 234.442 1.49335e+02 54.442  0.9498 
1 1 1 -6  24  6  o 1  2.64481e+01 5.10604e-01 3.73436e+02 359.019 1.53303e+01  -2.62435e-01 0.00000e+00 0.00000e+00 5.86803e+02 359.019 2.13367e+02 359.019 0.9668 
1 1 1 -6  24  7  o 15 4.91035e+00 8.48002e-01 2.19881e+02 225.480 -1.28142e+00 -1.30307e+00 0.00000e+00 0.00000e+00 9.69069e+01 45.480  3.16787e+02 45.480  0.6673 
1 1 1 -6  24  8  o 18 1.05119e+01 4.53806e-01 1.61533e+02 334.423 3.75046e+00  -1.79504e+00 0.00000e+00 0.00000e+00 1.81174e+02 334.423 1.96403e+01 334.423 0.8693 
1 1 1 -6  24  9  o 16 1.05891e+01 4.49142e-01 2.44149e+02 297.742 3.64323e+00  -6.92705e+00 0.00000e+00 0.00000e+00 1.26373e+02 297.742 1.17775e+02 117.742 0.9337 
1 1 1 -6  24  10 f 0  1.27864e+01 4.08361e-01 2.00218e+02 109.068 -2.90787e+00 8.41283e+00  0.00000e+00 0.00000e+00 2.50789e+02 109.068 5.05706e+01 109.068 0.9420 
1 1 1 -6  24  11 o 11 2.06326e+01 5.63580e-01 3.09941e+02 237.888 -1.72206e+01 -2.74389e+01 0.00000e+00 0.00000e+00 4.49916e+02 237.888 1.39975e+02 237.888 0.9844 
1 1 1 -6  24  12 o 11 1.01332e+01 7.56779e-01 1.61627e+02 179.425 -1.12085e+01 1.12392e-01  0.00000e+00 0.00000e+00 1.99787e+02 179.425 3.81598e+01 179.425 0.9543 
1 1 1 -6  24  13 o 15 1.91451e+01 7.14817e-01 3.88944e+02 12.729  6.44488e+01  1.45584e+01  0.00000e+00 0.00000e+00 3.20445e+02 12.729  6.84989e+01 192.729 0.9924 
1 1 1 -6  24  14 o 19 6.11839e+00 1.08230e+00 1.16252e+02 67.990  2.55778e+00  6.32741e+00  0.00000e+00 0.00000e+00 9.44942e+01 67.990  2.17581e+01 247.990 0.9235 
1 1 1 -6  24  15 o 7  2.52790e+00 8.53332e-01 5.87957e+01 117.697 -8.85056e-01 1.68598e+00  0.00000e+00 0.00000e+00 5.37593e+00 117.697 5.34197e+01 297.697 0.6814 
1 1 1 -6  24  16 o 12 5.45102e+00 1.47531e+00 1.74913e+02 239.815 -5.02649e+00 -8.64167e+00 0.00000e+00 0.00000e+00 1.74949e+01 239.815 1.57418e+02 59.815  0.9486 
1 1 1 -6  24  17 o 1  6.20333e+00 1.65761e+00 1.40955e+02 125.982 -5.36777e+00 7.39296e+00  0.00000e+00 0.00000e+00 7.65790e+01 125.982 6.43763e+01 305.982 0.9436 
1 1 1 -6  24  18 o 3  4.12404e+00 1.37898e+00 7.77760e+01 133.704 -2.95799e+00 3.09493e+00  0.00000e+00 0.00000e+00 5.59315e+01 133.704 2.18444e+01 313.704 0.8735 
1 1 1 -6  24  19 o 1  4.48631e+00 1.51079e+00 4.87577e+01 316.618 2.14940e+00  -2.03129e+00 0.00000e+00 0.00000e+00 8.53978e+01 316.618 3.66401e+01 316.618 0.8068 
1 1 1 -6  25  1  o 15 1.08006e+01 3.86823e-01 1.88780e+02 347.414 2.09578e+00  -4.67941e-01 0.00000e+00 0.00000e+00 1.04115e+02 347.414 8.46655e+01 167.413 0.7206 
1 1 1 -6  25  2  o 9  4.76609e+01 9.48510e-01 1.06678e+03 238.194 -2.74587e+01 -4.42760e+01 0.00000e+00 0.00000e+00 7.09079e+02 238.194 3.57703e+02 58.194  0.9904 
1 1 1 -6  25  3  o 3  1.46055e+01 3.90420e-01 3.12478e+02 33.329  4.23027e+00  2.78186e+00  0.00000e+00 0.00000e+00 1.79037e+02 33.329  1.33442e+02 213.329 0.8948 
1 1 1 -6  25  4  o 3  2.77916e+01 5.27230e-01 4.66755e+02 30.603  1.32187e+01  7.81839e+00  0.00000e+00 0.00000e+00 5.43358e+02 30.603  7.66029e+01 30.603  0.9669 
1 1 1 -6  25  5  o 9  3.09661e+01 5.68597e-01 5.93672e+02 200.957 -2.18694e+01 -8.37616e+00 0.00000e+00 0.00000e+00 5.44661e+02 200.957 4.90111e+01 20.957  0.9784 
1 1 1 -6  25  6  o 13 4.01292e+01 7.00244e-01 6.02566e+02 39.366  2.87032e+01  2.35486e+01  0.00000e+00 0.00000e+00 8.83853e+02 39.366  2.81287e+02 39.366  0.9864 
1 1 1 -6  25  7  o 18 1.75406e+01 6.22822e-01 4.24418e+02 252.832 -4.59629e+00 -1.48781e+01 0.00000e+00 0.00000e+00 2.12311e+02 252.832 2.12107e+02 72.832  0.9673 
1 1 1 -6  25  8  o 7  1.23355e+01 6.39178e-01 1.94724e+02 322.485 4.55586e+00  -3.49777e+00 0.00000e+00 0.00000e+00 2.25381e+02 322.485 3.06567e+01 322.485 0.9082 
1 1 1 -6  25  9  o 8  1.92965e+01 4.53258e-01 2.89072e+02 241.090 -7.77069e+00 -1.40711e+01 0.00000e+00 0.00000e+00 4.11128e+02 241.090 1.22056e+02 241.090 0.9684 
1 1 1 -6  25  10 o 3  1.26583e+01 4.14631e-01 2.33188e+02 251.112 -3.77648e+00 -1.10380e+01 0.00000e+00 0.00000e+00 2.19953e+02 251.112 1.32352e+01 71.112  0.9561 
1 1 1 -6  25  11 o 13 3.41425e+01 7.11135e-01 5.28421e+02 325.083 7.34151e+01  -5.12465e+01 0.00000e+00 0.00000e+00 7.41607e+02 325.083 2.13187e+02 325.083 0.9944 
1 1 1 -6  25  12 o 1  9.25824e+00 7.77479e-01 1.87330e+02 323.854 1.00602e+01  -7.34838e+00 0.00000e+00 0.00000e+00 1.44479e+02 323.854 4.28515e+01 143.854 0.9590 
1 1 1 -6  25  13 o 15 1.15031e+01 7.43635e-01 2.79898e+02 3.721   2.82907e+01  1.84010e+00  0.00000e+00 0.00000e+00 1.41920e+02 3.721   1.37979e+02 183.721 0.9822 
1 1 1 -6  25  14 o 10 1.81324e+01 7.78539e-01 3.13653e+02 74.454  1.52955e+01  5.49826e+01  0.00000e+00 0.00000e+00 3.56640e+02 74.454  4.29869e+01 74.454  0.9912 
1 1 1 -6  25  15 o 11 1.29309e+01 8.89681e-01 1.82049e+02 243.349 -1.33151e+01 -2.65305e+01 0.00000e+00 0.00000e+00 2.91477e+02 243.349 1.09428e+02 243.349 0.9830 
1 1 1 -6  25  16 o 16 5.87273e+00 1.54602e+00 1.30718e+02 188.732 -7.63162e+00 -1.17223e+00 0.00000e+00 0.00000e+00 7.31120e+01 188.732 5.76056e+01 8.732   0.9328 
1 1 1 -6  25  17 o 15 4.47703e+00 1.41267e+00 4.03149e+01 107.452 -6.83762e-01 2.17494e+00  0.00000e+00 0.00000e+00 8.25993e+01 107.452 4.22844e+01 107.452 0.7388 
1 1 1 -6  25  18 o 10 4.66665e+00 1.51920e+00 8.13983e+01 120.430 -2.33129e+00 3.96879e+00  0.00000e+00 0.00000e+00 7.15802e+01 120.430 9.81812e+00 300.430 0.8833 
1 1 1 -6  25  19 o 1  4.61359e+00 1.54082e+00 3.63129e+01 353.732 2.28838e+00  -2.51329e-01 0.00000e+00 0.00000e+00 9.05017e+01 353.732 5.41888e+01 353.732 0.7416 
1 1 1 -6  26  1  o 1  2.76311e+01 5.44536e-01 7.12021e+02 285.748 5.55466e+00  -1.96978e+01 0.00000e+00 0.00000e+00 3.02092e+02 285.748 4.09930e+02 105.748 0.9753 
1 1 1 -6  26  2  o 1  2.74568e+01 5.41546e-01 4.43729e+02 346.446 1.42211e+01  -3.42834e+00 0.00000e+00 0.00000e+00 5.53252e+02 346.446 1.09523e+02 346.446 0.9652 
1 1 1 -6  26  3  o 3  2.12757e+01 5.11151e-01 2.66351e+02 154.192 -6.73099e+00 3.25500e+00  0.00000e+00 0.00000e+00 4.78130e+02 154.192 2.11778e+02 154.192 0.9305 
1 1 1 -6  26  4  o 11 2.59917e+01 4.83919e-01 4.00555e+02 21.595  1.19230e+01  4.71951e+00  0.00000e+00 0.00000e+00 5.37530e+02 21.595  1.36975e+02 21.595  0.9602 
1 1 1 -6  26  5  o 9  4.08682e+01 7.86713e-01 9.99966e+02 176.431 -5.34907e+01 3.33666e+00  0.00000e+00 0.00000e+00 5.21021e+02 176.431 4.78945e+02 356.431 0.9906 
1 1 1 -6  26  6  o 12 4.70228e+01 7.99492e-01 8.29112e+02 180.723 -7.29035e+01 -9.19445e-01 0.00000e+00 0.00000e+00 9.24319e+02 180.723 9.52068e+01 180.723 0.9931 
1 1 1 -6  26  7  o 3  2.82781e+01 7.56154e-01 3.36776e+02 235.033 -1.12954e+01 -1.61514e+01 0.00000e+00 0.00000e+00 6.97034e+02 235.033 3.60258e+02 235.033 0.9743 
1 1 1 -6  26  8  o 3  1.82886e+01 5.82393e-01 3.02026e+02 32.582  1.24412e+01  7.95107e+00  0.00000e+00 0.00000e+00 3.60099e+02 32.582  5.80730e+01 32.582  0.9655 
1 1 1 -6  26  9  o 12 2.00373e+01 4.66371e-01 4.36120e+02 247.416 -1.08720e+01 -2.61391e+01 0.00000e+00 0.00000e+00 3.01268e+02 247.416 1.34852e+02 67.416  0.9822 
1 1 1 -6  26  10 o 13 4.65240e+01 8.03684e-01 8.77476e+02 38.295  1.22046e+02  9.63677e+01  0.00000e+00 0.00000e+00 8.58671e+02 38.295  1.88049e+01 218.295 0.9968 
1 1 1 -6  26  11 o 7  1.12833e+01 7.24920e-01 2.94484e+02 159.699 -1.65681e+01 6.12915e+00  0.00000e+00 0.00000e+00 1.15441e+02 159.699 1.79044e+02 339.699 0.9713 
1 1 1 -6  26  12 o 15 1.23201e+01 7.18486e-01 2.43661e+02 189.283 -2.14879e+01 -3.51210e+00 0.00000e+00 0.00000e+00 2.06036e+02 189.283 3.76251e+01 9.283   0.9768 
1 1 1 -6  26  13 o 16 8.05365e+00 8.43563e-01 2.51492e+02 298.678 8.32808e+00  -1.52257e+01 0.00000e+00 0.00000e+00 4.03705e+01 298.678 2.11122e+02 118.678 0.9707 
1 1 1 -6  26  14 o 17 3.74078e+00 1.03625e+00 1.06175e+02 64.124  1.59680e+00  3.29194e+00  0.00000e+00 0.00000e+00 1.22602e+01 64.124  9.39143e+01 244.124 0.8490 
1 1 1 -6  26  15 o 4  6.60049e+00 1.15938e+00 1.24542e+02 270.006 1.02424e-03  -9.45989e+00 0.00000e+00 0.00000e+00 1.07944e+02 270.006 1.65975e+01 90.006  0.9456 
1 1 1 -6  26  16 o 11 1.03769e+01 1.16889e+00 1.52765e+02 143.975 -1.59608e+01 1.16069e+01  0.00000e+00 0.00000e+00 2.23404e+02 143.975 7.06396e+01 143.975 0.9743 
1 1 1 -6  26  17 o 18 8.14537e+00 1.60514e+00 1.53880e+02 265.837 -1.01083e+00 -1.38882e+01 0.00000e+00 0.00000e+00 1.37717e+02 265.837 1.61633e+01 85.837  0.9634 
1 1 1 -6  26  18 o 8  9.61768e+00 1.69017e+00 2.04172e+02 44.815  1.54296e+01  1.53304e+01  0.00000e+00 0.00000e+00 1.44442e+02 44.815  5.97308e+01 224.815 0.9767 
1 1 1 -6  27  1  o 1  3.88862e+01 7.86436e-01 9.06025e+02 275.972 4.38172e+00  -4.18868e+01 0.00000e+00 0.00000e+00 5.39797e+02 275.972 3.66228e+02 95.972  0.9881 
1 1 1 -6  27  2  o 2  1.11978e+01 3.79163e-01 4.22998e+02 205.271 -4.77386e+00 -2.25362e+00 0.00000e+00 0.00000e+00 4.41055e+01 25.271  4.67104e+02 25.271  0.8995 
1 1 1 -6  27  3  o 1  2.51280e+01 5.75194e-01 4.27852e+02 84.114  1.44131e+00  1.39808e+01  0.00000e+00 0.00000e+00 4.82774e+02 84.114  5.49220e+01 84.114  0.9637 
1 1 1 -6  27  4  f 0  1.18724e+01 6.47735e-01 2.29961e+02 270.376 2.18490e-02  -3.32861e+00 0.00000e+00 0.00000e+00 1.41140e+02 270.376 8.88215e+01 90.376  0.8316 
1 1 1 -6  27  5  o 15 1.68001e+01 5.17139e-01 3.44948e+02 125.941 -4.63875e+00 6.39855e+00  0.00000e+00 0.00000e+00 2.44775e+02 125.941 1.00173e+02 305.941 0.9344 
1 1 1 -6  27  6  o 19 3.16394e+01 5.78057e-01 5.23745e+02 291.598 1.14762e+01  -2.89886e+01 0.00000e+00 0.00000e+00 6.44939e+02 291.598 1.21194e+02 291.598 0.9838 
1 1 1 -6  27  7  o 11 4.41299e+01 1.06545e+00 7.18736e+02 55.166  3.66295e+01  5.26355e+01  0.00000e+00 0.00000e+00 9.24085e+02 55.166  2.05349e+02 55.166  0.9922 
1 1 1 -6  27  8  o 4  2.50059e+01 4.98080e-01 4.90392e+02 330.451 2.85711e+01  -1.61972e+01 0.00000e+00 0.00000e+00 4.32803e+02 330.451 5.75882e+01 150.451 0.9847 
1 1 1 -6  27  9  o 4  1.17909e+01 6.94649e-01 2.63004e+02 54.189  5.76798e+00  7.99436e+00  0.00000e+00 0.00000e+00 1.55708e+02 54.189  1.07296e+02 234.189 0.9478 
1 1 1 -6  27  10 o 2  1.79400e+01 4.03877e-01 2.65619e+02 59.310  1.05612e+01  1.77940e+01  0.00000e+00 0.00000e+00 3.89533e+02 59.310  1.23914e+02 59.310  0.9755 
1 1 1 -6  27  11 o 3  1.25360e+01 6.99884e-01 2.53756e+02 211.204 -1.59528e+01 -9.66305e+00 0.00000e+00 0.00000e+00 2.02367e+02 211.204 5.13883e+01 31.204  0.9728 
1 1 1 -6  27  12 o 15 2.24295e+01 7.19488e-01 3.91639e+02 297.819 2.99017e+01  -5.66679e+01 0.00000e+00 0.00000e+00 4.39911e+02 297.819 4.82714e+01 297.819 0.9922 
1 1 1 -6  27  13 o 15 1.70272e+01 7.14941e-01 3.31033e+02 246.479 -1.99062e+01 -4.57348e+01 0.00000e+00 0.00000e+00 2.98175e+02 246.479 3.28587e+01 66.479  0.9899 
1 1 1 -6  27  14 o 12 9.65875e+00 9.13437e-01 1.77071e+02 47.598  1.19524e+01  1.30884e+01  0.00000e+00 0.00000e+00 1.72786e+02 47.598  4.28491e+00 227.598 0.9714 
1 1 1 -6  27  15 o 9  4.91209e+00 1.13405e+00 7.94089e+01 56.877  2.48169e+00  3.80351e+00  0.00000e+00 0.00000e+00 8.18794e+01 56.877  2.47050e+00 56.877  0.8815 
1 1 1 -6  27  16 o 3  1.04710e+01 1.16788e+00 8.79095e+01 224.991 -8.39310e+00 -8.39045e+00 0.00000e+00 0.00000e+00 2.84853e+02 224.991 1.96943e+02 224.991 0.9569 
1 1 1 -6  27  17 o 19 4.78039e+00 1.47930e+00 1.01843e+02 347.350 5.50883e+00  -1.23641e+00 0.00000e+00 0.00000e+00 5.91684e+01 347.350 4.26749e+01 167.350 0.9065 
1 1 1 -6  27  18 o 3  8.19730e+00 1.97744e+00 1.30166e+02 100.437 -1.75387e+00 9.52107e+00  0.00000e+00 0.00000e+00 1.57852e+02 100.437 2.76864e+01 100.437 0.9469 
1 1 1 -6  28  1  o 1  2.35426e+01 5.79318e-01 7.38697e+02 282.451 4.47054e+00  -2.02465e+01 0.00000e+00 0.00000e+00 1.25519e+02 282.451 6.13178e+02 102.451 0.9756 
1 1 1 -6  28  2  o 17 2.03406e+01 4.52791e-01 4.23516e+02 17.709  9.06086e+00  2.89326e+00  0.00000e+00 0.00000e+00 3.00183e+02 17.709  1.23333e+02 197.709 0.9459 
1 1 1 -6  28  3  o 6  2.79146e+01 7.05093e-01 7.44978e+02 230.994 -1.54998e+01 -1.91366e+01 0.00000e+00 0.00000e+00 2.83077e+02 230.994 4.61901e+02 50.994  0.9795 
1 1 1 -6  28  4  o 15 2.06611e+01 4.26732e-01 4.79497e+02 275.294 1.19247e+00  -1.28679e+01 0.00000e+00 0.00000e+00 2.66331e+02 275.294 2.13165e+02 95.294  0.9605 
1 1 1 -6  28  5  o 6  2.62813e+01 6.64187e-01 4.62895e+02 231.401 -1.02552e+01 -1.28470e+01 0.00000e+00 0.00000e+00 4.93808e+02 231.401 3.09136e+01 231.401 0.9691 
1 1 1 -6  28  6  o 5  4.32408e+01 7.47925e-01 7.25903e+02 128.402 -3.39322e+01 4.28092e+01  0.00000e+00 0.00000e+00 8.82510e+02 128.402 1.56607e+02 128.402 0.9908 
1 1 1 -6  28  7  o 10 4.00153e+01 8.88271e-01 6.88425e+02 116.682 -2.63945e+01 5.25201e+01  0.00000e+00 0.00000e+00 8.00036e+02 116.682 1.11611e+02 116.682 0.9915 
1 1 1 -6  28  8  o 10 1.65546e+01 7.75827e-01 2.35307e+02 55.821  5.62968e+00  8.29039e+00  0.00000e+00 0.00000e+00 3.53519e+02 55.821  1.18212e+02 55.821  0.9487 
1 1 1 -6  28  9  o 14 2.02649e+01 4.67536e-01 4.16334e+02 206.723 -2.35097e+01 -1.18362e+01 0.00000e+00 0.00000e+00 3.28288e+02 206.723 8.80460e+01 26.723  0.9808 
1 1 1 -6  28  10 o 15 3.44872e+01 5.73675e-01 5.39596e+02 35.688  6.45078e+01  4.63325e+01  0.00000e+00 0.00000e+00 7.43183e+02 35.688  2.03587e+02 35.688  0.9937 
1 1 1 -6  28  11 o 6  7.68239e+00 8.52156e-01 1.28355e+02 195.570 -5.41520e+00 -1.50885e+00 0.00000e+00 0.00000e+00 1.31966e+02 195.570 3.61166e+00 195.570 0.9060 
1 1 1 -6  28  12 o 18 1.48035e+01 6.98979e-01 2.69558e+02 49.380  1.86652e+01  2.17619e+01  0.00000e+00 0.00000e+00 2.73824e+02 49.380  4.26633e+00 49.380  0.9824 
1 1 1 -6  28  13 o 4  1.33792e+01 7.26966e-01 2.54917e+02 264.533 -3.02510e+00 -3.16100e+01 0.00000e+00 0.00000e+00 2.36553e+02 264.533 1.83633e+01 84.533  0.9841 
1 1 1 -6  28  14 o 8  1.75477e+01 7.84226e-01 3.69513e+02 338.999 6.54044e+01  -2.51082e+01 0.00000e+00 0.00000e+00 2.80093e+02 338.999 8.94197e+01 158.999 0.9928 
1 1 1 -6  28  15 o 9  7.69478e+00 1.16970e+00 1.54640e+02 43.359  9.47948e+00  8.95145e+00  0.00000e+00 0.00000e+00 1.20728e+02 43.359  3.39120e+01 223.359 0.9609 
1 1 1 -6  28  16 o 16 3.92130e+00 1.18236e+00 6.91276e+01 159.816 -3.25040e+00 1.19490e+00  0.00000e+00 0.00000e+00 5.32824e+01 159.816 1.58452e+01 339.816 0.8392 
1 1 1 -6  28  17 o 13 9.90083e+00 1.61909e+00 1.63794e+02 173.130 -1.70648e+01 2.05601e+00  0.00000e+00 0.00000e+00 1.93193e+02 173.130 2.93996e+01 173.130 0.9705 
1 1 1 -6  28  18 o 11 5.07768e+00 1.60210e+00 1.00033e+02 141.153 -4.63464e+00 3.73262e+00  0.00000e+00 0.00000e+00 7.17175e+01 141.153 2.83152e+01 321.153 0.9116 
1 1 1 -6  29  1  o 12 1.97949e+01 4.96774e-01 5.67727e+02 226.916 -8.48467e+00 -9.07192e+00 0.00000e+00 0.00000e+00 1.46408e+02 226.916 4.21319e+02 46.916  0.9589 
1 1 1 -6  29  2  o 17 2.23637e+01 5.39770e-01 5.47062e+02 203.114 -1.47688e+01 -6.30381e+00 0.00000e+00 0.00000e+00 2.67455e+02 203.114 2.79607e+02 23.114  0.9683 
1 1 1 -6  29  3  o 16 1.69797e+01 5.20690e-01 1.25675e+02 170.930 -2.48913e+00 3.97346e-01  0.00000e+00 0.00000e+00 3.64112e+02 170.930 2.38437e+02 170.930 0.7672 
1 1 1 -6  29  4  o 12 9.18883e+00 5.90583e-01 1.59215e+02 358.348 1.87034e+00  -5.39499e-02 0.00000e+00 0.00000e+00 7.40230e+01 358.348 8.51919e+01 178.348 0.6754 
1 1 1 -6  29  5  o 5  4.15293e+01 6.89424e-01 6.63830e+02 92.082  -1.58435e+00 4.35769e+01  0.00000e+00 0.00000e+00 8.78043e+02 92.082  2.14213e+02 92.082  0.9885 
1 1 1 -6  29  6  o 11 2.14246e+01 4.57303e-01 4.48372e+02 19.409  1.55526e+01  5.47979e+00  0.00000e+00 0.00000e+00 3.31104e+02 19.409  1.17269e+02 199.409 0.9692 
1 1 1 -6  29  7  o 2  2.11202e+01 5.58050e-01 5.45401e+02 307.078 1.50538e+01  -1.99208e+01 0.00000e+00 0.00000e+00 2.30891e+02 307.078 3.14510e+02 127.078 0.9798 
1 1 1 -6  29  8  o 3  1.07196e+01 4.26220e-01 2.86926e+02 257.246 -1.87578e+00 -8.28727e+00 0.00000e+00 0.00000e+00 9.04924e+01 257.246 1.96434e+02 77.246  0.9392 
1 1 1 -6  29  9  o 14 2.42346e+01 5.55152e-01 3.84313e+02 26.773  2.66217e+01  1.34317e+01  0.00000e+00 0.00000e+00 5.08164e+02 26.773  1.23851e+02 26.773  0.9831 
1 1 1 -6  29  10 o 7  2.59681e+01 4.78149e-01 4.35392e+02 158.691 -4.51817e+01 1.76240e+01  0.00000e+00 0.00000e+00 5.26501e+02 158.691 9.11088e+01 158.691 0.9896 
1 1 1 -6  29  11 o 14 1.13769e+01 4.77784e-01 2.99640e+02 43.807  1.42082e+01  1.36286e+01  0.00000e+00 0.00000e+00 1.14862e+02 43.807  1.84778e+02 223.807 0.9743 
1 1 1 -6  29  12 o 14 2.03956e+01 7.15112e-01 3.30620e+02 215.475 -3.92305e+01 -2.79568e+01 0.00000e+00 0.00000e+00 4.23431e+02 215.475 9.28114e+01 215.475 0.9896 
1 1 1 -6  29  13 o 6  4.48222e+00 1.04369e+00 9.32686e+01 294.538 1.47022e+00  -3.22050e+00 0.00000e+00 0.00000e+00 4.77879e+01 294.538 4.54806e+01 114.538 0.8432 
1 1 1 -6  29  14 o 11 4.98135e+00 1.12446e+00 7.10125e+01 66.399  1.41025e+00  3.22773e+00  0.00000e+00 0.00000e+00 8.54151e+01 66.399  1.44026e+01 66.399  0.8423 
1 1 1 -6  29  15 o 5  3.74536e+00 1.09191e+00 5.08944e+01 317.872 1.65580e+00  -1.49760e+00 0.00000e+00 0.00000e+00 5.12772e+01 317.872 3.82819e-01 317.872 0.7325 
1 1 1 -6  29  16 o 18 1.17510e+01 1.12865e+00 1.75925e+02 107.913 -7.89225e+00 2.44162e+01  0.00000e+00 0.00000e+00 2.52579e+02 107.913 7.66538e+01 107.913 0.9803 
1 1 1 -6  29  17 o 12 4.32039e+00 1.39513e+00 1.07146e+02 266.936 -3.07236e-01 -5.73969e+00 0.00000e+00 0.00000e+00 3.86347e+01 266.936 6.85113e+01 86.936  0.9083 
1 1 1 -6  29  18 o 17 4.27352e+00 1.41946e+00 6.60368e+01 145.775 -3.15432e+00 2.14572e+00  0.00000e+00 0.00000e+00 6.96895e+01 145.775 3.65275e+00 145.775 0.8560 
1 1 1 -6  30  1  o 15 3.54784e+01 7.28753e-01 6.32453e+02 343.055 2.80517e+01  -8.54660e+00 0.00000e+00 0.00000e+00 6.79336e+02 343.055 4.68827e+01 343.055 0.9828 
1 1 1 -6  30  2  o 1  2.65340e+01 5.29700e-01 6.56386e+02 233.422 -1.23807e+01 -1.66839e+01 0.00000e+00 0.00000e+00 3.17208e+02 233.422 3.39177e+02 53.422  0.9756 
1 1 1 -6  30  3  o 7  1.78386e+01 4.01234e-01 4.08821e+02 76.260  2.13058e+00  8.71374e+00  0.00000e+00 0.00000e+00 2.23241e+02 76.260  1.85581e+02 256.260 0.9425 
1 1 1 -6  30  4  o 18 1.45185e+01 3.79304e-01 2.53536e+02 239.911 -2.35765e+00 -4.06900e+00 0.00000e+00 0.00000e+00 2.29830e+02 239.911 2.37064e+01 59.911  0.8860 
1 1 1 -6  30  5  o 9  2.85813e+01 7.68649e-01 6.19150e+02 53.170  1.63108e+01  2.17793e+01  0.00000e+00 0.00000e+00 4.34382e+02 53.170  1.84768e+02 233.170 0.9814 
1 1 1 -6  30  6  o 5  2.15736e+01 4.44558e-01 3.28972e+02 42.162  8.98836e+00  8.13934e+00  0.00000e+00 0.00000e+00 4.46668e+02 42.162  1.17695e+02 42.162  0.9578 
1 1 1 -6  30  7  o 17 1.47085e+01 6.39239e-01 2.28793e+02 169.197 -7.29904e+00 1.39271e+00  0.00000e+00 0.00000e+00 2.84355e+02 169.197 5.55623e+01 169.197 0.9300 
1 1 1 -6  30  8  o 6  1.90861e+01 4.44577e-01 2.91407e+02 45.310  1.07696e+01  1.08868e+01  0.00000e+00 0.00000e+00 4.00276e+02 45.310  1.08868e+02 45.310  0.9668 
1 1 1 -6  30  9  o 3  3.44632e+01 6.29265e-01 6.57302e+02 239.462 -3.65262e+01 -6.19154e+01 0.00000e+00 0.00000e+00 6.24580e+02 239.462 3.27224e+01 59.462  0.9930 
1 1 1 -6  30  10 o 16 1.11461e+01 3.96535e-01 1.54055e+02 84.934  6.74414e-01  7.60703e+00  0.00000e+00 0.00000e+00 2.34745e+02 84.934  8.06900e+01 84.934  0.9320 
1 1 1 -6  30  11 o 18 1.32915e+01 3.96712e-01 2.33586e+02 70.304  6.13651e+00  1.71420e+01  0.00000e+00 0.00000e+00 2.49578e+02 70.304  1.59918e+01 70.304  0.9721 
1 1 1 -6  30  12 o 10 2.16106e+01 7.17879e-01 3.27192e+02 12.394  5.20219e+01  1.14320e+01  0.00000e+00 0.00000e+00 4.72519e+02 12.394  1.45327e+02 12.394  0.9906 
1 1 1 -6  30  13 o 4  1.19717e+01 7.71216e-01 1.85003e+02 290.446 7.19106e+00  -1.92890e+01 0.00000e+00 0.00000e+00 2.50795e+02 290.446 6.57923e+01 290.446 0.9754 
1 1 1 -6  30  14 o 1  4.54215e+00 1.13409e+00 1.87043e+02 151.421 -7.74494e+00 4.21903e+00  0.00000e+00 0.00000e+00 2.76191e+01 331.421 2.14662e+02 331.421 0.9415 
1 1 1 -6  30  15 o 12 4.52935e+00 1.16910e+00 7.26881e+01 27.272  3.29761e+00  1.69998e+00  0.00000e+00 0.00000e+00 7.09089e+01 27.272  1.77918e+00 207.272 0.8514 
1 1 1 -6  30  16 o 8  3.45619e+00 1.08807e+00 4.47979e+01 46.377  1.49885e+00  1.57267e+00  0.00000e+00 0.00000e+00 4.82940e+01 46.377  3.49606e+00 46.377  0.7242 
1 1 1 -6  30  17 o 11 5.40674e+00 1.50858e+00 4.60258e+01 126.526 -1.62740e+00 2.19721e+00  0.00000e+00 0.00000e+00 1.12292e+02 126.526 6.62666e+01 126.526 0.7882 
1 1 1 -6  30  18 o 2  4.60448e+00 1.50977e+00 9.22903e+01 65.646  2.29417e+00  5.06839e+00  0.00000e+00 0.00000e+00 6.23030e+01 65.646  2.99873e+01 245.646 0.9050 
1 1 1 -6  31  1  o 5  2.80061e+01 6.20580e-01 4.96490e+02 247.218 -6.41632e+00 -1.52773e+01 0.00000e+00 0.00000e+00 5.24751e+02 247.218 2.82603e+01 247.218 0.9693 
1 1 1 -6  31  2  o 4  1.67188e+01 4.19028e-01 3.25405e+02 63.542  2.87446e+00  5.77585e+00  0.00000e+00 0.00000e+00 2.52299e+02 63.542  7.31059e+01 243.542 0.9188 
1 1 1 -6  31  3  f 0  8.96824e+00 6.53414e-01 2.30661e+02 169.170 -2.63988e+00 5.05022e-01  0.00000e+00 0.00000e+00 3.36325e+01 169.170 1.97029e+02 349.170 0.7840 
1 1 1 -6  31  4  o 7  5.63490e+00 5.20517e-01 2.99508e+02 154.325 -2.00727e+00 9.64954e-01  0.00000e+00 0.00000e+00 1.44576e+02 334.325 4.44084e+02 334.325 0.7318 
1 1 1 -6  31  5  o 16 1.48240e+01 6.11929e-01 8.71219e+01 43.970  1.43048e+00  1.37996e+00  0.00000e+00 0.00000e+00 3.00196e+02 43.970  2.13074e+02 43.970  0.6957 
1 1 1 -6  31  6  o 9  1.36258e+01 3.90093e-01 2.85369e+02 317.173 4.91640e+00  -4.55701e+00 0.00000e+00 0.00000e+00 1.86188e+02 317.173 9.91805e+01 137.173 0.9221 
1 1 1 -6  31  7  o 18 1.16558e+01 5.84778e-01 2.42762e+02 107.569 -2.08700e+00 6.59127e+00  0.00000e+00 0.00000e+00 1.61447e+02 107.569 8.13154e+01 287.569 0.9246 
1 1 1 -6  31  8  o 8  1.85978e+01 4.45184e-01 3.97334e+02 160.005 -1.95591e+01 7.11684e+00  0.00000e+00 0.00000e+00 2.82799e+02 160.005 1.14535e+02 340.005 0.9757 
1 1 1 -6  31  9  o 9  3.12564e+01 6.20882e-01 5.41579e+02 320.460 4.27690e+01  -3.53059e+01 0.00000e+00 0.00000e+00 6.18494e+02 320.460 7.69152e+01 320.460 0.9909 
1 1 1 -6  31  10 o 8  2.81060e+01 5.04334e-01 5.11348e+02 22.160  6.14594e+01  2.50312e+01  0.00000e+00 0.00000e+00 5.32512e+02 22.160  2.11632e+01 22.160  0.9924 
1 1 1 -6  31  11 o 1  1.31889e+01 4.23796e-01 2.51822e+02 93.424  -1.15771e+00 1.93488e+01  0.00000e+00 0.00000e+00 2.28420e+02 93.424  2.34021e+01 273.424 0.9739 
1 1 1 -6  31  12 o 10 1.08958e+01 7.56030e-01 1.79787e+02 221.078 -1.19225e+01 -1.03927e+01 0.00000e+00 0.00000e+00 2.14141e+02 221.078 3.43546e+01 221.078 0.9679 
1 1 1 -6  31  13 o 16 5.96611e+00 9.72835e-01 1.60594e+02 142.654 -6.67893e+00 5.09640e+00  0.00000e+00 0.00000e+00 4.83413e+01 142.654 1.12253e+02 322.654 0.9384 
1 1 1 -6  31  14 o 11 6.25983e+00 1.14398e+00 1.11662e+02 336.978 6.89752e+00  -2.93096e+00 0.00000e+00 0.00000e+00 1.05511e+02 336.978 6.15061e+00 156.978 0.9307 
1 1 1 -6  31  15 o 19 5.21666e+00 1.12971e+00 7.63427e+01 292.416 1.82980e+00  -4.43597e+00 0.00000e+00 0.00000e+00 9.62423e+01 292.416 1.98996e+01 292.416 0.8885 
1 1 1 -6  31  16 o 4  1.32916e+01 1.07496e+00 2.87158e+02 24.876  4.88934e+01  2.26705e+01  0.00000e+00 0.00000e+00 2.02566e+02 24.876  8.45920e+01 204.876 0.9907 
1 1 1 -6  31  17 o 2  5.05712e+00 1.50977e+00 1.25941e+02 278.399 1.08557e+00  -7.35189e+00 0.00000e+00 0.00000e+00 4.87661e+01 278.399 7.71748e+01 98.400  0.9301 
1 1 1 -6  31  18 o 3  4.21624e+00 1.39905e+00 2.52933e+01 180.485 -1.51299e+00 -1.28184e-02 0.00000e+00 0.00000e+00 6.84474e+01 180.485 4.31541e+01 180.485 0.5993 
1 1 1 -6  32  1  o 18 2.74494e+01 7.69367e-01 3.78926e+02 89.321  1.45016e-01  1.22323e+01  0.00000e+00 0.00000e+00 6.10441e+02 89.321  2.31516e+02 89.321  0.9582 
1 1 1 -6  32  2  o 9  3.29064e+01 6.87931e-01 6.28868e+02 278.565 3.76807e+00  -2.50182e+01 0.00000e+00 0.00000e+00 5.83792e+02 278.565 4.50766e+01 98.565  0.9800 
1 1 1 -6  32  3  o 9  3.23175e+01 5.68828e-01 9.67926e+02 127.319 -2.43065e+01 3.18849e+01  0.00000e+00 0.00000e+00 2.31568e+02 127.319 7.36357e+02 307.319 0.9874 
1 1 1 -6  32  4  o 1  1.91866e+01 4.18209e-01 3.20259e+02 240.578 -4.11387e+00 -7.29430e+00 0.00000e+00 0.00000e+00 3.56076e+02 240.578 3.58171e+01 240.578 0.9382 
1 1 1 -6  32  5  o 14 1.93284e+01 4.47956e-01 2.78864e+02 251.715 -3.20502e+00 -9.69958e+00 0.00000e+00 0.00000e+00 4.10446e+02 251.715 1.31582e+02 251.715 0.9497 
1 1 1 -6  32  6  o 8  1.47507e+01 3.92993e-01 3.31936e+02 247.376 -3.97301e+00 -9.53343e+00 0.00000e+00 0.00000e+00 1.94126e+02 247.376 1.37810e+02 67.376  0.9503 
1 1 1 -6  32  7  o 18 3.82332e+01 7.59012e-01 5.85246e+02 77.221  1.19191e+01  5.25503e+01  0.00000e+00 0.00000e+00 8.35341e+02 77.221  2.50095e+02 77.221  0.9907 
1 1 1 -6  32  8  o 18 2.67737e+01 5.30802e-01 4.82055e+02 291.733 1.44606e+01  -3.62764e+01 0.00000e+00 0.00000e+00 5.08473e+02 291.733 2.64176e+01 291.733 0.9871 
1 1 1 -6  32  9  o 2  3.12702e+01 5.43051e-01 6.32160e+02 112.601 -2.70437e+01 6.49638e+01  0.00000e+00 0.00000e+00 5.30580e+02 112.601 1.01580e+02 292.601 0.9929 
1 1 1 -6  32  10 o 16 7.18000e+00 4.80054e-01 1.39688e+02 6.966   4.86267e+00  5.94127e-01  0.00000e+00 0.00000e+00 9.96974e+01 6.966   3.99901e+01 186.966 0.8910 
1 1 1 -6  32  11 o 1  8.93509e+00 3.66751e-01 1.84033e+02 76.776  2.35392e+00  1.00173e+01  0.00000e+00 0.00000e+00 1.33350e+02 76.776  5.06831e+01 256.776 0.9501 
1 1 1 -6  32  12 o 7  1.38119e+01 7.31761e-01 2.99364e+02 315.803 2.39933e+01  -2.33298e+01 0.00000e+00 0.00000e+00 2.08767e+02 315.803 9.05967e+01 135.803 0.9849 
1 1 1 -6  32  13 o 11 6.49444e+00 9.53545e-01 9.10971e+01 153.920 -5.14806e+00 2.51981e+00  0.00000e+00 0.00000e+00 1.28936e+02 153.920 3.78394e+01 153.920 0.9080 
1 1 1 -6  32  14 o 14 4.41717e+00 1.07065e+00 4.78264e+01 58.384  1.22556e+00  1.99087e+00  0.00000e+00 0.00000e+00 7.50244e+01 58.384  2.71980e+01 58.384  0.7461 
1 1 1 -6  32  15 o 7  8.84453e+00 1.02532e+00 8.42061e+01 19.807  8.70427e+00  3.13498e+00  0.00000e+00 0.00000e+00 2.26754e+02 19.807  1.42548e+02 19.807  0.9443 
1 1 1 -6  32  16 o 6  8.50165e+00 1.29394e+00 1.57293e+02 119.332 -7.66432e+00 1.36396e+01  0.00000e+00 0.00000e+00 1.48590e+02 119.332 8.70267e+00 299.332 0.9675 
1 1 1 -6  32  17 o 6  4.04866e+00 1.31795e+00 8.68092e+01 230.798 -2.93384e+00 -3.59703e+00 0.00000e+00 0.00000e+00 4.61742e+01 230.798 4.06349e+01 50.798  0.8844 
1 1 1 -6  32  18 o 13 3.74721e+00 1.28467e+00 3.14561e+01 46.967  1.19469e+00  1.27966e+00  0.00000e+00 0.00000e+00 5.92068e+01 46.967  2.77507e+01 46.967  0.6523 
1 1 1 -6  33  1  o 12 1.43903e+01 4.11136e-01 3.42474e+02 36.846  4.85903e+00  3.64109e+00  0.00000e+00 0.00000e+00 1.51933e+02 36.846  1.90542e+02 216.846 0.9135 
1 1 1 -6  33  2  o 15 1.69863e+01 4.26622e-01 8.87163e+01 296.781 8.88108e-01  -1.75961e+00 0.00000e+00 0.00000e+00 3.53857e+02 296.781 2.65141e+02 296.781 0.6930 
1 1 1 -6  33  3  o 4  1.82345e+01 5.44720e-01 2.58177e+02 148.891 -5.13501e+00 3.09878e+00  0.00000e+00 0.00000e+00 3.67066e+02 148.891 1.08889e+02 148.891 0.9123 
1 1 1 -6  33  4  o 11 2.09479e+01 6.24242e-01 3.64703e+02 285.715 3.28570e+00  -1.16778e+01 0.00000e+00 0.00000e+00 3.89084e+02 285.715 2.43818e+01 285.715 0.9579 
1 1 1 -6  33  5  o 10 2.12990e+01 8.09627e-01 1.44664e+02 121.365 -2.78668e+00 4.57165e+00  0.00000e+00 0.00000e+00 5.75888e+02 121.365 4.31223e+02 121.365 0.9010 
1 1 1 -6  33  6  o 12 3.31149e+01 5.81481e-01 5.24401e+02 74.934  9.42665e+00  3.50200e+01  0.00000e+00 0.00000e+00 7.01020e+02 74.934  1.76619e+02 74.934  0.9861 
1 1 1 -6  33  7  o 16 2.73167e+01 6.25847e-01 4.49146e+02 51.464  1.82814e+01  2.29533e+01  0.00000e+00 0.00000e+00 5.57681e+02 51.464  1.08535e+02 51.464  0.9828 
1 1 1 -6  33  8  o 18 4.27759e+01 7.46766e-01 6.17580e+02 309.126 4.94706e+01  -6.08177e+01 0.00000e+00 0.00000e+00 9.75227e+02 309.126 3.57647e+02 309.126 0.9936 
1 1 1 -6  33  9  o 10 2.05368e+01 4.34206e-01 4.59998e+02 258.893 -6.33723e+00 -3.22793e+01 0.00000e+00 0.00000e+00 2.97271e+02 258.893 1.62726e+02 78.893  0.9847 
1 1 1 -6  33  10 o 2  4.19484e+00 6.33054e-01 7.93578e+01 110.271 -5.53269e-01 1.49804e+00  0.00000e+00 0.00000e+00 1.78297e+01 110.271 6.15281e+01 290.271 0.6192 
1 1 1 -6  33  11 o 18 1.57892e+01 3.86198e-01 2.26924e+02 276.885 2.73827e+00  -2.26772e+01 0.00000e+00 0.00000e+00 3.50264e+02 276.885 1.23340e+02 276.885 0.9779 
1 1 1 -6  33  12 o 4  9.66518e+00 7.95791e-01 2.19699e+02 174.863 -1.59617e+01 1.43502e+00  0.00000e+00 0.00000e+00 1.29829e+02 174.863 8.98702e+01 354.863 0.9683 
1 1 1 -6  33  13 o 11 6.88356e+00 1.00974e+00 1.59557e+02 159.390 -9.74525e+00 3.66499e+00  0.00000e+00 0.00000e+00 8.46099e+01 159.390 7.49471e+01 339.390 0.9507 
1 1 1 -6  33  14 o 1  5.80080e+00 1.12751e+00 6.59199e+01 321.067 3.20277e+00  -2.58733e+00 0.00000e+00 0.00000e+00 1.21718e+02 321.067 5.57982e+01 321.067 0.8679 
1 1 1 -6  33  15 o 13 7.72785e+00 1.13705e+00 1.63399e+02 284.577 3.68538e+00  -1.41715e+01 0.00000e+00 0.00000e+00 1.14296e+02 284.577 4.91032e+01 104.577 0.9652 
1 1 1 -6  33  16 o 19 4.61452e+00 1.26187e+00 5.93772e+01 344.633 3.40121e+00  -9.34708e-01 0.00000e+00 0.00000e+00 8.51901e+01 344.633 2.58129e+01 344.633 0.8425 
1 1 1 -6  33  17 o 8  5.72826e+00 1.56515e+00 7.32319e+01 217.158 -3.72268e+00 -2.82133e+00 0.00000e+00 0.00000e+00 1.15072e+02 217.158 4.18404e+01 217.158 0.8851 
1 1 1 -6  33  18 o 18 7.00515e+00 1.74657e+00 7.57800e+01 10.607  5.56834e+00  1.04282e+00  0.00000e+00 0.00000e+00 1.59828e+02 10.607  8.40484e+01 10.607  0.9068 
1 1 1 -6  34  1  o 5  4.53449e+01 8.06831e-01 8.30948e+02 308.440 3.03020e+01  -3.81767e+01 0.00000e+00 0.00000e+00 8.56811e+02 308.440 2.58626e+01 308.440 0.9897 
1 1 1 -6  34  2  o 8  3.30766e+01 6.22256e-01 6.36526e+02 186.449 -2.67798e+01 -3.02726e+00 0.00000e+00 0.00000e+00 5.83718e+02 186.449 5.28079e+01 6.449   0.9813 
1 1 1 -6  34  3  o 15 1.85131e+01 5.73359e-01 1.62196e+02 227.392 -2.67943e+00 -2.91302e+00 0.00000e+00 0.00000e+00 4.37451e+02 227.392 2.75255e+02 227.392 0.8619 
1 1 1 -6  34  4  o 14 2.88127e+01 5.82483e-01 5.09431e+02 342.569 2.17002e+01  -6.81353e+00 0.00000e+00 0.00000e+00 5.48816e+02 342.569 3.93854e+01 342.569 0.9778 
1 1 1 -6  34  5  o 5  4.27409e+01 8.21823e-01 7.94298e+02 48.497  3.80753e+01  4.30325e+01  0.00000e+00 0.00000e+00 7.96357e+02 48.497  2.05835e+00 48.497  0.9913 
1 1 1 -6  34  6  o 9  4.41822e+01 7.33021e-01 8.13722e+02 57.590  3.97689e+01  6.26419e+01  0.00000e+00 0.00000e+00 8.32904e+02 57.590  1.91820e+01 57.590  0.9932 
1 1 1 -6  34  7  o 15 3.10727e+01 6.03989e-01 4.76051e+02 276.962 4.77988e+00  -3.91427e+01 0.00000e+00 0.00000e+00 6.74266e+02 276.962 1.98214e+02 276.962 0.9872 
1 1 1 -6  34  8  o 9  1.20499e+01 4.31711e-01 3.43042e+02 2.596   1.18996e+01  5.39485e-01  0.00000e+00 0.00000e+00 8.91088e+01 2.596   2.53934e+02 182.596 0.9571 
1 1 1 -6  34  9  o 2  2.32135e+01 4.57106e-01 5.75325e+02 223.061 -3.38300e+01 -3.16146e+01 0.00000e+00 0.00000e+00 2.84443e+02 223.061 2.90882e+02 43.061  0.9891 
1 1 1 -6  34  10 o 3  1.60902e+01 6.14490e-01 3.51640e+02 46.234  1.83622e+01  1.91709e+01  0.00000e+00 0.00000e+00 2.38897e+02 46.234  1.12743e+02 226.234 0.9810 
1 1 1 -6  34  11 o 10 7.18502e+00 4.24188e-01 8.19633e+01 74.801  1.07852e+00  3.96997e+00  0.00000e+00 0.00000e+00 1.51098e+02 74.801  6.91344e+01 74.801  0.8678 
1 1 1 -6  34  12 o 5  6.77928e+00 9.78651e-01 1.65498e+02 70.738  2.89227e+00  8.27659e+00  0.00000e+00 0.00000e+00 7.27648e+01 70.738  9.27335e+01 250.738 0.9411 
1 1 1 -6  34  13 o 3  5.26076e+00 9.23206e-01 7.79711e+01 154.846 -3.56741e+00 1.67523e+00  0.00000e+00 0.00000e+00 9.10563e+01 154.846 1.30852e+01 154.846 0.8612 
1 1 1 -6  34  14 o 7  1.15598e+01 8.95006e-01 1.98810e+02 16.124  2.48602e+01  7.18677e+00  0.00000e+00 0.00000e+00 2.23587e+02 16.124  2.47769e+01 16.124  0.9805 
1 1 1 -6  34  15 o 8  6.66272e+00 1.26334e+00 1.16834e+02 256.406 -1.98918e+00 -8.22610e+00 0.00000e+00 0.00000e+00 1.16039e+02 256.406 7.94487e-01 76.406  0.9389 
1 1 1 -6  34  16 o 3  1.32014e+01 1.09890e+00 2.21762e+02 48.948  2.58270e+01  2.96559e+01  0.00000e+00 0.00000e+00 2.62799e+02 48.948  4.10371e+01 48.948  0.9872 
1 1 1 -6  34  17 o 2  6.52568e+00 1.69620e+00 1.05739e+02 147.891 -6.17265e+00 3.87342e+00  0.00000e+00 0.00000e+00 1.19290e+02 147.891 1.35513e+01 147.891 0.9286 
1 1 1 -6  34  18 o 12 6.42332e+00 1.67413e+00 1.46681e+02 288.633 3.52308e+00  -1.04488e+01 0.00000e+00 0.00000e+00 8.04626e+01 288.633 6.62183e+01 108.633 0.9535 
1 1 1 -6  35  1  o 18 2.23671e+01 4.87946e-01 4.28195e+02 245.607 -5.08257e+00 -1.12080e+01 0.00000e+00 0.00000e+00 3.77981e+02 245.607 5.02147e+01 65.607  0.9585 
1 1 1 -6  35  2  o 19 2.65855e+01 5.55932e-01 5.57884e+02 287.439 5.66016e+00  -1.80186e+01 0.00000e+00 0.00000e+00 4.14694e+02 287.439 1.43190e+02 107.439 0.9732 
1 1 1 -6  35  3  o 9  1.72986e+01 6.27204e-01 2.90799e+02 257.356 -1.49193e+00 -6.65060e+00 0.00000e+00 0.00000e+00 3.09456e+02 257.356 1.86565e+01 257.356 0.9234 
1 1 1 -6  35  4  o 9  1.41636e+01 3.83802e-01 5.67752e+01 325.470 1.02602e+00  -7.05965e-01 0.00000e+00 0.00000e+00 2.23384e+02 325.470 1.66609e+02 325.470 0.5266 
1 1 1 -6  35  5  o 16 2.47978e+01 6.53735e-01 4.30173e+02 216.764 -1.44932e+01 -1.08283e+01 0.00000e+00 0.00000e+00 4.74650e+02 216.764 4.44772e+01 216.764 0.9720 
1 1 1 -6  35  6  o 7  1.51916e+01 4.08938e-01 3.05521e+02 57.149  5.49102e+00  8.50384e+00  0.00000e+00 0.00000e+00 2.35524e+02 57.149  6.99967e+01 237.149 0.9492 
1 1 1 -6  35  7  o 13 1.76986e+01 4.25518e-01 5.24097e+02 40.044  1.86536e+01  1.56765e+01  0.00000e+00 0.00000e+00 1.25753e+02 40.044  3.98343e+02 220.044 0.9793 
1 1 1 -6  35  8  o 12 4.64940e+00 7.24052e-01 8.27604e+01 128.564 -7.61404e-01 9.55023e-01  0.00000e+00 0.00000e+00 7.71605e+00 128.564 7.50443e+01 308.564 0.5194 
1 1 1 -6  35  9  o 5  2.04689e+01 4.35822e-01 2.97308e+02 279.800 4.08400e+00  -2.36429e+01 0.00000e+00 0.00000e+00 4.52911e+02 279.800 1.55603e+02 279.800 0.9789 
1 1 1 -6  35  10 o 11 7.23836e+00 5.00615e-01 2.43199e+02 51.517  5.58169e+00  7.02140e+00  0.00000e+00 0.00000e+00 1.20123e+01 51.517  2.31187e+02 231.517 0.9425 
1 1 1 -6  35  11 o 7  1.60671e+01 4.05657e-01 2.44916e+02 139.460 -2.16403e+01 1.85090e+01  0.00000e+00 0.00000e+00 3.44978e+02 139.460 1.00062e+02 139.460 0.9823 
1 1 1 -6  35  12 o 18 7.15580e+00 9.29586e-01 1.67612e+02 328.012 8.15293e+00  -5.09222e+00 0.00000e+00 0.00000e+00 8.52888e+01 328.012 8.23233e+01 148.012 0.9465 
1 1 1 -6  35  13 o 17 1.29648e+01 7.81871e-01 2.15828e+02 69.646  1.02089e+01  2.75183e+01  0.00000e+00 0.00000e+00 2.59496e+02 69.646  4.36678e+01 69.646  0.9828 
1 1 1 -6  35  14 o 1  7.86743e+00 1.03371e+00 1.77412e+02 268.969 -2.90332e-01 -1.61378e+01 0.00000e+00 0.00000e+00 1.06528e+02 268.969 7.08840e+01 88.969  0.9685 
1 1 1 -6  35  15 o 15 1.08057e+01 1.03168e+00 1.77439e+02 158.282 -2.43313e+01 9.69147e+00  0.00000e+00 0.00000e+00 2.17018e+02 158.282 3.95791e+01 158.282 0.9807 
1 1 1 -6  35  16 o 18 5.12911e+00 1.33520e+00 5.47604e+01 254.199 -9.52902e-01 -3.36718e+00 0.00000e+00 0.00000e+00 1.05623e+02 254.199 5.08626e+01 254.199 0.8411 
1 1 1 -6  35  17 o 4  4.10317e+00 1.34396e+00 9.92671e+01 156.189 -4.66338e+00 2.05782e+00  0.00000e+00 0.00000e+00 3.71813e+01 156.189 6.20858e+01 336.189 0.8956 
1 1 1 -6  35  18 o 7  3.73336e+00 1.29813e+00 3.99392e+01 34.358  1.89973e+00  1.29875e+00  0.00000e+00 0.00000e+00 6.27212e+01 34.358  2.27820e+01 34.358  0.7415 
1 1 1 -6  36  1  o 9  3.82710e+01 7.02777e-01 9.42700e+02 225.836 -3.18681e+01 -3.28120e+01 0.00000e+00 0.00000e+00 4.80511e+02 225.836 4.62189e+02 45.836  0.9890 
1 1 1 -6  36  2  o 5  4.37966e+01 8.46421e-01 8.23006e+02 152.873 -4.18597e+01 2.14460e+01  0.00000e+00 0.00000e+00 8.05646e+02 152.873 1.73594e+01 332.872 0.9893 
1 1 1 -6  36  3  o 12 1.58055e+01 5.99068e-01 3.49233e+02 190.074 -8.62898e+00 -1.53310e+00 0.00000e+00 0.00000e+00 2.09655e+02 190.074 1.39578e+02 10.075  0.9411 
1 1 1 -6  36  4  f 0  2.25076e+01 4.53949e-01 3.28017e+02 126.701 -8.35273e+00 1.12054e+01  0.00000e+00 0.00000e+00 4.86467e+02 126.701 1.58451e+02 126.701 0.9635 
1 1 1 -6  36  5  o 7  1.79345e+01 4.16789e-01 1.69675e+02 178.640 -5.23922e+00 1.24336e-01  0.00000e+00 0.00000e+00 4.35326e+02 178.640 2.65651e+02 178.640 0.8987 
1 1 1 -6  36  6  o 12 2.89828e+01 5.33118e-01 4.59745e+02 37.707  2.33880e+01  1.80809e+01  0.00000e+00 0.00000e+00 6.09009e+02 37.707  1.49264e+02 37.707  0.9829 
1 1 1 -6  36  7  o 11 3.52417e+01 6.76507e-01 6.44476e+02 230.906 -3.90028e+01 -4.80032e+01 0.00000e+00 0.00000e+00 6.66062e+02 230.906 2.15853e+01 230.906 0.9919 
1 1 1 -6  36  8  f 0  1.17667e+01 4.23575e-01 1.56164e+02 68.739  2.08377e+00  5.35531e+00  0.00000e+00 0.00000e+00 2.44224e+02 68.739  8.80605e+01 68.739  0.9082 
1 1 1 -6  36  9  o 19 2.12636e+01 4.42900e-01 4.18206e+02 248.071 -1.43901e+01 -3.57446e+01 0.00000e+00 0.00000e+00 3.67436e+02 248.071 5.07704e+01 68.071  0.9869 
1 1 1 -6  36  10 o 19 1.45341e+01 4.12271e-01 2.84130e+02 233.092 -1.36817e+01 -1.82168e+01 0.00000e+00 0.00000e+00 2.47462e+02 233.092 3.66683e+01 53.092  0.9778 
1 1 1 -6  36  11 o 4  1.80141e+01 4.18260e-01 3.32398e+02 105.043 -1.11992e+01 4.16695e+01  0.00000e+00 0.00000e+00 3.32996e+02 105.043 5.98775e-01 105.043 0.9883 
1 1 1 -6  36  12 o 18 6.96421e+00 9.73378e-01 1.73683e+02 266.682 -5.80436e-01 -1.00107e+01 0.00000e+00 0.00000e+00 7.30165e+01 266.682 1.00667e+02 86.682  0.9487 
1 1 1 -6  36  13 o 14 2.67355e+00 8.56193e-01 3.21914e+01 180.666 -8.52011e-01 -9.90122e-03 0.00000e+00 0.00000e+00 6.85344e+00 180.666 2.53380e+01 0.666   0.3915 
1 1 1 -6  36  14 o 4  4.69331e+00 1.11676e+00 9.06945e+01 273.096 2.46774e-01  -4.56298e+00 0.00000e+00 0.00000e+00 6.36046e+01 273.096 2.70900e+01 93.096  0.8823 
1 1 1 -6  36  15 o 10 1.34547e+01 9.55976e-01 1.74876e+02 250.691 -1.07986e+01 -3.08207e+01 0.00000e+00 0.00000e+00 3.18159e+02 250.691 1.43284e+02 250.691 0.9846 
1 1 1 -6  36  16 o 2  4.03910e+00 1.19260e+00 1.00658e+02 81.816  7.85829e-01  5.46393e+00  0.00000e+00 0.00000e+00 3.51070e+01 81.816  6.55507e+01 261.816 0.9042 
1 1 1 -6  36  17 f 0  4.67218e+00 1.46951e+00 3.62834e+01 325.128 1.60630e+00  -1.11942e+00 0.00000e+00 0.00000e+00 8.35366e+01 325.128 4.72531e+01 325.128 0.6907 
1 1 1 -6  36  18 f 0  4.22131e+00 1.43026e+00 8.34248e+01 14.618  4.73646e+00  1.23531e+00  0.00000e+00 0.00000e+00 5.60187e+01 14.618  2.74062e+01 194.618 0.8909 
1 1 1 -6  37  1  f 0  5.70056e+01 9.92875e-01 1.04975e+03 72.666  2.31080e+01  7.40373e+01  0.00000e+00 0.00000e+00 1.07965e+03 72.666  2.99001e+01 72.666  0.9935 
1 1 1 -6  37  2  o 19 3.22883e+01 7.06037e-01 5.59106e+02 333.642 2.18414e+01  -1.08222e+01 0.00000e+00 0.00000e+00 6.29283e+02 333.642 7.01776e+01 333.642 0.9793 
1 1 1 -6  37  3  o 2  3.30611e+01 5.80564e-01 6.56529e+02 224.321 -2.40317e+01 -2.34688e+01 0.00000e+00 0.00000e+00 5.66942e+02 224.321 8.95868e+01 44.321  0.9850 
1 1 1 -6  37  4  o 7  8.66283e+00 4.86764e-01 1.34921e+01 151.174 -1.80108e-01 9.91199e-02  0.00000e+00 0.00000e+00 1.97716e+01 151.174 6.27947e+00 151.174 0.1023 
1 1 1 -6  37  5  o 17 3.34268e+01 6.43929e-01 6.30096e+02 136.317 -3.17576e+01 3.03301e+01  0.00000e+00 0.00000e+00 6.10158e+02 136.317 1.99384e+01 316.317 0.9885 
1 1 1 -6  37  6  o 14 4.31126e+01 7.16987e-01 8.47158e+02 211.841 -7.51242e+01 -4.66536e+01 0.00000e+00 0.00000e+00 7.60900e+02 211.841 8.62578e+01 31.841  0.9943 
1 1 1 -6  37  7  o 7  3.02705e+01 5.52428e-01 6.81290e+02 281.723 1.14656e+01  -5.52511e+01 0.00000e+00 0.00000e+00 4.43384e+02 281.723 2.37906e+02 101.723 0.9911 
1 1 1 -6  37  8  o 18 2.77280e+01 4.90589e-01 4.93689e+02 332.982 3.91682e+01  -1.99723e+01 0.00000e+00 0.00000e+00 5.33162e+02 332.982 3.94729e+01 332.982 0.9886 
1 1 1 -6  37  9  o 9  6.16463e+00 5.69072e-01 1.21390e+02 104.084 -7.77184e-01 3.09780e+00  0.00000e+00 0.00000e+00 6.86072e+01 104.084 5.27824e+01 284.084 0.8234 
1 1 1 -6  37  10 o 16 8.33187e+00 4.66524e-01 2.26217e+02 77.712  2.42429e+00  1.11301e+01  0.00000e+00 0.00000e+00 7.14035e+01 77.712  1.54814e+02 257.712 0.9550 
1 1 1 -6  37  11 o 11 6.54051e+00 4.88160e-01 1.76258e+02 274.698 7.11929e-01  -8.66345e+00 0.00000e+00 0.00000e+00 5.36351e+01 274.698 1.22623e+02 94.698  0.9406 
1 1 1 -6  37  12 o 10 6.81086e+00 9.90480e-01 1.24058e+02 99.686  -1.17025e+00 6.85615e+00  0.00000e+00 0.00000e+00 1.11155e+02 99.686  1.29025e+01 279.686 0.9250 
1 1 1 -6  37  13 o 13 7.20315e+00 9.87876e-01 1.47818e+02 119.742 -5.25719e+00 9.20117e+00  0.00000e+00 0.00000e+00 1.07825e+02 119.742 3.99934e+01 299.742 0.9516 
1 1 1 -6  37  14 o 4  7.92290e+00 1.03798e+00 1.62767e+02 292.511 5.47731e+00  -1.32163e+01 0.00000e+00 0.00000e+00 1.21902e+02 292.511 4.08649e+01 112.511 0.9644 
1 1 1 -6  37  15 o 19 5.31832e+00 1.28995e+00 4.53812e+01 165.765 -2.73248e+00 6.93222e-01  0.00000e+00 0.00000e+00 1.12096e+02 165.765 6.67146e+01 165.765 0.7957 
1 1 1 -6  37  16 o 12 6.60373e+00 1.40798e+00 9.90897e+01 343.789 7.45299e+00  -2.16678e+00 0.00000e+00 0.00000e+00 1.29967e+02 343.789 3.08776e+01 343.789 0.9332 
1 1 1 -6  37  17 o 8  7.31549e+00 1.77872e+00 1.52748e+02 33.713  9.12265e+00  6.08708e+00  0.00000e+00 0.00000e+00 1.06138e+02 33.713  4.66101e+01 213.713 0.9533 
1 1 1 -6  38  1  o 12 3.27326e+01 6.25664e-01 5.76636e+02 201.468 -2.37754e+01 -9.35002e+00 0.00000e+00 0.00000e+00 6.29566e+02 201.468 5.29303e+01 201.468 0.9802 
1 1 1 -6  38  2  o 14 1.50171e+01 4.03574e-01 7.94083e+01 290.764 6.74193e-01  -1.77821e+00 0.00000e+00 0.00000e+00 3.04894e+02 290.764 2.25486e+02 290.764 0.6810 
1 1 1 -6  38  3  o 16 8.73773e+00 6.58027e-01 1.50055e+02 7.000   2.45472e+00  3.01393e-01  0.00000e+00 0.00000e+00 1.00080e+02 7.000   4.99749e+01 187.000 0.7620 
1 1 1 -6  38  4  f 0  2.16959e+01 4.49630e-01 4.32787e+02 357.565 1.60825e+01  -6.83995e-01 0.00000e+00 0.00000e+00 3.56148e+02 357.565 7.66383e+01 177.565 0.9684 
1 1 1 -6  38  5  o 2  3.66526e+01 6.90715e-01 6.89466e+02 324.720 4.27705e+01  -3.02603e+01 0.00000e+00 0.00000e+00 6.72900e+02 324.720 1.65656e+01 144.720 0.9904 
1 1 1 -6  38  6  o 12 1.13511e+01 4.16293e-01 2.29853e+02 185.383 -6.28355e+00 -5.92069e-01 0.00000e+00 0.00000e+00 1.60541e+02 185.383 6.93121e+01 5.383   0.9169 
1 1 1 -6  38  7  o 5  2.39325e+01 4.84647e-01 4.75402e+02 268.272 -9.62788e-01 -3.19208e+01 0.00000e+00 0.00000e+00 4.07522e+02 268.272 6.78800e+01 88.272  0.9842 
1 1 1 -6  38  8  o 13 1.27529e+01 4.03560e-01 3.02731e+02 130.914 -8.41251e+00 9.70674e+00  0.00000e+00 0.00000e+00 1.55975e+02 130.914 1.46755e+02 310.914 0.9602 
1 1 1 -6  38  9  o 15 4.28369e+01 6.66780e-01 7.15216e+02 55.529  7.54351e+01  1.09877e+02  0.00000e+00 0.00000e+00 8.82106e+02 55.529  1.66890e+02 55.529  0.9962 
1 1 1 -6  38  10 o 16 6.84134e+00 5.35685e-01 1.16866e+02 30.601  3.95742e+00  2.34055e+00  0.00000e+00 0.00000e+00 1.09088e+02 30.601  7.77783e+00 210.601 0.8831 
1 1 1 -6  38  11 o 7  7.79271e+00 4.50344e-01 8.45607e+01 239.207 -2.56985e+00 -4.31211e+00 0.00000e+00 0.00000e+00 1.75705e+02 239.207 9.11447e+01 239.207 0.8938 
1 1 1 -6  38  12 o 16 5.47246e+00 8.84426e-01 8.11344e+01 91.343  -8.81829e-02 3.76059e+00  0.00000e+00 0.00000e+00 9.32632e+01 91.343  1.21288e+01 91.343  0.8537 
1 1 1 -6  38  13 o 8  7.35910e+00 1.01780e+00 6.89720e+01 250.466 -1.66712e+00 -4.69896e+00 0.00000e+00 0.00000e+00 1.76118e+02 250.466 1.07146e+02 250.466 0.8931 
1 1 1 -6  38  14 o 17 1.42332e+01 8.44892e-01 2.14196e+02 312.296 2.62114e+01  -2.88105e+01 0.00000e+00 0.00000e+00 3.09179e+02 312.296 9.49835e+01 312.296 0.9871 
1 1 1 -6  38  15 o 15 1.16858e+01 1.04031e+00 1.87262e+02 203.039 -2.67315e+01 -1.13683e+01 0.00000e+00 0.00000e+00 2.40025e+02 203.039 5.27628e+01 203.039 0.9826 
1 1 1 -6  38  16 o 7  5.42465e+00 1.34688e+00 4.15192e+01 232.772 -1.70584e+00 -2.24511e+00 0.00000e+00 0.00000e+00 1.18909e+02 232.772 7.73901e+01 232.772 0.7957 
1 1 1 -6  38  17 o 2  5.97265e+00 1.64585e+00 1.08996e+02 28.377  6.19804e+00  3.34801e+00  0.00000e+00 0.00000e+00 9.63092e+01 28.377  1.26869e+01 208.377 0.9260 
1 1 1 -6  39  1  o 14 3.54353e+01 6.80756e-01 7.13384e+02 310.151 2.57469e+01  -3.05198e+01 0.00000e+00 0.00000e+00 6.01825e+02 310.151 1.11559e+02 130.151 0.9874 
1 1 1 -6  39  2  o 3  1.46260e+01 5.77237e-01 1.91000e+02 229.576 -2.79934e+00 -3.28637e+00 0.00000e+00 0.00000e+00 2.89732e+02 229.576 9.87312e+01 229.576 0.8747 
1 1 1 -6  39  3  o 18 3.21261e+01 5.73460e-01 6.32198e+02 195.882 -3.43889e+01 -9.78442e+00 0.00000e+00 0.00000e+00 5.57528e+02 195.882 7.46703e+01 15.882  0.9859 
1 1 1 -6  39  4  o 17 5.52112e+00 4.97974e-01 1.23085e+02 178.821 -1.16906e+00 2.40580e-02  0.00000e+00 0.00000e+00 1.87821e+01 358.821 1.41867e+02 358.821 0.5032 
1 1 1 -6  39  5  o 16 1.24442e+01 3.99851e-01 5.47120e+01 222.807 -1.09166e+00 -1.01114e+00 0.00000e+00 0.00000e+00 2.22275e+02 222.807 1.67563e+02 222.807 0.5932 
1 1 1 -6  39  6  o 18 2.53481e+01 5.01173e-01 4.31521e+02 143.159 -2.34968e+01 1.76040e+01  0.00000e+00 0.00000e+00 5.02799e+02 143.159 7.12781e+01 143.159 0.9828 
1 1 1 -6  39  7  o 13 1.84707e+01 4.25219e-01 1.76362e+02 352.107 9.79176e+00  -1.35748e+00 0.00000e+00 0.00000e+00 4.79908e+02 352.107 3.03546e+02 352.107 0.9480 
1 1 1 -6  39  8  o 2  2.91331e+01 5.19879e-01 5.44507e+02 173.539 -5.62583e+01 6.37064e+00  0.00000e+00 0.00000e+00 5.36957e+02 173.539 7.54960e+00 353.539 0.9911 
1 1 1 -6  39  9  o 4  3.27530e+01 5.47483e-01 6.14269e+02 15.610  8.92076e+01  2.49248e+01  0.00000e+00 0.00000e+00 6.04885e+02 15.610  9.38384e+00 195.610 0.9946 
1 1 1 -6  39  10 o 7  2.53708e+01 5.28778e-01 3.44074e+02 5.693   4.97810e+01  4.96264e+00  0.00000e+00 0.00000e+00 5.95124e+02 5.693   2.51050e+02 5.693   0.9900 
1 1 1 -6  39  11 o 10 1.86311e+01 4.32200e-01 2.22040e+02 165.311 -2.99154e+01 7.84211e+00  0.00000e+00 0.00000e+00 4.62697e+02 165.311 2.40657e+02 165.311 0.9837 
1 1 1 -6  39  12 o 18 1.26095e+01 5.14529e-01 3.00524e+02 117.237 -1.59860e+01 3.10561e+01  0.00000e+00 0.00000e+00 1.63351e+02 117.237 1.37173e+02 297.237 0.9856 
1 1 1 -6  39  13 o 7  3.30690e+00 9.21972e-01 4.82069e+01 202.968 -1.40540e+00 -5.95629e-01 0.00000e+00 0.00000e+00 2.60989e+01 202.968 2.21081e+01 22.968  0.6026 
1 1 1 -6  39  14 o 3  8.35921e+00 1.03021e+00 1.27677e+02 337.895 1.17248e+01  -4.76218e+00 0.00000e+00 0.00000e+00 1.71127e+02 337.895 4.34498e+01 337.895 0.9596 
1 1 1 -6  39  15 o 9  4.12212e+00 1.15222e+00 6.08020e+01 160.666 -2.97251e+00 1.04296e+00  0.00000e+00 0.00000e+00 6.50395e+01 160.666 4.23748e+00 160.666 0.8205 
1 1 1 -6  39  16 o 4  3.51620e+00 1.12540e+00 8.78641e+01 30.814  3.62794e+00  2.16386e+00  0.00000e+00 0.00000e+00 2.60320e+01 30.814  6.18321e+01 210.814 0.8716 
1 1 1 -6  39  17 o 14 5.44641e+00 1.62161e+00 1.05703e+02 265.086 -5.47291e-01 -6.36557e+00 0.00000e+00 0.00000e+00 7.98734e+01 265.086 2.58291e+01 85.086  0.9180 
1 1 1 -6  40  1  o 15 4.14161e+01 8.18559e-01 6.04825e+02 348.663 3.75625e+01  -7.53101e+00 0.00000e+00 0.00000e+00 9.31362e+02 348.663 3.26537e+02 348.663 0.9869 
1 1 1 -6  40  2  o 9  2.03080e+01 4.48942e-01 3.11288e+02 144.290 -9.74338e+00 7.00384e+00  0.00000e+00 0.00000e+00 4.19221e+02 144.290 1.07932e+02 144.290 0.9574 
1 1 1 -6  40  3  o 15 2.97619e+01 5.44447e-01 5.42952e+02 10.122  2.78500e+01  4.97185e+00  0.00000e+00 0.00000e+00 5.54910e+02 10.122  1.19576e+01 10.122  0.9822 
1 1 1 -6  40  4  o 17 1.76907e+01 5.98288e-01 2.30418e+02 359.538 8.53541e+00  -6.88231e-02 0.00000e+00 0.00000e+00 3.93499e+02 359.538 1.63080e+02 359.538 0.9395 
1 1 1 -6  40  5  o 12 8.59210e+00 4.25758e-01 2.26105e+02 203.353 -3.97865e+00 -1.71783e+00 0.00000e+00 0.00000e+00 5.60594e+01 203.353 1.70045e+02 23.353  0.8752 
1 1 1 -6  40  6  o 1  3.74777e+01 6.44018e-01 5.50524e+02 75.318  1.35869e+01  5.18576e+01  0.00000e+00 0.00000e+00 8.41712e+02 75.318  2.91188e+02 75.318  0.9906 
1 1 1 -6  40  7  o 1  1.34452e+01 4.70679e-01 1.70351e+02 172.158 -6.52887e+00 8.99164e-01  0.00000e+00 0.00000e+00 2.93541e+02 172.158 1.23190e+02 172.158 0.9207 
1 1 1 -6  40  8  o 6  2.46067e+01 4.59448e-01 4.06121e+02 70.747  1.14591e+01  3.28087e+01  0.00000e+00 0.00000e+00 5.02035e+02 70.747  9.59141e+01 70.747  0.9855 
1 1 1 -6  40  9  f 0  1.24541e+01 4.49606e-01 2.53625e+02 301.724 8.13395e+00  -1.31579e+01 0.00000e+00 0.00000e+00 1.97098e+02 301.724 5.65268e+01 121.724 0.9671 
1 1 1 -6  40  10 o 9  9.86442e+00 4.65397e-01 1.05322e+02 213.911 -5.01208e+00 -3.36933e+00 0.00000e+00 0.00000e+00 2.31411e+02 213.911 1.26089e+02 213.911 0.9130 
1 1 1 -6  40  11 f 0  7.57365e+00 4.66427e-01 1.05734e+02 215.515 -5.12535e+00 -3.65791e+00 0.00000e+00 0.00000e+00 1.53640e+02 215.515 4.79056e+01 215.515 0.9167 
1 1 1 -6  40  12 o 13 1.70090e+01 4.35695e-01 2.85393e+02 178.879 -4.79224e+01 9.37845e-01  0.00000e+00 0.00000e+00 3.42760e+02 178.879 5.73667e+01 178.879 0.9895 
1 1 1 -6  40  13 o 15 2.40334e+00 8.03148e-01 2.34344e+01 356.475 6.03946e-01  -3.72049e-02 0.00000e+00 0.00000e+00 2.50639e+00 356.475 2.09280e+01 176.475 0.2895 
1 1 1 -6  40  14 o 9  7.67411e+00 1.07329e+00 1.08033e+02 37.393  7.90136e+00  6.03948e+00  0.00000e+00 0.00000e+00 1.63013e+02 37.393  5.49800e+01 37.393  0.9483 
1 1 1 -6  40  15 o 7  1.38696e+01 9.70543e-01 2.11274e+02 198.361 -3.84303e+01 -1.27548e+01 0.00000e+00 0.00000e+00 2.98301e+02 198.361 8.70269e+01 198.361 0.9876 
1 1 1 -6  40  16 o 14 3.53476e+00 1.08910e+00 3.78976e+01 190.139 -1.97706e+00 -3.53556e-01 0.00000e+00 0.00000e+00 5.39339e+01 190.139 1.60363e+01 190.139 0.6992 
1 1 1 -6  40  17 o 16 7.01122e+00 2.05414e+00 1.23421e+02 266.362 -4.62156e-01 -7.26856e+00 0.00000e+00 0.00000e+00 1.18194e+02 266.362 5.22734e+00 86.362  0.9286 
1 1 1 -6  41  1  o 7  6.47312e+00 8.18538e-01 1.11257e+02 126.830 -8.05307e-01 1.07529e+00  0.00000e+00 0.00000e+00 2.37505e+01 126.830 8.75064e+01 306.830 0.5550 
1 1 1 -6  41  2  o 11 4.10084e+01 6.97177e-01 9.42402e+02 231.714 -4.18448e+01 -5.30116e+01 0.00000e+00 0.00000e+00 5.86780e+02 231.714 3.55621e+02 51.714  0.9926 
1 1 1 -6  41  3  o 11 1.49466e+01 4.09268e-01 2.54624e+02 180.744 -6.50946e+00 -8.44855e-02 0.00000e+00 0.00000e+00 2.61560e+02 180.744 6.93600e+00 180.744 0.9196 
1 1 1 -6  41  4  o 6  3.80154e+01 6.48647e-01 6.13676e+02 10.889  4.76734e+01  9.17101e+00  0.00000e+00 0.00000e+00 7.98525e+02 10.889  1.84849e+02 10.889  0.9896 
1 1 1 -6  41  5  o 2  2.68997e+01 1.01974e+00 4.90462e+02 278.430 4.57746e+00  -3.08859e+01 0.00000e+00 0.00000e+00 5.02448e+02 278.430 1.19859e+01 278.430 0.9839 
1 1 1 -6  41  6  o 6  1.02021e+01 4.30671e-01 1.47232e+02 201.232 -3.86714e+00 -1.50247e+00 0.00000e+00 0.00000e+00 1.85194e+02 201.232 3.79626e+01 201.232 0.8690 
1 1 1 -6  41  7  o 7  1.20866e+01 4.04173e-01 1.43309e+02 65.755  2.30659e+00  5.12173e+00  0.00000e+00 0.00000e+00 2.67009e+02 65.755  1.23700e+02 65.755  0.9060 
1 1 1 -6  41  8  o 12 3.28621e+01 5.90389e-01 6.09521e+02 216.923 -5.49919e+01 -4.13239e+01 0.00000e+00 0.00000e+00 6.12038e+02 216.923 2.51673e+00 216.923 0.9927 
1 1 1 -6  41  9  o 12 1.61837e+01 4.49554e-01 2.11697e+02 232.471 -9.97520e+00 -1.29865e+01 0.00000e+00 0.00000e+00 3.75058e+02 232.471 1.63360e+02 232.471 0.9690 
1 1 1 -6  41  10 o 18 1.65725e+01 4.23664e-01 2.96691e+02 0.430   3.05821e+01  2.29415e-01  0.00000e+00 0.00000e+00 3.12676e+02 0.430   1.59847e+01 0.430   0.9835 
1 1 1 -6  41  11 o 9  4.99866e+00 6.26316e-01 1.85084e+02 152.879 -6.82760e+00 3.49702e+00  0.00000e+00 0.00000e+00 1.10013e+01 332.879 1.96085e+02 332.879 0.9323 
1 1 1 -6  41  12 o 12 9.17196e+00 4.71820e-01 1.83441e+02 157.101 -1.53939e+01 6.50228e+00  0.00000e+00 0.00000e+00 1.48434e+02 157.101 3.50069e+01 337.101 0.9696 
1 1 1 -6  41  13 o 7  1.85763e+01 7.89826e-01 3.08897e+02 61.958  3.04760e+01  5.72163e+01  0.00000e+00 0.00000e+00 3.78275e+02 61.958  6.93784e+01 61.958  0.9923 
1 1 1 -6  41  14 o 11 1.09623e+01 9.23618e-01 2.36993e+02 255.683 -7.86479e+00 -3.08175e+01 0.00000e+00 0.00000e+00 1.64781e+02 255.683 7.22123e+01 75.683  0.9842 
1 1 1 -6  41  15 o 12 4.99639e+00 1.21943e+00 1.37127e+02 130.437 -5.56549e+00 6.53078e+00  0.00000e+00 0.00000e+00 3.75406e+01 130.437 9.95863e+01 310.437 0.9398 
1 1 1 -6  41  16 o 17 7.51381e+00 1.50197e+00 1.16890e+02 271.444 2.63422e-01  -1.04476e+01 0.00000e+00 0.00000e+00 1.48570e+02 271.444 3.16800e+01 271.444 0.9509 
1 1 1 -6  41  17 o 7  4.53176e+00 1.54927e+00 2.96037e+01 300.410 8.06498e-01  -1.37409e+00 0.00000e+00 0.00000e+00 7.43829e+01 300.410 4.47792e+01 300.410 0.6184 
1 1 1 -6  42  1  o 5  2.04666e+01 4.56893e-01 3.19424e+02 135.948 -8.27862e+00 8.00899e+00  0.00000e+00 0.00000e+00 4.15465e+02 135.948 9.60412e+01 135.948 0.9556 
1 1 1 -6  42  2  o 7  3.14478e+01 7.89910e-01 6.88428e+02 6.709   3.64055e+01  4.28232e+00  0.00000e+00 0.00000e+00 4.76663e+02 6.709   2.11764e+02 186.709 0.9863 
1 1 1 -6  42  3  o 7  4.24540e+01 7.07938e-01 8.70345e+02 136.337 -4.55443e+01 4.34673e+01  0.00000e+00 0.00000e+00 7.11071e+02 136.337 1.59274e+02 316.337 0.9920 
1 1 1 -6  42  4  o 4  4.13832e+01 7.61817e-01 8.77516e+02 275.142 7.00027e+00  -7.77963e+01 0.00000e+00 0.00000e+00 6.65722e+02 275.142 2.11794e+02 95.142  0.9936 
1 1 1 -6  42  5  o 3  2.73396e+01 5.19412e-01 5.08652e+02 219.809 -2.57353e+01 -2.14486e+01 0.00000e+00 0.00000e+00 5.01515e+02 219.809 7.13687e+00 39.809  0.9850 
1 1 1 -6  42  6  o 5  8.55753e+00 4.60904e-01 2.40198e+02 126.753 -3.46797e+00 4.64367e+00  0.00000e+00 0.00000e+00 5.14603e+01 126.753 1.88738e+02 306.753 0.9091 
1 1 1 -6  42  7  o 12 1.13874e+01 4.00971e-01 1.60190e+02 196.882 -5.45990e+00 -1.65701e+00 0.00000e+00 0.00000e+00 2.27014e+02 196.882 6.68241e+01 196.882 0.9075 
1 1 1 -6  42  8  o 17 1.67474e+01 4.06523e-01 1.84789e+02 334.967 1.10620e+01  -5.16602e+00 0.00000e+00 0.00000e+00 4.15999e+02 334.967 2.31210e+02 334.967 0.9581 
1 1 1 -6  42  9  o 1  1.11873e+01 4.22231e-01 1.86939e+02 190.342 -1.05806e+01 -1.93094e+00 0.00000e+00 0.00000e+00 2.11649e+02 190.342 2.47092e+01 190.342 0.9523 
1 1 1 -6  42  10 o 19 1.25710e+01 4.14671e-01 2.54704e+02 108.901 -6.58369e+00 1.92288e+01  0.00000e+00 0.00000e+00 2.03515e+02 108.901 5.11893e+01 288.900 0.9751 
1 1 1 -6  42  11 o 5  3.28538e+00 6.27976e-01 2.87105e+01 64.526  3.17254e-01  6.65911e-01  0.00000e+00 0.00000e+00 1.37221e+01 64.526  1.49884e+01 244.526 0.3458 
1 1 1 -6  42  12 o 5  5.10125e+00 6.93564e-01 1.20706e+02 267.074 -2.97898e-01 -5.82900e+00 0.00000e+00 0.00000e+00 5.24606e+01 267.074 6.82453e+01 87.074  0.9097 
1 1 1 -6  42  13 o 12 7.89157e+00 9.92132e-01 1.82749e+02 212.512 -1.33984e+01 -8.53968e+00 0.00000e+00 0.00000e+00 1.02006e+02 212.512 8.07428e+01 32.512  0.9680 
1 1 1 -6  42  14 o 14 6.72434e+00 1.23501e+00 1.21939e+02 96.139  -9.56965e-01 8.89646e+00  0.00000e+00 0.00000e+00 1.14015e+02 96.139  7.92324e+00 276.139 0.9423 
1 1 1 -6  42  15 o 15 5.15765e+00 1.28635e+00 1.07926e+02 35.299  5.18639e+00  3.67205e+00  0.00000e+00 0.00000e+00 6.80917e+01 35.299  3.98339e+01 215.299 0.9175 
1 1 1 -6  42  16 o 11 5.98353e+00 1.81649e+00 1.53355e+02 179.888 -8.58432e+00 1.67153e-02  0.00000e+00 0.00000e+00 5.55552e+01 179.888 9.78001e+01 359.888 0.9398 
1 1 1 -6  42  17 o 14 5.67284e+00 1.71899e+00 8.43852e+01 318.062 3.86615e+00  -3.47355e+00 0.00000e+00 0.00000e+00 1.04581e+02 318.062 2.01956e+01 318.062 0.8978 
1 1 1 -6  43  1  o 16 3.17786e+01 1.01401e+00 4.51219e+02 95.268  -2.19834e+00 2.38423e+01  0.00000e+00 0.00000e+00 7.17580e+02 95.268  2.66361e+02 95.268  0.9789 
1 1 1 -6  43  2  o 4  2.53995e+01 6.00831e-01 3.91160e+02 248.873 -6.14176e+00 -1.58944e+01 0.00000e+00 0.00000e+00 5.34414e+02 248.873 1.43255e+02 248.873 0.9702 
1 1 1 -6  43  3  o 1  3.01039e+01 5.50509e-01 4.21766e+02 188.286 -2.62759e+01 -3.82665e+00 0.00000e+00 0.00000e+00 6.87000e+02 188.286 2.65234e+02 188.286 0.9810 
1 1 1 -6  43  4  o 3  4.20489e+01 7.04252e-01 7.30280e+02 241.221 -3.25724e+01 -5.93013e+01 0.00000e+00 0.00000e+00 8.36029e+02 241.221 1.05749e+02 241.221 0.9926 
1 1 1 -6  43  5  o 11 3.57924e+01 6.20382e-01 6.67661e+02 24.555  5.79448e+01  2.64745e+01  0.00000e+00 0.00000e+00 6.64285e+02 24.555  3.37581e+00 204.555 0.9921 
1 1 1 -6  43  6  o 15 3.01808e+01 5.58984e-01 5.20368e+02 140.444 -3.66061e+01 3.02354e+01  0.00000e+00 0.00000e+00 5.99040e+02 140.444 7.86723e+01 140.444 0.9894 
1 1 1 -6  43  7  o 6  2.37946e+01 5.00254e-01 5.11248e+02 140.951 -3.02716e+01 2.45566e+01  0.00000e+00 0.00000e+00 3.68660e+02 140.951 1.42587e+02 320.951 0.9871 
1 1 1 -6  43  8  o 13 2.52166e+01 4.71591e-01 4.01932e+02 14.091  4.24151e+01  1.06469e+01  0.00000e+00 0.00000e+00 5.31240e+02 14.091  1.29308e+02 14.091  0.9885 
1 1 1 -6  43  9  o 13 1.64846e+01 4.17680e-01 2.59910e+02 171.043 -2.33666e+01 3.68286e+00  0.00000e+00 0.00000e+00 3.43573e+02 171.043 8.36629e+01 171.043 0.9786 
1 1 1 -6  43  10 o 3  1.40067e+01 4.14065e-01 2.58039e+02 50.385  1.60763e+01  1.94228e+01  0.00000e+00 0.00000e+00 2.55007e+02 50.385  3.03217e+00 230.385 0.9800 
1 1 1 -6  43  11 o 10 2.00296e+01 4.56780e-01 3.90866e+02 287.637 2.08197e+01  -6.54848e+01 0.00000e+00 0.00000e+00 3.51667e+02 287.637 3.91989e+01 107.637 0.9927 
1 1 1 -6  43  12 o 6  1.14346e+01 4.60399e-01 1.85967e+02 117.178 -1.07437e+01 2.09247e+01  0.00000e+00 0.00000e+00 2.31483e+02 117.178 4.55155e+01 117.178 0.9785 
1 1 1 -6  43  13 o 1  4.10238e+00 9.60668e-01 5.98817e+01 56.568  1.57023e+00  2.37852e+00  0.00000e+00 0.00000e+00 6.21748e+01 56.568  2.29311e+00 56.568  0.7983 
1 1 1 -6  43  14 o 1  1.26450e+01 9.05377e-01 3.06069e+02 105.214 -1.36343e+01 5.01348e+01  0.00000e+00 0.00000e+00 1.60178e+02 105.214 1.45891e+02 285.214 0.9903 
1 1 1 -6  43  15 o 6  3.92012e+00 1.20456e+00 5.15372e+01 143.325 -2.12572e+00 1.58304e+00  0.00000e+00 0.00000e+00 6.22391e+01 143.325 1.07019e+01 143.325 0.7804 
1 1 1 -6  43  16 o 17 4.36234e+00 1.45383e+00 8.37628e+01 21.644  4.06143e+00  1.61165e+00  0.00000e+00 0.00000e+00 5.82463e+01 21.644  2.55164e+01 201.644 0.8764 
1 1 1 -6  43  17 o 19 3.95915e+00 1.37258e+00 6.01284e+01 179.240 -3.27585e+00 4.34747e-02  0.00000e+00 0.00000e+00 6.15633e+01 179.240 1.43490e+00 179.240 0.8285 
1 1 1 -6  44  1  o 15 2.85379e+01 5.42812e-01 5.75333e+02 30.168  2.43857e+01  1.41746e+01  0.00000e+00 0.00000e+00 4.77600e+02 30.168  9.77332e+01 210.168 0.9821 
1 1 1 -6  44  2  o 18 3.52746e+01 7.46368e-01 6.67699e+02 298.955 2.36873e+01  -4.28127e+01 0.00000e+00 0.00000e+00 6.43448e+02 298.955 2.42517e+01 118.955 0.9897 
1 1 1 -6  44  3  o 14 1.83330e+01 4.36745e-01 2.53843e+02 318.173 7.25678e+00  -6.49440e+00 0.00000e+00 0.00000e+00 3.98037e+02 318.173 1.44194e+02 318.173 0.9472 
1 1 1 -6  44  4  o 7  3.07105e+01 5.61364e-01 6.08060e+02 133.005 -3.11579e+01 3.34068e+01  0.00000e+00 0.00000e+00 5.31624e+02 133.005 7.64355e+01 313.005 0.9890 
1 1 1 -6  44  5  o 18 1.70693e+01 6.39365e-01 3.58375e+02 226.564 -1.09274e+01 -1.15409e+01 0.00000e+00 0.00000e+00 2.61317e+02 226.564 9.70574e+01 46.564  0.9680 
1 1 1 -6  44  6  o 7  1.27621e+01 4.22655e-01 1.96318e+02 189.252 -7.15448e+00 -1.16540e+00 0.00000e+00 0.00000e+00 2.47697e+02 189.252 5.13783e+01 189.252 0.9282 
1 1 1 -6  44  7  o 10 1.59190e+01 4.14920e-01 3.92473e+02 80.183  3.53449e+00  2.04263e+01  0.00000e+00 0.00000e+00 1.89267e+02 80.183  2.03206e+02 260.183 0.9756 
1 1 1 -6  44  8  o 8  1.96940e+01 4.29901e-01 3.77578e+02 107.882 -9.82648e+00 3.04565e+01  0.00000e+00 0.00000e+00 3.48006e+02 107.882 2.95724e+01 287.882 0.9843 
1 1 1 -6  44  9  o 19 2.82672e+01 5.05732e-01 4.54963e+02 190.546 -7.61198e+01 -1.41714e+01 0.00000e+00 0.00000e+00 5.95491e+02 190.546 1.40528e+02 190.546 0.9935 
1 1 1 -6  44  10 o 13 2.19546e+01 4.60502e-01 3.84789e+02 357.277 6.05044e+01  -2.87719e+00 0.00000e+00 0.00000e+00 4.28923e+02 357.277 4.41333e+01 357.277 0.9917 
1 1 1 -6  44  11 o 19 2.92903e+00 7.26297e-01 5.48400e+00 322.200 1.07084e-01  -8.30618e-02 0.00000e+00 0.00000e+00 1.91007e+00 322.200 3.57393e+00 142.200 0.0676 
1 1 1 -6  44  12 o 8  1.01613e+01 4.77686e-01 1.68629e+02 24.180  1.69024e+01  7.58915e+00  0.00000e+00 0.00000e+00 2.00060e+02 24.180  3.14310e+01 24.180  0.9726 
1 1 1 -6  44  13 o 7  3.59135e+00 9.91429e-01 9.54736e+01 73.019  1.14404e+00  3.74652e+00  0.00000e+00 0.00000e+00 1.96646e+01 73.019  7.58091e+01 253.019 0.8603 
1 1 1 -6  44  14 o 3  3.39968e+00 9.85434e-01 1.17901e+02 138.837 -3.81788e+00 3.33793e+00  0.00000e+00 0.00000e+00 4.62659e+00 318.837 1.22528e+02 318.837 0.8950 
1 1 1 -6  44  15 o 2  9.65772e+00 1.89767e+00 2.03752e+02 1.786   1.62254e+01  5.05873e-01  0.00000e+00 0.00000e+00 1.44134e+02 1.786   5.96180e+01 181.786 0.9687 
1 1 1 -6  44  16 o 19 4.97524e+00 1.59141e+00 2.17482e+01 19.897  1.06194e+00  3.84357e-01  0.00000e+00 0.00000e+00 6.88627e+01 19.897  4.71145e+01 19.897  0.4904 
1 1 1 -6  44  17 o 3  6.77159e+00 2.02620e+00 1.00099e+02 208.848 -5.26514e+00 -2.90025e+00 0.00000e+00 0.00000e+00 1.29123e+02 208.848 2.90240e+01 208.848 0.9125 
1 1 1 -6  45  1  o 7  4.16186e+01 7.06957e-01 6.86291e+02 184.195 -5.92417e+01 -4.34479e+00 0.00000e+00 0.00000e+00 8.63833e+02 184.195 1.77542e+02 184.195 0.9915 
1 1 1 -6  45  2  o 13 1.80455e+01 5.13692e-01 4.63662e+02 309.845 1.12178e+01  -1.34426e+01 0.00000e+00 0.00000e+00 1.94317e+02 309.845 2.69345e+02 129.845 0.9710 
1 1 1 -6  45  3  o 11 1.78214e+01 5.19861e-01 3.02177e+02 176.152 -1.16589e+01 7.84173e-01  0.00000e+00 0.00000e+00 3.37473e+02 176.152 3.52954e+01 176.152 0.9562 
1 1 1 -6  45  4  o 11 1.99960e+01 5.07744e-01 3.71546e+02 132.032 -1.19909e+01 1.33025e+01  0.00000e+00 0.00000e+00 3.57430e+02 132.032 1.41151e+01 312.032 0.9717 
1 1 1 -6  45  5  o 11 2.78538e+01 5.57557e-01 4.95169e+02 306.279 2.23788e+01  -3.04879e+01 0.00000e+00 0.00000e+00 5.35437e+02 306.279 4.02684e+01 306.279 0.9867 
1 1 1 -6  45  6  o 6  1.31145e+01 4.07255e-01 1.75768e+02 101.898 -1.54486e+00 7.33192e+00  0.00000e+00 0.00000e+00 2.81653e+02 101.898 1.05885e+02 101.898 0.9307 
1 1 1 -6  45  7  o 9  4.76182e+01 7.20183e-01 8.41814e+02 49.757  9.06429e+01  1.07099e+02  0.00000e+00 0.00000e+00 9.35313e+02 49.757  9.34995e+01 49.757  0.9964 
1 1 1 -6  45  8  o 12 2.80291e+01 5.02524e-01 4.74619e+02 182.980 -6.14465e+01 -3.19839e+00 0.00000e+00 0.00000e+00 5.65889e+02 182.980 9.12699e+01 182.980 0.9918 
1 1 1 -6  45  9  o 6  1.00819e+01 4.31994e-01 1.53637e+02 45.309  6.33149e+00  6.40007e+00  0.00000e+00 0.00000e+00 2.01818e+02 45.309  4.81811e+01 45.309  0.9427 
1 1 1 -6  45  10 o 12 1.25125e+01 4.17206e-01 2.83669e+02 237.033 -1.46859e+01 -2.26429e+01 0.00000e+00 0.00000e+00 1.75159e+02 237.033 1.08511e+02 57.033  0.9813 
1 1 1 -6  45  11 o 17 3.73210e+00 7.38150e-01 7.24307e+01 294.550 9.91858e-01  -2.17144e+00 0.00000e+00 0.00000e+00 3.23746e+01 294.550 4.00560e+01 114.550 0.7522 
1 1 1 -6  45  12 o 6  1.09514e+01 4.81173e-01 2.15820e+02 351.364 2.64517e+01  -4.01724e+00 0.00000e+00 0.00000e+00 1.84962e+02 351.364 3.08579e+01 171.364 0.9811 
1 1 1 -6  45  13 o 6  3.82379e+00 1.03288e+00 8.35333e+01 190.660 -3.34486e+00 -6.29579e-01 0.00000e+00 0.00000e+00 3.55709e+01 190.660 4.79624e+01 10.660  0.8359 
1 1 1 -6  45  14 o 8  6.47128e+00 1.67557e+00 9.16832e+01 256.465 -1.21281e+00 -5.03818e+00 0.00000e+00 0.00000e+00 1.24494e+02 256.465 3.28106e+01 256.465 0.8974 
1 1 1 -6  45  15 o 9  4.88856e+00 1.56977e+00 1.58700e+02 117.235 -3.78263e+00 7.34930e+00  0.00000e+00 0.00000e+00 1.16840e+01 117.235 1.47016e+02 297.235 0.9374 
1 1 1 -6  45  16 o 10 5.46278e+00 1.72377e+00 1.70540e+02 31.223  8.07898e+00  4.89733e+00  0.00000e+00 0.00000e+00 2.12739e+01 31.223  1.49266e+02 211.223 0.9455 
1 1 1 -6  45  17 f 0  4.20842e+00 1.36703e+00 3.49962e+01 208.103 -1.88789e+00 -1.00817e+00 0.00000e+00 0.00000e+00 7.73140e+01 208.103 4.23178e+01 208.103 0.7195 
1 1 1 -6  46  1  f 0  3.27046e+01 5.94711e-01 7.39988e+02 101.507 -1.00557e+01 4.93944e+01  0.00000e+00 0.00000e+00 4.76112e+02 101.507 2.63877e+02 281.507 0.9900 
1 1 1 -6  46  2  o 11 2.60354e+01 6.11213e-01 6.24532e+02 255.878 -8.59566e+00 -3.41652e+01 0.00000e+00 0.00000e+00 3.39024e+02 255.878 2.85508e+02 75.878  0.9857 
1 1 1 -6  46  3  o 16 1.87179e+01 4.49329e-01 3.55214e+02 200.222 -1.53604e+01 -5.65818e+00 0.00000e+00 0.00000e+00 3.25487e+02 200.222 2.97264e+01 20.222  0.9690 
1 1 1 -6  46  4  o 1  1.95939e+01 4.50335e-01 3.54112e+02 188.305 -1.84668e+01 -2.69559e+00 0.00000e+00 0.00000e+00 3.60969e+02 188.305 6.85717e+00 188.305 0.9728 
1 1 1 -6  46  5  o 2  1.79561e+01 6.13023e-01 4.59965e+02 224.052 -1.65722e+01 -1.60327e+01 0.00000e+00 0.00000e+00 1.98535e+02 224.052 2.61430e+02 44.052  0.9781 
1 1 1 -6  46  6  o 18 4.16527e+01 6.48891e-01 6.57704e+02 19.749  7.95863e+01  2.85726e+01  0.00000e+00 0.00000e+00 8.93906e+02 19.749  2.36202e+02 19.749  0.9941 
1 1 1 -6  46  7  o 11 2.99990e+01 5.20793e-01 4.42489e+02 135.563 -3.27366e+01 3.20995e+01  0.00000e+00 0.00000e+00 6.68634e+02 135.563 2.26145e+02 135.563 0.9890 
1 1 1 -6  46  8  o 12 1.19241e+01 4.26374e-01 2.95393e+02 314.096 1.20252e+01  -1.24107e+01 0.00000e+00 0.00000e+00 1.37733e+02 314.096 1.57660e+02 134.096 0.9706 
1 1 1 -6  46  9  o 13 6.59606e+00 5.66935e-01 7.17764e+01 229.150 -1.78405e+00 -2.06319e+00 0.00000e+00 0.00000e+00 1.22501e+02 229.150 5.07244e+01 229.150 0.7876 
1 1 1 -6  46  10 f 0  2.35421e+01 5.22531e-01 3.51912e+02 238.331 -3.27689e+01 -5.31229e+01 0.00000e+00 0.00000e+00 5.20640e+02 238.331 1.68728e+02 238.331 0.9920 
1 1 1 -6  46  11 o 13 2.36295e+01 4.87170e-01 3.65113e+02 6.294   7.95828e+01  8.77754e+00  0.00000e+00 0.00000e+00 5.11473e+02 6.294   1.46360e+02 6.294   0.9937 
1 1 1 -6  46  12 f 0  5.49460e+00 7.25383e-01 9.17497e+01 312.406 3.49381e+00  -3.82546e+00 0.00000e+00 0.00000e+00 9.21527e+01 312.406 4.03004e-01 312.406 0.8974 
1 1 1 -6  46  13 o 15 8.46211e+00 9.84625e-01 9.79872e+01 12.554  9.54946e+00  2.12649e+00  0.00000e+00 0.00000e+00 2.00720e+02 12.554  1.02733e+02 12.554  0.9474 
1 1 1 -6  46  14 o 13 1.28781e+01 1.69379e+00 2.68253e+02 81.358  4.86103e+00  3.19820e+01  0.00000e+00 0.00000e+00 2.03584e+02 81.358  6.46694e+01 261.358 0.9844 
1 1 1 -6  46  15 o 9  6.21724e+00 1.74738e+00 1.66559e+02 331.107 8.33600e+00  -4.60034e+00 0.00000e+00 0.00000e+00 5.20795e+01 331.107 1.14479e+02 151.107 0.9459 
1 1 1 -6  46  16 o 19 5.73983e+00 1.75210e+00 9.31739e+01 227.349 -3.57590e+00 -3.88186e+00 0.00000e+00 0.00000e+00 9.85293e+01 227.349 5.35548e+00 227.349 0.8995 
1 1 1 -6  46  17 o 18 5.04349e+00 1.57861e+00 1.09349e+02 341.890 6.31941e+00  -2.06670e+00 0.00000e+00 0.00000e+00 6.29898e+01 341.890 4.63592e+01 161.890 0.9214 
1 1 1 -6  47  1  o 15 3.28588e+01 6.41547e-01 6.47904e+02 85.698  3.45023e+00  4.58689e+01  0.00000e+00 0.00000e+00 5.72587e+02 85.698  7.53177e+01 265.698 0.9891 
1 1 1 -6  47  2  o 3  2.38355e+01 8.76685e-01 4.24246e+02 269.722 -1.06668e-01 -2.20019e+01 0.00000e+00 0.00000e+00 4.49995e+02 269.722 2.57489e+01 269.722 0.9770 
1 1 1 -6  47  3  o 4  2.13342e+01 4.70516e-01 2.39465e+02 76.488  2.88428e+00  1.20027e+01  0.00000e+00 0.00000e+00 5.27991e+02 76.488  2.88526e+02 76.488  0.9586 
1 1 1 -6  47  4  o 7  4.16413e+00 9.76215e-01 5.51696e+01 254.674 -1.53634e-01 -5.60609e-01 0.00000e+00 0.00000e+00 1.15885e+01 74.674  6.67581e+01 74.674  0.2790 
1 1 1 -6  47  5  o 4  2.40855e+01 7.58179e-01 4.29877e+02 110.490 -1.07734e+01 2.88296e+01  0.00000e+00 0.00000e+00 4.58299e+02 110.490 2.84221e+01 110.490 0.9836 
1 1 1 -6  47  6  o 6  1.92038e+01 4.29727e-01 2.91491e+02 106.862 -5.23222e+00 1.72628e+01  0.00000e+00 0.00000e+00 4.07810e+02 106.862 1.16319e+02 106.862 0.9719 
1 1 1 -6  47  7  o 1  2.03485e+01 4.41333e-01 3.74266e+02 323.950 2.42456e+01  -1.76479e+01 0.00000e+00 0.00000e+00 3.74863e+02 323.950 5.97228e-01 323.950 0.9832 
1 1 1 -6  47  8  o 3  1.23958e+01 4.44110e-01 3.13925e+02 47.363  1.25935e+01  1.36777e+01  0.00000e+00 0.00000e+00 1.37255e+02 47.363  1.76670e+02 227.363 0.9727 
1 1 1 -6  47  9  o 11 1.98399e+01 4.42217e-01 3.54262e+02 268.019 -1.51227e+00 -4.37149e+01 0.00000e+00 0.00000e+00 3.79023e+02 268.019 2.47611e+01 268.019 0.9885 
1 1 1 -6  47  10 o 12 1.66685e+01 4.30170e-01 2.26648e+02 356.833 2.98389e+01  -1.65114e+00 0.00000e+00 0.00000e+00 3.85566e+02 356.833 1.58919e+02 356.833 0.9831 
1 1 1 -6  47  11 o 6  1.62583e+01 4.39460e-01 3.13939e+02 249.252 -1.68823e+01 -4.45639e+01 0.00000e+00 0.00000e+00 2.86519e+02 249.252 2.74200e+01 69.252  0.9895 
1 1 1 -6  47  12 o 1  9.45039e+00 5.16782e-01 1.88468e+02 44.205  1.45980e+01  1.41984e+01  0.00000e+00 0.00000e+00 1.55181e+02 44.205  3.32869e+01 224.205 0.9751 
1 1 1 -6  47  13 o 10 5.90063e+00 9.17531e-01 1.36108e+02 44.828  7.07326e+00  7.03084e+00  0.00000e+00 0.00000e+00 7.23802e+01 44.828  6.37282e+01 224.828 0.9485 
1 1 1 -6  47  14 o 8  9.98669e+00 1.86448e+00 1.74812e+02 193.492 -1.41758e+01 -3.40121e+00 0.00000e+00 0.00000e+00 1.83848e+02 193.492 9.03652e+00 193.492 0.9651 
1 1 1 -6  47  15 o 4  5.18301e+00 1.58801e+00 1.76347e+02 351.148 9.60433e+00  -1.49577e+00 0.00000e+00 0.00000e+00 6.11814e+00 351.148 1.70229e+02 171.148 0.9471 
1 1 1 -6  47  16 o 18 6.18858e+00 1.68127e+00 1.23708e+02 101.682 -1.65278e+00 7.99376e+00  0.00000e+00 0.00000e+00 9.14871e+01 101.682 3.22210e+01 281.682 0.9366 
1 1 1 -6  47  17 o 13 5.66699e+00 1.68653e+00 9.97016e+01 321.759 4.93481e+00  -3.88903e+00 0.00000e+00 0.00000e+00 9.29002e+01 321.759 6.80137e+00 141.759 0.9165 
1 1 1 -6  48  1  o 16 2.21433e+01 4.84980e-01 2.88145e+02 175.414 -1.41298e+01 1.13330e+00  0.00000e+00 0.00000e+00 5.13429e+02 175.414 2.25284e+02 175.414 0.9641 
1 1 1 -6  48  2  o 15 3.67172e+01 6.41763e-01 4.79895e+02 62.413  1.98324e+01  3.79563e+01  0.00000e+00 0.00000e+00 8.82154e+02 62.413  4.02260e+02 62.413  0.9883 
1 1 1 -6  48  3  o 9  9.18187e+00 4.69608e-01 2.92324e+02 115.775 -3.13821e+00 6.49908e+00  0.00000e+00 0.00000e+00 2.73493e+01 115.775 2.64975e+02 295.775 0.9279 
1 1 1 -6  48  4  o 17 1.41294e+01 4.35465e-01 4.41193e+02 157.397 -1.58687e+01 6.60648e+00  0.00000e+00 0.00000e+00 7.30721e+01 157.397 3.68121e+02 337.397 0.9705 
1 1 1 -6  48  5  o 7  2.39133e+01 6.04623e-01 3.48664e+02 353.407 2.36613e+01  -2.73489e+00 0.00000e+00 0.00000e+00 5.28710e+02 353.407 1.80045e+02 353.407 0.9788 
1 1 1 -6  48  6  o 12 2.83140e+01 5.03451e-01 4.91969e+02 282.785 1.01870e+01  -4.48931e+01 0.00000e+00 0.00000e+00 5.57190e+02 282.785 6.52207e+01 282.785 0.9891 
1 1 1 -6  48  7  o 5  1.75208e+01 4.21975e-01 4.20431e+02 269.144 -4.75791e-01 -3.18575e+01 0.00000e+00 0.00000e+00 2.25165e+02 269.144 1.95266e+02 89.144  0.9842 
1 1 1 -6  48  8  o 14 5.32455e+00 6.00353e-01 1.21627e+02 50.242  2.09001e+00  2.51230e+00  0.00000e+00 0.00000e+00 4.33190e+01 50.242  7.83077e+01 230.242 0.8280 
1 1 1 -6  48  9  o 6  3.13855e+00 7.42708e-01 6.97164e+01 131.695 -8.85489e-01 9.94038e-01  0.00000e+00 0.00000e+00 4.99870e+00 311.695 7.47151e+01 311.695 0.5516 
1 1 1 -6  48  10 o 19 1.53568e+01 4.30313e-01 2.34900e+02 79.857  5.44638e+00  3.04445e+01  0.00000e+00 0.00000e+00 3.29390e+02 79.857  9.44902e+01 79.857  0.9837 
1 1 1 -6  48  11 o 3  2.05772e+01 5.12456e-01 4.08226e+02 198.682 -7.75315e+01 -2.62157e+01 0.00000e+00 0.00000e+00 3.55037e+02 198.682 5.31889e+01 18.682  0.9939 
1 1 1 -6  48  12 o 9  9.51303e+00 5.88570e-01 1.87693e+02 43.523  1.48233e+01  1.40780e+01  0.00000e+00 0.00000e+00 1.58224e+02 43.523  2.94692e+01 223.523 0.9752 
1 1 1 -6  48  13 o 8  1.02682e+01 1.22619e+00 1.42521e+02 224.009 -1.13777e+01 -1.09909e+01 0.00000e+00 0.00000e+00 2.27664e+02 224.009 8.51429e+01 224.009 0.9679 
1 1 1 -6  48  14 f 0  8.53402e+00 1.80738e+00 1.95590e+02 296.182 6.37662e+00  -1.29690e+01 0.00000e+00 0.00000e+00 1.10761e+02 296.182 8.48286e+01 116.182 0.9648 
1 1 1 -6  48  15 o 16 3.77895e+00 1.25949e+00 2.24008e+01 138.196 -8.20419e-01 7.33631e-01  0.00000e+00 0.00000e+00 4.51424e+01 138.196 2.27416e+01 138.196 0.4809 
1 1 1 -6  48  16 o 1  4.19272e+00 1.32244e+00 7.17815e+01 169.536 -3.74898e+00 6.92417e-01  0.00000e+00 0.00000e+00 6.14354e+01 169.536 1.03461e+01 349.536 0.8559 
1 1 1 -6  49  1  o 13 3.04722e+01 5.69198e-01 6.12004e+02 55.635  2.53394e+01  3.70564e+01  0.00000e+00 0.00000e+00 5.19235e+02 55.635  9.27692e+01 235.635 0.9888 
1 1 1 -6  49  2  o 5  1.56722e+01 4.75554e-01 4.33806e+02 207.434 -1.45408e+01 -7.54822e+00 0.00000e+00 0.00000e+00 1.36154e+02 207.434 2.97652e+02 27.434  0.9690 
1 1 1 -6  49  3  o 1  4.94537e+01 8.89925e-01 8.28068e+02 59.329  5.32777e+01  8.98343e+01  0.00000e+00 0.00000e+00 1.01837e+03 59.329  1.90303e+02 59.329  0.9952 
1 1 1 -6  49  4  o 13 2.66724e+01 5.28315e-01 5.07359e+02 226.868 -2.59325e+01 -2.76813e+01 0.00000e+00 0.00000e+00 4.79572e+02 226.868 2.77865e+01 46.868  0.9867 
1 1 1 -6  49  5  o 4  2.21989e+01 4.61429e-01 5.42253e+02 330.631 3.39042e+01  -1.90796e+01 0.00000e+00 0.00000e+00 2.79005e+02 330.631 2.63248e+02 150.631 0.9871 
1 1 1 -6  49  6  o 2  1.13418e+01 4.26577e-01 1.87577e+02 124.089 -4.27086e+00 6.31053e+00  0.00000e+00 0.00000e+00 2.08323e+02 124.089 2.07463e+01 124.089 0.9319 
1 1 1 -6  49  7  o 15 2.53229e+01 4.74882e-01 5.11448e+02 280.108 1.00712e+01  -5.64961e+01 0.00000e+00 0.00000e+00 4.28212e+02 280.108 8.32357e+01 100.108 0.9912 
1 1 1 -6  49  8  o 12 5.10913e+00 6.28590e-01 1.50726e+02 180.354 -4.14911e+00 -2.56444e-02 0.00000e+00 0.00000e+00 1.53664e+01 180.354 1.35359e+02 0.354   0.8690 
1 1 1 -6  49  9  f 0  1.61266e+01 4.31070e-01 2.38457e+02 58.292  1.40898e+01  2.28063e+01  0.00000e+00 0.00000e+00 3.53005e+02 58.292  1.14548e+02 58.292  0.9812 
1 1 1 -6  49  10 o 10 6.42839e+00 5.38920e-01 1.74689e+02 260.398 -1.48760e+00 -8.79329e+00 0.00000e+00 0.00000e+00 5.15162e+01 260.398 1.23173e+02 80.398  0.9421 
1 1 1 -6  49  11 o 6  1.00493e+01 4.78414e-01 1.25590e+02 225.543 -8.76525e+00 -8.93303e+00 0.00000e+00 0.00000e+00 2.34103e+02 225.543 1.08513e+02 225.543 0.9592 
1 1 1 -6  49  12 o 15 7.55798e+00 6.68341e-01 1.13690e+02 282.640 2.20980e+00  -9.85363e+00 0.00000e+00 0.00000e+00 1.53743e+02 282.640 4.00530e+01 282.640 0.9491 
1 1 1 -6  49  13 o 18 6.26147e+00 9.04005e-01 3.66780e+01 73.577  8.42256e-01  2.85748e+00  0.00000e+00 0.00000e+00 1.51846e+02 73.577  1.15168e+02 73.577  0.8084 
1 1 1 -6  49  14 o 13 1.04445e+01 1.84241e+00 1.54287e+02 204.587 -1.24191e+01 -5.68243e+00 0.00000e+00 0.00000e+00 2.19780e+02 204.587 6.54934e+01 204.587 0.9627 
1 1 1 -6  49  15 o 18 8.51720e+00 1.65551e+00 1.67344e+02 338.662 1.36730e+01  -5.34127e+00 0.00000e+00 0.00000e+00 1.38193e+02 338.662 2.91512e+01 158.662 0.9653 
1 1 1 -6  49  16 o 7  4.90604e+00 1.49934e+00 6.39222e+01 29.308  3.22075e+00  1.80798e+00  0.00000e+00 0.00000e+00 9.09747e+01 29.308  2.70525e+01 29.308  0.8506 
1 1 1 -6  50  1  o 10 4.33645e+00 7.41895e-01 9.66917e+01 131.005 -7.28116e-01 8.37467e-01  0.00000e+00 0.00000e+00 1.79159e+01 311.005 1.14608e+02 311.005 0.4839 
1 1 1 -6  50  2  o 7  1.31867e+01 5.13622e-01 3.01107e+02 92.963  -5.37798e-01 1.03898e+01  0.00000e+00 0.00000e+00 1.69324e+02 92.963  1.31783e+02 272.963 0.9507 
1 1 1 -6  50  3  o 9  1.44520e+01 4.50982e-01 3.20405e+02 60.887  6.20875e+00  1.11490e+01  0.00000e+00 0.00000e+00 2.00017e+02 60.887  1.20388e+02 240.887 0.9600 
1 1 1 -6  50  4  o 7  2.31414e+01 5.81076e-01 5.14450e+02 78.904  6.88982e+00  3.51294e+01  0.00000e+00 0.00000e+00 3.41021e+02 78.904  1.73429e+02 258.904 0.9859 
1 1 1 -6  50  5  o 3  5.09296e+01 7.66924e-01 8.97584e+02 166.011 -1.35203e+02 3.36820e+01  0.00000e+00 0.00000e+00 1.00415e+03 166.011 1.06570e+02 166.011 0.9964 
1 1 1 -6  50  6  o 15 1.31720e+01 4.17741e-01 2.15297e+02 341.881 9.36975e+00  -3.06600e+00 0.00000e+00 0.00000e+00 2.52310e+02 341.881 3.70131e+01 341.881 0.9478 
1 1 1 -6  50  7  o 4  1.62880e+01 4.22554e-01 2.38449e+02 11.340  1.77025e+01  3.55005e+00  0.00000e+00 0.00000e+00 3.54073e+02 11.340  1.15624e+02 11.340  0.9719 
1 1 1 -6  50  8  o 2  7.40312e+00 5.78716e-01 1.70141e+02 112.498 -2.86943e+00 6.92802e+00  0.00000e+00 0.00000e+00 8.75754e+01 112.498 8.25656e+01 292.498 0.9307 
1 1 1 -6  50  9  o 19 9.11280e+00 4.60689e-01 1.19908e+02 320.659 6.06237e+00  -4.96925e+00 0.00000e+00 0.00000e+00 1.98152e+02 320.659 7.82446e+01 320.659 0.9338 
1 1 1 -6  50  10 o 16 1.35037e+01 4.66568e-01 2.88351e+02 312.890 2.32149e+01  -2.49912e+01 0.00000e+00 0.00000e+00 2.08489e+02 312.890 7.98617e+01 132.890 0.9852 
1 1 1 -6  50  11 o 2  4.58911e+00 7.66907e-01 8.63185e+01 196.717 -3.90101e+00 -1.17165e+00 0.00000e+00 0.00000e+00 6.20106e+01 196.717 2.43079e+01 16.717  0.8663 
1 1 1 -6  50  12 o 13 1.09364e+01 5.94659e-01 1.88934e+02 78.720  5.11861e+00  2.56633e+01  0.00000e+00 0.00000e+00 2.10864e+02 78.720  2.19295e+01 78.720  0.9807 
1 1 1 -6  50  13 o 6  1.34019e+01 1.13181e+00 2.16817e+02 168.902 -3.18123e+01 6.24045e+00  0.00000e+00 0.00000e+00 2.74492e+02 168.902 5.76755e+01 168.902 0.9845 
1 1 1 -6  50  14 o 15 4.89005e+00 1.26581e+00 6.04329e+01 233.580 -2.07227e+00 -2.80871e+00 0.00000e+00 0.00000e+00 9.24765e+01 233.580 3.20436e+01 233.580 0.8406 
1 1 1 -6  50  15 o 2  4.56327e+00 1.39911e+00 1.18675e+02 342.417 6.00186e+00  -1.90194e+00 0.00000e+00 0.00000e+00 3.67622e+01 342.417 8.19133e+01 162.417 0.9167 
1 1 1 -6  50  16 o 1  5.57139e+00 1.60098e+00 9.25742e+01 80.421  9.66406e-01  5.72672e+00  0.00000e+00 0.00000e+00 9.54342e+01 80.421  2.85999e+00 80.421  0.9093 
1 1 1 -6  51  1  o 18 1.98106e+01 4.74592e-01 3.89401e+02 138.336 -1.51152e+01 1.34503e+01  0.00000e+00 0.00000e+00 3.35552e+02 138.336 5.38492e+01 318.336 0.9750 
1 1 1 -6  51  2  o 15 2.13384e+01 4.84183e-01 3.27208e+02 55.703  1.08419e+01  1.58953e+01  0.00000e+00 0.00000e+00 4.52344e+02 55.703  1.25136e+02 55.703  0.9737 
1 1 1 -6  51  3  o 11 2.36978e+01 5.77832e-01 4.46765e+02 50.915  1.86558e+01  2.29680e+01  0.00000e+00 0.00000e+00 4.26906e+02 50.915  1.98598e+01 230.915 0.9830 
1 1 1 -6  51  4  o 14 2.24323e+01 4.75664e-01 4.69227e+02 136.744 -2.48430e+01 2.33750e+01  0.00000e+00 0.00000e+00 3.59326e+02 136.744 1.09901e+02 316.744 0.9852 
1 1 1 -6  51  5  o 5  3.58694e+01 5.90484e-01 5.28936e+02 256.219 -1.48707e+01 -6.06285e+01 0.00000e+00 0.00000e+00 8.04285e+02 256.219 2.75349e+02 256.219 0.9920 
1 1 1 -6  51  6  o 18 1.43650e+01 4.16982e-01 1.62453e+02 359.436 9.20115e+00  -9.05522e-02 0.00000e+00 0.00000e+00 3.45362e+02 359.436 1.82909e+02 359.436 0.9440 
1 1 1 -6  51  7  o 9  1.83866e+01 4.50646e-01 2.44125e+02 61.139  1.05948e+01  1.92231e+01  0.00000e+00 0.00000e+00 4.28123e+02 61.139  1.83998e+02 61.139  0.9769 
1 1 1 -6  51  8  o 18 2.46894e+01 5.02632e-01 4.74561e+02 195.756 -6.48514e+01 -1.82972e+01 0.00000e+00 0.00000e+00 4.41905e+02 195.756 3.26559e+01 15.756  0.9926 
1 1 1 -6  51  9  o 10 1.67735e+01 4.47452e-01 3.35722e+02 350.006 4.20144e+01  -7.40337e+00 0.00000e+00 0.00000e+00 2.83709e+02 350.006 5.20127e+01 170.006 0.9882 
1 1 1 -6  51  10 f 0  2.12176e+01 4.96368e-01 3.78639e+02 210.635 -6.09629e+01 -3.61035e+01 0.00000e+00 0.00000e+00 4.07998e+02 210.635 2.93592e+01 210.635 0.9929 
1 1 1 -6  51  11 f 0  1.17601e+01 5.58904e-01 2.85334e+02 160.910 -3.37593e+01 1.16836e+01  0.00000e+00 0.00000e+00 1.47205e+02 160.910 1.38129e+02 340.910 0.9859 
1 1 1 -6  51  12 o 7  1.32081e+01 6.00300e-01 2.52436e+02 90.305  -2.34204e-01 4.40542e+01  0.00000e+00 0.00000e+00 2.34223e+02 90.305  1.82137e+01 270.305 0.9886 
1 1 1 -6  51  13 o 7  8.23880e+00 1.07523e+00 1.46361e+02 279.184 2.27019e+00  -1.40406e+01 0.00000e+00 0.00000e+00 1.49409e+02 279.184 3.04858e+00 279.184 0.9642 
1 1 1 -6  51  14 o 3  8.80260e+00 1.48349e+00 1.51626e+02 51.052  9.00620e+00  1.11423e+01  0.00000e+00 0.00000e+00 1.64134e+02 51.052  1.25084e+01 51.052  0.9644 
1 1 1 -6  51  15 o 12 5.05395e+00 1.42187e+00 4.67111e+01 196.671 -2.83933e+00 -8.50280e-01 0.00000e+00 0.00000e+00 1.04867e+02 196.671 5.81559e+01 196.671 0.8073 
1 1 1 -6  51  16 o 12 3.97495e+00 1.30231e+00 1.17401e+02 75.923  1.57740e+00  6.29046e+00  0.00000e+00 0.00000e+00 1.81965e+01 75.923  9.92040e+01 255.923 0.9193 
1 1 1 -6  52  1  o 7  4.10448e+01 7.06166e-01 5.91468e+02 343.795 6.33002e+01  -1.83961e+01 0.00000e+00 0.00000e+00 9.37154e+02 343.795 3.45685e+02 343.795 0.9924 
1 1 1 -6  52  2  o 6  7.75781e+00 6.47423e-01 6.72552e+01 100.917 -2.75387e-01 1.42776e+00  0.00000e+00 0.00000e+00 1.02880e+02 100.917 3.56253e+01 100.917 0.5846 
1 1 1 -6  52  3  o 13 1.63813e+01 5.13510e-01 3.43063e+02 12.950  1.65328e+01  3.80165e+00  0.00000e+00 0.00000e+00 2.52864e+02 12.950  9.01991e+01 192.950 0.9701 
1 1 1 -6  52  4  o 12 8.45898e+00 5.27691e-01 1.71628e+02 184.617 -4.50368e+00 -3.63725e-01 0.00000e+00 0.00000e+00 1.07676e+02 184.617 6.39520e+01 4.617   0.8809 
1 1 1 -6  52  5  o 4  7.11993e+00 5.24885e-01 1.21621e+02 82.776  3.88081e-01  3.06161e+00  0.00000e+00 0.00000e+00 9.60857e+01 82.776  2.55350e+01 262.776 0.8162 
1 1 1 -6  52  6  o 4  3.19540e+01 5.46769e-01 5.35587e+02 79.827  1.29394e+01  7.21073e+01  0.00000e+00 0.00000e+00 6.52674e+02 79.827  1.17088e+02 79.827  0.9932 
1 1 1 -6  52  7  f 0  3.22124e+01 5.94219e-01 5.19654e+02 244.354 -3.40534e+01 -7.09293e+01 0.00000e+00 0.00000e+00 6.78025e+02 244.354 1.58371e+02 244.354 0.9936 
1 1 1 -6  52  8  o 14 1.21281e+01 4.33715e-01 2.16492e+02 273.798 1.08444e+00  -1.63339e+01 0.00000e+00 0.00000e+00 2.22938e+02 273.798 6.44657e+00 273.798 0.9690 
1 1 1 -6  52  9  o 4  1.69494e+01 4.46122e-01 3.04747e+02 15.307  3.72430e+01  1.01935e+01  0.00000e+00 0.00000e+00 3.20304e+02 15.307  1.55566e+01 15.307  0.9870 
1 1 1 -6  52  10 o 1  9.54122e+00 5.49068e-01 2.03473e+02 165.199 -1.72388e+01 4.55513e+00  0.00000e+00 0.00000e+00 1.42599e+02 165.199 6.08740e+01 345.199 0.9715 
1 1 1 -6  52  11 o 3  8.78676e+00 6.80362e-01 1.60892e+02 180.516 -1.52675e+01 -1.37384e-01 0.00000e+00 0.00000e+00 1.55940e+02 180.516 4.95269e+00 0.516   0.9667 
1 1 1 -6  52  12 o 8  1.52752e+01 5.80797e-01 2.94113e+02 341.863 5.65457e+01  -1.85221e+01 0.00000e+00 0.00000e+00 2.70323e+02 341.863 2.37894e+01 161.863 0.9916 
1 1 1 -6  52  13 o 18 8.48524e+00 7.66308e-01 1.72035e+02 99.357  -3.38081e+00 2.05173e+01  0.00000e+00 0.00000e+00 1.36163e+02 99.357  3.58719e+01 279.357 0.9757 
1 1 1 -6  52  14 o 8  4.28774e+00 1.29493e+00 3.96571e+01 195.261 -1.86232e+00 -5.08111e-01 0.00000e+00 0.00000e+00 6.97297e+01 195.261 3.00725e+01 195.261 0.6860 
1 1 1 -6  52  15 o 8  7.10260e+00 1.64438e+00 1.40648e+02 74.312  2.81935e+00  1.00385e+01  0.00000e+00 0.00000e+00 1.10200e+02 74.312  3.04479e+01 254.312 0.9508 
1 1 1 -6  52  16 o 4  3.29414e+00 1.09529e+00 4.82508e+01 187.367 -2.54529e+00 -3.29088e-01 0.00000e+00 0.00000e+00 4.61082e+01 187.367 2.14260e+00 7.367   0.7720 
1 1 1 -6  53  1  o 7  1.84512e+01 4.75321e-01 3.04749e+02 342.531 1.50775e+01  -4.74480e+00 0.00000e+00 0.00000e+00 3.65325e+02 342.531 6.05762e+01 342.531 0.9678 
1 1 1 -6  53  2  o 9  9.60014e+00 8.06092e-01 2.13677e+02 225.778 -4.23404e+00 -4.35057e+00 0.00000e+00 0.00000e+00 1.15262e+02 225.778 9.84151e+01 45.778  0.9134 
1 1 1 -6  53  3  o 18 9.75596e+00 4.84249e-01 1.59419e+02 68.396  1.85389e+00  4.68137e+00  0.00000e+00 0.00000e+00 1.67683e+02 68.396  8.26361e+00 68.396  0.8942 
1 1 1 -6  53  4  o 7  8.31890e+00 6.63483e-01 9.64290e+01 136.696 -1.85106e+00 1.74461e+00  0.00000e+00 0.00000e+00 1.43537e+02 136.696 4.71083e+01 136.696 0.7697 
1 1 1 -6  53  5  o 19 1.85238e+01 4.98143e-01 2.17319e+02 129.979 -8.95533e+00 1.06804e+01  0.00000e+00 0.00000e+00 4.51197e+02 129.979 2.33879e+02 129.979 0.9634 
1 1 1 -6  53  6  o 8  4.44799e+00 6.79677e-01 1.55517e+02 139.467 -2.28269e+00 1.95190e+00  0.00000e+00 0.00000e+00 2.05942e+01 319.467 1.76111e+02 319.467 0.8102 
1 1 1 -6  53  7  o 9  2.79229e+01 5.51350e-01 5.55145e+02 271.912 2.61472e+00  -7.83405e+01 0.00000e+00 0.00000e+00 4.82871e+02 271.912 7.22738e+01 91.912  0.9936 
1 1 1 -6  53  8  o 15 7.05051e+00 5.88255e-01 2.71550e+02 106.207 -3.33046e+00 1.14579e+01  0.00000e+00 0.00000e+00 1.92486e+01 286.208 2.90799e+02 286.208 0.9571 
1 1 1 -6  53  9  o 17 1.34901e+01 4.93500e-01 1.86209e+02 244.145 -8.58393e+00 -1.77131e+01 0.00000e+00 0.00000e+00 3.04797e+02 244.145 1.18589e+02 244.145 0.9743 
1 1 1 -6  53  10 o 14 7.04964e+00 6.53812e-01 1.40924e+02 21.727  8.28796e+00  3.30272e+00  0.00000e+00 0.00000e+00 1.07010e+02 21.727  3.39142e+01 201.727 0.9422 
1 1 1 -6  53  11 o 12 4.01945e+00 8.21268e-01 8.48733e+01 126.633 -2.03471e+00 2.73640e+00  0.00000e+00 0.00000e+00 4.04883e+01 126.633 4.43850e+01 306.633 0.8363 
1 1 1 -6  53  12 o 7  5.13723e+00 8.53422e-01 1.06769e+02 71.135  2.21359e+00  6.47837e+00  0.00000e+00 0.00000e+00 7.00543e+01 71.135  3.67150e+01 251.135 0.9238 
1 1 1 -6  53  13 o 2  5.92862e+00 8.77721e-01 1.05388e+02 52.446  4.97743e+00  6.47404e+00  0.00000e+00 0.00000e+00 1.01302e+02 52.446  4.08601e+00 232.446 0.9366 
1 1 1 -6  53  14 o 18 4.72495e+00 1.12377e+00 2.89114e+01 14.020  1.82009e+00  4.54490e-01  0.00000e+00 0.00000e+00 8.99100e+01 14.020  6.09985e+01 14.020  0.6763 
1 1 1 -6  53  15 o 8  4.30003e+00 1.33685e+00 1.11471e+02 7.330   6.12904e+00  7.88368e-01  0.00000e+00 0.00000e+00 3.46720e+01 7.330   7.67991e+01 187.330 0.9151 
1 1 1 -6  53  16 o 6  3.40532e+00 1.13300e+00 9.07640e+01 188.164 -5.00464e+00 -7.17935e-01 0.00000e+00 0.00000e+00 2.22566e+01 188.164 6.85075e+01 8.164   0.8947 
1 1 1 -6  54  1  o 15 1.82893e+01 4.80350e-01 2.78294e+02 10.010  1.44730e+01  2.55467e+00  0.00000e+00 0.00000e+00 3.84104e+02 10.010  1.05810e+02 10.010  0.9654 
1 1 1 -6  54  2  o 4  3.08047e+01 5.78817e-01 5.99619e+02 94.085  -3.76192e+00 5.26702e+01  0.00000e+00 0.00000e+00 5.44722e+02 94.085  5.48973e+01 274.085 0.9905 
1 1 1 -6  54  3  o 3  1.29855e+01 4.37476e-01 3.07249e+02 311.750 8.30502e+00  -9.30506e+00 0.00000e+00 0.00000e+00 1.59636e+02 311.750 1.47613e+02 131.750 0.9590 
1 1 1 -6  54  4  o 7  1.74137e+01 4.49734e-01 2.68609e+02 118.774 -7.45476e+00 1.35747e+01  0.00000e+00 0.00000e+00 3.62505e+02 118.774 9.38966e+01 118.774 0.9672 
1 1 1 -6  54  5  o 3  8.03546e+00 4.98437e-01 1.47653e+02 120.490 -2.36186e+00 4.01130e+00  0.00000e+00 0.00000e+00 1.18609e+02 120.490 2.90439e+01 300.490 0.8847 
1 1 1 -6  54  6  o 4  8.15435e+00 5.39689e-01 2.32145e+02 318.274 6.49375e+00  -5.79107e+00 0.00000e+00 0.00000e+00 5.49739e+01 318.274 1.77171e+02 138.274 0.9406 
1 1 1 -6  54  7  o 1  1.39684e+01 4.19345e-01 1.84947e+02 186.500 -1.55832e+01 -1.77541e+00 0.00000e+00 0.00000e+00 3.20646e+02 186.500 1.35699e+02 186.500 0.9676 
1 1 1 -6  54  8  o 16 7.36621e+00 5.53028e-01 1.94768e+02 115.203 -4.19314e+00 8.90982e+00  0.00000e+00 0.00000e+00 6.62160e+01 115.203 1.28552e+02 295.203 0.9478 
1 1 1 -6  54  9  o 17 3.20141e+00 7.43717e-01 3.21603e+01 260.940 -1.31047e-01 -8.21846e-01 0.00000e+00 0.00000e+00 1.37368e+01 260.940 1.84235e+01 80.940  0.3838 
1 1 1 -6  54  10 o 13 1.26930e+01 5.50781e-01 2.59296e+02 63.313  1.43104e+01  2.84697e+01  0.00000e+00 0.00000e+00 2.06949e+02 63.313  5.23477e+01 243.313 0.9842 
1 1 1 -6  54  11 o 12 9.29125e+00 6.62561e-01 1.59089e+02 123.969 -9.10785e+00 1.35188e+01  0.00000e+00 0.00000e+00 1.76581e+02 123.969 1.74919e+01 123.969 0.9688 
1 1 1 -6  54  12 o 10 1.50420e+01 5.62702e-01 3.25556e+02 321.773 5.07052e+01  -3.99394e+01 0.00000e+00 0.00000e+00 2.30473e+02 321.773 9.50830e+01 141.773 0.9922 
1 1 1 -6  54  13 o 10 6.57542e+00 8.52589e-01 1.09188e+02 165.321 -1.03809e+01 2.71927e+00  0.00000e+00 0.00000e+00 1.23835e+02 165.321 1.46465e+01 165.321 0.9522 
1 1 1 -6  54  14 o 8  5.52089e+00 1.02220e+00 1.39872e+02 69.716  3.96755e+00  1.07349e+01  0.00000e+00 0.00000e+00 5.61990e+01 69.716  8.36726e+01 249.716 0.9553 
1 1 1 -6  54  15 o 9  6.69187e+00 1.41712e+00 1.04921e+02 256.235 -1.93998e+00 -7.91916e+00 0.00000e+00 0.00000e+00 1.27807e+02 256.235 2.28857e+01 256.235 0.9365 
1 1 1 -6  54  16 o 5  1.22193e+01 1.54114e+00 1.65406e+02 49.155  1.63963e+01  1.89652e+01  0.00000e+00 0.00000e+00 2.78695e+02 49.155  1.13288e+02 49.155  0.9798 
1 1 1 -6  55  1  o 19 1.32876e+01 8.03788e-01 2.39543e+02 184.959 -1.00117e+01 -8.68658e-01 0.00000e+00 0.00000e+00 2.33412e+02 184.959 6.13076e+00 4.959   0.9489 
1 1 1 -6  55  2  o 12 3.31318e+01 6.09334e-01 4.91626e+02 206.547 -4.51385e+01 -2.25513e+01 0.00000e+00 0.00000e+00 7.38425e+02 206.547 2.46799e+02 206.547 0.9900 
1 1 1 -6  55  3  o 11 7.93163e+00 5.14352e-01 1.23120e+02 332.145 2.76371e+00  -1.46051e+00 0.00000e+00 0.00000e+00 1.20344e+02 332.145 2.77602e+00 152.145 0.8189 
1 1 1 -6  55  4  o 1  1.85570e+01 4.58266e-01 3.29020e+02 28.842  1.86028e+01  1.02447e+01  0.00000e+00 0.00000e+00 3.49693e+02 28.842  2.06738e+01 28.842  0.9762 
1 1 1 -6  55  5  o 1  2.31327e+01 4.88084e-01 4.38248e+02 238.292 -2.29250e+01 -3.71077e+01 0.00000e+00 0.00000e+00 4.18042e+02 238.292 2.02059e+01 58.292  0.9885 
1 1 1 -6  55  6  o 13 1.47968e+01 4.28817e-01 1.83162e+02 272.621 6.06211e-01  -1.32435e+01 0.00000e+00 0.00000e+00 3.49317e+02 272.621 1.66154e+02 272.621 0.9615 
1 1 1 -6  55  7  o 5  2.12152e+01 4.55316e-01 3.42226e+02 108.212 -1.31332e+01 3.99175e+01  0.00000e+00 0.00000e+00 4.41781e+02 108.212 9.95543e+01 108.212 0.9880 
1 1 1 -6  55  8  o 9  2.46379e+01 5.67070e-01 3.40708e+02 19.275  5.59992e+01  1.95832e+01  0.00000e+00 0.00000e+00 5.72377e+02 19.275  2.31669e+02 19.275  0.9915 
1 1 1 -6  55  9  o 18 1.12646e+01 5.15785e-01 1.80123e+02 84.553  1.53195e+00  1.60650e+01  0.00000e+00 0.00000e+00 2.27337e+02 84.553  4.72140e+01 84.553  0.9685 
1 1 1 -6  55  10 o 9  6.41325e+00 6.76639e-01 7.29323e+01 305.304 2.57255e+00  -3.63277e+00 0.00000e+00 0.00000e+00 1.37407e+02 305.304 6.44752e+01 305.304 0.8789 
1 1 1 -6  55  11 o 15 5.35785e+00 8.03130e-01 9.37011e+01 296.451 2.40565e+00  -4.83535e+00 0.00000e+00 0.00000e+00 8.64695e+01 296.451 7.23161e+00 116.451 0.9019 
1 1 1 -6  55  12 o 8  1.30546e+01 5.71330e-01 2.48278e+02 289.101 1.49322e+01  -4.31189e+01 0.00000e+00 0.00000e+00 2.32638e+02 289.101 1.56396e+01 109.101 0.9890 
1 1 1 -6  55  13 o 13 1.05988e+01 6.75147e-01 1.61017e+02 126.442 -1.59547e+01 2.16075e+01  0.00000e+00 0.00000e+00 2.25970e+02 126.442 6.49526e+01 126.442 0.9812 
1 1 1 -6  55  14 o 10 7.07599e+00 1.05411e+00 1.17837e+02 327.483 9.67301e+00  -6.16652e+00 0.00000e+00 0.00000e+00 1.33453e+02 327.483 1.56167e+01 327.483 0.9554 
1 1 1 -6  55  15 o 12 5.87604e+00 1.41376e+00 1.14103e+02 23.122  7.57680e+00  3.23516e+00  0.00000e+00 0.00000e+00 9.03708e+01 23.122  2.37322e+01 203.122 0.9372 
1 1 1 -6  55  16 o 12 3.67875e+00 1.16551e+00 3.94404e+01 78.878  4.71751e-01  2.39975e+00  0.00000e+00 0.00000e+00 6.41044e+01 78.878  2.46640e+01 78.878  0.7590 
1 1 1 -6  56  1  o 15 1.36961e+01 6.96149e-01 2.57146e+02 313.801 7.48764e+00  -7.80783e+00 0.00000e+00 0.00000e+00 2.32194e+02 313.801 2.49517e+01 133.801 0.9526 
1 1 1 -6  56  2  o 15 3.11930e+01 5.90407e-01 5.33526e+02 310.238 3.42899e+01  -4.05224e+01 0.00000e+00 0.00000e+00 6.24948e+02 310.238 9.14224e+01 310.238 0.9905 
1 1 1 -6  56  3  o 18 1.78783e+01 4.54838e-01 2.76239e+02 204.883 -1.60677e+01 -7.45262e+00 0.00000e+00 0.00000e+00 3.74624e+02 204.883 9.83848e+01 204.883 0.9713 
1 1 1 -6  56  4  o 19 1.48788e+01 4.96198e-01 3.35167e+02 57.364  1.05752e+01  1.65132e+01  0.00000e+00 0.00000e+00 2.07817e+02 57.364  1.27350e+02 237.364 0.9742 
1 1 1 -6  56  5  o 11 2.17502e+01 4.61400e-01 3.50963e+02 218.737 -2.63852e+01 -2.11664e+01 0.00000e+00 0.00000e+00 4.51289e+02 218.737 1.00326e+02 218.737 0.9851 
1 1 1 -6  56  6  o 8  9.35510e+00 4.63730e-01 1.85200e+02 159.194 -8.29005e+00 3.15002e+00  0.00000e+00 0.00000e+00 1.44505e+02 159.194 4.06953e+01 339.194 0.9418 
1 1 1 -6  56  7  f 0  1.49847e+01 4.89694e-01 9.20743e+01 13.054  7.79551e+00  1.80744e+00  0.00000e+00 0.00000e+00 4.32025e+02 13.054  3.39951e+02 13.054  0.9353 
1 1 1 -6  56  8  o 15 1.23967e+01 4.98107e-01 3.16438e+02 69.060  1.06263e+01  2.77701e+01  0.00000e+00 0.00000e+00 1.38978e+02 69.060  1.77461e+02 249.060 0.9830 
1 1 1 -6  56  9  o 8  8.02580e+00 6.27861e-01 6.83607e+01 29.766  4.10721e+00  2.34894e+00  0.00000e+00 0.00000e+00 1.97403e+02 29.766  1.29043e+02 29.766  0.8868 
1 1 1 -6  56  10 o 3  1.11630e+01 5.43913e-01 2.08219e+02 256.800 -5.78254e+00 -2.46545e+01 0.00000e+00 0.00000e+00 1.99983e+02 256.800 8.23591e+00 76.800  0.9801 
1 1 1 -6  56  11 o 8  1.23640e+01 5.38051e-01 2.56193e+02 306.570 2.29462e+01  -3.09312e+01 0.00000e+00 0.00000e+00 1.98696e+02 306.570 5.74972e+01 126.570 0.9869 
1 1 1 -6  56  12 o 9  3.09914e+00 8.61580e-01 3.40591e+01 327.689 1.13751e+00  -7.19398e-01 0.00000e+00 0.00000e+00 3.00780e+01 327.689 3.98115e+00 147.689 0.5557 
1 1 1 -6  56  13 o 6  6.79784e+00 9.19856e-01 7.30890e+01 72.691  2.09765e+00  6.73099e+00  0.00000e+00 0.00000e+00 1.61139e+02 72.691  8.80497e+01 72.691  0.9261 
1 1 1 -6  56  14 o 6  8.90947e+00 9.13214e-01 1.47229e+02 65.437  8.69560e+00  1.90250e+01  0.00000e+00 0.00000e+00 1.75890e+02 65.437  2.86603e+01 65.437  0.9758 
1 1 1 -6  56  15 f 0  2.89688e+00 9.83094e-01 1.59318e+01 233.794 -4.60343e-01 -6.28834e-01 0.00000e+00 0.00000e+00 2.30847e+01 233.794 7.15293e+00 233.794 0.3628 
1 1 1 -6  56  16 o 11 4.85044e+00 1.42930e+00 1.07875e+02 357.087 7.00311e+00  -3.56328e-01 0.00000e+00 0.00000e+00 5.86126e+01 357.087 4.92621e+01 177.087 0.9257 
1 1 1 -6  57  1  o 7  3.51981e+01 7.03307e-01 5.16619e+02 74.581  1.57844e+01  5.72302e+01  0.00000e+00 0.00000e+00 7.92163e+02 74.581  2.75544e+02 74.581  0.9915 
1 1 1 -6  57  2  o 16 3.17399e+01 6.19113e-01 5.42967e+02 121.438 -2.94348e+01 4.81493e+01  0.00000e+00 0.00000e+00 6.36307e+02 121.438 9.33405e+01 121.438 0.9911 
1 1 1 -6  57  3  o 16 1.01962e+01 5.15354e-01 1.17298e+02 191.381 -4.05907e+00 -8.17078e-01 0.00000e+00 0.00000e+00 2.14626e+02 191.381 9.73279e+01 191.381 0.8687 
1 1 1 -6  57  4  o 9  1.36190e+01 4.86428e-01 2.47889e+02 233.351 -8.69743e+00 -1.16902e+01 0.00000e+00 0.00000e+00 2.44396e+02 233.351 3.49297e+00 53.351  0.9651 
1 1 1 -6  57  5  o 11 1.91333e+01 4.47930e-01 3.00154e+02 212.011 -2.25487e+01 -1.40958e+01 0.00000e+00 0.00000e+00 4.02534e+02 212.011 1.02380e+02 212.011 0.9810 
1 1 1 -6  57  6  o 11 1.03180e+01 5.04534e-01 2.99052e+02 85.176  1.41758e+00  1.67974e+01  0.00000e+00 0.00000e+00 7.53663e+01 85.176  2.23685e+02 265.176 0.9699 
1 1 1 -6  57  7  o 1  3.92462e+00 7.60580e-01 3.85498e+00 270.929 1.48943e-03  -9.18376e-02 0.00000e+00 0.00000e+00 2.87723e+00 270.929 9.77746e-01 90.929  0.0459 
1 1 1 -6  57  8  o 6  3.32503e+00 7.59181e-01 1.68174e+02 254.651 -1.04959e+00 -3.82382e+00 0.00000e+00 0.00000e+00 6.10574e+01 74.651  2.29231e+02 74.651  0.8622 
1 1 1 -6  57  9  o 8  8.30634e+00 6.61476e-01 2.08311e+02 337.667 1.43849e+01  -5.90942e+00 0.00000e+00 0.00000e+00 9.16761e+01 337.667 1.16635e+02 157.667 0.9673 
1 1 1 -6  57  10 o 6  5.67234e+00 6.41799e-01 1.11497e+02 246.502 -2.63194e+00 -6.05357e+00 0.00000e+00 0.00000e+00 8.33519e+01 246.502 2.81456e+01 66.502  0.9208 
1 1 1 -6  57  11 o 5  9.76181e+00 5.60647e-01 1.40863e+02 297.382 8.07567e+00  -1.55913e+01 0.00000e+00 0.00000e+00 2.12471e+02 297.382 7.16088e+01 297.382 0.9711 
1 1 1 -6  57  12 o 16 8.43060e+00 6.87204e-01 1.42074e+02 178.652 -1.60645e+01 3.78109e-01  0.00000e+00 0.00000e+00 1.61932e+02 178.652 1.98588e+01 178.652 0.9684 
1 1 1 -6  57  13 o 15 7.30810e+00 8.77292e-01 1.72678e+02 12.395  1.78127e+01  3.91459e+00  0.00000e+00 0.00000e+00 9.16241e+01 12.395  8.10542e+01 192.394 0.9722 
1 1 1 -6  57  14 f 0  8.70464e+00 8.62242e-01 1.88930e+02 221.383 -2.05885e+01 -1.81404e+01 0.00000e+00 0.00000e+00 1.28591e+02 221.383 6.03386e+01 41.383  0.9816 
1 1 1 -6  57  15 o 9  4.12244e+00 1.25986e+00 5.81982e+01 257.111 -7.04845e-01 -3.08034e+00 0.00000e+00 0.00000e+00 6.74539e+01 257.111 9.25572e+00 257.111 0.8211 
1 1 1 -6  57  16 o 4  3.73184e+00 1.22116e+00 3.90453e+01 323.989 1.81712e+00  -1.32073e+00 0.00000e+00 0.00000e+00 6.25581e+01 323.989 2.35128e+01 323.989 0.7344 
1 1 1 -6  58  1  o 17 2.04778e+01 5.62579e-01 2.97104e+02 277.765 2.92321e+00  -2.14372e+01 0.00000e+00 0.00000e+00 4.52743e+02 277.765 1.55639e+02 277.765 0.9766 
1 1 1 -6  58  2  o 15 2.33153e+01 5.73425e-01 4.38058e+02 21.291  3.28430e+01  1.27988e+01  0.00000e+00 0.00000e+00 4.23360e+02 21.291  1.46983e+01 201.291 0.9857 
1 1 1 -6  58  3  o 12 2.04225e+01 5.04615e-01 3.61902e+02 176.495 -2.89499e+01 1.77316e+00  0.00000e+00 0.00000e+00 3.89966e+02 176.495 2.80643e+01 176.495 0.9826 
1 1 1 -6  58  4  o 12 1.85553e+01 4.47155e-01 2.95527e+02 0.786   2.43622e+01  3.34067e-01  0.00000e+00 0.00000e+00 3.84959e+02 0.786   8.94322e+01 0.786   0.9793 
1 1 1 -6  58  5  o 4  1.37867e+01 5.16770e-01 2.65994e+02 103.245 -3.99150e+00 1.69582e+01  0.00000e+00 0.00000e+00 2.35018e+02 103.245 3.09758e+01 283.245 0.9709 
1 1 1 -6  58  6  o 11 5.27356e+00 7.33109e-01 2.06844e+02 251.679 -1.99402e+00 -6.02206e+00 0.00000e+00 0.00000e+00 2.58622e+01 71.679  2.32707e+02 71.679  0.9174 
1 1 1 -6  58  7  o 16 3.86117e+00 7.94893e-01 7.55048e+01 308.543 1.19695e+00  -1.50243e+00 0.00000e+00 0.00000e+00 2.32823e+01 308.543 5.22225e+01 128.543 0.6844 
1 1 1 -6  58  8  o 9  7.44757e+00 6.53803e-01 7.83637e+01 198.510 -4.21651e+00 -1.41161e+00 0.00000e+00 0.00000e+00 1.66132e+02 198.510 8.77685e+01 198.510 0.8787 
1 1 1 -6  58  9  o 11 1.33073e+01 4.54335e-01 3.01841e+02 282.499 8.10236e+00  -3.65517e+01 0.00000e+00 0.00000e+00 1.88249e+02 282.499 1.13592e+02 102.499 0.9866 
1 1 1 -6  58  10 o 6  8.35100e+00 5.62444e-01 1.09766e+02 254.974 -2.64321e+00 -9.84658e+00 0.00000e+00 0.00000e+00 1.86031e+02 254.974 7.62648e+01 254.974 0.9496 
1 1 1 -6  58  11 o 17 1.35265e+01 5.35380e-01 2.14353e+02 173.909 -3.87025e+01 4.13011e+00  0.00000e+00 0.00000e+00 2.83223e+02 173.909 6.88701e+01 173.909 0.9871 
1 1 1 -6  58  12 o 5  1.35355e+01 5.97402e-01 2.22755e+02 321.669 3.38380e+01  -2.67533e+01 0.00000e+00 0.00000e+00 2.75321e+02 321.669 5.25660e+01 321.669 0.9883 
1 1 1 -6  58  13 o 4  7.12941e+00 8.51190e-01 1.73045e+02 161.896 -1.71406e+01 5.60376e+00  0.00000e+00 0.00000e+00 8.46696e+01 161.896 8.83750e+01 341.896 0.9719 
1 1 1 -6  58  14 o 9  1.17173e+01 7.49887e-01 1.48995e+02 295.110 1.23379e+01  -2.63270e+01 0.00000e+00 0.00000e+00 2.78807e+02 295.110 1.29812e+02 295.110 0.9826 
1 1 1 -6  58  15 o 14 3.47236e+00 1.13031e+00 1.33330e+02 106.232 -1.96779e+00 6.75898e+00  0.00000e+00 0.00000e+00 1.40004e+01 286.232 1.47330e+02 286.232 0.9260 
1 1 1 -6  58  16 o 12 4.07357e+00 1.26724e+00 4.33817e+01 290.970 9.92016e-01  -2.58834e+00 0.00000e+00 0.00000e+00 7.61522e+01 290.970 3.27705e+01 290.970 0.7916 
1 1 1 -6  59  1  o 8  1.84830e+01 5.18512e-01 3.93013e+02 332.427 2.22659e+01  -1.16267e+01 0.00000e+00 0.00000e+00 2.85954e+02 332.427 1.07059e+02 152.427 0.9799 
1 1 1 -6  59  2  o 7  8.40370e+00 5.17972e-01 1.77231e+02 207.829 -5.16854e+00 -2.72836e+00 0.00000e+00 0.00000e+00 1.09322e+02 207.829 6.79097e+01 27.829  0.9099 
1 1 1 -6  59  3  o 5  3.17224e+01 6.75196e-01 6.76548e+02 139.456 -6.89791e+01 5.90045e+01  0.00000e+00 0.00000e+00 5.05249e+02 139.456 1.71299e+02 319.456 0.9945 
1 1 1 -6  59  4  o 3  9.36333e+00 5.05683e-01 1.85959e+02 309.230 5.08325e+00  -6.22607e+00 0.00000e+00 0.00000e+00 1.42047e+02 309.230 4.39120e+01 129.230 0.9356 
1 1 1 -6  59  5  o 5  1.27666e+01 4.99572e-01 1.48238e+02 277.336 1.23138e+00  -9.56412e+00 0.00000e+00 0.00000e+00 3.04052e+02 277.336 1.55814e+02 277.336 0.9466 
1 1 1 -6  59  6  o 3  8.23841e+00 5.82632e-01 1.54728e+02 1.276   7.32488e+00  1.63178e-01  0.00000e+00 0.00000e+00 1.31540e+02 1.276   2.31877e+01 181.276 0.9290 
1 1 1 -6  59  7  o 10 7.08294e+00 6.24153e-01 1.60524e+02 289.282 2.62929e+00  -7.51578e+00 0.00000e+00 0.00000e+00 8.70008e+01 289.282 7.35229e+01 109.282 0.9349 
1 1 1 -6  59  8  o 18 6.22534e+00 6.62484e-01 1.33382e+02 216.856 -5.16537e+00 -3.87205e+00 0.00000e+00 0.00000e+00 8.02958e+01 216.856 5.30863e+01 36.856  0.9189 
1 1 1 -6  59  9  o 19 7.92010e+00 5.58420e-01 1.67452e+02 308.850 8.04549e+00  -9.98884e+00 0.00000e+00 0.00000e+00 1.16395e+02 308.850 5.10564e+01 128.850 0.9602 
1 1 1 -6  59  10 o 11 8.91501e+00 5.46743e-01 2.07021e+02 37.867  1.65828e+01  1.28943e+01  0.00000e+00 0.00000e+00 1.17443e+02 37.867  8.95778e+01 217.867 0.9759 
1 1 1 -6  59  11 o 5  1.12638e+01 5.56926e-01 1.86634e+02 170.848 -2.60335e+01 4.19413e+00  0.00000e+00 0.00000e+00 2.25032e+02 170.848 3.83984e+01 170.848 0.9809 
1 1 1 -6  59  12 o 10 7.51235e+00 7.00286e-01 1.93627e+02 268.470 -5.67632e-01 -2.12538e+01 0.00000e+00 0.00000e+00 7.93698e+01 268.470 1.14257e+02 88.470  0.9762 
1 1 1 -6  59  13 o 7  4.63942e+00 1.00903e+00 6.63994e+01 120.012 -2.03409e+00 3.52141e+00  0.00000e+00 0.00000e+00 8.30211e+01 120.012 1.66217e+01 120.012 0.8660 
1 1 1 -6  59  14 o 2  5.44651e+00 1.11603e+00 6.67809e+01 148.619 -4.57651e+00 2.79138e+00  0.00000e+00 0.00000e+00 1.15545e+02 148.619 4.87644e+01 148.619 0.9011 
1 1 1 -6  59  15 o 15 3.72228e+00 1.11299e+00 7.33096e+01 193.507 -4.12831e+00 -9.91618e-01 0.00000e+00 0.00000e+00 4.71814e+01 193.507 2.61282e+01 13.507  0.8723 
1 1 1 -6  59  16 o 16 4.83240e+00 1.46465e+00 7.99317e+01 340.426 4.94950e+00  -1.75994e+00 0.00000e+00 0.00000e+00 8.10707e+01 340.426 1.13902e+00 340.426 0.8989 
1 1 1 -6  60  1  o 9  3.43129e+01 6.11751e-01 5.47104e+02 140.062 -6.16299e+01 5.16001e+01  0.00000e+00 0.00000e+00 7.31003e+02 140.062 1.83898e+02 140.062 0.9938 
1 1 1 -6  60  2  o 18 7.34321e+00 6.69598e-01 1.02508e+02 126.610 -1.90150e+00 2.55942e+00  0.00000e+00 0.00000e+00 1.23942e+02 126.610 2.14340e+01 126.610 0.8230 
1 1 1 -6  60  3  o 18 1.36256e+01 7.41871e-01 1.42666e+02 91.031  -1.50782e-01 8.37726e+00  0.00000e+00 0.00000e+00 3.36181e+02 91.031  1.93515e+02 91.031  0.9383 
1 1 1 -6  60  4  o 4  2.30800e+01 5.56831e-01 4.12204e+02 17.996  4.37795e+01  1.42213e+01  0.00000e+00 0.00000e+00 4.42428e+02 17.996  3.02244e+01 17.996  0.9891 
1 1 1 -6  60  5  o 10 2.24218e+01 5.43598e-01 3.64020e+02 106.971 -1.29444e+01 4.24160e+01  0.00000e+00 0.00000e+00 4.65463e+02 106.971 1.01443e+02 106.971 0.9887 
1 1 1 -6  60  6  f 0  2.78634e+01 6.02343e-01 3.07602e+02 282.422 1.12349e+01  -5.10047e+01 0.00000e+00 0.00000e+00 7.24384e+02 282.422 4.16782e+02 282.422 0.9904 
1 1 1 -6  60  7  f 0  9.10108e+00 5.54030e-01 1.22409e+02 250.682 -2.76922e+00 -7.89958e+00 0.00000e+00 0.00000e+00 1.96713e+02 250.682 7.43042e+01 250.682 0.9382 
1 1 1 -6  60  8  o 7  9.19838e+00 5.17150e-01 1.53952e+02 27.534  1.09074e+01  5.68634e+00  0.00000e+00 0.00000e+00 1.75306e+02 27.534  2.13535e+01 27.534  0.9584 
1 1 1 -6  60  9  o 2  1.47364e+01 4.92275e-01 2.67514e+02 240.095 -1.94506e+01 -3.38187e+01 0.00000e+00 0.00000e+00 2.75334e+02 240.095 7.81980e+00 240.095 0.9871 
1 1 1 -6  60  10 o 15 8.03854e+00 5.84350e-01 1.72572e+02 271.129 2.88175e-01  -1.46227e+01 0.00000e+00 0.00000e+00 1.16733e+02 271.129 5.58393e+01 91.129  0.9652 
1 1 1 -6  60  11 o 17 1.83699e+01 5.53450e-01 2.49524e+02 66.028  2.46218e+01  5.53752e+01  0.00000e+00 0.00000e+00 4.29176e+02 66.028  1.79652e+02 66.028  0.9917 
1 1 1 -6  60  12 o 12 6.33303e+00 7.71936e-01 1.87034e+02 280.774 3.02084e+00  -1.58743e+01 0.00000e+00 0.00000e+00 4.12660e+01 280.774 1.45768e+02 100.774 0.9685 
1 1 1 -6  60  13 o 11 4.37473e+00 9.87266e-01 3.06874e+01 134.589 -1.39808e+00 1.41828e+00  0.00000e+00 0.00000e+00 8.25876e+01 134.589 5.19002e+01 134.589 0.6964 
1 1 1 -6  60  14 o 1  8.17184e+00 1.00122e+00 1.46143e+02 171.286 -1.83851e+01 2.81774e+00  0.00000e+00 0.00000e+00 1.49106e+02 171.286 2.96306e+00 171.286 0.9727 
1 1 1 -6  60  15 o 7  6.82796e+00 1.15962e+00 8.35309e+01 210.096 -7.53331e+00 -4.36623e+00 0.00000e+00 0.00000e+00 1.54769e+02 210.096 7.12376e+01 210.096 0.9407 
1 1 1 -6  60  16 o 9  4.14082e+00 1.27457e+00 5.53496e+01 88.936  6.60865e-02  3.55936e+00  0.00000e+00 0.00000e+00 7.41855e+01 88.936  1.88360e+01 88.936  0.8442 
1 1 1 -6  61  1  o 5  1.63753e+01 4.69255e-01 3.17022e+02 166.872 -2.17541e+01 5.07342e+00  0.00000e+00 0.00000e+00 2.82764e+02 166.872 3.42581e+01 346.872 0.9774 
1 1 1 -6  61  2  o 17 3.13965e+01 5.84998e-01 5.86858e+02 75.676  1.99976e+01  7.83188e+01  0.00000e+00 0.00000e+00 5.82072e+02 75.676  4.78605e+00 255.676 0.9938 
1 1 1 -6  61  3  o 18 1.75932e+01 5.99562e-01 2.89513e+02 3.030   2.45777e+01  1.30109e+00  0.00000e+00 0.00000e+00 3.55809e+02 3.030   6.62959e+01 3.030   0.9795 
1 1 1 -6  61  4  o 8  2.04707e+01 5.38998e-01 3.28760e+02 125.324 -1.97768e+01 2.79068e+01  0.00000e+00 0.00000e+00 4.26212e+02 125.324 9.74524e+01 125.324 0.9853 
1 1 1 -6  61  5  o 2  1.82579e+01 5.23643e-01 3.03300e+02 343.716 3.05728e+01  -8.93110e+00 0.00000e+00 0.00000e+00 3.68964e+02 343.716 6.56640e+01 343.716 0.9842 
1 1 1 -6  61  6  o 15 2.19010e+00 6.89427e-01 4.90943e+01 149.038 -6.20332e-01 3.72166e-01  0.00000e+00 0.00000e+00 2.12570e+01 329.038 7.03513e+01 329.038 0.3399 
1 1 1 -6  61  7  o 4  6.13334e+00 5.74215e-01 1.39220e+02 104.759 -1.59304e+00 6.04703e+00  0.00000e+00 0.00000e+00 7.07419e+01 104.759 6.84780e+01 284.759 0.9161 
1 1 1 -6  61  8  o 14 1.22379e+01 4.84688e-01 2.53948e+02 349.636 2.84976e+01  -5.21160e+00 0.00000e+00 0.00000e+00 1.95070e+02 349.636 5.88774e+01 169.636 0.9826 
1 1 1 -6  61  9  o 7  1.10766e+01 5.16039e-01 3.08361e+02 180.297 -3.74268e+01 -1.93801e-01 0.00000e+00 0.00000e+00 9.93751e+01 180.297 2.08986e+02 0.297   0.9865 
1 1 1 -6  61  10 f 0  7.22683e+00 6.25009e-01 2.44084e+02 7.251   1.98016e+01  2.51955e+00  0.00000e+00 0.00000e+00 1.85071e+01 7.251   2.25577e+02 187.251 0.9746 
1 1 1 -6  61  11 o 1  5.19394e+00 7.23843e-01 1.00031e+02 204.068 -6.35104e+00 -2.83666e+00 0.00000e+00 0.00000e+00 7.89339e+01 204.068 2.10972e+01 24.068  0.9250 
1 1 1 -6  61  12 o 19 4.16223e+00 9.23500e-01 4.09143e+01 21.319  2.28971e+00  8.93590e-01  0.00000e+00 0.00000e+00 7.68560e+01 21.319  3.59417e+01 21.319  0.7603 
1 1 1 -6  61  13 o 19 1.11831e+01 6.91095e-01 1.62274e+02 148.324 -2.44122e+01 1.50633e+01  0.00000e+00 0.00000e+00 2.46162e+02 148.324 8.38880e+01 148.324 0.9824 
1 1 1 -6  61  14 o 16 3.46541e+00 1.05691e+00 1.07115e+02 186.073 -5.66556e+00 -6.02771e-01 0.00000e+00 0.00000e+00 9.66022e+00 186.073 9.74545e+01 6.073   0.9074 
1 1 1 -6  61  15 o 5  5.18115e+00 1.20566e+00 5.91519e+01 322.860 3.80373e+00  -2.88087e+00 0.00000e+00 0.00000e+00 1.11478e+02 322.860 5.23261e+01 322.860 0.8878 
1 1 1 -6  61  16 o 1  7.71207e+00 1.77564e+00 1.06072e+02 45.532  6.36319e+00  6.48256e+00  0.00000e+00 0.00000e+00 1.63446e+02 45.532  5.73738e+01 45.532  0.9432 
1 1 1 -6  62  1  o 4  1.34434e+01 5.73940e-01 2.70455e+02 42.485  1.23295e+01  1.12921e+01  0.00000e+00 0.00000e+00 2.17964e+02 42.485  5.24917e+01 222.485 0.9696 
1 1 1 -6  62  2  o 1  1.57676e+01 6.13811e-01 3.71076e+02 56.109  1.48813e+01  2.21533e+01  0.00000e+00 0.00000e+00 2.08363e+02 56.109  1.62713e+02 236.109 0.9811 
1 1 1 -6  62  3  o 17 8.91157e+00 6.30496e-01 2.16249e+02 2.722   9.02993e+00  4.29359e-01  0.00000e+00 0.00000e+00 9.83880e+01 2.722   1.17861e+02 182.722 0.9430 
1 1 1 -6  62  4  o 10 1.05675e+01 6.00176e-01 1.29020e+02 117.190 -3.36590e+00 6.55224e+00  0.00000e+00 0.00000e+00 2.38556e+02 117.190 1.09536e+02 117.190 0.9294 
1 1 1 -6  62  5  o 3  4.26901e+00 7.84490e-01 1.68512e+02 189.405 -3.95618e+00 -6.55273e-01 0.00000e+00 0.00000e+00 3.05567e+01 9.405   1.99069e+02 9.405   0.8639 
1 1 1 -6  62  6  o 1  6.08576e+00 7.21887e-01 1.05842e+02 172.487 -4.40078e+00 5.80402e-01  0.00000e+00 0.00000e+00 9.40303e+01 172.487 1.18119e+01 352.487 0.8785 
1 1 1 -6  62  7  o 9  1.37102e+01 4.75197e-01 2.57444e+02 108.812 -9.69629e+00 2.84634e+01  0.00000e+00 0.00000e+00 2.46188e+02 108.812 1.12557e+01 288.812 0.9832 
1 1 1 -6  62  8  o 19 6.21518e+00 6.32466e-01 8.31232e+01 246.045 -1.89352e+00 -4.26199e+00 0.00000e+00 0.00000e+00 1.22222e+02 246.045 3.90988e+01 246.045 0.8850 
1 1 1 -6  62  9  o 1  8.44182e+00 5.45259e-01 1.46823e+02 274.251 9.80247e-01  -1.31872e+01 0.00000e+00 0.00000e+00 1.55956e+02 274.251 9.13314e+00 274.251 0.9614 
1 1 1 -6  62  10 o 10 1.06245e+01 5.26186e-01 1.63663e+02 228.859 -1.47555e+01 -1.68903e+01 0.00000e+00 0.00000e+00 2.23436e+02 228.859 5.97727e+01 228.859 0.9774 
1 1 1 -6  62  11 o 9  8.27374e+00 6.08599e-01 1.19381e+02 310.247 8.92426e+00  -1.05430e+01 0.00000e+00 0.00000e+00 1.77382e+02 310.247 5.80005e+01 310.247 0.9631 
1 1 1 -6  62  12 o 8  9.52096e+00 6.40394e-01 1.69232e+02 150.979 -2.26271e+01 1.25534e+01  0.00000e+00 0.00000e+00 1.78104e+02 150.979 8.87142e+00 150.979 0.9805 
1 1 1 -6  62  13 o 1  3.54321e+00 9.45712e-01 5.68891e+01 261.091 -4.54772e-01 -2.90113e+00 0.00000e+00 0.00000e+00 4.91546e+01 261.091 7.73450e+00 81.091  0.8052 
1 1 1 -6  62  14 o 13 7.07026e+00 1.03336e+00 1.40788e+02 59.807  7.91805e+00  1.36083e+01  0.00000e+00 0.00000e+00 1.13255e+02 59.807  2.75325e+01 239.807 0.9677 
1 1 1 -6  62  15 o 7  4.82452e+00 1.24635e+00 6.61569e+01 281.836 9.83644e-01  -4.69362e+00 0.00000e+00 0.00000e+00 9.28113e+01 281.836 2.66544e+01 281.836 0.8884 
1 1 1 -6  62  16 o 1  8.61557e+00 1.76938e+00 1.57675e+02 116.901 -7.08541e+00 1.39653e+01  0.00000e+00 0.00000e+00 1.51119e+02 116.901 6.55642e+00 296.901 0.9675 
1 1 1 -6  63  1  f 0  1.74156e+01 5.59386e-01 1.90015e+02 10.429  1.57701e+01  2.90249e+00  0.00000e+00 0.00000e+00 4.41751e+02 10.429  2.51736e+02 10.429  0.9683 
1 1 1 -6  63  2  f 0  2.78682e+01 6.53528e-01 3.53685e+02 267.024 -2.39594e+00 -4.60834e+01 0.00000e+00 0.00000e+00 6.78634e+02 267.024 3.24949e+02 267.024 0.9891 
1 1 1 -6  63  3  o 8  1.60073e+01 5.31521e-01 2.29294e+02 77.524  4.02079e+00  1.81728e+01  0.00000e+00 0.00000e+00 3.53631e+02 77.524  1.24336e+02 77.524  0.9728 
1 1 1 -6  63  4  o 13 1.46726e+01 5.33860e-01 2.98122e+02 252.396 -7.60594e+00 -2.39714e+01 0.00000e+00 0.00000e+00 2.39886e+02 252.396 5.82352e+01 72.396  0.9799 
1 1 1 -6  63  5  o 2  5.25885e+00 7.25366e-01 8.11525e+01 93.338  -1.51734e-01 2.60123e+00  0.00000e+00 0.00000e+00 7.14745e+01 93.338  9.67797e+00 273.338 0.7760 
1 1 1 -6  63  6  o 7  2.01922e+01 5.07452e-01 3.17391e+02 122.688 -2.62071e+01 4.08409e+01  0.00000e+00 0.00000e+00 4.29541e+02 122.688 1.12150e+02 122.688 0.9896 
1 1 1 -6  63  7  o 11 1.36155e+01 4.79192e-01 2.81429e+02 5.422   3.05353e+01  2.89817e+00  0.00000e+00 0.00000e+00 2.18807e+02 5.422   6.26219e+01 185.422 0.9836 
1 1 1 -6  63  8  o 1  1.60403e+01 4.97140e-01 3.28653e+02 215.161 -4.22136e+01 -2.97356e+01 0.00000e+00 0.00000e+00 2.64276e+02 215.161 6.43776e+01 35.161  0.9903 
1 1 1 -6  63  9  o 13 5.64021e+00 7.53451e-01 1.08185e+02 63.869  2.74552e+00  5.59653e+00  0.00000e+00 0.00000e+00 8.44892e+01 63.869  2.36956e+01 243.869 0.9158 
1 1 1 -6  63  10 o 17 5.65617e+00 7.67196e-01 8.79144e+01 201.266 -5.79351e+00 -2.25481e+00 0.00000e+00 0.00000e+00 1.05095e+02 201.266 1.71805e+01 201.266 0.9156 
1 1 1 -6  63  11 o 3  9.86324e+00 5.53953e-01 2.64170e+02 217.057 -2.90837e+01 -2.19612e+01 0.00000e+00 0.00000e+00 9.80252e+01 217.057 1.66145e+02 37.057  0.9862 
1 1 1 -6  63  12 o 11 9.86996e+00 6.34210e-01 1.45686e+02 96.923  -2.76271e+00 2.27520e+01  0.00000e+00 0.00000e+00 2.13385e+02 96.923  6.76989e+01 96.923  0.9779 
1 1 1 -6  63  13 o 16 3.04842e+00 9.16274e-01 5.52297e+01 290.313 9.30408e-01  -2.51350e+00 0.00000e+00 0.00000e+00 3.35055e+01 290.313 2.17242e+01 110.313 0.7833 
1 1 1 -6  63  14 o 6  3.47923e+00 9.98826e-01 3.69331e+01 196.153 -1.96337e+00 -5.68665e-01 0.00000e+00 0.00000e+00 5.41112e+01 196.153 1.71782e+01 196.153 0.7049 
1 1 1 -6  63  15 o 13 6.00804e+00 1.19277e+00 6.64078e+01 206.603 -5.89625e+00 -2.95308e+00 0.00000e+00 0.00000e+00 1.38717e+02 206.603 7.23093e+01 206.603 0.9207 
1 1 1 -6  63  16 o 6  3.73810e+00 1.22796e+00 9.43784e+01 299.017 3.07658e+00  -5.54644e+00 0.00000e+00 0.00000e+00 3.26340e+01 299.017 6.17444e+01 119.017 0.9174 
1 1 1 -6  64  1  o 12 1.83661e+01 5.53277e-01 3.37099e+02 256.652 -7.26773e+00 -3.06296e+01 0.00000e+00 0.00000e+00 3.39823e+02 256.652 2.72395e+00 256.652 0.9840 
1 1 1 -6  64  2  o 17 1.25614e+01 5.58144e-01 1.66277e+02 260.134 -1.81070e+00 -1.04117e+01 0.00000e+00 0.00000e+00 2.81239e+02 260.134 1.14962e+02 260.134 0.9514 
1 1 1 -6  64  3  o 11 2.68335e+01 6.24009e-01 4.76922e+02 69.957  2.59912e+01  7.12452e+01  0.00000e+00 0.00000e+00 5.20803e+02 69.957  4.38814e+01 69.957  0.9934 
1 1 1 -6  64  4  o 17 3.15494e+01 6.49819e-01 6.50294e+02 181.976 -1.16696e+02 -4.02656e+00 0.00000e+00 0.00000e+00 5.24985e+02 181.976 1.25309e+02 1.976   0.9957 
1 1 1 -6  64  5  o 5  1.23339e+01 4.87507e-01 2.91928e+02 114.587 -1.03661e+01 2.26549e+01  0.00000e+00 0.00000e+00 1.59924e+02 114.587 1.32004e+02 294.587 0.9797 
1 1 1 -6  64  6  o 16 1.80131e+01 4.95295e-01 2.26839e+02 32.270  2.56141e+01  1.61738e+01  0.00000e+00 0.00000e+00 4.35135e+02 32.270  2.08295e+02 32.270  0.9834 
1 1 1 -6  64  7  o 9  9.70178e+00 5.02350e-01 1.21521e+02 109.338 -3.44628e+00 9.82017e+00  0.00000e+00 0.00000e+00 2.22946e+02 109.338 1.01425e+02 109.338 0.9507 
1 1 1 -6  64  8  o 4  4.62838e+00 7.54530e-01 6.44432e+01 221.759 -2.07743e+00 -1.85477e+00 0.00000e+00 0.00000e+00 7.24932e+01 221.759 8.04998e+00 221.759 0.7927 
1 1 1 -6  64  9  o 9  5.17604e+00 6.86630e-01 1.77874e+02 245.203 -4.23484e+00 -9.16633e+00 0.00000e+00 0.00000e+00 5.33446e+00 245.203 1.72539e+02 65.203  0.9491 
1 1 1 -6  64  10 f 0  9.49588e+00 5.25783e-01 1.40235e+02 193.053 -1.64124e+01 -3.80495e+00 0.00000e+00 0.00000e+00 2.02939e+02 193.053 6.27045e+01 193.053 0.9699 
1 1 1 -6  64  11 o 9  6.24263e+00 7.57148e-01 1.53142e+02 149.915 -1.11815e+01 6.47781e+00  0.00000e+00 0.00000e+00 7.00877e+01 149.915 8.30539e+01 329.915 0.9605 
1 1 1 -6  64  12 o 17 6.29079e+00 8.27022e-01 1.43540e+02 174.513 -1.32989e+01 1.27747e+00  0.00000e+00 0.00000e+00 8.15089e+01 174.513 6.20307e+01 354.513 0.9618 
1 1 1 -6  64  13 o 14 6.10441e+00 9.65871e-01 7.57943e+01 341.768 6.92322e+00  -2.28056e+00 0.00000e+00 0.00000e+00 1.34839e+02 341.768 5.90448e+01 341.768 0.9286 
1 1 1 -6  64  14 o 7  4.49474e+00 1.13894e+00 8.38602e+01 116.647 -2.39907e+00 4.78112e+00  0.00000e+00 0.00000e+00 6.64399e+01 116.647 1.74203e+01 296.646 0.9009 
1 1 1 -6  64  15 o 19 3.06649e+00 1.00370e+00 4.63056e+01 231.165 -1.60652e+00 -1.99559e+00 0.00000e+00 0.00000e+00 4.14154e+01 231.165 4.89024e+00 51.165  0.7716 
1 1 1 -6  64  16 o 1  4.10287e+00 1.32298e+00 7.49005e+01 310.817 3.42913e+00  -3.97025e+00 0.00000e+00 0.00000e+00 6.16586e+01 310.817 1.32419e+01 130.817 0.8988 
1 1 1 -6  65  1  o 2  3.38447e+01 7.23242e-01 6.44400e+02 128.919 -7.29225e+01 9.03134e+01  0.00000e+00 0.00000e+00 6.17621e+02 128.919 2.67791e+01 308.919 0.9957 
1 1 1 -6  65  2  o 4  8.50067e+00 1.12332e+00 1.28405e+02 172.209 -5.84507e+00 7.99690e-01  0.00000e+00 0.00000e+00 1.61444e+02 172.209 3.30389e+01 172.209 0.9108 
1 1 1 -6  65  3  o 2  1.10386e+01 5.33666e-01 1.80548e+02 354.123 1.13629e+01  -1.16958e+00 0.00000e+00 0.00000e+00 2.14031e+02 354.123 3.34829e+01 354.123 0.9552 
1 1 1 -6  65  4  o 19 5.77205e+00 5.85890e-01 9.20971e+01 308.756 2.07573e+00  -2.58575e+00 0.00000e+00 0.00000e+00 8.72959e+01 308.756 4.80122e+00 128.756 0.8309 
1 1 1 -6  65  5  o 19 2.71540e+01 5.75598e-01 4.75883e+02 40.346  7.34361e+01  6.23798e+01  0.00000e+00 0.00000e+00 5.34032e+02 40.346  5.81487e+01 40.346  0.9948 
1 1 1 -6  65  6  o 19 6.62354e+00 5.98388e-01 6.68038e+01 88.701  8.36996e-02  3.69223e+00  0.00000e+00 0.00000e+00 1.43708e+02 88.701  7.69044e+01 88.701  0.8506 
1 1 1 -6  65  7  o 5  2.99616e+00 7.35346e-01 5.35493e+01 323.445 1.13811e+00  -8.43840e-01 0.00000e+00 0.00000e+00 1.07690e+01 323.445 4.27803e+01 143.445 0.5749 
1 1 1 -6  65  8  o 1  1.68143e+01 5.03755e-01 3.47002e+02 61.752  3.03486e+01  5.64857e+01  0.00000e+00 0.00000e+00 2.75512e+02 61.752  7.14900e+01 241.752 0.9922 
1 1 1 -6  65  9  o 12 2.86654e+00 7.02118e-01 5.80938e+01 18.148  1.75680e+00  5.75850e-01  0.00000e+00 0.00000e+00 1.36581e+01 18.148  4.44357e+01 198.148 0.6713 
1 1 1 -6  65  10 o 3  4.20756e+00 7.46312e-01 8.16242e+01 146.554 -3.71826e+00 2.45606e+00  0.00000e+00 0.00000e+00 5.61697e+01 146.554 2.54544e+01 326.554 0.8790 
1 1 1 -6  65  11 o 19 4.69596e+00 7.93783e-01 9.51803e+01 114.743 -2.57394e+00 5.58510e+00  0.00000e+00 0.00000e+00 6.46943e+01 114.743 3.04860e+01 294.743 0.9146 
1 1 1 -6  65  12 o 2  5.52165e+00 8.58870e-01 1.15059e+02 259.882 -1.69128e+00 -9.47707e+00 0.00000e+00 0.00000e+00 7.93027e+01 259.882 3.57567e+01 79.882  0.9465 
1 1 1 -6  65  13 o 14 3.40326e+00 9.59625e-01 6.89877e+01 93.185  -1.95409e-01 3.51127e+00  0.00000e+00 0.00000e+00 3.74653e+01 93.185  3.15224e+01 273.185 0.8420 
1 1 1 -6  65  14 f 0  6.40954e+00 1.07082e+00 1.26060e+02 194.324 -1.21507e+01 -3.10254e+00 0.00000e+00 0.00000e+00 1.02114e+02 194.324 2.39462e+01 14.324  0.9593 
1 1 1 -6  65  15 o 1  5.70111e+00 1.30055e+00 8.87259e+01 176.351 -7.78478e+00 4.96444e-01  0.00000e+00 0.00000e+00 1.08557e+02 176.351 1.98315e+01 176.351 0.9335 
1 1 1 -6  65  16 o 4  4.07517e+00 1.19525e+00 4.68981e+01 113.235 -1.33993e+00 3.12103e+00  0.00000e+00 0.00000e+00 7.91664e+01 113.235 3.22683e+01 113.235 0.8355 
1 1 1 -6  66  1  o 1  2.12451e+01 5.79373e-01 3.26663e+02 193.069 -3.87004e+01 -8.98386e+00 0.00000e+00 0.00000e+00 4.58754e+02 193.069 1.32091e+02 193.069 0.9873 
1 1 1 -6  66  2  o 4  1.73798e+01 5.55150e-01 3.87217e+02 41.739  2.87177e+01  2.56215e+01  0.00000e+00 0.00000e+00 2.54820e+02 41.739  1.32397e+02 221.739 0.9869 
1 1 1 -6  66  3  o 6  7.33330e+00 6.13170e-01 1.78884e+02 303.824 4.44961e+00  -6.64063e+00 0.00000e+00 0.00000e+00 7.77155e+01 303.824 1.01169e+02 123.824 0.9352 
1 1 1 -6  66  4  o 7  1.65106e+01 4.96339e-01 2.45293e+02 60.279  1.38789e+01  2.43119e+01  0.00000e+00 0.00000e+00 3.61061e+02 60.279  1.15768e+02 60.279  0.9820 
1 1 1 -6  66  5  o 6  1.64917e+01 4.86540e-01 2.80848e+02 224.486 -2.50395e+01 -2.45940e+01 0.00000e+00 0.00000e+00 3.26763e+02 224.486 4.59149e+01 224.486 0.9856 
1 1 1 -6  66  6  o 1  3.38361e+00 7.04046e-01 6.31720e+01 133.692 -1.13679e+00 1.18990e+00  0.00000e+00 0.00000e+00 1.64804e+01 133.692 4.66917e+01 313.692 0.6301 
1 1 1 -6  66  7  o 10 5.28270e+00 6.80563e-01 1.32657e+02 75.083  1.61025e+00  6.04470e+00  0.00000e+00 0.00000e+00 4.80338e+01 75.083  8.46228e+01 255.083 0.9162 
1 1 1 -6  66  8  o 16 6.87880e+00 5.59210e-01 1.18820e+02 7.369   8.62242e+00  1.11510e+00  0.00000e+00 0.00000e+00 1.22572e+02 7.369   3.75202e+00 7.369   0.9406 
1 1 1 -6  66  9  o 4  3.24918e+00 7.21303e-01 5.76615e+01 106.732 -6.23171e-01 2.07291e+00  0.00000e+00 0.00000e+00 2.99183e+01 106.732 2.77432e+01 286.732 0.7230 
1 1 1 -6  66  10 o 16 1.72635e+00 5.76551e-01 2.91170e+01 114.101 -2.88620e-01 6.45199e-01  0.00000e+00 0.00000e+00 7.70139e+00 294.101 3.68184e+01 294.101 0.3330 
1 1 1 -6  66  11 o 17 8.62082e+00 6.16359e-01 1.84170e+02 196.689 -2.51698e+01 -7.54601e+00 0.00000e+00 0.00000e+00 1.30501e+02 196.689 5.36697e+01 16.689  0.9808 
1 1 1 -6  66  12 o 6  4.34107e+00 8.19779e-01 9.55945e+01 192.464 -6.55978e+00 -1.44992e+00 0.00000e+00 0.00000e+00 5.32616e+01 192.464 4.23329e+01 12.464  0.9222 
1 1 1 -6  66  13 o 16 9.04252e+00 7.81647e-01 1.70996e+02 90.913  -4.60646e-01 2.89073e+01  0.00000e+00 0.00000e+00 1.59018e+02 90.913  1.19782e+01 270.913 0.9826 
1 1 1 -6  66  14 o 10 4.62236e+00 1.18779e+00 8.45376e+01 224.146 -4.15801e+00 -4.03586e+00 0.00000e+00 0.00000e+00 7.13722e+01 224.146 1.31654e+01 44.146  0.9090 
1 1 1 -6  66  15 o 6  3.44413e+00 1.03129e+00 8.14115e+01 244.007 -2.28659e+00 -4.68975e+00 0.00000e+00 0.00000e+00 3.32413e+01 244.007 4.81702e+01 64.007  0.8982 
1 1 1 -6  66  16 o 6  4.30881e+00 1.21988e+00 1.13916e+02 88.358  2.58001e-01  9.00022e+00  0.00000e+00 0.00000e+00 3.64520e+01 88.358  7.74644e+01 268.358 0.9427 
1 1 1 -6  67  1  o 5  8.28448e+00 6.26709e-01 1.30212e+02 85.798  4.51638e-01  6.14674e+00  0.00000e+00 0.00000e+00 1.53516e+02 85.798  2.33042e+01 85.798  0.9148 
1 1 1 -6  67  2  o 15 4.00083e+00 7.83007e-01 1.58092e+01 336.754 3.44858e-01  -1.48133e-01 0.00000e+00 0.00000e+00 1.18058e+01 336.754 4.00335e+00 156.754 0.1844 
1 1 1 -6  67  3  o 10 1.48613e+01 4.84922e-01 2.39836e+02 107.107 -7.28061e+00 2.36549e+01  0.00000e+00 0.00000e+00 3.04768e+02 107.107 6.49318e+01 107.107 0.9796 
1 1 1 -6  67  4  o 2  1.29914e+01 5.44644e-01 2.31106e+02 307.972 1.38405e+01  -1.77326e+01 0.00000e+00 0.00000e+00 2.43750e+02 307.972 1.26443e+01 307.972 0.9775 
1 1 1 -6  67  5  o 4  1.93484e+01 5.07304e-01 3.32570e+02 151.386 -4.41751e+01 2.40994e+01  0.00000e+00 0.00000e+00 3.83318e+02 151.386 5.07480e+01 151.386 0.9900 
1 1 1 -6  67  6  o 17 1.42437e+01 4.79889e-01 2.98317e+02 1.058   3.76332e+01  6.94819e-01  0.00000e+00 0.00000e+00 2.26590e+02 1.058   7.17270e+01 181.058 0.9866 
1 1 1 -6  67  7  o 10 1.68280e+01 4.58614e-01 2.91684e+02 352.319 4.78471e+01  -6.45287e+00 0.00000e+00 0.00000e+00 3.29925e+02 352.319 3.82409e+01 352.319 0.9896 
1 1 1 -6  67  8  o 13 5.59998e+00 6.94358e-01 9.70852e+01 287.995 1.74408e+00  -5.36920e+00 0.00000e+00 0.00000e+00 9.22656e+01 287.995 4.81966e+00 107.995 0.9065 
1 1 1 -6  67  9  o 18 1.57905e+01 4.71417e-01 2.99311e+02 45.144  4.56375e+01  4.58675e+01  0.00000e+00 0.00000e+00 2.84684e+02 45.144  1.46271e+01 225.144 0.9922 
1 1 1 -6  67  10 o 1  3.84903e+00 8.65111e-01 9.12829e+01 179.352 -4.63602e+00 5.24505e-02  0.00000e+00 0.00000e+00 3.54657e+01 179.352 5.58172e+01 359.352 0.8842 
1 1 1 -6  67  11 o 19 1.43746e+01 5.37760e-01 2.57905e+02 168.741 -6.01660e+01 1.19774e+01  0.00000e+00 0.00000e+00 2.72592e+02 168.741 1.46870e+01 168.741 0.9918 
1 1 1 -6  67  12 o 9  3.52002e+00 8.25686e-01 3.67616e+01 162.674 -1.84205e+00 5.74655e-01  0.00000e+00 0.00000e+00 5.29876e+01 162.674 1.62260e+01 162.674 0.6859 
1 1 1 -6  67  13 f 0  3.90067e+00 1.04403e+00 1.15145e+02 195.256 -6.57392e+00 -1.79299e+00 0.00000e+00 0.00000e+00 1.86180e+01 195.256 9.65266e+01 15.256  0.9234 
1 1 1 -6  67  14 o 3  3.56290e+00 1.09271e+00 1.00062e+02 69.678  1.97467e+00  5.33193e+00  0.00000e+00 0.00000e+00 1.98447e+01 69.678  8.02176e+01 249.678 0.9072 
1 1 1 -6  67  15 o 13 3.31830e+00 1.04385e+00 7.56323e+01 118.697 -2.19237e+00 4.00488e+00  0.00000e+00 0.00000e+00 3.28486e+01 118.697 4.27838e+01 298.697 0.8822 
1 1 1 -6  67  16 o 5  4.20030e+00 1.20381e+00 5.55594e+01 118.567 -2.11518e+00 3.88476e+00  0.00000e+00 0.00000e+00 8.09396e+01 118.567 2.53803e+01 118.567 0.8780 
1 1 1 -6  68  1  o 18 2.31006e+01 5.44599e-01 5.06773e+02 47.754  4.93874e+01  5.43786e+01  0.00000e+00 0.00000e+00 3.51974e+02 47.754  1.54798e+02 227.754 0.9932 
1 1 1 -6  68  2  o 4  1.35892e+01 4.82569e-01 2.32682e+02 167.872 -2.14742e+01 4.61458e+00  0.00000e+00 0.00000e+00 2.64076e+02 167.872 3.13934e+01 167.872 0.9770 
1 1 1 -6  68  3  o 10 9.27008e+00 6.07921e-01 1.77210e+02 310.022 7.42764e+00  -8.84501e+00 0.00000e+00 0.00000e+00 1.54148e+02 310.022 2.30621e+01 130.022 0.9557 
1 1 1 -6  68  4  o 19 1.01849e+01 5.04295e-01 2.79176e+02 173.794 -2.13636e+01 2.32315e+00  0.00000e+00 0.00000e+00 9.26256e+01 173.794 1.86551e+02 353.794 0.9764 
1 1 1 -6  68  5  o 6  5.93934e+00 6.26124e-01 7.83422e+01 10.801  3.58122e+00  6.83232e-01  0.00000e+00 0.00000e+00 1.09938e+02 10.801  3.15955e+01 10.801  0.8484 
1 1 1 -6  68  6  o 18 1.40645e+01 4.51189e-01 3.08314e+02 227.630 -2.73117e+01 -2.99411e+01 0.00000e+00 0.00000e+00 2.10398e+02 227.630 9.79162e+01 47.630  0.9876 
1 1 1 -6  68  7  o 15 2.93116e+00 7.39993e-01 3.50850e+01 106.753 -2.77975e-01 9.23412e-01  0.00000e+00 0.00000e+00 1.23493e+01 106.753 2.27358e+01 286.753 0.4336 
1 1 1 -6  68  8  o 6  4.11793e+00 6.93135e-01 1.02248e+02 310.781 3.00941e+00  -3.48879e+00 0.00000e+00 0.00000e+00 3.34229e+01 310.781 6.88247e+01 130.781 0.8834 
1 1 1 -6  68  9  o 2  6.02296e+00 6.65001e-01 8.39715e+01 128.372 -4.05331e+00 5.11907e+00  0.00000e+00 0.00000e+00 1.22497e+02 128.372 3.85251e+01 128.372 0.9199 
1 1 1 -6  68  10 o 2  7.97277e+00 5.96608e-01 1.38183e+02 136.742 -1.10759e+01 1.04221e+01  0.00000e+00 0.00000e+00 1.48756e+02 136.742 1.05734e+01 136.742 0.9665 
1 1 1 -6  68  11 o 19 3.26457e+00 8.53958e-01 5.28097e+01 323.562 2.01727e+00  -1.48932e+00 0.00000e+00 0.00000e+00 4.01985e+01 323.562 1.26112e+01 143.562 0.7658 
1 1 1 -6  68  12 o 10 2.86411e+00 8.33274e-01 6.60620e+01 236.857 -1.59277e+00 -2.43935e+00 0.00000e+00 0.00000e+00 1.94580e+01 236.857 4.66040e+01 56.858  0.8034 
1 1 1 -6  68  13 o 13 3.81220e+00 1.02780e+00 6.87406e+01 128.344 -2.37627e+00 3.00414e+00  0.00000e+00 0.00000e+00 5.25190e+01 128.344 1.62216e+01 308.344 0.8567 
1 1 1 -6  68  14 o 12 3.54730e+00 1.07063e+00 5.37872e+01 94.266  -2.42469e-01 3.25017e+00  0.00000e+00 0.00000e+00 5.50834e+01 94.266  1.29622e+00 94.266  0.8275 
1 1 1 -6  68  15 o 12 8.72711e+00 1.12816e+00 1.80209e+02 73.622  7.65140e+00  2.60340e+01  0.00000e+00 0.00000e+00 1.37105e+02 73.622  4.31040e+01 253.622 0.9814 
1 1 1 -6  68  16 o 6  3.96708e+00 1.19532e+00 3.63733e+01 8.772   2.69266e+00  4.15486e-01  0.00000e+00 0.00000e+00 7.92125e+01 8.772   4.28392e+01 8.772   0.7874 
1 1 1 -6  69  1  o 14 1.07862e+01 5.08195e-01 1.93038e+02 297.036 6.53341e+00  -1.28028e+01 0.00000e+00 0.00000e+00 1.96306e+02 297.036 3.26848e+00 297.036 0.9646 
1 1 1 -6  69  2  o 17 7.29310e+00 5.70386e-01 2.43171e+02 322.831 9.99432e+00  -7.57770e+00 0.00000e+00 0.00000e+00 1.85525e+01 322.831 2.24619e+02 142.831 0.9593 
1 1 1 -6  69  3  o 14 2.01799e+01 5.15252e-01 2.89363e+02 88.952  8.07952e-01  4.41542e+01  0.00000e+00 0.00000e+00 4.56682e+02 88.952  1.67319e+02 88.952  0.9886 
1 1 1 -6  69  4  o 2  1.62327e+01 5.47497e-01 3.11935e+02 292.628 1.51366e+01  -3.63127e+01 0.00000e+00 0.00000e+00 2.87058e+02 292.628 2.48770e+01 112.628 0.9872 
1 1 1 -6  69  5  o 18 9.30509e+00 5.16099e-01 1.71417e+02 159.052 -1.29440e+01 4.95538e+00  0.00000e+00 0.00000e+00 1.63428e+02 159.052 7.98947e+00 339.052 0.9632 
1 1 1 -6  69  6  o 6  1.19736e+01 4.52836e-01 2.67760e+02 280.380 5.38547e+00  -2.94021e+01 0.00000e+00 0.00000e+00 1.71764e+02 280.380 9.59964e+01 100.380 0.9831 
1 1 1 -6  69  7  o 10 9.21237e+00 4.86511e-01 2.10080e+02 294.552 8.69913e+00  -1.90426e+01 0.00000e+00 0.00000e+00 1.25356e+02 294.552 8.47239e+01 114.552 0.9758 
1 1 1 -6  69  8  o 16 6.72398e+00 5.89426e-01 1.28960e+02 7.696   9.82971e+00  1.32835e+00  0.00000e+00 0.00000e+00 1.08766e+02 7.696   2.01934e+01 187.696 0.9482 
1 1 1 -6  69  9  o 16 6.55461e+00 6.37666e-01 1.31469e+02 298.225 5.49340e+00  -1.02346e+01 0.00000e+00 0.00000e+00 1.01990e+02 298.225 2.94792e+01 118.225 0.9559 
1 1 1 -6  69  10 o 9  7.21490e+00 6.29172e-01 1.21147e+02 17.109  1.25493e+01  3.86282e+00  0.00000e+00 0.00000e+00 1.37014e+02 17.109  1.58670e+01 17.109  0.9611 
1 1 1 -6  69  11 o 11 7.25185e+00 7.34539e-01 1.53184e+02 349.366 1.68006e+01  -3.15449e+00 0.00000e+00 0.00000e+00 1.08541e+02 349.366 4.46425e+01 169.366 0.9703 
1 1 1 -6  69  12 o 11 4.98844e+00 9.55812e-01 7.87724e+01 102.857 -1.35841e+00 5.95187e+00  0.00000e+00 0.00000e+00 9.06517e+01 102.857 1.18793e+01 102.857 0.9140 
1 1 1 -6  69  13 o 6  5.93182e+00 1.04935e+00 9.04917e+01 17.114  7.92451e+00  2.43998e+00  0.00000e+00 0.00000e+00 1.15977e+02 17.114  2.54850e+01 17.114  0.9376 
1 1 1 -6  69  14 o 18 3.07549e+00 9.94671e-01 2.36452e+01 16.728  1.24077e+00  3.72901e-01  0.00000e+00 0.00000e+00 3.81012e+01 16.728  1.44560e+01 16.728  0.5414 
1 1 1 -6  69  15 o 14 3.73598e+00 1.13240e+00 2.71788e+01 295.097 7.77336e-01  -1.65964e+00 0.00000e+00 0.00000e+00 6.53041e+01 295.097 3.81253e+01 295.097 0.6683 
1 1 1 -6  69  16 o 2  4.18068e+00 1.24691e+00 5.15261e+01 336.484 3.64541e+00  -1.58630e+00 0.00000e+00 0.00000e+00 8.18944e+01 336.484 3.03683e+01 336.484 0.8626 
1 1 1 -6  70  1  o 8  1.61956e+01 5.02035e-01 1.98448e+02 26.913  2.16059e+01  1.09674e+01  0.00000e+00 0.00000e+00 3.94883e+02 26.913  1.96435e+02 26.913  0.9791 
1 1 1 -6  70  2  o 16 1.67984e+01 5.06513e-01 1.97037e+02 262.481 -3.27970e+00 -2.48473e+01 0.00000e+00 0.00000e+00 4.18612e+02 262.481 2.21575e+02 262.481 0.9798 
1 1 1 -6  70  3  o 10 1.86346e+01 5.04633e-01 4.01948e+02 136.260 -4.00352e+01 3.83114e+01  0.00000e+00 0.00000e+00 2.88455e+02 136.260 1.13493e+02 316.260 0.9909 
1 1 1 -6  70  4  o 11 7.58214e+00 5.69250e-01 2.02806e+02 131.694 -8.08974e+00 9.08168e+00  0.00000e+00 0.00000e+00 6.86376e+01 131.694 1.34169e+02 311.694 0.9580 
1 1 1 -6  70  5  o 8  1.95527e+01 4.65153e-01 2.79012e+02 215.900 -4.13018e+01 -2.98976e+01 0.00000e+00 0.00000e+00 4.44126e+02 215.900 1.65114e+02 215.900 0.9901 
1 1 1 -6  70  6  o 17 1.74017e+01 4.57220e-01 3.41889e+02 262.478 -7.76673e+00 -5.88185e+01 0.00000e+00 0.00000e+00 3.02226e+02 262.478 3.96632e+01 82.478  0.9915 
1 1 1 -6  70  7  o 19 3.15689e+00 7.55813e-01 1.59809e+02 222.813 -3.91029e+00 -3.62267e+00 0.00000e+00 0.00000e+00 5.37516e+01 42.813  2.13560e+02 42.813  0.9005 
1 1 1 -6  70  8  o 18 4.00507e+00 7.63191e-01 3.84302e+01 77.680  3.94922e-01  1.80826e+00  0.00000e+00 0.00000e+00 6.18622e+01 77.680  2.34320e+01 77.680  0.6717 
1 1 1 -6  70  9  o 10 7.25746e+00 6.81210e-01 6.69618e+01 110.070 -2.26901e+00 6.21026e+00  0.00000e+00 0.00000e+00 1.82016e+02 110.070 1.15054e+02 110.070 0.9209 
1 1 1 -6  70  10 o 6  5.45826e+00 7.91654e-01 1.33217e+02 37.321  7.95743e+00  6.06649e+00  0.00000e+00 0.00000e+00 5.95112e+01 37.321  7.37062e+01 217.321 0.9486 
1 1 1 -6  70  11 o 3  3.68131e+00 9.01129e-01 4.48806e+01 242.180 -1.14509e+00 -2.17002e+00 0.00000e+00 0.00000e+00 5.91460e+01 242.180 1.42654e+01 242.180 0.7599 
1 1 1 -6  70  12 f 0  3.64480e+00 8.99044e-01 1.45704e+02 133.639 -5.98784e+00 6.27922e+00  0.00000e+00 0.00000e+00 1.83470e+01 313.639 1.64051e+02 313.639 0.9405 
1 1 1 -6  70  13 o 14 7.61985e+00 9.39607e-01 9.04518e+01 354.452 1.18844e+01  -1.15434e+00 0.00000e+00 0.00000e+00 1.80253e+02 354.452 8.98013e+01 354.452 0.9572 
1 1 1 -6  70  14 o 11 3.74533e+00 1.11139e+00 5.87872e+01 1.941   3.85564e+00  1.30684e-01  0.00000e+00 0.00000e+00 6.03340e+01 1.941   1.54677e+00 1.941   0.8578 
1 1 1 -6  70  15 o 4  3.56693e+00 1.11472e+00 3.47679e+01 10.635  2.40471e+00  4.51539e-01  0.00000e+00 0.00000e+00 6.55068e+01 10.635  3.07389e+01 10.635  0.7591 
1 1 1 -6  70  16 o 1  3.28273e+00 1.08094e+00 3.20965e+01 238.399 -1.26603e+00 -2.05786e+00 0.00000e+00 0.00000e+00 5.96512e+01 238.399 2.75547e+01 238.399 0.7556 
1 1 1 -6  71  1  o 7  1.21547e+01 5.10399e-01 2.08486e+02 343.482 1.80187e+01  -5.34349e+00 0.00000e+00 0.00000e+00 2.33935e+02 343.482 2.54493e+01 343.482 0.9730 
1 1 1 -6  71  2  o 12 1.61679e+01 5.57759e-01 3.97866e+02 139.424 -3.79814e+01 3.25262e+01  0.00000e+00 0.00000e+00 2.00671e+02 139.424 1.97195e+02 319.424 0.9900 
1 1 1 -6  71  3  o 12 1.40137e+01 4.92428e-01 2.42088e+02 208.267 -2.53599e+01 -1.36359e+01 0.00000e+00 0.00000e+00 2.72582e+02 208.267 3.04949e+01 208.267 0.9825 
1 1 1 -6  71  4  o 18 1.31497e+01 4.49767e-01 2.80395e+02 136.302 -2.33898e+01 2.23505e+01  0.00000e+00 0.00000e+00 2.03277e+02 136.302 7.71175e+01 316.302 0.9844 
1 1 1 -6  71  5  o 3  6.62145e+00 5.44821e-01 1.46783e+02 93.340  -5.19741e-01 8.90511e+00  0.00000e+00 0.00000e+00 8.61916e+01 93.340  6.05910e+01 273.340 0.9422 
1 1 1 -6  71  6  o 18 4.69088e+00 6.72494e-01 8.52424e+01 272.401 1.59569e-01  -3.80606e+00 0.00000e+00 0.00000e+00 6.45854e+01 272.401 2.06570e+01 92.401  0.8558 
1 1 1 -6  71  7  o 19 1.51093e+01 4.57337e-01 2.25436e+02 141.399 -3.08707e+01 2.46442e+01  0.00000e+00 0.00000e+00 3.30951e+02 141.399 1.05515e+02 141.399 0.9873 
1 1 1 -6  71  8  o 14 5.34454e+00 6.76621e-01 9.02294e+01 243.611 -2.76529e+00 -5.57342e+00 0.00000e+00 0.00000e+00 9.21808e+01 243.611 1.95134e+00 243.611 0.9157 
1 1 1 -6  71  9  o 10 1.14314e+01 5.18101e-01 2.14887e+02 211.408 -3.01321e+01 -1.83982e+01 0.00000e+00 0.00000e+00 2.04801e+02 211.408 1.00866e+01 31.408  0.9857 
1 1 1 -6  71  10 o 5  2.71984e+00 7.85944e-01 3.63560e+01 28.275  1.34207e+00  7.21866e-01  0.00000e+00 0.00000e+00 2.45752e+01 28.275  1.17808e+01 208.275 0.6020 
1 1 1 -6  71  11 o 3  9.01458e+00 6.55276e-01 1.72358e+02 245.890 -1.10889e+01 -2.47779e+01 0.00000e+00 0.00000e+00 1.56585e+02 245.890 1.57726e+01 65.890  0.9814 
1 1 1 -6  71  12 o 12 8.51637e+00 7.66260e-01 1.81825e+02 331.705 2.45361e+01  -1.32086e+01 0.00000e+00 0.00000e+00 1.28798e+02 331.705 5.30261e+01 151.705 0.9819 
1 1 1 -6  71  13 o 10 5.77688e+00 1.09238e+00 9.20250e+01 199.307 -7.68623e+00 -2.69275e+00 0.00000e+00 0.00000e+00 1.08721e+02 199.307 1.66965e+01 199.307 0.9364 
1 1 1 -6  71  14 o 10 6.05569e+00 1.22237e+00 9.68454e+01 118.148 -4.26679e+00 7.97477e+00  0.00000e+00 0.00000e+00 1.14836e+02 118.148 1.79908e+01 118.148 0.9430 
1 1 1 -6  71  15 o 10 4.35350e+00 1.15295e+00 8.66396e+01 268.779 -1.58233e-01 -7.42728e+00 0.00000e+00 0.00000e+00 6.32818e+01 268.779 2.33578e+01 88.780  0.9300 
1 1 1 -6  71  16 o 5  6.75615e+00 1.31059e+00 1.07784e+02 288.285 4.17983e+00  -1.26496e+01 0.00000e+00 0.00000e+00 1.32515e+02 288.285 2.47308e+01 288.285 0.9617 
1 1 1 -6  72  1  o 17 4.90390e+00 7.92827e-01 9.50010e+01 290.546 1.21192e+00  -3.23358e+00 0.00000e+00 0.00000e+00 5.88119e+01 290.546 3.61891e+01 110.546 0.8386 
1 1 1 -6  72  2  o 6  8.98770e+00 6.19480e-01 1.75306e+02 224.588 -9.31171e+00 -9.17870e+00 0.00000e+00 0.00000e+00 1.47614e+02 224.588 2.76926e+01 44.588  0.9610 
1 1 1 -6  72  3  o 14 8.63679e+00 5.40117e-01 1.34022e+02 181.452 -1.00304e+01 -2.54339e-01 0.00000e+00 0.00000e+00 1.72234e+02 181.452 3.82122e+01 181.452 0.9488 
1 1 1 -6  72  4  o 12 1.47049e+01 4.48128e-01 2.68475e+02 16.271  3.54812e+01  1.03559e+01  0.00000e+00 0.00000e+00 2.73370e+02 16.271  4.89524e+00 16.271  0.9864 
1 1 1 -6  72  5  o 3  1.00776e+01 5.85331e-01 2.14243e+02 178.506 -2.07412e+01 5.40863e-01  0.00000e+00 0.00000e+00 1.52847e+02 178.506 6.13964e+01 358.506 0.9756 
1 1 1 -6  72  6  o 4  1.76930e+01 4.68223e-01 3.62249e+02 216.504 -5.58624e+01 -4.13417e+01 0.00000e+00 0.00000e+00 2.93215e+02 216.504 6.90344e+01 36.504  0.9928 
1 1 1 -6  72  7  o 11 6.38663e+00 5.71383e-01 1.28753e+02 69.885  3.25238e+00  8.88023e+00  0.00000e+00 0.00000e+00 9.64503e+01 69.885  3.23025e+01 249.885 0.9456 
1 1 1 -6  72  8  o 8  1.35085e+01 4.95270e-01 2.79271e+02 245.882 -1.96494e+01 -4.38903e+01 0.00000e+00 0.00000e+00 2.18875e+02 245.882 6.03958e+01 65.882  0.9895 
1 1 1 -6  72  9  o 6  4.39573e+00 8.01105e-01 1.33974e+02 6.455   7.52878e+00  8.51802e-01  0.00000e+00 0.00000e+00 1.84939e+01 6.455   1.15480e+02 186.455 0.9315 
1 1 1 -6  72  10 o 8  1.13340e+01 5.39592e-01 1.97624e+02 330.032 3.23132e+01  -1.86318e+01 0.00000e+00 0.00000e+00 2.18389e+02 330.032 2.07650e+01 330.032 0.9865 
1 1 1 -6  72  11 o 7  5.92587e+00 8.26579e-01 1.22557e+02 56.218  6.02052e+00  8.99953e+00  0.00000e+00 0.00000e+00 8.72999e+01 56.218  3.52567e+01 236.218 0.9526 
1 1 1 -6  72  12 o 15 7.43260e+00 8.41396e-01 1.55720e+02 74.843  5.15325e+00  1.90232e+01  0.00000e+00 0.00000e+00 1.13223e+02 74.843  4.24971e+01 254.843 0.9743 
1 1 1 -6  72  13 o 10 4.75664e+00 1.08927e+00 1.40692e+02 214.926 -8.67193e+00 -6.05557e+00 0.00000e+00 0.00000e+00 2.72260e+01 214.926 1.13466e+02 34.926  0.9515 
1 1 1 -6  72  14 o 18 6.38607e+00 1.16421e+00 1.34137e+02 40.337  1.11260e+01  9.44779e+00  0.00000e+00 0.00000e+00 9.42873e+01 40.337  3.98499e+01 220.337 0.9651 
1 1 1 -6  72  15 o 7  3.75164e+00 1.09564e+00 3.21534e+01 144.584 -1.88881e+00 1.34310e+00  0.00000e+00 0.00000e+00 7.11260e+01 144.584 3.89726e+01 144.584 0.7436 
1 1 1 -6  72  16 o 8  3.67708e+00 1.17165e+00 7.10503e+01 186.992 -5.71361e+00 -7.00788e-01 0.00000e+00 0.00000e+00 5.24606e+01 186.992 1.85897e+01 6.993   0.9084 
1 1 1 -6  73  1  o 19 6.69381e+00 7.41004e-01 8.24272e+01 310.844 2.75982e+00  -3.19237e+00 0.00000e+00 0.00000e+00 1.35709e+02 310.844 5.32815e+01 310.844 0.8715 
1 1 1 -6  73  2  o 4  2.10941e+01 5.44043e-01 3.80289e+02 24.362  6.32782e+01  2.86539e+01  0.00000e+00 0.00000e+00 4.02538e+02 24.362  2.22496e+01 24.362  0.9928 
1 1 1 -6  73  3  o 18 1.65276e+01 4.54974e-01 2.71780e+02 226.666 -2.89004e+01 -3.06318e+01 0.00000e+00 0.00000e+00 3.38419e+02 226.666 6.66391e+01 226.666 0.9881 
1 1 1 -6  73  4  o 13 8.04867e+00 5.37478e-01 1.28121e+02 320.292 7.29491e+00  -6.05802e+00 0.00000e+00 0.00000e+00 1.56170e+02 320.292 2.80490e+01 320.292 0.9457 
1 1 1 -6  73  5  o 3  5.46112e+00 6.35107e-01 8.84495e+01 15.778  4.47321e+00  1.26394e+00  0.00000e+00 0.00000e+00 9.18754e+01 15.778  3.42596e+00 15.778  0.8845 
1 1 1 -6  73  6  o 14 9.74058e+00 4.98893e-01 1.66964e+02 98.326  -2.56124e+00 1.75005e+01  0.00000e+00 0.00000e+00 1.86015e+02 98.326  1.90512e+01 98.326  0.9713 
1 1 1 -6  73  7  o 6  3.00519e+00 7.67102e-01 3.56706e+01 333.639 1.09342e+00  -5.41848e-01 0.00000e+00 0.00000e+00 2.24852e+01 333.639 1.31854e+01 153.639 0.5190 
1 1 1 -6  73  8  o 5  7.31370e+00 5.76934e-01 1.12722e+02 78.667  2.12819e+00  1.06188e+01  0.00000e+00 0.00000e+00 1.46874e+02 78.667  3.41521e+01 78.667  0.9526 
1 1 1 -6  73  9  o 7  6.82406e+00 6.52803e-01 1.00963e+02 263.189 -1.21741e+00 -1.01926e+01 0.00000e+00 0.00000e+00 1.40387e+02 263.189 3.94243e+01 263.189 0.9500 
1 1 1 -6  73  10 o 3  9.81425e+00 5.90488e-01 1.40009e+02 320.612 1.71934e+01  -1.41166e+01 0.00000e+00 0.00000e+00 2.16776e+02 320.612 7.67673e+01 320.612 0.9773 
1 1 1 -6  73  11 o 3  6.11604e+00 8.41523e-01 1.26167e+02 170.557 -1.16735e+01 1.94155e+00  0.00000e+00 0.00000e+00 9.13195e+01 170.557 3.48476e+01 350.557 0.9568 
1 1 1 -6  73  12 o 10 7.55249e+00 8.72687e-01 1.39134e+02 130.475 -1.16463e+01 1.36480e+01  0.00000e+00 0.00000e+00 1.33372e+02 130.475 5.76245e+00 310.475 0.9717 
1 1 1 -6  73  13 o 16 4.57542e+00 1.10141e+00 9.43045e+01 282.876 1.52451e+00  -6.66916e+00 0.00000e+00 0.00000e+00 6.24703e+01 282.876 3.18342e+01 102.876 0.9237 
1 1 1 -6  73  14 o 13 3.89080e+00 1.11042e+00 4.22040e+01 286.631 8.29962e-01  -2.77860e+00 0.00000e+00 0.00000e+00 7.34664e+01 286.631 3.12624e+01 286.631 0.8023 
1 1 1 -6  73  15 o 1  3.60648e+00 1.12992e+00 2.35873e+01 258.320 -3.40226e-01 -1.64575e+00 0.00000e+00 0.00000e+00 6.15375e+01 258.320 3.79502e+01 258.320 0.6377 
1 1 1 -6  73  16 o 6  4.10270e+00 1.23670e+00 6.43953e+01 100.959 -1.06477e+00 5.49874e+00  0.00000e+00 0.00000e+00 7.29713e+01 100.959 8.57604e+00 100.959 0.9057 
1 1 1 -6  74  1  o 15 1.08686e+01 5.54284e-01 2.28765e+02 349.768 2.14131e+01  -3.86522e+00 0.00000e+00 0.00000e+00 1.68121e+02 349.768 6.06442e+01 169.768 0.9767 
1 1 1 -6  74  2  o 18 2.11301e+01 6.41187e-01 3.24648e+02 233.163 -3.72113e+01 -4.96738e+01 0.00000e+00 0.00000e+00 4.58675e+02 233.163 1.34027e+02 233.163 0.9919 
1 1 1 -6  74  3  o 3  4.02242e+00 7.22432e-01 7.79208e+01 46.316  1.91482e+00  2.00489e+00  0.00000e+00 0.00000e+00 4.10417e+01 46.316  3.68790e+01 226.316 0.7916 
1 1 1 -6  74  4  o 11 9.49333e+00 5.03624e-01 1.87511e+02 7.035   1.74802e+01  2.15707e+00  0.00000e+00 0.00000e+00 1.56772e+02 7.035   3.07383e+01 187.035 0.9712 
1 1 1 -6  74  5  o 17 2.02883e+01 4.76844e-01 3.64282e+02 97.479  -1.04255e+01 7.94188e+01  0.00000e+00 0.00000e+00 3.88186e+02 97.479  2.39038e+01 97.479  0.9937 
1 1 1 -6  74  6  o 12 1.17625e+01 4.78328e-01 1.99888e+02 75.292  6.88342e+00  2.62232e+01  0.00000e+00 0.00000e+00 2.30697e+02 75.292  3.08095e+01 75.292  0.9814 
1 1 1 -6  74  7  o 15 1.89630e+01 4.81631e-01 3.62261e+02 214.251 -7.75032e+01 -5.27722e+01 0.00000e+00 0.00000e+00 3.40848e+02 214.251 2.14136e+01 34.251  0.9947 
1 1 1 -6  74  8  o 6  1.50091e+01 4.90443e-01 2.75935e+02 16.654  5.71219e+01  1.70874e+01  0.00000e+00 0.00000e+00 2.78462e+02 16.654  2.52700e+00 16.654  0.9916 
1 1 1 -6  74  9  o 8  7.07403e+00 6.39964e-01 1.48878e+02 187.243 -1.52243e+01 -1.93499e+00 0.00000e+00 0.00000e+00 1.05708e+02 187.243 4.31698e+01 7.243   0.9669 
1 1 1 -6  74  10 o 15 3.98440e+00 8.04335e-01 8.71523e+01 48.687  3.42281e+00  3.89431e+00  0.00000e+00 0.00000e+00 4.58465e+01 48.687  4.13057e+01 228.687 0.8975 
1 1 1 -6  74  11 o 15 5.37467e+00 8.91597e-01 1.17822e+02 339.594 9.54498e+00  -3.55092e+00 0.00000e+00 0.00000e+00 7.18229e+01 339.594 4.59987e+01 159.594 0.9496 
1 1 1 -6  74  12 o 2  4.25120e+00 9.35176e-01 1.32137e+02 160.436 -8.86779e+00 3.15144e+00  0.00000e+00 0.00000e+00 1.70495e+01 160.436 1.15087e+02 340.436 0.9453 
1 1 1 -6  74  13 o 19 6.06429e+00 1.07701e+00 8.09427e+01 1.522   8.34159e+00  2.21612e-01  0.00000e+00 0.00000e+00 1.30022e+02 1.522   4.90793e+01 1.522   0.9380 
1 1 1 -6  74  14 o 4  5.44258e+00 1.10590e+00 8.16574e+01 335.238 7.08275e+00  -3.26693e+00 0.00000e+00 0.00000e+00 1.06568e+02 335.238 2.49106e+01 335.238 0.9335 
1 1 1 -6  74  15 o 4  5.28088e+00 1.31711e+00 1.40211e+02 148.621 -1.08851e+01 6.63880e+00  0.00000e+00 0.00000e+00 4.73833e+01 148.621 9.28281e+01 328.621 0.9599 
1 1 1 -6  75  1  o 13 1.37613e+01 5.42552e-01 2.17926e+02 151.232 -2.42118e+01 1.32929e+01  0.00000e+00 0.00000e+00 2.87050e+02 151.232 6.91245e+01 151.232 0.9817 
1 1 1 -6  75  2  o 15 1.92448e+01 5.57272e-01 3.82862e+02 78.487  1.34742e+01  6.61490e+01  0.00000e+00 0.00000e+00 3.30894e+02 78.487  5.19674e+01 258.487 0.9926 
1 1 1 -6  75  3  o 3  1.25249e+01 4.60577e-01 1.73680e+02 2.563   2.14022e+01  9.58213e-01  0.00000e+00 0.00000e+00 2.83090e+02 2.563   1.09410e+02 2.563   0.9764 
1 1 1 -6  75  4  o 19 1.57963e+01 5.20890e-01 2.66896e+02 139.475 -3.15506e+01 2.69707e+01  0.00000e+00 0.00000e+00 3.15699e+02 139.475 4.88034e+01 139.475 0.9879 
1 1 1 -6  75  5  o 19 8.25733e+00 5.17475e-01 1.99701e+02 100.565 -3.39694e+00 1.82128e+01  0.00000e+00 0.00000e+00 9.99867e+01 100.565 9.97143e+01 280.565 0.9726 
1 1 1 -6  75  6  o 11 1.30464e+01 4.74234e-01 2.55774e+02 252.422 -1.18283e+01 -3.73377e+01 0.00000e+00 0.00000e+00 2.24516e+02 252.422 3.12579e+01 72.422  0.9872 
1 1 1 -6  75  7  o 7  7.28690e+00 5.73031e-01 1.07078e+02 242.967 -4.43431e+00 -8.69046e+00 0.00000e+00 0.00000e+00 1.50183e+02 242.967 4.31047e+01 242.967 0.9473 
1 1 1 -6  75  8  o 13 8.55062e+00 5.54738e-01 1.60753e+02 294.792 8.52192e+00  -1.84496e+01 0.00000e+00 0.00000e+00 1.49765e+02 294.792 1.09879e+01 114.792 0.9751 
1 1 1 -6  75  9  o 4  1.28513e+01 5.16457e-01 2.01009e+02 130.535 -2.87662e+01 3.36389e+01  0.00000e+00 0.00000e+00 2.71819e+02 130.535 7.08099e+01 130.535 0.9886 
1 1 1 -6  75  10 o 19 1.00028e+01 5.96620e-01 1.62554e+02 11.807  2.50654e+01  5.23951e+00  0.00000e+00 0.00000e+00 2.02057e+02 11.807  3.95034e+01 11.807  0.9803 
1 1 1 -6  75  11 o 19 3.30358e+00 9.18431e-01 1.09895e+01 213.591 -4.63788e-01 -3.08038e-01 0.00000e+00 0.00000e+00 2.19184e+01 213.591 1.09289e+01 213.591 0.2681 
1 1 1 -6  75  12 o 5  1.19192e+01 7.04450e-01 2.14017e+02 54.885  2.90579e+01  4.13224e+01  0.00000e+00 0.00000e+00 2.23981e+02 54.885  9.96440e+00 54.885  0.9901 
1 1 1 -6  75  13 f 0  4.31884e+00 1.13853e+00 9.91058e+01 164.784 -6.81012e+00 1.85233e+00  0.00000e+00 0.00000e+00 4.92109e+01 164.784 4.98948e+01 344.784 0.9262 
1 1 1 -6  75  14 o 19 3.10567e+00 9.92458e-01 1.15128e+02 229.295 -4.67627e+00 -5.43572e+00 0.00000e+00 0.00000e+00 8.44758e+00 49.295  1.23576e+02 49.295  0.9274 
1 1 1 -6  75  15 o 10 5.16117e+00 1.35042e+00 6.78281e+01 72.069  1.78710e+00  5.52272e+00  0.00000e+00 0.00000e+00 1.05789e+02 72.069  3.79610e+01 72.069  0.9092 
1 1 1 -6  76  1  o 7  6.59113e+00 6.81089e-01 1.54707e+02 57.979  4.82241e+00  7.71125e+00  0.00000e+00 0.00000e+00 7.76446e+01 57.979  7.70622e+01 237.979 0.9433 
1 1 1 -6  76  2  o 13 1.41584e+01 5.38425e-01 2.44119e+02 204.294 -3.05727e+01 -1.38003e+01 0.00000e+00 0.00000e+00 2.76871e+02 204.294 3.27515e+01 204.294 0.9850 
1 1 1 -6  76  3  o 13 1.54725e+01 4.52047e-01 3.21227e+02 327.696 4.19511e+01  -2.65241e+01 0.00000e+00 0.00000e+00 2.50719e+02 327.696 7.05077e+01 147.696 0.9899 
1 1 1 -6  76  4  o 17 1.10929e+01 5.32836e-01 2.03449e+02 235.266 -1.37616e+01 -1.98492e+01 0.00000e+00 0.00000e+00 2.01947e+02 235.266 1.50194e+00 55.266  0.9791 
1 1 1 -6  76  5  o 17 9.45002e+00 5.00747e-01 1.97015e+02 20.565  2.00228e+01  7.51201e+00  0.00000e+00 0.00000e+00 1.47195e+02 20.565  4.98203e+01 200.565 0.9763 
1 1 1 -6  76  6  o 4  5.42456e+00 6.64896e-01 1.44602e+02 328.576 8.30426e+00  -5.07380e+00 0.00000e+00 0.00000e+00 4.69644e+01 328.576 9.76376e+01 148.576 0.9471 
1 1 1 -6  76  7  o 1  1.28970e+01 4.88617e-01 2.22353e+02 128.315 -2.39099e+01 3.02592e+01  0.00000e+00 0.00000e+00 2.51940e+02 128.315 2.95865e+01 128.315 0.9869 
1 1 1 -6  76  8  o 11 9.97999e+00 5.20225e-01 1.18711e+02 81.443  2.58293e+00  1.71664e+01  0.00000e+00 0.00000e+00 2.42035e+02 81.443  1.23324e+02 81.443  0.9708 
1 1 1 -6  76  9  o 10 2.80474e+00 8.00678e-01 5.01092e+01 134.559 -1.48102e+00 1.50400e+00  0.00000e+00 0.00000e+00 2.45222e+01 134.559 2.55870e+01 314.559 0.7152 
1 1 1 -6  76  10 o 1  4.42416e+00 8.91290e-01 8.97223e+01 66.265  2.31385e+00  5.26225e+00  0.00000e+00 0.00000e+00 5.96657e+01 66.265  3.00567e+01 246.265 0.9083 
1 1 1 -6  76  11 f 0  2.65578e+00 8.27277e-01 3.58735e+01 283.130 3.76893e-01  -1.61573e+00 0.00000e+00 0.00000e+00 2.65772e+01 283.130 9.29629e+00 103.130 0.6331 
1 1 1 -6  76  12 o 3  1.38268e+01 6.66889e-01 2.58730e+02 201.342 -6.49035e+01 -2.53599e+01 0.00000e+00 0.00000e+00 2.50673e+02 201.342 8.05621e+00 21.342  0.9928 
1 1 1 -6  76  13 o 4  2.81544e+00 9.14383e-01 7.21032e+01 356.938 3.88372e+00  -2.07742e-01 0.00000e+00 0.00000e+00 1.75665e+01 356.938 5.45368e+01 176.938 0.8591 
1 1 1 -6  76  14 o 18 5.57541e+00 1.26055e+00 1.04718e+02 199.349 -9.45442e+00 -3.31993e+00 0.00000e+00 0.00000e+00 9.11612e+01 199.349 1.35567e+01 19.349  0.9487 
1 1 1 -6  76  15 o 13 4.06753e+00 1.22773e+00 6.55154e+01 117.881 -2.55179e+00 4.82345e+00  0.00000e+00 0.00000e+00 7.03493e+01 117.881 4.83387e+00 117.881 0.9030 
1 1 1 -6  77  1  o 7  1.64455e+01 4.98702e-01 2.27945e+02 108.180 -1.15736e+01 3.52416e+01  0.00000e+00 0.00000e+00 3.78166e+02 108.180 1.50220e+02 108.180 0.9864 
1 1 1 -6  77  2  o 13 1.09445e+01 5.57755e-01 2.37201e+02 45.657  1.77564e+01  1.81687e+01  0.00000e+00 0.00000e+00 1.63455e+02 45.657  7.37462e+01 225.657 0.9801 
1 1 1 -6  77  3  o 8  3.26600e+00 7.93824e-01 5.53933e+01 75.646  4.49629e-01  1.75704e+00  0.00000e+00 0.00000e+00 2.56558e+01 75.646  2.97375e+01 255.646 0.6647 
1 1 1 -6  77  4  o 13 8.39926e+00 5.72025e-01 1.61688e+02 116.173 -6.41068e+00 1.30438e+01  0.00000e+00 0.00000e+00 1.40778e+02 116.173 2.09093e+01 296.173 0.9650 
1 1 1 -6  77  5  o 1  1.20096e+01 4.77862e-01 1.79066e+02 351.017 2.49309e+01  -3.94084e+00 0.00000e+00 0.00000e+00 2.59919e+02 351.017 8.08536e+01 351.017 0.9800 
1 1 1 -6  77  6  o 2  8.61406e+00 5.22577e-01 1.10689e+02 109.776 -4.34651e+00 1.20888e+01  0.00000e+00 0.00000e+00 1.97661e+02 109.776 8.69721e+01 109.776 0.9603 
1 1 1 -6  77  7  o 18 7.70268e+00 5.65463e-01 1.66561e+02 230.235 -1.15681e+01 -1.39018e+01 0.00000e+00 0.00000e+00 1.12345e+02 230.235 5.42161e+01 50.235  0.9719 
1 1 1 -6  77  8  o 8  6.49484e+00 6.28984e-01 1.04957e+02 183.216 -9.96870e+00 -5.60097e-01 0.00000e+00 0.00000e+00 1.24384e+02 183.216 1.94273e+01 183.216 0.9485 
1 1 1 -6  77  9  o 16 9.07428e+00 6.07822e-01 1.60072e+02 285.844 6.42338e+00  -2.26326e+01 0.00000e+00 0.00000e+00 1.70234e+02 285.844 1.01622e+01 285.844 0.9785 
1 1 1 -6  77  10 o 9  9.13385e+00 6.21287e-01 1.35677e+02 77.740  4.44856e+00  2.04710e+01  0.00000e+00 0.00000e+00 1.95615e+02 77.740  5.99377e+01 77.740  0.9758 
1 1 1 -6  77  11 o 2  1.20468e+01 6.35843e-01 1.48968e+02 236.038 -1.88648e+01 -2.80082e+01 0.00000e+00 0.00000e+00 2.91730e+02 236.038 1.42762e+02 236.038 0.9851 
1 1 1 -6  77  12 o 1  4.64105e+00 1.07105e+00 4.99461e+01 154.143 -3.28698e+00 1.59304e+00  0.00000e+00 0.00000e+00 9.61899e+01 154.143 4.62438e+01 154.143 0.8487 
1 1 1 -6  77  13 o 16 3.96956e+00 1.09757e+00 1.05506e+02 258.921 -1.35132e+00 -6.90135e+00 0.00000e+00 0.00000e+00 3.07182e+01 258.921 7.47875e+01 78.921  0.9259 
1 1 1 -6  77  14 o 8  5.45879e+00 1.23915e+00 1.28431e+02 146.479 -1.07078e+01 7.09291e+00  0.00000e+00 0.00000e+00 6.56423e+01 146.479 6.27890e+01 326.479 0.9602 
1 1 1 -6  77  15 o 17 8.55341e+00 1.35653e+00 1.72613e+02 307.938 1.57163e+01  -2.01607e+01 0.00000e+00 0.00000e+00 1.37464e+02 307.938 3.51491e+01 127.938 0.9802 
1 1 1 -6  78  1  o 15 1.72578e+01 6.33385e-01 2.97110e+02 197.651 -5.20919e+01 -1.65757e+01 0.00000e+00 0.00000e+00 3.41631e+02 197.651 4.45211e+01 197.651 0.9908 
1 1 1 -6  78  2  o 16 7.73333e+00 6.18813e-01 1.10572e+02 250.743 -2.96257e+00 -8.48028e+00 0.00000e+00 0.00000e+00 1.61627e+02 250.743 5.10557e+01 250.743 0.9426 
1 1 1 -6  78  3  o 15 3.34098e+00 7.63024e-01 1.01197e+02 279.329 5.77761e-01  -3.51716e+00 0.00000e+00 0.00000e+00 4.10816e+00 279.329 9.70890e+01 99.329  0.8444 
1 1 1 -6  78  4  o 8  2.08910e+01 5.26848e-01 4.28334e+02 290.947 3.42045e+01  -8.93523e+01 0.00000e+00 0.00000e+00 3.47042e+02 290.947 8.12911e+01 110.947 0.9948 
1 1 1 -6  78  5  o 5  3.59224e+00 7.27648e-01 8.92540e+01 124.991 -2.23684e+00 3.19557e+00  0.00000e+00 0.00000e+00 2.58968e+01 124.991 6.33572e+01 304.991 0.8596 
1 1 1 -6  78  6  o 10 1.08832e+01 4.88550e-01 1.41434e+02 165.469 -2.09888e+01 5.44029e+00  0.00000e+00 0.00000e+00 2.54715e+02 165.469 1.13281e+02 165.469 0.9767 
1 1 1 -6  78  7  o 2  3.22398e+00 7.79754e-01 7.11851e+01 252.894 -9.21760e-01 -2.99504e+00 0.00000e+00 0.00000e+00 2.72090e+01 252.894 4.39761e+01 72.894  0.8194 
1 1 1 -6  78  8  o 18 2.43385e+00 7.29413e-01 1.15128e+02 1.434   3.88039e+00  9.71181e-02  0.00000e+00 0.00000e+00 3.73298e+01 181.434 1.52458e+02 181.434 0.8588 
1 1 1 -6  78  9  o 1  4.53665e+00 8.38892e-01 8.27283e+01 44.356  4.11104e+00  4.01966e+00  0.00000e+00 0.00000e+00 7.05227e+01 44.356  1.22055e+01 224.356 0.9083 
1 1 1 -6  78  10 o 16 5.04924e+00 8.82926e-01 6.65216e+01 39.527  4.19821e+00  3.46405e+00  0.00000e+00 0.00000e+00 1.02863e+02 39.527  3.63413e+01 39.527  0.9027 
1 1 1 -6  78  11 o 10 5.74394e+00 9.65280e-01 1.04658e+02 154.488 -8.20974e+00 3.91789e+00  0.00000e+00 0.00000e+00 9.65174e+01 154.488 8.14024e+00 334.488 0.9433 
1 1 1 -6  78  12 o 16 1.45173e+01 6.76648e-01 2.52785e+02 220.935 -5.65238e+01 -4.90229e+01 0.00000e+00 0.00000e+00 2.82100e+02 220.935 2.93152e+01 220.935 0.9933 
1 1 1 -6  78  13 o 12 9.25732e+00 9.51885e-01 1.77890e+02 66.829  1.27477e+01  2.97848e+01  0.00000e+00 0.00000e+00 1.59813e+02 66.829  1.80779e+01 246.829 0.9844 
1 1 1 -6  78  14 o 18 3.73930e+00 1.07778e+00 1.82599e+01 314.377 9.30192e-01  -9.50653e-01 0.00000e+00 0.00000e+00 5.80383e+01 314.377 3.97784e+01 314.377 0.5512 
1 1 1 -6  78  15 o 1  2.49060e+00 8.63325e-01 1.65404e+01 15.196  1.17790e+00  3.19933e-01  0.00000e+00 0.00000e+00 3.12640e+01 15.196  1.47236e+01 15.196  0.5191 
1 1 1 -6  79  1  o 1  1.48322e+01 6.37601e-01 2.41890e+02 300.660 2.00102e+01  -3.37551e+01 0.00000e+00 0.00000e+00 3.04943e+02 300.660 6.30537e+01 300.660 0.9872 
1 1 1 -6  79  2  o 16 2.00290e+01 5.69767e-01 3.45676e+02 57.721  3.96248e+01  6.27301e+01  0.00000e+00 0.00000e+00 3.97038e+02 57.721  5.13621e+01 57.721  0.9932 
1 1 1 -6  79  3  o 12 4.65090e+00 7.70549e-01 5.84325e+01 256.337 -6.86848e-01 -2.82553e+00 0.00000e+00 0.00000e+00 8.09327e+01 256.337 2.25002e+01 256.337 0.8029 
1 1 1 -6  79  4  o 4  2.59800e+00 7.30299e-01 1.46787e+02 55.171  2.51393e+00  3.61317e+00  0.00000e+00 0.00000e+00 6.17588e+01 235.171 2.08546e+02 235.171 0.8774 
1 1 1 -6  79  5  o 8  6.40210e+00 5.72723e-01 9.83567e+01 5.812   8.32820e+00  8.47685e-01  0.00000e+00 0.00000e+00 1.25589e+02 5.812   2.72326e+01 5.812   0.9382 
1 1 1 -6  79  6  f 0  5.12662e+00 7.17137e-01 1.07213e+02 81.006  1.07868e+00  6.81548e+00  0.00000e+00 0.00000e+00 6.93730e+01 81.006  3.78402e+01 261.006 0.9244 
1 1 1 -6  79  7  o 14 1.01729e+01 5.29311e-01 1.27436e+02 20.367  1.77556e+01  6.59156e+00  0.00000e+00 0.00000e+00 2.41242e+02 20.367  1.13806e+02 20.367  0.9732 
1 1 1 -6  79  8  o 8  7.23221e+00 6.25392e-01 1.55591e+02 259.634 -3.24729e+00 -1.77522e+01 0.00000e+00 0.00000e+00 1.05968e+02 259.634 4.96235e+01 79.634  0.9719 
1 1 1 -6  79  9  o 13 2.36494e+00 7.43657e-01 2.85715e+01 102.969 -2.25562e-01 9.79463e-01  0.00000e+00 0.00000e+00 1.08415e+01 102.969 1.77300e+01 282.969 0.4482 
1 1 1 -6  79  10 o 12 7.85082e+00 7.60137e-01 1.55378e+02 83.874  2.28686e+00  2.13076e+01  0.00000e+00 0.00000e+00 1.29416e+02 83.874  2.59614e+01 263.874 0.9764 
1 1 1 -6  79  11 o 18 7.84373e+00 8.06677e-01 1.64691e+02 233.149 -1.37383e+01 -1.83306e+01 0.00000e+00 0.00000e+00 1.20044e+02 233.149 4.46470e+01 53.149  0.9779 
1 1 1 -6  79  12 o 13 3.37336e+00 9.98748e-01 6.44266e+01 339.567 3.64917e+00  -1.35951e+00 0.00000e+00 0.00000e+00 4.30770e+01 339.567 2.13495e+01 159.567 0.8593 
1 1 1 -6  79  13 o 10 1.47499e+01 7.68166e-01 2.76115e+02 131.858 -5.93975e+01 6.62969e+01  0.00000e+00 0.00000e+00 2.67262e+02 131.858 8.85349e+00 311.858 0.9944 
1 1 1 -6  79  14 o 18 3.60660e+00 1.10521e+00 8.32278e+01 304.865 3.45839e+00  -4.96387e+00 0.00000e+00 0.00000e+00 3.86517e+01 304.865 4.45761e+01 124.865 0.9131 
1 1 1 -6  79  15 o 15 4.32141e+00 1.25016e+00 7.84448e+01 254.708 -1.87202e+00 -6.84650e+00 0.00000e+00 0.00000e+00 6.95800e+01 254.708 8.86478e+00 74.708  0.9266 
1 1 1 -6  80  1  o 13 1.22368e+01 6.38183e-01 2.00771e+02 183.081 -2.73097e+01 -1.47012e+00 0.00000e+00 0.00000e+00 2.47704e+02 183.081 4.69327e+01 183.081 0.9815 
1 1 1 -6  80  2  o 9  1.93188e+01 6.27720e-01 3.65153e+02 82.995  8.99717e+00  7.32192e+01  0.00000e+00 0.00000e+00 3.51041e+02 82.995  1.41118e+01 262.995 0.9932 
1 1 1 -6  80  3  f 0  1.17455e+01 5.32690e-01 2.36854e+02 238.385 -1.69077e+01 -2.74670e+01 0.00000e+00 0.00000e+00 1.94540e+02 238.385 4.23142e+01 58.385  0.9844 
1 1 1 -6  80  4  o 14 9.23094e+00 5.67801e-01 1.82299e+02 145.033 -1.75824e+01 1.22964e+01  0.00000e+00 0.00000e+00 1.53844e+02 145.033 2.84555e+01 325.033 0.9764 
1 1 1 -6  80  5  o 8  4.11416e+00 7.42299e-01 7.26563e+01 329.803 3.36444e+00  -1.95787e+00 0.00000e+00 0.00000e+00 5.91174e+01 329.803 1.35389e+01 149.804 0.8593 
1 1 1 -6  80  6  o 12 7.07806e+00 5.72419e-01 1.62156e+02 134.513 -1.13842e+01 1.15793e+01  0.00000e+00 0.00000e+00 9.32760e+01 134.513 6.88797e+01 314.513 0.9687 
1 1 1 -6  80  7  o 8  3.29226e+00 8.17289e-01 3.59618e+01 112.369 -6.14127e-01 1.49224e+00  0.00000e+00 0.00000e+00 4.04001e+01 112.369 4.43823e+00 112.369 0.6230 
1 1 1 -6  80  8  o 18 6.98186e+00 6.27062e-01 1.68871e+02 270.484 1.59203e-01  -1.88444e+01 0.00000e+00 0.00000e+00 8.38932e+01 270.484 8.49776e+01 90.484  0.9731 
1 1 1 -6  80  9  o 9  6.54324e+00 7.66713e-01 1.12315e+02 164.330 -1.08362e+01 3.03979e+00  0.00000e+00 0.00000e+00 1.19862e+02 164.330 7.54734e+00 164.330 0.9545 
1 1 1 -6  80  10 o 11 5.15903e+00 9.22409e-01 1.25696e+02 298.282 5.07928e+00  -9.44046e+00 0.00000e+00 0.00000e+00 5.67665e+01 298.282 6.89298e+01 118.282 0.9522 
1 1 1 -6  80  11 o 15 1.17628e+01 6.91093e-01 1.83170e+02 63.802  1.72122e+01  3.49822e+01  0.00000e+00 0.00000e+00 2.47739e+02 63.802  6.45689e+01 63.802  0.9871 
1 1 1 -6  80  12 o 1  9.25274e+00 8.67145e-01 1.31393e+02 172.856 -2.38555e+01 2.98993e+00  0.00000e+00 0.00000e+00 2.04460e+02 172.856 7.30667e+01 172.856 0.9790 
1 1 1 -6  80  13 o 5  3.56064e+00 1.03520e+00 6.20454e+01 13.371  4.17348e+00  9.92007e-01  0.00000e+00 0.00000e+00 5.31975e+01 13.371  8.84794e+00 193.371 0.8738 
1 1 1 -6  80  14 o 12 5.98657e+00 1.22088e+00 1.27428e+02 233.646 -8.21289e+00 -1.11583e+01 0.00000e+00 0.00000e+00 8.59279e+01 233.646 4.15002e+01 53.646  0.9632 
1 1 1 -6  80  15 o 8  3.24635e+00 1.05636e+00 2.90757e+01 263.903 -2.35851e-01 -2.20814e+00 0.00000e+00 0.00000e+00 5.86163e+01 263.903 2.95406e+01 263.903 0.7309 
1 1 1 -6  81  1  o 7  8.20572e+00 7.43806e-01 1.31067e+02 290.872 4.20434e+00  -1.10264e+01 0.00000e+00 0.00000e+00 1.61976e+02 290.872 3.09094e+01 290.872 0.9566 
1 1 1 -6  81  2  o 15 7.26987e+00 7.61808e-01 1.46001e+02 208.734 -1.06407e+01 -5.83393e+00 0.00000e+00 0.00000e+00 1.13866e+02 208.734 3.21358e+01 28.735  0.9579 
1 1 1 -6  81  3  o 13 1.07204e+01 5.38784e-01 1.94023e+02 76.783  6.11617e+00  2.60421e+01  0.00000e+00 0.00000e+00 1.98335e+02 76.783  4.31169e+00 76.783  0.9811 
1 1 1 -6  81  4  o 17 6.61530e+00 6.57360e-01 1.31756e+02 230.928 -7.11210e+00 -8.76006e+00 0.00000e+00 0.00000e+00 1.03706e+02 230.928 2.80501e+01 50.928  0.9546 
1 1 1 -6  81  5  o 13 9.13909e+00 5.24436e-01 1.07586e+02 42.540  9.63597e+00  8.84203e+00  0.00000e+00 0.00000e+00 2.19709e+02 42.540  1.12124e+02 42.540  0.9610 
1 1 1 -6  81  6  o 9  1.12285e+01 5.11991e-01 1.77036e+02 67.780  1.06325e+01  2.60286e+01  0.00000e+00 0.00000e+00 2.33672e+02 67.780  5.66359e+01 67.780  0.9821 
1 1 1 -6  81  7  f 0  1.22025e+01 5.16823e-01 8.82157e+01 344.681 1.77963e+01  -4.87494e+00 0.00000e+00 0.00000e+00 3.53500e+02 344.681 2.65284e+02 344.681 0.9725 
1 1 1 -6  81  8  o 15 6.98516e+00 6.45993e-01 1.15196e+02 181.059 -1.28331e+01 -2.37303e-01 0.00000e+00 0.00000e+00 1.34286e+02 181.059 1.90900e+01 181.059 0.9602 
1 1 1 -6  81  9  o 14 2.71366e+00 8.12988e-01 2.40320e+01 41.310  7.61219e-01  6.68990e-01  0.00000e+00 0.00000e+00 2.14680e+01 41.310  2.56400e+00 221.310 0.4511 
1 1 1 -6  81  10 o 18 7.53738e+00 7.47459e-01 1.27272e+02 81.752  2.45740e+00  1.69535e+01  0.00000e+00 0.00000e+00 1.44346e+02 81.752  1.70740e+01 81.752  0.9704 
1 1 1 -6  81  11 o 17 2.76085e+00 8.57305e-01 1.07257e+02 152.173 -4.70093e+00 2.48140e+00  0.00000e+00 0.00000e+00 1.50388e+01 332.173 1.22295e+02 332.173 0.9002 
1 1 1 -6  81  12 o 9  3.72421e+00 1.04714e+00 5.27077e+01 170.697 -3.39569e+00 5.56240e-01  0.00000e+00 0.00000e+00 6.29748e+01 170.697 1.02671e+01 170.697 0.8380 
1 1 1 -6  81  13 o 8  3.98017e+00 1.11020e+00 7.65661e+01 54.652  3.41528e+00  4.81493e+00  0.00000e+00 0.00000e+00 5.76832e+01 54.652  1.88829e+01 234.651 0.9108 
1 1 1 -6  81  14 o 6  3.84648e+00 1.11971e+00 7.33190e+01 314.696 4.08416e+00  -4.12776e+00 0.00000e+00 0.00000e+00 5.60582e+01 314.696 1.72608e+01 134.696 0.9092 
1 1 1 -6  81  15 o 13 5.37470e+00 1.26530e+00 1.17640e+02 192.245 -1.24419e+01 -2.70017e+00 0.00000e+00 0.00000e+00 7.29915e+01 192.245 4.46488e+01 12.245  0.9599 
1 1 1 -6  82  1  o 17 7.09048e+00 7.87410e-01 1.66297e+02 325.310 1.15686e+01  -8.00746e+00 0.00000e+00 0.00000e+00 8.87503e+01 325.310 7.75465e+01 145.310 0.9638 
1 1 1 -6  82  2  o 3  8.61364e+00 7.04712e-01 1.52584e+02 162.538 -1.53554e+01 4.83045e+00  0.00000e+00 0.00000e+00 1.58641e+02 162.538 6.05750e+00 162.538 0.9684 
1 1 1 -6  82  3  o 11 1.31784e+01 4.87143e-01 2.12064e+02 43.774  2.74363e+01  2.62867e+01  0.00000e+00 0.00000e+00 2.72913e+02 43.774  6.08495e+01 43.774  0.9868 
1 1 1 -6  82  4  o 4  1.36803e+01 5.32983e-01 2.37174e+02 24.908  4.09097e+01  1.89970e+01  0.00000e+00 0.00000e+00 2.67115e+02 24.908  2.99412e+01 24.908  0.9889 
1 1 1 -6  82  5  o 8  5.97626e+00 6.96153e-01 8.54609e+01 213.480 -5.78801e+00 -3.82806e+00 0.00000e+00 0.00000e+00 1.20473e+02 213.480 3.50123e+01 213.480 0.9248 
1 1 1 -6  82  6  o 6  2.37749e+00 6.79886e-01 5.91365e+01 63.141  9.36303e-01  1.84887e+00  0.00000e+00 0.00000e+00 3.66018e+00 63.141  5.54763e+01 243.141 0.7093 
1 1 1 -6  82  7  o 2  6.19098e+00 6.70348e-01 1.25079e+02 144.381 -9.99398e+00 7.15991e+00  0.00000e+00 0.00000e+00 9.57304e+01 144.381 2.93485e+01 324.381 0.9584 
1 1 1 -6  82  8  o 8  6.89210e+00 6.94310e-01 1.37288e+02 117.981 -6.74140e+00 1.26886e+01  0.00000e+00 0.00000e+00 1.09925e+02 117.981 2.73635e+01 297.982 0.9645 
1 1 1 -6  82  9  o 13 6.90112e+00 7.19882e-01 1.81431e+02 118.573 -1.04901e+01 1.92616e+01  0.00000e+00 0.00000e+00 6.90923e+01 118.573 1.12339e+02 298.573 0.9769 
1 1 1 -6  82  10 o 8  1.14935e+01 6.30188e-01 1.74403e+02 345.217 3.45121e+01  -9.10746e+00 0.00000e+00 0.00000e+00 2.46315e+02 345.217 7.19114e+01 345.217 0.9859 
1 1 1 -6  82  11 o 11 3.41871e+00 9.39930e-01 8.05220e+01 252.628 -1.42293e+00 -4.54831e+00 0.00000e+00 0.00000e+00 3.20494e+01 252.628 4.84725e+01 72.628  0.8876 
1 1 1 -6  82  12 o 5  3.08986e+00 9.53632e-01 7.13874e+01 95.300  -4.04572e-01 4.36099e+00  0.00000e+00 0.00000e+00 2.90041e+01 95.300  4.23833e+01 275.300 0.8767 
1 1 1 -6  82  13 o 8  4.28517e+00 1.14538e+00 5.17005e+01 352.032 4.35214e+00  -6.09210e-01 0.00000e+00 0.00000e+00 8.74606e+01 352.032 3.57601e+01 352.032 0.8771 
1 1 1 -6  82  14 o 18 3.49701e+00 1.08308e+00 9.23505e+01 192.635 -7.21540e+00 -1.61747e+00 0.00000e+00 0.00000e+00 2.78896e+01 192.635 6.44609e+01 12.635  0.9297 
1 1 1 -6  82  15 o 9  3.26152e+00 1.08094e+00 6.50096e+01 65.129  2.30224e+00  4.96630e+00  0.00000e+00 0.00000e+00 4.38304e+01 65.129  2.11792e+01 245.129 0.9033 
1 1 1 -6  83  1  o 3  3.24141e+00 7.67031e-01 2.63990e+01 43.617  7.74224e-01  7.37733e-01  0.00000e+00 0.00000e+00 3.05015e+01 43.617  4.10253e+00 43.617  0.4705 
1 1 1 -6  83  2  o 6  5.47514e+00 8.64987e-01 7.43879e+01 79.915  8.58077e-01  4.82449e+00  0.00000e+00 0.00000e+00 1.07584e+02 79.915  3.31961e+01 79.915  0.8910 
1 1 1 -6  83  3  f 0  9.82931e+00 6.30832e-01 2.04381e+02 346.651 2.64197e+01  -6.26937e+00 0.00000e+00 0.00000e+00 1.55307e+02 346.651 4.90742e+01 166.651 0.9814 
1 1 1 -6  83  4  o 10 8.05860e+00 6.11696e-01 7.75761e+01 253.744 -2.43341e+00 -8.34567e+00 0.00000e+00 0.00000e+00 2.04922e+02 253.744 1.27346e+02 253.744 0.9406 
1 1 1 -6  83  5  o 13 3.49093e+00 7.69882e-01 2.77942e+01 139.080 -9.53891e-01 8.26865e-01  0.00000e+00 0.00000e+00 4.13445e+01 139.080 1.35503e+01 139.080 0.5317 
1 1 1 -6  83  6  o 5  3.20546e+00 8.03361e-01 6.48384e+01 87.154  1.39003e-01  2.79607e+00  0.00000e+00 0.00000e+00 2.99137e+01 87.154  3.49246e+01 267.154 0.7940 
1 1 1 -6  83  7  o 17 6.50244e+00 6.74381e-01 8.92790e+01 95.353  -8.55388e-01 9.12863e+00  0.00000e+00 0.00000e+00 1.39043e+02 95.353  4.97645e+01 95.353  0.9438 
1 1 1 -6  83  8  o 9  3.51907e+00 8.19857e-01 4.53100e+01 94.634  -1.92798e-01 2.37848e+00  0.00000e+00 0.00000e+00 5.30833e+01 94.634  7.77332e+00 94.634  0.7520 
1 1 1 -6  83  9  o 18 8.95500e+00 6.33093e-01 1.38603e+02 23.985  1.98730e+01  8.84188e+00  0.00000e+00 0.00000e+00 1.86342e+02 23.985  4.77387e+01 23.985  0.9767 
1 1 1 -6  83  10 o 11 1.13225e+01 6.25509e-01 1.96790e+02 283.758 1.02725e+01  -4.19535e+01 0.00000e+00 0.00000e+00 2.18609e+02 283.758 2.18189e+01 283.758 0.9884 
1 1 1 -6  83  11 o 13 3.49901e+00 9.81077e-01 3.49495e+01 267.815 -8.09510e-02 -2.12213e+00 0.00000e+00 0.00000e+00 5.81044e+01 267.815 2.31549e+01 267.815 0.7171 
1 1 1 -6  83  12 o 14 6.91833e+00 1.00351e+00 9.05797e+01 16.771  1.14525e+01  3.45133e+00  0.00000e+00 0.00000e+00 1.54800e+02 16.771  6.42199e+01 16.771  0.9572 
1 1 1 -6  83  13 o 10 1.44175e+01 7.72896e-01 2.10603e+02 287.578 2.24399e+01  -7.08316e+01 0.00000e+00 0.00000e+00 3.19458e+02 287.578 1.08855e+02 287.578 0.9932 
1 1 1 -6  83  14 o 11 4.85646e+00 1.19882e+00 1.55679e+02 94.302  -1.14634e+00 1.52397e+01  0.00000e+00 0.00000e+00 1.79135e+01 94.302  1.37766e+02 274.302 0.9667 
1 1 1 -6  84  1  o 2  1.01673e+01 5.23989e-01 1.90768e+02 238.477 -1.41655e+01 -2.30951e+01 0.00000e+00 0.00000e+00 1.81456e+02 238.477 9.31191e+00 58.477  0.9814 
1 1 1 -6  84  2  o 5  1.09241e+01 6.26037e-01 2.85118e+02 306.321 2.49548e+01  -3.39453e+01 0.00000e+00 0.00000e+00 1.17408e+02 306.321 1.67710e+02 126.321 0.9881 
1 1 1 -6  84  3  o 8  5.17115e+00 8.50927e-01 6.49301e+01 133.333 -2.94021e+00 3.11653e+00  0.00000e+00 0.00000e+00 1.03481e+02 133.333 3.85512e+01 133.333 0.8736 
1 1 1 -6  84  4  o 8  2.78602e+00 7.49784e-01 2.41035e+01 272.845 4.60603e-02  -9.26797e-01 0.00000e+00 0.00000e+00 1.95252e+01 272.845 4.57829e+00 92.845  0.4203 
1 1 1 -6  84  5  o 12 9.39471e+00 5.86492e-01 1.70068e+02 76.035  5.87375e+00  2.36198e+01  0.00000e+00 0.00000e+00 1.72543e+02 76.035  2.47460e+00 76.035  0.9792 
1 1 1 -6  84  6  o 12 9.30806e+00 6.33941e-01 1.21042e+02 240.155 -8.96859e+00 -1.56317e+01 0.00000e+00 0.00000e+00 2.15653e+02 240.155 9.46112e+01 240.155 0.9718 
1 1 1 -6  84  7  o 10 5.37882e+00 7.38973e-01 1.22515e+02 301.402 5.50689e+00  -9.02101e+00 0.00000e+00 0.00000e+00 6.78439e+01 301.402 5.46714e+01 121.402 0.9514 
1 1 1 -6  84  8  o 15 6.43962e+00 7.09295e-01 1.16064e+02 40.442  9.26608e+00  7.89786e+00  0.00000e+00 0.00000e+00 1.13249e+02 40.442  2.81486e+00 220.442 0.9580 
1 1 1 -6  84  9  o 3  5.47646e+00 8.43378e-01 4.55794e+01 15.620  4.34235e+00  1.21404e+00  0.00000e+00 0.00000e+00 1.33540e+02 15.620  8.79604e+01 15.620  0.8806 
1 1 1 -6  84  10 o 9  1.32793e+01 6.12935e-01 2.42758e+02 324.138 4.89245e+01  -3.53655e+01 0.00000e+00 0.00000e+00 2.45961e+02 324.138 3.20324e+00 324.138 0.9917 
1 1 1 -6  84  11 o 15 7.75985e+00 8.59518e-01 1.13400e+02 160.548 -1.61182e+01 5.69257e+00  0.00000e+00 0.00000e+00 1.65779e+02 160.548 5.23797e+01 160.548 0.9703 
1 1 1 -6  84  12 o 10 2.93330e+00 9.34806e-01 5.07349e+01 347.171 2.87404e+00  -6.54488e-01 0.00000e+00 0.00000e+00 3.68497e+01 347.171 1.38851e+01 167.171 0.8060 
1 1 1 -6  84  13 o 9  4.49254e+00 1.16916e+00 6.17141e+01 89.801  1.84564e-02  5.30206e+00  0.00000e+00 0.00000e+00 8.79055e+01 89.801  2.61913e+01 89.801  0.8999 
1 1 1 -6  84  14 o 4  2.50878e+00 8.56709e-01 1.03489e+02 126.364 -4.46495e+00 6.06414e+00  0.00000e+00 0.00000e+00 1.71436e+01 306.364 1.20632e+02 306.364 0.9310 
1 1 1 -6  85  1  o 9  1.29564e+01 5.01254e-01 1.70790e+02 271.290 7.17358e-01  -3.18492e+01 0.00000e+00 0.00000e+00 3.04793e+02 271.290 1.34003e+02 271.290 0.9842 
1 1 1 -6  85  2  o 14 8.51446e+00 7.20822e-01 1.83996e+02 244.766 -8.95089e+00 -1.89920e+01 0.00000e+00 0.00000e+00 1.25803e+02 244.766 5.81926e+01 64.766  0.9759 
1 1 1 -6  85  3  o 10 3.63768e+00 9.09692e-01 5.64849e+01 154.474 -2.39976e+00 1.14595e+00  0.00000e+00 0.00000e+00 4.94352e+01 154.474 7.04967e+00 334.474 0.7813 
1 1 1 -6  85  4  o 17 9.51853e+00 6.64881e-01 1.81360e+02 6.360   2.40048e+01  2.67575e+00  0.00000e+00 0.00000e+00 1.65809e+02 6.360   1.55508e+01 186.360 0.9791 
1 1 1 -6  85  5  o 6  3.84074e+00 8.15025e-01 1.34087e+02 10.420  6.78912e+00  1.24843e+00  0.00000e+00 0.00000e+00 1.89112e+00 190.420 1.35979e+02 190.420 0.9244 
1 1 1 -6  85  6  o 10 5.61835e+00 8.07797e-01 1.07432e+02 324.607 7.30420e+00  -5.18950e+00 0.00000e+00 0.00000e+00 8.95985e+01 324.607 1.78340e+01 144.607 0.9424 
1 1 1 -6  85  7  o 14 2.51092e+00 7.28194e-01 6.18356e+01 5.788   2.61328e+00  2.64916e-01  0.00000e+00 0.00000e+00 1.08202e+01 5.788   5.10154e+01 185.788 0.7781 
1 1 1 -6  85  8  f 0  7.89665e+00 7.75132e-01 1.38863e+02 117.563 -8.65880e+00 1.65885e+01  0.00000e+00 0.00000e+00 1.46639e+02 117.563 7.77557e+00 117.563 0.9729 
1 1 1 -6  85  9  o 6  1.45324e+01 5.82293e-01 2.55734e+02 331.934 6.46958e+01  -3.44953e+01 0.00000e+00 0.00000e+00 2.80211e+02 331.934 2.44763e+01 331.934 0.9932 
1 1 1 -6  85  10 o 19 4.50679e+00 9.77145e-01 1.15815e+02 197.798 -8.30755e+00 -2.66701e+00 0.00000e+00 0.00000e+00 4.15046e+01 197.798 7.43102e+01 17.798  0.9408 
1 1 1 -6  85  11 o 10 4.56764e+00 1.05715e+00 5.04741e+01 318.121 3.12537e+00  -2.80216e+00 0.00000e+00 0.00000e+00 9.69580e+01 318.121 4.64839e+01 318.121 0.8707 
1 1 1 -6  85  12 o 7  5.21766e+00 1.10529e+00 1.21914e+02 161.164 -1.10970e+01 3.78551e+00  0.00000e+00 0.00000e+00 6.28902e+01 161.164 5.90234e+01 341.164 0.9564 
1 1 1 -6  85  13 o 18 3.25360e+00 1.00001e+00 5.42478e+01 164.039 -3.69063e+00 1.05557e+00  0.00000e+00 0.00000e+00 4.89171e+01 164.039 5.33064e+00 344.039 0.8570 
1 1 1 -6  85  14 o 9  5.12108e+00 1.28985e+00 1.40349e+02 2.290   1.36602e+01  5.46167e-01  0.00000e+00 0.00000e+00 4.18603e+01 2.290   9.84882e+01 182.290 0.9627 
1 1 1 -6  86  1  o 16 4.20215e+00 7.52521e-01 8.54319e+01 345.958 4.81487e+00  -1.20423e+00 0.00000e+00 0.00000e+00 5.44162e+01 345.958 3.10157e+01 165.958 0.8925 
1 1 1 -6  86  2  o 2  2.52671e+00 7.27578e-01 5.92740e+01 345.429 2.02016e+00  -5.25127e-01 0.00000e+00 0.00000e+00 7.74749e+00 345.429 5.15265e+01 165.429 0.7116 
1 1 1 -6  86  3  o 6  4.54844e+00 1.02584e+00 3.16491e+01 212.373 -1.46866e+00 -9.31079e-01 0.00000e+00 0.00000e+00 7.84937e+01 212.373 4.68446e+01 212.373 0.6499 
1 1 1 -6  86  4  o 8  3.27474e+00 8.75068e-01 7.28061e+01 351.587 3.13586e+00  -4.63795e-01 0.00000e+00 0.00000e+00 2.74241e+01 351.587 4.53820e+01 171.587 0.8218 
1 1 1 -6  86  5  o 4  6.85391e+00 6.99080e-01 1.54663e+02 201.832 -1.53395e+01 -6.14534e+00 0.00000e+00 0.00000e+00 9.26252e+01 201.832 6.20380e+01 21.832  0.9693 
1 1 1 -6  86  6  o 3  7.02353e+00 6.96309e-01 1.41508e+02 33.521  1.29594e+01  8.58464e+00  0.00000e+00 0.00000e+00 1.11238e+02 33.521  3.02705e+01 213.521 0.9673 
1 1 1 -6  86  7  o 5  5.78738e+00 7.47541e-01 1.18295e+02 170.324 -1.15489e+01 1.96910e+00  0.00000e+00 0.00000e+00 8.74765e+01 170.324 3.08183e+01 350.324 0.9563 
1 1 1 -6  86  8  o 7  1.25925e+01 5.70220e-01 1.86610e+02 328.522 3.60153e+01  -2.20516e+01 0.00000e+00 0.00000e+00 2.75667e+02 328.522 8.90568e+01 328.522 0.9881 
1 1 1 -6  86  9  o 13 1.70030e+01 5.75316e-01 2.58175e+02 140.037 -6.78365e+01 5.68464e+01  0.00000e+00 0.00000e+00 3.69481e+02 140.037 1.11306e+02 140.037 0.9943 
1 1 1 -6  86  10 f 0  5.99924e+00 9.18669e-01 5.68651e+01 292.864 2.36020e+00  -5.59709e+00 0.00000e+00 0.00000e+00 1.46423e+02 292.864 8.95580e+01 292.864 0.9135 
1 1 1 -6  86  11 o 16 6.79781e+00 9.26185e-01 1.17314e+02 265.407 -1.20214e+00 -1.49636e+01 0.00000e+00 0.00000e+00 1.26082e+02 265.407 8.76812e+00 265.407 0.9661 
1 1 1 -6  86  12 o 9  5.29823e+00 1.13381e+00 1.20008e+02 62.919  5.62220e+00  1.09956e+01  0.00000e+00 0.00000e+00 6.80490e+01 62.919  5.19591e+01 242.919 0.9586 
1 1 1 -6  86  13 o 5  3.45485e+00 1.04793e+00 6.02790e+01 327.320 3.83613e+00  -2.46083e+00 0.00000e+00 0.00000e+00 5.24342e+01 327.320 7.84481e+00 147.320 0.8820 
1 1 1 -6  86  14 o 14 3.23264e+00 1.03095e+00 7.12122e+01 10.117  5.71129e+00  1.01905e+00  0.00000e+00 0.00000e+00 3.73833e+01 10.117  3.38290e+01 190.117 0.9092 
1 1 1 -6  87  1  o 3  4.41895e+00 7.60230e-01 6.96664e+01 31.962  3.53577e+00  2.20618e+00  0.00000e+00 0.00000e+00 7.35977e+01 31.962  3.93122e+00 31.962  0.8697 
1 1 1 -6  87  2  o 13 1.14515e+01 5.11394e-01 2.26216e+02 219.575 -2.93139e+01 -2.42292e+01 0.00000e+00 0.00000e+00 1.94891e+02 219.575 3.13248e+01 39.575  0.9868 
1 1 1 -6  87  3  o 17 4.90430e+00 1.09740e+00 5.57491e+01 245.218 -1.37518e+00 -2.97857e+00 0.00000e+00 0.00000e+00 9.56627e+01 245.218 3.99135e+01 245.218 0.8288 
1 1 1 -6  87  4  o 4  2.63118e+00 7.83283e-01 7.43934e+00 215.443 -2.46076e-01 -1.75154e-01 0.00000e+00 0.00000e+00 7.19046e+00 215.443 2.48881e-01 35.443  0.1493 
1 1 1 -6  87  5  o 17 8.94564e+00 6.50338e-01 1.49014e+02 356.404 2.10784e+01  -1.32481e+00 0.00000e+00 0.00000e+00 1.75923e+02 356.404 2.69091e+01 356.404 0.9760 
1 1 1 -6  87  6  o 12 7.72698e+00 6.74625e-01 8.75848e+01 241.258 -4.97920e+00 -9.07885e+00 0.00000e+00 0.00000e+00 1.85562e+02 241.258 9.79768e+01 241.258 0.9504 
1 1 1 -6  87  7  o 10 7.36007e+00 7.57566e-01 1.80558e+02 330.219 1.99504e+01  -1.14170e+01 0.00000e+00 0.00000e+00 8.69996e+01 330.219 9.35586e+01 150.219 0.9780 
1 1 1 -6  87  8  o 19 8.22036e+00 6.60589e-01 1.47434e+02 186.223 -2.39750e+01 -2.61424e+00 0.00000e+00 0.00000e+00 1.51507e+02 186.223 4.07240e+00 186.223 0.9790 
1 1 1 -6  87  9  o 2  1.07622e+01 6.20239e-01 1.23339e+02 36.304  2.20766e+01  1.62190e+01  0.00000e+00 0.00000e+00 2.68753e+02 36.304  1.45414e+02 36.304  0.9816 
1 1 1 -6  87  10 o 15 7.64852e+00 8.39493e-01 1.22785e+02 298.849 8.99731e+00  -1.63332e+01 0.00000e+00 0.00000e+00 1.53151e+02 298.849 3.03660e+01 298.849 0.9728 
1 1 1 -6  87  11 o 5  4.97691e+00 1.12789e+00 1.13169e+02 340.337 9.20350e+00  -3.28858e+00 0.00000e+00 0.00000e+00 6.15344e+01 340.337 5.16342e+01 160.337 0.9474 
1 1 1 -6  87  12 f 0  3.59661e+00 1.04754e+00 1.85715e+01 7.990   1.42849e+00  2.00517e-01  0.00000e+00 0.00000e+00 5.88609e+01 7.990   4.02894e+01 7.990   0.5816 
1 1 1 -6  87  13 o 2  2.67853e+00 8.89851e-01 4.44517e+01 149.223 -2.79225e+00 1.66297e+00  0.00000e+00 0.00000e+00 3.74550e+01 149.223 6.99673e+00 329.223 0.8269 
1 1 1 -6  87  14 o 10 3.28432e+00 1.04476e+00 6.36305e+01 327.885 4.74763e+00  -2.97990e+00 0.00000e+00 0.00000e+00 4.62617e+01 327.885 1.73688e+01 147.885 0.9058 
1 1 1 -6  88  1  f 0  7.50864e+00 6.10891e-01 9.09308e+01 343.402 9.65122e+00  -2.87672e+00 0.00000e+00 0.00000e+00 1.74636e+02 343.402 8.37055e+01 343.402 0.9490 
1 1 1 -6  88  2  o 17 3.47369e+00 7.03761e-01 1.11505e+02 254.487 -1.47607e+00 -5.31770e+00 0.00000e+00 0.00000e+00 5.51403e+00 254.487 1.05991e+02 74.487  0.9042 
1 1 1 -6  88  3  o 1  4.36887e+00 8.67434e-01 1.00889e+02 285.518 1.75052e+00  -6.30454e+00 0.00000e+00 0.00000e+00 4.88112e+01 285.518 5.20778e+01 105.518 0.9200 
1 1 1 -6  88  4  o 19 1.19593e+01 6.42932e-01 1.89801e+02 173.058 -3.61207e+01 4.39796e+00  0.00000e+00 0.00000e+00 2.49233e+02 173.058 5.94323e+01 173.058 0.9862 
1 1 1 -6  88  5  o 8  5.56547e+00 9.25095e-01 8.98155e+01 127.661 -4.30862e+00 5.58248e+00  0.00000e+00 0.00000e+00 1.01956e+02 127.661 1.21401e+01 127.661 0.9261 
1 1 1 -6  88  6  o 12 8.26953e+00 6.79346e-01 1.55226e+02 6.447   2.02691e+01  2.29035e+00  0.00000e+00 0.00000e+00 1.44643e+02 6.447   1.05831e+01 186.447 0.9752 
1 1 1 -6  88  7  o 4  9.01939e+00 6.93169e-01 1.41917e+02 253.198 -6.71962e+00 -2.22537e+01 0.00000e+00 0.00000e+00 1.85966e+02 253.198 4.40488e+01 253.198 0.9782 
1 1 1 -6  88  8  o 8  5.96321e+00 8.18828e-01 1.02637e+02 242.060 -5.04438e+00 -9.51124e+00 0.00000e+00 0.00000e+00 1.08260e+02 242.060 5.62338e+00 242.060 0.9524 
1 1 1 -6  88  9  o 10 1.11689e+01 6.36745e-01 1.82692e+02 107.567 -1.21511e+01 3.83825e+01  0.00000e+00 0.00000e+00 2.26575e+02 107.567 4.38826e+01 107.567 0.9875 
1 1 1 -6  88  10 o 2  4.09815e+00 9.89347e-01 5.06740e+01 80.335  6.36536e-01  3.73758e+00  0.00000e+00 0.00000e+00 7.92385e+01 80.335  2.85646e+01 80.335  0.8550 
1 1 1 -6  88  11 o 18 7.55061e+00 9.42637e-01 1.60577e+02 213.509 -1.99246e+01 -1.31921e+01 0.00000e+00 0.00000e+00 1.13210e+02 213.509 4.73669e+01 33.509  0.9788 
1 1 1 -6  88  12 o 5  2.60812e+00 8.52874e-01 7.87886e+01 50.355  3.27767e+00  3.95571e+00  0.00000e+00 0.00000e+00 7.74202e+00 50.355  7.10466e+01 230.355 0.8965 
1 1 1 -6  88  13 o 8  4.50616e+00 1.18531e+00 4.83479e+01 176.813 -4.44912e+00 2.47732e-01  0.00000e+00 0.00000e+00 9.80980e+01 176.813 4.97501e+01 176.813 0.8790 
1 1 1 -6  88  14 o 16 2.99364e+00 9.84922e-01 8.98673e+01 254.015 -2.16112e+00 -7.54414e+00 0.00000e+00 0.00000e+00 1.33894e+01 254.015 7.64778e+01 74.015  0.9339 
1 1 1 -6  89  1  o 5  7.81153e+00 5.87453e-01 1.39221e+02 116.734 -8.18969e+00 1.62595e+01  0.00000e+00 0.00000e+00 1.43733e+02 116.734 4.51205e+00 116.734 0.9721 
1 1 1 -6  89  2  o 19 4.25959e+00 7.92590e-01 1.07764e+02 329.786 5.95241e+00  -3.46631e+00 0.00000e+00 0.00000e+00 3.88829e+01 329.786 6.88808e+01 149.786 0.9243 
1 1 1 -6  89  3  o 19 5.44456e+00 7.86143e-01 1.11777e+02 107.219 -2.72326e+00 8.78732e+00  0.00000e+00 0.00000e+00 7.95879e+01 107.219 3.21887e+01 287.219 0.9440 
1 1 1 -6  89  4  o 6  7.27421e+00 7.78771e-01 1.45993e+02 353.724 1.59399e+01  -1.75291e+00 0.00000e+00 0.00000e+00 1.16148e+02 353.724 2.98446e+01 173.724 0.9683 
1 1 1 -6  89  5  o 6  1.05058e+01 7.68889e-01 1.72268e+02 88.333  8.74453e-01  3.00421e+01  0.00000e+00 0.00000e+00 2.11966e+02 88.333  3.96983e+01 88.333  0.9832 
1 1 1 -6  89  6  o 14 9.48216e+00 6.46333e-01 1.35371e+02 223.631 -1.55264e+01 -1.48015e+01 0.00000e+00 0.00000e+00 2.08821e+02 223.631 7.34499e+01 223.631 0.9764 
1 1 1 -6  89  7  o 5  3.23139e+00 8.87447e-01 6.90151e+01 57.659  2.01242e+00  3.17831e+00  0.00000e+00 0.00000e+00 3.34744e+01 57.659  3.55407e+01 237.659 0.8537 
1 1 1 -6  89  8  o 8  7.28988e+00 8.23733e-01 1.57887e+02 123.757 -1.14074e+01 1.70681e+01  0.00000e+00 0.00000e+00 1.06084e+02 123.757 5.18036e+01 303.757 0.9753 
1 1 1 -6  89  9  o 10 3.07429e+00 8.78791e-01 8.11694e+01 86.470  2.75977e-01  4.47411e+00  0.00000e+00 0.00000e+00 1.91742e+01 86.470  6.19952e+01 266.470 0.8798 
1 1 1 -6  89  10 o 15 6.17078e+00 9.43751e-01 9.58564e+01 313.973 7.71210e+00  -7.99357e+00 0.00000e+00 0.00000e+00 1.22327e+02 313.973 2.64705e+01 313.973 0.9539 
1 1 1 -6  89  11 o 19 3.74492e+00 1.02332e+00 6.80981e+01 337.945 4.63334e+00  -1.87717e+00 0.00000e+00 0.00000e+00 5.58050e+01 337.945 1.22931e+01 157.945 0.8934 
1 1 1 -6  89  12 o 9  5.43937e+00 1.16164e+00 1.19178e+02 291.235 4.61337e+00  -1.18721e+01 0.00000e+00 0.00000e+00 7.40088e+01 291.235 4.51695e+01 111.236 0.9599 
1 1 1 -6  89  13 o 12 3.96322e+00 1.11418e+00 5.48483e+01 167.902 -4.84376e+00 1.03822e+00  0.00000e+00 0.00000e+00 7.58659e+01 167.902 2.10176e+01 167.902 0.8923 
1 1 1 -6  90  1  o 10 1.15584e+01 5.34282e-01 1.10354e+02 124.829 -1.21611e+01 1.74785e+01  0.00000e+00 0.00000e+00 3.09981e+02 124.829 1.99627e+02 124.829 0.9762 
1 1 1 -6  90  2  o 8  4.54278e+00 7.96680e-01 7.39869e+01 119.546 -2.47541e+00 4.36716e+00  0.00000e+00 0.00000e+00 7.72248e+01 119.546 3.23786e+00 119.546 0.8938 
1 1 1 -6  90  3  o 9  9.99174e+00 5.63525e-01 1.97069e+02 81.017  5.05560e+00  3.19825e+01  0.00000e+00 0.00000e+00 1.69081e+02 81.017  2.79883e+01 261.017 0.9844 
1 1 1 -6  90  4  o 10 6.32306e+00 7.31254e-01 1.32456e+02 203.516 -1.15069e+01 -5.00715e+00 0.00000e+00 0.00000e+00 9.32328e+01 203.516 3.92234e+01 23.516  0.9593 
1 1 1 -6  90  5  o 13 6.44719e+00 1.01410e+00 8.05859e+01 192.576 -7.55132e+00 -1.68466e+00 0.00000e+00 0.00000e+00 1.43097e+02 192.576 6.25109e+01 192.576 0.9329 
1 1 1 -6  90  6  o 11 6.48962e+00 9.25217e-01 1.20456e+02 99.038  -1.93691e+00 1.21773e+01  0.00000e+00 0.00000e+00 1.10746e+02 99.038  9.71037e+00 279.038 0.9586 
1 1 1 -6  90  7  o 18 2.98248e+00 8.60999e-01 5.34042e+01 96.313  -2.94948e-01 2.66588e+00  0.00000e+00 0.00000e+00 3.33844e+01 96.313  2.00198e+01 276.313 0.7834 
1 1 1 -6  90  8  o 11 1.16399e+01 6.71241e-01 2.11081e+02 206.715 -4.41594e+01 -2.22244e+01 0.00000e+00 0.00000e+00 2.16570e+02 206.715 5.48903e+00 206.715 0.9898 
1 1 1 -6  90  9  o 13 1.03573e+01 6.69774e-01 1.86643e+02 13.059  3.91948e+01  9.09141e+00  0.00000e+00 0.00000e+00 1.92694e+02 13.059  6.05139e+00 13.059  0.9875 
1 1 1 -6  90  10 o 17 3.04553e+00 9.12778e-01 5.66013e+01 279.861 6.02667e-01  -3.46702e+00 0.00000e+00 0.00000e+00 3.84396e+01 279.861 1.81617e+01 99.861  0.8421 
1 1 1 -6  90  11 o 4  3.05058e+00 9.37984e-01 2.33133e+01 180.705 -1.61712e+00 -1.98918e-02 0.00000e+00 0.00000e+00 4.71459e+01 180.705 2.38327e+01 180.705 0.6238 
1 1 1 -6  90  12 o 18 5.37120e+00 1.10718e+00 8.69287e+01 48.029  6.34199e+00  7.05068e+00  0.00000e+00 0.00000e+00 1.00970e+02 48.029  1.40409e+01 48.029  0.9457 
1 1 1 -6  90  13 o 18 3.81752e+00 1.10714e+00 7.31869e+01 172.824 -6.22714e+00 7.84068e-01  0.00000e+00 0.00000e+00 5.60978e+01 172.824 1.70891e+01 352.824 0.9164 
1 1 1 -6  91  1  o 1  6.58475e+00 6.44879e-01 1.25058e+02 351.569 1.30149e+01  -1.92918e+00 0.00000e+00 0.00000e+00 1.10663e+02 351.569 1.43944e+01 171.569 0.9612 
1 1 1 -6  91  2  o 9  5.02250e+00 7.64031e-01 7.39915e+01 272.556 2.52266e-01  -5.65125e+00 0.00000e+00 0.00000e+00 9.55460e+01 272.556 2.15545e+01 272.556 0.9067 
1 1 1 -6  91  3  o 12 2.91646e+00 7.65051e-01 6.32432e+01 45.085  2.06241e+00  2.06853e+00  0.00000e+00 0.00000e+00 2.40178e+01 45.085  3.92254e+01 225.085 0.8040 
1 1 1 -6  91  4  o 11 1.30911e+01 5.13249e-01 2.65503e+02 271.654 1.69655e+00  -5.87376e+01 0.00000e+00 0.00000e+00 2.17305e+02 271.654 4.81988e+01 91.654  0.9915 
1 1 1 -6  91  5  o 15 5.14084e+00 1.06833e+00 5.67288e+01 11.574  4.17959e+00  8.55945e-01  0.00000e+00 0.00000e+00 1.10137e+02 11.574  5.34081e+01 11.574  0.8730 
1 1 1 -6  91  6  o 11 1.17072e+01 7.12112e-01 2.03640e+02 79.710  7.88202e+00  4.34147e+01  0.00000e+00 0.00000e+00 2.26416e+02 79.710  2.27756e+01 79.710  0.9886 
1 1 1 -6  91  7  o 12 2.34744e+00 7.60489e-01 7.12687e+01 283.340 6.48209e-01  -2.73360e+00 0.00000e+00 0.00000e+00 1.98223e+00 103.340 7.32509e+01 103.340 0.7948 
1 1 1 -6  91  8  o 13 5.65995e+00 9.54999e-01 9.74385e+01 72.830  2.70825e+00  8.76494e+00  0.00000e+00 0.00000e+00 1.00790e+02 72.830  3.35196e+00 72.830  0.9438 
1 1 1 -6  91  9  o 11 4.46890e+00 1.00887e+00 4.19849e+01 170.431 -3.33670e+00 5.62514e-01  0.00000e+00 0.00000e+00 9.63457e+01 170.431 5.43609e+01 170.431 0.8348 
1 1 1 -6  91  10 o 8  5.22993e+00 8.61248e-01 1.29109e+02 202.859 -1.30879e+01 -5.51757e+00 0.00000e+00 0.00000e+00 5.77058e+01 202.859 7.14033e+01 22.859  0.9641 
1 1 1 -6  91  11 o 8  8.48592e+00 8.56405e-01 1.32289e+02 12.254  2.77182e+01  6.02004e+00  0.00000e+00 0.00000e+00 1.76243e+02 12.254  4.39549e+01 12.254  0.9822 
1 1 1 -6  91  12 o 18 6.96025e+00 1.03436e+00 1.59263e+02 220.849 -2.05757e+01 -1.77910e+01 0.00000e+00 0.00000e+00 9.33618e+01 220.849 6.59013e+01 40.849  0.9814 
1 1 1 -6  91  13 o 18 4.18110e+00 1.17132e+00 5.39746e+01 228.263 -3.30706e+00 -3.70695e+00 0.00000e+00 0.00000e+00 8.39085e+01 228.263 2.99339e+01 228.263 0.8926 
1 1 1 -6  92  1  o 1  2.80257e+00 7.79550e-01 7.54448e+00 46.901  2.27450e-01  2.43069e-01  0.00000e+00 0.00000e+00 9.58764e+00 46.901  2.04315e+00 46.901  0.1642 
1 1 1 -6  92  2  o 15 5.73706e+00 8.49221e-01 8.66515e+01 68.778  2.56155e+00  6.59648e+00  0.00000e+00 0.00000e+00 1.11165e+02 68.778  2.45132e+01 68.778  0.9264 
1 1 1 -6  92  3  o 7  3.29368e+00 7.67778e-01 4.45521e+01 269.545 -1.78919e-02 -2.25116e+00 0.00000e+00 0.00000e+00 4.55190e+01 269.545 9.66913e-01 269.545 0.7350 
1 1 1 -6  92  4  o 3  6.98297e+00 6.31912e-01 1.15474e+02 84.204  1.37051e+00  1.35007e+01  0.00000e+00 0.00000e+00 1.34457e+02 84.204  1.89825e+01 84.204  0.9624 
1 1 1 -6  92  5  o 5  3.40436e+00 9.72960e-01 3.96112e+01 190.335 -2.08159e+00 -3.79600e-01 0.00000e+00 0.00000e+00 5.09812e+01 190.335 1.13700e+01 190.335 0.7159 
1 1 1 -6  92  6  f 0  5.26812e+00 1.02025e+00 5.14395e+01 95.133  -3.73507e-01 4.15774e+00  0.00000e+00 0.00000e+00 1.18804e+02 95.133  6.73650e+01 95.133  0.8699 
1 1 1 -6  92  7  o 8  3.13109e+00 8.95108e-01 5.75776e+01 222.684 -2.23724e+00 -2.06330e+00 0.00000e+00 0.00000e+00 3.69430e+01 222.684 2.06346e+01 42.684  0.8131 
1 1 1 -6  92  8  o 8  9.47694e+00 7.90060e-01 1.69239e+02 133.205 -2.10950e+01 2.24601e+01  0.00000e+00 0.00000e+00 1.76591e+02 133.205 7.35149e+00 133.205 0.9836 
1 1 1 -6  92  9  o 2  4.31501e+00 1.05212e+00 6.93971e+01 299.668 2.59049e+00  -4.54741e+00 0.00000e+00 0.00000e+00 7.43317e+01 299.668 4.93466e+00 299.668 0.8985 
1 1 1 -6  92  10 o 3  8.93089e+00 8.12818e-01 1.00719e+02 122.523 -1.03706e+01 1.62641e+01  0.00000e+00 0.00000e+00 2.21390e+02 122.523 1.20671e+02 122.523 0.9737 
1 1 1 -6  92  11 o 19 2.82702e+00 9.03364e-01 3.26595e+01 234.777 -1.27836e+00 -1.81066e+00 0.00000e+00 0.00000e+00 4.37451e+01 234.777 1.10855e+01 234.777 0.7303 
1 1 1 -6  92  12 o 19 2.75165e+00 9.08225e-01 4.43029e+01 147.456 -2.63362e+00 1.68068e+00  0.00000e+00 0.00000e+00 3.89942e+01 147.456 5.30875e+00 327.455 0.8188 
1 1 1 -6  92  13 o 11 3.37171e+00 1.04798e+00 3.63917e+01 83.139  3.91424e-01  3.25318e+00  0.00000e+00 0.00000e+00 6.67886e+01 83.139  3.03969e+01 83.139  0.8285 
1 1 1 -6  93  1  o 1  8.58728e+00 6.04911e-01 1.30617e+02 190.829 -1.96414e+01 -3.75704e+00 0.00000e+00 0.00000e+00 1.80936e+02 190.829 5.03186e+01 190.829 0.9747 
1 1 1 -6  93  2  o 3  8.41209e+00 6.06306e-01 1.20977e+02 113.397 -6.60960e+00 1.52760e+01  0.00000e+00 0.00000e+00 1.82494e+02 113.397 6.15163e+01 113.397 0.9695 
1 1 1 -6  93  3  f 0  8.28207e+00 5.94391e-01 1.20059e+02 282.327 3.62636e+00  -1.65939e+01 0.00000e+00 0.00000e+00 1.78796e+02 282.327 5.87368e+01 282.327 0.9701 
1 1 1 -6  93  4  o 3  1.01317e+01 5.44701e-01 1.71458e+02 162.418 -3.12815e+01 9.91236e+00  0.00000e+00 0.00000e+00 1.99450e+02 162.418 2.79919e+01 162.418 0.9846 
1 1 1 -6  93  5  o 4  7.56339e+00 7.56591e-01 1.38365e+02 303.399 1.04159e+01  -1.57968e+01 0.00000e+00 0.00000e+00 1.35164e+02 303.399 3.20077e+00 123.399 0.9732 
1 1 1 -6  93  6  o 19 5.49729e+00 1.02430e+00 1.78748e+02 349.552 1.41578e+01  -2.61063e+00 0.00000e+00 0.00000e+00 1.81924e+01 349.552 1.60556e+02 169.552 0.9646 
1 1 1 -6  93  7  o 13 1.35163e+01 7.11104e-01 2.11160e+02 173.513 -5.07324e+01 5.76849e+00  0.00000e+00 0.00000e+00 2.85566e+02 173.513 7.44064e+01 173.513 0.9902 
1 1 1 -6  93  8  f 0  1.18210e+01 6.90010e-01 1.85745e+02 23.186  4.37745e+01  1.87494e+01  0.00000e+00 0.00000e+00 2.48060e+02 23.186  6.23148e+01 23.186  0.9894 
1 1 1 -6  93  9  o 4  2.79898e+00 8.88490e-01 1.67117e+01 205.803 -8.74697e-01 -4.22897e-01 0.00000e+00 0.00000e+00 2.85392e+01 205.803 1.18275e+01 205.803 0.4362 
1 1 1 -6  93  10 f 0  6.07566e+00 9.89915e-01 1.14117e+02 132.771 -1.00333e+01 1.08459e+01  0.00000e+00 0.00000e+00 1.03116e+02 132.771 1.10016e+01 312.771 0.9655 
1 1 1 -6  93  11 o 14 3.27140e+00 9.64151e-01 4.05835e+01 259.983 -5.35094e-01 -3.02957e+00 0.00000e+00 0.00000e+00 5.81186e+01 259.983 1.75351e+01 259.983 0.8155 
1 1 1 -6  93  12 o 16 2.95694e+00 9.36372e-01 4.26662e+01 279.252 5.46517e-01  -3.35502e+00 0.00000e+00 0.00000e+00 4.86697e+01 279.252 6.00358e+00 279.252 0.8357 
1 1 1 -6  93  13 o 19 2.32798e+00 8.03217e-01 3.64590e+01 51.558  1.68110e+00  2.11786e+00  0.00000e+00 0.00000e+00 3.10624e+01 51.558  5.39656e+00 231.558 0.7855 
1 1 1 -6  94  1  o 11 3.78905e+00 8.17326e-01 1.07197e+02 112.791 -2.44495e+00 5.81877e+00  0.00000e+00 0.00000e+00 2.20982e+01 112.791 8.50986e+01 292.791 0.9169 
1 1 1 -6  94  2  o 7  3.68804e+00 8.14409e-01 8.07982e+01 86.899  2.50374e-01  4.62159e+00  0.00000e+00 0.00000e+00 4.04861e+01 86.899  4.03120e+01 266.899 0.8840 
1 1 1 -6  94  3  o 16 4.78069e+00 8.04558e-01 5.88522e+01 221.531 -3.54363e+00 -3.13856e+00 0.00000e+00 0.00000e+00 9.88063e+01 221.531 3.99541e+01 221.531 0.8868 
1 1 1 -6  94  4  o 7  3.56077e+00 7.95010e-01 5.64714e+01 357.990 3.27477e+00  -1.14939e-01 0.00000e+00 0.00000e+00 5.31889e+01 357.990 3.28246e+00 177.990 0.8285 
1 1 1 -6  94  5  o 11 6.22373e+00 7.97809e-01 1.12159e+02 67.236  4.70011e+00  1.12011e+01  0.00000e+00 0.00000e+00 1.09327e+02 67.236  2.83217e+00 247.236 0.9579 
1 1 1 -6  94  6  o 19 4.26645e+00 1.03246e+00 5.72240e+01 199.583 -3.58683e+00 -1.27604e+00 0.00000e+00 0.00000e+00 7.83238e+01 199.583 2.10998e+01 199.583 0.8557 
1 1 1 -6  94  7  o 10 4.59415e+00 1.07721e+00 5.66232e+01 307.729 2.53525e+00  -3.27680e+00 0.00000e+00 0.00000e+00 9.14819e+01 307.729 3.48587e+01 307.729 0.8688 
1 1 1 -6  94  8  o 13 5.96909e+00 1.03255e+00 1.18215e+02 119.273 -6.11818e+00 1.09146e+01  0.00000e+00 0.00000e+00 9.40801e+01 119.273 2.41351e+01 299.273 0.9592 
1 1 1 -6  94  9  o 3  9.56804e+00 8.37449e-01 1.22532e+02 318.638 1.88173e+01  -1.65674e+01 0.00000e+00 0.00000e+00 2.24836e+02 318.638 1.02305e+02 318.638 0.9798 
1 1 1 -6  94  10 o 9  4.16085e+00 1.10100e+00 8.55428e+01 98.998  -1.14613e+00 7.23809e+00  0.00000e+00 0.00000e+00 5.75637e+01 98.998  2.79791e+01 278.998 0.9290 
1 1 1 -6  94  11 o 6  3.08624e+00 9.40259e-01 7.23013e+01 129.046 -3.27306e+00 4.03521e+00  0.00000e+00 0.00000e+00 3.01796e+01 129.046 4.21217e+01 309.046 0.8977 
1 1 1 -6  94  12 o 15 4.63989e+00 1.09808e+00 8.97852e+01 323.633 7.60294e+00  -5.59867e+00 0.00000e+00 0.00000e+00 7.23240e+01 323.633 1.74611e+01 143.633 0.9455 
1 1 1 -6  94  13 o 8  4.47401e+00 1.19822e+00 3.82270e+01 189.350 -4.00967e+00 -6.60178e-01 0.00000e+00 0.00000e+00 1.04793e+02 189.350 6.65661e+01 189.350 0.8659 
1 1 1 -6  95  1  o 6  1.02647e+01 5.76958e-01 1.80758e+02 131.046 -2.27512e+01 2.61301e+01  0.00000e+00 0.00000e+00 1.95582e+02 131.046 1.48242e+01 131.046 0.9855 
1 1 1 -6  95  2  o 19 8.59178e+00 6.05656e-01 1.82616e+02 5.889   2.95025e+01  3.04320e+00  0.00000e+00 0.00000e+00 1.31497e+02 5.889   5.11183e+01 185.889 0.9830 
1 1 1 -6  95  3  o 7  3.65948e+00 8.02738e-01 6.02564e+01 100.433 -6.48487e-01 3.52183e+00  0.00000e+00 0.00000e+00 5.47368e+01 100.433 5.51958e+00 280.433 0.8452 
1 1 1 -6  95  4  o 4  8.23185e+00 6.20351e-01 1.87971e+02 128.555 -1.95539e+01 2.45339e+01  0.00000e+00 0.00000e+00 1.13013e+02 128.555 7.49578e+01 308.555 0.9839 
1 1 1 -6  95  5  o 6  6.85865e+00 7.40605e-01 8.97121e+01 290.390 4.00240e+00  -1.07681e+01 0.00000e+00 0.00000e+00 1.53674e+02 290.390 6.39621e+01 290.390 0.9554 
1 1 1 -6  95  6  o 19 4.44562e+00 8.98302e-01 9.06308e+01 237.997 -3.47378e+00 -5.55861e+00 0.00000e+00 0.00000e+00 6.12210e+01 237.997 2.94098e+01 57.997  0.9202 
1 1 1 -6  95  7  o 11 2.79532e+00 8.87220e-01 7.98587e+01 165.705 -3.98600e+00 1.01564e+00  0.00000e+00 0.00000e+00 1.01226e+01 165.705 6.97361e+01 345.705 0.8677 
1 1 1 -6  95  8  o 13 7.11454e+00 1.01334e+00 1.19023e+02 291.040 5.44875e+00  -1.41650e+01 0.00000e+00 0.00000e+00 1.35872e+02 291.040 1.68483e+01 291.040 0.9665 
1 1 1 -6  95  9  o 15 2.45506e+00 7.99367e-01 6.07612e+01 167.654 -3.15363e+00 6.90249e-01  0.00000e+00 0.00000e+00 1.43139e+01 167.654 4.64473e+01 347.654 0.8255 
1 1 1 -6  95  10 o 12 6.67931e+00 1.09177e+00 6.08220e+01 246.167 -3.16288e+00 -7.16012e+00 0.00000e+00 0.00000e+00 1.70011e+02 246.167 1.09189e+02 246.167 0.9337 
1 1 1 -6  95  11 o 12 2.87882e+00 8.90388e-01 1.41958e+01 175.890 -1.11240e+00 7.99350e-02  0.00000e+00 0.00000e+00 3.75143e+01 175.890 2.33185e+01 175.890 0.4857 
1 1 1 -6  95  12 o 19 3.60787e+00 1.06158e+00 1.35244e+01 169.668 -1.17409e+00 2.14037e-01  0.00000e+00 0.00000e+00 5.45522e+01 169.668 4.10278e+01 169.668 0.5107 
1 1 1 -6  96  1  o 16 6.54179e+00 7.11139e-01 4.81147e+01 255.084 -1.37409e+00 -5.15833e+00 0.00000e+00 0.00000e+00 1.71039e+02 255.084 1.22924e+02 255.084 0.9007 
1 1 1 -6  96  2  f 0  7.00259e+00 6.65280e-01 1.61003e+02 337.373 1.96930e+01  -8.20843e+00 0.00000e+00 0.00000e+00 9.31928e+01 337.373 6.78104e+01 157.373 0.9763 
1 1 1 -6  96  3  o 14 3.92489e+00 8.10973e-01 7.69023e+01 333.781 4.97940e+00  -2.45223e+00 0.00000e+00 0.00000e+00 5.50831e+01 333.781 2.18193e+01 153.781 0.9048 
1 1 1 -6  96  4  o 4  5.72892e+00 7.68573e-01 1.04372e+02 217.675 -7.92709e+00 -6.12126e+00 0.00000e+00 0.00000e+00 9.75398e+01 217.675 6.83210e+00 37.675  0.9487 
1 1 1 -6  96  5  o 15 3.79128e+00 8.54154e-01 7.29119e+01 301.350 2.62370e+00  -4.30670e+00 0.00000e+00 0.00000e+00 5.29943e+01 301.350 1.99176e+01 121.350 0.8944 
1 1 1 -6  96  6  o 1  3.36295e+00 8.86983e-01 4.06016e+01 57.307  1.32068e+00  2.05772e+00  0.00000e+00 0.00000e+00 5.41074e+01 57.307  1.35058e+01 57.307  0.7589 
1 1 1 -6  96  7  o 9  6.22649e+00 1.05057e+00 1.06056e+02 232.846 -6.85088e+00 -9.04092e+00 0.00000e+00 0.00000e+00 1.14436e+02 232.846 8.37971e+00 232.846 0.9548 
1 1 1 -6  96  8  o 17 7.83811e+00 9.42510e-01 1.02131e+02 52.686  9.69836e+00  1.27247e+01  0.00000e+00 0.00000e+00 1.79123e+02 52.686  7.69917e+01 52.686  0.9682 
1 1 1 -6  96  9  o 3  4.21541e+00 1.02897e+00 1.02799e+02 296.057 3.93478e+00  -8.04703e+00 0.00000e+00 0.00000e+00 4.43171e+01 296.057 5.84816e+01 116.057 0.9424 
1 1 1 -6  96  10 o 12 4.22686e+00 1.12215e+00 5.65762e+01 106.111 -1.31797e+00 4.56294e+00  0.00000e+00 0.00000e+00 8.21880e+01 106.111 2.56118e+01 106.111 0.8872 
1 1 1 -6  96  11 o 12 4.09406e+00 1.09839e+00 5.97936e+01 3.820   5.40104e+00  3.60603e-01  0.00000e+00 0.00000e+00 7.67515e+01 3.820   1.69579e+01 3.820   0.9022 
1 1 1 -6  96  12 o 4  2.48476e+00 8.38493e-01 1.63296e+01 333.961 1.20958e+00  -5.90972e-01 0.00000e+00 0.00000e+00 3.46739e+01 333.961 1.83443e+01 333.961 0.5558 
1 1 1 -6  97  1  o 5  3.62477e+00 8.67025e-01 6.75846e+01 108.996 -1.42125e+00 4.12858e+00  0.00000e+00 0.00000e+00 5.05249e+01 108.996 1.70597e+01 288.996 0.8763 
1 1 1 -6  97  2  o 4  1.04627e+01 5.72608e-01 1.50854e+02 4.617   3.04350e+01  2.45799e+00  0.00000e+00 0.00000e+00 2.31649e+02 4.617   8.07942e+01 4.617   0.9835 
1 1 1 -6  97  3  o 6  8.57538e+00 6.49063e-01 1.69118e+02 317.437 1.88914e+01  -1.73492e+01 0.00000e+00 0.00000e+00 1.43251e+02 317.437 2.58672e+01 137.437 0.9803 
1 1 1 -6  97  4  o 7  1.07681e+01 5.83269e-01 1.77908e+02 138.378 -2.82837e+01 2.51311e+01  0.00000e+00 0.00000e+00 2.16710e+02 138.378 3.88022e+01 138.378 0.9867 
1 1 1 -6  97  5  o 11 3.69867e+00 8.38337e-01 2.97501e+01 249.837 -6.75156e-01 -1.83865e+00 0.00000e+00 0.00000e+00 6.51078e+01 249.837 3.53577e+01 249.837 0.6909 
1 1 1 -6  97  6  o 3  7.32835e+00 7.29599e-01 1.30290e+02 17.934  1.83383e+01  5.93503e+00  0.00000e+00 0.00000e+00 1.34445e+02 17.934  4.15497e+00 17.934  0.9737 
1 1 1 -6  97  7  o 7  3.38842e+00 9.18156e-01 1.43998e+02 285.967 2.69313e+00  -9.41275e+00 0.00000e+00 0.00000e+00 2.49672e+01 105.967 1.68966e+02 105.967 0.9475 
1 1 1 -6  97  8  o 8  3.95091e+00 1.04472e+00 5.17207e+01 178.313 -3.71380e+00 1.09356e-01  0.00000e+00 0.00000e+00 7.29415e+01 178.313 2.12207e+01 178.313 0.8516 
1 1 1 -6  97  9  o 2  5.62711e+00 1.19105e+00 1.29022e+02 160.508 -1.30645e+01 4.62443e+00  0.00000e+00 0.00000e+00 7.16446e+01 160.508 5.73777e+01 340.508 0.9632 
1 1 1 -6  97  10 o 2  3.86215e+00 1.06814e+00 5.29555e+01 261.100 -6.64329e-01 -4.24225e+00 0.00000e+00 0.00000e+00 7.19041e+01 261.100 1.89486e+01 261.100 0.8739 
1 1 1 -6  97  11 o 17 3.64550e+00 1.02594e+00 3.40761e+01 180.190 -3.07460e+00 -1.02158e-02 0.00000e+00 0.00000e+00 7.57809e+01 180.190 4.17047e+01 180.190 0.8154 
1 1 1 -6  97  12 o 12 3.48783e+00 1.00405e+00 9.04254e+01 49.016  5.43113e+00  6.25138e+00  0.00000e+00 0.00000e+00 3.03146e+01 49.016  6.01107e+01 229.016 0.9375 
1 1 1 -6  98  1  o 11 8.25960e+00 6.74813e-01 1.21671e+02 247.639 -6.69028e+00 -1.62635e+01 0.00000e+00 0.00000e+00 1.76518e+02 247.639 5.48475e+01 247.639 0.9711 
1 1 1 -6  98  2  o 15 9.00038e+00 6.13296e-01 1.14912e+02 103.505 -4.32747e+00 1.80185e+01  0.00000e+00 0.00000e+00 2.10412e+02 103.505 9.55005e+01 103.505 0.9726 
1 1 1 -6  98  3  o 1  8.35225e+00 6.49041e-01 1.16438e+02 204.184 -1.70182e+01 -7.64264e+00 0.00000e+00 0.00000e+00 1.85398e+02 204.184 6.89598e+01 204.184 0.9728 
1 1 1 -6  98  4  f 0  1.31805e+01 5.63756e-01 1.89923e+02 284.098 1.16429e+01  -4.63577e+01 0.00000e+00 0.00000e+00 2.94337e+02 284.098 1.04414e+02 284.098 0.9895 
1 1 1 -6  98  5  o 9  6.08291e+00 7.99917e-01 1.49093e+02 147.082 -1.43051e+01 9.26089e+00  0.00000e+00 0.00000e+00 6.99285e+01 147.082 7.91640e+01 327.082 0.9702 
1 1 1 -6  98  6  o 3  9.21602e+00 6.63198e-01 1.64283e+02 288.426 1.04253e+01  -3.12914e+01 0.00000e+00 0.00000e+00 1.72321e+02 288.426 8.03745e+00 288.426 0.9847 
1 1 1 -6  98  7  o 3  5.25541e+00 8.17990e-01 1.39806e+02 210.404 -1.38047e+01 -8.10058e+00 0.00000e+00 0.00000e+00 4.88079e+01 210.404 9.09981e+01 30.404  0.9682 
1 1 1 -6  98  8  o 6  4.44865e+00 1.01758e+00 4.28459e+01 218.905 -2.91790e+00 -2.35487e+00 0.00000e+00 0.00000e+00 9.77379e+01 218.905 5.48920e+01 218.905 0.8532 
1 1 1 -6  98  9  o 14 3.78862e+00 1.03050e+00 8.52441e+01 120.236 -3.28573e+00 5.63735e+00  0.00000e+00 0.00000e+00 4.37384e+01 120.236 4.15057e+01 300.236 0.9198 
1 1 1 -6  98  10 f 0  3.64498e+00 1.08034e+00 3.09546e+01 29.205  2.31520e+00  1.29419e+00  0.00000e+00 0.00000e+00 7.42701e+01 29.205  4.33154e+01 29.205  0.7806 
1 1 1 -6  98  11 o 10 3.38740e+00 1.03414e+00 7.39137e+01 156.374 -5.97566e+00 2.61395e+00  0.00000e+00 0.00000e+00 4.12085e+01 156.374 3.27052e+01 336.374 0.9198 
1 1 1 -6  98  12 o 17 4.09997e+00 1.08184e+00 1.09501e+02 267.157 -5.98841e-01 -1.20570e+01 0.00000e+00 0.00000e+00 3.54364e+01 267.157 7.40650e+01 87.157  0.9576 
1 1 1 -6  99  1  o 8  2.27990e+00 7.23646e-01 3.81609e+01 250.915 -5.26703e-01 -1.52229e+00 0.00000e+00 0.00000e+00 1.45733e+01 250.915 2.35876e+01 70.915  0.6224 
1 1 1 -6  99  2  o 14 4.24075e+00 8.69732e-01 6.08813e+01 246.120 -1.89018e+00 -4.26945e+00 0.00000e+00 0.00000e+00 7.85703e+01 246.120 1.76890e+01 246.120 0.8851 
1 1 1 -6  99  3  o 14 5.67731e+00 7.91308e-01 8.42808e+01 265.124 -7.00124e-01 -8.20678e+00 0.00000e+00 0.00000e+00 1.13315e+02 265.124 2.90345e+01 265.124 0.9372 
1 1 1 -6  99  4  o 8  7.60773e+00 6.87983e-01 1.29612e+02 54.136  1.15485e+01  1.59748e+01  0.00000e+00 0.00000e+00 1.45535e+02 54.136  1.59233e+01 54.136  0.9743 
1 1 1 -6  99  5  o 6  6.25504e+00 8.29413e-01 1.14408e+02 220.978 -1.08011e+01 -9.38214e+00 0.00000e+00 0.00000e+00 1.09401e+02 220.978 5.00706e+00 40.978  0.9644 
1 1 1 -6  99  6  o 13 2.99139e+00 8.55998e-01 4.02036e+01 306.245 1.41475e+00  -1.92982e+00 0.00000e+00 0.00000e+00 4.33008e+01 306.245 3.09715e+00 306.245 0.7528 
1 1 1 -6  99  7  o 3  9.76423e+00 6.67146e-01 1.40145e+02 208.276 -2.86835e+01 -1.54291e+01 0.00000e+00 0.00000e+00 2.16087e+02 208.276 7.59417e+01 208.276 0.9845 
1 1 1 -6  99  8  o 15 5.11594e+00 1.00886e+00 5.87374e+01 166.876 -6.13716e+00 1.43088e+00  0.00000e+00 0.00000e+00 1.14949e+02 166.876 5.62119e+01 166.876 0.9168 
1 1 1 -6  99  9  o 12 5.98515e+00 1.06194e+00 1.02491e+02 74.200  3.48507e+00  1.23157e+01  0.00000e+00 0.00000e+00 1.10139e+02 74.200  7.64765e+00 74.200  0.9601 
1 1 1 -6  99  10 o 10 3.41499e+00 1.01664e+00 5.08699e+01 320.989 3.14853e+00  -2.55061e+00 0.00000e+00 0.00000e+00 5.84070e+01 320.989 7.53711e+00 320.989 0.8655 
1 1 1 -6  99  11 o 15 2.89376e+00 9.35372e-01 5.04491e+01 158.462 -3.78801e+00 1.49503e+00  0.00000e+00 0.00000e+00 4.21479e+01 158.462 8.30116e+00 338.462 0.8662 
1 1 1 -6  100 1  o 15 5.15412e+00 8.60475e-01 1.02639e+02 140.016 -6.73378e+00 5.64704e+00  0.00000e+00 0.00000e+00 7.76122e+01 140.016 2.50272e+01 320.016 0.9413 
1 1 1 -6  100 2  o 3  7.57678e+00 6.85747e-01 1.44648e+02 83.695  2.32156e+00  2.10101e+01  0.00000e+00 0.00000e+00 1.30033e+02 83.695  1.46146e+01 263.694 0.9761 
1 1 1 -6  100 3  o 18 3.26717e+00 8.61227e-01 4.75706e+01 132.287 -1.90119e+00 2.09034e+00  0.00000e+00 0.00000e+00 4.90128e+01 132.287 1.44214e+00 132.287 0.7962 
1 1 1 -6  100 4  o 18 3.45831e+00 8.82986e-01 5.47770e+01 154.392 -3.15591e+00 1.51260e+00  0.00000e+00 0.00000e+00 5.31688e+01 154.392 1.60821e+00 334.392 0.8411 
1 1 1 -6  100 5  o 2  8.52408e+00 6.61829e-01 1.44655e+02 57.353  1.48655e+01  2.32029e+01  0.00000e+00 0.00000e+00 1.65727e+02 57.353  2.10717e+01 57.353  0.9817 
1 1 1 -6  100 6  o 14 7.15182e+00 7.52369e-01 1.28878e+02 179.178 -2.09447e+01 3.00312e-01  0.00000e+00 0.00000e+00 1.29834e+02 179.178 9.56483e-01 179.178 0.9758 
1 1 1 -6  100 7  o 5  2.25101e+00 7.50962e-01 8.57450e+01 33.124  3.60555e+00  2.35261e+00  0.00000e+00 0.00000e+00 1.28343e+01 213.124 9.85793e+01 213.124 0.8743 
1 1 1 -6  100 8  f 0  3.80652e+00 9.62178e-01 3.84900e+01 165.539 -3.28960e+00 8.48350e-01  0.00000e+00 0.00000e+00 7.92558e+01 165.539 4.07659e+01 165.539 0.8356 
1 1 1 -6  100 9  o 3  4.79260e+00 1.16994e+00 5.61681e+01 17.379  4.95391e+00  1.55050e+00  0.00000e+00 0.00000e+00 1.02973e+02 17.379  4.68046e+01 17.379  0.8976 
1 1 1 -6  100 10 o 15 2.91144e+00 9.42196e-01 3.49513e+01 54.645  1.57764e+00  2.22368e+00  0.00000e+00 0.00000e+00 4.97981e+01 54.645  1.48468e+01 54.645  0.7875 
1 1 1 -6  100 11 f 0  2.17085e+00 7.59168e-01 3.70510e+01 159.191 -2.56564e+00 9.75039e-01  0.00000e+00 0.00000e+00 2.62164e+01 159.191 1.08347e+01 339.191 0.7892 
1 1 1 -6  101 1  o 13 8.86976e+00 6.30578e-01 1.41821e+02 147.927 -2.19318e+01 1.37436e+01  0.00000e+00 0.00000e+00 1.81214e+02 147.927 3.93935e+01 147.927 0.9805 
1 1 1 -6  101 2  o 7  3.29706e+00 8.78116e-01 6.18573e+01 80.588  6.09270e-01  3.67560e+00  0.00000e+00 0.00000e+00 4.24606e+01 80.588  1.93968e+01 260.588 0.8521 
1 1 1 -6  101 3  o 12 1.02323e+01 6.21850e-01 1.58286e+02 351.273 3.41782e+01  -5.24666e+00 0.00000e+00 0.00000e+00 2.15978e+02 351.273 5.76928e+01 351.273 0.9854 
1 1 1 -6  101 4  o 15 5.42565e+00 8.74133e-01 9.99597e+01 139.703 -7.96528e+00 6.75445e+00  0.00000e+00 0.00000e+00 9.14412e+01 139.703 8.51846e+00 319.702 0.9508 
1 1 1 -6  101 5  o 18 3.10858e+00 8.13450e-01 6.49431e+01 226.851 -2.81526e+00 -3.00326e+00 0.00000e+00 0.00000e+00 3.50953e+01 226.851 2.98478e+01 46.851  0.8679 
1 1 1 -6  101 6  o 5  3.49271e+00 9.04595e-01 9.61586e+01 138.706 -5.15551e+00 4.52824e+00  0.00000e+00 0.00000e+00 2.34384e+01 138.706 7.27202e+01 318.706 0.9240 
1 1 1 -6  101 7  o 10 4.43044e+00 9.94767e-01 1.11780e+02 216.920 -8.40353e+00 -6.31407e+00 0.00000e+00 0.00000e+00 4.42950e+01 216.920 6.74855e+01 36.920  0.9512 
1 1 1 -6  101 8  o 9  4.69686e+00 9.21103e-01 4.83551e+01 73.953  1.48554e+00  5.16485e+00  0.00000e+00 0.00000e+00 1.08337e+02 73.953  5.99819e+01 73.953  0.9014 
1 1 1 -6  101 9  f 0  5.07258e+00 1.17465e+00 1.17072e+02 356.406 1.27505e+01  -8.00844e-01 0.00000e+00 0.00000e+00 6.30253e+01 356.406 5.40467e+01 176.406 0.9600 
1 1 1 -6  101 10 o 14 5.14956e+00 1.26276e+00 1.08616e+02 271.262 2.40097e-01  -1.08958e+01 0.00000e+00 0.00000e+00 7.27182e+01 271.262 3.58977e+01 91.262  0.9530 
1 1 1 -6  101 11 o 11 3.24656e+00 1.00491e+00 4.95823e+01 106.164 -1.24322e+00 4.28918e+00  0.00000e+00 0.00000e+00 5.58131e+01 106.164 6.23076e+00 106.164 0.8793 
1 1 1 -6  102 1  o 8  3.12924e+00 8.57167e-01 4.37257e+01 135.094 -1.81859e+00 1.81264e+00  0.00000e+00 0.00000e+00 4.60011e+01 135.094 2.27546e+00 135.094 0.7722 
1 1 1 -6  102 2  o 3  7.20306e+00 7.06563e-01 8.23230e+01 76.075  3.06726e+00  1.23712e+01  0.00000e+00 0.00000e+00 1.74354e+02 76.075  9.20314e+01 76.075  0.9599 
1 1 1 -6  102 3  o 3  2.23228e+00 7.33057e-01 4.95536e+01 99.937  -3.99952e-01 2.28282e+00  0.00000e+00 0.00000e+00 1.20425e+01 99.937  3.75111e+01 279.937 0.7436 
1 1 1 -6  102 4  o 7  2.95589e+00 8.93080e-01 5.63072e+01 352.833 3.20756e+00  -4.03319e-01 0.00000e+00 0.00000e+00 3.42321e+01 352.833 2.20751e+01 172.833 0.8258 
1 1 1 -6  102 5  o 5  3.64806e+00 9.10916e-01 7.02199e+01 53.164  3.11098e+00  4.15315e+00  0.00000e+00 0.00000e+00 5.11685e+01 53.164  1.90514e+01 233.164 0.8976 
1 1 1 -6  102 6  o 3  4.65288e+00 1.00874e+00 7.29266e+01 146.218 -5.58912e+00 3.73905e+00  0.00000e+00 0.00000e+00 8.60702e+01 146.218 1.31436e+01 146.218 0.9223 
1 1 1 -6  102 7  o 6  6.03113e+00 9.16908e-01 1.15791e+02 326.023 1.38818e+01  -9.35536e+00 0.00000e+00 0.00000e+00 1.00743e+02 326.023 1.50479e+01 146.023 0.9697 
1 1 1 -6  102 8  o 18 3.76002e+00 9.06001e-01 5.65002e+01 311.508 3.30163e+00  -3.73072e+00 0.00000e+00 0.00000e+00 6.77296e+01 311.508 1.12294e+01 311.508 0.8930 
1 1 1 -6  102 9  o 10 6.45861e+00 9.81789e-01 1.13313e+02 192.024 -1.75781e+01 -3.74419e+00 0.00000e+00 0.00000e+00 1.18734e+02 192.024 5.42138e+00 192.024 0.9718 
1 1 1 -6  102 10 o 16 4.59250e+00 1.20210e+00 8.89610e+01 263.551 -9.80770e-01 -8.67723e+00 0.00000e+00 0.00000e+00 7.06618e+01 263.551 1.82992e+01 83.551  0.9409 
1 1 1 -6  102 11 o 5  3.37300e+00 1.02161e+00 4.38972e+01 67.040  1.68115e+00  3.96833e+00  0.00000e+00 0.00000e+00 6.49677e+01 67.040  2.10705e+01 67.040  0.8745 
1 1 1 -6  103 1  o 7  2.27921e+00 7.25025e-01 6.31861e+01 19.753  2.92790e+00  1.05140e+00  0.00000e+00 0.00000e+00 6.01602e+00 19.753  5.71700e+01 199.753 0.8179 
1 1 1 -6  103 2  o 18 6.67287e+00 7.68262e-01 1.13078e+02 48.307  1.05479e+01  1.18415e+01  0.00000e+00 0.00000e+00 1.26622e+02 48.307  1.35441e+01 48.307  0.9679 
1 1 1 -6  103 3  o 2  5.09927e+00 8.83462e-01 5.41318e+01 186.147 -5.36287e+00 -5.77585e-01 0.00000e+00 0.00000e+00 1.16455e+02 186.147 6.23232e+01 186.147 0.9018 
1 1 1 -6  103 4  o 17 4.95362e+00 1.00484e+00 9.68710e+01 103.365 -2.12285e+00 8.93527e+00  0.00000e+00 0.00000e+00 7.65001e+01 103.365 2.03709e+01 283.365 0.9439 
1 1 1 -6  103 5  o 19 3.70226e+00 8.75359e-01 7.69408e+01 193.632 -5.64705e+00 -1.36956e+00 0.00000e+00 0.00000e+00 4.78250e+01 193.632 2.91158e+01 13.633  0.9093 
1 1 1 -6  103 6  o 10 1.07212e+01 6.50008e-01 1.64776e+02 96.597  -5.54073e+00 4.79058e+01  0.00000e+00 0.00000e+00 2.28192e+02 96.597  6.34163e+01 96.597  0.9896 
1 1 1 -6  103 7  o 11 3.98835e+00 9.80415e-01 7.54116e+01 275.198 6.14958e-01  -6.75984e+00 0.00000e+00 0.00000e+00 6.08643e+01 275.198 1.45472e+01 95.198  0.9231 
1 1 1 -6  103 8  f 0  3.56151e+00 9.82125e-01 7.84134e+01 212.439 -5.45139e+00 -3.46477e+00 0.00000e+00 0.00000e+00 4.26487e+01 212.439 3.57648e+01 32.439  0.9190 
1 1 1 -6  103 9  o 3  4.11561e+00 1.05433e+00 6.20573e+01 185.732 -6.12608e+00 -6.14964e-01 0.00000e+00 0.00000e+00 7.70912e+01 185.732 1.50339e+01 185.732 0.9147 
1 1 1 -6  103 10 o 10 3.32445e+00 9.57229e-01 3.72812e+01 128.636 -2.17615e+00 2.72249e+00  0.00000e+00 0.00000e+00 6.58917e+01 128.636 2.86104e+01 128.636 0.8403 
1 1 1 -6  104 1  o 17 7.25458e+00 7.37865e-01 1.25794e+02 114.280 -8.01946e+00 1.77778e+01  0.00000e+00 0.00000e+00 1.36451e+02 114.280 1.06569e+01 114.280 0.9740 
1 1 1 -6  104 2  o 10 5.45597e+00 8.54308e-01 1.06240e+02 47.399  7.74583e+00  8.42321e+00  0.00000e+00 0.00000e+00 8.71242e+01 47.399  1.91156e+01 227.399 0.9553 
1 1 1 -6  104 3  o 11 5.11010e+00 9.32169e-01 1.00390e+02 209.750 -8.97077e+00 -5.12717e+00 0.00000e+00 0.00000e+00 7.97061e+01 209.750 2.06840e+01 29.750  0.9503 
1 1 1 -6  104 4  o 7  5.56971e+00 9.36754e-01 1.10196e+02 318.948 9.07311e+00  -7.90161e+00 0.00000e+00 0.00000e+00 8.74940e+01 318.948 2.27019e+01 138.948 0.9575 
1 1 1 -6  104 5  o 10 4.60612e+00 9.33980e-01 2.45792e+01 41.080  1.78625e+00  1.55715e+00  0.00000e+00 0.00000e+00 1.03422e+02 41.080  7.88429e+01 41.080  0.7500 
1 1 1 -6  104 6  o 7  3.29614e+00 9.18370e-01 5.91542e+01 132.400 -3.16180e+00 3.46261e+00  0.00000e+00 0.00000e+00 4.89394e+01 132.400 1.02148e+01 312.400 0.8856 
1 1 1 -6  104 7  o 14 3.21530e+00 9.12734e-01 4.09648e+01 323.427 2.55784e+00  -1.89774e+00 0.00000e+00 0.00000e+00 5.69318e+01 323.427 1.59670e+01 323.427 0.8228 
1 1 1 -6  104 8  o 14 7.30581e+00 9.18244e-01 1.44356e+02 247.506 -1.07253e+01 -2.59007e+01 0.00000e+00 0.00000e+00 1.20945e+02 247.506 2.34108e+01 67.506  0.9820 
1 1 1 -6  104 9  o 1  4.15162e+00 1.02027e+00 8.65960e+01 87.456  3.88031e-01  8.73357e+00  0.00000e+00 0.00000e+00 5.77504e+01 87.456  2.88456e+01 267.456 0.9409 
1 1 1 -6  104 10 o 2  3.51629e+00 1.02035e+00 7.55744e+01 297.023 3.11634e+00  -6.11009e+00 0.00000e+00 0.00000e+00 4.43729e+01 297.023 3.12015e+01 117.023 0.9239 
1 1 1 -6  105 1  o 3  6.15977e+00 8.00830e-01 7.67893e+01 4.411   1.03815e+01  8.00831e-01  0.00000e+00 0.00000e+00 1.40486e+02 4.411   6.36970e+01 4.411   0.9507 
1 1 1 -6  105 2  o 18 1.33634e+01 5.76448e-01 1.97915e+02 32.453  5.55620e+01  3.53326e+01  0.00000e+00 0.00000e+00 2.93960e+02 32.453  9.60448e+01 32.453  0.9924 
1 1 1 -6  105 3  o 11 1.63626e+01 5.82827e-01 2.09159e+02 182.459 -8.32818e+01 -3.57694e+00 0.00000e+00 0.00000e+00 3.93847e+02 182.459 1.84687e+02 182.459 0.9940 
1 1 1 -6  105 4  o 14 6.59127e+00 8.82688e-01 1.17831e+02 27.762  1.49138e+01  7.85056e+00  0.00000e+00 0.00000e+00 1.19073e+02 27.762  1.24204e+00 27.762  0.9699 
1 1 1 -6  105 5  o 19 6.81221e+00 7.83127e-01 5.40350e+01 177.087 -9.40913e+00 4.78767e-01  0.00000e+00 0.00000e+00 1.84494e+02 177.087 1.30459e+02 177.087 0.9453 
1 1 1 -6  105 6  o 13 8.01962e+00 8.27161e-01 7.93616e+01 326.692 1.35661e+01  -8.91399e+00 0.00000e+00 0.00000e+00 2.08216e+02 326.692 1.28854e+02 326.692 0.9687 
1 1 1 -6  105 7  o 6  6.26647e+00 9.19087e-01 1.25027e+02 188.758 -1.88929e+01 -2.91074e+00 0.00000e+00 0.00000e+00 1.00651e+02 188.758 2.43761e+01 8.758   0.9735 
1 1 1 -6  105 8  f 0  6.65957e+00 9.64896e-01 1.12439e+02 94.845  -1.70030e+00 2.00600e+01  0.00000e+00 0.00000e+00 1.27562e+02 94.845  1.51226e+01 94.845  0.9748 
1 1 1 -6  105 9  o 18 6.42203e+00 9.75509e-01 7.66542e+01 180.429 -1.32079e+01 -9.88694e-02 0.00000e+00 0.00000e+00 1.51414e+02 180.429 7.47599e+01 180.429 0.9614 
1 1 1 -6  105 10 o 17 7.01711e+00 1.08349e+00 1.42650e+02 14.385  2.63841e+01  6.76710e+00  0.00000e+00 0.00000e+00 1.11552e+02 14.385  3.10980e+01 194.385 0.9815 
1 1 1 -6  106 1  o 12 3.33570e+00 8.87403e-01 1.03205e+02 99.143  -1.10819e+00 6.88574e+00  0.00000e+00 0.00000e+00 1.12728e+01 99.143  9.19326e+01 279.143 0.9252 
1 1 1 -6  106 2  o 8  6.23058e+00 8.16595e-01 9.71134e+01 257.939 -2.71117e+00 -1.26885e+01 0.00000e+00 0.00000e+00 1.24824e+02 257.939 2.77105e+01 257.939 0.9607 
1 1 1 -6  106 3  o 19 2.36570e+00 7.50310e-01 4.30064e+01 113.732 -9.72852e-01 2.21285e+00  0.00000e+00 0.00000e+00 2.32559e+01 113.732 1.97505e+01 293.732 0.7557 
1 1 1 -6  106 4  o 15 2.25228e+00 7.27429e-01 8.61968e+01 175.875 -5.16884e+00 3.72771e-01  0.00000e+00 0.00000e+00 1.13118e+01 355.875 9.75086e+01 355.875 0.8974 
1 1 1 -6  106 5  o 5  9.14712e+00 6.95700e-01 1.41573e+02 233.955 -1.96662e+01 -2.70232e+01 0.00000e+00 0.00000e+00 1.92029e+02 233.955 5.04559e+01 233.955 0.9849 
1 1 1 -6  106 6  o 9  7.63486e+00 8.61809e-01 1.53850e+02 105.561 -7.93360e+00 2.84904e+01  0.00000e+00 0.00000e+00 1.23879e+02 105.561 2.99708e+01 285.561 0.9829 
1 1 1 -6  106 7  o 7  3.35063e+00 9.05009e-01 6.06152e+01 186.404 -5.43268e+00 -6.09754e-01 0.00000e+00 0.00000e+00 5.13073e+01 186.404 9.30791e+00 6.404   0.9032 
1 1 1 -6  106 8  o 1  3.14204e+00 8.91852e-01 5.02220e+01 217.720 -3.71276e+00 -2.87166e+00 0.00000e+00 0.00000e+00 5.26353e+01 217.720 2.41328e+00 217.720 0.8858 
1 1 1 -6  106 9  o 14 3.18887e+00 9.22845e-01 3.56932e+01 297.926 1.54951e+00  -2.92330e+00 0.00000e+00 0.00000e+00 6.21036e+01 297.926 2.64104e+01 297.926 0.8304 
1 1 1 -6  106 10 o 6  2.91605e+00 9.16984e-01 2.59715e+01 291.339 9.11579e-01  -2.33343e+00 0.00000e+00 0.00000e+00 5.64030e+01 291.339 3.04314e+01 291.339 0.7656 
1 1 1 -6  107 1  o 1  2.93284e+00 8.64981e-01 4.31569e+01 318.955 2.09677e+00  -1.82561e+00 0.00000e+00 0.00000e+00 4.30104e+01 318.955 1.46490e-01 138.955 0.7923 
1 1 1 -6  107 2  o 2  2.84754e+00 8.39614e-01 4.89847e+01 107.913 -9.59387e-01 2.96796e+00  0.00000e+00 0.00000e+00 3.74036e+01 107.913 1.15811e+01 287.913 0.8184 
1 1 1 -6  107 3  o 9  7.28708e+00 7.68231e-01 9.95717e+01 257.706 -4.00189e+00 -1.83634e+01 0.00000e+00 0.00000e+00 1.63160e+02 257.706 6.35881e+01 257.706 0.9730 
1 1 1 -6  107 4  o 4  2.34737e+00 7.65871e-01 1.84099e+01 251.214 -3.77467e-01 -1.10968e+00 0.00000e+00 0.00000e+00 2.54134e+01 251.214 7.00350e+00 251.214 0.5041 
1 1 1 -6  107 5  o 9  3.73274e+00 9.48348e-01 3.27856e+01 346.920 2.72951e+00  -6.34187e-01 0.00000e+00 0.00000e+00 7.69600e+01 346.920 4.41744e+01 346.920 0.7942 
1 1 1 -6  107 6  o 11 6.06209e+00 1.07585e+00 8.79519e+01 45.832  7.93691e+00  8.17083e+00  0.00000e+00 0.00000e+00 1.26243e+02 45.832  3.82909e+01 45.832  0.9550 
1 1 1 -6  107 7  o 7  3.35311e+00 9.47228e-01 5.24246e+01 258.291 -9.75943e-01 -4.70884e+00 0.00000e+00 0.00000e+00 5.77586e+01 258.291 5.33398e+00 258.291 0.8888 
1 1 1 -6  107 8  o 9  2.53397e+00 8.20678e-01 2.73511e+01 348.709 2.09107e+00  -4.17489e-01 0.00000e+00 0.00000e+00 3.99031e+01 348.709 1.25520e+01 348.709 0.7184 
1 1 1 -6  107 9  o 1  3.83774e+00 1.03437e+00 8.93127e+01 31.064  7.89794e+00  4.75760e+00  0.00000e+00 0.00000e+00 4.44538e+01 31.064  4.48590e+01 211.064 0.9441 
1 1 1 -6  108 1  o 9  2.56522e+00 7.92308e-01 2.67451e+01 225.481 -1.22373e+00 -1.24445e+00 0.00000e+00 0.00000e+00 3.51792e+01 225.481 8.43403e+00 225.481 0.6512 
1 1 1 -6  108 2  o 1  4.03926e+00 8.88668e-01 7.31553e+01 23.763  6.63963e+00  2.92327e+00  0.00000e+00 0.00000e+00 6.57942e+01 23.763  7.36106e+00 203.763 0.9283 
1 1 1 -6  108 3  o 3  3.91263e+00 9.11002e-01 5.65267e+01 204.284 -4.87060e+00 -2.19753e+00 0.00000e+00 0.00000e+00 7.40292e+01 204.284 1.75026e+01 204.284 0.9008 
1 1 1 -6  108 4  o 12 1.75232e+01 6.16267e-01 2.52684e+02 58.738  6.75728e+01  1.11305e+02  0.00000e+00 0.00000e+00 3.93637e+02 58.738  1.40952e+02 58.738  0.9962 
1 1 1 -6  108 5  o 1  8.78955e+00 7.22583e-01 1.49629e+02 233.229 -2.17571e+01 -2.91143e+01 0.00000e+00 0.00000e+00 1.71141e+02 233.229 2.15117e+01 233.229 0.9861 
1 1 1 -6  108 6  o 8  2.58837e+00 8.33506e-01 6.34175e+01 18.648  4.25463e+00  1.43582e+00  0.00000e+00 0.00000e+00 2.08321e+01 18.648  4.25853e+01 198.648 0.8800 
1 1 1 -6  108 7  o 12 3.23573e+00 9.20790e-01 6.01336e+01 119.650 -2.78408e+00 4.89083e+00  0.00000e+00 0.00000e+00 4.82424e+01 119.650 1.18913e+01 299.650 0.9062 
1 1 1 -6  108 8  o 18 3.56934e+00 9.91365e-01 6.48648e+01 52.191  4.01900e+00  5.17958e+00  0.00000e+00 0.00000e+00 5.64543e+01 52.191  8.41046e+00 232.191 0.9202 
1 1 1 -6  108 9  o 2  2.99133e+00 9.12298e-01 4.43075e+01 61.200  2.09497e+00  3.81069e+00  0.00000e+00 0.00000e+00 5.23742e+01 61.200  8.06667e+00 61.200  0.8757 
1 1 1 -6  109 1  o 1  3.56458e+00 8.90226e-01 2.55687e+01 254.225 -5.57646e-01 -1.97393e+00 0.00000e+00 0.00000e+00 6.76946e+01 254.225 4.21259e+01 254.225 0.7060 
1 1 1 -6  109 2  o 15 3.05496e+00 8.75257e-01 7.47427e+01 196.779 -4.96555e+00 -1.49717e+00 0.00000e+00 0.00000e+00 2.68367e+01 196.779 4.79061e+01 16.779  0.8975 
1 1 1 -6  109 3  o 13 3.49617e+00 8.81534e-01 3.99126e+01 78.113  6.94571e-01  3.29982e+00  0.00000e+00 0.00000e+00 6.80835e+01 78.113  2.81710e+01 78.113  0.8341 
1 1 1 -6  109 4  o 8  5.24574e+00 8.85979e-01 5.58391e+01 99.974  -1.20696e+00 6.86295e+00  0.00000e+00 0.00000e+00 1.23805e+02 99.974  6.79658e+01 99.974  0.9252 
1 1 1 -6  109 5  o 17 8.78776e+00 7.35669e-01 1.12332e+02 332.447 2.82519e+01  -1.47402e+01 0.00000e+00 0.00000e+00 2.07638e+02 332.447 9.53063e+01 332.447 0.9842 
1 1 1 -6  109 6  o 6  2.22143e+00 7.21016e-01 4.68425e+01 322.508 2.78884e+00  -2.13935e+00 0.00000e+00 0.00000e+00 2.23065e+01 322.508 2.45360e+01 142.508 0.8419 
1 1 1 -6  109 7  o 11 3.67484e+00 9.55144e-01 8.55063e+01 169.968 -8.38492e+00 1.48334e+00  0.00000e+00 0.00000e+00 4.20412e+01 169.968 4.34651e+01 349.968 0.9393 
1 1 1 -6  109 8  o 12 2.64710e+00 8.38067e-01 1.95969e+01 13.711  1.55209e+00  3.78662e-01  0.00000e+00 0.00000e+00 4.09417e+01 13.711  2.13448e+01 13.711  0.6194 
1 1 1 -6  109 9  o 4  3.22928e+00 9.59463e-01 4.59129e+01 231.586 -2.82126e+00 -3.55772e+00 0.00000e+00 0.00000e+00 5.91204e+01 231.586 1.32075e+01 231.586 0.8815 
1 1 1 -6  110 1  f 0  2.39358e+00 7.59251e-01 2.00258e+01 153.327 -1.13682e+00 5.71078e-01  0.00000e+00 0.00000e+00 2.73789e+01 153.327 7.35318e+00 153.327 0.5346 
1 1 1 -6  110 2  o 17 3.69674e+00 9.37214e-01 6.00612e+01 17.736  5.01460e+00  1.60387e+00  0.00000e+00 0.00000e+00 6.30470e+01 17.736  2.98579e+00 17.736  0.8992 
1 1 1 -6  110 3  o 15 5.18563e+00 9.16721e-01 9.12589e+01 350.455 1.10980e+01  -1.86609e+00 0.00000e+00 0.00000e+00 9.19796e+01 350.455 7.20611e-01 350.455 0.9545 
1 1 1 -6  110 4  o 5  2.46662e+00 7.84675e-01 2.95294e+01 207.463 -1.99904e+00 -1.03902e+00 0.00000e+00 0.00000e+00 3.75792e+01 207.463 8.04976e+00 207.463 0.7352 
1 1 1 -6  110 5  f 0  4.72018e+00 9.51354e-01 6.78601e+01 165.157 -7.80944e+00 2.06964e+00  0.00000e+00 0.00000e+00 9.55248e+01 165.157 2.76647e+01 165.157 0.9359 
1 1 1 -6  110 6  o 11 4.29049e+00 9.82612e-01 4.66692e+01 212.020 -4.27876e+00 -2.67574e+00 0.00000e+00 0.00000e+00 9.51837e+01 212.020 4.85145e+01 212.020 0.8945 
1 1 1 -6  110 7  o 3  3.43634e+00 9.00577e-01 3.21062e+01 335.050 3.11295e+00  -1.44826e+00 0.00000e+00 0.00000e+00 7.42107e+01 335.050 4.21045e+01 335.050 0.8375 
1 1 1 -6  110 8  o 4  2.47308e+00 7.96936e-01 4.21955e+01 42.842  2.85532e+00  2.64798e+00  0.00000e+00 0.00000e+00 3.62540e+01 42.842  5.94155e+00 222.842 0.8593 
1 1 1 -6  110 9  o 7  2.65394e+00 8.47351e-01 3.09202e+01 106.113 -8.64745e-01 2.99341e+00  0.00000e+00 0.00000e+00 4.91759e+01 106.113 1.82557e+01 106.113 0.8182 
1 1 1 -6  111 1  o 3  3.57741e+00 9.29331e-01 4.47226e+01 291.120 1.35656e+00  -3.51187e+00 0.00000e+00 0.00000e+00 6.84057e+01 291.120 2.36831e+01 291.120 0.8538 
1 1 1 -6  111 2  o 16 4.22119e+00 8.16998e-01 7.28518e+01 103.213 -1.86460e+00 7.94178e+00  0.00000e+00 0.00000e+00 7.35170e+01 103.213 6.65171e-01 103.213 0.9365 
1 1 1 -6  111 3  o 5  3.63634e+00 9.56777e-01 3.47729e+01 237.957 -1.77060e+00 -2.82878e+00 0.00000e+00 0.00000e+00 7.72149e+01 237.957 4.24419e+01 237.957 0.8321 
1 1 1 -6  111 4  o 2  2.69592e+00 8.25163e-01 7.83542e+01 193.188 -5.65684e+00 -1.32553e+00 0.00000e+00 0.00000e+00 1.23305e+01 193.188 6.60237e+01 13.188  0.9093 
1 1 1 -6  111 5  o 12 8.45248e+00 7.59122e-01 1.22338e+02 318.041 2.43225e+01  -2.18688e+01 0.00000e+00 0.00000e+00 1.85368e+02 318.041 6.30296e+01 318.041 0.9846 
1 1 1 -6  111 6  o 6  6.76881e+00 8.90826e-01 1.02251e+02 190.298 -1.95993e+01 -3.56096e+00 0.00000e+00 0.00000e+00 1.41512e+02 190.298 3.92607e+01 190.298 0.9746 
1 1 1 -6  111 7  o 15 3.35247e+00 9.46018e-01 9.48330e+01 93.108  -4.78636e-01 8.81376e+00  0.00000e+00 0.00000e+00 2.17303e+01 93.108  7.31027e+01 273.108 0.9415 
1 1 1 -6  111 8  o 1  2.29604e+00 7.72979e-01 3.15691e+01 335.317 2.55887e+00  -1.17601e+00 0.00000e+00 0.00000e+00 3.58275e+01 335.317 4.25842e+00 335.317 0.7954 
1 1 1 -6  112 1  f 0  5.92238e+00 8.70415e-01 5.22313e+01 264.853 -7.93353e-01 -8.80753e+00 0.00000e+00 0.00000e+00 1.54250e+02 264.853 1.02018e+02 264.853 0.9416 
1 1 1 -6  112 2  o 15 2.07106e+00 6.89452e-01 4.90246e+01 280.812 6.18530e-01  -3.23861e+00 0.00000e+00 0.00000e+00 1.45818e+01 280.812 3.44428e+01 100.812 0.8298 
1 1 1 -6  112 3  o 3  3.39109e+00 8.83195e-01 6.03159e+01 179.069 -5.47924e+00 8.90236e-02  0.00000e+00 0.00000e+00 5.30342e+01 179.069 7.28161e+00 359.069 0.9034 
1 1 1 -6  112 4  o 6  3.42851e+00 8.98638e-01 5.09671e+01 150.547 -4.24272e+00 2.39582e+00  0.00000e+00 0.00000e+00 6.19205e+01 150.547 1.09534e+01 150.547 0.8903 
1 1 1 -6  112 5  o 16 3.03339e+00 8.44828e-01 5.06601e+01 316.067 3.47510e+00  -3.34799e+00 0.00000e+00 0.00000e+00 4.90356e+01 316.067 1.62451e+00 136.067 0.8892 
1 1 1 -6  112 6  f 0  2.39018e+00 7.68758e-01 9.05040e+01 101.941 -1.51426e+00 7.16014e+00  0.00000e+00 0.00000e+00 8.48349e+00 281.941 9.89875e+01 281.941 0.9289 
1 1 1 -6  112 7  o 17 2.46096e+00 8.07064e-01 1.27873e+01 213.033 -9.73744e-01 -6.33152e-01 0.00000e+00 0.00000e+00 3.27019e+01 213.033 1.99147e+01 213.033 0.5007 
1 1 1 -6  112 8  o 2  2.50343e+00 8.19184e-01 2.54581e+01 252.970 -7.26812e-01 -2.37289e+00 0.00000e+00 0.00000e+00 4.50088e+01 252.970 1.95506e+01 252.970 0.7630 
1 1 1 -6  113 1  o 19 3.77747e+00 9.47215e-01 5.96267e+01 309.202 3.60363e+00  -4.41810e+00 0.00000e+00 0.00000e+00 6.72530e+01 309.202 7.62624e+00 309.202 0.9075 
1 1 1 -6  113 2  o 10 7.70133e+00 7.42227e-01 8.00923e+01 146.016 -1.69592e+01 1.14323e+01  0.00000e+00 0.00000e+00 1.97814e+02 146.016 1.17722e+02 146.016 0.9752 
1 1 1 -6  113 3  o 11 3.85435e+00 9.22692e-01 4.47637e+01 153.830 -4.22004e+00 2.07380e+00  0.00000e+00 0.00000e+00 8.15427e+01 153.830 3.67790e+01 153.830 0.8860 
1 1 1 -6  113 4  o 5  2.57663e+00 8.06329e-01 6.47736e+01 148.790 -4.65745e+00 2.82172e+00  0.00000e+00 0.00000e+00 2.12241e+01 148.790 4.35495e+01 328.790 0.9028 
1 1 1 -6  113 5  f 0  2.75206e+00 8.33713e-01 2.17486e+01 295.079 8.46631e-01  -1.80908e+00 0.00000e+00 0.00000e+00 4.91655e+01 295.079 2.74169e+01 295.079 0.6973 
1 1 1 -6  113 6  o 1  3.01200e+00 8.97286e-01 5.54389e+01 128.703 -3.23578e+00 4.03844e+00  0.00000e+00 0.00000e+00 4.43684e+01 128.703 1.10705e+01 308.703 0.8973 
1 1 1 -6  113 7  o 13 2.55939e+00 8.18808e-01 5.21594e+01 25.545  4.44724e+00  2.12552e+00  0.00000e+00 0.00000e+00 3.20693e+01 25.545  2.00901e+01 205.545 0.8917 
1 1 1 -6  113 8  f 0  4.65900e+00 1.03737e+00 7.07092e+01 333.470 8.99480e+00  -4.49055e+00 0.00000e+00 0.00000e+00 9.23328e+01 333.470 2.16236e+01 333.470 0.9489 
1 1 1 -6  114 1  o 17 2.42529e+00 7.32444e-01 6.01461e+01 145.047 -4.15288e+00 2.90283e+00  0.00000e+00 0.00000e+00 2.01648e+01 145.047 3.99813e+01 325.047 0.8949 
1 1 1 -6  114 2  o 3  4.33962e+00 9.33480e-01 1.21829e+02 271.126 2.73883e-01  -1.39386e+01 0.00000e+00 0.00000e+00 3.28259e+01 271.126 8.90027e+01 91.126  0.9634 
1 1 1 -6  114 3  o 7  3.15508e+00 8.91181e-01 5.60566e+01 58.234  2.79360e+00  4.51157e+00  0.00000e+00 0.00000e+00 4.89424e+01 58.234  7.11420e+00 238.234 0.9000 
1 1 1 -6  114 4  o 14 5.13582e+00 9.53984e-01 7.29337e+01 195.993 -9.85689e+00 -2.82515e+00 0.00000e+00 0.00000e+00 1.07372e+02 195.993 3.44382e+01 195.993 0.9499 
1 1 1 -6  114 5  o 14 8.14356e+00 7.95700e-01 9.90751e+01 139.091 -2.17042e+01 1.88070e+01  0.00000e+00 0.00000e+00 1.96460e+02 139.091 9.73850e+01 139.091 0.9824 
1 1 1 -6  114 6  o 6  8.02715e+00 8.22911e-01 1.39004e+02 326.324 3.36357e+01  -2.24121e+01 0.00000e+00 0.00000e+00 1.53656e+02 326.324 1.46519e+01 326.324 0.9876 
1 1 1 -6  114 7  o 2  2.55552e+00 8.05897e-01 3.88235e+01 15.728  3.77713e+00  1.06371e+00  0.00000e+00 0.00000e+00 4.23125e+01 15.728  3.48896e+00 15.728  0.8605 
1 1 1 -6  115 1  o 14 3.99670e+00 9.63872e-01 9.57884e+01 0.419   1.06817e+01  7.80580e-02  0.00000e+00 0.00000e+00 4.49531e+01 0.419   5.08352e+01 180.419 0.9520 
1 1 1 -6  115 2  o 4  4.96076e+00 9.71979e-01 7.75740e+01 161.357 -9.71531e+00 3.27766e+00  0.00000e+00 0.00000e+00 9.66784e+01 161.357 1.91045e+01 161.357 0.9499 
1 1 1 -6  115 3  o 13 8.06319e+00 7.77193e-01 1.33586e+02 111.379 -1.38835e+01 3.54641e+01  0.00000e+00 0.00000e+00 1.60522e+02 111.379 2.69361e+01 111.379 0.9868 
1 1 1 -6  115 4  o 4  2.22187e+00 7.28477e-01 4.68943e+01 32.124  3.37011e+00  2.11604e+00  0.00000e+00 0.00000e+00 2.39282e+01 32.124  2.29661e+01 212.124 0.8627 
1 1 1 -6  115 5  o 9  2.41260e+00 7.83900e-01 4.76738e+01 346.580 4.15238e+00  -9.90747e-01 0.00000e+00 0.00000e+00 3.01147e+01 346.580 1.75591e+01 166.580 0.8731 
1 1 1 -6  115 6  o 3  6.45597e+00 9.27690e-01 6.45699e+01 268.235 -4.06956e-01 -1.32089e+01 0.00000e+00 0.00000e+00 1.64498e+02 268.235 9.99284e+01 268.235 0.9614 
1 1 1 -6  115 7  o 17 2.92823e+00 8.93627e-01 5.51542e+01 45.052  3.93571e+00  3.94292e+00  0.00000e+00 0.00000e+00 4.26021e+01 45.052  1.25521e+01 225.052 0.9051 
1 1 1 -6  116 1  o 6  3.58632e+00 9.49416e-01 7.63773e+01 303.098 4.42576e+00  -6.78965e+00 0.00000e+00 0.00000e+00 4.77684e+01 303.098 2.86089e+01 123.098 0.9361 
1 1 1 -6  116 2  o 11 6.90235e+00 8.50417e-01 1.24341e+02 145.396 -2.20770e+01 1.52320e+01  0.00000e+00 0.00000e+00 1.26015e+02 145.396 1.67388e+00 145.396 0.9812 
1 1 1 -6  116 3  o 6  5.97557e+00 8.90820e-01 7.58733e+01 313.565 9.15760e+00  -9.62817e+00 0.00000e+00 0.00000e+00 1.36459e+02 313.565 6.05853e+01 313.565 0.9616 
1 1 1 -6  116 4  o 4  2.08443e+00 6.90643e-01 2.41837e+01 325.119 1.69559e+00  -1.18203e+00 0.00000e+00 0.00000e+00 3.03607e+01 325.119 6.17699e+00 325.119 0.7085 
1 1 1 -6  116 5  o 4  4.77519e+00 1.02331e+00 1.20114e+02 208.700 -1.47863e+01 -8.09532e+00 0.00000e+00 0.00000e+00 5.08566e+01 208.700 6.92578e+01 28.700  0.9699 
1 1 1 -6  116 6  o 9  5.70605e+00 1.00570e+00 8.59339e+01 340.532 1.45597e+01  -5.14656e+00 0.00000e+00 0.00000e+00 1.17656e+02 340.532 3.17220e+01 340.532 0.9671 
1 1 1 -6  116 7  o 4  2.14734e+00 7.24948e-01 9.60987e+00 223.082 -7.21058e-01 -6.74333e-01 0.00000e+00 0.00000e+00 2.53739e+01 223.082 1.57640e+01 223.082 0.4419 
1 1 1 -6  117 1  o 17 3.19186e+00 8.45961e-01 5.14060e+01 287.777 1.53185e+00  -4.77765e+00 0.00000e+00 0.00000e+00 5.40552e+01 287.777 2.64924e+00 287.777 0.8938 
1 1 1 -6  117 2  o 19 3.09269e+00 8.79467e-01 5.57704e+01 20.916  5.08450e+00  1.94321e+00  0.00000e+00 0.00000e+00 4.74039e+01 20.916  8.36655e+00 200.916 0.9027 
1 1 1 -6  117 3  o 1  2.82849e+00 7.94274e-01 5.79675e+01 1.240   6.01585e+00  1.30175e-01  0.00000e+00 0.00000e+00 3.73888e+01 1.240   2.05787e+01 181.240 0.9126 
1 1 1 -6  117 4  o 19 2.56482e+00 7.89903e-01 4.91890e+01 220.713 -3.65008e+00 -3.14102e+00 0.00000e+00 0.00000e+00 3.49938e+01 220.713 1.41951e+01 40.713  0.8889 
1 1 1 -6  117 5  o 16 2.34301e+00 7.84009e-01 2.59367e+01 80.046  4.26433e-01  2.42978e+00  0.00000e+00 0.00000e+00 3.98954e+01 80.046  1.39586e+01 80.046  0.7613 
1 1 1 -6  117 6  o 12 2.74458e+00 8.58334e-01 3.59132e+01 294.827 1.48400e+00  -3.20765e+00 0.00000e+00 0.00000e+00 4.94100e+01 294.827 1.34968e+01 294.827 0.8429 
1 1 1 -6  118 1  o 15 3.10719e+00 8.67763e-01 4.39738e+01 192.308 -4.60689e+00 -1.00512e+00 0.00000e+00 0.00000e+00 5.78014e+01 192.308 1.38277e+01 192.308 0.8863 
1 1 1 -6  118 2  o 4  6.66324e+00 8.69907e-01 7.72738e+01 281.042 3.39096e+00  -1.73760e+01 0.00000e+00 0.00000e+00 1.61831e+02 281.042 8.45568e+01 281.042 0.9713 
1 1 1 -6  118 3  o 4  2.98578e+00 8.69699e-01 6.40024e+01 119.453 -3.27808e+00 5.80521e+00  0.00000e+00 0.00000e+00 3.76151e+01 119.453 2.63874e+01 299.452 0.9216 
1 1 1 -6  118 4  o 5  3.77112e+00 9.56424e-01 6.27099e+01 273.729 4.92123e-01  -7.55068e+00 0.00000e+00 0.00000e+00 6.69343e+01 273.729 4.22446e+00 273.729 0.9314 
1 1 1 -6  118 5  o 11 2.01077e+00 6.98921e-01 7.41166e+00 215.019 -5.56567e-01 -3.89993e-01 0.00000e+00 0.00000e+00 1.64443e+01 215.019 9.03259e+00 215.019 0.3216 
1 1 1 -6  118 6  f 0  2.45754e+00 7.94751e-01 2.50206e+01 39.616  1.95310e+00  1.61668e+00  0.00000e+00 0.00000e+00 4.46419e+01 39.616  1.96212e+01 39.616  0.7688 
1 1 1 -6  119 1  f 0  2.45415e+00 7.80901e-01 6.52075e+01 226.976 -4.20356e+00 -4.50405e+00 0.00000e+00 0.00000e+00 1.77315e+01 226.976 4.74760e+01 46.976  0.9148 
1 1 1 -6  119 2  o 7  3.07117e+00 8.98917e-01 7.06035e+01 305.047 4.07052e+00  -5.80311e+00 0.00000e+00 0.00000e+00 3.44823e+01 305.047 3.61212e+01 125.047 0.9265 
1 1 1 -6  119 3  o 16 3.94439e+00 9.55933e-01 3.82603e+01 205.354 -4.52141e+00 -2.14244e+00 0.00000e+00 0.00000e+00 9.18392e+01 205.354 5.35789e+01 205.354 0.8935 
1 1 1 -6  119 4  o 8  4.19063e+00 9.45105e-01 5.40748e+01 19.907  7.25073e+00  2.62569e+00  0.00000e+00 0.00000e+00 9.01525e+01 19.907  3.60778e+01 19.907  0.9327 
1 1 1 -6  119 5  o 3  4.40644e+00 9.71787e-01 7.53107e+01 221.034 -8.74521e+00 -7.61133e+00 0.00000e+00 0.00000e+00 8.00267e+01 221.034 4.71597e+00 221.034 0.9558 
1 1 1 -6  119 6  o 19 3.29147e+00 8.97353e-01 5.19517e+01 99.917  -1.26987e+00 7.26348e+00  0.00000e+00 0.00000e+00 6.08144e+01 99.917  8.86273e+00 99.917  0.9295 
1 1 1 -6  120 1  o 16 3.32192e+00 9.01885e-01 4.24462e+01 315.856 3.57192e+00  -3.46674e+00 0.00000e+00 0.00000e+00 6.70927e+01 315.856 2.46465e+01 315.856 0.8929 
1 1 1 -6  120 2  o 14 2.87458e+00 8.38300e-01 6.92404e+01 144.498 -6.21466e+00 4.43318e+00  0.00000e+00 0.00000e+00 2.96689e+01 144.498 3.95714e+01 324.498 0.9320 
1 1 1 -6  120 3  o 5  2.85563e+00 8.47961e-01 4.05495e+01 45.174  2.96533e+00  2.98335e+00  0.00000e+00 0.00000e+00 5.12426e+01 45.174  1.06931e+01 45.174  0.8710 
1 1 1 -6  120 4  f 0  3.70619e+00 9.70129e-01 7.67588e+01 256.705 -2.29072e+00 -9.69417e+00 0.00000e+00 0.00000e+00 5.28985e+01 256.705 2.38603e+01 76.705  0.9484 
1 1 1 -6  120 5  o 13 3.43578e+00 1.00230e+00 8.22078e+01 104.869 -2.41329e+00 9.08972e+00  0.00000e+00 0.00000e+00 3.75276e+01 104.869 4.46802e+01 284.869 0.9452 
1 1 1 -6  121 1  o 11 2.84094e+00 8.35729e-01 4.98249e+01 252.947 -1.52791e+00 -4.98118e+00 0.00000e+00 0.00000e+00 4.43661e+01 252.947 5.45879e+00 72.947  0.8980 
1 1 1 -6  121 2  o 4  2.00229e+00 6.75687e-01 3.87770e+01 144.993 -2.98687e+00 2.09195e+00  0.00000e+00 0.00000e+00 2.39187e+01 144.993 1.48583e+01 324.993 0.8484 
1 1 1 -6  121 3  o 2  3.20754e+00 9.06662e-01 8.06826e+01 143.690 -7.51811e+00 5.52463e+00  0.00000e+00 0.00000e+00 3.11169e+01 143.690 4.95657e+01 323.690 0.9448 
1 1 1 -6  121 4  o 14 3.47340e+00 9.51474e-01 4.43440e+01 24.401  4.97448e+00  2.25663e+00  0.00000e+00 0.00000e+00 7.13286e+01 24.401  2.69846e+01 24.401  0.9031 
1 1 1 -6  121 5  o 11 2.55793e+00 8.19462e-01 1.89434e+01 157.848 -1.69379e+00 6.89559e-01  0.00000e+00 0.00000e+00 4.39908e+01 157.848 2.50474e+01 157.848 0.6676 
1 1 1 -6  122 1  o 19 3.90712e+00 9.88690e-01 8.77931e+01 260.513 -1.84611e+00 -1.10470e+01 0.00000e+00 0.00000e+00 4.98101e+01 260.513 3.79830e+01 80.513  0.9543 
1 1 1 -6  122 2  o 3  3.33443e+00 9.47015e-01 6.07306e+01 121.735 -3.94884e+00 6.38502e+00  0.00000e+00 0.00000e+00 5.37779e+01 121.735 6.95274e+00 301.735 0.9308 
1 1 1 -6  122 3  o 5  2.05406e+00 6.95240e-01 7.01808e+00 17.864  6.71488e-01  2.16413e-01  0.00000e+00 0.00000e+00 1.81686e+01 17.864  1.11505e+01 17.864  0.3325 
1 1 1 -6  122 4  o 15 5.48227e+00 1.02435e+00 1.01080e+02 318.232 1.23553e+01  -1.10345e+01 0.00000e+00 0.00000e+00 9.48158e+01 318.232 6.26378e+00 138.232 0.9693 
1 1 1 -5  0   1  o 10 1.09905e+01 5.04991e-01 3.82335e+02 0.000   1.66477e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.71680e+00 0.000   3.79619e+02 180.000 0.9309 
1 1 1 -5  0   2  f 0  1.55451e+01 5.71629e-01 3.78218e+01 0.000   1.68841e-01  0.00000e+00  0.00000e+00 0.00000e+00 6.00071e+01 0.000   2.21853e+01 0.000   0.1673 
1 1 1 -5  0   3  o 17 2.19338e+01 6.91315e-01 2.87315e+02 0.000   2.41746e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.24676e+02 0.000   2.37361e+02 0.000   0.9842 
1 1 1 -5  0   4  o 5  2.03168e+01 6.59660e-01 2.74174e+02 180.000 -2.40012e+00 -0.00000e+00 0.00000e+00 0.00000e+00 4.77219e+02 180.000 2.03045e+02 180.000 0.9837 
1 1 1 -5  0   5  f 0  1.25389e+01 5.41091e-01 5.74040e+02 180.000 -3.19160e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.04422e+02 0.000   6.78462e+02 0.000   0.9966 
1 1 1 -5  0   6  o 16 3.66016e+01 1.03915e+00 8.86485e+02 180.000 -1.68325e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.88248e+02 180.000 3.98237e+02 0.000   1.0000 
1 1 1 -5  0   7  o 14 2.04881e+01 6.72515e-01 2.97930e+02 180.000 -3.76738e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.70308e+02 180.000 1.72378e+02 180.000 0.9989 
1 1 1 -5  0   8  o 1  3.87507e+01 9.00480e-01 5.58955e+02 180.000 -1.71426e+01 0.00000e+00  0.00000e+00 0.00000e+00 8.94666e+02 180.000 3.35712e+02 180.000 1.0000 
1 1 1 -5  0   9  o 9  2.70924e+01 6.78666e-01 6.76011e+02 0.000   1.92200e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.39551e+02 0.000   3.36460e+02 180.000 1.0000 
1 1 1 -5  0   10 o 3  3.86922e+01 9.00642e-01 6.95882e+02 0.000   3.49348e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.53365e+02 0.000   5.74830e+01 0.000   1.0000 
1 1 1 -5  0   11 o 3  1.29543e+01 5.58421e-01 1.24417e+02 0.000   2.59009e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.54963e+02 0.000   2.30546e+02 0.000   0.9888 
1 1 1 -5  0   12 o 4  1.96835e+01 6.09485e-01 5.37577e+02 0.000   2.59073e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.98397e+02 0.000   3.39180e+02 180.000 1.0000 
1 1 1 -5  0   13 o 19 8.41210e+00 8.75533e-01 1.24753e+02 0.000   3.56529e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.88973e+02 0.000   6.42206e+01 0.000   0.9984 
1 1 1 -5  0   14 o 7  1.87774e+00 1.22046e+00 5.55715e+01 0.000   4.46146e-01  0.00000e+00  0.00000e+00 0.00000e+00 2.62315e+01 180.000 8.18029e+01 180.000 0.4187 
1 1 1 -5  0   15 o 4  1.82701e+00 1.23146e+00 4.78577e+01 180.000 -4.52383e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.89920e+01 0.000   6.68497e+01 0.000   0.4239 
1 1 1 -5  0   16 o 10 2.67261e+00 1.69263e+00 6.30249e+01 0.000   9.51015e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.06353e+01 0.000   5.23896e+01 180.000 0.7402 
1 1 1 -5  0   17 o 8  3.12189e+00 1.90949e+00 9.32874e+01 0.000   1.69063e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.51725e+01 0.000   7.81149e+01 180.000 0.9342 
1 1 1 -5  0   18 o 12 8.19236e+00 2.13095e+00 1.27291e+02 180.000 -6.02665e+00 -0.00000e+00 0.00000e+00 0.00000e+00 1.76973e+02 180.000 4.96812e+01 180.000 1.0000 
1 1 1 -5  0   19 o 16 5.64241e+00 2.68002e+00 3.66150e+01 0.000   1.00042e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.22810e+02 0.000   8.61952e+01 0.000   0.7618 
1 1 1 -5  0   20 o 8  3.84976e+00 2.43034e+00 8.75386e+00 0.000   1.99467e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.93173e+01 0.000   1.05634e+01 0.000   0.1969 
1 1 1 -5  1   1  o 14 2.05211e+01 5.51342e-01 9.35752e+01 200.823 -1.41729e+00 -5.39020e-01 0.00000e+00 0.00000e+00 3.69953e+02 200.823 2.76377e+02 200.823 0.6001 
1 1 1 -5  1   2  o 11 2.41154e+01 5.26337e-01 4.86523e+02 160.855 -6.35361e+00 2.20577e+00  0.00000e+00 0.00000e+00 3.50382e+02 160.855 1.36141e+02 340.855 0.9223 
1 1 1 -5  1   3  o 5  1.08567e+01 3.66195e-01 6.16732e+01 213.238 -4.30072e-01 -2.81835e-01 0.00000e+00 0.00000e+00 3.99889e+01 213.238 2.16843e+01 33.238  0.2490 
1 1 1 -5  1   4  o 14 1.44842e+01 3.95913e-01 2.01417e+02 345.515 2.43555e+00  -6.29183e-01 0.00000e+00 0.00000e+00 2.16089e+02 345.515 1.46714e+01 345.515 0.7667 
1 1 1 -5  1   5  o 11 1.61106e+01 4.13361e-01 1.48386e+02 152.960 -1.88699e+00 9.63141e-01  0.00000e+00 0.00000e+00 2.85293e+02 152.960 1.36907e+02 152.960 0.7163 
1 1 1 -5  1   6  o 14 1.02159e+01 3.75324e-01 2.53240e+02 319.288 2.05019e+00  -1.76420e+00 0.00000e+00 0.00000e+00 4.81772e+01 319.288 2.05063e+02 139.288 0.7855 
1 1 1 -5  1   7  o 4  4.81832e+01 8.50586e-01 9.93129e+02 177.159 -5.83169e+01 2.89378e+00  0.00000e+00 0.00000e+00 7.99959e+02 177.159 1.93170e+02 357.159 0.9914 
1 1 1 -5  1   8  o 19 1.43002e+01 3.42696e-01 2.68872e+02 168.124 -6.00654e+00 1.26312e+00  0.00000e+00 0.00000e+00 2.21668e+02 168.124 4.72041e+01 348.124 0.9145 
1 1 1 -5  1   9  o 1  4.01122e+01 6.56527e-01 6.27480e+02 28.205  4.61866e+01  2.47704e+01  0.00000e+00 0.00000e+00 8.61715e+02 28.205  2.34235e+02 28.205  0.9904 
1 1 1 -5  1   10 o 12 2.41854e+01 4.47947e-01 4.90835e+02 223.100 -2.27181e+01 -2.12589e+01 0.00000e+00 0.00000e+00 4.00367e+02 223.100 9.04675e+01 43.100  0.9838 
1 1 1 -5  1   11 o 4  3.12047e+01 5.44885e-01 5.31993e+02 83.338  6.13704e+00  5.25464e+01  0.00000e+00 0.00000e+00 6.24725e+02 83.338  9.27318e+01 83.338  0.9905 
1 1 1 -5  1   12 o 6  3.83190e+01 6.50923e-01 5.96906e+02 241.780 -5.18310e+01 -9.65819e+01 0.00000e+00 0.00000e+00 8.29302e+02 241.780 2.32396e+02 241.780 0.9954 
1 1 1 -5  1   13 o 4  1.75564e+01 5.11302e-01 3.79249e+02 51.904  2.83496e+01  3.61610e+01  0.00000e+00 0.00000e+00 2.69380e+02 51.904  1.09868e+02 231.904 0.9891 
1 1 1 -5  1   14 o 5  9.65824e+00 6.21927e-01 1.42355e+02 293.955 5.06244e+00  -1.13944e+01 0.00000e+00 0.00000e+00 2.03282e+02 293.955 6.09271e+01 293.955 0.9590 
1 1 1 -5  1   15 o 4  3.60034e+00 9.56748e-01 2.43730e+01 162.964 -8.42623e-01 2.58199e-01  0.00000e+00 0.00000e+00 2.96781e+01 162.964 5.30512e+00 162.964 0.4028 
1 1 1 -5  1   16 f 0  4.72645e+00 1.09113e+00 7.82612e+01 349.285 4.32389e+00  -8.18180e-01 0.00000e+00 0.00000e+00 7.61305e+01 349.285 2.13075e+00 169.285 0.8773 
1 1 1 -5  1   17 o 9  1.35028e+01 8.42665e-01 2.43190e+02 220.252 -3.82989e+01 -3.24242e+01 0.00000e+00 0.00000e+00 2.53920e+02 220.252 1.07298e+01 220.252 0.9900 
1 1 1 -5  1   18 o 15 4.55804e+00 1.24898e+00 8.56156e+01 95.868  -5.44163e-01 5.29426e+00  0.00000e+00 0.00000e+00 6.68029e+01 95.868  1.88127e+01 275.868 0.9004 
1 1 1 -5  1   19 o 18 4.19621e+00 1.32254e+00 7.27343e+01 330.562 3.84704e+00  -2.17101e+00 0.00000e+00 0.00000e+00 6.38956e+01 330.562 8.83867e+00 150.563 0.8779 
1 1 1 -5  1   20 o 18 5.65063e+00 1.66227e+00 8.44110e+01 192.477 -5.75264e+00 -1.27294e+00 0.00000e+00 0.00000e+00 1.06183e+02 192.477 2.17716e+01 192.477 0.9106 
1 1 1 -5  2   1  o 8  9.23775e+00 3.52975e-01 2.73437e+02 60.678  9.77017e-01  1.73949e+00  0.00000e+00 0.00000e+00 3.11131e+01 240.678 3.04550e+02 240.678 0.6970 
1 1 1 -5  2   2  o 3  3.01340e+01 6.22905e-01 4.40079e+02 36.517  6.08938e+00  4.50867e+00  0.00000e+00 0.00000e+00 6.16038e+02 36.517  1.75959e+02 36.517  0.9315 
1 1 1 -5  2   3  f 0  1.07253e+01 3.66089e-01 3.18530e+02 357.004 2.61562e+00  -1.36905e-01 0.00000e+00 0.00000e+00 4.93397e+00 177.004 3.23464e+02 177.004 0.7774 
1 1 1 -5  2   4  o 17 2.40032e+01 5.22284e-01 4.82726e+02 12.704  9.71621e+00  2.19036e+00  0.00000e+00 0.00000e+00 3.73149e+02 12.704  1.09577e+02 192.704 0.9484 
1 1 1 -5  2   5  o 3  2.80874e+01 5.88188e-01 5.45729e+02 161.860 -1.28609e+01 4.21349e+00  0.00000e+00 0.00000e+00 4.70000e+02 161.860 7.57288e+01 341.860 0.9623 
1 1 1 -5  2   6  o 1  2.13812e+01 4.82489e-01 5.85049e+02 9.658   1.28623e+01  2.18888e+00  0.00000e+00 0.00000e+00 1.86596e+02 9.658   3.98453e+02 189.658 0.9609 
1 1 1 -5  2   7  o 3  2.32478e+01 4.69051e-01 6.83630e+02 327.584 1.65557e+01  -1.05129e+01 0.00000e+00 0.00000e+00 1.66470e+02 327.584 5.17160e+02 147.584 0.9742 
1 1 1 -5  2   8  o 2  1.31253e+01 3.32216e-01 3.14564e+02 154.798 -5.96293e+00 2.80620e+00  0.00000e+00 0.00000e+00 1.38723e+02 154.798 1.75841e+02 334.798 0.9207 
1 1 1 -5  2   9  o 16 2.59569e+01 4.65077e-01 5.94057e+02 17.539  3.08680e+01  9.75563e+00  0.00000e+00 0.00000e+00 3.63787e+02 17.539  2.30270e+02 197.539 0.9844 
1 1 1 -5  2   10 o 16 2.70887e+01 4.82573e-01 4.47318e+02 201.299 -2.95399e+01 -1.15165e+01 0.00000e+00 0.00000e+00 5.51175e+02 201.299 1.03858e+02 201.299 0.9841 
1 1 1 -5  2   11 o 17 5.37718e+01 8.67114e-01 9.58151e+02 251.484 -5.25024e+01 -1.56769e+02 0.00000e+00 0.00000e+00 1.04811e+03 251.484 8.99613e+01 251.484 0.9970 
1 1 1 -5  2   12 o 12 2.67255e+01 5.56863e-01 4.34881e+02 348.089 5.50513e+01  -1.16118e+01 0.00000e+00 0.00000e+00 5.55469e+02 348.089 1.20588e+02 348.089 0.9911 
1 1 1 -5  2   13 o 8  1.09970e+01 5.27858e-01 1.79928e+02 301.107 7.03812e+00  -1.16638e+01 0.00000e+00 0.00000e+00 2.15477e+02 301.107 3.55494e+01 301.107 0.9626 
1 1 1 -5  2   14 o 1  8.93213e+00 7.07339e-01 1.43414e+02 249.615 -3.96965e+00 -1.06827e+01 0.00000e+00 0.00000e+00 1.74918e+02 249.615 3.15038e+01 249.615 0.9551 
1 1 1 -5  2   15 o 14 5.44875e+00 9.57301e-01 9.78165e+01 57.168  2.90132e+00  4.49647e+00  0.00000e+00 0.00000e+00 8.51672e+01 57.168  1.26494e+01 237.168 0.9009 
1 1 1 -5  2   16 o 1  4.79836e+00 9.93325e-01 7.50076e+01 185.658 -4.46223e+00 -4.42118e-01 0.00000e+00 0.00000e+00 8.21837e+01 185.658 7.17606e+00 185.658 0.8799 
1 1 1 -5  2   17 o 18 7.91255e+00 1.10657e+00 8.08016e+01 27.735  7.54447e+00  3.96682e+00  0.00000e+00 0.00000e+00 1.95605e+02 27.735  1.14803e+02 27.735  0.9394 
1 1 1 -5  2   18 o 4  4.47202e+00 1.29626e+00 3.14446e+01 182.922 -1.85856e+00 -9.48517e-02 0.00000e+00 0.00000e+00 8.04300e+01 182.922 4.89854e+01 182.922 0.6736 
1 1 1 -5  2   19 o 10 3.94336e+00 1.28476e+00 4.26645e+01 193.241 -2.43451e+00 -5.72847e-01 0.00000e+00 0.00000e+00 6.92415e+01 193.241 2.65770e+01 193.241 0.7651 
1 1 1 -5  2   20 o 6  4.50625e+00 1.41077e+00 5.88617e+01 348.467 3.89957e+00  -7.95718e-01 0.00000e+00 0.00000e+00 8.51372e+01 348.467 2.62754e+01 348.467 0.8627 
1 1 1 -5  3   1  o 19 2.34149e+01 5.10975e-01 5.57763e+02 246.391 -4.10635e+00 -9.39510e+00 0.00000e+00 0.00000e+00 2.79359e+02 246.391 2.78405e+02 66.391  0.9499 
1 1 1 -5  3   2  o 11 1.33306e+01 3.81155e-01 3.71436e+02 304.498 1.60090e+00  -2.32947e+00 0.00000e+00 0.00000e+00 2.79659e+01 304.498 3.43471e+02 124.498 0.7963 
1 1 1 -5  3   3  o 13 9.36290e+00 3.55958e-01 2.36098e+02 259.498 -3.08087e-01 -1.66196e+00 0.00000e+00 0.00000e+00 1.07927e+01 79.498  2.46890e+02 79.498  0.6398 
1 1 1 -5  3   4  o 7  2.03920e+01 4.66920e-01 3.39079e+02 173.825 -5.90253e+00 6.38656e-01  0.00000e+00 0.00000e+00 3.59649e+02 173.825 2.05692e+01 173.825 0.9114 
1 1 1 -5  3   5  o 14 4.13067e+00 5.21848e-01 6.93722e+01 252.679 -7.53173e-02 -2.41502e-01 0.00000e+00 0.00000e+00 4.98935e+01 72.679  1.19266e+02 72.679  0.1255 
1 1 1 -5  3   6  f 0  2.92391e+01 6.08093e-01 6.78862e+02 308.945 1.29669e+01  -1.60442e+01 0.00000e+00 0.00000e+00 3.92370e+02 308.945 2.86491e+02 128.945 0.9755 
1 1 1 -5  3   7  o 12 1.90807e+01 5.27661e-01 2.71475e+02 76.827  1.45385e+00  6.21161e+00  0.00000e+00 0.00000e+00 3.85928e+02 76.827  1.14453e+02 76.827  0.9179 
1 1 1 -5  3   8  o 17 4.01962e+01 6.56512e-01 7.67648e+02 75.307  1.23673e+01  4.71643e+01  0.00000e+00 0.00000e+00 7.24635e+02 75.307  4.30129e+01 255.307 0.9897 
1 1 1 -5  3   9  o 9  2.51999e+01 4.56286e-01 5.54840e+02 253.156 -8.50553e+00 -2.80940e+01 0.00000e+00 0.00000e+00 3.73537e+02 253.156 1.81303e+02 73.156  0.9828 
1 1 1 -5  3   10 o 1  3.21982e+01 5.49824e-01 5.81759e+02 289.854 1.65868e+01  -4.59346e+01 0.00000e+00 0.00000e+00 6.11824e+02 289.854 3.00653e+01 289.854 0.9897 
1 1 1 -5  3   11 o 6  1.34779e+01 3.84155e-01 3.08222e+02 11.109  1.35695e+01  2.66441e+00  0.00000e+00 0.00000e+00 1.77579e+02 11.109  1.30643e+02 191.109 0.9631 
1 1 1 -5  3   12 o 4  2.24411e+01 4.77750e-01 4.70614e+02 199.559 -4.85247e+01 -1.72398e+01 0.00000e+00 0.00000e+00 3.60271e+02 199.559 1.10344e+02 19.559  0.9902 
1 1 1 -5  3   13 o 7  1.51775e+01 5.05738e-01 1.82731e+02 91.666  -5.56768e-01 1.91383e+01  0.00000e+00 0.00000e+00 3.69198e+02 91.666  1.86466e+02 91.666  0.9735 
1 1 1 -5  3   14 o 7  3.62211e+00 9.20617e-01 9.41566e+01 16.945  2.74367e+00  8.35953e-01  0.00000e+00 0.00000e+00 1.39380e+01 16.945  8.02186e+01 196.945 0.7997 
1 1 1 -5  3   15 o 14 1.15302e+01 6.22994e-01 2.09883e+02 153.486 -2.26502e+01 1.13000e+01  0.00000e+00 0.00000e+00 2.11329e+02 153.486 1.44668e+00 153.486 0.9800 
1 1 1 -5  3   16 o 6  9.30005e+00 8.16932e-01 1.92428e+02 65.881  9.83889e+00  2.19752e+01  0.00000e+00 0.00000e+00 1.46564e+02 65.881  4.58641e+01 245.881 0.9790 
1 1 1 -5  3   17 o 2  8.11476e+00 1.07987e+00 9.11969e+01 297.447 4.61392e+00  -8.88337e+00 0.00000e+00 0.00000e+00 1.95073e+02 297.447 1.03876e+02 297.447 0.9487 
1 1 1 -5  3   18 o 14 6.86759e+00 1.44635e+00 6.49574e+01 189.328 -5.29002e+00 -8.68940e-01 0.00000e+00 0.00000e+00 1.64887e+02 189.328 9.99291e+01 189.328 0.9011 
1 1 1 -5  3   19 o 6  5.34394e+00 1.52990e+00 8.24494e+01 118.774 -2.64872e+00 4.82320e+00  0.00000e+00 0.00000e+00 9.67057e+01 118.774 1.42564e+01 118.774 0.9039 
1 1 1 -5  3   20 o 1  4.72651e+00 1.50002e+00 1.08955e+02 216.444 -5.79697e+00 -4.28074e+00 0.00000e+00 0.00000e+00 5.34638e+01 216.444 5.54912e+01 36.444  0.9278 
1 1 1 -5  4   1  o 10 2.77160e+01 5.80511e-01 5.75246e+02 259.602 -2.24408e+00 -1.22300e+01 0.00000e+00 0.00000e+00 4.25024e+02 259.602 1.50223e+02 79.602  0.9589 
1 1 1 -5  4   2  o 1  2.07869e+01 4.71318e-01 3.59980e+02 72.403  1.28411e+00  4.04877e+00  0.00000e+00 0.00000e+00 3.22348e+02 72.403  3.76321e+01 252.403 0.8724 
1 1 1 -5  4   3  o 8  1.01425e+01 3.60620e-01 2.47823e+02 206.417 -1.71461e+00 -8.51765e-01 0.00000e+00 0.00000e+00 1.28158e+01 206.417 2.35007e+02 26.417  0.6832 
1 1 1 -5  4   4  o 14 1.98126e+01 5.31221e-01 3.85186e+02 304.930 3.73761e+00  -5.35170e+00 0.00000e+00 0.00000e+00 2.99999e+02 304.930 8.51873e+01 124.930 0.9198 
1 1 1 -5  4   5  o 1  6.16904e+00 4.14654e-01 3.48835e+01 234.300 -1.10839e-01 -1.54248e-01 0.00000e+00 0.00000e+00 1.29656e+01 54.300  4.78491e+01 54.300  0.0945 
1 1 1 -5  4   6  o 19 2.65995e+01 5.63086e-01 7.78853e+02 189.401 -2.12366e+01 -3.51629e+00 0.00000e+00 0.00000e+00 1.96696e+02 189.401 5.82158e+02 9.402   0.9765 
1 1 1 -5  4   7  f 0  2.91701e+01 5.52587e-01 5.32139e+02 210.073 -1.65198e+01 -9.56585e+00 0.00000e+00 0.00000e+00 5.33714e+02 210.073 1.57479e+00 210.073 0.9734 
1 1 1 -5  4   8  o 19 1.27347e+01 3.32842e-01 3.22375e+02 217.317 -5.20483e+00 -3.96742e+00 0.00000e+00 0.00000e+00 1.17137e+02 217.317 2.05238e+02 37.317  0.9201 
1 1 1 -5  4   9  o 6  1.99357e+01 3.97835e-01 2.52129e+02 130.044 -6.79918e+00 8.09034e+00  0.00000e+00 0.00000e+00 4.58860e+02 130.044 2.06731e+02 130.044 0.9514 
1 1 1 -5  4   10 o 2  2.60789e+01 4.72833e-01 4.70402e+02 275.390 3.01512e+00  -3.19581e+01 0.00000e+00 0.00000e+00 4.91044e+02 275.390 2.06419e+01 275.390 0.9843 
1 1 1 -5  4   11 f 0  1.57266e+01 3.92154e-01 3.18741e+02 259.982 -2.90058e+00 -1.64195e+01 0.00000e+00 0.00000e+00 2.51869e+02 259.982 6.68721e+01 79.982  0.9695 
1 1 1 -5  4   12 o 19 1.93522e+01 4.52831e-01 4.66673e+02 179.726 -4.41163e+01 2.11152e-01  0.00000e+00 0.00000e+00 2.48648e+02 179.726 2.18025e+02 359.726 0.9886 
1 1 1 -5  4   13 o 5  6.16669e+00 8.05505e-01 1.66037e+02 86.152  4.51310e-01  6.71035e+00  0.00000e+00 0.00000e+00 4.64197e+01 86.152  1.19618e+02 266.152 0.9223 
1 1 1 -5  4   14 o 5  3.19349e+00 8.07206e-01 9.64447e+01 207.128 -2.37771e+00 -1.21822e+00 0.00000e+00 0.00000e+00 3.20431e+00 27.128  9.96490e+01 27.128  0.7824 
1 1 1 -5  4   15 o 16 4.47394e+00 1.00130e+00 1.44231e+02 152.928 -5.36587e+00 2.74249e+00  0.00000e+00 0.00000e+00 7.98525e+00 152.928 1.36246e+02 332.928 0.9128 
1 1 1 -5  4   16 o 3  7.00448e+00 9.33246e-01 9.52627e+01 52.100  5.24648e+00  6.73944e+00  0.00000e+00 0.00000e+00 1.49747e+02 52.100  5.44845e+01 52.100  0.9395 
1 1 1 -5  4   17 o 13 9.89299e+00 1.08940e+00 2.25669e+02 259.267 -5.59391e+00 -2.95128e+01 0.00000e+00 0.00000e+00 1.36043e+02 259.267 8.96265e+01 79.267  0.9832 
1 1 1 -5  4   18 o 18 6.35936e+00 1.45414e+00 1.54479e+02 129.454 -7.46351e+00 9.06882e+00  0.00000e+00 0.00000e+00 7.14155e+01 129.454 8.30634e+01 309.454 0.9564 
1 1 1 -5  4   19 o 11 5.21472e+00 1.51515e+00 8.57988e+01 227.664 -3.92982e+00 -4.31331e+00 0.00000e+00 0.00000e+00 9.01539e+01 227.664 4.35508e+00 227.664 0.9097 
1 1 1 -5  4   20 o 11 4.82603e+00 1.52424e+00 3.49439e+01 78.275  4.70578e-01  2.26730e+00  0.00000e+00 0.00000e+00 9.79314e+01 78.275  6.29875e+01 78.275  0.7434 
1 1 1 -5  5   1  o 5  2.69992e+01 5.69048e-01 6.21733e+02 252.465 -3.91758e+00 -1.23983e+01 0.00000e+00 0.00000e+00 3.54523e+02 252.465 2.67210e+02 72.465  0.9607 
1 1 1 -5  5   2  o 17 1.65894e+01 4.17499e-01 3.07699e+02 135.780 -2.06493e+00 2.00945e+00  0.00000e+00 0.00000e+00 1.92151e+02 135.780 1.15548e+02 315.780 0.8008 
1 1 1 -5  5   3  o 16 6.95659e+00 4.56928e-01 2.91861e+02 168.295 -1.50530e+00 3.11877e-01  0.00000e+00 0.00000e+00 1.33507e+02 348.295 4.25368e+02 348.295 0.6052 
1 1 1 -5  5   4  o 6  1.56477e+01 5.85079e-01 2.28819e+02 202.516 -2.81644e+00 -1.16753e+00 0.00000e+00 0.00000e+00 2.49778e+02 202.516 2.09590e+01 202.516 0.8135 
1 1 1 -5  5   5  o 12 3.81939e+01 7.64524e-01 7.88191e+02 246.087 -1.06720e+01 -2.40683e+01 0.00000e+00 0.00000e+00 6.19543e+02 246.087 1.68648e+02 66.087  0.9808 
1 1 1 -5  5   6  o 2  3.78492e+01 7.58301e-01 7.36505e+02 152.248 -2.54633e+01 1.33980e+01  0.00000e+00 0.00000e+00 6.60115e+02 152.248 7.63900e+01 332.248 0.9825 
1 1 1 -5  5   7  o 16 1.48234e+01 3.74019e-01 3.63083e+02 353.044 6.58842e+00  -8.03768e-01 0.00000e+00 0.00000e+00 1.49503e+02 353.044 2.13579e+02 173.044 0.9212 
1 1 1 -5  5   8  o 5  3.76979e+01 6.21624e-01 6.31118e+02 188.181 -3.71996e+01 -5.34827e+00 0.00000e+00 0.00000e+00 7.64022e+02 188.181 1.32904e+02 188.181 0.9866 
1 1 1 -5  5   9  o 17 1.61084e+01 3.65926e-01 4.23181e+02 133.648 -9.89602e+00 1.03743e+01  0.00000e+00 0.00000e+00 1.59169e+02 133.648 2.64012e+02 313.648 0.9645 
1 1 1 -5  5   10 o 11 1.99072e+01 4.00487e-01 2.46778e+02 212.183 -1.09101e+01 -6.86583e+00 0.00000e+00 0.00000e+00 4.69304e+02 212.183 2.22526e+02 212.183 0.9604 
1 1 1 -5  5   11 o 9  4.15123e+01 6.86258e-01 5.76600e+02 81.616  1.13785e+01  7.72061e+01  0.00000e+00 0.00000e+00 9.66928e+02 81.616  3.90329e+02 81.616  0.9936 
1 1 1 -5  5   12 o 1  3.19635e+00 7.78545e-01 1.39960e+02 201.971 -1.95434e+00 -7.88442e-01 0.00000e+00 0.00000e+00 5.45536e+01 21.971  1.94513e+02 21.971  0.7146 
1 1 1 -5  5   13 o 13 2.40969e+01 5.41154e-01 3.74392e+02 305.579 3.60384e+01  -5.03759e+01 0.00000e+00 0.00000e+00 5.18407e+02 305.579 1.44015e+02 305.579 0.9919 
1 1 1 -5  5   14 o 2  1.71969e+01 5.27878e-01 2.57481e+02 253.634 -1.15127e+01 -3.92034e+01 0.00000e+00 0.00000e+00 3.76314e+02 253.634 1.18834e+02 253.634 0.9877 
1 1 1 -5  5   15 o 10 8.37091e+00 7.83230e-01 1.19129e+02 172.918 -9.90998e+00 1.23113e+00  0.00000e+00 0.00000e+00 1.76829e+02 172.918 5.77000e+01 172.918 0.9485 
1 1 1 -5  5   16 o 3  5.94399e+00 9.94365e-01 7.74549e+01 61.597  2.72611e+00  5.04119e+00  0.00000e+00 0.00000e+00 1.23481e+02 61.597  4.60260e+01 61.597  0.9080 
1 1 1 -5  5   17 o 3  7.17110e+00 1.16392e+00 1.08876e+02 265.225 -8.39089e-01 -1.00447e+01 0.00000e+00 0.00000e+00 1.44196e+02 265.225 3.53207e+01 265.225 0.9490 
1 1 1 -5  5   18 o 18 9.32157e+00 1.27354e+00 1.19250e+02 102.555 -3.24318e+00 1.45625e+01  0.00000e+00 0.00000e+00 2.15134e+02 102.555 9.58842e+01 102.555 0.9659 
1 1 1 -5  5   19 o 7  4.96021e+00 1.48234e+00 8.64635e+01 40.418  4.36152e+00  3.71430e+00  0.00000e+00 0.00000e+00 8.05704e+01 40.418  5.89312e+00 220.418 0.9079 
1 1 1 -5  5   20 o 5  7.49557e+00 1.84874e+00 6.91463e+01 165.685 -5.39382e+00 1.37637e+00  0.00000e+00 0.00000e+00 1.82116e+02 165.685 1.12969e+02 165.685 0.9051 
1 1 1 -5  6   1  o 9  2.37695e+01 5.17304e-01 5.32020e+02 33.450  8.11102e+00  5.35831e+00  0.00000e+00 0.00000e+00 3.15215e+02 33.450  2.16805e+02 213.450 0.9471 
1 1 1 -5  6   2  o 15 1.66371e+01 4.13996e-01 1.36384e+02 239.213 -6.50782e-01 -1.09225e+00 0.00000e+00 0.00000e+00 1.98100e+02 239.213 6.17160e+01 239.213 0.5343 
1 1 1 -5  6   3  o 3  9.54601e+00 5.36096e-01 2.15701e+02 68.554  5.66065e-01  1.44104e+00  0.00000e+00 0.00000e+00 2.53330e+00 68.554  2.13168e+02 248.554 0.6078 
1 1 1 -5  6   4  o 11 1.53207e+01 4.02608e-01 2.21368e+02 303.564 1.59446e+00  -2.40311e+00 0.00000e+00 0.00000e+00 2.40018e+02 303.564 1.86498e+01 303.564 0.8010 
1 1 1 -5  6   5  o 4  3.19251e+00 5.28103e-01 1.93340e+01 45.951  3.76143e-02  3.88843e-02  0.00000e+00 0.00000e+00 1.60901e+01 225.951 3.54241e+01 225.951 0.0270 
1 1 1 -5  6   6  o 5  1.41421e+01 3.92506e-01 3.89999e+02 17.136  5.47422e+00  1.68786e+00  0.00000e+00 0.00000e+00 9.22373e+01 17.136  2.97762e+02 197.136 0.9079 
1 1 1 -5  6   7  o 2  1.97882e+01 4.24047e-01 3.98775e+02 277.240 1.22363e+00  -9.63253e+00 0.00000e+00 0.00000e+00 3.04622e+02 277.240 9.41537e+01 97.240  0.9470 
1 1 1 -5  6   8  o 15 2.18653e+01 4.14667e-01 4.04395e+02 172.597 -1.39235e+01 1.80898e+00  0.00000e+00 0.00000e+00 3.86009e+02 172.597 1.83856e+01 352.597 0.9637 
1 1 1 -5  6   9  o 13 2.69056e+01 4.76405e-01 6.74491e+02 6.135   3.77836e+01  4.06150e+00  0.00000e+00 0.00000e+00 3.20660e+02 6.135   3.53830e+02 186.135 0.9868 
1 1 1 -5  6   10 o 16 1.48070e+01 3.66493e-01 1.94310e+02 144.637 -6.16228e+00 4.37329e+00  0.00000e+00 0.00000e+00 3.22152e+02 144.637 1.27842e+02 144.637 0.9313 
1 1 1 -5  6   11 o 10 1.38083e+01 3.82069e-01 2.36883e+02 274.768 9.03927e-01  -1.08362e+01 0.00000e+00 0.00000e+00 2.55490e+02 274.768 1.86074e+01 274.768 0.9528 
1 1 1 -5  6   12 o 15 4.90572e+00 7.17812e-01 8.32617e+01 186.030 -1.92809e+00 -2.03663e-01 0.00000e+00 0.00000e+00 4.28319e+01 186.030 4.04297e+01 6.030   0.6875 
1 1 1 -5  6   13 o 19 5.41735e+00 7.91045e-01 7.67801e+01 262.829 -3.41711e-01 -2.71605e+00 0.00000e+00 0.00000e+00 8.27810e+01 262.829 6.00095e+00 262.829 0.7885 
1 1 1 -5  6   14 o 13 1.04228e+01 5.76615e-01 2.43768e+02 123.664 -1.28704e+01 1.93250e+01  0.00000e+00 0.00000e+00 1.36682e+02 123.664 1.07086e+02 303.664 0.9782 
1 1 1 -5  6   15 o 1  6.26213e+00 8.70028e-01 3.77887e+01 30.292  1.99203e+00  1.16367e+00  0.00000e+00 0.00000e+00 1.35466e+02 30.292  9.76776e+01 30.292  0.7423 
1 1 1 -5  6   16 o 13 6.33417e+00 9.66641e-01 9.13288e+01 182.981 -7.28185e+00 -3.79205e-01 0.00000e+00 0.00000e+00 1.27672e+02 182.981 3.63432e+01 182.981 0.9287 
1 1 1 -5  6   17 o 13 1.25946e+01 8.31205e-01 2.45488e+02 168.021 -4.64362e+01 9.85221e+00  0.00000e+00 0.00000e+00 2.17894e+02 168.021 2.75940e+01 348.021 0.9894 
1 1 1 -5  6   18 o 8  7.93064e+00 1.43669e+00 1.68810e+02 168.813 -1.58743e+01 3.13958e+00  0.00000e+00 0.00000e+00 1.16472e+02 168.813 5.23378e+01 348.813 0.9686 
1 1 1 -5  6   19 o 15 4.00682e+00 1.30043e+00 6.21686e+01 330.534 3.31164e+00  -1.87103e+00 0.00000e+00 0.00000e+00 6.49703e+01 330.534 2.80173e+00 330.534 0.8555 
1 1 1 -5  6   20 o 19 3.64775e+00 1.25130e+00 3.91823e+01 69.208  8.62560e-01  2.27167e+00  0.00000e+00 0.00000e+00 6.31117e+01 69.208  2.39294e+01 69.208  0.7572 
1 1 1 -5  7   1  o 6  1.26986e+01 3.72096e-01 4.37831e+02 246.124 -1.31587e+00 -2.97283e+00 0.00000e+00 0.00000e+00 4.26178e+01 66.124  4.80449e+02 66.124  0.8270 
1 1 1 -5  7   2  o 19 1.55883e+01 4.00890e-01 2.74190e+02 186.843 -3.48648e+00 -4.18371e-01 0.00000e+00 0.00000e+00 2.19461e+02 186.843 5.47290e+01 6.843   0.8417 
1 1 1 -5  7   3  o 3  1.81039e+01 5.04281e-01 4.47135e+02 256.654 -1.39621e+00 -5.88511e+00 0.00000e+00 0.00000e+00 1.74598e+02 256.654 2.72537e+02 76.654  0.9131 
1 1 1 -5  7   4  o 11 1.09244e+01 3.59877e-01 2.76743e+02 319.457 1.94498e+00  -1.66368e+00 0.00000e+00 0.00000e+00 4.00366e+01 319.457 2.36706e+02 139.457 0.7713 
1 1 1 -5  7   5  o 3  1.86203e+01 4.40486e-01 3.34056e+02 102.122 -1.25750e+00 5.85490e+00  0.00000e+00 0.00000e+00 3.04192e+02 102.122 2.98638e+01 282.122 0.9122 
1 1 1 -5  7   6  o 3  2.59712e+01 5.53531e-01 7.35312e+02 50.362  1.25874e+01  1.51950e+01  0.00000e+00 0.00000e+00 2.15036e+02 50.362  5.20276e+02 230.362 0.9743 
1 1 1 -5  7   7  o 7  2.32471e+01 4.64880e-01 5.96377e+02 204.384 -1.55021e+01 -7.02670e+00 0.00000e+00 0.00000e+00 2.50155e+02 204.384 3.46222e+02 24.384  0.9702 
1 1 1 -5  7   8  f 0  4.58210e+01 8.10483e-01 9.21813e+02 87.591  2.77502e+00  6.59700e+01  0.00000e+00 0.00000e+00 7.83851e+02 87.591  1.37963e+02 267.591 0.9924 
1 1 1 -5  7   9  f 0  6.23653e+00 3.83631e-01 2.36135e+02 291.526 1.13593e+00  -2.87990e+00 0.00000e+00 0.00000e+00 4.51923e+01 111.526 2.81327e+02 111.526 0.8168 
1 1 1 -5  7   10 o 14 7.36239e+00 3.84934e-01 2.50479e+02 68.484  1.77432e+00  4.50077e+00  0.00000e+00 0.00000e+00 5.20784e+00 248.484 2.55687e+02 248.484 0.8895 
1 1 1 -5  7   11 o 12 1.29822e+01 4.03668e-01 2.53465e+02 88.253  3.32947e-01  1.09147e+01  0.00000e+00 0.00000e+00 2.09542e+02 88.253  4.39233e+01 268.253 0.9531 
1 1 1 -5  7   12 o 9  2.14348e+01 4.68889e-01 3.53190e+02 251.437 -1.17417e+01 -3.49639e+01 0.00000e+00 0.00000e+00 4.37272e+02 251.437 8.40822e+01 251.437 0.9863 
1 1 1 -5  7   13 o 15 2.14598e+01 5.45250e-01 4.63927e+02 246.001 -2.87682e+01 -6.46167e+01 0.00000e+00 0.00000e+00 3.31950e+02 246.001 1.31977e+02 66.001  0.9929 
1 1 1 -5  7   14 o 11 2.07959e+01 5.56610e-01 3.87312e+02 68.733  2.67858e+01  6.88191e+01  0.00000e+00 0.00000e+00 3.83384e+02 68.733  3.92786e+00 248.733 0.9932 
1 1 1 -5  7   15 o 9  1.73451e+01 5.56063e-01 2.97778e+02 206.295 -4.91175e+01 -2.42702e+01 0.00000e+00 0.00000e+00 3.42796e+02 206.295 4.50179e+01 206.295 0.9908 
1 1 1 -5  7   16 o 12 8.17265e+00 8.85308e-01 1.48946e+02 6.878   1.57873e+01  1.90442e+00  0.00000e+00 0.00000e+00 1.45595e+02 6.878   3.35002e+00 186.878 0.9680 
1 1 1 -5  7   17 o 17 9.39159e+00 9.97369e-01 1.38172e+02 181.871 -1.83185e+01 -5.98373e-01 0.00000e+00 0.00000e+00 2.01391e+02 181.871 6.32199e+01 181.871 0.9723 
1 1 1 -5  7   18 o 10 1.36646e+01 1.03459e+00 2.53366e+02 346.106 5.22696e+01  -1.29296e+01 0.00000e+00 0.00000e+00 2.49374e+02 346.106 3.99248e+00 166.106 0.9907 
1 1 1 -5  7   19 f 0  4.48835e+00 1.39796e+00 1.35535e+02 182.616 -8.63378e+00 -3.94442e-01 0.00000e+00 0.00000e+00 2.09820e+01 182.616 1.14553e+02 2.616   0.9402 
1 1 1 -5  7   20 o 12 4.63940e+00 1.46264e+00 1.18112e+02 356.738 7.87664e+00  -4.48914e-01 0.00000e+00 0.00000e+00 4.24260e+01 356.738 7.56859e+01 176.738 0.9343 
1 1 1 -5  8   1  f 0  2.17040e+01 5.66394e-01 2.52635e+02 267.513 -1.37363e-01 -3.16216e+00 0.00000e+00 0.00000e+00 4.18366e+02 267.513 1.65731e+02 267.513 0.8215 
1 1 1 -5  8   2  o 14 2.23916e+01 6.01550e-01 4.79409e+02 252.502 -2.61821e+00 -8.30501e+00 0.00000e+00 0.00000e+00 3.13074e+02 252.502 1.66335e+02 72.502  0.9407 
1 1 1 -5  8   3  o 5  2.41827e+01 5.22775e-01 4.69180e+02 120.549 -4.27516e+00 7.24363e+00  0.00000e+00 0.00000e+00 3.84413e+02 120.549 8.47671e+01 300.549 0.9385 
1 1 1 -5  8   4  o 8  1.28236e+01 3.77812e-01 3.20312e+02 0.030   3.20699e+00  1.65145e-03  0.00000e+00 0.00000e+00 7.70268e+01 0.030   2.43285e+02 180.029 0.8242 
1 1 1 -5  8   5  f 0  7.70397e+00 3.61680e-01 1.42298e+02 347.793 1.02877e+00  -2.22561e-01 0.00000e+00 0.00000e+00 7.77094e+00 167.793 1.50068e+02 167.793 0.4647 
1 1 1 -5  8   6  o 17 7.52842e+00 3.61991e-01 1.12052e+02 234.672 -5.89590e-01 -8.31842e-01 0.00000e+00 0.00000e+00 1.61104e+01 234.672 9.59417e+01 54.672  0.4533 
1 1 1 -5  8   7  o 5  2.64339e+01 5.10158e-01 4.77184e+02 75.291  3.92133e+00  1.49378e+01  0.00000e+00 0.00000e+00 4.82298e+02 75.291  5.11477e+00 75.291  0.9671 
1 1 1 -5  8   8  o 4  2.70276e+01 5.20557e-01 4.01227e+02 40.782  1.27207e+01  1.09731e+01  0.00000e+00 0.00000e+00 5.81898e+02 40.782  1.80671e+02 40.782  0.9698 
1 1 1 -5  8   9  o 9  2.52219e+01 4.53349e-01 4.41702e+02 213.547 -1.94557e+01 -1.29003e+01 0.00000e+00 0.00000e+00 4.83185e+02 213.547 4.14828e+01 213.547 0.9783 
1 1 1 -5  8   10 o 5  3.88759e+01 6.42695e-01 6.84215e+02 224.297 -5.19123e+01 -5.06542e+01 0.00000e+00 0.00000e+00 7.61715e+02 224.297 7.74998e+01 224.297 0.9931 
1 1 1 -5  8   11 o 15 1.36948e+01 3.73054e-01 2.13499e+02 207.935 -8.57818e+00 -4.54861e+00 0.00000e+00 0.00000e+00 2.71820e+02 207.935 5.83215e+01 207.935 0.9470 
1 1 1 -5  8   12 o 19 2.06153e+01 4.62098e-01 4.26984e+02 299.369 2.05925e+01  -3.65913e+01 0.00000e+00 0.00000e+00 3.34527e+02 299.369 9.24568e+01 119.369 0.9880 
1 1 1 -5  8   13 o 8  1.59717e+01 4.44451e-01 3.03118e+02 101.993 -7.23889e+00 3.40755e+01  0.00000e+00 0.00000e+00 2.84814e+02 101.993 1.83041e+01 281.993 0.9855 
1 1 1 -5  8   14 o 5  8.53368e+00 6.47260e-01 1.83751e+02 318.508 1.05768e+01  -9.35499e+00 0.00000e+00 0.00000e+00 1.23174e+02 318.508 6.05772e+01 138.508 0.9639 
1 1 1 -5  8   15 o 19 1.12834e+01 6.05211e-01 2.55052e+02 243.879 -1.32825e+01 -2.70876e+01 0.00000e+00 0.00000e+00 1.58476e+02 243.879 9.65755e+01 63.879  0.9833 
1 1 1 -5  8   16 f 0  9.87487e+00 8.32680e-01 1.31661e+02 11.784  1.61858e+01  3.37666e+00  0.00000e+00 0.00000e+00 2.24678e+02 11.784  9.30175e+01 11.784  0.9693 
1 1 1 -5  8   17 o 10 1.37421e+01 8.19310e-01 2.27267e+02 94.904  -3.85150e+00 4.48891e+01  0.00000e+00 0.00000e+00 2.78023e+02 94.904  5.07561e+01 94.904  0.9888 
1 1 1 -5  8   18 o 16 4.00611e+00 1.26255e+00 2.35962e+01 125.070 -6.93578e-01 9.87974e-01  0.00000e+00 0.00000e+00 5.30205e+01 125.070 2.94242e+01 125.070 0.5150 
1 1 1 -5  8   19 o 19 6.99846e+00 1.63944e+00 1.41472e+02 191.879 -1.15336e+01 -2.42619e+00 0.00000e+00 0.00000e+00 1.06817e+02 191.879 3.46559e+01 11.879  0.9566 
1 1 1 -5  8   20 o 3  3.98636e+00 1.34229e+00 9.28702e+01 49.907  3.77131e+00  4.47973e+00  0.00000e+00 0.00000e+00 4.14900e+01 49.907  5.13802e+01 229.907 0.9101 
1 1 1 -5  9   1  f 0  2.36867e+01 5.19286e-01 1.33766e+02 33.204  1.51295e+00  9.90214e-01  0.00000e+00 0.00000e+00 4.57792e+02 33.204  3.24026e+02 33.204  0.6636 
1 1 1 -5  9   2  o 1  1.12221e+01 4.16645e-01 1.96749e+02 274.174 1.29350e-01  -1.77254e+00 0.00000e+00 0.00000e+00 8.08854e+01 274.174 1.15863e+02 94.174  0.6576 
1 1 1 -5  9   3  o 6  8.27013e+00 3.46126e-01 2.92655e+02 155.426 -1.62151e+00 7.41482e-01  0.00000e+00 0.00000e+00 8.77732e+01 335.426 3.80429e+02 335.426 0.6587 
1 1 1 -5  9   4  o 12 1.58712e+01 4.76331e-01 1.71310e+02 173.354 -2.09304e+00 2.43881e-01  0.00000e+00 0.00000e+00 2.55067e+02 173.354 8.37573e+01 173.354 0.7146 
1 1 1 -5  9   5  o 17 1.22160e+01 3.67156e-01 2.04597e+02 152.466 -2.11879e+00 1.10459e+00  0.00000e+00 0.00000e+00 1.40777e+02 152.466 6.38198e+01 332.466 0.7524 
1 1 1 -5  9   6  o 15 3.13883e+01 5.84866e-01 6.19698e+02 192.834 -2.27472e+01 -5.18228e+00 0.00000e+00 0.00000e+00 5.33549e+02 192.834 8.61481e+01 12.834  0.9783 
1 1 1 -5  9   7  o 9  1.83320e+01 4.77140e-01 3.21823e+02 78.567  1.43023e+00  7.07215e+00  0.00000e+00 0.00000e+00 3.16593e+02 78.567  5.22954e+00 258.567 0.9279 
1 1 1 -5  9   8  o 6  3.65867e+01 6.65003e-01 4.76700e+02 194.843 -2.59486e+01 -6.87677e+00 0.00000e+00 0.00000e+00 8.69787e+02 194.843 3.93087e+02 194.843 0.9812 
1 1 1 -5  9   9  o 4  2.26816e+01 4.21434e-01 3.26814e+02 208.859 -1.36041e+01 -7.49718e+00 0.00000e+00 0.00000e+00 4.95477e+02 208.859 1.68663e+02 208.859 0.9673 
1 1 1 -5  9   10 f 0  1.50231e+01 3.90868e-01 3.55241e+02 141.073 -1.14650e+01 9.26013e+00  0.00000e+00 0.00000e+00 1.87963e+02 141.073 1.67279e+02 321.073 0.9655 
1 1 1 -5  9   11 o 6  2.27760e+01 4.45011e-01 3.54357e+02 341.016 2.52291e+01  -8.67927e+00 0.00000e+00 0.00000e+00 4.81796e+02 341.016 1.27439e+02 341.016 0.9811 
1 1 1 -5  9   12 o 12 2.55618e+01 5.14292e-01 3.94746e+02 164.824 -4.61975e+01 1.25308e+01  0.00000e+00 0.00000e+00 5.50878e+02 164.824 1.56132e+02 164.824 0.9895 
1 1 1 -5  9   13 o 15 1.36688e+01 4.61223e-01 2.80021e+02 74.544  7.31968e+00  2.64737e+01  0.00000e+00 0.00000e+00 2.21130e+02 74.544  5.88911e+01 254.544 0.9816 
1 1 1 -5  9   14 o 15 8.03144e+00 6.13587e-01 1.99729e+02 345.932 1.41047e+01  -3.53441e+00 0.00000e+00 0.00000e+00 8.94436e+01 345.932 1.10286e+02 165.932 0.9650 
1 1 1 -5  9   15 o 2  2.46441e+01 6.73716e-01 4.82911e+02 184.719 -1.22167e+02 -1.00849e+01 0.00000e+00 0.00000e+00 4.31851e+02 184.719 5.10596e+01 4.719   0.9959 
1 1 1 -5  9   16 o 17 5.72153e+00 1.01087e+00 1.01849e+02 55.801  3.86329e+00  5.68483e+00  0.00000e+00 0.00000e+00 9.49852e+01 55.801  6.86425e+00 235.801 0.9241 
1 1 1 -5  9   17 o 17 3.94812e+00 1.15612e+00 9.76459e+01 19.637  4.44328e+00  1.58543e+00  0.00000e+00 0.00000e+00 3.24815e+01 19.637  6.51644e+01 199.637 0.8864 
1 1 1 -5  9   18 o 11 5.58711e+00 1.41290e+00 1.25184e+02 219.633 -6.27726e+00 -5.19913e+00 0.00000e+00 0.00000e+00 6.91214e+01 219.633 5.60626e+01 39.633  0.9365 
1 1 1 -5  9   19 o 18 4.09422e+00 1.31556e+00 6.07864e+01 289.612 1.26034e+00  -3.53716e+00 0.00000e+00 0.00000e+00 6.87944e+01 289.612 8.00796e+00 289.612 0.8534 
1 1 1 -5  9   20 o 13 4.32146e+00 1.39661e+00 3.30904e+01 327.431 1.92423e+00  -1.22912e+00 0.00000e+00 0.00000e+00 8.52191e+01 327.431 5.21287e+01 327.431 0.7392 
1 1 1 -5  10  1  o 5  2.16366e+01 4.87303e-01 4.52984e+02 44.770  3.92096e+00  3.88965e+00  0.00000e+00 0.00000e+00 2.83286e+02 44.770  1.69698e+02 224.770 0.9042 
1 1 1 -5  10  2  o 13 2.27886e+01 5.00734e-01 2.39000e+02 358.974 4.32821e+00  -7.75097e-02 0.00000e+00 0.00000e+00 5.11234e+02 358.974 2.72234e+02 358.974 0.8751 
1 1 1 -5  10  3  o 14 1.92163e+01 4.48896e-01 5.18627e+02 185.038 -7.58122e+00 -6.68281e-01 0.00000e+00 0.00000e+00 1.54753e+02 185.038 3.63873e+02 5.038   0.9318 
1 1 1 -5  10  4  o 11 9.13963e+00 5.34290e-01 7.38854e+01 305.955 3.04990e-01  -4.20480e-01 0.00000e+00 0.00000e+00 1.24696e+01 305.955 6.14158e+01 125.955 0.2513 
1 1 1 -5  10  5  o 3  1.99437e+01 4.57157e-01 3.81028e+02 62.064  3.38340e+00  6.38033e+00  0.00000e+00 0.00000e+00 3.14338e+02 62.064  6.66899e+01 242.064 0.9279 
1 1 1 -5  10  6  o 12 2.64433e+01 5.17136e-01 5.98343e+02 266.457 -1.17087e+00 -1.89129e+01 0.00000e+00 0.00000e+00 3.68147e+02 266.457 2.30195e+02 86.457  0.9732 
1 1 1 -5  10  7  o 5  2.02545e+01 4.29435e-01 4.20554e+02 247.657 -4.23354e+00 -1.03003e+01 0.00000e+00 0.00000e+00 3.04656e+02 247.657 1.15898e+02 67.657  0.9540 
1 1 1 -5  10  8  o 19 1.67940e+01 3.89281e-01 3.49670e+02 49.139  5.95328e+00  6.88200e+00  0.00000e+00 0.00000e+00 2.44531e+02 49.139  1.05139e+02 229.138 0.9433 
1 1 1 -5  10  9  o 16 2.69983e+01 4.74510e-01 5.13443e+02 274.393 2.21806e+00  -2.88749e+01 0.00000e+00 0.00000e+00 4.80827e+02 274.393 3.26156e+01 94.393  0.9826 
1 1 1 -5  10  10 o 4  3.11426e+01 5.35010e-01 6.34778e+02 159.678 -5.08012e+01 1.88141e+01  0.00000e+00 0.00000e+00 5.20717e+02 159.678 1.14061e+02 339.678 0.9907 
1 1 1 -5  10  11 o 6  3.71137e+01 6.44944e-01 5.70325e+02 327.573 6.30794e+01  -4.00724e+01 0.00000e+00 0.00000e+00 8.09111e+02 327.573 2.38786e+02 327.573 0.9933 
1 1 1 -5  10  12 o 4  2.34564e+01 4.65449e-01 4.93152e+02 112.333 -2.09174e+01 5.09180e+01  0.00000e+00 0.00000e+00 3.75770e+02 112.333 1.17382e+02 292.333 0.9909 
1 1 1 -5  10  13 o 7  1.67706e+01 4.44859e-01 3.12908e+02 179.893 -3.77043e+01 7.01275e-02  0.00000e+00 0.00000e+00 3.05098e+02 179.893 7.80977e+00 359.893 0.9866 
1 1 1 -5  10  14 o 9  6.78198e+00 7.18808e-01 1.48578e+02 51.206  5.58684e+00  6.95007e+00  0.00000e+00 0.00000e+00 8.98227e+01 51.206  5.87549e+01 231.206 0.9421 
1 1 1 -5  10  15 o 11 1.07800e+01 6.46274e-01 1.66401e+02 175.162 -2.01502e+01 1.70567e+00  0.00000e+00 0.00000e+00 2.25310e+02 175.162 5.89093e+01 175.162 0.9750 
1 1 1 -5  10  16 o 14 1.81997e+01 6.25396e-01 2.67991e+02 338.146 6.19427e+01  -2.48435e+01 0.00000e+00 0.00000e+00 4.04444e+02 338.146 1.36453e+02 338.146 0.9925 
1 1 1 -5  10  17 o 11 5.68788e+00 1.21868e+00 1.32278e+02 269.750 -3.88278e-02 -8.90259e+00 0.00000e+00 0.00000e+00 6.69539e+01 269.750 6.53241e+01 89.750  0.9420 
1 1 1 -5  10  18 o 6  6.41960e+00 1.40067e+00 1.35869e+02 87.535  4.40306e-01  1.02271e+01  0.00000e+00 0.00000e+00 9.05635e+01 87.535  4.53051e+01 267.535 0.9498 
1 1 1 -5  10  19 o 6  9.94046e+00 1.90235e+00 1.36328e+02 165.002 -1.26135e+01 3.37940e+00  0.00000e+00 0.00000e+00 2.17914e+02 165.002 8.15861e+01 165.002 0.9609 
1 1 1 -5  10  20 o 10 5.42496e+00 1.71750e+00 4.52465e+01 109.937 -1.03144e+00 2.84355e+00  0.00000e+00 0.00000e+00 1.17852e+02 109.937 7.26060e+01 109.937 0.8118 
1 1 1 -5  11  1  o 9  3.04006e+01 6.28687e-01 5.91346e+02 108.511 -3.16671e+00 9.45838e+00  0.00000e+00 0.00000e+00 4.93710e+02 108.511 9.76363e+01 288.511 0.9485 
1 1 1 -5  11  2  o 17 1.27211e+01 4.94492e-01 2.21033e+02 190.217 -2.17272e+00 -3.91593e-01 0.00000e+00 0.00000e+00 1.27893e+02 190.217 9.31404e+01 10.217  0.7291 
1 1 1 -5  11  3  o 10 3.45110e+01 1.00915e+00 6.93855e+02 236.219 -9.95344e+00 -1.48790e+01 0.00000e+00 0.00000e+00 5.67209e+02 236.219 1.26646e+02 56.219  0.9717 
1 1 1 -5  11  4  o 18 1.34509e+01 3.72765e-01 1.61154e+02 316.007 1.19356e+00  -1.15233e+00 0.00000e+00 0.00000e+00 1.58947e+02 316.007 2.20702e+00 136.007 0.6331 
1 1 1 -5  11  5  o 17 2.45001e+01 5.26985e-01 6.43333e+02 148.441 -1.26857e+01 7.79165e+00  0.00000e+00 0.00000e+00 2.45743e+02 148.441 3.97589e+02 328.441 0.9658 
1 1 1 -5  11  6  o 5  2.04942e+01 4.33494e-01 4.97277e+02 312.349 8.20877e+00  -9.00579e+00 0.00000e+00 0.00000e+00 2.40056e+02 312.349 2.57221e+02 132.349 0.9580 
1 1 1 -5  11  7  o 4  5.21885e+01 9.16475e-01 1.17239e+03 9.267   7.75358e+01  1.26513e+01  0.00000e+00 0.00000e+00 7.73774e+02 9.267   3.98614e+02 189.267 0.9936 
1 1 1 -5  11  8  o 17 1.35577e+01 3.57377e-01 3.88225e+02 209.547 -7.08733e+00 -4.01750e+00 0.00000e+00 0.00000e+00 8.79528e+01 209.547 3.00272e+02 29.547  0.9364 
1 1 1 -5  11  9  o 9  3.03466e+01 5.74605e-01 6.02094e+02 209.599 -3.30130e+01 -1.87535e+01 0.00000e+00 0.00000e+00 5.20185e+02 209.599 8.19092e+01 29.599  0.9867 
1 1 1 -5  11  10 o 7  4.60579e+01 7.43576e-01 9.54886e+02 80.557  1.94899e+01  1.17181e+02  0.00000e+00 0.00000e+00 7.62690e+02 80.557  1.92196e+02 260.557 0.9958 
1 1 1 -5  11  11 o 13 2.31798e+01 4.58684e-01 4.58167e+02 278.624 5.69277e+00  -3.75357e+01 0.00000e+00 0.00000e+00 3.97674e+02 278.624 6.04927e+01 98.624  0.9867 
1 1 1 -5  11  12 o 15 1.28159e+01 4.03591e-01 1.64712e+02 105.842 -2.75213e+00 9.69839e+00  0.00000e+00 0.00000e+00 2.89979e+02 105.842 1.25266e+02 105.842 0.9490 
1 1 1 -5  11  13 o 18 9.30709e+00 4.57465e-01 2.45476e+02 14.154  1.58795e+01  4.00469e+00  0.00000e+00 0.00000e+00 9.13403e+01 14.154  1.54136e+02 194.154 0.9690 
1 1 1 -5  11  14 o 6  3.74127e+00 9.04936e-01 9.67273e+01 158.841 -2.84285e+00 1.10035e+00  0.00000e+00 0.00000e+00 1.68259e+01 158.841 7.99014e+01 338.841 0.8135 
1 1 1 -5  11  15 o 16 4.43192e+00 9.69984e-01 4.07706e+01 300.331 9.26289e-01  -1.58315e+00 0.00000e+00 0.00000e+00 6.96622e+01 300.331 2.88916e+01 300.331 0.6686 
1 1 1 -5  11  16 o 10 8.58091e+00 9.37684e-01 1.15737e+02 333.934 1.08516e+01  -5.30807e+00 0.00000e+00 0.00000e+00 1.90179e+02 333.934 7.44425e+01 333.934 0.9577 
1 1 1 -5  11  17 o 11 7.25291e+00 1.55843e+00 1.66920e+02 129.799 -7.59095e+00 9.11115e+00  0.00000e+00 0.00000e+00 9.11208e+01 129.799 7.57989e+01 309.799 0.9569 
1 1 1 -5  11  18 o 8  5.31434e+00 1.54066e+00 5.76416e+01 327.974 2.79586e+00  -1.74878e+00 0.00000e+00 0.00000e+00 1.06114e+02 327.974 4.84722e+01 327.974 0.8298 
1 1 1 -5  11  19 o 4  4.10113e+00 1.40840e+00 6.42441e+01 128.238 -2.21927e+00 2.81633e+00  0.00000e+00 0.00000e+00 6.43410e+01 128.238 9.68970e-02 128.238 0.8455 
1 1 1 -5  11  20 o 13 5.36485e+00 1.75983e+00 9.99708e+01 244.391 -2.76324e+00 -5.76511e+00 0.00000e+00 0.00000e+00 8.24281e+01 244.391 1.75427e+01 64.391  0.9181 
1 1 1 -5  12  1  o 6  1.32649e+01 4.35738e-01 4.19279e+02 114.682 -1.88124e+00 4.09347e+00  0.00000e+00 0.00000e+00 2.02186e+01 114.682 3.99060e+02 294.682 0.8805 
1 1 1 -5  12  2  o 6  6.59226e+00 3.52828e-01 1.22076e+02 234.722 -3.55792e-01 -5.02913e-01 0.00000e+00 0.00000e+00 4.90974e+01 54.722  1.71174e+02 54.722  0.2943 
1 1 1 -5  12  3  o 18 5.62953e+00 3.75918e-01 1.10677e+02 47.518  3.15242e-01  3.44239e-01  0.00000e+00 0.00000e+00 6.25671e+01 227.518 1.73244e+02 227.518 0.2273 
1 1 1 -5  12  4  o 11 1.47447e+01 4.49438e-01 4.39163e+02 10.529  5.50071e+00  1.02234e+00  0.00000e+00 0.00000e+00 6.27523e+01 10.529  3.76411e+02 190.529 0.9056 
1 1 1 -5  12  5  o 6  2.30027e+01 5.05262e-01 4.12207e+02 347.632 8.40908e+00  -1.84387e+00 0.00000e+00 0.00000e+00 4.00189e+02 347.632 1.20174e+01 167.632 0.9400 
1 1 1 -5  12  6  o 14 1.53501e+01 3.78052e-01 3.01983e+02 80.047  8.91455e-01  5.08014e+00  0.00000e+00 0.00000e+00 2.15024e+02 80.047  8.69583e+01 260.047 0.8969 
1 1 1 -5  12  7  o 7  1.66989e+01 5.33176e-01 4.87312e+02 340.986 9.99006e+00  -3.44251e+00 0.00000e+00 0.00000e+00 1.08953e+02 340.986 3.78358e+02 160.986 0.9514 
1 1 1 -5  12  8  o 10 1.01328e+01 4.42787e-01 1.23767e+02 190.214 -2.34469e+00 -4.22461e-01 0.00000e+00 0.00000e+00 1.61855e+02 190.214 3.80881e+01 190.214 0.7516 
1 1 1 -5  12  9  o 7  5.77910e+01 9.19237e-01 1.09013e+03 208.083 -1.18141e+02 -6.30375e+01 0.00000e+00 0.00000e+00 1.06764e+03 208.083 2.24926e+01 28.083  0.9963 
1 1 1 -5  12  10 o 2  2.63913e+01 4.68004e-01 5.78680e+02 267.048 -2.21482e+00 -4.29463e+01 0.00000e+00 0.00000e+00 3.98071e+02 267.048 1.80609e+02 87.048  0.9883 
1 1 1 -5  12  11 o 3  8.16441e+00 3.82201e-01 1.36228e+02 12.437  3.89418e+00  8.58794e-01  0.00000e+00 0.00000e+00 1.27422e+02 12.437  8.80561e+00 192.436 0.8630 
1 1 1 -5  12  12 o 15 1.68648e+01 4.96025e-01 2.75836e+02 116.859 -1.07300e+01 2.11874e+01  0.00000e+00 0.00000e+00 3.41203e+02 116.859 6.53669e+01 116.859 0.9787 
1 1 1 -5  12  13 o 6  1.31489e+01 4.69285e-01 3.46865e+02 314.737 2.43076e+01  -2.45318e+01 0.00000e+00 0.00000e+00 1.37043e+02 314.737 2.09821e+02 134.737 0.9854 
1 1 1 -5  12  14 o 6  6.39836e+00 1.16652e+00 1.67372e+02 63.165  3.75419e+00  7.42084e+00  0.00000e+00 0.00000e+00 5.64930e+01 63.165  1.10879e+02 243.165 0.9378 
1 1 1 -5  12  15 o 2  6.76048e+00 1.22389e+00 1.16120e+02 105.720 -1.95218e+00 6.93561e+00  0.00000e+00 0.00000e+00 1.17628e+02 105.720 1.50811e+00 105.720 0.9278 
1 1 1 -5  12  16 o 12 1.11882e+01 1.07721e+00 1.93919e+02 285.216 6.50864e+00  -2.39285e+01 0.00000e+00 0.00000e+00 2.14079e+02 285.216 2.01603e+01 285.216 0.9796 
1 1 1 -5  12  17 o 7  5.63916e+00 1.54087e+00 1.40019e+02 111.411 -3.08635e+00 7.87117e+00  0.00000e+00 0.00000e+00 5.68261e+01 111.411 8.31932e+01 291.411 0.9389 
1 1 1 -5  12  18 o 13 5.10538e+00 1.54357e+00 5.25202e+01 52.676  1.74627e+00  2.29033e+00  0.00000e+00 0.00000e+00 9.92783e+01 52.676  4.67581e+01 52.676  0.8007 
1 1 1 -5  12  19 o 9  5.27250e+00 1.66750e+00 7.80984e+01 38.025  3.67406e+00  2.87309e+00  0.00000e+00 0.00000e+00 9.49322e+01 38.025  1.68338e+01 38.025  0.8850 
1 1 1 -5  12  20 f 0  4.70565e+00 1.59957e+00 5.08066e+01 325.398 2.66144e+00  -1.83610e+00 0.00000e+00 0.00000e+00 9.31073e+01 325.398 4.23007e+01 325.398 0.8259 
1 1 1 -5  13  1  o 14 2.36143e+01 4.90247e-01 3.76954e+02 96.654  -8.22146e-01 7.04752e+00  0.00000e+00 0.00000e+00 4.46385e+02 96.654  6.94310e+01 96.654  0.9266 
1 1 1 -5  13  2  o 12 7.53669e+00 3.30406e-01 4.50637e+01 317.558 1.89329e-01  -1.73135e-01 0.00000e+00 0.00000e+00 8.99113e+00 137.558 5.40548e+01 137.558 0.1272 
1 1 1 -5  13  3  o 12 2.14570e+01 4.81028e-01 3.03766e+02 173.918 -5.65761e+00 6.02826e-01  0.00000e+00 0.00000e+00 4.28275e+02 173.918 1.24509e+02 173.918 0.9072 
1 1 1 -5  13  4  o 19 2.19588e+01 5.79848e-01 2.53270e+02 14.903  4.59702e+00  1.22346e+00  0.00000e+00 0.00000e+00 4.79216e+02 14.903  2.25945e+02 14.903  0.8874 
1 1 1 -5  13  5  o 17 1.89941e+01 4.44286e-01 4.39553e+02 80.423  1.25539e+00  7.44038e+00  0.00000e+00 0.00000e+00 2.24948e+02 80.423  2.14605e+02 260.423 0.9312 
1 1 1 -5  13  6  o 17 2.50652e+01 4.96080e-01 4.86194e+02 93.792  -8.91568e-01 1.34503e+01  0.00000e+00 0.00000e+00 4.19408e+02 93.792  6.67865e+01 273.792 0.9622 
1 1 1 -5  13  7  o 7  9.96263e+00 4.82881e-01 2.35504e+02 241.085 -1.47142e+00 -2.66378e+00 0.00000e+00 0.00000e+00 6.85073e+01 241.085 1.66997e+02 61.085  0.8131 
1 1 1 -5  13  8  o 8  3.34450e+01 6.14544e-01 6.30224e+02 115.636 -1.71737e+01 3.57871e+01  0.00000e+00 0.00000e+00 6.08177e+02 115.636 2.20469e+01 295.636 0.9873 
1 1 1 -5  13  9  o 9  2.57543e+01 4.58141e-01 5.26072e+02 193.265 -2.87117e+01 -6.76886e+00 0.00000e+00 0.00000e+00 4.22604e+02 193.265 1.03468e+02 13.265  0.9829 
1 1 1 -5  13  10 o 18 4.67637e+01 7.52916e-01 7.22495e+02 337.414 8.61534e+01  -3.58372e+01 0.00000e+00 0.00000e+00 1.01926e+03 337.414 2.96768e+02 337.414 0.9946 
1 1 1 -5  13  11 o 10 8.13478e+00 5.31929e-01 1.63801e+02 223.851 -3.40895e+00 -3.27492e+00 0.00000e+00 0.00000e+00 1.06066e+02 223.851 5.77349e+01 43.851  0.8866 
1 1 1 -5  13  12 o 16 2.56857e+01 6.88336e-01 5.24596e+02 309.519 4.27797e+01  -5.18602e+01 0.00000e+00 0.00000e+00 4.28413e+02 309.519 9.61830e+01 129.519 0.9925 
1 1 1 -5  13  13 o 5  5.28411e+00 9.44951e-01 1.59244e+02 192.296 -5.67875e+00 -1.23780e+00 0.00000e+00 0.00000e+00 2.02032e+01 192.296 1.39041e+02 12.296  0.9093 
1 1 1 -5  13  14 o 19 1.69980e+01 7.94985e-01 2.92574e+02 35.928  3.49405e+01  2.53189e+01  0.00000e+00 0.00000e+00 3.34184e+02 35.928  4.16100e+01 35.928  0.9883 
1 1 1 -5  13  15 o 6  1.34947e+01 8.95227e-01 2.50333e+02 206.852 -3.13802e+01 -1.58873e+01 0.00000e+00 0.00000e+00 2.45368e+02 206.852 4.96517e+00 26.852  0.9857 
1 1 1 -5  13  16 o 4  3.54303e+00 1.14268e+00 9.58752e+00 234.873 -2.23329e-01 -3.17450e-01 0.00000e+00 0.00000e+00 1.55372e+01 234.873 5.94969e+00 234.873 0.1905 
1 1 1 -5  13  17 o 2  1.45941e+01 1.39839e+00 2.10693e+02 70.442  1.20196e+01  3.38337e+01  0.00000e+00 0.00000e+00 3.24292e+02 70.442  1.13599e+02 70.442  0.9860 
1 1 1 -5  13  18 f 0  6.85262e+00 1.62121e+00 1.97371e+02 3.396   1.46424e+01  8.68884e-01  0.00000e+00 0.00000e+00 4.82467e+01 3.396   1.49124e+02 183.396 0.9653 
1 1 1 -5  13  19 o 8  4.73644e+00 1.53090e+00 1.06808e+02 171.496 -6.23708e+00 9.32588e-01  0.00000e+00 0.00000e+00 5.42300e+01 171.496 5.25777e+01 351.496 0.9169 
1 1 1 -5  14  1  o 6  1.40395e+01 3.72554e-01 3.28079e+02 98.815  -5.54611e-01 3.57644e+00  0.00000e+00 0.00000e+00 1.19415e+02 98.815  2.08664e+02 278.815 0.8471 
1 1 1 -5  14  2  f 0  8.02842e+00 3.30396e-01 3.08900e+02 278.258 2.65331e-01  -1.82821e+00 0.00000e+00 0.00000e+00 1.06244e+02 98.258  4.15144e+02 98.258  0.6710 
1 1 1 -5  14  3  o 14 1.55041e+01 3.79597e-01 3.07380e+02 311.920 2.75204e+00  -3.06507e+00 0.00000e+00 0.00000e+00 1.98641e+02 311.920 1.08739e+02 131.920 0.8680 
1 1 1 -5  14  4  o 13 1.56593e+01 3.98739e-01 2.54920e+02 214.646 -2.79387e+00 -1.93070e+00 0.00000e+00 0.00000e+00 2.36841e+02 214.646 1.80781e+01 34.646  0.8355 
1 1 1 -5  14  5  o 17 3.27098e+01 6.06277e-01 6.77321e+02 16.738  1.90095e+01  5.71676e+00  0.00000e+00 0.00000e+00 5.20206e+02 16.738  1.57115e+02 196.738 0.9745 
1 1 1 -5  14  6  o 8  4.05080e+01 9.58540e-01 5.70295e+02 218.094 -1.97570e+01 -1.54882e+01 0.00000e+00 0.00000e+00 9.20143e+02 218.094 3.49848e+02 218.094 0.9799 
1 1 1 -5  14  7  o 12 2.15758e+01 5.43153e-01 3.28802e+02 167.685 -8.86161e+00 1.93465e+00  0.00000e+00 0.00000e+00 4.34839e+02 167.685 1.06037e+02 167.685 0.9431 
1 1 1 -5  14  8  o 7  3.07378e+01 5.74646e-01 5.57943e+02 270.088 4.95107e-02  -3.22741e+01 0.00000e+00 0.00000e+00 5.76787e+02 270.088 1.88436e+01 270.088 0.9844 
1 1 1 -5  14  9  o 12 3.80798e+01 6.91014e-01 7.05819e+02 203.099 -5.31584e+01 -2.26735e+01 0.00000e+00 0.00000e+00 7.08820e+02 203.099 3.00151e+00 203.099 0.9913 
1 1 1 -5  14  10 o 15 3.93410e+00 4.13279e-01 5.03715e+01 40.336  4.25332e-01  3.61168e-01  0.00000e+00 0.00000e+00 1.07922e+01 220.336 6.11637e+01 220.336 0.2687 
1 1 1 -5  14  11 o 5  3.29719e+01 7.62171e-01 5.82103e+02 13.165  6.33461e+01  1.48173e+01  0.00000e+00 0.00000e+00 6.41995e+02 13.165  5.98920e+01 13.165  0.9923 
1 1 1 -5  14  12 o 13 5.42638e+00 8.84256e-01 1.55218e+02 298.335 1.93574e+00  -3.58986e+00 0.00000e+00 0.00000e+00 2.05378e+01 298.335 1.34680e+02 118.335 0.8665 
1 1 1 -5  14  13 o 19 1.22608e+01 6.73577e-01 1.39854e+02 301.762 6.60093e+00  -1.06620e+01 0.00000e+00 0.00000e+00 2.99365e+02 301.762 1.59512e+02 301.762 0.9593 
1 1 1 -5  14  14 o 6  1.68865e+01 8.17575e-01 2.57944e+02 26.233  3.36769e+01  1.65950e+01  0.00000e+00 0.00000e+00 3.63576e+02 26.233  1.05631e+02 26.233  0.9866 
1 1 1 -5  14  15 o 14 1.49911e+01 9.17381e-01 2.56136e+02 111.897 -1.54851e+01 3.85253e+01  0.00000e+00 0.00000e+00 2.95745e+02 111.897 3.96094e+01 111.897 0.9879 
1 1 1 -5  14  16 o 11 5.62709e+00 1.39630e+00 4.63568e+01 351.051 2.58836e+00  -4.07587e-01 0.00000e+00 0.00000e+00 1.16488e+02 351.051 7.01309e+01 351.051 0.7775 
1 1 1 -5  14  17 o 6  4.89031e+00 1.42869e+00 7.98870e+01 116.957 -2.02941e+00 3.99040e+00  0.00000e+00 0.00000e+00 8.00414e+01 116.957 1.54350e-01 116.957 0.8796 
1 1 1 -5  14  18 o 11 4.87410e+00 1.52985e+00 1.19128e+02 158.431 -6.21385e+00 2.45628e+00  0.00000e+00 0.00000e+00 4.76960e+01 158.431 7.14322e+01 338.432 0.9218 
1 1 1 -5  14  19 o 14 5.07949e+00 1.61480e+00 1.44537e+01 327.814 7.26979e-01  -4.57557e-01 0.00000e+00 0.00000e+00 5.97955e+01 327.814 4.53418e+01 327.814 0.3942 
1 1 1 -5  15  1  o 14 2.13786e+01 6.04072e-01 4.10089e+02 168.450 -6.52612e+00 1.33363e+00  0.00000e+00 0.00000e+00 3.31185e+02 168.450 7.89034e+01 348.450 0.9215 
1 1 1 -5  15  2  o 15 2.08806e+01 4.47057e-01 3.89479e+02 331.835 5.50665e+00  -2.94829e+00 0.00000e+00 0.00000e+00 3.29983e+02 331.835 5.94962e+01 151.835 0.9160 
1 1 1 -5  15  3  o 1  1.72479e+01 4.50750e-01 2.56390e+02 33.256  3.15651e+00  2.07000e+00  0.00000e+00 0.00000e+00 2.97641e+02 33.256  4.12509e+01 33.256  0.8543 
1 1 1 -5  15  4  o 5  1.26333e+01 4.58007e-01 3.27727e+02 117.293 -1.70038e+00 3.29534e+00  0.00000e+00 0.00000e+00 7.64915e+01 117.293 2.51235e+02 297.293 0.8513 
1 1 1 -5  15  5  o 12 2.60742e+01 4.82421e-01 3.63809e+02 300.212 5.09111e+00  -8.74305e+00 0.00000e+00 0.00000e+00 5.65998e+02 300.212 2.02189e+02 300.212 0.9492 
1 1 1 -5  15  6  o 14 1.90681e+01 3.96750e-01 4.24419e+02 179.708 -1.06868e+01 5.43975e-02  0.00000e+00 0.00000e+00 2.57179e+02 179.708 1.67240e+02 359.708 0.9520 
1 1 1 -5  15  7  o 2  2.45625e+01 4.88075e-01 4.55164e+02 241.446 -6.82126e+00 -1.25351e+01 0.00000e+00 0.00000e+00 4.33649e+02 241.446 2.15152e+01 61.446  0.9643 
1 1 1 -5  15  8  o 16 3.64838e+01 7.78338e-01 7.57398e+02 33.371  4.01898e+01  2.64711e+01  0.00000e+00 0.00000e+00 5.96475e+02 33.371  1.60924e+02 213.371 0.9896 
1 1 1 -5  15  9  o 13 1.82250e+01 3.53959e-01 2.54607e+02 40.608  7.87353e+00  6.75028e+00  0.00000e+00 0.00000e+00 3.94536e+02 40.608  1.39929e+02 40.608  0.9505 
1 1 1 -5  15  10 o 4  1.68473e+01 3.73391e-01 3.25578e+02 295.722 7.26276e+00  -1.50758e+01 0.00000e+00 0.00000e+00 2.86108e+02 295.722 3.94699e+01 115.722 0.9696 
1 1 1 -5  15  11 o 19 1.70584e+01 5.97438e-01 3.49698e+02 233.462 -1.21955e+01 -1.64584e+01 0.00000e+00 0.00000e+00 2.72726e+02 233.462 7.69717e+01 53.462  0.9753 
1 1 1 -5  15  12 o 5  9.32496e+00 6.95409e-01 2.65764e+02 59.674  6.21657e+00  1.06272e+01  0.00000e+00 0.00000e+00 6.83231e+01 59.674  1.97441e+02 239.674 0.9585 
1 1 1 -5  15  13 o 12 1.96970e+01 6.67226e-01 3.08846e+02 203.648 -4.10718e+01 -1.79848e+01 0.00000e+00 0.00000e+00 4.18448e+02 203.648 1.09602e+02 203.648 0.9888 
1 1 1 -5  15  14 o 9  1.72661e+01 7.80462e-01 1.90698e+02 270.730 3.64664e-01  -2.86280e+01 0.00000e+00 0.00000e+00 4.42056e+02 270.730 2.51357e+02 270.730 0.9824 
1 1 1 -5  15  15 o 3  1.25443e+01 9.02713e-01 2.31394e+02 134.186 -2.19768e+01 2.26101e+01  0.00000e+00 0.00000e+00 2.28582e+02 134.186 2.81173e+00 314.186 0.9840 
1 1 1 -5  15  16 o 1  1.00130e+01 1.11865e+00 1.75308e+02 259.478 -3.70099e+00 -1.99262e+01 0.00000e+00 0.00000e+00 1.88074e+02 259.478 1.27652e+01 259.478 0.9750 
1 1 1 -5  15  17 o 7  8.67970e+00 1.57674e+00 1.58827e+02 351.714 1.35778e+01  -1.97741e+00 0.00000e+00 0.00000e+00 1.51860e+02 351.714 6.96694e+00 171.714 0.9628 
1 1 1 -5  15  18 o 18 5.92059e+00 1.62940e+00 6.55691e+01 117.054 -1.90311e+00 3.72631e+00  0.00000e+00 0.00000e+00 1.25733e+02 117.054 6.01643e+01 117.054 0.8702 
1 1 1 -5  15  19 o 7  5.71986e+00 1.75754e+00 4.74207e+01 32.365  2.42613e+00  1.53758e+00  0.00000e+00 0.00000e+00 1.22269e+02 32.365  7.48483e+01 32.365  0.8001 
1 1 1 -5  16  1  o 17 1.00938e+01 4.32538e-01 3.70971e+02 311.920 1.87449e+00  -2.08766e+00 0.00000e+00 0.00000e+00 6.92324e+01 131.920 4.40204e+02 131.920 0.7945 
1 1 1 -5  16  2  o 4  4.40201e+00 3.85877e-01 5.54737e+01 240.161 -9.20423e-02 -1.60463e-01 0.00000e+00 0.00000e+00 4.02243e+01 60.161  9.56980e+01 60.161  0.0921 
1 1 1 -5  16  3  o 5  1.10293e+01 4.27083e-01 1.20151e+02 112.650 -3.99460e-01 9.57299e-01  0.00000e+00 0.00000e+00 7.03842e+01 112.650 4.97669e+01 292.650 0.4595 
1 1 1 -5  16  4  o 12 6.90511e+00 3.29512e-01 9.79050e+01 143.034 -4.80379e-01 3.61547e-01  0.00000e+00 0.00000e+00 2.32132e+01 323.034 1.21118e+02 323.034 0.2878 
1 1 1 -5  16  5  o 12 1.45840e+01 3.48409e-01 3.04227e+02 348.777 4.62345e+00  -9.17371e-01 0.00000e+00 0.00000e+00 1.81342e+02 348.777 1.22885e+02 168.777 0.8863 
1 1 1 -5  16  6  o 4  3.05966e+01 5.72591e-01 6.36702e+02 239.924 -1.27813e+01 -2.20699e+01 0.00000e+00 0.00000e+00 4.89331e+02 239.924 1.47371e+02 59.924  0.9802 
1 1 1 -5  16  7  o 18 2.80632e+01 5.17435e-01 5.74601e+02 65.486  8.86896e+00  1.94486e+01  0.00000e+00 0.00000e+00 4.53499e+02 65.486  1.21102e+02 245.486 0.9763 
1 1 1 -5  16  8  o 9  2.00884e+01 5.20666e-01 1.84873e+02 343.705 6.26008e+00  -1.82994e+00 0.00000e+00 0.00000e+00 5.07989e+02 343.705 3.23116e+02 343.705 0.9198 
1 1 1 -5  16  9  o 11 2.00627e+01 4.94904e-01 4.21916e+02 240.387 -9.28611e+00 -1.63380e+01 0.00000e+00 0.00000e+00 3.09589e+02 240.387 1.12327e+02 60.387  0.9730 
1 1 1 -5  16  10 o 1  1.70469e+01 4.43997e-01 3.31772e+02 314.759 1.20862e+01  -1.21883e+01 0.00000e+00 0.00000e+00 2.87629e+02 314.759 4.41424e+01 134.759 0.9704 
1 1 1 -5  16  11 o 11 1.29323e+01 7.16046e-01 8.66195e+01 205.922 -3.42068e+00 -1.66260e+00 0.00000e+00 0.00000e+00 3.27286e+02 205.922 2.40667e+02 205.922 0.8555 
1 1 1 -5  16  12 o 1  1.52742e+01 6.23338e-01 2.44719e+02 90.208  -7.32087e-02 2.01480e+01  0.00000e+00 0.00000e+00 3.11836e+02 90.208  6.71173e+01 90.208  0.9749 
1 1 1 -5  16  13 o 10 1.59841e+01 6.50223e-01 2.71646e+02 241.049 -1.55223e+01 -2.80599e+01 0.00000e+00 0.00000e+00 3.15838e+02 241.049 4.41923e+01 241.049 0.9843 
1 1 1 -5  16  14 o 2  1.64565e+01 7.96861e-01 3.02345e+02 43.881  3.27538e+01  3.14993e+01  0.00000e+00 0.00000e+00 3.04738e+02 43.881  2.39324e+00 43.881  0.9889 
1 1 1 -5  16  15 o 2  9.69455e+00 1.05330e+00 1.23624e+02 334.088 1.10415e+01  -5.36435e+00 0.00000e+00 0.00000e+00 2.22576e+02 334.088 9.89529e+01 334.088 0.9584 
1 1 1 -5  16  16 o 14 6.71415e+00 1.24487e+00 1.34170e+02 36.698  8.20218e+00  6.11320e+00  0.00000e+00 0.00000e+00 1.03181e+02 36.698  3.09889e+01 216.698 0.9498 
1 1 1 -5  16  17 o 18 3.67450e+00 1.21684e+00 7.29157e+01 179.356 -3.27363e+00 3.67960e-02  0.00000e+00 0.00000e+00 4.02361e+01 179.356 3.26795e+01 359.356 0.8284 
1 1 1 -5  16  18 o 19 3.90221e+00 1.30827e+00 3.19922e+01 59.077  8.43260e-01  1.40771e+00  0.00000e+00 0.00000e+00 5.91504e+01 59.077  2.71582e+01 59.077  0.6291 
1 1 1 -5  16  19 o 8  4.65120e+00 1.54605e+00 1.50657e+02 328.271 7.31123e+00  -4.52056e+00 0.00000e+00 0.00000e+00 1.14347e+01 328.271 1.39222e+02 148.271 0.9399 
1 1 1 -5  17  1  o 14 1.10774e+01 4.42548e-01 2.06424e+02 162.895 -1.61041e+00 4.95588e-01  0.00000e+00 0.00000e+00 5.97357e+01 162.895 1.46688e+02 342.895 0.6386 
1 1 1 -5  17  2  o 5  1.11139e+01 4.31890e-01 1.14068e+02 62.132  4.42131e-01  8.36172e-01  0.00000e+00 0.00000e+00 6.43729e+01 62.132  4.96949e+01 242.132 0.4269 
1 1 1 -5  17  3  o 7  1.39496e+01 4.01033e-01 4.24029e+02 60.372  2.26250e+00  3.97824e+00  0.00000e+00 0.00000e+00 3.88453e+01 60.372  3.85183e+02 240.372 0.8825 
1 1 1 -5  17  4  o 6  1.16240e+01 3.82700e-01 2.80293e+02 339.132 2.68190e+00  -1.02239e+00 0.00000e+00 0.00000e+00 6.91550e+01 339.132 2.11138e+02 159.132 0.7999 
1 1 1 -5  17  5  o 5  2.51514e+01 4.70572e-01 4.49414e+02 341.058 1.12651e+01  -3.86608e+00 0.00000e+00 0.00000e+00 4.54812e+02 341.058 5.39801e+00 341.058 0.9571 
1 1 1 -5  17  6  o 12 2.91698e+01 6.39714e-01 6.40949e+02 0.955   2.43146e+01  4.05444e-01  0.00000e+00 0.00000e+00 4.31458e+02 0.955   2.09490e+02 180.955 0.9792 
1 1 1 -5  17  7  f 0  2.40830e+01 4.83084e-01 5.38499e+02 194.227 -1.66223e+01 -4.21440e+00 0.00000e+00 0.00000e+00 3.38388e+02 194.227 2.00111e+02 14.227  0.9704 
1 1 1 -5  17  8  o 11 1.89317e+01 3.93600e-01 2.61140e+02 237.913 -4.61709e+00 -7.36395e+00 0.00000e+00 0.00000e+00 4.06568e+02 237.913 1.45428e+02 237.913 0.9406 
1 1 1 -5  17  9  o 11 4.43422e+01 7.31855e-01 7.40214e+02 190.643 -7.06360e+01 -1.32737e+01 0.00000e+00 0.00000e+00 9.09701e+02 190.643 1.69486e+02 190.643 0.9930 
1 1 1 -5  17  10 o 4  1.71452e+01 5.72639e-01 2.97441e+02 3.419   1.53052e+01  9.14508e-01  0.00000e+00 0.00000e+00 3.23193e+02 3.419   2.57523e+01 3.419   0.9668 
1 1 1 -5  17  11 o 18 1.89037e+01 6.08897e-01 3.65259e+02 268.506 -7.00449e-01 -2.68627e+01 0.00000e+00 0.00000e+00 3.28631e+02 268.506 3.66284e+01 88.506  0.9812 
1 1 1 -5  17  12 o 12 1.45631e+01 6.22194e-01 1.61601e+02 77.227  2.80039e+00  1.23533e+01  0.00000e+00 0.00000e+00 3.60755e+02 77.227  1.99154e+02 77.227  0.9597 
1 1 1 -5  17  13 o 6  1.37766e+01 6.65636e-01 2.36755e+02 355.332 2.39146e+01  -1.95257e+00 0.00000e+00 0.00000e+00 2.66822e+02 355.332 3.00673e+01 355.332 0.9789 
1 1 1 -5  17  14 o 1  5.24148e+00 1.14153e+00 4.64601e+00 193.379 -1.94068e-01 -4.61600e-02 0.00000e+00 0.00000e+00 1.47584e+01 193.379 1.01123e+01 193.379 0.0992 
1 1 1 -5  17  15 o 8  8.39256e+00 1.04458e+00 1.32382e+02 357.151 1.19682e+01  -5.95578e-01 0.00000e+00 0.00000e+00 1.66984e+02 357.151 3.46027e+01 357.151 0.9573 
1 1 1 -5  17  16 o 16 8.34825e+00 1.29180e+00 1.18147e+02 115.650 -4.72705e+00 9.84405e+00  0.00000e+00 0.00000e+00 1.77971e+02 115.650 5.98239e+01 115.650 0.9531 
1 1 1 -5  17  17 o 8  6.23808e+00 1.52161e+00 1.52878e+02 281.037 1.87425e+00  -9.60900e+00 0.00000e+00 0.00000e+00 6.68268e+01 281.037 8.60512e+01 101.037 0.9475 
1 1 1 -5  17  18 o 5  8.94098e+00 1.86357e+00 1.62053e+02 80.188  2.26914e+00  1.31206e+01  0.00000e+00 0.00000e+00 1.57168e+02 80.188  4.88531e+00 260.188 0.9617 
1 1 1 -5  17  19 f 0  1.01035e+01 1.94262e+00 5.61882e+01 350.477 5.41182e+00  -9.07859e-01 0.00000e+00 0.00000e+00 2.82295e+02 350.477 2.26106e+02 350.477 0.9036 
1 1 1 -5  18  1  o 17 1.86884e+01 5.17651e-01 3.31758e+02 148.356 -4.00202e+00 2.46630e+00  0.00000e+00 0.00000e+00 2.91131e+02 148.356 4.06273e+01 328.356 0.8860 
1 1 1 -5  18  2  o 16 1.14468e+01 3.44975e-01 1.51313e+02 235.421 -8.53210e-01 -1.23777e+00 0.00000e+00 0.00000e+00 1.05684e+02 235.421 4.56285e+01 55.421  0.5970 
1 1 1 -5  18  3  o 4  1.27076e+01 3.49917e-01 2.95982e+02 344.637 2.77425e+00  -7.62256e-01 0.00000e+00 0.00000e+00 8.64513e+01 344.637 2.09531e+02 164.636 0.8005 
1 1 1 -5  18  4  o 8  4.70928e+00 5.83806e-01 1.62104e+02 230.614 -4.63819e-01 -5.64953e-01 0.00000e+00 0.00000e+00 1.01390e+02 50.614  2.63494e+02 50.614  0.3431 
1 1 1 -5  18  5  o 10 5.25409e+01 8.74320e-01 1.08375e+03 37.216  4.68736e+01  3.56001e+01  0.00000e+00 0.00000e+00 8.73001e+02 37.216  2.10747e+02 217.216 0.9915 
1 1 1 -5  18  6  o 2  2.94794e+01 7.49660e-01 7.41984e+02 191.961 -2.52923e+01 -5.35824e+00 0.00000e+00 0.00000e+00 3.43132e+02 191.961 3.98852e+02 11.961  0.9805 
1 1 1 -5  18  7  o 19 3.28903e+01 5.81628e-01 6.01119e+02 207.517 -2.30462e+01 -1.20058e+01 0.00000e+00 0.00000e+00 6.08949e+02 207.517 7.82986e+00 207.517 0.9806 
1 1 1 -5  18  8  o 2  3.02340e+01 7.95414e-01 4.80728e+02 0.510   2.45806e+01  2.18853e-01  0.00000e+00 0.00000e+00 6.29607e+02 0.510   1.48879e+02 0.510   0.9794 
1 1 1 -5  18  9  o 16 6.15558e+01 9.37330e-01 1.11650e+03 185.516 -1.62845e+02 -1.57276e+01 0.00000e+00 0.00000e+00 1.18284e+03 185.516 6.63415e+01 185.516 0.9969 
1 1 1 -5  18  10 o 13 1.54167e+01 5.78807e-01 3.40024e+02 357.244 1.49997e+01  -7.22048e-01 0.00000e+00 0.00000e+00 2.17602e+02 357.244 1.22421e+02 177.244 0.9661 
1 1 1 -5  18  11 o 6  1.05412e+01 6.53276e-01 2.18440e+02 318.310 6.65359e+00  -5.92606e+00 0.00000e+00 0.00000e+00 1.53046e+02 318.310 6.53936e+01 138.310 0.9421 
1 1 1 -5  18  12 o 17 1.14455e+01 6.51027e-01 2.95825e+02 7.555   1.98099e+01  2.62735e+00  0.00000e+00 0.00000e+00 1.21091e+02 7.555   1.74733e+02 187.555 0.9746 
1 1 1 -5  18  13 o 13 2.02329e+01 6.76934e-01 4.01663e+02 48.647  3.86901e+01  4.39576e+01  0.00000e+00 0.00000e+00 3.47310e+02 48.647  5.43526e+01 228.647 0.9914 
1 1 1 -5  18  14 o 17 8.42017e+00 8.34866e-01 2.09987e+02 317.850 1.19763e+01  -1.08403e+01 0.00000e+00 0.00000e+00 9.41984e+01 317.850 1.15789e+02 137.850 0.9685 
1 1 1 -5  18  15 o 17 4.60719e+00 1.03008e+00 1.53413e+02 124.719 -4.36520e+00 6.29968e+00  0.00000e+00 0.00000e+00 6.62022e+00 124.719 1.46793e+02 304.719 0.9323 
1 1 1 -5  18  16 o 8  9.55808e+00 1.20988e+00 1.48188e+02 255.667 -3.97708e+00 -1.55657e+01 0.00000e+00 0.00000e+00 1.96272e+02 255.667 4.80843e+01 255.667 0.9684 
1 1 1 -5  18  17 o 17 7.11040e+00 1.55423e+00 1.24226e+02 281.827 1.94757e+00  -9.30030e+00 0.00000e+00 0.00000e+00 1.25756e+02 281.827 1.53007e+00 281.827 0.9458 
1 1 1 -5  18  18 o 15 7.06051e+00 1.76962e+00 1.16587e+02 92.333  -3.37144e-01 8.27594e+00  0.00000e+00 0.00000e+00 1.29153e+02 92.333  1.25661e+01 92.333  0.9375 
1 1 1 -5  18  19 o 12 5.24142e+00 1.68953e+00 8.42265e+01 19.762  4.80592e+00  1.72666e+00  0.00000e+00 0.00000e+00 8.98479e+01 19.762  5.62138e+00 19.762  0.8958 
1 1 1 -5  19  1  o 6  1.80675e+01 4.45051e-01 3.30592e+02 241.864 -2.10271e+00 -3.93202e+00 0.00000e+00 0.00000e+00 2.66921e+02 241.864 6.36709e+01 61.864  0.8791 
1 1 1 -5  19  2  o 4  2.20332e+01 6.08463e-01 2.96376e+02 354.030 5.53134e+00  -5.78464e-01 0.00000e+00 0.00000e+00 4.53493e+02 354.030 1.57117e+02 354.030 0.9050 
1 1 1 -5  19  3  o 10 2.06812e+01 4.46015e-01 3.85023e+02 336.900 6.29563e+00  -2.68534e+00 0.00000e+00 0.00000e+00 3.33194e+02 336.900 5.18292e+01 156.900 0.9238 
1 1 1 -5  19  4  o 10 7.30824e+00 5.03649e-01 7.34873e+01 108.203 -1.59438e-01 4.84833e-01  0.00000e+00 0.00000e+00 5.59082e+00 288.203 7.90781e+01 288.203 0.2472 
1 1 1 -5  19  5  o 18 4.70981e+01 7.89727e-01 8.10420e+02 156.869 -3.61424e+01 1.54395e+01  0.00000e+00 0.00000e+00 9.35980e+02 156.869 1.25560e+02 156.869 0.9872 
1 1 1 -5  19  6  o 13 3.06676e+01 5.46233e-01 7.08712e+02 277.757 3.47025e+00  -2.54764e+01 0.00000e+00 0.00000e+00 4.19960e+02 277.757 2.88752e+02 97.757  0.9804 
1 1 1 -5  19  7  o 2  1.88802e+01 3.93092e-01 3.81886e+02 275.067 8.68389e-01  -9.79311e+00 0.00000e+00 0.00000e+00 2.89414e+02 275.067 9.24717e+01 95.067  0.9477 
1 1 1 -5  19  8  o 9  2.02890e+01 4.10317e-01 5.39017e+02 197.924 -1.78045e+01 -5.75894e+00 0.00000e+00 0.00000e+00 2.01076e+02 197.924 3.37940e+02 17.924  0.9729 
1 1 1 -5  19  9  o 13 1.65532e+01 3.47040e-01 2.09987e+02 93.867  -5.76193e-01 8.52479e+00  0.00000e+00 0.00000e+00 3.72694e+02 93.867  1.62707e+02 93.867  0.9395 
1 1 1 -5  19  10 o 12 2.31371e+01 6.29724e-01 4.43134e+02 284.758 7.44085e+00  -2.82465e+01 0.00000e+00 0.00000e+00 4.08096e+02 284.758 3.50382e+01 104.758 0.9827 
1 1 1 -5  19  11 o 17 6.23417e+00 8.59259e-01 2.43588e+01 257.315 -1.38456e-01 -6.15157e-01 0.00000e+00 0.00000e+00 4.57336e+01 257.315 2.13747e+01 257.315 0.3006 
1 1 1 -5  19  12 o 16 6.40753e+00 8.66548e-01 1.75275e+02 1.106   6.38582e+00  1.23277e-01  0.00000e+00 0.00000e+00 4.45464e+01 1.106   1.30729e+02 181.106 0.9180 
1 1 1 -5  19  13 o 2  1.05849e+01 7.12959e-01 2.00505e+02 23.356  1.39218e+01  6.01169e+00  0.00000e+00 0.00000e+00 1.81429e+02 23.356  1.90761e+01 203.356 0.9664 
1 1 1 -5  19  14 o 9  1.06018e+01 7.61554e-01 1.91955e+02 23.830  1.73385e+01  7.65796e+00  0.00000e+00 0.00000e+00 1.92890e+02 23.830  9.35448e-01 23.830  0.9733 
1 1 1 -5  19  15 f 0  5.97018e+00 1.22726e+00 9.30645e+01 249.702 -1.98734e+00 -5.37308e+00 0.00000e+00 0.00000e+00 1.08887e+02 249.702 1.58224e+01 249.702 0.9079 
1 1 1 -5  19  16 o 5  8.94370e+00 1.25104e+00 1.66476e+02 160.436 -1.55712e+01 5.53352e+00  0.00000e+00 0.00000e+00 1.56124e+02 160.436 1.03526e+01 340.436 0.9693 
1 1 1 -5  19  17 o 7  4.78417e+00 1.39682e+00 6.37927e+01 295.087 1.53367e+00  -3.27589e+00 0.00000e+00 0.00000e+00 8.68234e+01 295.087 2.30307e+01 295.087 0.8470 
1 1 1 -5  19  18 o 11 6.38803e+00 1.61267e+00 9.04661e+01 151.231 -5.65533e+00 3.10503e+00  0.00000e+00 0.00000e+00 1.27427e+02 151.231 3.69609e+01 151.231 0.9189 
1 1 1 -5  19  19 o 3  6.72046e+00 1.82757e+00 1.59966e+02 317.717 8.29566e+00  -7.54384e+00 0.00000e+00 0.00000e+00 7.77956e+01 317.717 8.21705e+01 137.718 0.9543 
1 1 1 -5  20  1  o 15 1.63169e+01 3.83005e-01 1.82721e+02 283.776 6.15373e-01  -2.50979e+00 0.00000e+00 0.00000e+00 2.92259e+02 283.776 1.09538e+02 283.776 0.7738 
1 1 1 -5  20  2  o 3  1.80556e+01 3.93630e-01 4.76978e+02 102.651 -1.47328e+00 6.56357e+00  0.00000e+00 0.00000e+00 1.49292e+02 102.651 3.27686e+02 282.651 0.9223 
1 1 1 -5  20  3  o 18 2.09177e+01 4.46148e-01 2.85430e+02 288.268 1.58959e+00  -4.81550e+00 0.00000e+00 0.00000e+00 4.18357e+02 288.268 1.32928e+02 288.268 0.8950 
1 1 1 -5  20  4  o 11 2.30086e+01 4.42708e-01 3.44196e+02 146.943 -6.04371e+00 3.93339e+00  0.00000e+00 0.00000e+00 4.57986e+02 146.943 1.13790e+02 146.943 0.9278 
1 1 1 -5  20  5  o 3  2.66610e+01 4.94181e-01 5.09745e+02 15.497  1.57655e+01  4.37141e+00  0.00000e+00 0.00000e+00 4.60512e+02 15.497  4.92330e+01 195.497 0.9689 
1 1 1 -5  20  6  o 13 6.50801e+01 1.37186e+00 1.21499e+03 326.718 7.85010e+01  -5.15300e+01 0.00000e+00 0.00000e+00 1.21500e+03 326.718 8.84804e-03 326.718 0.9947 
1 1 1 -5  20  7  o 12 1.06066e+01 5.28893e-01 3.93766e+01 56.275  3.14129e-01  4.70563e-01  0.00000e+00 0.00000e+00 6.89149e+01 56.275  2.95383e+01 56.275  0.2721 
1 1 1 -5  20  8  o 3  3.65409e+01 6.22647e-01 6.25956e+02 289.248 1.29081e+01  -3.69680e+01 0.00000e+00 0.00000e+00 7.26413e+02 289.248 1.00457e+02 289.248 0.9871 
1 1 1 -5  20  9  o 11 1.71976e+01 3.55034e-01 3.29549e+02 61.437  6.56357e+00  1.20572e+01  0.00000e+00 0.00000e+00 2.90822e+02 61.437  3.87274e+01 241.437 0.9629 
1 1 1 -5  20  10 o 1  1.61161e+01 5.75324e-01 2.46164e+02 304.914 7.30230e+00  -1.04621e+01 0.00000e+00 0.00000e+00 3.32996e+02 304.914 8.68324e+01 304.914 0.9600 
1 1 1 -5  20  11 o 1  2.29108e+01 6.51187e-01 3.80826e+02 138.532 -2.77672e+01 2.45390e+01  0.00000e+00 0.00000e+00 4.64479e+02 138.532 8.36523e+01 138.532 0.9864 
1 1 1 -5  20  12 f 0  4.01186e+00 9.67608e-01 5.44675e+01 181.932 -1.17317e+00 -3.95842e-02 0.00000e+00 0.00000e+00 2.11842e+01 181.932 3.32833e+01 1.932   0.5046 
1 1 1 -5  20  13 o 12 4.43125e+00 9.64402e-01 1.26007e+02 109.755 -1.34386e+00 3.74197e+00  0.00000e+00 0.00000e+00 1.66959e+01 109.755 1.09311e+02 289.755 0.8626 
1 1 1 -5  20  14 o 13 1.08741e+01 7.49318e-01 1.78161e+02 340.741 1.71186e+01  -5.98096e+00 0.00000e+00 0.00000e+00 2.16049e+02 340.741 3.78872e+01 340.741 0.9720 
1 1 1 -5  20  15 o 8  9.57534e+00 1.05480e+00 1.01507e+02 111.341 -3.94191e+00 1.00893e+01  0.00000e+00 0.00000e+00 2.38334e+02 111.341 1.36827e+02 111.341 0.9527 
1 1 1 -5  20  16 o 18 7.01045e+00 1.45703e+00 9.70414e+01 296.778 3.01441e+00  -5.97331e+00 0.00000e+00 0.00000e+00 1.43461e+02 296.778 4.64196e+01 296.778 0.9219 
1 1 1 -5  20  17 o 12 1.23553e+01 1.34763e+00 1.75547e+02 204.370 -2.30412e+01 -1.04372e+01 0.00000e+00 0.00000e+00 2.74493e+02 204.370 9.89467e+01 204.370 0.9800 
1 1 1 -5  20  18 o 7  1.26287e+01 1.56151e+00 2.05957e+02 20.526  2.81253e+01  1.05300e+01  0.00000e+00 0.00000e+00 2.54949e+02 20.526  4.89914e+01 20.526  0.9832 
1 1 1 -5  20  19 o 6  5.46629e+00 1.69733e+00 3.81197e+01 206.219 -2.13864e+00 -1.05321e+00 0.00000e+00 0.00000e+00 1.14215e+02 206.219 7.60954e+01 206.219 0.7518 
1 1 1 -5  21  1  o 16 2.30372e+01 5.83783e-01 4.12343e+02 308.597 5.03711e+00  -6.31045e+00 0.00000e+00 0.00000e+00 3.98612e+02 308.597 1.37307e+01 128.597 0.9359 
1 1 1 -5  21  2  o 14 2.26912e+01 5.04730e-01 4.84485e+02 206.266 -7.57820e+00 -3.73972e+00 0.00000e+00 0.00000e+00 3.16588e+02 206.266 1.67896e+02 26.266  0.9388 
1 1 1 -5  21  3  o 16 1.86146e+01 3.98256e-01 4.65694e+02 30.612  6.65846e+00  3.93968e+00  0.00000e+00 0.00000e+00 1.87111e+02 30.612  2.78583e+02 210.612 0.9329 
1 1 1 -5  21  4  o 5  2.13316e+01 5.00508e-01 4.14148e+02 82.498  1.03972e+00  7.89538e+00  0.00000e+00 0.00000e+00 3.35224e+02 82.498  7.89249e+01 262.498 0.9349 
1 1 1 -5  21  5  o 17 1.56804e+01 3.60678e-01 3.10470e+02 23.509  5.35130e+00  2.32786e+00  0.00000e+00 0.00000e+00 2.25277e+02 23.509  8.51932e+01 203.509 0.9097 
1 1 1 -5  21  6  o 6  3.18199e+01 7.18136e-01 5.45706e+02 47.715  1.42431e+01  1.56610e+01  0.00000e+00 0.00000e+00 6.20148e+02 47.715  7.44422e+01 47.715  0.9761 
1 1 1 -5  21  7  f 0  1.10714e+01 5.43317e-01 1.13564e+02 182.326 -1.99794e+00 -8.11471e-02 0.00000e+00 0.00000e+00 1.76218e+02 182.326 6.26535e+01 182.326 0.6977 
1 1 1 -5  21  8  o 2  1.29542e+01 3.40231e-01 1.75353e+02 108.216 -1.22425e+00 3.72015e+00  0.00000e+00 0.00000e+00 2.42415e+02 108.216 6.70619e+01 108.216 0.8602 
1 1 1 -5  21  9  o 10 2.62054e+01 4.58861e-01 5.46463e+02 123.147 -1.88590e+01 2.88777e+01  0.00000e+00 0.00000e+00 4.20916e+02 123.147 1.25547e+02 303.147 0.9854 
1 1 1 -5  21  10 o 17 9.07775e+00 6.70505e-01 1.03800e+02 334.841 2.71718e+00  -1.27621e+00 0.00000e+00 0.00000e+00 1.71490e+02 334.841 6.76897e+01 334.841 0.8101 
1 1 1 -5  21  11 o 16 2.60197e+01 6.84713e-01 3.20431e+02 187.688 -3.48599e+01 -4.70577e+00 0.00000e+00 0.00000e+00 6.38813e+02 187.688 3.18382e+02 187.688 0.9857 
1 1 1 -5  21  12 o 1  1.09210e+01 6.64394e-01 1.25802e+02 162.923 -7.40727e+00 2.27550e+00  0.00000e+00 0.00000e+00 2.54968e+02 162.923 1.29166e+02 162.923 0.9330 
1 1 1 -5  21  13 f 0  3.55811e+00 9.50907e-01 8.49988e+01 305.593 1.25594e+00  -1.75473e+00 0.00000e+00 0.00000e+00 1.09142e+01 305.593 7.40846e+01 125.593 0.7221 
1 1 1 -5  21  14 o 6  1.06987e+01 7.63834e-01 2.49815e+02 246.124 -1.00726e+01 -2.27561e+01 0.00000e+00 0.00000e+00 1.41075e+02 246.124 1.08739e+02 66.124  0.9797 
1 1 1 -5  21  15 o 16 6.16414e+00 1.12203e+00 1.20336e+02 12.647  7.81544e+00  1.75363e+00  0.00000e+00 0.00000e+00 9.44431e+01 12.647  2.58929e+01 192.647 0.9353 
1 1 1 -5  21  16 o 19 3.37869e+00 1.13364e+00 7.65163e+01 146.470 -2.50150e+00 1.65760e+00  0.00000e+00 0.00000e+00 2.53243e+01 146.470 5.11921e+01 326.470 0.8100 
1 1 1 -5  21  17 o 9  8.61247e+00 1.45716e+00 1.02481e+02 224.671 -6.85849e+00 -6.78030e+00 0.00000e+00 0.00000e+00 2.00524e+02 224.671 9.80428e+01 224.671 0.9466 
1 1 1 -5  21  18 o 5  8.10659e+00 1.77020e+00 1.42902e+02 57.874  5.88979e+00  9.37984e+00  0.00000e+00 0.00000e+00 1.44075e+02 57.874  1.17380e+00 57.874  0.9537 
1 1 1 -5  21  19 o 5  4.24539e+00 1.45439e+00 4.28908e+01 338.798 2.32853e+00  -9.03285e-01 0.00000e+00 0.00000e+00 7.74558e+01 338.798 3.45650e+01 338.798 0.7647 
1 1 1 -5  22  1  o 15 2.23500e+01 5.73705e-01 4.29496e+02 140.493 -5.74887e+00 4.74011e+00  0.00000e+00 0.00000e+00 3.52509e+02 140.493 7.69870e+01 320.493 0.9302 
1 1 1 -5  22  2  o 11 1.71900e+01 3.87195e-01 2.20345e+02 333.389 2.92643e+00  -1.46616e+00 0.00000e+00 0.00000e+00 3.15053e+02 333.389 9.47082e+01 333.389 0.8283 
1 1 1 -5  22  3  o 11 2.78739e+01 5.23131e-01 5.35875e+02 83.429  1.50492e+00  1.30639e+01  0.00000e+00 0.00000e+00 4.71194e+02 83.429  6.46807e+01 263.429 0.9612 
1 1 1 -5  22  4  o 1  1.66064e+01 3.98544e-01 4.48702e+02 12.265  7.78553e+00  1.69255e+00  0.00000e+00 0.00000e+00 1.34659e+02 12.265  3.14044e+02 192.265 0.9350 
1 1 1 -5  22  5  o 13 2.53511e+01 4.84561e-01 6.27058e+02 317.133 1.29150e+01  -1.19875e+01 0.00000e+00 0.00000e+00 2.97570e+02 317.133 3.29488e+02 137.133 0.9712 
1 1 1 -5  22  6  o 19 1.96804e+01 4.02264e-01 3.75300e+02 245.967 -3.93782e+00 -8.83060e+00 0.00000e+00 0.00000e+00 3.24083e+02 245.967 5.12172e+01 65.967  0.9468 
1 1 1 -5  22  7  o 14 3.76097e+01 6.51322e-01 7.19772e+02 264.775 -3.88787e+00 -4.25153e+01 0.00000e+00 0.00000e+00 6.74421e+02 264.775 4.53508e+01 84.775  0.9882 
1 1 1 -5  22  8  o 15 3.15013e+01 5.28052e-01 5.55986e+02 190.699 -3.61361e+01 -6.82737e+00 0.00000e+00 0.00000e+00 6.08744e+02 190.699 5.27580e+01 190.699 0.9863 
1 1 1 -5  22  9  o 12 1.82055e+01 3.55506e-01 3.06477e+02 296.008 6.60107e+00  -1.35296e+01 0.00000e+00 0.00000e+00 3.52452e+02 296.008 4.59750e+01 296.008 0.9662 
1 1 1 -5  22  10 o 17 2.66068e+01 6.77518e-01 4.81115e+02 335.977 3.59985e+01  -1.60445e+01 0.00000e+00 0.00000e+00 5.02087e+02 335.977 2.09716e+01 335.977 0.9872 
1 1 1 -5  22  11 o 3  4.25435e+01 9.28054e-01 7.58650e+02 191.343 -1.29219e+02 -2.59223e+01 0.00000e+00 0.00000e+00 8.26403e+02 191.343 6.77527e+01 191.343 0.9962 
1 1 1 -5  22  12 o 14 1.71031e+01 6.37956e-01 2.91716e+02 110.991 -1.01993e+01 2.65830e+01  0.00000e+00 0.00000e+00 3.36025e+02 110.991 4.43095e+01 110.991 0.9823 
1 1 1 -5  22  13 o 15 1.10341e+01 7.11035e-01 1.44425e+02 35.450  1.05831e+01  7.53497e+00  0.00000e+00 0.00000e+00 2.51288e+02 35.450  1.06862e+02 35.450  0.9607 
1 1 1 -5  22  14 f 0  5.07659e+00 1.04818e+00 1.96911e+02 72.679  2.78681e+00  8.93584e+00  0.00000e+00 0.00000e+00 1.80170e+01 252.679 2.14928e+02 252.679 0.9450 
1 1 1 -5  22  15 o 10 1.20186e+01 9.75187e-01 1.93793e+02 326.212 2.22661e+01  -1.48989e+01 0.00000e+00 0.00000e+00 2.45473e+02 326.212 5.16792e+01 326.212 0.9812 
1 1 1 -5  22  16 o 10 5.60461e+00 1.21520e+00 5.16473e+01 180.835 -3.22381e+00 -4.69627e-02 0.00000e+00 0.00000e+00 1.20453e+02 180.835 6.88061e+01 180.835 0.8253 
1 1 1 -5  22  17 o 2  1.08592e+01 1.42191e+00 1.75071e+02 88.013  7.78077e-01  2.24284e+01  0.00000e+00 0.00000e+00 2.19392e+02 88.013  4.43209e+01 88.013  0.9775 
1 1 1 -5  22  18 o 16 6.28636e+00 1.67612e+00 1.30349e+02 328.788 7.10419e+00  -4.30455e+00 0.00000e+00 0.00000e+00 8.84422e+01 328.788 4.19070e+01 148.788 0.9377 
1 1 1 -5  22  19 o 5  7.15593e+00 1.75640e+00 1.50372e+02 211.536 -1.00860e+01 -6.18945e+00 0.00000e+00 0.00000e+00 1.03404e+02 211.536 4.69680e+01 31.536  0.9568 
1 1 1 -5  23  1  o 12 2.43499e+01 6.17247e-01 4.33117e+02 325.435 6.63178e+00  -4.56901e+00 0.00000e+00 0.00000e+00 4.23785e+02 325.435 9.33221e+00 145.435 0.9357 
1 1 1 -5  23  2  o 11 1.85305e+01 4.02645e-01 4.84033e+02 45.676  5.33921e+00  5.46669e+00  0.00000e+00 0.00000e+00 1.65367e+02 45.676  3.18666e+02 225.676 0.9321 
1 1 1 -5  23  3  o 7  9.72347e+00 3.27347e-01 2.74515e+02 189.391 -2.52946e+00 -4.18362e-01 0.00000e+00 0.00000e+00 7.53790e+00 189.391 2.66977e+02 9.391   0.7718 
1 1 1 -5  23  4  o 18 5.21422e+00 5.81196e-01 2.35400e+02 91.847  -4.17728e-02 1.29552e+00  0.00000e+00 0.00000e+00 1.29307e+02 271.847 3.64707e+02 271.847 0.5416 
1 1 1 -5  23  5  o 14 2.62936e+01 4.87645e-01 4.20601e+02 152.570 -1.08090e+01 5.61002e+00  0.00000e+00 0.00000e+00 5.25336e+02 152.570 1.04735e+02 152.570 0.9580 
1 1 1 -5  23  6  o 12 2.42005e+01 4.62213e-01 4.55776e+02 302.131 7.63525e+00  -1.21568e+01 0.00000e+00 0.00000e+00 4.20291e+02 302.131 3.54852e+01 122.131 0.9645 
1 1 1 -5  23  7  o 9  4.45430e+01 7.51674e-01 9.00410e+02 161.904 -5.85038e+01 1.91171e+01  0.00000e+00 0.00000e+00 7.56754e+02 161.904 1.43656e+02 341.904 0.9918 
1 1 1 -5  23  8  o 15 1.12385e+01 3.72903e-01 2.36790e+02 295.928 2.44909e+00  -5.03734e+00 0.00000e+00 0.00000e+00 1.44750e+02 295.928 9.20400e+01 115.928 0.9057 
1 1 1 -5  23  9  o 3  3.96788e+01 6.14319e-01 6.34371e+02 112.178 -2.52598e+01 6.19643e+01  0.00000e+00 0.00000e+00 8.40768e+02 112.178 2.06398e+02 112.178 0.9925 
1 1 1 -5  23  10 o 14 3.96067e+00 9.49406e-01 1.26663e+01 262.343 -2.00240e-02 -1.48938e-01 0.00000e+00 0.00000e+00 1.55884e+00 82.343  1.42251e+01 82.343  0.0749 
1 1 1 -5  23  11 o 9  1.81958e+01 6.24953e-01 4.09710e+02 144.924 -2.66388e+01 1.87057e+01  0.00000e+00 0.00000e+00 2.60223e+02 144.924 1.49488e+02 324.924 0.9845 
1 1 1 -5  23  12 o 19 1.27565e+01 6.68827e-01 1.99345e+02 279.304 2.33209e+00  -1.42354e+01 0.00000e+00 0.00000e+00 2.60452e+02 279.304 6.11067e+01 279.304 0.9647 
1 1 1 -5  23  13 o 8  8.50320e+00 8.03836e-01 1.73121e+02 10.932  1.15119e+01  2.22344e+00  0.00000e+00 0.00000e+00 1.30427e+02 10.932  4.26948e+01 190.932 0.9564 
1 1 1 -5  23  14 o 10 8.94781e+00 8.51281e-01 2.20030e+02 154.394 -1.77599e+01 8.51155e+00  0.00000e+00 0.00000e+00 1.05040e+02 154.394 1.14990e+02 334.394 0.9743 
1 1 1 -5  23  15 f 0  6.30530e+00 1.25675e+00 1.09625e+02 317.526 4.93553e+00  -4.51848e+00 0.00000e+00 0.00000e+00 1.06898e+02 317.526 2.72654e+00 137.526 0.9219 
1 1 1 -5  23  16 o 6  4.02231e+00 1.24491e+00 4.98328e+01 313.405 1.67485e+00  -1.77081e+00 0.00000e+00 0.00000e+00 6.36056e+01 313.405 1.37727e+01 313.405 0.7580 
1 1 1 -5  23  17 o 15 6.02242e+00 1.48558e+00 8.30333e+01 219.111 -4.39878e+00 -3.57616e+00 0.00000e+00 0.00000e+00 1.19926e+02 219.111 3.68925e+01 219.111 0.9069 
1 1 1 -5  23  18 o 5  5.67768e+00 1.58873e+00 1.83723e+02 305.060 6.65991e+00  -9.49031e+00 0.00000e+00 0.00000e+00 1.76923e+01 305.060 1.66031e+02 125.060 0.9559 
1 1 1 -5  23  19 o 1  5.94378e+00 1.77352e+00 5.06392e+01 315.289 2.29904e+00  -2.27596e+00 0.00000e+00 0.00000e+00 1.31321e+02 315.289 8.06823e+01 315.289 0.8260 
1 1 1 -5  24  1  o 13 3.79545e+00 4.45001e-01 8.63011e+01 317.091 2.05964e-01  -1.91452e-01 0.00000e+00 0.00000e+00 6.64277e+01 137.091 1.52729e+02 137.091 0.1392 
1 1 1 -5  24  2  o 3  9.08627e+00 3.30895e-01 1.11599e+02 178.521 -9.06018e-01 2.33960e-02  0.00000e+00 0.00000e+00 2.92191e+01 178.521 8.23796e+01 358.521 0.4122 
1 1 1 -5  24  3  o 9  2.10118e+01 5.57650e-01 3.45574e+02 354.301 6.83610e+00  -6.82178e-01 0.00000e+00 0.00000e+00 3.84145e+02 354.301 3.85709e+01 354.301 0.9241 
1 1 1 -5  24  4  o 1  5.20481e+00 7.22174e-01 2.26026e+02 146.511 -1.02131e+00 6.75714e-01  0.00000e+00 0.00000e+00 1.24282e+02 326.511 3.50308e+02 326.511 0.5203 
1 1 1 -5  24  5  o 17 3.41455e+01 5.71514e-01 5.40013e+02 166.020 -2.34509e+01 5.83822e+00  0.00000e+00 0.00000e+00 7.15334e+02 166.020 1.75321e+02 166.020 0.9791 
1 1 1 -5  24  6  o 9  1.85188e+01 3.93436e-01 3.09558e+02 273.861 4.95752e-01  -7.34626e+00 0.00000e+00 0.00000e+00 3.36363e+02 273.861 2.68057e+01 273.861 0.9294 
1 1 1 -5  24  7  o 15 1.81258e+01 5.48055e-01 2.29262e+02 164.400 -6.16392e+00 1.72101e+00  0.00000e+00 0.00000e+00 3.94945e+02 164.400 1.65684e+02 164.400 0.9182 
1 1 1 -5  24  8  o 14 2.50975e+01 4.94083e-01 5.89851e+02 253.210 -8.95017e+00 -2.96631e+01 0.00000e+00 0.00000e+00 3.35560e+02 253.210 2.54291e+02 73.210  0.9837 
1 1 1 -5  24  9  o 19 3.38754e+01 5.45080e-01 7.41974e+02 355.971 6.54172e+01  -4.60721e+00 0.00000e+00 0.00000e+00 5.17134e+02 355.971 2.24841e+02 175.971 0.9923 
1 1 1 -5  24  10 f 0  3.19847e+01 7.49422e-01 6.12031e+02 268.341 -1.78568e+00 -6.16427e+01 0.00000e+00 0.00000e+00 5.75290e+02 268.341 3.67415e+01 88.341  0.9919 
1 1 1 -5  24  11 o 15 1.94006e+01 6.37473e-01 4.15315e+02 60.084  1.74855e+01  3.03882e+01  0.00000e+00 0.00000e+00 2.99741e+02 60.084  1.15574e+02 240.084 0.9856 
1 1 1 -5  24  12 o 13 2.94714e+01 7.55436e-01 4.48669e+02 224.920 -5.58259e+01 -5.56695e+01 0.00000e+00 0.00000e+00 6.45404e+02 224.920 1.96735e+02 224.920 0.9936 
1 1 1 -5  24  13 o 7  2.66593e+01 7.43507e-01 4.33510e+02 19.873  8.30702e+01  3.00261e+01  0.00000e+00 0.00000e+00 5.55897e+02 19.873  1.22387e+02 19.873  0.9943 
1 1 1 -5  24  14 o 18 4.20687e+00 1.02727e+00 4.47319e+01 233.943 -1.02767e+00 -1.41150e+00 0.00000e+00 0.00000e+00 5.74354e+01 233.943 1.27035e+01 233.943 0.6513 
1 1 1 -5  24  15 o 7  1.24267e+01 9.71381e-01 2.22044e+02 296.919 1.36445e+01  -2.68729e+01 0.00000e+00 0.00000e+00 2.33058e+02 296.919 1.10133e+01 296.919 0.9833 
1 1 1 -5  24  16 o 14 5.04308e+00 1.36992e+00 1.08253e+02 317.232 4.45703e+00  -4.12269e+00 0.00000e+00 0.00000e+00 6.31283e+01 317.232 4.51247e+01 137.232 0.9135 
1 1 1 -5  24  17 o 16 4.63848e+00 1.39961e+00 6.21218e+01 19.476  3.24177e+00  1.14645e+00  0.00000e+00 0.00000e+00 8.22843e+01 19.476  2.01625e+01 19.476  0.8378 
1 1 1 -5  24  18 f 0  6.53763e+00 1.72904e+00 1.03149e+02 216.725 -5.54151e+00 -4.13427e+00 0.00000e+00 0.00000e+00 1.21166e+02 216.725 1.80168e+01 216.725 0.9246 
1 1 1 -5  24  19 o 16 5.48795e+00 1.66741e+00 4.97764e+01 200.785 -2.95825e+00 -1.12286e+00 0.00000e+00 0.00000e+00 1.17296e+02 200.785 6.75193e+01 200.785 0.8214 
1 1 1 -5  25  1  f 0  1.52841e+01 4.15628e-01 1.86225e+02 325.894 1.99440e+00  -1.35059e+00 0.00000e+00 0.00000e+00 2.47540e+02 325.894 6.13148e+01 325.894 0.7547 
1 1 1 -5  25  2  o 4  2.24307e+01 4.52720e-01 5.87613e+02 343.251 1.11136e+01  -3.34451e+00 0.00000e+00 0.00000e+00 2.18460e+02 343.251 3.69153e+02 163.251 0.9559 
1 1 1 -5  25  3  o 15 1.81793e+01 4.98157e-01 3.76165e+02 106.327 -1.73939e+00 5.93767e+00  0.00000e+00 0.00000e+00 2.49076e+02 106.327 1.27088e+02 286.327 0.9152 
1 1 1 -5  25  4  o 14 2.68386e+01 4.73512e-01 5.64650e+02 233.106 -9.44111e+00 -1.25771e+01 0.00000e+00 0.00000e+00 4.10948e+02 233.106 1.53702e+02 53.106  0.9677 
1 1 1 -5  25  5  o 10 3.66567e+01 6.05824e-01 7.43367e+02 34.893  2.90691e+01  2.02733e+01  0.00000e+00 0.00000e+00 6.13435e+02 34.893  1.29932e+02 214.893 0.9858 
1 1 1 -5  25  6  o 9  2.59622e+01 4.87259e-01 5.67936e+02 304.186 1.05661e+01  -1.55557e+01 0.00000e+00 0.00000e+00 3.80082e+02 304.186 1.87854e+02 124.186 0.9730 
1 1 1 -5  25  7  o 5  1.67266e+01 3.96015e-01 3.08218e+02 15.283  9.43782e+00  2.57892e+00  0.00000e+00 0.00000e+00 2.86130e+02 15.283  2.20880e+01 195.283 0.9474 
1 1 1 -5  25  8  o 14 8.92697e+00 3.89231e-01 1.71182e+02 244.178 -1.39397e+00 -2.88078e+00 0.00000e+00 0.00000e+00 1.04437e+02 244.178 6.67456e+01 64.178  0.8238 
1 1 1 -5  25  9  o 8  3.85329e+01 6.02741e-01 6.52984e+02 13.743  6.34578e+01  1.55201e+01  0.00000e+00 0.00000e+00 7.79102e+02 13.743  1.26118e+02 13.743  0.9923 
1 1 1 -5  25  10 f 0  1.52918e+01 6.00040e-01 1.73272e+02 273.373 4.95515e-01  -8.40777e+00 0.00000e+00 0.00000e+00 3.63871e+02 273.373 1.90599e+02 273.373 0.9386 
1 1 1 -5  25  11 o 8  3.32079e+01 7.88210e-01 6.32661e+02 71.176  3.03160e+01  8.89301e+01  0.00000e+00 0.00000e+00 6.02428e+02 71.176  3.02335e+01 251.176 0.9947 
1 1 1 -5  25  12 o 4  1.33461e+01 6.88018e-01 2.71615e+02 221.352 -1.63642e+01 -1.44024e+01 0.00000e+00 0.00000e+00 2.15399e+02 221.352 5.62157e+01 41.352  0.9768 
1 1 1 -5  25  13 o 19 1.58378e+01 6.88580e-01 2.27826e+02 190.989 -2.73205e+01 -5.30510e+00 0.00000e+00 0.00000e+00 3.52560e+02 190.989 1.24734e+02 190.989 0.9819 
1 1 1 -5  25  14 o 15 2.82432e+00 8.81127e-01 3.24108e+01 283.851 2.13309e-01  -8.65098e-01 0.00000e+00 0.00000e+00 1.03883e+01 283.851 2.20225e+01 103.851 0.4064 
1 1 1 -5  25  15 o 19 4.62743e+00 1.25493e+00 1.12081e+02 222.997 -3.95357e+00 -3.68641e+00 0.00000e+00 0.00000e+00 4.33731e+01 222.997 6.87077e+01 42.997  0.9020 
1 1 1 -5  25  16 o 7  4.10902e+00 1.26051e+00 3.08599e+01 271.922 5.02562e-02  -1.49755e+00 0.00000e+00 0.00000e+00 6.02035e+01 271.922 2.93435e+01 271.922 0.5957 
1 1 1 -5  25  17 o 18 8.56592e+00 1.52291e+00 1.59671e+02 119.451 -7.42515e+00 1.31499e+01  0.00000e+00 0.00000e+00 1.47877e+02 119.451 1.17943e+01 299.451 0.9663 
1 1 1 -5  25  18 o 13 4.33878e+00 1.43129e+00 9.13616e+01 270.294 2.54196e-02  -4.94574e+00 0.00000e+00 0.00000e+00 5.22736e+01 270.294 3.90880e+01 90.294  0.8921 
1 1 1 -5  25  19 o 11 6.49219e+00 1.86247e+00 1.27858e+02 72.726  2.50073e+00  8.04157e+00  0.00000e+00 0.00000e+00 9.79658e+01 72.726  2.98918e+01 252.726 0.9386 
1 1 1 -5  26  1  o 15 1.08561e+01 3.77107e-01 3.40833e+02 235.652 -1.85150e+00 -2.70927e+00 0.00000e+00 0.00000e+00 2.49520e+00 55.652  3.43328e+02 55.652  0.8288 
1 1 1 -5  26  2  o 17 1.79177e+01 4.00207e-01 2.95276e+02 243.945 -2.22457e+00 -4.54993e+00 0.00000e+00 0.00000e+00 3.07462e+02 243.945 1.21860e+01 243.945 0.8949 
1 1 1 -5  26  3  o 7  1.27237e+01 3.29802e-01 8.24306e+01 202.222 -1.04110e+00 -4.25338e-01 0.00000e+00 0.00000e+00 1.51287e+02 202.222 6.88565e+01 202.222 0.4888 
1 1 1 -5  26  4  o 17 2.76391e+01 6.58753e-01 4.04618e+02 57.777  7.13368e+00  1.13181e+01  0.00000e+00 0.00000e+00 5.93991e+02 57.777  1.89373e+02 57.777  0.9619 
1 1 1 -5  26  5  o 9  2.63682e+01 4.70292e-01 5.69011e+02 77.413  3.88116e+00  1.73820e+01  0.00000e+00 0.00000e+00 3.92769e+02 77.413  1.76242e+02 257.413 0.9715 
1 1 1 -5  26  6  o 9  2.32190e+01 5.97064e-01 3.99640e+02 238.612 -6.37369e+00 -1.04466e+01 0.00000e+00 0.00000e+00 4.35249e+02 238.612 3.56088e+01 238.612 0.9582 
1 1 1 -5  26  7  o 4  2.46386e+01 4.44868e-01 4.12770e+02 359.838 1.91857e+01  -5.41235e-02 0.00000e+00 0.00000e+00 4.86819e+02 359.838 7.40484e+01 359.838 0.9736 
1 1 1 -5  26  8  o 7  8.31099e+00 4.00540e-01 2.31931e+02 146.191 -3.49653e+00 2.34149e+00  0.00000e+00 0.00000e+00 3.93857e+01 146.191 1.92545e+02 326.191 0.8711 
1 1 1 -5  26  9  f 0  7.34577e+00 3.47908e-01 1.43791e+02 98.730  -4.43158e-01 2.88600e+00  0.00000e+00 0.00000e+00 7.73578e+01 98.730  6.64328e+01 278.730 0.8039 
1 1 1 -5  26  10 o 16 6.32784e+00 8.78504e-01 8.25841e+01 276.079 1.77129e-01  -1.66306e+00 0.00000e+00 0.00000e+00 6.80095e+01 276.079 1.45746e+01 96.079  0.6360 
1 1 1 -5  26  11 o 13 1.29158e+01 6.51305e-01 2.20218e+02 107.083 -3.78857e+00 1.23276e+01  0.00000e+00 0.00000e+00 2.43581e+02 107.083 2.33637e+01 107.083 0.9604 
1 1 1 -5  26  12 o 8  1.07226e+01 8.45169e-01 1.24640e+02 313.599 5.50342e+00  -5.77929e+00 0.00000e+00 0.00000e+00 2.49903e+02 313.599 1.25263e+02 313.599 0.9351 
1 1 1 -5  26  13 f 0  1.01286e+01 7.26488e-01 1.52810e+02 251.113 -4.17599e+00 -1.22063e+01 0.00000e+00 0.00000e+00 2.10226e+02 251.113 5.74163e+01 251.113 0.9604 
1 1 1 -5  26  14 o 6  4.89487e+00 1.07811e+00 6.97949e+01 126.938 -1.94369e+00 2.58518e+00  0.00000e+00 0.00000e+00 8.09257e+01 126.938 1.11308e+01 126.938 0.8259 
1 1 1 -5  26  15 f 0  1.19081e+01 1.01536e+00 1.84249e+02 88.306  7.54725e-01  2.55254e+01  0.00000e+00 0.00000e+00 2.50447e+02 88.306  6.61985e+01 88.306  0.9802 
1 1 1 -5  26  16 o 17 9.75822e+00 1.32754e+00 1.93820e+02 230.516 -1.37555e+01 -1.66964e+01 0.00000e+00 0.00000e+00 1.60676e+02 230.516 3.31445e+01 50.516  0.9766 
1 1 1 -5  26  17 o 9  1.05591e+01 1.47040e+00 1.74282e+02 124.927 -1.22062e+01 1.74795e+01  0.00000e+00 0.00000e+00 2.08710e+02 124.927 3.44277e+01 124.927 0.9763 
1 1 1 -5  26  18 o 10 7.12907e+00 1.82573e+00 1.54004e+02 155.698 -9.70452e+00 4.38220e+00  0.00000e+00 0.00000e+00 9.77820e+01 155.698 5.62217e+01 335.698 0.9518 
1 1 1 -5  26  19 o 8  4.04130e+00 1.39951e+00 2.21701e+01 52.215  7.76948e-01  1.00216e+00  0.00000e+00 0.00000e+00 5.77037e+01 52.215  3.55336e+01 52.215  0.5334 
1 1 1 -5  27  1  o 12 2.12249e+01 4.94874e-01 4.02062e+02 179.296 -8.19924e+00 1.00775e-01  0.00000e+00 0.00000e+00 3.45615e+02 179.296 5.64475e+01 359.296 0.9369 
1 1 1 -5  27  2  o 15 1.79159e+01 4.03541e-01 1.96560e+02 20.752  3.00654e+00  1.13920e+00  0.00000e+00 0.00000e+00 3.58832e+02 20.752  1.62272e+02 20.752  0.8247 
1 1 1 -5  27  3  o 9  1.07692e+01 3.17372e-01 3.58513e+02 8.712   4.04989e+00  6.20575e-01  0.00000e+00 0.00000e+00 7.61051e+00 188.712 3.66123e+02 188.712 0.8672 
1 1 1 -5  27  4  o 7  2.67555e+01 4.73961e-01 5.11927e+02 95.102  -1.35438e+00 1.51702e+01  0.00000e+00 0.00000e+00 4.59435e+02 95.102  5.24920e+01 275.102 0.9666 
1 1 1 -5  27  5  o 12 2.75310e+01 4.85624e-01 5.93247e+02 8.714   1.98997e+01  3.05018e+00  0.00000e+00 0.00000e+00 4.14315e+02 8.714   1.78932e+02 188.714 0.9748 
1 1 1 -5  27  6  o 15 2.09816e+01 4.45355e-01 3.00591e+02 343.533 8.25514e+00  -2.44018e+00 0.00000e+00 0.00000e+00 4.39429e+02 343.533 1.38838e+02 343.533 0.9400 
1 1 1 -5  27  7  o 5  2.18333e+01 4.62058e-01 4.49768e+02 292.573 6.62224e+00  -1.59299e+01 0.00000e+00 0.00000e+00 3.44871e+02 292.573 1.04897e+02 112.573 0.9706 
1 1 1 -5  27  8  o 14 1.12873e+01 4.46593e-01 9.55635e+01 340.307 2.20636e+00  -7.89703e-01 0.00000e+00 0.00000e+00 2.20340e+02 340.307 1.24777e+02 340.307 0.7468 
1 1 1 -5  27  9  o 4  8.58959e+00 3.39311e-01 2.38627e+02 296.672 2.60451e+00  -5.18470e+00 0.00000e+00 0.00000e+00 5.38170e+01 296.672 1.84810e+02 116.672 0.9092 
1 1 1 -5  27  10 o 6  7.77542e+00 7.32281e-01 2.56175e+02 274.660 5.23898e-01  -6.42696e+00 0.00000e+00 0.00000e+00 1.11459e+01 274.660 2.45029e+02 94.660  0.9188 
1 1 1 -5  27  11 o 13 1.32349e+01 6.34630e-01 2.44515e+02 51.668  9.62820e+00  1.21774e+01  0.00000e+00 0.00000e+00 2.34083e+02 51.668  1.04317e+01 231.668 0.9672 
1 1 1 -5  27  12 o 1  6.03758e+00 9.53284e-01 1.46786e+02 308.698 3.23118e+00  -4.03343e+00 0.00000e+00 0.00000e+00 5.55386e+01 308.698 9.12478e+01 128.698 0.8971 
1 1 1 -5  27  13 o 6  6.87169e+00 9.12635e-01 5.65591e+01 21.865  2.90539e+00  1.16589e+00  0.00000e+00 0.00000e+00 1.53508e+02 21.865  9.69486e+01 21.865  0.8192 
1 1 1 -5  27  14 o 8  1.73839e+01 7.59907e-01 3.19329e+02 249.295 -2.06893e+01 -5.47392e+01 0.00000e+00 0.00000e+00 3.23158e+02 249.295 3.82985e+00 249.295 0.9914 
1 1 1 -5  27  15 o 15 5.82350e+00 1.29287e+00 1.30439e+02 176.687 -7.49634e+00 4.33889e-01  0.00000e+00 0.00000e+00 7.14134e+01 176.687 5.90257e+01 356.687 0.9308 
1 1 1 -5  27  16 o 7  1.00224e+01 1.30306e+00 1.91795e+02 312.545 1.50584e+01  -1.64076e+01 0.00000e+00 0.00000e+00 1.72525e+02 312.545 1.92702e+01 132.545 0.9773 
1 1 1 -5  27  17 o 12 5.64061e+00 1.53911e+00 7.49607e+01 224.159 -3.24282e+00 -3.14900e+00 0.00000e+00 0.00000e+00 1.09638e+02 224.159 3.46768e+01 224.159 0.8809 
1 1 1 -5  27  18 o 14 4.14787e+00 1.36671e+00 9.28185e+01 67.549  1.93451e+00  4.68156e+00  0.00000e+00 0.00000e+00 4.49033e+01 67.549  4.79153e+01 247.549 0.8949 
1 1 1 -5  27  19 o 13 7.56034e+00 2.06765e+00 1.04028e+02 286.550 2.02124e+00  -6.80158e+00 0.00000e+00 0.00000e+00 1.55545e+02 286.550 5.15174e+01 286.550 0.9266 
1 1 1 -5  28  1  o 19 2.00812e+01 4.32769e-01 4.26389e+02 66.375  3.25637e+00  7.44458e+00  0.00000e+00 0.00000e+00 2.80493e+02 66.375  1.45896e+02 246.375 0.9363 
1 1 1 -5  28  2  o 4  2.64588e+01 5.10840e-01 4.99127e+02 329.268 1.02204e+01  -6.07614e+00 0.00000e+00 0.00000e+00 4.52568e+02 329.268 4.65584e+01 149.268 0.9570 
1 1 1 -5  28  3  o 1  3.48002e+01 7.80469e-01 7.14005e+02 43.723  1.86361e+01  1.78231e+01  0.00000e+00 0.00000e+00 5.67922e+02 43.723  1.46084e+02 223.723 0.9804 
1 1 1 -5  28  4  o 18 1.53068e+01 3.49161e-01 1.75577e+02 124.256 -1.67210e+00 2.45522e+00  0.00000e+00 0.00000e+00 2.88800e+02 124.256 1.13223e+02 124.256 0.8078 
1 1 1 -5  28  5  o 6  1.10190e+01 3.22313e-01 7.55829e+01 50.334  6.53167e-01  7.87692e-01  0.00000e+00 0.00000e+00 1.12450e+02 50.334  3.68675e+01 50.334  0.4546 
1 1 1 -5  28  6  o 6  7.39411e+00 5.44940e-01 1.19327e+02 1.641   1.19496e+00  3.42304e-02  0.00000e+00 0.00000e+00 2.25381e+01 1.641   9.67884e+01 181.641 0.5114 
1 1 1 -5  28  7  o 7  7.51591e+00 3.64923e-01 3.16702e+01 111.254 -1.48214e-01 3.81046e-01  0.00000e+00 0.00000e+00 2.47706e+01 111.254 6.89963e+00 291.254 0.2003 
1 1 1 -5  28  8  o 13 2.15390e+01 4.39619e-01 3.20132e+02 161.060 -1.45024e+01 4.97672e+00  0.00000e+00 0.00000e+00 4.60194e+02 161.060 1.40062e+02 161.060 0.9668 
1 1 1 -5  28  9  o 18 1.79546e+01 3.73775e-01 4.14038e+02 17.842  1.99507e+01  6.42177e+00  0.00000e+00 0.00000e+00 2.42027e+02 17.842  1.72011e+02 197.842 0.9758 
1 1 1 -5  28  10 o 17 1.61755e+01 6.04975e-01 2.97876e+02 114.794 -7.14071e+00 1.54584e+01  0.00000e+00 0.00000e+00 2.89288e+02 114.794 8.58844e+00 294.794 0.9702 
1 1 1 -5  28  11 o 4  1.22242e+01 6.69346e-01 3.06448e+02 30.221  1.51128e+01  8.80330e+00  0.00000e+00 0.00000e+00 1.37280e+02 30.221  1.69168e+02 210.221 0.9710 
1 1 1 -5  28  12 o 2  1.72259e+01 6.68312e-01 2.72494e+02 272.927 1.61446e+00  -3.15776e+01 0.00000e+00 0.00000e+00 3.60640e+02 272.927 8.81459e+01 272.927 0.9841 
1 1 1 -5  28  13 o 2  9.82129e+00 7.50973e-01 1.68237e+02 307.512 8.42809e+00  -1.09788e+01 0.00000e+00 0.00000e+00 1.84739e+02 307.512 1.65026e+01 307.512 0.9632 
1 1 1 -5  28  14 o 13 2.04929e+01 7.64232e-01 3.31448e+02 157.299 -6.37086e+01 2.66506e+01  0.00000e+00 0.00000e+00 4.26891e+02 157.299 9.54422e+01 157.299 0.9927 
1 1 1 -5  28  15 o 4  4.53770e+00 1.23906e+00 7.12223e+01 269.723 -1.67204e-02 -3.45693e+00 0.00000e+00 0.00000e+00 7.05080e+01 269.723 7.14364e-01 89.723  0.8388 
1 1 1 -5  28  16 o 9  4.84361e+00 1.32129e+00 6.76765e+01 136.545 -2.71292e+00 2.57041e+00  0.00000e+00 0.00000e+00 8.59164e+01 136.545 1.82398e+01 136.545 0.8526 
1 1 1 -5  28  17 f 0  1.24836e+01 1.48539e+00 1.68729e+02 30.553  2.00177e+01  1.18162e+01  0.00000e+00 0.00000e+00 2.84922e+02 30.553  1.16192e+02 30.553  0.9782 
1 1 1 -5  28  18 o 2  4.31538e+00 1.41402e+00 4.31110e+01 58.974  1.23554e+00  2.05414e+00  0.00000e+00 0.00000e+00 7.74981e+01 58.974  3.43872e+01 58.974  0.7533 
1 1 1 -5  28  19 o 14 5.26554e+00 1.71446e+00 1.43073e+02 97.105  -1.08274e+00 8.68648e+00  0.00000e+00 0.00000e+00 4.05145e+01 97.105  1.02558e+02 277.105 0.9410 
1 1 1 -5  29  1  o 5  1.46690e+01 3.82448e-01 4.42646e+02 45.258  4.13849e+00  4.17590e+00  0.00000e+00 0.00000e+00 5.94325e+01 45.258  3.83213e+02 225.258 0.9104 
1 1 1 -5  29  2  o 10 3.23143e+01 7.57120e-01 6.78145e+02 87.720  9.20943e-01  2.31334e+01  0.00000e+00 0.00000e+00 5.09801e+02 87.720  1.68344e+02 267.720 0.9782 
1 1 1 -5  29  3  o 9  1.45173e+01 3.46845e-01 3.35621e+02 296.076 2.22119e+00  -4.53887e+00 0.00000e+00 0.00000e+00 1.52307e+02 296.076 1.83315e+02 116.076 0.8946 
1 1 1 -5  29  4  o 17 1.10941e+01 5.15279e-01 1.83286e+02 246.739 -1.05397e+00 -2.45188e+00 0.00000e+00 0.00000e+00 1.42591e+02 246.739 4.06947e+01 66.739  0.7822 
1 1 1 -5  29  5  o 13 2.63847e+01 4.73500e-01 4.96488e+02 340.402 1.60827e+01  -5.72623e+00 0.00000e+00 0.00000e+00 4.64436e+02 340.402 3.20512e+01 160.402 0.9703 
1 1 1 -5  29  6  o 5  4.32762e+01 6.56394e-01 7.03721e+02 256.727 -1.10650e+01 -4.69051e+01 0.00000e+00 0.00000e+00 9.02900e+02 256.727 1.99179e+02 256.727 0.9896 
1 1 1 -5  29  7  o 18 3.36555e+01 5.88961e-01 6.32641e+02 185.686 -3.59697e+01 -3.58144e+00 0.00000e+00 0.00000e+00 6.11646e+02 185.686 2.09945e+01 5.686   0.9861 
1 1 1 -5  29  8  o 14 1.13343e+01 4.68963e-01 2.67528e+02 311.747 4.95183e+00  -5.54868e+00 0.00000e+00 0.00000e+00 1.27476e+02 311.747 1.40052e+02 131.747 0.9301 
1 1 1 -5  29  9  o 10 3.12461e+01 5.62899e-01 4.83731e+02 166.821 -4.43511e+01 1.03856e+01  0.00000e+00 0.00000e+00 6.73269e+02 166.821 1.89538e+02 166.821 0.9890 
1 1 1 -5  29  10 o 1  6.41655e+00 6.16020e-01 5.70342e+01 355.728 1.25293e+00  -9.35817e-02 0.00000e+00 0.00000e+00 7.01761e+01 355.728 1.31419e+01 355.728 0.5299 
1 1 1 -5  29  11 o 3  1.99057e+01 6.52514e-01 3.88897e+02 222.599 -2.65701e+01 -2.44319e+01 0.00000e+00 0.00000e+00 3.44818e+02 222.599 4.40789e+01 42.599  0.9860 
1 1 1 -5  29  12 o 16 6.73398e+00 9.46900e-01 1.50051e+02 94.351  -5.04139e-01 6.62535e+00  0.00000e+00 0.00000e+00 8.16609e+01 94.351  6.83902e+01 274.351 0.9213 
1 1 1 -5  29  13 o 7  6.40333e+00 9.16624e-01 1.52292e+02 181.632 -8.20760e+00 -2.33885e-01 0.00000e+00 0.00000e+00 7.15646e+01 181.632 8.07274e+01 1.632   0.9370 
1 1 1 -5  29  14 o 2  1.46510e+01 7.75305e-01 2.46873e+02 85.152  3.26687e+00  3.85194e+01  0.00000e+00 0.00000e+00 2.92105e+02 85.152  4.52324e+01 85.152  0.9870 
1 1 1 -5  29  15 o 14 4.04634e+00 1.19345e+00 9.56313e+01 137.535 -3.11845e+00 2.85404e+00  0.00000e+00 0.00000e+00 3.56992e+01 137.535 5.99321e+01 317.535 0.8717 
1 1 1 -5  29  16 o 12 1.07787e+01 1.25599e+00 1.28017e+02 242.166 -7.65023e+00 -1.44891e+01 0.00000e+00 0.00000e+00 2.60410e+02 242.166 1.32393e+02 242.166 0.9690 
1 1 1 -5  29  17 o 12 6.59007e+00 1.60995e+00 1.52106e+02 124.218 -6.07465e+00 8.93249e+00  0.00000e+00 0.00000e+00 8.10590e+01 124.218 7.10474e+01 304.218 0.9525 
1 1 1 -5  29  18 o 15 5.89273e+00 1.67883e+00 1.09513e+02 158.033 -6.51082e+00 2.62620e+00  0.00000e+00 0.00000e+00 9.28636e+01 158.033 1.66497e+01 338.033 0.9258 
1 1 1 -5  29  19 o 5  5.42036e+00 1.63394e+00 7.48819e+01 301.097 2.58394e+00  -4.28397e+00 0.00000e+00 0.00000e+00 1.04536e+02 301.097 2.96541e+01 301.097 0.8935 
1 1 1 -5  30  1  o 18 4.31025e+01 8.53260e-01 9.99185e+02 12.707  4.43831e+01  1.00075e+01  0.00000e+00 0.00000e+00 6.03177e+02 12.707  3.96009e+02 192.707 0.9889 
1 1 1 -5  30  2  o 13 6.33413e+00 5.58383e-01 1.73443e+02 331.349 1.01049e+00  -5.52100e-01 0.00000e+00 0.00000e+00 5.50213e+01 151.349 2.28464e+02 151.349 0.4975 
1 1 1 -5  30  3  o 8  1.07223e+01 3.26836e-01 1.58936e+02 119.003 -9.92019e-01 1.78941e+00  0.00000e+00 0.00000e+00 1.25114e+02 119.003 3.38226e+01 299.003 0.7052 
1 1 1 -5  30  4  o 17 1.22836e+01 3.45711e-01 2.19152e+02 185.363 -3.20661e+00 -3.01052e-01 0.00000e+00 0.00000e+00 1.61420e+02 185.363 5.77328e+01 5.363   0.8251 
1 1 1 -5  30  5  o 1  3.11390e+01 5.35391e-01 6.55228e+02 84.674  2.42554e+00  2.60207e+01  0.00000e+00 0.00000e+00 4.90934e+02 84.674  1.64294e+02 264.675 0.9807 
1 1 1 -5  30  6  o 9  4.81296e+01 8.22416e-01 8.44444e+02 322.387 4.93380e+01  -3.80131e+01 0.00000e+00 0.00000e+00 9.46491e+02 322.387 1.02046e+02 322.387 0.9919 
1 1 1 -5  30  7  o 3  3.38685e+01 6.18768e-01 4.79456e+02 87.376  1.27048e+00  2.77237e+01  0.00000e+00 0.00000e+00 7.67206e+02 87.376  2.87751e+02 87.376  0.9818 
1 1 1 -5  30  8  o 2  3.05521e+01 5.54721e-01 5.36035e+02 185.885 -3.96503e+01 -4.08675e+00 0.00000e+00 0.00000e+00 5.94174e+02 185.885 5.81389e+01 185.885 0.9874 
1 1 1 -5  30  9  o 5  3.25997e+01 5.35363e-01 5.80515e+02 78.057  1.12511e+01  5.31940e+01  0.00000e+00 0.00000e+00 6.28706e+02 78.057  4.81907e+01 78.057  0.9908 
1 1 1 -5  30  10 o 15 2.11553e+01 4.56729e-01 4.47232e+02 275.874 3.35223e+00  -3.25836e+01 0.00000e+00 0.00000e+00 3.32002e+02 275.874 1.15230e+02 95.874  0.9846 
1 1 1 -5  30  11 o 5  2.06727e+01 6.56847e-01 4.32387e+02 351.173 4.41791e+01  -6.86073e+00 0.00000e+00 0.00000e+00 3.31627e+02 351.173 1.00760e+02 171.173 0.9888 
1 1 1 -5  30  12 o 15 4.64305e+00 9.84804e-01 1.32771e+02 127.212 -2.42459e+00 3.19292e+00  0.00000e+00 0.00000e+00 1.70178e+01 127.212 1.15753e+02 307.212 0.8639 
1 1 1 -5  30  13 o 2  2.61324e+01 7.56311e-01 5.01588e+02 313.236 7.88164e+01  -8.38257e+01 0.00000e+00 0.00000e+00 4.69120e+02 313.236 3.24676e+01 133.236 0.9956 
1 1 1 -5  30  14 o 19 7.28072e+00 1.00489e+00 1.66006e+02 147.825 -1.00947e+01 6.35089e+00  0.00000e+00 0.00000e+00 9.37089e+01 147.825 7.22967e+01 327.825 0.9571 
1 1 1 -5  30  15 o 15 6.94265e+00 1.25885e+00 5.67981e+01 4.258   4.17965e+00  3.11194e-01  0.00000e+00 0.00000e+00 1.68199e+02 4.258   1.11401e+02 4.258   0.8705 
1 1 1 -5  30  16 o 6  1.73869e+01 1.11098e+00 2.98346e+02 231.045 -4.18499e+01 -5.17639e+01 0.00000e+00 0.00000e+00 3.43340e+02 231.045 4.49938e+01 231.045 0.9925 
1 1 1 -5  30  17 o 13 5.64525e+00 1.53186e+00 1.06921e+02 349.635 6.92948e+00  -1.26738e+00 0.00000e+00 0.00000e+00 8.72426e+01 349.635 1.96788e+01 169.635 0.9260 
1 1 1 -5  30  18 o 18 5.19936e+00 1.59114e+00 6.14173e+01 50.642  2.33634e+00  2.84852e+00  0.00000e+00 0.00000e+00 1.02554e+02 50.642  4.11362e+01 50.642  0.8502 
1 1 1 -5  31  1  o 1  2.75927e+01 5.35108e-01 4.54686e+02 70.666  4.37489e+00  1.24693e+01  0.00000e+00 0.00000e+00 5.42416e+02 70.666  8.77300e+01 70.666  0.9614 
1 1 1 -5  31  2  o 6  7.41260e+00 4.07446e-01 3.30701e+02 358.662 2.54723e+00  -5.94973e-02 0.00000e+00 0.00000e+00 1.16193e+02 178.662 4.46894e+02 178.662 0.7701 
1 1 1 -5  31  3  o 15 1.28703e+01 5.37347e-01 1.40162e+02 40.746  1.51063e+00  1.30147e+00  0.00000e+00 0.00000e+00 1.96699e+02 40.746  5.65371e+01 40.746  0.6968 
1 1 1 -5  31  4  o 4  2.32824e+01 4.80489e-01 5.33885e+02 343.418 1.40998e+01  -4.19858e+00 0.00000e+00 0.00000e+00 3.10067e+02 343.418 2.23819e+02 163.418 0.9654 
1 1 1 -5  31  5  o 2  3.54252e+01 5.91215e-01 5.20197e+02 15.030  2.26194e+01  6.07365e+00  0.00000e+00 0.00000e+00 7.80615e+02 15.030  2.60418e+02 15.030  0.9784 
1 1 1 -5  31  6  o 16 3.68003e+01 6.57626e-01 7.77337e+02 169.571 -4.31850e+01 7.94876e+00  0.00000e+00 0.00000e+00 5.87230e+02 169.571 1.90107e+02 349.571 0.9885 
1 1 1 -5  31  7  o 16 5.44137e+00 4.79560e-01 1.69935e+02 7.123   1.92729e+00  2.40852e-01  0.00000e+00 0.00000e+00 2.95813e+01 187.123 1.99516e+02 187.123 0.6881 
1 1 1 -5  31  8  o 5  2.18717e+01 4.03560e-01 2.98327e+02 227.643 -1.06099e+01 -1.16368e+01 0.00000e+00 0.00000e+00 4.94589e+02 227.643 1.96262e+02 227.643 0.9677 
1 1 1 -5  31  9  o 1  1.28053e+01 3.84345e-01 1.78573e+02 251.139 -2.13190e+00 -6.24053e+00 0.00000e+00 0.00000e+00 2.62793e+02 251.139 8.42203e+01 251.139 0.9207 
1 1 1 -5  31  10 o 1  2.88540e+01 4.91326e-01 5.55240e+02 351.842 6.22201e+01  -8.91994e+00 0.00000e+00 0.00000e+00 5.15467e+02 351.842 3.97733e+01 171.842 0.9920 
1 1 1 -5  31  11 o 12 2.90277e+01 7.43015e-01 4.70335e+02 153.277 -6.46719e+01 3.25584e+01  0.00000e+00 0.00000e+00 6.07056e+02 153.277 1.36721e+02 153.277 0.9931 
1 1 1 -5  31  12 o 6  1.65078e+01 6.56315e-01 2.69644e+02 156.400 -2.99296e+01 1.30762e+01  0.00000e+00 0.00000e+00 3.37267e+02 156.400 6.76233e+01 156.400 0.9846 
1 1 1 -5  31  13 o 3  5.02445e+00 1.04482e+00 8.80110e+01 272.496 1.55496e-01  -3.56769e+00 0.00000e+00 0.00000e+00 7.03237e+01 272.496 1.76872e+01 92.496  0.8447 
1 1 1 -5  31  14 o 9  5.78902e+00 1.03670e+00 7.48675e+01 223.325 -2.90326e+00 -2.73828e+00 0.00000e+00 0.00000e+00 1.11352e+02 223.325 3.64842e+01 223.325 0.8632 
1 1 1 -5  31  15 o 1  4.08875e+00 1.19890e+00 6.69926e+01 284.015 7.48275e-01  -2.99775e+00 0.00000e+00 0.00000e+00 5.72720e+01 284.015 9.72062e+00 104.015 0.8164 
1 1 1 -5  31  16 o 17 5.01939e+00 1.39488e+00 9.76067e+01 111.462 -1.96724e+00 5.00373e+00  0.00000e+00 0.00000e+00 7.06371e+01 111.462 2.69696e+01 291.462 0.9014 
1 1 1 -5  31  17 o 8  4.78930e+00 1.44448e+00 5.75603e+01 66.240  1.37259e+00  3.11804e+00  0.00000e+00 0.00000e+00 9.11522e+01 66.240  3.35918e+01 66.240  0.8361 
1 1 1 -5  31  18 o 16 4.60085e+00 1.54356e+00 1.15239e+02 266.925 -3.49013e-01 -6.49645e+00 0.00000e+00 0.00000e+00 4.16873e+01 266.925 7.35512e+01 86.925  0.9196 
1 1 1 -5  32  1  o 3  1.02404e+01 6.15133e-01 2.43104e+02 150.763 -2.25311e+00 1.26111e+00  0.00000e+00 0.00000e+00 5.46544e+01 150.763 1.88450e+02 330.763 0.7736 
1 1 1 -5  32  2  o 5  4.24792e+01 6.94957e-01 9.42034e+02 173.312 -4.74209e+01 5.56077e+00  0.00000e+00 0.00000e+00 6.37260e+02 173.312 3.04774e+02 353.312 0.9895 
1 1 1 -5  32  3  o 6  1.25004e+01 4.18758e-01 1.98080e+02 337.597 3.01909e+00  -1.24455e+00 0.00000e+00 0.00000e+00 1.90611e+02 337.597 7.46906e+00 157.597 0.8279 
1 1 1 -5  32  4  o 16 2.46193e+01 4.94649e-01 6.47651e+02 330.643 1.70662e+01  -9.59949e+00 0.00000e+00 0.00000e+00 2.52753e+02 330.643 3.94897e+02 150.643 0.9741 
1 1 1 -5  32  5  o 13 4.77291e+01 7.64904e-01 9.97516e+02 5.951   6.19772e+01  6.46028e+00  0.00000e+00 0.00000e+00 7.79177e+02 5.951   2.18339e+02 185.951 0.9919 
1 1 1 -5  32  6  o 14 2.39816e+01 4.28576e-01 4.61818e+02 81.847  2.97590e+00  2.07712e+01  0.00000e+00 0.00000e+00 4.15949e+02 81.847  4.58696e+01 261.847 0.9759 
1 1 1 -5  32  7  o 19 1.02587e+01 3.25455e-01 3.46417e+02 89.188  1.05994e-01  7.48093e+00  0.00000e+00 0.00000e+00 1.14161e+01 89.188  3.35001e+02 269.188 0.9305 
1 1 1 -5  32  8  o 3  2.09851e+01 4.49040e-01 3.13153e+02 188.502 -1.74499e+01 -2.60853e+00 0.00000e+00 0.00000e+00 4.50327e+02 188.502 1.37174e+02 188.502 0.9712 
1 1 1 -5  32  9  o 1  1.32836e+01 4.88634e-01 2.56877e+02 320.197 8.45687e+00  -7.04672e+00 0.00000e+00 0.00000e+00 2.17207e+02 320.197 3.96694e+01 140.197 0.9534 
1 1 1 -5  32  10 o 17 2.04017e+01 4.04629e-01 3.70808e+02 97.323  -4.18643e+00 3.25763e+01  0.00000e+00 0.00000e+00 3.80576e+02 97.323  9.76790e+00 97.323  0.9847 
1 1 1 -5  32  11 o 5  1.54359e+01 6.40881e-01 2.93683e+02 252.732 -7.95595e+00 -2.55943e+01 0.00000e+00 0.00000e+00 2.72316e+02 252.732 2.13673e+01 72.732  0.9812 
1 1 1 -5  32  12 f 0  9.45640e+00 7.49532e-01 1.69045e+02 145.994 -9.60303e+00 6.47889e+00  0.00000e+00 0.00000e+00 1.68436e+02 145.994 6.08449e-01 325.994 0.9558 
1 1 1 -5  32  13 o 14 7.64753e+00 9.06936e-01 1.76719e+02 244.119 -4.96219e+00 -1.02279e+01 0.00000e+00 0.00000e+00 9.56973e+01 244.119 8.10218e+01 64.119  0.9550 
1 1 1 -5  32  14 o 16 7.82379e+00 9.48147e-01 1.76705e+02 44.117  1.01533e+01  9.84529e+00  0.00000e+00 0.00000e+00 1.04334e+02 44.117  7.23718e+01 224.117 0.9640 
1 1 1 -5  32  15 o 13 1.14883e+01 9.03202e-01 1.63423e+02 323.572 1.86687e+01  -1.37778e+01 0.00000e+00 0.00000e+00 2.54887e+02 323.572 9.14644e+01 323.572 0.9782 
1 1 1 -5  32  16 o 1  9.45100e+00 1.46191e+00 1.91707e+02 249.877 -6.77737e+00 -1.84970e+01 0.00000e+00 0.00000e+00 1.50647e+02 249.877 4.10597e+01 69.877  0.9743 
1 1 1 -5  32  17 o 7  7.27028e+00 1.52899e+00 1.33207e+02 138.938 -8.20154e+00 7.14514e+00  0.00000e+00 0.00000e+00 1.24052e+02 138.938 9.15503e+00 318.938 0.9529 
1 1 1 -5  32  18 o 16 4.00422e+00 1.34994e+00 5.71085e+01 21.082  2.98398e+00  1.15034e+00  0.00000e+00 0.00000e+00 6.52073e+01 21.082  8.09882e+00 21.082  0.8236 
1 1 1 -5  33  1  o 4  8.07049e+00 4.08749e-01 2.78253e+02 311.900 1.80497e+00  -2.01164e+00 0.00000e+00 0.00000e+00 4.00548e+01 131.900 3.18308e+02 131.900 0.7854 
1 1 1 -5  33  2  o 16 2.78462e+01 5.00609e-01 4.50976e+02 32.129  1.17814e+01  7.39869e+00  0.00000e+00 0.00000e+00 5.56883e+02 32.129  1.05907e+02 32.129  0.9634 
1 1 1 -5  33  3  o 9  2.16486e+01 4.24242e-01 3.08440e+02 213.095 -7.31059e+00 -4.76473e+00 0.00000e+00 0.00000e+00 4.56504e+02 213.095 1.48064e+02 213.095 0.9408 
1 1 1 -5  33  4  o 3  2.19606e+01 5.80983e-01 6.45408e+02 284.017 4.46908e+00  -1.79017e+01 0.00000e+00 0.00000e+00 1.56363e+02 284.017 4.89045e+02 104.017 0.9725 
1 1 1 -5  33  5  o 7  5.94332e+01 8.74916e-01 9.88744e+02 136.743 -5.74163e+01 5.40254e+01  0.00000e+00 0.00000e+00 1.22721e+03 136.743 2.38464e+02 136.743 0.9936 
1 1 1 -5  33  6  o 10 3.66710e+01 6.26649e-01 6.81828e+02 83.951  4.61365e+00  4.35381e+01  0.00000e+00 0.00000e+00 6.77660e+02 83.951  4.16790e+00 263.951 0.9885 
1 1 1 -5  33  7  o 11 1.87112e+01 3.67897e-01 3.27998e+02 232.686 -7.79171e+00 -1.02230e+01 0.00000e+00 0.00000e+00 3.45455e+02 232.686 1.74573e+01 232.686 0.9603 
1 1 1 -5  33  8  o 9  2.52588e+01 4.96216e-01 5.49613e+02 326.034 3.01206e+01  -2.02908e+01 0.00000e+00 0.00000e+00 3.83366e+02 326.034 1.66247e+02 146.034 0.9861 
1 1 1 -5  33  9  o 15 1.97567e+01 3.96310e-01 2.09409e+02 235.201 -7.38872e+00 -1.06315e+01 0.00000e+00 0.00000e+00 5.00911e+02 235.201 2.91503e+02 235.201 0.9606 
1 1 1 -5  33  10 o 6  2.18624e+01 4.33068e-01 3.03623e+02 36.753  2.29425e+01  1.71340e+01  0.00000e+00 0.00000e+00 4.99623e+02 36.753  1.96000e+02 36.753  0.9824 
1 1 1 -5  33  11 o 5  1.11894e+01 7.20277e-01 2.03098e+02 186.018 -1.31648e+01 -1.38785e+00 0.00000e+00 0.00000e+00 1.98915e+02 186.018 4.18219e+00 6.018   0.9615 
1 1 1 -5  33  12 o 2  8.49109e+00 8.10681e-01 1.65372e+02 167.401 -9.61916e+00 2.14996e+00  0.00000e+00 0.00000e+00 1.35100e+02 167.401 3.02724e+01 347.401 0.9478 
1 1 1 -5  33  13 o 18 1.13345e+01 7.49431e-01 1.53248e+02 283.769 3.82339e+00  -1.56028e+01 0.00000e+00 0.00000e+00 2.56137e+02 283.769 1.02889e+02 283.769 0.9684 
1 1 1 -5  33  14 o 10 4.29714e+00 1.04054e+00 3.47315e+01 179.116 -1.53900e+00 2.37358e-02  0.00000e+00 0.00000e+00 6.22442e+01 179.116 2.75128e+01 179.116 0.6057 
1 1 1 -5  33  15 o 15 6.56851e+00 1.16433e+00 7.08465e+01 48.605  3.37784e+00  3.83209e+00  0.00000e+00 0.00000e+00 1.48166e+02 48.605  7.73197e+01 48.605  0.8958 
1 1 1 -5  33  16 o 3  7.79169e+00 1.35043e+00 1.58871e+02 142.342 -1.07989e+01 8.33359e+00  0.00000e+00 0.00000e+00 1.19973e+02 142.342 3.88982e+01 322.342 0.9626 
1 1 1 -5  33  17 f 0  4.71741e+00 1.43797e+00 3.25429e+01 344.457 1.78727e+00  -4.97093e-01 0.00000e+00 0.00000e+00 8.52546e+01 344.457 5.27117e+01 344.457 0.6725 
1 1 1 -5  33  18 o 13 1.04492e+01 1.98102e+00 1.53207e+02 63.507  6.53063e+00  1.31023e+01  0.00000e+00 0.00000e+00 2.20822e+02 63.507  6.76148e+01 63.507  0.9652 
1 1 1 -5  34  1  o 2  5.87240e+01 9.32549e-01 1.11677e+03 168.684 -7.04116e+01 1.40902e+01  0.00000e+00 0.00000e+00 1.07453e+03 168.684 4.22421e+01 348.684 0.9930 
1 1 1 -5  34  2  f 0  2.95407e+01 5.23921e-01 6.24806e+02 50.219  1.55503e+01  1.86766e+01  0.00000e+00 0.00000e+00 4.61867e+02 50.219  1.62939e+02 230.219 0.9792 
1 1 1 -5  34  3  o 10 1.75284e+01 3.82955e-01 1.88062e+02 158.500 -3.63982e+00 1.43373e+00  0.00000e+00 0.00000e+00 3.78071e+02 158.500 1.90009e+02 158.500 0.8601 
1 1 1 -5  34  4  o 10 1.30488e+01 3.46998e-01 1.53462e+02 162.511 -2.45847e+00 7.74640e-01  0.00000e+00 0.00000e+00 2.25261e+02 162.511 7.17988e+01 162.511 0.7732 
1 1 1 -5  34  5  o 6  5.28959e+01 7.87868e-01 1.11484e+03 342.195 8.84713e+01  -2.84127e+01 0.00000e+00 0.00000e+00 8.59110e+02 342.195 2.55728e+02 162.195 0.9946 
1 1 1 -5  34  6  o 5  2.05951e+01 5.36051e-01 4.11792e+02 212.937 -1.21860e+01 -7.89454e+00 0.00000e+00 0.00000e+00 3.33433e+02 212.937 7.83592e+01 32.937  0.9649 
1 1 1 -5  34  7  o 11 1.76241e+01 3.59901e-01 3.55561e+02 350.312 1.34810e+01  -2.30149e+00 0.00000e+00 0.00000e+00 2.80317e+02 350.312 7.52446e+01 170.312 0.9627 
1 1 1 -5  34  8  o 17 2.67125e+01 4.94156e-01 5.80304e+02 330.249 3.70268e+01  -2.11632e+01 0.00000e+00 0.00000e+00 4.08353e+02 330.249 1.71951e+02 150.249 0.9882 
1 1 1 -5  34  9  o 19 3.22217e+01 5.18453e-01 5.79889e+02 72.369  1.81426e+01  5.70858e+01  0.00000e+00 0.00000e+00 6.15923e+02 72.369  3.60346e+01 72.369  0.9916 
1 1 1 -5  34  10 o 14 3.46829e+01 6.25067e-01 5.13330e+02 40.993  5.87179e+01  5.10309e+01  0.00000e+00 0.00000e+00 7.75326e+02 40.993  2.61995e+02 40.993  0.9936 
1 1 1 -5  34  11 o 7  6.19703e+00 9.21846e-01 5.49399e+01 109.903 -6.26488e-01 1.73034e+00  0.00000e+00 0.00000e+00 1.00135e+02 109.903 4.51946e+01 109.903 0.6697 
1 1 1 -5  34  12 o 5  1.34280e+01 6.91151e-01 3.32617e+02 221.021 -2.41476e+01 -2.10065e+01 0.00000e+00 0.00000e+00 1.60772e+02 221.021 1.71845e+02 41.021  0.9843 
1 1 1 -5  34  13 o 3  1.21493e+01 8.63922e-01 1.76774e+02 252.244 -5.93364e+00 -1.85305e+01 0.00000e+00 0.00000e+00 2.64536e+02 252.244 8.77624e+01 252.244 0.9740 
1 1 1 -5  34  14 o 18 4.62504e+00 1.08309e+00 5.90027e+01 61.511  1.31708e+00  2.42688e+00  0.00000e+00 0.00000e+00 7.72393e+01 61.511  1.82366e+01 61.511  0.7907 
1 1 1 -5  34  15 o 1  5.04306e+00 1.13829e+00 5.62832e+01 130.641 -2.11556e+00 2.46471e+00  0.00000e+00 0.00000e+00 9.88904e+01 130.641 4.26072e+01 130.641 0.8268 
1 1 1 -5  34  16 o 11 7.82638e+00 1.50832e+00 1.41087e+02 146.667 -9.29534e+00 6.11347e+00  0.00000e+00 0.00000e+00 1.36448e+02 146.667 4.63958e+00 326.667 0.9539 
1 1 1 -5  34  17 o 18 7.78944e+00 1.57291e+00 9.72751e+01 116.283 -3.54459e+00 7.17737e+00  0.00000e+00 0.00000e+00 1.73218e+02 116.283 7.59429e+01 116.283 0.9353 
1 1 1 -5  34  18 o 10 4.80064e+00 1.52258e+00 5.83155e+01 321.398 2.74682e+00  -2.19288e+00 0.00000e+00 0.00000e+00 9.15506e+01 321.398 3.32351e+01 321.398 0.8419 
1 1 1 -5  35  1  o 9  5.72383e+01 9.96463e-01 1.06700e+03 10.304  7.77990e+01  1.41443e+01  0.00000e+00 0.00000e+00 1.07005e+03 10.304  3.05209e+00 10.304  0.9937 
1 1 1 -5  35  2  o 10 1.23636e+01 3.57675e-01 1.83249e+02 239.711 -1.49562e+00 -2.56059e+00 0.00000e+00 0.00000e+00 1.91719e+02 239.711 8.46976e+00 239.711 0.8074 
1 1 1 -5  35  3  o 6  2.88954e+01 5.12233e-01 6.40258e+02 254.856 -5.93319e+00 -2.19223e+01 0.00000e+00 0.00000e+00 4.20599e+02 254.856 2.19659e+02 74.856  0.9777 
1 1 1 -5  35  4  o 13 1.11712e+01 5.44260e-01 2.34743e+02 155.539 -3.03776e+00 1.38191e+00  0.00000e+00 0.00000e+00 1.14175e+02 155.539 1.20568e+02 335.539 0.8321 
1 1 1 -5  35  5  o 13 1.15314e+01 3.43431e-01 2.15859e+02 318.918 2.97932e+00  -2.59742e+00 0.00000e+00 0.00000e+00 1.56919e+02 318.918 5.89401e+01 138.918 0.8617 
1 1 1 -5  35  6  o 16 4.31877e+01 6.60035e-01 8.89307e+02 15.602  6.26629e+01  1.74978e+01  0.00000e+00 0.00000e+00 7.17578e+02 15.602  1.71729e+02 195.602 0.9923 
1 1 1 -5  35  7  o 5  1.53011e+01 4.34451e-01 2.65894e+02 343.974 8.70332e+00  -2.49992e+00 0.00000e+00 0.00000e+00 2.74844e+02 343.974 8.94940e+00 343.974 0.9431 
1 1 1 -5  35  8  o 12 1.17127e+01 3.91955e-01 2.87016e+02 9.197   9.14595e+00  1.48084e+00  0.00000e+00 0.00000e+00 1.27221e+02 9.197   1.59795e+02 189.197 0.9444 
1 1 1 -5  35  9  o 12 4.57900e+01 6.84551e-01 8.25234e+02 196.342 -1.14390e+02 -3.35402e+01 0.00000e+00 0.00000e+00 8.81126e+02 196.342 5.58915e+01 196.342 0.9958 
1 1 1 -5  35  10 o 14 2.71976e+01 4.86101e-01 5.01521e+02 352.185 5.96108e+01  -8.18132e+00 0.00000e+00 0.00000e+00 5.06989e+02 352.185 5.46806e+00 352.185 0.9917 
1 1 1 -5  35  11 o 16 2.35527e+01 6.97480e-01 4.07311e+02 293.631 2.17317e+01  -4.96692e+01 0.00000e+00 0.00000e+00 4.64498e+02 293.631 5.71875e+01 293.631 0.9907 
1 1 1 -5  35  12 o 10 1.47739e+01 6.97633e-01 2.44356e+02 90.945  -4.49635e-01 2.72563e+01  0.00000e+00 0.00000e+00 2.96909e+02 90.945  5.25524e+01 90.945  0.9815 
1 1 1 -5  35  13 o 16 3.77311e+00 9.48370e-01 6.85310e+01 168.007 -2.23028e+00 4.73766e-01  0.00000e+00 0.00000e+00 3.54221e+01 168.007 3.31090e+01 348.007 0.7388 
1 1 1 -5  35  14 o 19 2.87147e+00 8.88014e-01 4.69428e+01 331.002 1.35268e+00  -7.49745e-01 0.00000e+00 0.00000e+00 1.80357e+01 331.002 2.89071e+01 151.002 0.6074 
1 1 1 -5  35  15 o 15 1.11267e+01 9.44650e-01 2.27221e+02 77.125  7.42779e+00  3.24961e+01  0.00000e+00 0.00000e+00 1.80578e+02 77.125  4.66425e+01 257.125 0.9849 
1 1 1 -5  35  16 o 7  8.75890e+00 1.39427e+00 1.49809e+02 294.328 6.32470e+00  -1.39895e+01 0.00000e+00 0.00000e+00 1.64972e+02 294.328 1.51636e+01 294.328 0.9669 
1 1 1 -5  35  17 o 18 4.64295e+00 1.44576e+00 5.69566e+01 188.166 -2.98620e+00 -4.28523e-01 0.00000e+00 0.00000e+00 8.28735e+01 188.166 2.59169e+01 188.166 0.8112 
1 1 1 -5  35  18 o 17 8.56047e+00 1.70581e+00 1.80190e+02 10.850  1.71901e+01  3.29470e+00  0.00000e+00 0.00000e+00 1.28011e+02 10.850  5.21785e+01 190.850 0.9710 
1 1 1 -5  36  1  o 1  3.57584e+01 6.06764e-01 7.85573e+02 144.120 -2.96300e+01 2.14324e+01  0.00000e+00 0.00000e+00 5.39395e+02 144.120 2.46178e+02 324.120 0.9862 
1 1 1 -5  36  2  o 13 1.37858e+01 3.68390e-01 1.36921e+02 121.424 -1.16787e+00 1.91145e+00  0.00000e+00 0.00000e+00 2.42879e+02 121.424 1.05958e+02 121.424 0.7335 
1 1 1 -5  36  3  o 17 1.42911e+01 4.90504e-01 2.04457e+02 93.800  -2.52578e-01 3.80229e+00  0.00000e+00 0.00000e+00 2.54761e+02 93.800  5.03042e+01 93.800  0.8558 
1 1 1 -5  36  4  o 2  2.80621e+01 6.19135e-01 5.81477e+02 292.135 8.08130e+00  -1.98669e+01 0.00000e+00 0.00000e+00 4.46860e+02 292.135 1.34617e+02 112.135 0.9764 
1 1 1 -5  36  5  o 11 3.45650e+01 5.51756e-01 6.39089e+02 58.618  1.77123e+01  2.90379e+01  0.00000e+00 0.00000e+00 6.38340e+02 58.618  7.48825e-01 238.618 0.9852 
1 1 1 -5  36  6  o 7  9.54256e+00 4.23340e-01 1.55362e+02 343.598 2.44627e+00  -7.20080e-01 0.00000e+00 0.00000e+00 1.20245e+02 343.598 3.51169e+01 163.598 0.7703 
1 1 1 -5  36  7  o 2  1.06368e+01 3.37434e-01 3.68492e+02 264.530 -9.20833e-01 -9.61609e+00 0.00000e+00 0.00000e+00 8.84209e+00 264.530 3.59649e+02 84.530  0.9467 
1 1 1 -5  36  8  o 11 3.11702e+01 5.73989e-01 5.54674e+02 68.862  1.74089e+01  4.50265e+01  0.00000e+00 0.00000e+00 6.00358e+02 68.862  4.56847e+01 68.862  0.9896 
1 1 1 -5  36  9  o 19 3.35871e+01 5.36438e-01 4.98883e+02 20.650  5.15718e+01  1.94356e+01  0.00000e+00 0.00000e+00 7.46442e+02 20.650  2.47559e+02 20.650  0.9909 
1 1 1 -5  36  10 o 17 3.39485e+01 5.67806e-01 4.73155e+02 351.474 7.27506e+01  -1.09063e+01 0.00000e+00 0.00000e+00 7.87497e+02 351.474 3.14342e+02 351.474 0.9932 
1 1 1 -5  36  11 o 9  1.52638e+01 6.69678e-01 2.51899e+02 30.743  1.99623e+01  1.18730e+01  0.00000e+00 0.00000e+00 3.05908e+02 30.743  5.40093e+01 30.743  0.9782 
1 1 1 -5  36  12 o 10 9.19652e+00 8.04081e-01 2.46884e+02 119.572 -8.92519e+00 1.57291e+01  0.00000e+00 0.00000e+00 8.67381e+01 119.572 1.60146e+02 299.572 0.9719 
1 1 1 -5  36  13 o 1  8.33803e+00 8.77164e-01 1.85773e+02 231.170 -8.75374e+00 -1.08758e+01 0.00000e+00 0.00000e+00 1.13785e+02 231.170 7.19881e+01 51.170  0.9635 
1 1 1 -5  36  14 o 15 9.83579e+00 8.79220e-01 1.87214e+02 272.896 1.11546e+00  -2.20487e+01 0.00000e+00 0.00000e+00 1.70770e+02 272.896 1.64433e+01 92.896  0.9771 
1 1 1 -5  36  15 o 17 1.12223e+01 9.37906e-01 1.74156e+02 48.029  1.69054e+01  1.87946e+01  0.00000e+00 0.00000e+00 2.35072e+02 48.029  6.09160e+01 48.029  0.9800 
1 1 1 -5  36  16 o 15 5.37901e+00 1.49050e+00 1.29251e+02 357.958 7.26478e+00  -2.58949e-01 0.00000e+00 0.00000e+00 5.63589e+01 357.958 7.28918e+01 177.959 0.9284 
1 1 1 -5  36  17 o 7  3.52776e+00 1.20590e+00 6.83932e+01 144.581 -2.79030e+00 1.98435e+00  0.00000e+00 0.00000e+00 4.12208e+01 144.581 2.71724e+01 324.581 0.8370 
1 1 1 -5  36  18 o 6  3.93623e+00 1.33094e+00 4.32235e+01 13.606  2.37673e+00  5.75234e-01  0.00000e+00 0.00000e+00 6.75283e+01 13.606  2.43048e+01 13.606  0.7589 
1 1 1 -5  37  1  o 17 1.38290e+01 3.73332e-01 1.81339e+02 188.101 -2.94667e+00 -4.19423e-01 0.00000e+00 0.00000e+00 2.38544e+02 188.101 5.72055e+01 188.101 0.8082 
1 1 1 -5  37  2  o 18 1.62990e+01 4.69388e-01 2.57389e+02 189.907 -5.07474e+00 -8.86322e-01 0.00000e+00 0.00000e+00 2.91551e+02 189.907 3.41613e+01 189.907 0.8968 
1 1 1 -5  37  3  o 11 2.60981e+01 4.82004e-01 4.74442e+02 210.913 -1.36205e+01 -8.15575e+00 0.00000e+00 0.00000e+00 4.73970e+02 210.913 4.71884e-01 30.913  0.9680 
1 1 1 -5  37  4  o 15 3.84463e+01 6.38504e-01 8.54138e+02 182.310 -4.43625e+01 -1.78965e+00 0.00000e+00 0.00000e+00 5.72293e+02 182.310 2.81845e+02 2.310   0.9887 
1 1 1 -5  37  5  o 12 7.74538e+00 3.66300e-01 1.58342e+02 340.575 2.19190e+00  -7.72974e-01 0.00000e+00 0.00000e+00 5.79352e+01 340.575 1.00407e+02 160.575 0.7444 
1 1 1 -5  37  6  o 17 1.23216e+01 5.46884e-01 2.49082e+02 302.503 3.45072e+00  -5.41594e+00 0.00000e+00 0.00000e+00 1.75172e+02 302.503 7.39100e+01 122.503 0.9185 
1 1 1 -5  37  7  o 8  1.48400e+01 3.89383e-01 3.67503e+02 289.880 4.48776e+00  -1.24106e+01 0.00000e+00 0.00000e+00 1.67002e+02 289.880 2.00500e+02 109.880 0.9613 
1 1 1 -5  37  8  o 8  1.28410e+01 3.58634e-01 3.30656e+02 40.172  9.87612e+00  8.33776e+00  0.00000e+00 0.00000e+00 1.31141e+02 40.172  1.99515e+02 220.172 0.9605 
1 1 1 -5  37  9  o 9  7.83906e+00 4.67338e-01 2.60941e+02 302.608 3.93303e+00  -6.14798e+00 0.00000e+00 0.00000e+00 1.14504e+01 302.608 2.49490e+02 122.608 0.9287 
1 1 1 -5  37  10 o 7  1.17052e+01 3.88482e-01 1.62791e+02 187.199 -9.27962e+00 -1.17212e+00 0.00000e+00 0.00000e+00 2.50715e+02 187.199 8.79242e+01 187.199 0.9449 
1 1 1 -5  37  11 o 9  1.89359e+01 4.80814e-01 3.33959e+02 257.405 -8.70848e+00 -3.89758e+01 0.00000e+00 0.00000e+00 3.64459e+02 257.405 3.04995e+01 257.405 0.9874 
1 1 1 -5  37  12 o 13 1.64563e+01 6.86302e-01 3.51421e+02 256.427 -1.04844e+01 -4.34278e+01 0.00000e+00 0.00000e+00 2.55818e+02 256.427 9.56025e+01 76.427  0.9887 
1 1 1 -5  37  13 o 17 3.59625e+00 9.89422e-01 1.07001e+02 79.635  6.61013e-01  3.61415e+00  0.00000e+00 0.00000e+00 6.93059e+00 79.635  1.00070e+02 259.635 0.8497 
1 1 1 -5  37  14 o 12 3.54728e+00 9.92185e-01 4.44208e+01 88.535  4.60146e-02  1.79927e+00  0.00000e+00 0.00000e+00 4.30458e+01 88.535  1.37496e+00 268.535 0.6620 
1 1 1 -5  37  15 o 11 4.55169e+00 1.19881e+00 1.02700e+02 53.522  3.12495e+00  4.22645e+00  0.00000e+00 0.00000e+00 4.95443e+01 53.522  5.31559e+01 233.522 0.8990 
1 1 1 -5  37  16 o 13 4.01440e+00 1.26590e+00 9.01342e+01 271.874 1.51970e-01  -4.64375e+00 0.00000e+00 0.00000e+00 4.18175e+01 271.874 4.83167e+01 91.874  0.8845 
1 1 1 -5  37  17 o 2  3.59881e+00 1.20798e+00 4.87727e+01 268.004 -8.55670e-02 -2.45585e+00 0.00000e+00 0.00000e+00 5.27850e+01 268.004 4.01232e+00 268.004 0.7603 
1 1 1 -5  38  1  o 15 2.34470e+01 4.56780e-01 3.46220e+02 120.384 -5.04332e+00 8.60158e+00  0.00000e+00 0.00000e+00 4.89116e+02 120.384 1.42896e+02 120.384 0.9484 
1 1 1 -5  38  2  o 10 3.00630e+01 6.41082e-01 5.22176e+02 136.038 -1.46613e+01 1.41393e+01  0.00000e+00 0.00000e+00 5.78680e+02 136.038 5.65039e+01 136.038 0.9751 
1 1 1 -5  38  3  o 6  2.34235e+01 4.53282e-01 1.46156e+02 267.957 -1.61976e-01 -4.54105e+00 0.00000e+00 0.00000e+00 6.29032e+02 267.957 4.82876e+02 267.957 0.8816 
1 1 1 -5  38  4  o 10 3.69110e+01 6.19116e-01 5.61022e+02 22.089  3.03732e+01  1.23266e+01  0.00000e+00 0.00000e+00 8.02700e+02 22.089  2.41678e+02 22.089  0.9846 
1 1 1 -5  38  5  o 15 2.39764e+01 4.36792e-01 4.98539e+02 12.316  2.05389e+01  4.48426e+00  0.00000e+00 0.00000e+00 3.79048e+02 12.316  1.19491e+02 192.316 0.9759 
1 1 1 -5  38  6  o 2  1.93968e+01 4.37870e-01 3.08298e+02 20.464  1.17343e+01  4.37885e+00  0.00000e+00 0.00000e+00 3.89132e+02 20.464  8.08337e+01 20.464  0.9592 
1 1 1 -5  38  7  f 0  2.95248e+01 5.25407e-01 6.66857e+02 308.760 3.30285e+01  -4.11372e+01 0.00000e+00 0.00000e+00 4.28686e+02 308.760 2.38170e+02 128.760 0.9905 
1 1 1 -5  38  8  o 3  3.33926e+01 5.74699e-01 5.65339e+02 321.415 4.22296e+01  -3.36936e+01 0.00000e+00 0.00000e+00 6.73184e+02 321.415 1.07844e+02 321.415 0.9907 
1 1 1 -5  38  9  o 1  4.34324e+01 7.09674e-01 8.03368e+02 260.207 -2.01941e+01 -1.16996e+02 0.00000e+00 0.00000e+00 8.14623e+02 260.207 1.12547e+01 260.207 0.9958 
1 1 1 -5  38  10 o 11 1.65995e+01 3.98105e-01 2.61364e+02 195.394 -2.00163e+01 -5.51118e+00 0.00000e+00 0.00000e+00 3.44020e+02 195.394 8.26565e+01 195.394 0.9756 
1 1 1 -5  38  11 o 6  3.10183e+01 5.42055e-01 4.96957e+02 184.973 -1.05699e+02 -9.19689e+00 0.00000e+00 0.00000e+00 6.56108e+02 184.973 1.59151e+02 184.973 0.9953 
1 1 1 -5  38  12 o 18 1.59084e+01 6.97069e-01 3.48176e+02 179.089 -4.64681e+01 7.38597e-01  0.00000e+00 0.00000e+00 2.39047e+02 179.089 1.09130e+02 359.089 0.9892 
1 1 1 -5  38  13 o 19 5.87714e+00 1.04165e+00 9.70950e+01 177.950 -5.25855e+00 1.88252e-01  0.00000e+00 0.00000e+00 9.99047e+01 177.950 2.80966e+00 177.950 0.8991 
1 1 1 -5  38  14 o 9  6.67514e+00 1.03053e+00 1.41085e+02 288.608 3.20704e+00  -9.52503e+00 0.00000e+00 0.00000e+00 9.47997e+01 288.608 4.62854e+01 108.608 0.9489 
1 1 1 -5  38  15 o 3  5.07641e+00 1.21107e+00 7.30284e+01 262.095 -5.69057e-01 -4.09836e+00 0.00000e+00 0.00000e+00 9.10105e+01 262.095 1.79821e+01 262.095 0.8686 
1 1 1 -5  38  16 o 5  7.38064e+00 1.45343e+00 9.92087e+01 13.710  7.79284e+00  1.90114e+00  0.00000e+00 0.00000e+00 1.57336e+02 13.710  5.81270e+01 13.710  0.9354 
1 1 1 -5  38  17 o 16 4.60536e+00 1.44383e+00 3.99797e+01 56.754  1.26196e+00  1.92507e+00  0.00000e+00 0.00000e+00 8.67790e+01 56.754  4.67994e+01 56.754  0.7416 
1 1 1 -5  39  1  o 17 2.04232e+01 5.71755e-01 3.73163e+02 6.813   9.83704e+00  1.17531e+00  0.00000e+00 0.00000e+00 3.54103e+02 6.813   1.90600e+01 186.813 0.9481 
1 1 1 -5  39  2  o 19 3.77898e+01 7.64247e-01 6.26884e+02 242.156 -1.40471e+01 -2.65935e+01 0.00000e+00 0.00000e+00 7.68255e+02 242.156 1.41371e+02 242.156 0.9832 
1 1 1 -5  39  3  o 12 3.90297e+01 6.49831e-01 6.86349e+02 16.806  3.48099e+01  1.05137e+01  0.00000e+00 0.00000e+00 7.58335e+02 16.806  7.19866e+01 16.806  0.9862 
1 1 1 -5  39  4  o 18 2.82174e+01 4.84214e-01 4.36494e+02 156.588 -1.74996e+01 7.57692e+00  0.00000e+00 0.00000e+00 5.94056e+02 156.588 1.57562e+02 156.588 0.9734 
1 1 1 -5  39  5  o 3  4.10131e+01 6.36775e-01 7.78068e+02 335.508 4.93723e+01  -2.24914e+01 0.00000e+00 0.00000e+00 7.45733e+02 335.508 3.23348e+01 155.509 0.9907 
1 1 1 -5  39  6  o 16 1.07278e+01 3.51641e-01 2.96908e+02 282.701 1.53121e+00  -6.79418e+00 0.00000e+00 0.00000e+00 7.50808e+01 282.701 2.21827e+02 102.701 0.9251 
1 1 1 -5  39  7  o 8  2.57466e+01 4.44486e-01 5.40170e+02 290.214 1.28780e+01  -3.49752e+01 0.00000e+00 0.00000e+00 4.11237e+02 290.214 1.28933e+02 110.214 0.9865 
1 1 1 -5  39  8  o 16 3.31969e+01 5.29975e-01 6.52825e+02 271.768 2.15421e+00  -6.97844e+01 0.00000e+00 0.00000e+00 5.80934e+02 271.768 7.18903e+01 91.768  0.9928 
1 1 1 -5  39  9  o 13 1.54882e+01 3.81730e-01 2.98758e+02 56.424  1.01215e+01  1.52477e+01  0.00000e+00 0.00000e+00 2.64552e+02 56.424  3.42057e+01 236.424 0.9723 
1 1 1 -5  39  10 o 17 1.65595e+01 4.20258e-01 2.65853e+02 286.008 6.22921e+00  -2.17128e+01 0.00000e+00 0.00000e+00 3.39244e+02 286.008 7.33907e+01 286.008 0.9776 
1 1 1 -5  39  11 o 12 8.04256e+00 5.32728e-01 1.84447e+02 134.669 -7.16151e+00 7.24485e+00  0.00000e+00 0.00000e+00 1.00766e+02 134.669 8.36803e+01 314.668 0.9496 
1 1 1 -5  39  12 o 13 7.08375e+00 8.83372e-01 1.34688e+02 186.695 -7.68712e+00 -9.02391e-01 0.00000e+00 0.00000e+00 1.11907e+02 186.695 2.27809e+01 6.695   0.9330 
1 1 1 -5  39  13 o 11 1.10536e+01 7.97091e-01 2.10970e+02 305.727 1.42083e+01  -1.97530e+01 0.00000e+00 0.00000e+00 1.92512e+02 305.727 1.84577e+01 125.727 0.9792 
1 1 1 -5  39  14 o 7  8.53390e+00 1.02954e+00 1.58534e+02 308.905 9.83864e+00  -1.21911e+01 0.00000e+00 0.00000e+00 1.48937e+02 308.905 9.59674e+00 128.905 0.9675 
1 1 1 -5  39  15 o 6  7.89962e+00 1.14003e+00 1.21983e+02 28.900  1.08691e+01  6.00004e+00  0.00000e+00 0.00000e+00 1.59771e+02 28.900  3.77883e+01 28.900  0.9588 
1 1 1 -5  39  16 o 14 6.11449e+00 1.45268e+00 1.14751e+02 111.067 -2.91999e+00 7.58046e+00  0.00000e+00 0.00000e+00 9.79523e+01 111.067 1.67988e+01 291.067 0.9363 
1 1 1 -5  39  17 o 18 4.41907e+00 1.42723e+00 6.29436e+01 263.085 -3.97567e-01 -3.27834e+00 0.00000e+00 0.00000e+00 7.31820e+01 263.085 1.02384e+01 263.085 0.8301 
1 1 1 -5  40  1  o 3  1.64604e+01 6.15840e-01 2.61428e+02 309.000 3.45353e+00  -4.26474e+00 0.00000e+00 0.00000e+00 2.97142e+02 309.000 3.57144e+01 309.000 0.9036 
1 1 1 -5  40  2  o 17 2.37149e+01 5.46335e-01 4.98061e+02 79.118  2.94743e+00  1.53320e+01  0.00000e+00 0.00000e+00 3.63286e+02 79.118  1.34774e+02 259.118 0.9674 
1 1 1 -5  40  3  f 0  2.49403e+01 4.72360e-01 4.81313e+02 192.729 -1.58665e+01 -3.58407e+00 0.00000e+00 0.00000e+00 4.25468e+02 192.729 5.58452e+01 12.729  0.9688 
1 1 1 -5  40  4  o 7  3.01397e+01 5.06065e-01 5.09228e+02 298.069 1.36681e+01  -2.56318e+01 0.00000e+00 0.00000e+00 6.01829e+02 298.069 9.26010e+01 298.069 0.9826 
1 1 1 -5  40  5  o 16 2.86613e+01 4.75426e-01 6.07755e+02 247.298 -1.15576e+01 -2.76260e+01 0.00000e+00 0.00000e+00 4.48863e+02 247.298 1.58892e+02 67.298  0.9832 
1 1 1 -5  40  6  o 12 7.21667e+00 3.87105e-01 2.01248e+02 266.693 -1.86914e-01 -3.23533e+00 0.00000e+00 0.00000e+00 2.22377e+01 266.693 1.79010e+02 86.694  0.8263 
1 1 1 -5  40  7  o 17 1.43795e+01 3.64261e-01 2.35620e+02 333.580 7.96673e+00  -3.95825e+00 0.00000e+00 0.00000e+00 2.71720e+02 333.580 3.61007e+01 333.580 0.9420 
1 1 1 -5  40  8  o 5  1.05509e+01 4.13020e-01 1.69509e+02 165.684 -5.42061e+00 1.38332e+00  0.00000e+00 0.00000e+00 1.88115e+02 165.684 1.86058e+01 165.684 0.9056 
1 1 1 -5  40  9  o 9  1.93807e+01 4.05876e-01 3.16026e+02 206.258 -2.38513e+01 -1.17663e+01 0.00000e+00 0.00000e+00 3.95107e+02 206.258 7.90812e+01 206.258 0.9810 
1 1 1 -5  40  10 o 19 1.60184e+01 4.02594e-01 3.73631e+02 193.053 -3.21710e+01 -7.45870e+00 0.00000e+00 0.00000e+00 2.15902e+02 193.053 1.57729e+02 13.053  0.9847 
1 1 1 -5  40  11 o 10 2.65538e+01 4.87999e-01 4.66886e+02 46.756  6.06402e+01  6.44766e+01  0.00000e+00 0.00000e+00 5.19073e+02 46.756  5.21876e+01 46.756  0.9943 
1 1 1 -5  40  12 o 6  5.57241e+00 9.30486e-01 1.25485e+02 200.172 -5.50681e+00 -2.02304e+00 0.00000e+00 0.00000e+00 6.37507e+01 200.172 6.17346e+01 20.172  0.9102 
1 1 1 -5  40  13 o 5  1.44213e+01 7.54789e-01 2.10100e+02 221.058 -2.33028e+01 -2.02983e+01 0.00000e+00 0.00000e+00 3.18647e+02 221.058 1.08547e+02 221.058 0.9837 
1 1 1 -5  40  14 o 11 5.97814e+00 1.10748e+00 9.17421e+01 285.077 1.53687e+00  -5.70501e+00 0.00000e+00 0.00000e+00 1.11019e+02 285.077 1.92768e+01 285.077 0.9109 
1 1 1 -5  40  15 o 4  9.81360e+00 1.07071e+00 2.12349e+02 126.300 -1.61438e+01 2.19770e+01  0.00000e+00 0.00000e+00 1.45899e+02 126.300 6.64492e+01 306.300 0.9815 
1 1 1 -5  40  16 o 19 7.11651e+00 1.50928e+00 1.47739e+02 271.447 2.95914e-01  -1.17139e+01 0.00000e+00 0.00000e+00 1.05100e+02 271.447 4.26390e+01 91.447  0.9563 
1 1 1 -5  40  17 o 1  3.58520e+00 1.23367e+00 6.21315e+01 174.121 -3.10552e+00 3.19747e-01  0.00000e+00 0.00000e+00 4.67705e+01 174.121 1.53610e+01 354.121 0.8186 
1 1 1 -5  41  1  o 16 1.38223e+01 3.79644e-01 1.89541e+02 356.252 3.46691e+00  -2.27121e-01 0.00000e+00 0.00000e+00 2.46324e+02 356.252 5.67823e+01 356.252 0.8398 
1 1 1 -5  41  2  o 16 3.14499e+01 6.63601e-01 5.16619e+02 105.141 -5.74709e+00 2.12390e+01  0.00000e+00 0.00000e+00 6.36853e+02 105.141 1.20234e+02 105.141 0.9770 
1 1 1 -5  41  3  o 9  1.99531e+01 4.21135e-01 3.80415e+02 89.246  1.58578e-01  1.20433e+01  0.00000e+00 0.00000e+00 3.36563e+02 89.246  4.38515e+01 269.246 0.9575 
1 1 1 -5  41  4  o 7  3.66489e+01 6.38853e-01 5.25277e+02 99.614  -5.62758e+00 3.32217e+01  0.00000e+00 0.00000e+00 8.28903e+02 99.614  3.03626e+02 99.614  0.9850 
1 1 1 -5  41  5  o 16 1.22419e+01 3.47993e-01 3.29377e+02 222.430 -6.27822e+00 -5.73888e+00 0.00000e+00 0.00000e+00 1.01718e+02 222.430 2.27659e+02 42.430  0.9392 
1 1 1 -5  41  6  o 2  5.17089e+01 7.86756e-01 8.82187e+02 149.241 -9.44471e+01 5.62093e+01  0.00000e+00 0.00000e+00 1.04666e+03 149.241 1.64472e+02 149.241 0.9954 
1 1 1 -5  41  7  o 11 9.21624e+00 3.76833e-01 1.52831e+02 189.585 -3.82988e+00 -6.46734e-01 0.00000e+00 0.00000e+00 1.43625e+02 189.585 9.20580e+00 9.585   0.8589 
1 1 1 -5  41  8  o 3  2.83016e+01 4.80337e-01 5.96479e+02 213.373 -4.52767e+01 -2.98240e+01 0.00000e+00 0.00000e+00 4.52916e+02 213.373 1.43564e+02 33.373  0.9907 
1 1 1 -5  41  9  o 4  2.82880e+01 4.85528e-01 5.70887e+02 141.752 -5.44655e+01 4.29335e+01  0.00000e+00 0.00000e+00 4.79396e+02 141.752 9.14912e+01 321.752 0.9928 
1 1 1 -5  41  10 o 5  1.79291e+01 4.49626e-01 2.07314e+02 95.996  -2.34837e+00 2.23570e+01  0.00000e+00 0.00000e+00 4.47613e+02 95.996  2.40299e+02 95.996  0.9775 
1 1 1 -5  41  11 f 0  9.64827e+00 5.41272e-01 2.31672e+02 288.408 5.27549e+00  -1.58517e+01 0.00000e+00 0.00000e+00 1.17622e+02 288.408 1.14050e+02 108.408 0.9696 
1 1 1 -5  41  12 o 13 3.24761e+00 8.49495e-01 1.04709e+02 95.160  -2.61939e-01 2.90077e+00  0.00000e+00 0.00000e+00 7.38845e+00 275.160 1.12098e+02 275.160 0.8033 
1 1 1 -5  41  13 o 14 6.53254e+00 1.03292e+00 1.28078e+02 148.429 -6.97046e+00 4.28338e+00  0.00000e+00 0.00000e+00 9.99752e+01 148.429 2.81026e+01 328.429 0.9367 
1 1 1 -5  41  14 o 7  4.05108e+00 1.04030e+00 3.25712e+01 311.874 1.03549e+00  -1.15510e+00 0.00000e+00 0.00000e+00 5.92128e+01 311.874 2.66417e+01 311.874 0.6086 
1 1 1 -5  41  15 f 0  7.62475e+00 1.21445e+00 7.06274e+01 343.612 6.28857e+00  -1.84935e+00 0.00000e+00 0.00000e+00 1.90306e+02 343.612 1.19678e+02 343.612 0.9202 
1 1 1 -5  41  16 o 11 5.96433e+00 1.53501e+00 1.04965e+02 326.281 5.79218e+00  -3.86561e+00 0.00000e+00 0.00000e+00 1.00002e+02 326.281 4.96285e+00 146.281 0.9251 
1 1 1 -5  41  17 o 17 4.96887e+00 1.60791e+00 4.74886e+01 222.239 -1.93979e+00 -1.76130e+00 0.00000e+00 0.00000e+00 9.58389e+01 222.239 4.83503e+01 222.239 0.7775 
1 1 1 -5  42  1  o 16 4.75411e+01 7.71747e-01 7.18660e+02 12.383  4.49844e+01  9.87631e+00  0.00000e+00 0.00000e+00 1.04686e+03 12.383  3.28197e+02 12.383  0.9891 
1 1 1 -5  42  2  o 15 2.53139e+01 9.52644e-01 2.62505e+02 128.586 -6.47301e+00 8.11280e+00  0.00000e+00 0.00000e+00 6.40663e+02 128.586 3.78158e+02 128.586 0.9505 
1 1 1 -5  42  3  o 13 2.70822e+01 5.00499e-01 4.66835e+02 316.877 1.42296e+01  -1.33263e+01 0.00000e+00 0.00000e+00 5.22934e+02 316.877 5.60991e+01 316.877 0.9740 
1 1 1 -5  42  4  o 3  2.55536e+01 5.31772e-01 6.04319e+02 234.011 -1.55180e+01 -2.13672e+01 0.00000e+00 0.00000e+00 3.35786e+02 234.011 2.68533e+02 54.011  0.9809 
1 1 1 -5  42  5  o 19 1.79203e+01 3.78666e-01 2.78771e+02 192.250 -1.02497e+01 -2.22551e+00 0.00000e+00 0.00000e+00 3.60164e+02 192.250 8.13933e+01 192.250 0.9511 
1 1 1 -5  42  6  o 3  2.57109e+01 4.48652e-01 4.48951e+02 345.543 2.69828e+01  -6.95677e+00 0.00000e+00 0.00000e+00 4.96955e+02 345.543 4.80037e+01 345.543 0.9819 
1 1 1 -5  42  7  o 16 1.33202e+01 4.06679e-01 3.15996e+02 164.441 -1.14125e+01 3.17754e+00  0.00000e+00 0.00000e+00 1.61254e+02 164.441 1.54742e+02 344.441 0.9568 
1 1 1 -5  42  8  o 1  2.63630e+01 5.27510e-01 5.25170e+02 237.412 -2.46053e+01 -3.84920e+01 0.00000e+00 0.00000e+00 4.50515e+02 237.412 7.46546e+01 57.412  0.9890 
1 1 1 -5  42  9  o 9  7.12071e+00 4.64524e-01 2.19274e+02 229.852 -4.45707e+00 -5.28387e+00 0.00000e+00 0.00000e+00 2.69090e+01 229.852 1.92365e+02 49.852  0.9245 
1 1 1 -5  42  10 o 7  1.10984e+01 4.65958e-01 2.20697e+02 68.081  5.28992e+00  1.31464e+01  0.00000e+00 0.00000e+00 1.79085e+02 68.081  4.16123e+01 248.081 0.9640 
1 1 1 -5  42  11 o 1  7.90269e+00 7.47516e-01 7.20247e+01 164.542 -3.97260e+00 1.09860e+00  0.00000e+00 0.00000e+00 1.84081e+02 164.542 1.12056e+02 164.542 0.8680 
1 1 1 -5  42  12 o 16 9.02595e+00 5.50158e-01 1.17177e+02 313.683 6.69570e+00  -7.01072e+00 0.00000e+00 0.00000e+00 2.01624e+02 313.683 8.44478e+01 313.683 0.9469 
1 1 1 -5  42  13 o 11 9.87727e+00 8.42934e-01 2.82948e+02 128.143 -1.69708e+01 2.16104e+01  0.00000e+00 0.00000e+00 7.83587e+01 128.143 2.04589e+02 308.143 0.9816 
1 1 1 -5  42  14 o 16 7.26949e+00 1.07174e+00 1.56484e+02 89.220  1.80276e-01  1.32377e+01  0.00000e+00 0.00000e+00 1.03699e+02 89.220  5.27858e+01 269.220 0.9615 
1 1 1 -5  42  15 o 3  7.05964e+00 1.27227e+00 1.68194e+02 278.250 1.99562e+00  -1.37637e+01 0.00000e+00 0.00000e+00 8.47003e+01 278.250 8.34933e+01 98.250  0.9633 
1 1 1 -5  42  16 o 9  7.11921e+00 1.71395e+00 1.16733e+02 321.037 6.20611e+00  -5.01889e+00 0.00000e+00 0.00000e+00 1.30527e+02 321.037 1.37932e+01 321.037 0.9351 
1 1 1 -5  42  17 o 17 5.13464e+00 1.64316e+00 3.75585e+01 266.558 -1.26754e-01 -2.10718e+00 0.00000e+00 0.00000e+00 9.86723e+01 266.558 6.11139e+01 266.558 0.7152 
1 1 1 -5  43  1  o 4  2.37114e+01 4.68536e-01 2.62665e+02 240.797 -4.83869e+00 -8.65666e+00 0.00000e+00 0.00000e+00 5.81364e+02 240.797 3.18699e+02 240.797 0.9482 
1 1 1 -5  43  2  o 8  4.70240e+01 7.70010e-01 7.53531e+02 81.273  8.24666e+00  5.37251e+01  0.00000e+00 0.00000e+00 9.95023e+02 81.273  2.41492e+02 81.273  0.9908 
1 1 1 -5  43  3  o 10 1.47077e+01 3.90174e-01 2.46552e+02 290.442 2.39577e+00  -6.42767e+00 0.00000e+00 0.00000e+00 2.63274e+02 290.442 1.67226e+01 290.442 0.9239 
1 1 1 -5  43  4  o 18 2.91391e+01 4.82839e-01 4.54142e+02 232.170 -1.39599e+01 -1.79774e+01 0.00000e+00 0.00000e+00 6.14357e+02 232.170 1.60214e+02 232.170 0.9778 
1 1 1 -5  43  5  o 12 1.29152e+01 3.59628e-01 2.30241e+02 271.734 1.96689e-01  -6.49769e+00 0.00000e+00 0.00000e+00 2.14903e+02 271.734 1.53377e+01 91.734  0.9195 
1 1 1 -5  43  6  o 11 2.43110e+01 5.42869e-01 4.07189e+02 231.173 -1.66034e+01 -2.06310e+01 0.00000e+00 0.00000e+00 4.86239e+02 231.173 7.90500e+01 231.173 0.9809 
1 1 1 -5  43  7  o 3  2.79085e+01 4.77722e-01 4.90575e+02 189.728 -4.07831e+01 -6.99149e+00 0.00000e+00 0.00000e+00 5.41664e+02 189.728 5.10887e+01 189.728 0.9878 
1 1 1 -5  43  8  o 13 2.84239e+01 4.86222e-01 3.81565e+02 226.006 -2.69047e+01 -2.78667e+01 0.00000e+00 0.00000e+00 6.68155e+02 226.006 2.86591e+02 226.006 0.9870 
1 1 1 -5  43  9  o 16 2.75694e+01 5.22500e-01 5.19938e+02 38.075  5.19782e+01  4.07191e+01  0.00000e+00 0.00000e+00 5.03050e+02 38.075  1.68884e+01 218.075 0.9924 
1 1 1 -5  43  10 o 18 2.20324e+01 4.42225e-01 3.58382e+02 304.063 2.58053e+01  -3.81674e+01 0.00000e+00 0.00000e+00 4.55788e+02 304.063 9.74061e+01 304.063 0.9891 
1 1 1 -5  43  11 o 15 2.36458e+01 4.67927e-01 3.83047e+02 88.066  2.26994e+00  6.72382e+01  0.00000e+00 0.00000e+00 4.93053e+02 88.066  1.10006e+02 88.066  0.9925 
1 1 1 -5  43  12 o 11 1.34202e+01 5.18450e-01 2.66470e+02 233.230 -2.08580e+01 -2.79116e+01 0.00000e+00 0.00000e+00 2.26809e+02 233.230 3.96608e+01 53.230  0.9855 
1 1 1 -5  43  13 o 14 5.34821e+00 1.01167e+00 1.15207e+02 132.195 -4.13622e+00 4.56244e+00  0.00000e+00 0.00000e+00 6.70776e+01 132.195 4.81297e+01 312.195 0.9148 
1 1 1 -5  43  14 o 11 8.21026e+00 1.05040e+00 1.24545e+02 185.786 -1.23420e+01 -1.25056e+00 0.00000e+00 0.00000e+00 1.68465e+02 185.786 4.39201e+01 185.786 0.9588 
1 1 1 -5  43  15 o 6  9.67707e+00 1.11326e+00 2.02675e+02 289.405 8.35346e+00  -2.37143e+01 0.00000e+00 0.00000e+00 1.49899e+02 289.405 5.27767e+01 109.405 0.9799 
1 1 1 -5  43  16 o 2  4.11258e+00 1.31633e+00 8.66743e+01 155.183 -4.21199e+00 1.94770e+00  0.00000e+00 0.00000e+00 4.83916e+01 155.183 3.82827e+01 335.183 0.8843 
1 1 1 -5  43  17 o 5  7.79911e+00 2.03379e+00 7.29798e+01 103.673 -1.14791e+00 4.71847e+00  0.00000e+00 0.00000e+00 1.84475e+02 103.673 1.11495e+02 103.673 0.8899 
1 1 1 -5  44  1  o 11 2.28691e+01 4.62204e-01 3.64567e+02 116.036 -5.66979e+00 1.16060e+01  0.00000e+00 0.00000e+00 4.59957e+02 116.036 9.53907e+01 116.036 0.9605 
1 1 1 -5  44  2  o 14 1.78956e+01 4.14705e-01 3.80935e+02 339.628 1.21361e+01  -4.50661e+00 0.00000e+00 0.00000e+00 2.64144e+02 339.628 1.16791e+02 159.628 0.9606 
1 1 1 -5  44  3  o 17 5.28498e+01 8.50029e-01 9.01938e+02 280.645 1.51883e+01  -8.08076e+01 0.00000e+00 0.00000e+00 1.06854e+03 280.645 1.66603e+02 280.645 0.9939 
1 1 1 -5  44  4  o 3  2.66805e+01 4.61216e-01 5.54388e+02 125.527 -1.80787e+01 2.53201e+01  0.00000e+00 0.00000e+00 4.29859e+02 125.527 1.24528e+02 305.527 0.9838 
1 1 1 -5  44  5  o 16 2.63432e+01 4.57462e-01 4.05810e+02 85.094  2.03432e+00  2.36983e+01  0.00000e+00 0.00000e+00 5.60549e+02 85.094  1.54739e+02 85.094  0.9787 
1 1 1 -5  44  6  o 18 3.71414e+01 5.76210e-01 7.69700e+02 126.512 -4.43125e+01 5.98578e+01  0.00000e+00 0.00000e+00 6.12238e+02 126.512 1.57461e+02 306.512 0.9933 
1 1 1 -5  44  7  o 7  1.34653e+01 3.80388e-01 2.95755e+02 118.890 -5.54875e+00 1.00557e+01  0.00000e+00 0.00000e+00 1.85878e+02 118.890 1.09877e+02 298.890 0.9554 
1 1 1 -5  44  8  o 5  7.09663e+00 4.97469e-01 1.49128e+02 244.149 -1.59804e+00 -3.29824e+00 0.00000e+00 0.00000e+00 7.63589e+01 244.149 7.27689e+01 64.149  0.8493 
1 1 1 -5  44  9  o 19 2.43411e+00 6.19008e-01 1.04555e+02 234.323 -7.13757e-01 -9.94140e-01 0.00000e+00 0.00000e+00 5.72256e+01 54.323  1.61781e+02 54.323  0.5201 
1 1 1 -5  44  10 o 2  1.23233e+01 4.66057e-01 2.31620e+02 121.525 -9.25864e+00 1.50940e+01  0.00000e+00 0.00000e+00 2.15541e+02 121.525 1.60789e+01 301.525 0.9713 
1 1 1 -5  44  11 o 4  1.52178e+01 4.22879e-01 2.79427e+02 18.710  3.17857e+01  1.07650e+01  0.00000e+00 0.00000e+00 2.80049e+02 18.710  6.21854e-01 18.710  0.9850 
1 1 1 -5  44  12 o 4  6.91828e+00 6.41894e-01 1.25117e+02 222.915 -6.08524e+00 -5.65776e+00 0.00000e+00 0.00000e+00 1.16812e+02 222.915 8.30497e+00 42.915  0.9377 
1 1 1 -5  44  13 o 19 1.07216e+01 8.50995e-01 2.10734e+02 122.446 -1.34200e+01 2.11094e+01  0.00000e+00 0.00000e+00 1.80636e+02 122.446 3.00974e+01 302.446 0.9798 
1 1 1 -5  44  14 o 11 1.37717e+01 8.82542e-01 2.54287e+02 332.248 3.86112e+01  -2.03160e+01 0.00000e+00 0.00000e+00 2.52346e+02 332.248 1.94078e+00 152.248 0.9885 
1 1 1 -5  44  15 o 10 5.28849e+00 1.53017e+00 8.11426e+01 233.061 -2.61790e+00 -3.48180e+00 0.00000e+00 0.00000e+00 9.10756e+01 233.061 9.93304e+00 233.061 0.8759 
1 1 1 -5  44  16 f 0  4.51380e+00 1.49317e+00 1.21264e+02 225.252 -4.61354e+00 -4.65434e+00 0.00000e+00 0.00000e+00 3.29721e+01 225.252 8.82918e+01 45.252  0.9202 
1 1 1 -5  44  17 o 17 5.00180e+00 1.63271e+00 1.33325e+02 7.333   7.42376e+00  9.55362e-01  0.00000e+00 0.00000e+00 3.93085e+01 7.333   9.40168e+01 187.333 0.9306 
1 1 1 -5  45  1  o 15 6.69824e+00 5.01510e-01 1.64896e+02 275.770 2.10007e-01  -2.07843e+00 0.00000e+00 0.00000e+00 1.40709e+01 275.770 1.50825e+02 95.770  0.7119 
1 1 1 -5  45  2  o 17 1.12703e+01 4.40897e-01 2.70460e+02 319.635 4.09261e+00  -3.47872e+00 0.00000e+00 0.00000e+00 1.10700e+02 319.635 1.59761e+02 139.635 0.9013 
1 1 1 -5  45  3  o 17 5.94041e+00 4.77794e-01 2.45409e+02 189.161 -2.45313e+00 -3.95626e-01 0.00000e+00 0.00000e+00 7.53241e+01 9.161   3.20733e+02 9.161   0.7633 
1 1 1 -5  45  4  o 3  8.13460e+00 4.41519e-01 1.31907e+02 2.963   2.24586e+00  1.16237e-01  0.00000e+00 0.00000e+00 9.21675e+01 2.963   3.97395e+01 182.963 0.7347 
1 1 1 -5  45  5  o 3  1.94915e+01 3.94766e-01 3.97116e+02 81.489  2.81622e+00  1.88196e+01  0.00000e+00 0.00000e+00 3.13875e+02 81.489  8.32408e+01 261.489 0.9734 
1 1 1 -5  45  6  o 11 1.14566e+01 4.32112e-01 9.65666e+01 27.566  2.70368e+00  1.41139e+00  0.00000e+00 0.00000e+00 2.52559e+02 27.566  1.55992e+02 27.566  0.8136 
1 1 1 -5  45  7  o 7  4.63235e+01 6.92561e-01 6.77030e+02 79.395  1.83241e+01  9.78663e+01  0.00000e+00 0.00000e+00 1.04826e+03 79.395  3.71228e+02 79.395  0.9950 
1 1 1 -5  45  8  o 7  7.66249e+00 4.41372e-01 4.29979e+01 47.376  8.79837e-01  9.56003e-01  0.00000e+00 0.00000e+00 1.12490e+02 47.376  6.94923e+01 47.376  0.5425 
1 1 1 -5  45  9  o 7  1.86739e+01 4.11305e-01 3.65046e+02 189.357 -3.21554e+01 -5.29877e+00 0.00000e+00 0.00000e+00 3.22213e+02 189.357 4.28330e+01 9.357   0.9845 
1 1 1 -5  45  10 o 19 2.56084e+01 4.77895e-01 4.97305e+02 293.030 3.14566e+01  -7.39990e+01 0.00000e+00 0.00000e+00 4.53250e+02 293.030 4.40555e+01 113.030 0.9938 
1 1 1 -5  45  11 o 12 7.61051e+00 5.22946e-01 8.81362e+01 195.004 -5.45753e+00 -1.46275e+00 0.00000e+00 0.00000e+00 1.69351e+02 195.004 8.12143e+01 195.004 0.9066 
1 1 1 -5  45  12 o 12 1.16650e+01 5.00121e-01 2.03590e+02 102.240 -4.97902e+00 2.29516e+01  0.00000e+00 0.00000e+00 2.21994e+02 102.240 1.84040e+01 102.240 0.9785 
1 1 1 -5  45  13 o 12 5.86175e+00 1.08739e+00 1.33218e+02 355.775 8.24654e+00  -6.09224e-01 0.00000e+00 0.00000e+00 7.14736e+01 355.775 6.17441e+01 175.775 0.9374 
1 1 1 -5  45  14 f 0  3.48858e+00 1.04217e+00 9.24194e+01 73.998  1.06525e+00  3.71445e+00  0.00000e+00 0.00000e+00 1.89769e+01 73.998  7.34425e+01 253.998 0.8581 
1 1 1 -5  45  15 o 18 1.82290e+01 1.57867e+00 2.72969e+02 239.835 -2.53517e+01 -4.36189e+01 0.00000e+00 0.00000e+00 3.97890e+02 239.835 1.24921e+02 239.835 0.9900 
1 1 1 -5  45  16 o 19 5.45985e+00 1.66315e+00 9.42079e+01 89.167  7.71677e-02  5.30471e+00  0.00000e+00 0.00000e+00 8.82431e+01 89.167  5.96478e+00 269.167 0.9000 
1 1 1 -5  45  17 o 7  4.94191e+00 1.60091e+00 1.03225e+02 252.467 -1.81203e+00 -5.73570e+00 0.00000e+00 0.00000e+00 6.40247e+01 252.467 3.92002e+01 72.468  0.9126 
1 1 1 -5  46  1  o 7  3.51267e+01 6.08752e-01 5.28969e+02 281.387 6.41880e+00  -3.18708e+01 0.00000e+00 0.00000e+00 7.68845e+02 281.387 2.39875e+02 281.387 0.9845 
1 1 1 -5  46  2  o 4  9.99703e+00 4.83728e-01 3.23529e+02 101.466 -1.10005e+00 5.42358e+00  0.00000e+00 0.00000e+00 1.56970e+01 101.466 3.07832e+02 281.465 0.9045 
1 1 1 -5  46  3  o 11 3.21485e+01 5.24937e-01 4.16464e+02 141.485 -2.20144e+01 1.75206e+01  0.00000e+00 0.00000e+00 7.67613e+02 141.485 3.51148e+02 141.485 0.9821 
1 1 1 -5  46  4  o 6  3.39974e+01 5.40232e-01 6.64346e+02 7.602   4.86134e+01  6.48781e+00  0.00000e+00 0.00000e+00 5.97106e+02 7.602   6.72399e+01 187.602 0.9898 
1 1 1 -5  46  5  o 2  2.35652e+01 4.31697e-01 4.34678e+02 33.258  2.06698e+01  1.35558e+01  0.00000e+00 0.00000e+00 4.30276e+02 33.258  4.40221e+00 213.258 0.9796 
1 1 1 -5  46  6  o 2  3.45953e+01 5.94707e-01 5.08738e+02 218.410 -3.85079e+01 -3.05322e+01 0.00000e+00 0.00000e+00 7.73623e+02 218.410 2.64885e+02 218.410 0.9898 
1 1 1 -5  46  7  o 2  1.81291e+01 5.38332e-01 2.18689e+02 28.739  1.11384e+01  6.10791e+00  0.00000e+00 0.00000e+00 4.32567e+02 28.739  2.13878e+02 28.739  0.9598 
1 1 1 -5  46  8  o 17 1.51075e+01 3.93073e-01 2.05707e+02 185.397 -1.34473e+01 -1.27055e+00 0.00000e+00 0.00000e+00 3.38027e+02 185.397 1.32320e+02 185.397 0.9622 
1 1 1 -5  46  9  o 2  1.32946e+01 5.05339e-01 2.08663e+02 315.071 9.99310e+00  -9.96831e+00 0.00000e+00 0.00000e+00 2.70304e+02 315.071 6.16415e+01 315.071 0.9639 
1 1 1 -5  46  10 o 10 1.53353e+01 4.86057e-01 2.35549e+02 105.419 -6.65085e+00 2.41144e+01  0.00000e+00 0.00000e+00 3.25614e+02 105.419 9.00647e+01 105.419 0.9798 
1 1 1 -5  46  11 o 7  1.78319e+01 4.44510e-01 3.29176e+02 337.241 4.34503e+01  -1.82281e+01 0.00000e+00 0.00000e+00 3.29137e+02 337.241 3.94318e-02 157.241 0.9893 
1 1 1 -5  46  12 o 8  1.62073e+01 4.92001e-01 3.26988e+02 10.912  5.72317e+01  1.10334e+01  0.00000e+00 0.00000e+00 2.72045e+02 10.912  5.49427e+01 190.912 0.9914 
1 1 1 -5  46  13 o 4  6.09810e+00 1.02889e+00 8.78186e+01 89.046  1.00508e-01  6.03640e+00  0.00000e+00 0.00000e+00 1.19537e+02 89.046  3.17180e+01 89.046  0.9129 
1 1 1 -5  46  14 o 9  6.63593e+00 1.54069e+00 9.04080e+01 95.369  -5.42950e-01 5.77666e+00  0.00000e+00 0.00000e+00 1.34074e+02 95.369  4.36663e+01 95.369  0.9092 
1 1 1 -5  46  15 o 19 5.17302e+00 1.55080e+00 3.93595e+01 316.022 1.44120e+00  -1.39066e+00 0.00000e+00 0.00000e+00 9.48869e+01 316.022 5.55274e+01 316.022 0.6982 
1 1 1 -5  46  16 o 15 5.64951e+00 1.68318e+00 1.06303e+02 242.881 -2.82331e+00 -5.51269e+00 0.00000e+00 0.00000e+00 8.56622e+01 242.881 2.06407e+01 62.881  0.9153 
1 1 1 -5  46  17 o 18 5.38555e+00 1.77868e+00 1.37612e+02 244.822 -3.27139e+00 -6.95906e+00 0.00000e+00 0.00000e+00 4.86053e+01 244.822 8.90071e+01 64.822  0.9325 
1 1 1 -5  47  1  o 7  6.04828e+01 1.05233e+00 1.20695e+03 245.930 -4.94809e+01 -1.10772e+02 0.00000e+00 0.00000e+00 1.05321e+03 245.930 1.53745e+02 65.930  0.9959 
1 1 1 -5  47  2  o 1  4.76492e+01 7.78484e-01 9.07627e+02 95.071  -6.49322e+00 7.31680e+01  0.00000e+00 0.00000e+00 8.67611e+02 95.071  4.00156e+01 275.071 0.9932 
1 1 1 -5  47  3  o 12 1.40387e+01 4.82390e-01 2.40036e+02 67.618  2.68839e+00  6.52829e+00  0.00000e+00 0.00000e+00 2.47553e+02 67.618  7.51719e+00 67.618  0.9262 
1 1 1 -5  47  4  o 12 3.49794e+01 5.53861e-01 6.77073e+02 215.363 -4.27817e+01 -3.03615e+01 0.00000e+00 0.00000e+00 6.21527e+02 215.363 5.55468e+01 35.363  0.9904 
1 1 1 -5  47  5  o 6  2.09331e+01 4.11489e-01 2.59042e+02 177.461 -1.45613e+01 6.45554e-01  0.00000e+00 0.00000e+00 4.97834e+02 177.461 2.38792e+02 177.461 0.9651 
1 1 1 -5  47  6  o 4  5.72352e+01 8.32059e-01 9.76034e+02 311.677 1.09595e+02  -1.23105e+02 0.00000e+00 0.00000e+00 1.16067e+03 311.677 1.84634e+02 311.677 0.9970 
1 1 1 -5  47  7  o 6  1.18632e+01 4.26992e-01 2.80866e+02 84.310  1.09713e+00  1.10112e+01  0.00000e+00 0.00000e+00 1.42534e+02 84.310  1.38332e+02 264.310 0.9537 
1 1 1 -5  47  8  o 14 1.89298e+01 4.15404e-01 2.36396e+02 310.159 1.24499e+01  -1.47538e+01 0.00000e+00 0.00000e+00 4.52966e+02 310.159 2.16570e+02 310.159 0.9737 
1 1 1 -5  47  9  o 15 4.84020e+00 6.24161e-01 3.22842e+01 337.710 7.78430e-01  -3.19097e-01 0.00000e+00 0.00000e+00 3.77814e+01 337.710 5.49719e+00 337.710 0.3873 
1 1 1 -5  47  10 o 6  1.23795e+01 4.29062e-01 2.21129e+02 280.414 3.56348e+00  -1.93882e+01 0.00000e+00 0.00000e+00 2.29270e+02 280.414 8.14017e+00 280.414 0.9743 
1 1 1 -5  47  11 o 7  2.63885e+01 4.99994e-01 4.85638e+02 85.763  8.35641e+00  1.12808e+02  0.00000e+00 0.00000e+00 4.94584e+02 85.763  8.94536e+00 85.763  0.9956 
1 1 1 -5  47  12 o 16 5.09200e+00 8.99288e-01 1.28059e+02 208.823 -5.53133e+00 -3.04372e+00 0.00000e+00 0.00000e+00 4.59966e+01 208.823 8.20625e+01 28.823  0.9170 
1 1 1 -5  47  13 o 19 3.77948e+00 9.28839e-01 1.08252e+02 183.694 -4.78674e+00 -3.09061e-01 0.00000e+00 0.00000e+00 1.67991e+01 183.694 9.14529e+01 3.694   0.8884 
1 1 1 -5  47  14 o 11 5.26690e+00 1.45887e+00 8.51707e+01 86.899  2.41260e-01  4.45397e+00  0.00000e+00 0.00000e+00 8.70963e+01 86.899  1.92554e+00 86.899  0.8792 
1 1 1 -5  47  15 o 12 6.87039e+00 1.69251e+00 5.89148e+01 194.051 -3.65255e+00 -9.14131e-01 0.00000e+00 0.00000e+00 1.59091e+02 194.051 1.00176e+02 194.051 0.8538 
1 1 1 -5  47  16 o 13 6.51302e+00 1.73223e+00 1.79642e+02 190.657 -1.10051e+01 -2.07088e+00 0.00000e+00 0.00000e+00 5.10605e+01 190.657 1.28581e+02 10.657  0.9542 
1 1 1 -5  47  17 o 3  3.93237e+00 1.37445e+00 5.48750e+01 175.732 -3.00333e+00 2.24124e-01  0.00000e+00 0.00000e+00 6.33405e+01 175.732 8.46548e+00 175.732 0.8108 
1 1 1 -5  48  1  o 2  2.99277e+01 6.66364e-01 6.07706e+02 282.320 6.62118e+00  -3.03160e+01 0.00000e+00 0.00000e+00 4.96899e+02 282.320 1.10808e+02 102.320 0.9838 
1 1 1 -5  48  2  f 0  8.78273e+00 6.48918e-01 1.01666e+02 319.410 1.41203e+00  -1.20980e+00 0.00000e+00 0.00000e+00 1.20127e+02 319.410 1.84607e+01 319.410 0.6733 
1 1 1 -5  48  3  o 4  4.04081e+01 6.21886e-01 6.09069e+02 139.319 -4.04078e+01 3.47334e+01  0.00000e+00 0.00000e+00 8.91727e+02 139.319 2.82659e+02 139.319 0.9906 
1 1 1 -5  48  4  o 19 8.00191e+00 6.79551e-01 9.46740e+01 138.687 -1.37831e+00 1.21143e+00  0.00000e+00 0.00000e+00 1.05881e+02 138.687 1.12068e+01 138.687 0.6687 
1 1 1 -5  48  5  o 12 2.42084e+01 4.44451e-01 3.80134e+02 264.083 -2.48456e+00 -2.39716e+01 0.00000e+00 0.00000e+00 5.07718e+02 264.083 1.27584e+02 264.083 0.9790 
1 1 1 -5  48  6  o 7  5.39037e+01 7.89159e-01 1.01749e+03 52.388  9.42364e+01  1.22317e+02  0.00000e+00 0.00000e+00 9.94165e+02 52.388  2.33269e+01 232.388 0.9968 
1 1 1 -5  48  7  o 19 3.20450e+01 5.28209e-01 6.00467e+02 194.302 -6.64030e+01 -1.69281e+01 0.00000e+00 0.00000e+00 5.89827e+02 194.302 1.06400e+01 14.302  0.9927 
1 1 1 -5  48  8  o 17 4.48366e+01 6.83051e-01 7.19110e+02 14.140  1.35468e+02  3.41267e+01  0.00000e+00 0.00000e+00 9.51489e+02 14.140  2.32379e+02 14.140  0.9964 
1 1 1 -5  48  9  o 11 1.64964e+01 4.13403e-01 2.41636e+02 224.570 -1.72001e+01 -1.69438e+01 0.00000e+00 0.00000e+00 3.61877e+02 224.570 1.20241e+02 224.570 0.9791 
1 1 1 -5  48  10 o 2  1.01404e+01 5.05464e-01 1.50516e+02 209.725 -9.96824e+00 -5.69152e+00 0.00000e+00 0.00000e+00 2.11215e+02 209.725 6.06989e+01 209.725 0.9554 
1 1 1 -5  48  11 o 19 3.67856e+00 7.25022e-01 9.73685e+01 110.425 -1.10780e+00 2.97479e+00  0.00000e+00 0.00000e+00 1.54496e+01 110.425 8.19189e+01 290.425 0.8221 
1 1 1 -5  48  12 o 4  1.03541e+01 5.20290e-01 2.09751e+02 349.187 2.39474e+01  -4.57401e+00 0.00000e+00 0.00000e+00 1.68173e+02 349.187 4.15782e+01 169.187 0.9793 
1 1 1 -5  48  13 o 13 1.23049e+01 8.16989e-01 2.34228e+02 87.742  1.31376e+00  3.33256e+01  0.00000e+00 0.00000e+00 2.17039e+02 87.742  1.71888e+01 267.742 0.9849 
1 1 1 -5  48  14 o 8  5.56311e+00 1.41090e+00 1.91823e+01 228.655 -7.09991e-01 -8.06882e-01 0.00000e+00 0.00000e+00 7.85461e+01 228.655 5.93638e+01 228.655 0.4723 
1 1 1 -5  48  15 f 0  4.37641e+00 1.41800e+00 1.02699e+02 102.622 -1.14963e+00 5.13404e+00  0.00000e+00 0.00000e+00 4.35120e+01 102.622 5.91868e+01 282.622 0.8991 
1 1 1 -5  48  16 o 13 7.59931e+00 2.06666e+00 9.17027e+01 104.219 -1.39487e+00 5.50462e+00  0.00000e+00 0.00000e+00 1.64132e+02 104.219 7.24296e+01 104.219 0.9071 
1 1 1 -5  48  17 o 14 5.18866e+00 1.71713e+00 5.60961e+01 7.335   3.24981e+00  4.18324e-01  0.00000e+00 0.00000e+00 1.03267e+02 7.335   4.71707e+01 7.335   0.8285 
1 1 1 -5  49  1  o 14 1.68325e+01 5.49823e-01 2.99067e+02 258.928 -2.01971e+00 -1.03214e+01 0.00000e+00 0.00000e+00 3.01568e+02 258.928 2.50121e+00 258.928 0.9512 
1 1 1 -5  49  2  o 13 1.22136e+01 4.42403e-01 1.13318e+02 331.376 2.54077e+00  -1.38668e+00 0.00000e+00 0.00000e+00 2.53978e+02 331.376 1.40660e+02 331.376 0.8019 
1 1 1 -5  49  3  o 6  5.11002e+01 8.12726e-01 8.76156e+02 152.689 -8.68914e+01 4.48693e+01  0.00000e+00 0.00000e+00 1.02974e+03 152.689 1.53587e+02 152.689 0.9949 
1 1 1 -5  49  4  o 15 2.22209e+01 5.57754e-01 2.70742e+02 303.801 8.02432e+00  -1.19861e+01 0.00000e+00 0.00000e+00 5.32555e+02 303.801 2.61813e+02 303.801 0.9647 
1 1 1 -5  49  5  o 6  5.23076e+00 5.48893e-01 1.78555e+02 15.815  2.45792e+00  6.96221e-01  0.00000e+00 0.00000e+00 2.75350e+01 195.815 2.06090e+02 195.815 0.7708 
1 1 1 -5  49  6  o 4  1.52565e+01 3.96947e-01 3.38397e+02 268.947 -3.07273e-01 -1.67220e+01 0.00000e+00 0.00000e+00 2.15395e+02 268.947 1.23002e+02 88.947  0.9696 
1 1 1 -5  49  7  o 16 1.34014e+01 4.36083e-01 1.72229e+02 21.887  7.44124e+00  2.98943e+00  0.00000e+00 0.00000e+00 2.96774e+02 21.887  1.24545e+02 21.887  0.9354 
1 1 1 -5  49  8  o 6  2.25721e+01 4.51494e-01 3.19735e+02 70.089  1.13676e+01  3.13834e+01  0.00000e+00 0.00000e+00 5.11469e+02 70.089  1.91734e+02 70.089  0.9849 
1 1 1 -5  49  9  o 11 1.14822e+01 4.26722e-01 3.04607e+02 259.236 -3.78160e+00 -1.98923e+01 0.00000e+00 0.00000e+00 1.13659e+02 259.236 1.90948e+02 79.236  0.9750 
1 1 1 -5  49  10 o 5  1.90792e+01 4.90057e-01 3.33402e+02 29.665  4.18363e+01  2.38290e+01  0.00000e+00 0.00000e+00 3.71439e+02 29.665  3.80370e+01 29.665  0.9896 
1 1 1 -5  49  11 o 16 1.16346e+01 4.59270e-01 2.64920e+02 36.866  2.29864e+01  1.72372e+01  0.00000e+00 0.00000e+00 1.61445e+02 36.866  1.03475e+02 216.866 0.9824 
1 1 1 -5  49  12 f 0  5.87650e+00 7.47953e-01 1.17876e+02 43.393  5.13912e+00  4.85869e+00  0.00000e+00 0.00000e+00 8.49927e+01 43.393  3.28834e+01 223.393 0.9263 
1 1 1 -5  49  13 o 11 7.92652e+00 9.53565e-01 1.03605e+02 220.085 -7.51118e+00 -6.32176e+00 0.00000e+00 0.00000e+00 1.76052e+02 220.085 7.24467e+01 220.085 0.9476 
1 1 1 -5  49  14 o 12 7.86168e+00 1.66044e+00 1.02191e+02 315.509 5.47351e+00  -5.37707e+00 0.00000e+00 0.00000e+00 1.70431e+02 315.509 6.82407e+01 315.509 0.9324 
1 1 1 -5  49  15 o 11 5.64482e+00 1.39800e+00 1.74329e+02 27.110  9.91525e+00  5.07602e+00  0.00000e+00 0.00000e+00 2.57457e+01 27.110  1.48583e+02 207.110 0.9540 
1 1 1 -5  49  16 o 17 8.37094e+00 2.03738e+00 9.61976e+01 50.803  4.19255e+00  5.14119e+00  0.00000e+00 0.00000e+00 1.89972e+02 50.803  9.37741e+01 50.803  0.9212 
1 1 1 -5  49  17 f 0  6.62338e+00 2.02562e+00 2.12439e+02 216.637 -1.00085e+01 -7.44297e+00 0.00000e+00 0.00000e+00 2.30025e+01 216.637 1.89436e+02 36.637  0.9590 
1 1 1 -5  50  1  o 9  7.48521e+00 6.90516e-01 1.27203e+02 227.741 -1.38289e+00 -1.52197e+00 0.00000e+00 0.00000e+00 7.12443e+01 227.741 5.59587e+01 47.741  0.7068 
1 1 1 -5  50  2  o 13 1.91635e+01 4.25918e-01 3.06050e+02 237.826 -6.79453e+00 -1.08003e+01 0.00000e+00 0.00000e+00 3.83776e+02 237.826 7.77260e+01 237.826 0.9600 
1 1 1 -5  50  3  o 5  5.11034e+00 5.45106e-01 3.57663e+01 307.595 2.72239e-01  -3.53578e-01 0.00000e+00 0.00000e+00 5.94450e+00 307.595 2.98218e+01 127.595 0.2177 
1 1 1 -5  50  4  o 13 1.17507e+01 3.82371e-01 3.51845e+02 142.291 -8.79155e+00 6.79699e+00  0.00000e+00 0.00000e+00 6.81379e+01 142.291 2.83707e+02 322.291 0.9539 
1 1 1 -5  50  5  o 5  4.47409e+01 6.75050e-01 6.58994e+02 38.087  6.95324e+01  5.44954e+01  0.00000e+00 0.00000e+00 1.00709e+03 38.087  3.48091e+02 38.087  0.9943 
1 1 1 -5  50  6  o 3  2.38717e+01 5.14455e-01 3.72663e+02 323.320 2.21332e+01  -1.64854e+01 0.00000e+00 0.00000e+00 5.04532e+02 323.320 1.31869e+02 323.320 0.9817 
1 1 1 -5  50  7  o 11 1.60787e+01 4.02437e-01 2.21781e+02 212.855 -1.18298e+01 -7.63992e+00 0.00000e+00 0.00000e+00 3.57933e+02 212.855 1.36152e+02 212.855 0.9638 
1 1 1 -5  50  8  o 1  1.16888e+01 4.58691e-01 2.26267e+02 84.741  1.18191e+00  1.28404e+01  0.00000e+00 0.00000e+00 1.93402e+02 84.741  3.28646e+01 264.741 0.9604 
1 1 1 -5  50  9  o 9  2.53334e+01 4.96369e-01 4.34074e+02 132.067 -4.55903e+01 5.05136e+01  0.00000e+00 0.00000e+00 5.05320e+02 132.067 7.12457e+01 132.067 0.9926 
1 1 1 -5  50  10 o 16 1.36981e+01 4.28865e-01 2.48889e+02 176.720 -2.53962e+01 1.45565e+00  0.00000e+00 0.00000e+00 2.52276e+02 176.720 3.38710e+00 176.720 0.9801 
1 1 1 -5  50  11 o 19 6.54239e+00 5.84953e-01 1.35879e+02 305.394 4.68388e+00  -6.59233e+00 0.00000e+00 0.00000e+00 9.25004e+01 305.394 4.33788e+01 125.394 0.9360 
1 1 1 -5  50  12 f 0  8.76719e+00 6.89399e-01 1.21024e+02 34.106  9.61423e+00  6.51077e+00  0.00000e+00 0.00000e+00 1.91262e+02 34.106  7.02379e+01 34.106  0.9559 
1 1 1 -5  50  13 o 4  1.24732e+01 7.56656e-01 1.21116e+02 189.877 -1.84205e+01 -3.20731e+00 0.00000e+00 0.00000e+00 3.30625e+02 189.877 2.09509e+02 189.877 0.9729 
1 1 1 -5  50  14 o 14 6.08685e+00 1.56835e+00 1.74018e+02 45.188  7.40250e+00  7.45135e+00  0.00000e+00 0.00000e+00 4.12801e+01 45.188  1.32738e+02 225.188 0.9511 
1 1 1 -5  50  15 o 19 7.49492e+00 1.58223e+00 1.36095e+02 59.560  5.51539e+00  9.38559e+00  0.00000e+00 0.00000e+00 1.29212e+02 59.560  6.88237e+00 239.560 0.9529 
1 1 1 -5  50  16 o 2  6.02384e+00 1.81732e+00 5.11985e+01 226.923 -2.05253e+00 -2.19514e+00 0.00000e+00 0.00000e+00 1.29933e+02 226.923 7.87341e+01 226.923 0.8104 
1 1 1 -5  50  17 o 13 7.82119e+00 2.11076e+00 1.62383e+02 71.904  3.29319e+00  1.00781e+01  0.00000e+00 0.00000e+00 1.13445e+02 71.904  4.89385e+01 251.904 0.9516 
1 1 1 -5  51  1  o 7  3.34342e+01 6.24500e-01 4.76584e+02 45.762  2.45747e+01  2.52371e+01  0.00000e+00 0.00000e+00 7.59386e+02 45.762  2.82802e+02 45.762  0.9857 
1 1 1 -5  51  2  o 12 2.70087e+01 5.05270e-01 2.95908e+02 188.448 -1.93838e+01 -2.87903e+00 0.00000e+00 0.00000e+00 6.90530e+02 188.448 3.94622e+02 188.448 0.9741 
1 1 1 -5  51  3  o 16 2.72877e+01 4.78966e-01 5.41151e+02 223.084 -2.59570e+01 -2.42762e+01 0.00000e+00 0.00000e+00 4.67077e+02 223.084 7.40740e+01 43.084  0.9858 
1 1 1 -5  51  4  o 18 1.45352e+01 3.93346e-01 1.05337e+02 239.826 -2.12683e+00 -3.65806e+00 0.00000e+00 0.00000e+00 3.69431e+02 239.826 2.64094e+02 239.826 0.8719 
1 1 1 -5  51  5  o 12 2.33706e+01 4.64804e-01 3.45179e+02 326.013 1.92806e+01  -1.29983e+01 0.00000e+00 0.00000e+00 5.10922e+02 326.013 1.65743e+02 326.013 0.9783 
1 1 1 -5  51  6  o 5  3.74915e+01 5.93839e-01 6.73963e+02 149.433 -7.14968e+01 4.22275e+01  0.00000e+00 0.00000e+00 7.20705e+02 149.433 4.67421e+01 149.433 0.9940 
1 1 1 -5  51  7  o 13 1.61902e+01 4.05605e-01 3.64656e+02 238.834 -1.32466e+01 -2.19020e+01 0.00000e+00 0.00000e+00 2.28961e+02 238.834 1.35695e+02 58.834  0.9803 
1 1 1 -5  51  8  o 10 1.33621e+01 4.82621e-01 2.53266e+02 242.474 -7.99078e+00 -1.53332e+01 0.00000e+00 0.00000e+00 2.31526e+02 242.474 2.17399e+01 62.474  0.9706 
1 1 1 -5  51  9  o 13 1.40309e+01 4.20226e-01 3.37047e+02 158.828 -2.80203e+01 1.08526e+01  0.00000e+00 0.00000e+00 1.78236e+02 158.828 1.58812e+02 338.828 0.9832 
1 1 1 -5  51  10 f 0  2.59484e+00 7.10696e-01 6.39049e+01 15.883  1.30051e+00  3.70054e-01  0.00000e+00 0.00000e+00 9.92329e+00 195.883 7.38282e+01 195.883 0.5574 
1 1 1 -5  51  11 o 15 1.43139e+01 5.24062e-01 3.15585e+02 250.836 -1.44093e+01 -4.14614e+01 0.00000e+00 0.00000e+00 2.12078e+02 250.836 1.03507e+02 70.836  0.9885 
1 1 1 -5  51  12 o 2  4.60384e+00 1.05588e+00 1.03595e+02 261.708 -6.76276e-01 -4.64019e+00 0.00000e+00 0.00000e+00 4.83153e+01 261.708 5.52799e+01 81.708  0.8856 
1 1 1 -5  51  13 o 1  1.00580e+01 9.85474e-01 1.41128e+02 2.701   1.71592e+01  8.09485e-01  0.00000e+00 0.00000e+00 2.22177e+02 2.701   8.10491e+01 2.701   0.9704 
1 1 1 -5  51  14 o 10 8.69232e+00 1.29606e+00 1.24250e+02 324.017 1.01113e+01  -7.34171e+00 0.00000e+00 0.00000e+00 1.85742e+02 324.017 6.14920e+01 324.017 0.9591 
1 1 1 -5  51  15 o 9  4.99266e+00 1.39263e+00 1.06758e+02 115.008 -2.69846e+00 5.78482e+00  0.00000e+00 0.00000e+00 6.34642e+01 115.008 4.32934e+01 295.008 0.9179 
1 1 1 -5  51  16 o 16 5.40858e+00 2.33927e+00 4.22593e+01 231.152 -9.91514e-01 -1.23107e+00 0.00000e+00 0.00000e+00 8.12381e+01 231.152 3.89788e+01 231.152 0.6155 
1 1 1 -5  51  17 o 2  7.87534e+00 1.89746e+00 1.11938e+02 150.547 -7.62382e+00 4.30516e+00  0.00000e+00 0.00000e+00 1.62676e+02 150.547 5.07380e+01 150.547 0.9410 
1 1 1 -5  52  1  o 11 6.95694e+00 5.80871e-01 1.29594e+02 154.561 -1.98548e+00 9.44439e-01  0.00000e+00 0.00000e+00 6.02805e+01 154.561 6.93131e+01 334.561 0.7278 
1 1 1 -5  52  2  o 7  3.51372e+01 5.94807e-01 6.14306e+02 274.943 4.45878e+00  -5.15541e+01 0.00000e+00 0.00000e+00 6.90099e+02 274.943 7.57921e+01 274.943 0.9903 
1 1 1 -5  52  3  o 16 1.01811e+01 4.78962e-01 2.15692e+02 126.142 -3.46649e+00 4.74643e+00  0.00000e+00 0.00000e+00 1.31654e+02 126.142 8.40388e+01 306.142 0.9104 
1 1 1 -5  52  4  o 12 4.87313e+01 7.26822e-01 7.44466e+02 87.786  3.87905e+00  1.00340e+02  0.00000e+00 0.00000e+00 1.07181e+03 87.786  3.27347e+02 87.786  0.9950 
1 1 1 -5  52  5  o 18 4.02433e+00 6.53374e-01 9.00093e+01 252.831 -3.41311e-01 -1.10471e+00 0.00000e+00 0.00000e+00 1.48211e+01 72.831  1.04830e+02 72.831  0.4990 
1 1 1 -5  52  6  o 4  5.40246e+00 5.70247e-01 1.41539e+02 20.119  2.54794e+00  9.33390e-01  0.00000e+00 0.00000e+00 1.74319e+01 20.119  1.24108e+02 200.119 0.7864 
1 1 1 -5  52  7  o 3  2.26639e+01 4.44267e-01 4.86996e+02 224.506 -3.38165e+01 -3.32390e+01 0.00000e+00 0.00000e+00 3.51600e+02 224.506 1.35396e+02 44.507  0.9894 
1 1 1 -5  52  8  o 19 1.20443e+01 4.14509e-01 2.69081e+02 157.468 -1.64964e+01 6.84381e+00  0.00000e+00 0.00000e+00 1.68264e+02 157.468 1.00817e+02 337.468 0.9716 
1 1 1 -5  52  9  o 18 3.78068e+00 7.00884e-01 3.69490e+01 326.289 7.78767e-01  -5.19589e-01 0.00000e+00 0.00000e+00 2.28219e+01 326.289 1.41271e+01 146.289 0.4233 
1 1 1 -5  52  10 o 1  2.32668e+01 4.74282e-01 3.19582e+02 66.152  2.40952e+01  5.45073e+01  0.00000e+00 0.00000e+00 5.41354e+02 66.152  2.21772e+02 66.152  0.9916 
1 1 1 -5  52  11 o 17 1.11232e+01 5.60198e-01 2.01591e+02 344.218 2.10512e+01  -5.94952e+00 0.00000e+00 0.00000e+00 2.03551e+02 344.218 1.95957e+00 344.218 0.9769 
1 1 1 -5  52  12 o 12 8.76319e+00 6.56215e-01 1.14811e+02 181.505 -1.18529e+01 -3.11366e-01 0.00000e+00 0.00000e+00 1.97551e+02 181.505 8.27395e+01 181.505 0.9569 
1 1 1 -5  52  13 o 5  1.12694e+01 8.20415e-01 1.79988e+02 90.006  -2.95623e-03 2.72426e+01  0.00000e+00 0.00000e+00 2.31642e+02 90.006  5.16547e+01 90.006  0.9815 
1 1 1 -5  52  14 o 5  6.58857e+00 8.75425e-01 6.28908e+01 70.542  1.99606e+00  5.64992e+00  0.00000e+00 0.00000e+00 1.60561e+02 70.542  9.76699e+01 70.542  0.9122 
1 1 1 -5  52  15 o 2  4.78330e+00 1.38045e+00 7.55061e+01 52.705  2.68162e+00  3.52074e+00  0.00000e+00 0.00000e+00 8.04803e+01 52.705  4.97420e+00 52.705  0.8781 
1 1 1 -5  52  16 o 2  4.31159e+00 2.03423e+00 6.47624e+01 287.603 7.10487e-01  -2.23935e+00 0.00000e+00 0.00000e+00 5.48019e+01 287.603 9.96047e+00 107.603 0.7476 
1 1 1 -5  52  17 o 15 6.16841e+00 1.76089e+00 1.63789e+02 199.411 -1.04499e+01 -3.68232e+00 0.00000e+00 0.00000e+00 5.41791e+01 199.411 1.09610e+02 19.411  0.9537 
1 1 1 -5  53  1  o 5  3.52824e+00 6.69524e-01 8.72825e+01 293.191 2.89148e-01  -6.74911e-01 0.00000e+00 0.00000e+00 4.17220e+01 113.191 1.29004e+02 113.191 0.3444 
1 1 1 -5  53  2  o 16 4.73941e+01 7.54706e-01 8.47408e+02 354.376 1.05357e+02  -1.03749e+01 0.00000e+00 0.00000e+00 9.20595e+02 354.376 7.31866e+01 354.376 0.9953 
1 1 1 -5  53  3  o 19 2.56715e+01 6.46515e-01 3.03699e+02 148.534 -1.81276e+01 1.10937e+01  0.00000e+00 0.00000e+00 6.35265e+02 148.534 3.31566e+02 148.534 0.9762 
1 1 1 -5  53  4  o 12 2.07369e+01 4.31822e-01 3.06065e+02 204.108 -1.75773e+01 -7.86575e+00 0.00000e+00 0.00000e+00 4.50149e+02 204.108 1.44084e+02 204.108 0.9737 
1 1 1 -5  53  5  o 19 1.51032e+01 3.99363e-01 3.95813e+02 341.035 1.76646e+01  -6.07018e+00 0.00000e+00 0.00000e+00 1.54229e+02 341.035 2.41584e+02 161.035 0.9729 
1 1 1 -5  53  6  o 19 2.50469e+01 4.63482e-01 4.71519e+02 240.377 -2.02347e+01 -3.55867e+01 0.00000e+00 0.00000e+00 4.54092e+02 240.377 1.74274e+01 60.377  0.9877 
1 1 1 -5  53  7  o 3  5.61923e+00 6.86669e-01 1.03469e+02 108.517 -8.36830e-01 2.49856e+00  0.00000e+00 0.00000e+00 6.01942e+01 108.517 4.32752e+01 288.517 0.7789 
1 1 1 -5  53  8  o 12 1.59994e+01 4.20435e-01 3.47888e+02 238.466 -1.76311e+01 -2.87337e+01 0.00000e+00 0.00000e+00 2.41042e+02 238.466 1.06846e+02 58.466  0.9851 
1 1 1 -5  53  9  o 10 1.45990e+01 4.18387e-01 1.92024e+02 226.367 -1.39363e+01 -1.46177e+01 0.00000e+00 0.00000e+00 3.39445e+02 226.367 1.47421e+02 226.367 0.9749 
1 1 1 -5  53  10 o 16 5.53109e+00 7.13476e-01 1.22576e+02 85.903  4.04676e-01  5.65009e+00  0.00000e+00 0.00000e+00 6.45666e+01 85.903  5.80096e+01 265.903 0.9068 
1 1 1 -5  53  11 o 9  6.90331e+00 8.68512e-01 1.19080e+02 166.001 -7.94214e+00 1.98010e+00  0.00000e+00 0.00000e+00 1.22003e+02 166.001 2.92283e+00 166.001 0.9368 
1 1 1 -5  53  12 o 17 5.39235e+00 8.35679e-01 7.37720e+01 332.880 4.14365e+00  -2.12218e+00 0.00000e+00 0.00000e+00 1.03923e+02 332.880 3.01507e+01 332.880 0.8847 
1 1 1 -5  53  13 o 17 5.01459e+00 1.01747e+00 7.65081e+01 246.972 -1.76314e+00 -4.14809e+00 0.00000e+00 0.00000e+00 8.77983e+01 246.972 1.12901e+01 246.972 0.8805 
1 1 1 -5  53  14 o 18 1.76597e+01 7.68459e-01 2.68744e+02 273.429 4.30583e+00  -7.18705e+01 0.00000e+00 0.00000e+00 3.83138e+02 273.429 1.14394e+02 273.429 0.9930 
1 1 1 -5  53  15 o 17 5.74708e+00 1.54108e+00 1.06771e+02 239.830 -3.47532e+00 -5.97839e+00 0.00000e+00 0.00000e+00 9.05336e+01 239.830 1.62374e+01 59.830  0.9246 
1 1 1 -5  53  16 o 13 5.80923e+00 1.47592e+00 1.04581e+02 173.201 -7.38290e+00 8.80221e-01  0.00000e+00 0.00000e+00 9.58185e+01 173.201 8.76202e+00 353.201 0.9301 
1 1 1 -5  53  17 o 7  4.41643e+00 1.40918e+00 2.90757e+01 142.557 -1.42394e+00 1.09038e+00  0.00000e+00 0.00000e+00 7.90297e+01 142.557 4.99540e+01 142.557 0.6608 
1 1 1 -5  54  1  o 2  8.38843e+00 5.11457e-01 1.62620e+02 169.049 -3.50603e+00 6.78396e-01  0.00000e+00 0.00000e+00 1.03013e+02 169.049 5.96074e+01 349.049 0.8447 
1 1 1 -5  54  2  o 14 1.49267e+01 4.97642e-01 2.21013e+02 68.253  3.19321e+00  8.00527e+00  0.00000e+00 0.00000e+00 3.04853e+02 68.253  8.38399e+01 68.253  0.9401 
1 1 1 -5  54  3  o 9  2.50792e+01 5.29086e-01 5.65170e+02 172.220 -3.93604e+01 5.37785e+00  0.00000e+00 0.00000e+00 3.62470e+02 172.220 2.02700e+02 352.220 0.9873 
1 1 1 -5  54  4  o 3  3.56964e+01 5.74404e-01 7.09637e+02 59.884  3.63040e+01  6.25879e+01  0.00000e+00 0.00000e+00 6.17829e+02 59.884  9.18077e+01 239.884 0.9931 
1 1 1 -5  54  5  f 0  1.59464e+01 4.04860e-01 1.95349e+02 199.547 -9.43106e+00 -3.34844e+00 0.00000e+00 0.00000e+00 3.70862e+02 199.547 1.75513e+02 199.547 0.9486 
1 1 1 -5  54  6  o 3  1.16430e+01 4.04077e-01 2.99192e+02 161.066 -1.29958e+01 4.45797e+00  0.00000e+00 0.00000e+00 1.20204e+02 161.066 1.78988e+02 341.066 0.9629 
1 1 1 -5  54  7  o 15 2.98692e+01 5.14506e-01 4.49127e+02 91.935  -2.20158e+00 6.51478e+01  0.00000e+00 0.00000e+00 6.58995e+02 91.935  2.09868e+02 91.935  0.9923 
1 1 1 -5  54  8  o 7  2.21528e+01 4.53405e-01 4.21745e+02 237.812 -2.87447e+01 -4.56664e+01 0.00000e+00 0.00000e+00 3.98232e+02 237.812 2.35136e+01 57.812  0.9907 
1 1 1 -5  54  9  o 6  3.75962e+00 7.17132e-01 9.85360e+01 36.969  2.14493e+00  1.61452e+00  0.00000e+00 0.00000e+00 1.14663e+01 36.969  8.70697e+01 216.969 0.7837 
1 1 1 -5  54  10 o 12 1.96162e+01 5.31939e-01 3.32784e+02 331.491 5.02332e+01  -2.72850e+01 0.00000e+00 0.00000e+00 3.92596e+02 331.491 5.98115e+01 331.491 0.9912 
1 1 1 -5  54  11 o 16 8.95618e+00 6.22356e-01 1.29146e+02 139.280 -9.18601e+00 7.90681e+00  0.00000e+00 0.00000e+00 1.90611e+02 139.280 6.14651e+01 139.280 0.9578 
1 1 1 -5  54  12 o 7  1.15476e+01 6.08873e-01 1.73737e+02 326.641 2.20612e+01  -1.45243e+01 0.00000e+00 0.00000e+00 2.48087e+02 326.641 7.43505e+01 326.641 0.9809 
1 1 1 -5  54  13 o 8  6.15060e+00 9.10045e-01 9.81571e+01 84.987  6.69879e-01  7.63706e+00  0.00000e+00 0.00000e+00 1.15184e+02 84.987  1.70271e+01 84.987  0.9323 
1 1 1 -5  54  14 o 1  5.47925e+00 1.09901e+00 1.10726e+02 312.382 5.47095e+00  -5.99514e+00 0.00000e+00 0.00000e+00 7.99294e+01 312.382 3.07963e+01 132.382 0.9362 
1 1 1 -5  54  15 o 17 1.15367e+01 1.50278e+00 1.38859e+02 292.208 7.20187e+00  -1.76403e+01 0.00000e+00 0.00000e+00 2.78064e+02 292.208 1.39205e+02 292.208 0.9734 
1 1 1 -5  54  16 o 8  3.78136e+00 1.18456e+00 6.25993e+01 277.649 4.73182e-01  -3.52352e+00 0.00000e+00 0.00000e+00 5.57439e+01 277.649 6.85538e+00 97.649  0.8439 
1 1 1 -5  54  17 o 12 4.75751e+00 1.51992e+00 5.86475e+01 81.833  5.13694e-01  3.57920e+00  0.00000e+00 0.00000e+00 9.05946e+01 81.833  3.19472e+01 81.833  0.8469 
1 1 1 -5  55  1  o 4  2.09283e+01 4.60047e-01 3.79555e+02 21.619  2.03466e+01  8.06344e+00  0.00000e+00 0.00000e+00 3.86739e+02 21.619  7.18392e+00 21.619  0.9769 
1 1 1 -5  55  2  o 2  4.06264e+01 6.34982e-01 7.75013e+02 280.325 1.57386e+01  -8.63901e+01 0.00000e+00 0.00000e+00 7.38590e+02 280.325 3.64231e+01 100.325 0.9943 
1 1 1 -5  55  3  o 6  2.24284e+01 5.13764e-01 3.85543e+02 22.240  2.41580e+01  9.87850e+00  0.00000e+00 0.00000e+00 4.38310e+02 22.240  5.27673e+01 22.240  0.9807 
1 1 1 -5  55  4  o 12 2.22383e+01 5.12303e-01 3.84530e+02 107.695 -8.09332e+00 2.53676e+01  0.00000e+00 0.00000e+00 4.32325e+02 107.695 4.77950e+01 107.695 0.9810 
1 1 1 -5  55  5  o 6  1.20159e+01 4.17870e-01 1.45478e+02 308.614 3.91213e+00  -4.89811e+00 0.00000e+00 0.00000e+00 2.66587e+02 308.614 1.21110e+02 308.614 0.9163 
1 1 1 -5  55  6  o 1  1.15860e+01 4.28962e-01 1.13587e+02 76.581  1.31848e+00  5.52616e+00  0.00000e+00 0.00000e+00 2.79516e+02 76.581  1.65929e+02 76.581  0.9071 
1 1 1 -5  55  7  o 9  1.09649e+01 4.60060e-01 1.74815e+02 51.105  5.72287e+00  7.09373e+00  0.00000e+00 0.00000e+00 2.11883e+02 51.105  3.70677e+01 51.105  0.9434 
1 1 1 -5  55  8  o 16 1.50449e+01 4.22618e-01 3.23257e+02 267.456 -1.34559e+00 -3.02905e+01 0.00000e+00 0.00000e+00 2.29424e+02 267.456 9.38333e+01 87.456  0.9834 
1 1 1 -5  55  9  o 9  1.72261e+01 5.63411e-01 2.92295e+02 149.266 -3.17870e+01 1.88991e+01  0.00000e+00 0.00000e+00 3.41997e+02 149.266 4.97020e+01 149.266 0.9864 
1 1 1 -5  55  10 o 19 6.61214e+00 6.38967e-01 1.63066e+02 329.449 8.37345e+00  -4.94245e+00 0.00000e+00 0.00000e+00 7.05218e+01 329.449 9.25447e+01 149.449 0.9471 
1 1 1 -5  55  11 o 12 1.54976e+01 5.47542e-01 2.98150e+02 321.349 4.02467e+01  -3.21868e+01 0.00000e+00 0.00000e+00 2.73804e+02 321.349 2.43461e+01 141.349 0.9902 
1 1 1 -5  55  12 o 1  6.56815e+00 9.36454e-01 8.73149e+01 95.405  -5.98808e-01 6.32855e+00  0.00000e+00 0.00000e+00 1.37094e+02 95.405  4.97792e+01 95.405  0.9176 
1 1 1 -5  55  13 o 13 4.63562e+00 1.01469e+00 4.02449e+01 230.463 -1.48249e+00 -1.79603e+00 0.00000e+00 0.00000e+00 8.82295e+01 230.463 4.79846e+01 230.463 0.7450 
1 1 1 -5  55  14 o 13 1.28960e+01 8.21613e-01 2.21340e+02 155.952 -4.21678e+01 1.88169e+01  0.00000e+00 0.00000e+00 2.52675e+02 155.952 3.13347e+01 155.952 0.9891 
1 1 1 -5  55  15 o 19 5.58623e+00 1.41219e+00 8.96057e+01 195.021 -5.84758e+00 -1.56919e+00 0.00000e+00 0.00000e+00 9.97615e+01 195.021 1.01559e+01 195.021 0.9132 
1 1 1 -5  55  16 o 15 4.08246e+00 1.24013e+00 2.94905e+01 51.724  1.13388e+00  1.43698e+00  0.00000e+00 0.00000e+00 7.16066e+01 51.724  4.21161e+01 51.724  0.6679 
1 1 1 -5  55  17 o 2  4.66160e+00 1.52095e+00 8.65442e+01 110.767 -1.92114e+00 5.06629e+00  0.00000e+00 0.00000e+00 6.92181e+01 110.767 1.73261e+01 290.767 0.9023 
1 1 1 -5  56  1  o 7  2.77759e+01 5.19906e-01 4.66088e+02 47.856  2.43552e+01  2.69133e+01  0.00000e+00 0.00000e+00 5.60398e+02 47.856  9.43101e+01 47.856  0.9861 
1 1 1 -5  56  2  o 9  1.08450e+01 5.85276e-01 1.56912e+02 70.853  1.68009e+00  4.83901e+00  0.00000e+00 0.00000e+00 2.07200e+02 70.853  5.02880e+01 70.853  0.8961 
1 1 1 -5  56  3  o 1  1.34892e+01 5.33678e-01 2.39661e+02 347.064 1.01643e+01  -2.33470e+00 0.00000e+00 0.00000e+00 2.40665e+02 347.064 1.00420e+00 347.064 0.9508 
1 1 1 -5  56  4  o 6  3.59586e+01 5.80585e-01 6.24916e+02 162.628 -6.83772e+01 2.13920e+01  0.00000e+00 0.00000e+00 7.11806e+02 162.628 8.68909e+01 162.628 0.9930 
1 1 1 -5  56  5  o 7  4.71887e+01 7.15272e-01 6.01954e+02 348.460 9.46578e+01  -1.93273e+01 0.00000e+00 0.00000e+00 1.15460e+03 348.460 5.52649e+02 348.460 0.9948 
1 1 1 -5  56  6  o 11 1.17116e+01 4.10678e-01 2.02525e+02 260.583 -1.72420e+00 -1.03964e+01 0.00000e+00 0.00000e+00 2.14139e+02 260.583 1.16139e+01 260.583 0.9513 
1 1 1 -5  56  7  o 4  3.38062e+00 7.06013e-01 1.22238e+02 253.714 -6.18515e-01 -2.11710e+00 0.00000e+00 0.00000e+00 3.01507e+01 73.714  1.52389e+02 73.714  0.7288 
1 1 1 -5  56  8  o 7  2.67378e+00 7.54234e-01 5.83259e+01 133.499 -6.51251e-01 6.86293e-01  0.00000e+00 0.00000e+00 1.56850e+01 313.499 7.40108e+01 313.499 0.4270 
1 1 1 -5  56  9  o 4  1.12275e+01 5.06096e-01 2.03537e+02 203.784 -1.63325e+01 -7.19815e+00 0.00000e+00 0.00000e+00 2.03605e+02 203.784 6.76359e-02 203.784 0.9716 
1 1 1 -5  56  10 o 11 3.10554e+00 8.24691e-01 6.24446e+01 41.865  1.24278e+00  1.11370e+00  0.00000e+00 0.00000e+00 1.11219e+01 41.865  5.13227e+01 221.865 0.6352 
1 1 1 -5  56  11 o 14 1.54177e+01 5.51125e-01 3.01344e+02 209.418 -4.59934e+01 -2.59350e+01 0.00000e+00 0.00000e+00 2.67710e+02 209.418 3.36349e+01 29.418  0.9905 
1 1 1 -5  56  12 o 12 6.73423e+00 7.80189e-01 1.02014e+02 265.591 -6.77165e-01 -8.78287e+00 0.00000e+00 0.00000e+00 1.34010e+02 265.591 3.19966e+01 265.591 0.9414 
1 1 1 -5  56  13 o 15 5.03265e+00 1.01717e+00 7.31702e+01 40.024  3.45960e+00  2.90547e+00  0.00000e+00 0.00000e+00 9.17117e+01 40.024  1.85414e+01 40.024  0.8809 
1 1 1 -5  56  14 o 17 5.30469e+00 9.78676e-01 1.68211e+02 218.075 -9.73854e+00 -7.62903e+00 0.00000e+00 0.00000e+00 2.07469e+01 218.075 1.47464e+02 38.075  0.9587 
1 1 1 -5  56  15 o 2  2.51438e+00 8.61656e-01 3.91574e+01 266.342 -1.07844e-01 -1.68699e+00 0.00000e+00 0.00000e+00 2.05509e+01 266.342 1.86065e+01 86.342  0.6398 
1 1 1 -5  56  16 o 15 6.50089e+00 1.32005e+00 7.63044e+01 339.506 6.63549e+00  -2.48016e+00 0.00000e+00 0.00000e+00 1.46978e+02 339.506 7.06734e+01 339.506 0.9265 
1 1 1 -5  56  17 o 11 3.98155e+00 1.34847e+00 4.61510e+01 17.704  2.80209e+00  8.94488e-01  0.00000e+00 0.00000e+00 7.26115e+01 17.704  2.64605e+01 17.704  0.8056 
1 1 1 -5  57  1  o 10 1.21925e+01 4.24531e-01 1.89164e+02 187.154 -6.93651e+00 -8.70682e-01 0.00000e+00 0.00000e+00 2.33622e+02 187.154 4.44583e+01 187.154 0.9254 
1 1 1 -5  57  2  o 2  2.59679e+01 4.80492e-01 3.86465e+02 310.243 1.86270e+01  -2.20087e+01 0.00000e+00 0.00000e+00 5.69251e+02 310.243 1.82786e+02 310.243 0.9825 
1 1 1 -5  57  3  o 2  7.09308e+00 5.48290e-01 1.74715e+02 189.084 -3.79785e+00 -6.07215e-01 0.00000e+00 0.00000e+00 5.29977e+01 189.084 1.21718e+02 9.084   0.8573 
1 1 1 -5  57  4  o 12 3.42801e+01 5.63204e-01 6.46609e+02 14.728  7.04035e+01  1.85074e+01  0.00000e+00 0.00000e+00 6.27664e+02 14.728  1.89446e+01 194.728 0.9931 
1 1 1 -5  57  5  o 3  1.91663e+01 4.69426e-01 3.01617e+02 57.906  1.20606e+01  1.92311e+01  0.00000e+00 0.00000e+00 3.99468e+02 57.906  9.78509e+01 57.906  0.9777 
1 1 1 -5  57  6  o 11 5.17205e+00 6.65273e-01 1.78387e+02 197.631 -3.98404e+00 -1.26621e+00 0.00000e+00 0.00000e+00 1.01107e+01 17.631  1.88498e+02 17.631  0.8701 
1 1 1 -5  57  7  o 1  1.07926e+01 4.26429e-01 2.61172e+02 306.795 1.02269e+01  -1.36729e+01 0.00000e+00 0.00000e+00 1.30151e+02 306.795 1.31020e+02 126.795 0.9703 
1 1 1 -5  57  8  o 17 1.91826e+01 5.01777e-01 3.85010e+02 178.147 -5.09335e+01 1.64733e+00  0.00000e+00 0.00000e+00 3.24306e+02 178.147 6.07041e+01 358.147 0.9901 
1 1 1 -5  57  9  o 8  1.92867e+01 5.14945e-01 3.76338e+02 255.727 -1.50938e+01 -5.93317e+01 0.00000e+00 0.00000e+00 3.37509e+02 255.727 3.88292e+01 75.727  0.9918 
1 1 1 -5  57  10 o 5  2.00651e+01 5.48674e-01 3.30261e+02 249.473 -2.24680e+01 -6.00060e+01 0.00000e+00 0.00000e+00 4.12090e+02 249.473 8.18284e+01 249.473 0.9922 
1 1 1 -5  57  11 o 1  1.32728e+01 5.45016e-01 2.18383e+02 274.263 2.29100e+00  -3.07375e+01 0.00000e+00 0.00000e+00 2.68044e+02 274.263 4.96617e+01 274.263 0.9836 
1 1 1 -5  57  12 o 19 4.29464e+00 9.51906e-01 1.25543e+02 72.961  1.81672e+00  5.92776e+00  0.00000e+00 0.00000e+00 2.07900e+01 72.961  1.04753e+02 252.961 0.9154 
1 1 1 -5  57  13 o 19 1.30311e+01 7.16713e-01 2.48748e+02 208.034 -4.54120e+01 -2.41807e+01 0.00000e+00 0.00000e+00 2.31121e+02 208.034 1.76268e+01 28.034  0.9902 
1 1 1 -5  57  14 o 19 6.07071e+00 9.73966e-01 1.42131e+02 40.513  9.97472e+00  8.52323e+00  0.00000e+00 0.00000e+00 7.46241e+01 40.513  6.75067e+01 220.513 0.9611 
1 1 1 -5  57  15 o 10 5.42677e+00 1.27110e+00 8.39047e+01 150.533 -5.39942e+00 3.05077e+00  0.00000e+00 0.00000e+00 1.00441e+02 150.533 1.65360e+01 150.533 0.9154 
1 1 1 -5  57  16 o 9  4.33293e+00 1.35100e+00 1.17506e+02 44.464  5.15538e+00  5.05977e+00  0.00000e+00 0.00000e+00 3.15314e+01 44.464  8.59742e+01 224.464 0.9279 
1 1 1 -5  57  17 o 13 3.95739e+00 1.31639e+00 4.90861e+01 232.554 -1.97468e+00 -2.57851e+00 0.00000e+00 0.00000e+00 7.20435e+01 232.554 2.29574e+01 232.554 0.8268 
1 1 1 -5  58  1  o 1  1.81132e+01 4.43119e-01 2.98386e+02 172.986 -1.73860e+01 2.13889e+00  0.00000e+00 0.00000e+00 3.60546e+02 172.986 6.21601e+01 172.986 0.9710 
1 1 1 -5  58  2  o 5  2.14275e+01 5.29390e-01 2.44639e+02 17.258  1.55746e+01  4.83856e+00  0.00000e+00 0.00000e+00 5.32885e+02 17.258  2.88245e+02 17.258  0.9688 
1 1 1 -5  58  3  f 0  6.72975e+00 6.36489e-01 3.34875e+01 159.878 -6.70906e-01 2.45808e-01  0.00000e+00 0.00000e+00 5.12330e+01 159.878 1.77455e+01 159.878 0.3362 
1 1 1 -5  58  4  f 0  1.66721e+01 4.67174e-01 2.15904e+02 272.144 4.67425e-01  -1.24883e+01 0.00000e+00 0.00000e+00 3.82530e+02 272.144 1.66626e+02 272.144 0.9591 
1 1 1 -5  58  5  o 19 6.01845e+00 5.69603e-01 2.63584e+02 186.538 -6.72391e+00 -7.70573e-01 0.00000e+00 0.00000e+00 5.58246e+01 6.538   3.19409e+02 6.538   0.9228 
1 1 1 -5  58  6  o 4  1.23577e+01 4.19432e-01 2.40315e+02 271.374 3.40797e-01  -1.42053e+01 0.00000e+00 0.00000e+00 2.05130e+02 271.374 3.51847e+01 91.374  0.9641 
1 1 1 -5  58  7  o 17 1.47144e+01 4.79117e-01 3.52788e+02 18.589  2.83541e+01  9.53622e+00  0.00000e+00 0.00000e+00 1.87733e+02 18.589  1.65055e+02 198.589 0.9831 
1 1 1 -5  58  8  o 11 1.39642e+01 4.88933e-01 1.73727e+02 233.524 -1.08903e+01 -1.47302e+01 0.00000e+00 0.00000e+00 3.33251e+02 233.524 1.59524e+02 233.524 0.9723 
1 1 1 -5  58  9  o 12 1.30134e+01 5.01483e-01 2.42447e+02 332.021 2.42797e+01  -1.28983e+01 0.00000e+00 0.00000e+00 2.34204e+02 332.021 8.24306e+00 152.021 0.9816 
1 1 1 -5  58  10 o 5  3.07055e+00 7.70911e-01 6.31069e+01 146.452 -1.50231e+00 9.96153e-01  0.00000e+00 0.00000e+00 1.27407e+01 146.452 5.03662e+01 326.452 0.6625 
1 1 1 -5  58  11 o 4  9.22757e+00 5.99234e-01 1.32335e+02 63.357  6.23780e+00  1.24333e+01  0.00000e+00 0.00000e+00 1.98814e+02 63.357  6.64796e+01 63.357  0.9634 
1 1 1 -5  58  12 o 17 7.04860e+00 8.03630e-01 1.04091e+02 207.727 -8.48180e+00 -4.45816e+00 0.00000e+00 0.00000e+00 1.44155e+02 207.727 4.00639e+01 207.727 0.9463 
1 1 1 -5  58  13 o 12 7.09018e+00 9.12425e-01 8.41187e+01 65.781  3.48820e+00  7.75470e+00  0.00000e+00 0.00000e+00 1.63486e+02 65.781  7.93677e+01 65.781  0.9392 
1 1 1 -5  58  14 o 1  4.18276e+00 1.03297e+00 1.26697e+02 116.879 -3.57714e+00 7.05723e+00  0.00000e+00 0.00000e+00 1.84903e+01 116.879 1.08206e+02 296.879 0.9345 
1 1 1 -5  58  15 o 2  1.01312e+01 7.94459e-01 1.87123e+02 267.602 -1.41446e+00 -3.37734e+01 0.00000e+00 0.00000e+00 1.83180e+02 267.602 3.94334e+00 87.602  0.9851 
1 1 1 -5  58  16 o 4  4.07332e+00 1.28076e+00 1.87065e+01 180.137 -1.13576e+00 -2.71331e-03 0.00000e+00 0.00000e+00 5.56316e+01 180.137 3.69251e+01 180.137 0.4924 
1 1 1 -5  59  1  o 3  1.85319e+01 4.96570e-01 3.39945e+02 143.412 -1.57356e+01 1.16814e+01  0.00000e+00 0.00000e+00 3.36279e+02 143.412 3.66558e+00 323.412 0.9741 
1 1 1 -5  59  2  f 0  3.14871e+01 5.37301e-01 3.04715e+02 354.906 3.05521e+01  -2.72320e+00 0.00000e+00 0.00000e+00 8.55006e+02 354.906 5.50291e+02 354.906 0.9836 
1 1 1 -5  59  3  o 16 3.05983e+01 5.29032e-01 5.93074e+02 194.275 -6.26690e+01 -1.59455e+01 0.00000e+00 0.00000e+00 5.43449e+02 194.275 4.96253e+01 14.275  0.9922 
1 1 1 -5  59  4  f 0  7.79045e+00 5.60582e-01 2.43885e+02 295.976 3.25064e+00  -6.67198e+00 0.00000e+00 0.00000e+00 2.72047e+01 295.976 2.16680e+02 115.976 0.9300 
1 1 1 -5  59  5  o 19 1.34809e+01 4.16762e-01 2.43044e+02 22.862  1.33981e+01  5.64919e+00  0.00000e+00 0.00000e+00 2.43491e+02 22.862  4.46757e-01 22.862  0.9650 
1 1 1 -5  59  6  o 5  1.31062e+01 4.77848e-01 3.75873e+02 148.124 -2.13388e+01 1.32695e+01  0.00000e+00 0.00000e+00 1.04195e+02 148.124 2.71678e+02 328.125 0.9799 
1 1 1 -5  59  7  o 7  1.42524e+01 4.76863e-01 2.62652e+02 297.847 1.08392e+01  -2.05178e+01 0.00000e+00 0.00000e+00 2.58190e+02 297.847 4.46157e+00 117.847 0.9782 
1 1 1 -5  59  8  o 12 4.57520e+00 7.90468e-01 8.95763e+01 185.645 -2.92962e+00 -2.89601e-01 0.00000e+00 0.00000e+00 4.80523e+01 185.645 4.15240e+01 5.645   0.8058 
1 1 1 -5  59  9  o 16 3.82263e+00 7.91853e-01 7.34541e+01 227.543 -1.57240e+00 -1.71860e+00 0.00000e+00 0.00000e+00 3.28029e+01 227.543 4.06512e+01 47.543  0.7451 
1 1 1 -5  59  10 o 14 3.21237e+00 7.77874e-01 9.76864e+01 221.640 -2.39937e+00 -2.13326e+00 0.00000e+00 0.00000e+00 1.03736e+00 221.640 9.66490e+01 41.640  0.8244 
1 1 1 -5  59  11 o 13 4.48953e+00 8.50259e-01 7.83803e+01 288.702 1.31442e+00  -3.88273e+00 0.00000e+00 0.00000e+00 6.66352e+01 288.702 1.17451e+01 108.702 0.8672 
1 1 1 -5  59  12 o 18 9.04109e+00 6.75470e-01 1.60958e+02 124.777 -1.17849e+01 1.69707e+01  0.00000e+00 0.00000e+00 1.67236e+02 124.777 6.27760e+00 124.777 0.9755 
1 1 1 -5  59  13 o 9  5.20598e+00 9.09227e-01 9.34538e+01 68.735  2.49794e+00  6.41840e+00  0.00000e+00 0.00000e+00 8.54256e+01 68.735  8.02821e+00 248.735 0.9243 
1 1 1 -5  59  14 o 14 8.37092e+00 9.07192e-01 1.32907e+02 272.090 6.46750e-01  -1.77200e+01 0.00000e+00 0.00000e+00 1.69077e+02 272.090 3.61704e+01 272.090 0.9714 
1 1 1 -5  59  15 o 1  1.26830e+01 7.26731e-01 1.81328e+02 88.293  1.21920e+00  4.09042e+01  0.00000e+00 0.00000e+00 2.83401e+02 88.293  1.02073e+02 88.293  0.9877 
1 1 1 -5  59  16 o 12 1.11905e+01 1.52717e+00 1.22248e+02 273.599 1.06832e+00  -1.69844e+01 0.00000e+00 0.00000e+00 2.80046e+02 273.599 1.57798e+02 273.599 0.9702 
1 1 1 -5  60  1  o 9  4.69299e+00 7.74867e-01 1.57915e+02 56.461  1.32637e+00  2.00094e+00  0.00000e+00 0.00000e+00 2.54352e+01 236.461 1.83350e+02 236.461 0.7537 
1 1 1 -5  60  2  o 16 2.48016e+01 5.78710e-01 3.58720e+02 149.937 -2.52492e+01 1.46144e+01  0.00000e+00 0.00000e+00 5.53825e+02 149.937 1.95105e+02 149.937 0.9827 
1 1 1 -5  60  3  o 3  2.32150e+01 4.65944e-01 5.01098e+02 290.083 1.38490e+01  -3.78783e+01 0.00000e+00 0.00000e+00 3.56949e+02 290.083 1.44148e+02 110.083 0.9875 
1 1 1 -5  60  4  o 2  2.52675e+01 4.79266e-01 4.40856e+02 211.619 -4.08800e+01 -2.51686e+01 0.00000e+00 0.00000e+00 4.94561e+02 211.619 5.37048e+01 211.619 0.9895 
1 1 1 -5  60  5  o 6  2.36152e+01 4.70139e-01 4.40431e+02 114.106 -2.07548e+01 4.63847e+01  0.00000e+00 0.00000e+00 4.33914e+02 114.106 6.51776e+00 294.106 0.9901 
1 1 1 -5  60  6  o 10 1.75865e+01 4.92789e-01 3.97402e+02 16.621  3.65462e+01  1.09098e+01  0.00000e+00 0.00000e+00 2.51209e+02 16.621  1.46193e+02 196.621 0.9868 
1 1 1 -5  60  7  o 6  2.38726e+01 5.41797e-01 4.00679e+02 301.118 3.09426e+01  -5.12579e+01 0.00000e+00 0.00000e+00 4.83531e+02 301.118 8.28523e+01 301.118 0.9916 
1 1 1 -5  60  8  o 6  2.01490e+01 5.29493e-01 3.24015e+02 9.879   4.73498e+01  8.24606e+00  0.00000e+00 0.00000e+00 4.20228e+02 9.879   9.62138e+01 9.879   0.9895 
1 1 1 -5  60  9  o 18 1.32603e+01 4.66439e-01 2.54365e+02 235.726 -1.77005e+01 -2.59730e+01 0.00000e+00 0.00000e+00 2.32319e+02 235.726 2.20465e+01 55.726  0.9840 
1 1 1 -5  60  10 o 9  7.73714e+00 5.74961e-01 1.32210e+02 43.629  7.83479e+00  7.46852e+00  0.00000e+00 0.00000e+00 1.42501e+02 43.629  1.02908e+01 43.629  0.9526 
1 1 1 -5  60  11 o 17 4.32481e+00 8.19093e-01 1.10825e+02 185.971 -5.84888e+00 -6.11743e-01 0.00000e+00 0.00000e+00 3.58107e+01 185.971 7.50142e+01 5.971   0.9105 
1 1 1 -5  60  12 o 8  5.94198e+00 8.26820e-01 8.54103e+01 265.225 -5.37358e-01 -6.43245e+00 0.00000e+00 0.00000e+00 1.17738e+02 265.225 3.23273e+01 265.225 0.9189 
1 1 1 -5  60  13 f 0  2.11870e+01 6.21982e-01 4.09388e+02 356.760 1.39223e+02  -7.88021e+00 0.00000e+00 0.00000e+00 3.75311e+02 356.760 3.40769e+01 176.760 0.9964 
1 1 1 -5  60  14 o 1  4.58466e+00 1.03294e+00 7.02642e+01 250.359 -1.63968e+00 -4.59442e+00 0.00000e+00 0.00000e+00 8.13299e+01 250.359 1.10657e+01 250.359 0.8905 
1 1 1 -5  60  15 o 4  5.31442e+00 1.07356e+00 1.14511e+02 136.025 -6.78715e+00 6.54865e+00  0.00000e+00 0.00000e+00 7.18478e+01 136.025 4.26628e+01 316.025 0.9454 
1 1 1 -5  60  16 o 17 5.74490e+00 1.52546e+00 8.52803e+01 261.035 -9.95754e-01 -6.31164e+00 0.00000e+00 0.00000e+00 1.10115e+02 261.035 2.48345e+01 261.035 0.9180 
1 1 1 -5  61  1  o 15 1.41542e+01 4.47842e-01 1.52448e+02 208.330 -6.79455e+00 -3.66309e+00 0.00000e+00 0.00000e+00 3.41940e+02 208.330 1.89492e+02 208.330 0.9328 
1 1 1 -5  61  2  o 12 4.54060e+01 7.00488e-01 8.52532e+02 111.766 -4.89398e+01 1.22567e+02  0.00000e+00 0.00000e+00 8.40785e+02 111.766 1.17470e+01 291.766 0.9962 
1 1 1 -5  61  3  o 2  1.21624e+01 4.41445e-01 2.39841e+02 301.294 6.57800e+00  -1.08213e+01 0.00000e+00 0.00000e+00 1.96940e+02 301.294 4.29012e+01 121.294 0.9597 
1 1 1 -5  61  4  o 17 1.99455e+01 4.47854e-01 4.40354e+02 140.529 -3.00583e+01 2.47523e+01  0.00000e+00 0.00000e+00 2.96087e+02 140.529 1.44268e+02 320.529 0.9871 
1 1 1 -5  61  5  o 18 2.34596e+01 5.36870e-01 3.17662e+02 111.177 -1.27323e+01 3.28643e+01  0.00000e+00 0.00000e+00 5.46919e+02 111.177 2.29257e+02 111.177 0.9857 
1 1 1 -5  61  6  o 2  1.47189e+01 4.90466e-01 1.68262e+02 30.535  1.23019e+01  7.25646e+00  0.00000e+00 0.00000e+00 3.62138e+02 30.535  1.93876e+02 30.535  0.9643 
1 1 1 -5  61  7  o 12 6.82165e+00 6.17555e-01 8.76726e+01 158.394 -3.77078e+00 1.49338e+00  0.00000e+00 0.00000e+00 1.32856e+02 158.394 4.51831e+01 158.394 0.8656 
1 1 1 -5  61  8  o 13 1.26321e+01 5.02611e-01 1.72441e+02 80.870  2.92791e+00  1.82179e+01  0.00000e+00 0.00000e+00 2.86046e+02 80.870  1.13605e+02 80.870  0.9725 
1 1 1 -5  61  9  o 17 9.88083e+00 5.00208e-01 1.59679e+02 117.965 -6.83756e+00 1.28787e+01  0.00000e+00 0.00000e+00 1.95950e+02 117.965 3.62703e+01 117.965 0.9651 
1 1 1 -5  61  10 o 2  5.17981e+00 8.91949e-01 1.08158e+02 301.001 2.82179e+00  -4.69596e+00 0.00000e+00 0.00000e+00 6.62249e+01 301.001 4.19326e+01 121.002 0.9034 
1 1 1 -5  61  11 o 7  6.11342e+00 7.44696e-01 1.36264e+02 283.703 2.47868e+00  -1.01652e+01 0.00000e+00 0.00000e+00 8.01942e+01 283.703 5.60699e+01 103.703 0.9509 
1 1 1 -5  61  12 o 19 3.16562e+00 8.79038e-01 5.15498e+01 353.040 2.20019e+00  -2.68605e-01 0.00000e+00 0.00000e+00 3.44527e+01 353.040 1.70970e+01 173.040 0.7303 
1 1 1 -5  61  13 o 12 4.39852e+00 8.57671e-01 5.96104e+01 316.499 2.88440e+00  -2.73730e+00 0.00000e+00 0.00000e+00 8.13988e+01 316.499 2.17883e+01 316.499 0.8626 
1 1 1 -5  61  14 o 7  9.10008e+00 8.38423e-01 1.52855e+02 163.587 -2.31173e+01 6.80963e+00  0.00000e+00 0.00000e+00 1.77909e+02 163.587 2.50538e+01 163.587 0.9790 
1 1 1 -5  61  15 o 8  7.03480e+00 1.07007e+00 8.30332e+01 264.242 -9.23908e-01 -9.16291e+00 0.00000e+00 0.00000e+00 1.63257e+02 264.242 8.02241e+01 264.242 0.9440 
1 1 1 -5  61  16 o 13 4.98770e+00 1.40743e+00 8.34862e+01 325.103 4.84916e+00  -3.38244e+00 0.00000e+00 0.00000e+00 8.48253e+01 325.103 1.33902e+00 325.103 0.9110 
1 1 1 -5  62  1  o 3  2.08819e+01 4.72295e-01 2.88131e+02 39.226  1.61335e+01  1.31705e+01  0.00000e+00 0.00000e+00 4.74672e+02 39.226  1.86541e+02 39.226  0.9757 
1 1 1 -5  62  2  o 7  1.07992e+01 4.58487e-01 1.35423e+02 131.377 -3.80140e+00 4.31531e+00  0.00000e+00 0.00000e+00 2.31714e+02 131.377 9.62914e+01 131.377 0.9083 
1 1 1 -5  62  3  o 4  5.94218e+00 6.98633e-01 9.26566e+01 160.722 -2.18732e+00 7.65058e-01  0.00000e+00 0.00000e+00 7.26599e+01 160.722 1.99968e+01 340.722 0.7436 
1 1 1 -5  62  4  o 12 3.14290e+01 6.33420e-01 5.30441e+02 150.286 -6.58322e+01 3.75718e+01  0.00000e+00 0.00000e+00 6.37217e+02 150.286 1.06776e+02 150.286 0.9934 
1 1 1 -5  62  5  o 14 4.17737e+01 7.68022e-01 6.88491e+02 12.878  1.37967e+02  3.15428e+01  0.00000e+00 0.00000e+00 8.67567e+02 12.878  1.79076e+02 12.878  0.9965 
1 1 1 -5  62  6  o 3  8.41416e+00 5.37916e-01 2.90489e+02 216.826 -1.12787e+01 -8.44549e+00 0.00000e+00 0.00000e+00 1.25105e+01 216.826 2.77978e+02 36.826  0.9638 
1 1 1 -5  62  7  o 19 1.40822e+01 4.89809e-01 2.74780e+02 147.740 -2.46776e+01 1.55762e+01  0.00000e+00 0.00000e+00 2.41953e+02 147.740 3.28275e+01 327.740 0.9827 
1 1 1 -5  62  8  o 4  2.82181e+00 7.03587e-01 4.79821e+01 338.835 9.70921e-01  -3.75905e-01 0.00000e+00 0.00000e+00 5.36126e-01 338.835 4.74459e+01 158.835 0.4608 
1 1 1 -5  62  9  o 15 3.22241e+00 7.72776e-01 4.78486e+01 69.064  5.05464e-01  1.32120e+00  0.00000e+00 0.00000e+00 2.11577e+01 69.064  2.66909e+01 249.064 0.5743 
1 1 1 -5  62  10 o 12 4.65535e+00 7.59575e-01 1.25531e+02 109.658 -2.10805e+00 5.90110e+00  0.00000e+00 0.00000e+00 3.34058e+01 109.658 9.21248e+01 289.658 0.9163 
1 1 1 -5  62  11 o 1  1.00274e+01 5.42225e-01 2.16417e+02 71.458  9.56685e+00  2.85227e+01  0.00000e+00 0.00000e+00 1.50619e+02 71.458  6.57973e+01 251.458 0.9832 
1 1 1 -5  62  12 o 3  6.05492e+00 8.08560e-01 1.31111e+02 275.362 1.01361e+00  -1.07988e+01 0.00000e+00 0.00000e+00 8.34478e+01 275.362 4.76629e+01 95.362  0.9527 
1 1 1 -5  62  13 o 14 2.96727e+00 8.67078e-01 4.14366e+01 277.305 2.20358e-01  -1.71901e+00 0.00000e+00 0.00000e+00 3.00873e+01 277.305 1.13494e+01 97.305  0.6487 
1 1 1 -5  62  14 o 4  4.09224e+00 1.03594e+00 1.05547e+02 225.576 -4.86765e+00 -4.96647e+00 0.00000e+00 0.00000e+00 3.49656e+01 225.576 7.05816e+01 45.576  0.9250 
1 1 1 -5  62  15 o 3  5.10997e+00 1.18523e+00 4.17318e+01 325.333 2.63490e+00  -1.82223e+00 0.00000e+00 0.00000e+00 1.14392e+02 325.333 7.26598e+01 325.333 0.8240 
1 1 1 -5  62  16 o 8  3.97547e+00 1.25302e+00 7.02180e+01 176.158 -4.35787e+00 2.92680e-01  0.00000e+00 0.00000e+00 5.88087e+01 176.158 1.14093e+01 356.158 0.8763 
1 1 1 -5  63  1  o 19 1.15773e+01 4.68524e-01 2.09871e+02 91.951  -3.57686e-01 1.05025e+01  0.00000e+00 0.00000e+00 2.02337e+02 91.951  7.53380e+00 271.951 0.9512 
1 1 1 -5  63  2  o 9  3.73564e+01 6.09992e-01 8.17252e+02 313.005 8.85159e+01  -9.49035e+01 0.00000e+00 0.00000e+00 5.75311e+02 313.005 2.41942e+02 133.005 0.9961 
1 1 1 -5  63  3  o 17 2.71711e+01 5.82446e-01 5.17654e+02 129.340 -3.89987e+01 4.75787e+01  0.00000e+00 0.00000e+00 4.90491e+02 129.340 2.71626e+01 309.340 0.9918 
1 1 1 -5  63  4  o 14 2.53932e+01 5.64833e-01 4.12223e+02 41.899  3.67852e+01  3.30041e+01  0.00000e+00 0.00000e+00 5.27660e+02 41.899  1.15436e+02 41.899  0.9898 
1 1 1 -5  63  5  o 17 9.10408e+00 5.23817e-01 9.17877e+01 77.457  1.08796e+00  4.89006e+00  0.00000e+00 0.00000e+00 2.12280e+02 77.457  1.20492e+02 77.457  0.8936 
1 1 1 -5  63  6  o 2  1.66935e+01 4.99238e-01 1.83689e+02 166.590 -1.87876e+01 4.47925e+00  0.00000e+00 0.00000e+00 4.23541e+02 166.590 2.39852e+02 166.590 0.9738 
1 1 1 -5  63  7  o 4  1.27240e+01 4.80356e-01 2.24124e+02 75.836  5.28607e+00  2.09457e+01  0.00000e+00 0.00000e+00 2.39775e+02 75.836  1.56511e+01 75.836  0.9766 
1 1 1 -5  63  8  o 8  6.34305e+00 7.01426e-01 9.17639e+01 93.464  -2.98296e-01 4.92838e+00  0.00000e+00 0.00000e+00 1.19306e+02 93.464  2.75426e+01 93.464  0.8919 
1 1 1 -5  63  9  o 6  9.62744e+00 5.31712e-01 1.83649e+02 108.382 -5.47816e+00 1.64852e+01  0.00000e+00 0.00000e+00 1.64789e+02 108.382 1.88599e+01 288.382 0.9708 
1 1 1 -5  63  10 o 10 1.74213e+01 6.05752e-01 3.60203e+02 168.783 -7.00850e+01 1.38985e+01  0.00000e+00 0.00000e+00 2.84224e+02 168.783 7.59797e+01 348.783 0.9930 
1 1 1 -5  63  11 o 10 1.00777e+01 5.64775e-01 2.01157e+02 292.270 1.00998e+01  -2.46629e+01 0.00000e+00 0.00000e+00 1.66841e+02 292.270 3.43160e+01 112.270 0.9811 
1 1 1 -5  63  12 o 18 6.21966e+00 8.11632e-01 9.80997e+01 248.494 -3.40676e+00 -8.64581e+00 0.00000e+00 0.00000e+00 1.20370e+02 248.494 2.22702e+01 248.494 0.9446 
1 1 1 -5  63  13 o 9  4.97683e+00 9.97629e-01 1.08750e+02 192.848 -7.24579e+00 -1.65258e+00 0.00000e+00 0.00000e+00 6.32153e+01 192.848 4.55349e+01 12.848  0.9301 
1 1 1 -5  63  14 o 14 4.68758e+00 1.08580e+00 1.29044e+02 120.094 -4.57784e+00 7.89904e+00  0.00000e+00 0.00000e+00 3.51038e+01 120.094 9.39406e+01 300.094 0.9435 
1 1 1 -5  63  15 o 3  9.73781e+00 9.72783e-01 1.56763e+02 321.200 2.07707e+01  -1.67001e+01 0.00000e+00 0.00000e+00 1.97408e+02 321.200 4.06451e+01 321.200 0.9811 
1 1 1 -5  63  16 o 2  3.69806e+00 1.11529e+00 6.31375e+01 56.376  2.36542e+00  3.55707e+00  0.00000e+00 0.00000e+00 5.64415e+01 56.376  6.69602e+00 236.376 0.8732 
1 1 1 -5  64  1  o 17 2.20950e+01 4.73665e-01 3.41450e+02 101.456 -6.42775e+00 3.17192e+01  0.00000e+00 0.00000e+00 4.72614e+02 101.456 1.31165e+02 101.456 0.9844 
1 1 1 -5  64  2  o 6  9.83891e+00 5.21407e-01 1.35184e+02 275.034 5.13573e-01  -5.83077e+00 0.00000e+00 0.00000e+00 1.99820e+02 275.034 6.46353e+01 275.034 0.9100 
1 1 1 -5  64  3  o 8  1.69447e+01 5.19767e-01 2.07817e+02 102.452 -3.68923e+00 1.67075e+01  0.00000e+00 0.00000e+00 4.07146e+02 102.452 1.99329e+02 102.452 0.9703 
1 1 1 -5  64  4  o 15 2.05156e+01 5.26231e-01 3.23302e+02 273.827 2.24501e+00  -3.35581e+01 0.00000e+00 0.00000e+00 4.32222e+02 273.827 1.08920e+02 273.827 0.9850 
1 1 1 -5  64  5  o 17 2.69556e+00 7.59640e-01 1.06367e+02 182.412 -1.59029e+00 -6.69975e-02 0.00000e+00 0.00000e+00 4.41158e+01 2.412   1.50483e+02 2.412   0.6180 
1 1 1 -5  64  6  o 5  1.34344e+01 5.15033e-01 2.46150e+02 331.752 2.00650e+01  -1.07802e+01 0.00000e+00 0.00000e+00 2.44470e+02 331.752 1.67995e+00 151.752 0.9778 
1 1 1 -5  64  7  o 4  8.97677e+00 5.12914e-01 1.43458e+02 217.210 -8.00632e+00 -6.07933e+00 0.00000e+00 0.00000e+00 1.74485e+02 217.210 3.10265e+01 217.210 0.9489 
1 1 1 -5  64  8  o 4  2.03014e+01 5.13568e-01 4.39070e+02 99.878  -1.41336e+01 8.11668e+01  0.00000e+00 0.00000e+00 3.13603e+02 99.878  1.25467e+02 279.878 0.9939 
1 1 1 -5  64  9  o 11 1.30912e+01 5.10323e-01 2.38482e+02 226.432 -2.35345e+01 -2.47411e+01 0.00000e+00 0.00000e+00 2.42297e+02 226.432 3.81469e+00 226.432 0.9852 
1 1 1 -5  64  10 o 8  4.34843e+00 7.77523e-01 9.12223e+01 329.095 3.85855e+00  -2.30972e+00 0.00000e+00 0.00000e+00 5.13433e+01 329.095 3.98791e+01 149.095 0.8802 
1 1 1 -5  64  11 f 0  9.07675e+00 5.95043e-01 2.63674e+02 33.158  2.81489e+01  1.83909e+01  0.00000e+00 0.00000e+00 6.90518e+01 33.158  1.94622e+02 213.158 0.9850 
1 1 1 -5  64  12 o 13 2.99927e+00 8.64425e-01 1.04206e+02 127.923 -2.78392e+00 3.57315e+00  0.00000e+00 0.00000e+00 5.93930e+00 307.923 1.10146e+02 307.923 0.8812 
1 1 1 -5  64  13 o 18 5.71770e+00 1.00484e+00 9.56139e+01 109.302 -2.70044e+00 7.71021e+00  0.00000e+00 0.00000e+00 1.03312e+02 109.302 7.69848e+00 109.302 0.9366 
1 1 1 -5  64  14 o 11 5.79647e+00 1.09523e+00 7.30865e+01 173.682 -5.92127e+00 6.55595e-01  0.00000e+00 0.00000e+00 1.23009e+02 173.682 4.99224e+01 173.682 0.9117 
1 1 1 -5  64  15 o 14 1.05579e+01 1.03044e+00 1.79509e+02 68.683  1.20017e+01  3.07551e+01  0.00000e+00 0.00000e+00 2.05865e+02 68.683  2.63557e+01 68.683  0.9847 
1 1 1 -5  64  16 o 1  6.12500e+00 1.10021e+00 1.47522e+02 198.339 -1.58562e+01 -5.25595e+00 0.00000e+00 0.00000e+00 7.23541e+01 198.339 7.51682e+01 18.339  0.9696 
1 1 1 -5  65  1  o 12 9.52214e+00 5.37692e-01 1.59666e+02 69.297  2.47245e+00  6.54222e+00  0.00000e+00 0.00000e+00 1.70094e+02 69.297  1.04282e+01 69.297  0.9255 
1 1 1 -5  65  2  o 12 1.04685e+01 5.48458e-01 1.54995e+02 232.957 -4.73833e+00 -6.27822e+00 0.00000e+00 0.00000e+00 2.10808e+02 232.957 5.58129e+01 232.957 0.9341 
1 1 1 -5  65  3  o 16 2.73191e+01 5.88146e-01 4.59654e+02 304.433 3.33414e+01  -4.86335e+01 0.00000e+00 0.00000e+00 5.53265e+02 304.433 9.36104e+01 304.433 0.9915 
1 1 1 -5  65  4  o 13 8.13873e+00 5.96177e-01 1.30234e+02 329.048 5.40290e+00  -3.24022e+00 0.00000e+00 0.00000e+00 1.48677e+02 329.048 1.84430e+01 329.048 0.9168 
1 1 1 -5  65  5  o 2  1.08648e+01 5.12273e-01 1.05986e+02 185.824 -7.06449e+00 -7.20624e-01 0.00000e+00 0.00000e+00 2.70172e+02 185.824 1.64187e+02 185.824 0.9266 
1 1 1 -5  65  6  o 19 1.41347e+01 5.31329e-01 3.21232e+02 29.176  2.97353e+01  1.66023e+01  0.00000e+00 0.00000e+00 1.98783e+02 29.176  1.22449e+02 209.176 0.9852 
1 1 1 -5  65  7  o 6  2.24322e+01 5.23983e-01 4.57443e+02 124.617 -4.90882e+01 7.11109e+01  0.00000e+00 0.00000e+00 3.74867e+02 124.617 8.25765e+01 304.617 0.9942 
1 1 1 -5  65  8  o 2  1.18409e+01 4.94186e-01 2.71524e+02 340.615 2.80690e+01  -9.87613e+00 0.00000e+00 0.00000e+00 1.62603e+02 340.615 1.08921e+02 160.615 0.9831 
1 1 1 -5  65  9  o 9  4.59198e+00 7.72705e-01 1.13704e+02 122.044 -2.91180e+00 4.65185e+00  0.00000e+00 0.00000e+00 4.09330e+01 122.044 7.27712e+01 302.044 0.9036 
1 1 1 -5  65  10 f 0  1.30741e+01 4.86908e-01 3.38650e+02 154.212 -5.43220e+01 2.62462e+01  0.00000e+00 0.00000e+00 1.44169e+02 154.212 1.94481e+02 334.212 0.9917 
1 1 1 -5  65  11 o 3  2.73939e+00 7.97723e-01 5.24707e+01 143.971 -1.57429e+00 1.14502e+00  0.00000e+00 0.00000e+00 1.77383e+01 143.971 3.47325e+01 323.971 0.6888 
1 1 1 -5  65  12 o 11 8.81442e+00 6.73917e-01 1.51965e+02 204.864 -1.90847e+01 -8.84416e+00 0.00000e+00 0.00000e+00 1.67819e+02 204.864 1.58533e+01 204.864 0.9759 
1 1 1 -5  65  13 o 12 7.82970e+00 8.43092e-01 1.60553e+02 139.245 -1.57656e+01 1.35868e+01  0.00000e+00 0.00000e+00 1.23156e+02 139.245 3.73971e+01 319.245 0.9757 
1 1 1 -5  65  14 o 16 4.05898e+00 9.53069e-01 8.48206e+01 169.648 -5.53571e+00 1.01121e+00  0.00000e+00 0.00000e+00 5.16361e+01 169.648 3.31845e+01 349.648 0.9061 
1 1 1 -5  65  15 o 4  6.06732e+00 1.28505e+00 3.80098e+01 33.924  2.84425e+00  1.91298e+00  0.00000e+00 0.00000e+00 1.50248e+02 33.924  1.12238e+02 33.924  0.8372 
1 1 1 -5  65  16 o 12 4.37897e+00 1.19444e+00 4.51705e+01 175.893 -3.64709e+00 2.61870e-01  0.00000e+00 0.00000e+00 9.24314e+01 175.893 4.72609e+01 175.893 0.8489 
1 1 1 -5  66  1  o 3  1.70050e+01 5.24865e-01 2.30109e+02 228.303 -1.23587e+01 -1.38727e+01 0.00000e+00 0.00000e+00 3.88740e+02 228.303 1.58631e+02 228.303 0.9727 
1 1 1 -5  66  2  o 19 1.84618e+01 5.40374e-01 3.25403e+02 277.114 3.51178e+00  -2.81389e+01 0.00000e+00 0.00000e+00 3.52826e+02 277.114 2.74230e+01 277.114 0.9822 
1 1 1 -5  66  3  o 9  7.35694e+00 6.01743e-01 1.11884e+02 129.963 -2.85627e+00 3.40849e+00  0.00000e+00 0.00000e+00 1.29834e+02 129.963 1.79508e+01 129.963 0.8788 
1 1 1 -5  66  4  o 4  7.96698e+00 6.05210e-01 1.69795e+02 195.374 -7.40508e+00 -2.03615e+00 0.00000e+00 0.00000e+00 1.07836e+02 195.374 6.19591e+01 15.374  0.9324 
1 1 1 -5  66  5  o 8  1.30091e+01 4.40006e-01 2.08341e+02 41.673  1.28013e+01  1.13947e+01  0.00000e+00 0.00000e+00 2.63225e+02 41.673  5.48838e+01 41.673  0.9704 
1 1 1 -5  66  6  o 6  1.03585e+01 4.89766e-01 1.98300e+02 186.189 -1.54521e+01 -1.67576e+00 0.00000e+00 0.00000e+00 1.75785e+02 186.189 2.25149e+01 6.189   0.9673 
1 1 1 -5  66  7  o 6  1.62373e+01 4.81711e-01 3.94974e+02 326.099 4.64938e+01  -3.12436e+01 0.00000e+00 0.00000e+00 2.05463e+02 326.099 1.89511e+02 146.099 0.9910 
1 1 1 -5  66  8  o 14 5.51783e+00 6.65935e-01 8.79881e+01 312.828 3.11040e+00  -3.35560e+00 0.00000e+00 0.00000e+00 9.35900e+01 312.828 5.60194e+00 312.828 0.8825 
1 1 1 -5  66  9  o 5  2.43978e+01 5.10472e-01 3.32318e+02 105.158 -2.29311e+01 8.46481e+01  0.00000e+00 0.00000e+00 5.71591e+02 105.158 2.39272e+02 105.158 0.9943 
1 1 1 -5  66  10 o 8  4.48562e+00 8.07128e-01 9.41312e+01 247.461 -1.98814e+00 -4.79047e+00 0.00000e+00 0.00000e+00 5.57683e+01 247.461 3.83629e+01 67.461  0.8975 
1 1 1 -5  66  11 o 16 5.73838e+00 7.39149e-01 3.29132e+01 320.236 1.97685e+00  -1.64496e+00 0.00000e+00 0.00000e+00 1.32014e+02 320.236 9.91005e+01 320.236 0.7726 
1 1 1 -5  66  12 o 19 8.83755e+00 6.73100e-01 1.77996e+02 75.996  6.00296e+00  2.40700e+01  0.00000e+00 0.00000e+00 1.43786e+02 75.996  3.42100e+01 255.996 0.9796 
1 1 1 -5  66  13 o 19 3.69523e+00 1.00962e+00 9.70037e+01 13.937  5.23511e+00  1.29910e+00  0.00000e+00 0.00000e+00 2.67303e+01 13.937  7.02734e+01 193.936 0.9018 
1 1 1 -5  66  14 o 5  7.73984e+00 1.01294e+00 1.13376e+02 26.785  1.29719e+01  6.54833e+00  0.00000e+00 0.00000e+00 1.63662e+02 26.785  5.02857e+01 26.785  0.9650 
1 1 1 -5  66  15 o 3  7.23211e+00 1.08956e+00 1.03908e+02 49.259  8.35041e+00  9.69404e+00  0.00000e+00 0.00000e+00 1.53371e+02 49.259  4.94629e+01 49.259  0.9601 
1 1 1 -5  66  16 o 16 5.41951e+00 1.31675e+00 1.29672e+02 289.567 4.04050e+00  -1.13676e+01 0.00000e+00 0.00000e+00 6.24070e+01 289.567 6.72650e+01 109.567 0.9576 
1 1 1 -5  67  1  o 19 3.21757e+01 6.52365e-01 6.52984e+02 323.157 8.42011e+01  -6.30884e+01 0.00000e+00 0.00000e+00 5.44861e+02 323.157 1.08123e+02 143.157 0.9952 
1 1 1 -5  67  2  o 18 1.47189e+01 5.17142e-01 2.92239e+02 23.966  2.14480e+01  9.53405e+00  0.00000e+00 0.00000e+00 2.46326e+02 23.966  4.59131e+01 203.966 0.9785 
1 1 1 -5  67  3  f 0  2.06357e+01 5.29952e-01 3.53576e+02 310.910 2.74796e+01  -3.17118e+01 0.00000e+00 0.00000e+00 4.08584e+02 310.910 5.50073e+01 310.910 0.9880 
1 1 1 -5  67  4  o 17 1.87466e+01 4.53661e-01 3.22328e+02 244.390 -1.62138e+01 -3.38261e+01 0.00000e+00 0.00000e+00 3.68769e+02 244.390 4.64410e+01 244.390 0.9866 
1 1 1 -5  67  5  o 4  4.77687e+00 7.05978e-01 2.62958e+01 152.712 -7.71123e-01 3.97804e-01  0.00000e+00 0.00000e+00 4.46316e+01 152.712 1.83358e+01 152.712 0.3976 
1 1 1 -5  67  6  o 4  5.69947e+00 6.32990e-01 8.64198e+01 325.277 3.09803e+00  -2.14697e+00 0.00000e+00 0.00000e+00 9.52777e+01 325.277 8.85789e+00 325.277 0.8540 
1 1 1 -5  67  7  o 14 5.47552e+00 7.33124e-01 9.41426e+01 237.449 -2.45451e+00 -3.84528e+00 0.00000e+00 0.00000e+00 8.60507e+01 237.449 8.09189e+00 57.449  0.8821 
1 1 1 -5  67  8  o 18 6.53467e+00 5.89765e-01 1.22360e+02 186.485 -7.71318e+00 -8.76767e-01 0.00000e+00 0.00000e+00 1.04984e+02 186.485 1.73765e+01 6.485   0.9332 
1 1 1 -5  67  9  o 4  8.46734e+00 5.21438e-01 1.52541e+02 116.614 -6.18005e+00 1.23336e+01  0.00000e+00 0.00000e+00 1.51253e+02 116.614 1.28842e+00 296.614 0.9630 
1 1 1 -5  67  10 o 3  6.44502e+00 6.64533e-01 1.29172e+02 231.482 -6.92341e+00 -8.69838e+00 0.00000e+00 0.00000e+00 9.96911e+01 231.482 2.94807e+01 51.482  0.9539 
1 1 1 -5  67  11 o 2  9.52885e+00 5.87122e-01 1.79014e+02 76.897  5.88156e+00  2.52684e+01  0.00000e+00 0.00000e+00 1.68509e+02 76.897  1.05050e+01 256.897 0.9805 
1 1 1 -5  67  12 o 4  9.08379e+00 6.63353e-01 1.51881e+02 328.585 1.94796e+01  -1.18972e+01 0.00000e+00 0.00000e+00 1.78202e+02 328.585 2.63207e+01 328.585 0.9778 
1 1 1 -5  67  13 o 7  5.03287e+00 1.05034e+00 1.07001e+02 151.387 -6.74229e+00 3.67796e+00  0.00000e+00 0.00000e+00 6.72180e+01 151.387 3.97829e+01 331.387 0.9324 
1 1 1 -5  67  14 o 18 4.30022e+00 1.14640e+00 1.26155e+02 258.489 -1.60351e+00 -7.87380e+00 0.00000e+00 0.00000e+00 2.30463e+01 258.489 1.03108e+02 78.489  0.9355 
1 1 1 -5  67  15 o 15 4.16744e+00 1.17647e+00 8.55074e+01 77.811  1.19646e+00  5.53910e+00  0.00000e+00 0.00000e+00 5.45009e+01 77.811  3.10065e+01 257.811 0.9069 
1 1 1 -5  67  16 o 3  4.36001e+00 1.22663e+00 7.11985e+01 120.456 -2.72899e+00 4.64108e+00  0.00000e+00 0.00000e+00 7.42619e+01 120.456 3.06343e+00 120.456 0.9016 
1 1 1 -5  68  1  f 0  2.30267e+01 5.58912e-01 3.82295e+02 303.484 2.90339e+01  -4.38925e+01 0.00000e+00 0.00000e+00 4.70671e+02 303.484 8.83759e+01 303.484 0.9905 
1 1 1 -5  68  2  o 1  2.06054e+01 5.56732e-01 3.53955e+02 76.377  9.85085e+00  4.06478e+01  0.00000e+00 0.00000e+00 4.07185e+02 76.377  5.32293e+01 76.377  0.9880 
1 1 1 -5  68  3  o 6  1.26881e+01 5.09635e-01 1.72525e+02 228.126 -8.45634e+00 -9.43348e+00 0.00000e+00 0.00000e+00 2.82577e+02 228.126 1.10052e+02 228.126 0.9597 
1 1 1 -5  68  4  o 8  3.70266e+01 7.00151e-01 7.12574e+02 191.243 -1.73755e+02 -3.45396e+01 0.00000e+00 0.00000e+00 6.66824e+02 191.243 4.57492e+01 11.243  0.9972 
1 1 1 -5  68  5  o 5  5.66561e+00 6.29882e-01 8.10687e+01 104.092 -8.29617e-01 3.30478e+00  0.00000e+00 0.00000e+00 9.58235e+01 104.092 1.47549e+01 104.092 0.8361 
1 1 1 -5  68  6  o 6  2.90484e+00 7.36959e-01 9.92308e+01 204.350 -2.01132e+00 -9.10277e-01 0.00000e+00 0.00000e+00 2.01860e+01 24.350  1.19417e+02 24.350  0.7291 
1 1 1 -5  68  7  o 12 1.36329e+01 4.74728e-01 2.81245e+02 252.608 -1.06471e+01 -3.39917e+01 0.00000e+00 0.00000e+00 2.20068e+02 252.608 6.11772e+01 72.608  0.9859 
1 1 1 -5  68  8  o 2  6.46059e+00 5.97777e-01 1.29036e+02 126.890 -5.28063e+00 7.03570e+00  0.00000e+00 0.00000e+00 9.76510e+01 126.890 3.13849e+01 306.890 0.9413 
1 1 1 -5  68  9  o 9  3.15944e+00 7.56804e-01 7.26822e+01 48.531  1.73842e+00  1.96710e+00  0.00000e+00 0.00000e+00 1.88701e+01 48.531  5.38121e+01 228.531 0.7780 
1 1 1 -5  68  10 o 4  1.33973e+01 5.05064e-01 2.13754e+02 171.442 -3.78073e+01 5.68946e+00  0.00000e+00 0.00000e+00 2.78315e+02 171.442 6.45610e+01 171.442 0.9868 
1 1 1 -5  68  11 o 12 3.36648e+00 8.76679e-01 4.76076e+01 2.158   2.09132e+00  7.88134e-02  0.00000e+00 0.00000e+00 4.15837e+01 2.158   6.02381e+00 182.158 0.7124 
1 1 1 -5  68  12 o 4  4.36913e+00 9.81993e-01 3.71621e+01 161.284 -2.05284e+00 6.95488e-01  0.00000e+00 0.00000e+00 8.02750e+01 161.284 4.31128e+01 161.284 0.7234 
1 1 1 -5  68  13 o 2  8.35853e+00 8.97741e-01 1.05381e+02 194.508 -1.49356e+01 -3.86485e+00 0.00000e+00 0.00000e+00 1.94643e+02 194.508 8.92613e+01 194.508 0.9670 
1 1 1 -5  68  14 o 8  5.43713e+00 1.21381e+00 8.58281e+01 174.824 -6.68489e+00 6.05581e-01  0.00000e+00 0.00000e+00 1.00090e+02 174.824 1.42622e+01 174.824 0.9222 
1 1 1 -5  68  15 o 10 4.83093e+00 1.25566e+00 7.06241e+01 328.365 4.59383e+00  -2.83004e+00 0.00000e+00 0.00000e+00 9.07436e+01 328.365 2.01196e+01 328.365 0.9018 
1 1 1 -5  68  16 o 6  5.35156e+00 1.16501e+00 8.07331e+01 148.334 -7.11311e+00 4.38725e+00  0.00000e+00 0.00000e+00 1.05007e+02 148.334 2.42736e+01 148.334 0.9381 
1 1 1 -5  69  1  o 1  8.38548e+00 6.03756e-01 2.21461e+02 186.530 -1.04842e+01 -1.20018e+00 0.00000e+00 0.00000e+00 7.68448e+01 186.530 1.44616e+02 6.530   0.9514 
1 1 1 -5  69  2  o 7  1.73027e+01 5.31571e-01 3.03170e+02 140.183 -2.32648e+01 1.93950e+01  0.00000e+00 0.00000e+00 3.32863e+02 140.183 2.96930e+01 140.183 0.9834 
1 1 1 -5  69  3  o 18 1.55058e+01 5.28585e-01 3.04370e+02 295.836 1.29123e+01  -2.66677e+01 0.00000e+00 0.00000e+00 2.65192e+02 295.836 3.91780e+01 115.836 0.9830 
1 1 1 -5  69  4  f 0  1.02580e+01 5.14408e-01 2.49633e+02 132.971 -1.24294e+01 1.33423e+01  0.00000e+00 0.00000e+00 1.22874e+02 132.971 1.26759e+02 312.971 0.9722 
1 1 1 -5  69  5  o 11 4.57959e+00 7.13777e-01 9.56280e+01 303.613 1.73145e+00  -2.60472e+00 0.00000e+00 0.00000e+00 4.44036e+01 303.613 5.12245e+01 123.613 0.8190 
1 1 1 -5  69  6  o 18 1.12845e+01 4.80186e-01 2.40179e+02 14.360  2.29258e+01  5.86924e+00  0.00000e+00 0.00000e+00 1.71905e+02 14.360  6.82744e+01 194.360 0.9786 
1 1 1 -5  69  7  o 10 4.24651e+00 6.96947e-01 1.43205e+02 32.565  4.80286e+00  3.06744e+00  0.00000e+00 0.00000e+00 4.95470e-01 32.565  1.42709e+02 212.565 0.9074 
1 1 1 -5  69  8  o 8  1.13829e+01 4.70109e-01 1.78948e+02 185.283 -2.30020e+01 -2.12714e+00 0.00000e+00 0.00000e+00 2.35982e+02 185.283 5.70344e+01 185.283 0.9781 
1 1 1 -5  69  9  o 1  2.31364e+00 6.99888e-01 4.88975e+01 247.900 -5.21544e-01 -1.28442e+00 0.00000e+00 0.00000e+00 6.60235e-02 67.900  4.89635e+01 67.900  0.5667 
1 1 1 -5  69  10 o 14 1.15546e+01 5.32151e-01 1.79328e+02 260.966 -4.65527e+00 -2.92794e+01 0.00000e+00 0.00000e+00 2.43327e+02 260.966 6.39987e+01 260.966 0.9830 
1 1 1 -5  69  11 o 15 7.41284e+00 6.78348e-01 9.69309e+01 105.627 -3.04290e+00 1.08783e+01  0.00000e+00 0.00000e+00 1.66186e+02 105.627 6.92547e+01 105.627 0.9547 
1 1 1 -5  69  12 o 16 7.03364e+00 8.57532e-01 9.48704e+01 335.013 8.88938e+00  -4.14272e+00 0.00000e+00 0.00000e+00 1.52707e+02 335.013 5.78363e+01 335.013 0.9476 
1 1 1 -5  69  13 o 10 4.25079e+00 1.02878e+00 6.08463e+01 120.009 -1.98049e+00 3.42906e+00  0.00000e+00 0.00000e+00 7.51299e+01 120.009 1.42836e+01 120.009 0.8620 
1 1 1 -5  69  14 o 10 4.33048e+00 1.15557e+00 9.97095e+01 322.778 5.26490e+00  -3.99940e+00 0.00000e+00 0.00000e+00 4.81394e+01 322.778 5.15701e+01 142.778 0.9209 
1 1 1 -5  69  15 o 10 5.92321e+00 1.20864e+00 1.14456e+02 178.163 -1.09585e+01 3.51398e-01  0.00000e+00 0.00000e+00 9.46417e+01 178.163 1.98142e+01 358.163 0.9532 
1 1 1 -5  69  16 o 1  4.71867e+00 1.29914e+00 3.02659e+01 346.671 2.43114e+00  -5.76017e-01 0.00000e+00 0.00000e+00 1.03231e+02 346.671 7.29651e+01 346.671 0.7648 
1 1 1 -5  70  1  o 2  1.82275e+01 5.37894e-01 3.12200e+02 61.794  1.65438e+01  3.08457e+01  0.00000e+00 0.00000e+00 3.59435e+02 61.794  4.72357e+01 61.794  0.9856 
1 1 1 -5  70  2  o 12 1.18842e+01 5.58869e-01 1.58886e+02 214.520 -9.73012e+00 -6.69222e+00 0.00000e+00 0.00000e+00 2.66035e+02 214.520 1.07149e+02 214.520 0.9567 
1 1 1 -5  70  3  o 3  1.29400e+01 4.69214e-01 2.19939e+02 202.320 -1.82350e+01 -7.48610e+00 0.00000e+00 0.00000e+00 2.51087e+02 202.320 3.11479e+01 202.320 0.9743 
1 1 1 -5  70  4  o 9  2.46513e+01 5.89782e-01 3.95882e+02 205.168 -6.59489e+01 -3.09890e+01 0.00000e+00 0.00000e+00 5.18399e+02 205.168 1.22517e+02 205.168 0.9931 
1 1 1 -5  70  5  o 4  7.62690e+00 5.64420e-01 9.14233e+01 61.813  2.76063e+00  5.15126e+00  0.00000e+00 0.00000e+00 1.67613e+02 61.813  7.61901e+01 61.813  0.9099 
1 1 1 -5  70  6  o 8  1.12042e+01 4.61034e-01 1.95856e+02 305.570 1.19264e+01  -1.66772e+01 0.00000e+00 0.00000e+00 2.11825e+02 305.570 1.59693e+01 305.570 0.9753 
1 1 1 -5  70  7  o 10 6.36040e+00 5.48163e-01 5.44763e+01 145.848 -2.80421e+00 1.90232e+00  0.00000e+00 0.00000e+00 1.43560e+02 145.848 8.90835e+01 145.848 0.8351 
1 1 1 -5  70  8  o 14 1.60191e+01 4.65705e-01 3.12539e+02 122.029 -3.07197e+01 4.91069e+01  0.00000e+00 0.00000e+00 2.79171e+02 122.029 3.33679e+01 302.029 0.9913 
1 1 1 -5  70  9  o 19 1.62043e+01 4.87687e-01 2.52239e+02 35.097  4.54051e+01  3.19081e+01  0.00000e+00 0.00000e+00 3.45651e+02 35.097  9.34118e+01 35.097  0.9909 
1 1 1 -5  70  10 o 3  2.79760e+00 8.01651e-01 9.55392e+01 334.642 3.10612e+00  -1.47211e+00 0.00000e+00 0.00000e+00 8.34125e+00 154.642 1.03880e+02 154.642 0.8378 
1 1 1 -5  70  11 o 1  4.80376e+00 8.51468e-01 5.95970e+01 358.314 4.19357e+00  -1.23410e-01 0.00000e+00 0.00000e+00 9.58749e+01 358.314 3.62779e+01 358.314 0.8706 
1 1 1 -5  70  12 o 4  5.13034e+00 9.62068e-01 1.68959e+02 105.942 -3.43873e+00 1.20385e+01  0.00000e+00 0.00000e+00 1.38064e+01 105.942 1.55152e+02 285.942 0.9592 
1 1 1 -5  70  13 o 14 5.84517e+00 1.07754e+00 1.05353e+02 180.318 -8.75408e+00 -4.86609e-02 0.00000e+00 0.00000e+00 9.87355e+01 180.318 6.61782e+00 0.318   0.9410 
1 1 1 -5  70  14 o 15 5.87773e+00 1.22769e+00 7.45930e+01 46.846  4.59755e+00  4.90379e+00  0.00000e+00 0.00000e+00 1.26341e+02 46.846  5.17481e+01 46.846  0.9223 
1 1 1 -5  70  15 o 6  3.42709e+00 1.08927e+00 7.30167e+01 161.399 -4.20840e+00 1.41637e+00  0.00000e+00 0.00000e+00 3.84633e+01 161.399 3.45534e+01 341.399 0.8786 
1 1 1 -5  70  16 o 4  4.10114e+00 1.18998e+00 8.54453e+01 196.808 -6.36283e+00 -1.92201e+00 0.00000e+00 0.00000e+00 5.43013e+01 196.808 3.11440e+01 16.808  0.9214 
1 1 1 -5  71  1  o 6  2.51870e+01 5.60029e-01 4.20675e+02 30.737  6.25428e+01  3.71896e+01  0.00000e+00 0.00000e+00 5.14276e+02 30.737  9.36011e+01 30.737  0.9931 
1 1 1 -5  71  2  o 1  9.98423e+00 5.05049e-01 1.74361e+02 143.985 -9.70847e+00 7.05754e+00  0.00000e+00 0.00000e+00 1.82825e+02 143.985 8.46436e+00 143.985 0.9574 
1 1 1 -5  71  3  o 7  1.78295e+01 4.89177e-01 2.30153e+02 184.129 -3.08591e+01 -2.22769e+00 0.00000e+00 0.00000e+00 4.24998e+02 184.129 1.94846e+02 184.129 0.9837 
1 1 1 -5  71  4  o 7  8.71046e+00 5.52302e-01 1.50921e+02 151.935 -8.51105e+00 4.53782e+00  0.00000e+00 0.00000e+00 1.56962e+02 151.935 6.04126e+00 151.935 0.9466 
1 1 1 -5  71  5  o 19 5.04174e+00 6.72921e-01 8.10465e+01 169.449 -3.39178e+00 6.31775e-01  0.00000e+00 0.00000e+00 7.67182e+01 169.449 4.32826e+00 349.449 0.8385 
1 1 1 -5  71  6  o 3  9.11365e+00 4.80625e-01 1.68876e+02 316.632 1.03756e+01  -9.80072e+00 0.00000e+00 0.00000e+00 1.58934e+02 316.632 9.94206e+00 136.632 0.9643 
1 1 1 -5  71  7  o 3  1.04895e+01 4.66457e-01 1.80012e+02 174.236 -2.07497e+01 2.09437e+00  0.00000e+00 0.00000e+00 2.01523e+02 174.236 2.15109e+01 174.236 0.9757 
1 1 1 -5  71  8  o 18 2.12437e+01 4.87764e-01 3.59882e+02 323.180 6.57268e+01  -4.92047e+01 0.00000e+00 0.00000e+00 4.26690e+02 323.180 6.68080e+01 323.180 0.9939 
1 1 1 -5  71  9  o 12 3.96184e+00 7.95301e-01 4.05453e+01 45.617  1.43345e+00  1.46465e+00  0.00000e+00 0.00000e+00 6.35391e+01 45.617  2.29938e+01 45.617  0.7057 
1 1 1 -5  71  10 f 0  4.97381e+00 8.43650e-01 1.13246e+02 279.163 1.17107e+00  -7.25983e+00 0.00000e+00 0.00000e+00 5.86848e+01 279.163 5.45611e+01 99.163  0.9293 
1 1 1 -5  71  11 o 2  6.06482e+00 7.88858e-01 1.44700e+02 53.386  7.86831e+00  1.05891e+01  0.00000e+00 0.00000e+00 7.19887e+01 53.386  7.27111e+01 233.386 0.9613 
1 1 1 -5  71  12 o 2  5.84605e+00 9.01165e-01 1.07184e+02 228.059 -6.71772e+00 -7.47638e+00 0.00000e+00 0.00000e+00 9.87968e+01 228.059 8.38717e+00 48.059  0.9489 
1 1 1 -5  71  13 o 11 8.15982e+00 9.11605e-01 1.08642e+02 357.769 1.50256e+01  -5.85388e-01 0.00000e+00 0.00000e+00 1.83818e+02 357.769 7.51758e+01 357.769 0.9662 
1 1 1 -5  71  14 o 4  5.71470e+00 1.21626e+00 1.40557e+02 220.127 -9.41872e+00 -7.93902e+00 0.00000e+00 0.00000e+00 6.24369e+01 220.127 7.81197e+01 40.127  0.9585 
1 1 1 -5  71  15 o 2  7.37796e+00 1.20765e+00 1.17273e+02 101.387 -2.91204e+00 1.44589e+01  0.00000e+00 0.00000e+00 1.46421e+02 101.387 2.91480e+01 101.387 0.9655 
1 1 1 -5  71  16 o 12 3.01668e+00 1.01393e+00 3.90113e+01 238.933 -1.36647e+00 -2.26820e+00 0.00000e+00 0.00000e+00 4.80142e+01 238.933 9.00292e+00 238.933 0.7802 
1 1 1 -5  72  1  o 12 4.28428e+00 7.30519e-01 1.61684e+02 307.740 2.91467e+00  -3.76576e+00 0.00000e+00 0.00000e+00 1.95802e+01 127.740 1.81264e+02 127.740 0.8876 
1 1 1 -5  72  2  o 1  1.84707e+01 5.01933e-01 2.82366e+02 201.680 -3.64718e+01 -1.44995e+01 0.00000e+00 0.00000e+00 3.98849e+02 201.680 1.16483e+02 201.680 0.9872 
1 1 1 -5  72  3  o 14 2.68021e+01 5.69561e-01 5.21251e+02 145.154 -8.41403e+01 5.85801e+01  0.00000e+00 0.00000e+00 4.74823e+02 145.154 4.64283e+01 325.154 0.9951 
1 1 1 -5  72  4  o 7  2.78553e+01 6.32702e-01 4.08622e+02 318.325 7.02960e+01  -6.25771e+01 0.00000e+00 0.00000e+00 6.25708e+02 318.325 2.17086e+02 318.325 0.9947 
1 1 1 -5  72  5  f 0  1.85464e+01 4.52975e-01 2.66233e+02 358.724 4.37956e+01  -9.75567e-01 0.00000e+00 0.00000e+00 4.17849e+02 358.724 1.51616e+02 358.724 0.9885 
1 1 1 -5  72  6  o 3  2.37058e+01 4.87322e-01 4.19625e+02 192.764 -9.49309e+01 -2.15050e+01 0.00000e+00 0.00000e+00 4.59890e+02 192.764 4.02659e+01 192.764 0.9948 
1 1 1 -5  72  7  o 7  4.99486e+00 6.87454e-01 9.19414e+01 180.922 -4.94884e+00 -7.96368e-02 0.00000e+00 0.00000e+00 7.41530e+01 180.922 1.77885e+01 0.922   0.8922 
1 1 1 -5  72  8  o 15 2.14274e+01 4.96777e-01 3.58073e+02 11.878  9.21066e+01  1.93724e+01  0.00000e+00 0.00000e+00 4.35770e+02 11.878  7.76970e+01 11.878  0.9947 
1 1 1 -5  72  9  o 2  1.85754e+01 5.01987e-01 3.52400e+02 107.400 -2.61700e+01 8.35083e+01  0.00000e+00 0.00000e+00 3.35005e+02 107.400 1.73944e+01 287.400 0.9943 
1 1 1 -5  72  10 o 11 1.42688e+01 5.25354e-01 2.16244e+02 267.824 -1.77118e+00 -4.66074e+01 0.00000e+00 0.00000e+00 3.08699e+02 267.824 9.24552e+01 267.824 0.9892 
1 1 1 -5  72  11 o 15 8.17515e+00 6.69381e-01 1.67873e+02 105.463 -6.04029e+00 2.18350e+01  0.00000e+00 0.00000e+00 1.29127e+02 105.463 3.87461e+01 285.463 0.9777 
1 1 1 -5  72  12 o 1  7.13594e+00 8.47962e-01 6.96590e+01 297.381 3.83867e+00  -7.41145e+00 0.00000e+00 0.00000e+00 1.78849e+02 297.381 1.09190e+02 297.381 0.9380 
1 1 1 -5  72  13 o 11 5.02677e+00 1.00044e+00 8.39346e+01 180.876 -7.04100e+00 -1.07696e-01 0.00000e+00 0.00000e+00 8.87093e+01 180.876 4.77465e+00 180.876 0.9260 
1 1 1 -5  72  14 o 7  8.12995e+00 1.06875e+00 9.87727e+01 119.325 -7.10546e+00 1.26488e+01  0.00000e+00 0.00000e+00 1.91881e+02 119.325 9.31081e+01 119.325 0.9649 
1 1 1 -5  72  15 o 7  4.74046e+00 1.29338e+00 5.69284e+01 179.562 -4.60126e+00 3.51684e-02  0.00000e+00 0.00000e+00 9.80362e+01 179.562 4.11079e+01 179.562 0.8832 
1 1 1 -5  72  16 o 14 8.38500e+00 1.27962e+00 1.15795e+02 90.489  -1.58389e-01 1.85712e+01  0.00000e+00 0.00000e+00 1.85725e+02 90.489  6.99297e+01 90.489  0.9727 
1 1 1 -5  73  1  o 4  2.18996e+01 5.32339e-01 3.65913e+02 70.991  1.96607e+01  5.70713e+01  0.00000e+00 0.00000e+00 4.45526e+02 70.991  7.96131e+01 70.991  0.9917 
1 1 1 -5  73  2  o 18 1.76001e+01 4.96197e-01 2.55608e+02 21.050  3.11372e+01  1.19836e+01  0.00000e+00 0.00000e+00 3.91871e+02 21.050  1.36263e+02 21.050  0.9849 
1 1 1 -5  73  3  o 12 2.54807e+01 5.59702e-01 4.76135e+02 57.591  5.46531e+01  8.60892e+01  0.00000e+00 0.00000e+00 4.70616e+02 57.591  5.51929e+00 237.591 0.9951 
1 1 1 -5  73  4  o 15 9.64434e+00 4.92192e-01 2.09105e+02 5.793   1.75058e+01  1.77599e+00  0.00000e+00 0.00000e+00 1.40474e+02 5.793   6.86315e+01 185.793 0.9712 
1 1 1 -5  73  5  o 12 1.44070e+01 4.39643e-01 1.64793e+02 119.897 -1.10614e+01 1.92390e+01  0.00000e+00 0.00000e+00 3.60419e+02 119.897 1.95626e+02 119.897 0.9772 
1 1 1 -5  73  6  o 3  1.17215e+01 4.54866e-01 2.15424e+02 159.349 -2.35464e+01 8.87424e+00  0.00000e+00 0.00000e+00 2.12847e+02 159.349 2.57626e+00 339.349 0.9799 
1 1 1 -5  73  7  f 0  6.05195e+00 6.01430e-01 2.12199e+02 273.353 7.96299e-01  -1.35900e+01 0.00000e+00 0.00000e+00 4.87047e+00 273.353 2.07328e+02 93.353  0.9625 
1 1 1 -5  73  8  o 7  1.00597e+01 4.97823e-01 1.44814e+02 262.460 -2.59721e+00 -1.96223e+01 0.00000e+00 0.00000e+00 2.20210e+02 262.460 7.53960e+01 262.460 0.9744 
1 1 1 -5  73  9  o 3  3.30586e+00 8.07556e-01 1.12168e+02 329.445 4.16117e+00  -2.45653e+00 0.00000e+00 0.00000e+00 2.76312e+00 149.445 1.14931e+02 149.445 0.8893 
1 1 1 -5  73  10 o 12 8.27606e+00 6.30517e-01 2.14280e+02 351.254 2.88222e+01  -4.43397e+00 0.00000e+00 0.00000e+00 8.81256e+01 351.254 1.26155e+02 171.254 0.9827 
1 1 1 -5  73  11 o 6  4.09151e+00 8.26546e-01 6.83614e+01 111.580 -1.47623e+00 3.73237e+00  0.00000e+00 0.00000e+00 6.29795e+01 111.580 5.38183e+00 291.580 0.8640 
1 1 1 -5  73  12 o 4  2.77986e+00 8.60944e-01 6.22784e+01 106.878 -8.60133e-01 2.83488e+00  0.00000e+00 0.00000e+00 2.10083e+01 106.878 4.12700e+01 286.878 0.8072 
1 1 1 -5  73  13 o 1  6.11163e+00 1.02433e+00 7.21711e+01 357.739 7.03947e+00  -2.77898e-01 0.00000e+00 0.00000e+00 1.37698e+02 357.739 6.55272e+01 357.739 0.9260 
1 1 1 -5  73  14 o 10 3.97618e+00 1.13307e+00 4.09949e+01 89.337  3.09494e-02  2.67421e+00  0.00000e+00 0.00000e+00 7.42933e+01 89.337  3.32984e+01 89.337  0.7827 
1 1 1 -5  73  15 o 12 3.82686e+00 1.09687e+00 4.97687e+01 73.764  1.09933e+00  3.77496e+00  0.00000e+00 0.00000e+00 7.21352e+01 73.764  2.23665e+01 73.764  0.8608 
1 1 1 -5  73  16 o 17 4.29185e+00 1.22121e+00 4.87044e+01 349.551 4.07239e+00  -7.51047e-01 0.00000e+00 0.00000e+00 8.91059e+01 349.551 4.04015e+01 349.551 0.8687 
1 1 1 -5  74  1  o 7  1.21488e+01 6.72529e-01 1.92669e+02 274.183 1.29862e+00  -1.77539e+01 0.00000e+00 0.00000e+00 2.48223e+02 274.183 5.55533e+01 274.183 0.9715 
1 1 1 -5  74  2  o 10 7.92308e+00 5.78996e-01 1.01842e+02 119.137 -3.28971e+00 5.90136e+00  0.00000e+00 0.00000e+00 1.71174e+02 119.137 6.93316e+01 119.137 0.9227 
1 1 1 -5  74  3  o 7  1.86981e+01 4.52333e-01 3.71094e+02 352.377 5.52162e+01  -7.38987e+00 0.00000e+00 0.00000e+00 3.20644e+02 352.377 5.04503e+01 172.377 0.9910 
1 1 1 -5  74  4  f 0  8.78197e+00 5.00437e-01 2.75620e+02 179.033 -2.24827e+01 3.79361e-01  0.00000e+00 0.00000e+00 4.47176e+01 179.033 2.30902e+02 359.033 0.9775 
1 1 1 -5  74  5  o 11 1.01592e+01 4.62033e-01 2.61770e+02 234.753 -1.51044e+01 -2.13744e+01 0.00000e+00 0.00000e+00 1.09843e+02 234.753 1.51927e+02 54.753  0.9807 
1 1 1 -5  74  6  o 17 4.77513e+00 6.78877e-01 8.28967e+01 205.465 -3.69541e+00 -1.75982e+00 0.00000e+00 0.00000e+00 7.14382e+01 205.465 1.14586e+01 25.465  0.8670 
1 1 1 -5  74  7  o 19 1.27861e+01 4.67178e-01 2.50729e+02 89.692  1.85688e-01  3.45905e+01  0.00000e+00 0.00000e+00 2.18694e+02 89.692  3.20351e+01 269.692 0.9854 
1 1 1 -5  74  8  o 13 1.06203e+01 4.99140e-01 1.91252e+02 349.954 2.54656e+01  -4.51146e+00 0.00000e+00 0.00000e+00 1.96436e+02 349.954 5.18438e+00 349.954 0.9805 
1 1 1 -5  74  9  o 6  6.19450e+00 6.79626e-01 1.07580e+02 359.832 8.95859e+00  -2.63051e-02 0.00000e+00 0.00000e+00 1.09613e+02 359.832 2.03302e+00 359.832 0.9424 
1 1 1 -5  74  10 o 11 8.09278e+00 6.34688e-01 1.51154e+02 98.383  -2.86980e+00 1.94741e+01  0.00000e+00 0.00000e+00 1.41955e+02 98.383  9.19903e+00 278.383 0.9743 
1 1 1 -5  74  11 o 4  4.70451e+00 8.75561e-01 1.14131e+02 230.780 -4.94640e+00 -6.06057e+00 0.00000e+00 0.00000e+00 4.90302e+01 230.780 6.51004e+01 50.780  0.9337 
1 1 1 -5  74  12 o 9  1.19968e+01 6.61989e-01 1.57105e+02 7.260   3.47930e+01  4.43260e+00  0.00000e+00 0.00000e+00 2.81712e+02 7.260   1.24607e+02 7.260   0.9856 
1 1 1 -5  74  13 o 8  3.69140e+00 1.02652e+00 2.89891e+01 235.143 -1.00558e+00 -1.44377e+00 0.00000e+00 0.00000e+00 6.05222e+01 235.143 3.15331e+01 235.143 0.6540 
1 1 1 -5  74  14 o 11 5.46627e+00 1.24218e+00 6.26719e+01 232.402 -3.34105e+00 -4.33875e+00 0.00000e+00 0.00000e+00 1.20217e+02 232.402 5.75456e+01 232.402 0.9034 
1 1 1 -5  74  15 o 15 5.67924e+00 1.30037e+00 5.29890e+01 354.590 4.90073e+00  -4.64084e-01 0.00000e+00 0.00000e+00 1.34338e+02 354.590 8.13492e+01 354.590 0.8916 
1 1 1 -5  74  16 o 5  3.56058e+00 1.13862e+00 4.65927e+01 289.739 1.27403e+00  -3.55061e+00 0.00000e+00 0.00000e+00 6.57955e+01 289.739 1.92029e+01 289.739 0.8542 
1 1 1 -5  75  1  o 10 9.49070e+00 6.05481e-01 1.77573e+02 26.793  1.18275e+01  5.97274e+00  0.00000e+00 0.00000e+00 1.63237e+02 26.793  1.43359e+01 206.793 0.9615 
1 1 1 -5  75  2  o 7  1.12698e+01 4.96235e-01 1.85697e+02 69.488  5.84865e+00  1.56328e+01  0.00000e+00 0.00000e+00 2.22282e+02 69.488  3.65857e+01 69.488  0.9696 
1 1 1 -5  75  3  o 17 4.97580e+00 6.43057e-01 1.23369e+02 273.568 3.28037e-01  -5.26019e+00 0.00000e+00 0.00000e+00 4.36458e+01 273.568 7.97232e+01 93.568  0.8993 
1 1 1 -5  75  4  o 15 3.70758e+00 7.13764e-01 7.00618e+01 136.251 -1.66080e+00 1.58981e+00  0.00000e+00 0.00000e+00 3.24723e+01 136.251 3.75895e+01 316.251 0.7413 
1 1 1 -5  75  5  o 3  7.46369e+00 5.05929e-01 2.07050e+02 200.248 -1.42945e+01 -5.27300e+00 0.00000e+00 0.00000e+00 6.19816e+01 200.248 1.45069e+02 20.248  0.9666 
1 1 1 -5  75  6  o 19 4.15813e+00 7.21815e-01 1.47265e+02 255.314 -1.65487e+00 -6.31417e+00 0.00000e+00 0.00000e+00 4.71089e+00 75.314  1.51976e+02 75.314  0.9198 
1 1 1 -5  75  7  o 4  9.20283e+00 4.97803e-01 1.70697e+02 17.422  1.83909e+01  5.77111e+00  0.00000e+00 0.00000e+00 1.63081e+02 17.422  7.61596e+00 197.422 0.9737 
1 1 1 -5  75  8  o 7  4.38810e+00 7.49931e-01 3.97351e+01 35.361  1.84174e+00  1.30698e+00  0.00000e+00 0.00000e+00 8.04769e+01 35.361  4.07417e+01 35.361  0.7360 
1 1 1 -5  75  9  o 10 6.93765e+00 6.32340e-01 8.28295e+01 9.053   8.01507e+00  1.27705e+00  0.00000e+00 0.00000e+00 1.58766e+02 9.053   7.59366e+01 9.053   0.9362 
1 1 1 -5  75  10 o 17 4.88707e+00 8.09934e-01 6.88775e+01 188.329 -4.93394e+00 -7.22349e-01 0.00000e+00 0.00000e+00 9.33419e+01 188.329 2.44644e+01 188.329 0.8931 
1 1 1 -5  75  11 o 6  8.12630e+00 7.19909e-01 1.38618e+02 317.841 1.35334e+01  -1.22538e+01 0.00000e+00 0.00000e+00 1.54780e+02 317.841 1.61619e+01 317.841 0.9722 
1 1 1 -5  75  12 o 12 3.56748e+00 9.54912e-01 9.72447e+01 250.295 -1.90585e+00 -5.32143e+00 0.00000e+00 0.00000e+00 2.27565e+01 250.295 7.44882e+01 70.295  0.9066 
1 1 1 -5  75  13 o 6  4.24348e+00 1.09913e+00 5.76414e+01 239.495 -1.97101e+00 -3.34550e+00 0.00000e+00 0.00000e+00 7.74532e+01 239.495 1.98118e+01 239.495 0.8589 
1 1 1 -5  75  14 o 3  8.00752e+00 1.09927e+00 2.20771e+02 40.931  2.37718e+01  2.06143e+01  0.00000e+00 0.00000e+00 7.09911e+01 40.931  1.49780e+02 220.931 0.9840 
1 1 1 -5  75  15 o 12 8.64653e+00 1.20784e+00 1.52426e+02 278.920 3.78441e+00  -2.41113e+01 0.00000e+00 0.00000e+00 1.60778e+02 278.920 8.35226e+00 278.920 0.9793 
1 1 1 -5  75  16 o 7  2.94960e+00 9.92183e-01 6.05431e+01 114.406 -1.98858e+00 4.38261e+00  0.00000e+00 0.00000e+00 3.63213e+01 114.406 2.42218e+01 294.406 0.8888 
1 1 1 -5  76  1  o 1  8.67593e+00 7.43894e-01 1.61276e+02 179.572 -1.16069e+01 8.66858e-02  0.00000e+00 0.00000e+00 1.48401e+02 179.572 1.28755e+01 359.572 0.9559 
1 1 1 -5  76  2  f 0  1.21168e+01 5.08501e-01 3.19166e+02 315.790 2.43953e+01  -2.37317e+01 0.00000e+00 0.00000e+00 1.26451e+02 315.790 1.92715e+02 135.790 0.9852 
1 1 1 -5  76  3  o 7  1.16595e+01 4.50326e-01 2.45397e+02 153.139 -2.38384e+01 1.20734e+01  0.00000e+00 0.00000e+00 1.81471e+02 153.139 6.39262e+01 333.139 0.9811 
1 1 1 -5  76  4  o 15 1.14181e+01 4.63360e-01 2.08415e+02 75.237  5.95923e+00  2.26138e+01  0.00000e+00 0.00000e+00 2.08283e+02 75.237  1.31989e-01 255.237 0.9784 
1 1 1 -5  76  5  o 7  8.28656e+00 4.77884e-01 1.26391e+02 107.491 -3.46738e+00 1.10030e+01  0.00000e+00 0.00000e+00 1.68848e+02 107.491 4.24568e+01 107.491 0.9556 
1 1 1 -5  76  6  o 17 5.78518e+00 6.07808e-01 9.76209e+01 188.175 -6.25613e+00 -8.98774e-01 0.00000e+00 0.00000e+00 1.00074e+02 188.175 2.45292e+00 188.175 0.9171 
1 1 1 -5  76  7  o 15 6.37819e+00 6.06768e-01 7.66894e+01 145.896 -5.34155e+00 3.61703e+00  0.00000e+00 0.00000e+00 1.41561e+02 145.896 6.48720e+01 145.896 0.9188 
1 1 1 -5  76  8  o 4  7.56612e+00 5.70209e-01 1.31676e+02 295.045 5.93521e+00  -1.27018e+01 0.00000e+00 0.00000e+00 1.39670e+02 295.045 7.99427e+00 295.045 0.9636 
1 1 1 -5  76  9  o 2  4.49499e+00 7.94529e-01 8.80563e+01 198.948 -5.14389e+00 -1.76598e+00 0.00000e+00 0.00000e+00 6.28357e+01 198.948 2.52206e+01 18.948  0.9026 
1 1 1 -5  76  10 f 0  2.33066e+00 7.36431e-01 1.07981e+02 187.213 -3.83807e+00 -4.85731e-01 0.00000e+00 0.00000e+00 3.36478e+01 7.213   1.41629e+02 7.213   0.8583 
1 1 1 -5  76  11 f 0  5.96403e+00 8.58541e-01 9.41623e+01 128.428 -5.71004e+00 7.19703e+00  0.00000e+00 0.00000e+00 1.14852e+02 128.428 2.06900e+01 128.428 0.9439 
1 1 1 -5  76  12 o 12 4.14766e+00 1.02516e+00 9.03099e+01 269.223 -8.06997e-02 -5.94669e+00 0.00000e+00 0.00000e+00 4.99374e+01 269.223 4.03725e+01 89.222  0.9115 
1 1 1 -5  76  13 o 1  1.04008e+01 8.01927e-01 1.42224e+02 40.471  2.28422e+01  1.94889e+01  0.00000e+00 0.00000e+00 2.36751e+02 40.471  9.45265e+01 40.471  0.9832 
1 1 1 -5  76  14 o 6  5.11723e+00 1.12945e+00 1.78307e+02 227.652 -1.06019e+01 -1.16318e+01 0.00000e+00 0.00000e+00 5.02011e+00 227.652 1.73287e+02 47.652  0.9677 
1 1 1 -5  76  15 o 3  4.70589e+00 1.25254e+00 6.19604e+01 242.828 -2.35703e+00 -4.59187e+00 0.00000e+00 0.00000e+00 9.41441e+01 242.828 3.21837e+01 242.828 0.8970 
1 1 1 -5  77  1  o 6  1.90911e+01 5.24973e-01 3.59000e+02 93.260  -3.59935e+00 6.31975e+01  0.00000e+00 0.00000e+00 3.48071e+02 93.260  1.09291e+01 273.260 0.9921 
1 1 1 -5  77  2  o 12 1.09728e+01 5.08437e-01 1.58179e+02 261.012 -2.50709e+00 -1.58508e+01 0.00000e+00 0.00000e+00 2.38372e+02 261.012 8.01928e+01 261.012 0.9683 
1 1 1 -5  77  3  o 15 1.23547e+01 4.45801e-01 1.81313e+02 52.447  1.34818e+01  1.75365e+01  0.00000e+00 0.00000e+00 2.69080e+02 52.447  8.77669e+01 52.447  0.9771 
1 1 1 -5  77  4  o 14 1.72605e+01 4.53585e-01 3.26815e+02 329.183 4.82803e+01  -2.88000e+01 0.00000e+00 0.00000e+00 3.11128e+02 329.183 1.56869e+01 149.183 0.9911 
1 1 1 -5  77  5  o 14 6.35381e+00 5.68427e-01 1.15746e+02 19.242  7.71008e+00  2.69123e+00  0.00000e+00 0.00000e+00 1.06079e+02 19.242  9.66693e+00 199.242 0.9366 
1 1 1 -5  77  6  o 1  4.59051e+00 7.68343e-01 7.66031e+01 289.540 1.27801e+00  -3.60104e+00 0.00000e+00 0.00000e+00 6.98368e+01 289.540 6.76630e+00 109.540 0.8563 
1 1 1 -5  77  7  o 3  1.05538e+01 4.94959e-01 2.76774e+02 268.421 -1.02606e+00 -3.72176e+01 0.00000e+00 0.00000e+00 1.10863e+02 268.421 1.65912e+02 88.421  0.9865 
1 1 1 -5  77  8  o 13 8.19845e+00 5.46417e-01 1.38930e+02 233.477 -1.00423e+01 -1.35601e+01 0.00000e+00 0.00000e+00 1.56939e+02 233.477 1.80092e+01 233.477 0.9699 
1 1 1 -5  77  9  o 19 5.21857e+00 7.62158e-01 1.22503e+02 37.233  7.92331e+00  6.02130e+00  0.00000e+00 0.00000e+00 6.15076e+01 37.233  6.09956e+01 217.233 0.9483 
1 1 1 -5  77  10 o 11 4.73143e+00 8.57808e-01 1.14623e+02 143.927 -6.20960e+00 4.52369e+00  0.00000e+00 0.00000e+00 4.92863e+01 143.927 6.53363e+01 323.927 0.9324 
1 1 1 -5  77  11 o 3  2.55570e+00 8.08631e-01 1.42657e+01 172.383 -5.85539e-01 7.83064e-02  0.00000e+00 0.00000e+00 1.26015e+01 172.383 1.66422e+00 352.383 0.2832 
1 1 1 -5  77  12 o 18 3.54015e+00 9.67506e-01 8.07566e+01 207.492 -4.32157e+00 -2.24894e+00 0.00000e+00 0.00000e+00 3.61388e+01 207.492 4.46178e+01 27.492  0.8903 
1 1 1 -5  77  13 o 8  1.15487e+01 7.80973e-01 1.99247e+02 13.123  4.67319e+01  1.08944e+01  0.00000e+00 0.00000e+00 2.24172e+02 13.123  2.49250e+01 13.123  0.9895 
1 1 1 -5  77  14 o 2  2.01600e+01 7.88900e-01 3.05873e+02 274.525 1.12666e+01  -1.42365e+02 0.00000e+00 0.00000e+00 4.37709e+02 274.525 1.31836e+02 274.525 0.9965 
1 1 1 -5  77  15 o 11 4.22425e+00 1.22110e+00 8.58857e+01 91.334  -1.55890e-01 6.69520e+00  0.00000e+00 0.00000e+00 5.81151e+01 91.334  2.77706e+01 271.334 0.9220 
1 1 1 -5  78  1  o 11 7.75758e+00 5.72662e-01 6.84852e+01 334.302 4.36899e+00  -2.10242e+00 0.00000e+00 0.00000e+00 1.89141e+02 334.302 1.20656e+02 334.302 0.8897 
1 1 1 -5  78  2  o 16 1.25105e+01 5.05054e-01 1.82175e+02 249.593 -7.76257e+00 -2.08653e+01 0.00000e+00 0.00000e+00 2.74030e+02 249.593 9.18546e+01 249.593 0.9773 
1 1 1 -5  78  3  o 9  6.98703e+00 5.37399e-01 1.03751e+02 123.212 -3.89259e+00 5.94577e+00  0.00000e+00 0.00000e+00 1.37767e+02 123.212 3.40162e+01 123.212 0.9267 
1 1 1 -5  78  4  o 1  8.26788e+00 4.92707e-01 1.29670e+02 319.421 8.78547e+00  -7.52450e+00 0.00000e+00 0.00000e+00 1.64956e+02 319.421 3.52864e+01 319.421 0.9557 
1 1 1 -5  78  5  o 12 1.49659e+01 5.00485e-01 1.75646e+02 349.644 2.96959e+01  -5.42647e+00 0.00000e+00 0.00000e+00 3.72777e+02 349.644 1.97131e+02 349.644 0.9833 
1 1 1 -5  78  6  o 5  8.30168e+00 5.13816e-01 1.87747e+02 167.928 -1.97116e+01 4.21564e+00  0.00000e+00 0.00000e+00 1.13698e+02 167.928 7.40487e+01 347.928 0.9749 
1 1 1 -5  78  7  o 9  1.33461e+01 4.71176e-01 2.73011e+02 148.442 -4.38037e+01 2.69043e+01  0.00000e+00 0.00000e+00 2.18942e+02 148.442 5.40690e+01 328.442 0.9902 
1 1 1 -5  78  8  o 18 9.67154e+00 5.25118e-01 1.16332e+02 241.009 -7.97448e+00 -1.43919e+01 0.00000e+00 0.00000e+00 2.32343e+02 241.009 1.16011e+02 241.009 0.9691 
1 1 1 -5  78  9  o 6  6.24899e+00 7.35016e-01 1.12604e+02 313.613 7.49709e+00  -7.86923e+00 0.00000e+00 0.00000e+00 1.08735e+02 313.613 3.86951e+00 133.613 0.9528 
1 1 1 -5  78  10 o 11 1.20191e+01 5.74928e-01 2.11776e+02 117.680 -1.95529e+01 3.72746e+01  0.00000e+00 0.00000e+00 2.29333e+02 117.680 1.75573e+01 117.680 0.9880 
1 1 1 -5  78  11 o 12 6.07214e+00 9.11744e-01 1.27772e+02 285.133 3.36547e+00  -1.24445e+01 0.00000e+00 0.00000e+00 8.86599e+01 285.133 3.91121e+01 105.133 0.9604 
1 1 1 -5  78  12 o 10 3.33442e+00 8.81904e-01 8.31166e+01 90.637  -5.35309e-02 4.81513e+00  0.00000e+00 0.00000e+00 2.67887e+01 90.637  5.63279e+01 270.637 0.8889 
1 1 1 -5  78  13 o 12 7.62281e+00 1.04979e+00 1.77288e+02 232.546 -1.43791e+01 -1.87707e+01 0.00000e+00 0.00000e+00 9.90535e+01 232.546 7.82346e+01 52.546  0.9786 
1 1 1 -5  78  14 o 10 6.80105e+00 1.17092e+00 6.52516e+01 39.296  6.47181e+00  5.29641e+00  0.00000e+00 0.00000e+00 1.70863e+02 39.296  1.05611e+02 39.296  0.9382 
1 1 1 -5  78  15 f 0  2.96460e+00 9.86745e-01 2.60578e+01 314.494 1.38893e+00  -1.41366e+00 0.00000e+00 0.00000e+00 5.00803e+01 314.494 2.40225e+01 314.494 0.6948 
1 1 1 -5  79  1  o 17 7.00356e+00 5.70230e-01 1.44027e+02 121.165 -5.09204e+00 8.41946e+00  0.00000e+00 0.00000e+00 1.03664e+02 121.165 4.03629e+01 301.165 0.9477 
1 1 1 -5  79  2  o 7  5.83199e+00 6.72970e-01 1.80425e+02 274.748 8.30787e-01  -1.00029e+01 0.00000e+00 0.00000e+00 2.60012e+01 274.748 1.54424e+02 94.748  0.9488 
1 1 1 -5  79  3  o 16 7.42609e+00 5.87201e-01 1.12696e+02 81.968  1.25825e+00  8.91633e+00  0.00000e+00 0.00000e+00 1.48378e+02 81.968  3.56818e+01 81.968  0.9427 
1 1 1 -5  79  4  o 9  3.34452e+00 7.43850e-01 7.87993e+01 270.499 2.34915e-02  -2.69787e+00 0.00000e+00 0.00000e+00 1.90594e+01 270.499 5.97399e+01 90.499  0.7849 
1 1 1 -5  79  5  o 6  1.78365e+01 4.64908e-01 2.72763e+02 44.747  4.06464e+01  4.02897e+01  0.00000e+00 0.00000e+00 3.85981e+02 44.747  1.13218e+02 44.747  0.9912 
1 1 1 -5  79  6  o 8  1.56389e+01 4.68870e-01 2.67544e+02 220.536 -4.33956e+01 -3.71104e+01 0.00000e+00 0.00000e+00 3.09715e+02 220.536 4.21702e+01 220.536 0.9912 
1 1 1 -5  79  7  o 9  6.01679e+00 6.85943e-01 9.56043e+01 58.922  4.02426e+00  6.67697e+00  0.00000e+00 0.00000e+00 1.13424e+02 58.922  1.78197e+01 58.922  0.9335 
1 1 1 -5  79  8  o 12 1.04565e+01 5.21969e-01 2.26193e+02 173.925 -3.56193e+01 3.79063e+00  0.00000e+00 0.00000e+00 1.57241e+02 173.925 6.89513e+01 353.925 0.9859 
1 1 1 -5  79  9  o 7  1.31039e+01 5.24579e-01 2.60266e+02 354.237 5.65237e+01  -5.70415e+00 0.00000e+00 0.00000e+00 2.22443e+02 354.237 3.78224e+01 174.237 0.9912 
1 1 1 -5  79  10 o 12 1.67811e+01 5.61214e-01 3.55712e+02 160.531 -9.72302e+01 3.43711e+01  0.00000e+00 0.00000e+00 2.64452e+02 160.531 9.12601e+01 340.531 0.9951 
1 1 1 -5  79  11 o 8  1.09688e+01 6.42315e-01 1.26666e+02 323.493 2.09370e+01  -1.54964e+01 0.00000e+00 0.00000e+00 2.72445e+02 323.493 1.45779e+02 323.493 0.9806 
1 1 1 -5  79  12 o 8  4.98510e+00 1.06504e+00 8.58321e+01 104.869 -1.76226e+00 6.63752e+00  0.00000e+00 0.00000e+00 8.49329e+01 104.869 8.99180e-01 284.869 0.9240 
1 1 1 -5  79  13 o 7  9.71889e+00 8.80269e-01 1.55231e+02 306.394 1.86989e+01  -2.53681e+01 0.00000e+00 0.00000e+00 1.98959e+02 306.394 4.37279e+01 306.394 0.9840 
1 1 1 -5  79  14 o 4  4.23116e+00 1.19697e+00 6.92501e+01 85.523  4.35689e-01  5.56470e+00  0.00000e+00 0.00000e+00 7.24736e+01 85.523  3.22347e+00 85.523  0.9053 
1 1 1 -5  79  15 o 6  3.35369e+00 1.07898e+00 2.95667e+01 286.277 6.13799e-01  -2.10212e+00 0.00000e+00 0.00000e+00 6.04941e+01 286.277 3.09274e+01 286.277 0.7266 
1 1 1 -5  80  1  o 12 2.19227e+01 6.02200e-01 4.20540e+02 328.181 8.41650e+01  -5.22233e+01 0.00000e+00 0.00000e+00 3.93226e+02 328.181 2.73146e+01 148.181 0.9949 
1 1 1 -5  80  2  o 1  9.93375e+00 5.34409e-01 1.60395e+02 106.780 -4.92548e+00 1.63345e+01  0.00000e+00 0.00000e+00 1.99083e+02 106.780 3.86880e+01 106.780 0.9702 
1 1 1 -5  80  3  o 10 8.54918e+00 5.69903e-01 1.78728e+02 252.847 -5.00231e+00 -1.62067e+01 0.00000e+00 0.00000e+00 1.30479e+02 252.847 4.82494e+01 72.847  0.9701 
1 1 1 -5  80  4  o 16 5.31419e+00 6.47067e-01 5.54761e+01 125.557 -1.78228e+00 2.49342e+00  0.00000e+00 0.00000e+00 1.05873e+02 125.557 5.03968e+01 125.557 0.8147 
1 1 1 -5  80  5  o 2  1.73905e+01 4.64049e-01 3.27675e+02 228.851 -4.90860e+01 -5.61723e+01 0.00000e+00 0.00000e+00 3.15785e+02 228.851 1.18906e+01 48.851  0.9933 
1 1 1 -5  80  6  o 8  3.77783e+00 7.26371e-01 7.79351e+01 122.312 -2.05951e+00 3.25625e+00  0.00000e+00 0.00000e+00 4.26912e+01 122.312 3.52439e+01 302.312 0.8576 
1 1 1 -5  80  7  o 14 5.19466e+00 6.96578e-01 9.90495e+01 192.460 -7.07659e+00 -1.56369e+00 0.00000e+00 0.00000e+00 8.03587e+01 192.460 1.86909e+01 12.460  0.9282 
1 1 1 -5  80  8  o 11 5.14998e+00 7.34307e-01 6.19181e+01 172.723 -4.37069e+00 5.58134e-01  0.00000e+00 0.00000e+00 1.06123e+02 172.723 4.42049e+01 172.723 0.8775 
1 1 1 -5  80  9  o 2  3.62121e+00 8.25241e-01 1.13773e+02 323.404 5.09713e+00  -3.78493e+00 0.00000e+00 0.00000e+00 9.67566e+00 323.404 1.04098e+02 143.404 0.9175 
1 1 1 -5  80  10 o 10 3.23825e+00 8.72672e-01 8.92177e+01 133.177 -3.21883e+00 3.43047e+00  0.00000e+00 0.00000e+00 1.73115e+01 133.177 7.19063e+01 313.177 0.8860 
1 1 1 -5  80  11 o 11 4.40690e+00 1.03817e+00 1.04562e+02 216.934 -5.35031e+00 -4.02203e+00 0.00000e+00 0.00000e+00 4.61604e+01 216.934 5.84013e+01 36.934  0.9219 
1 1 1 -5  80  12 o 14 1.51765e+01 6.90910e-01 2.10711e+02 51.702  4.00710e+01  5.07428e+01  0.00000e+00 0.00000e+00 3.47419e+02 51.702  1.36708e+02 51.702  0.9922 
1 1 1 -5  80  13 o 3  2.93542e+00 9.34855e-01 3.62440e+01 244.093 -9.31249e-01 -1.91722e+00 0.00000e+00 0.00000e+00 4.18207e+01 244.093 5.57668e+00 244.093 0.7182 
1 1 1 -5  80  14 o 13 5.64373e+00 1.20710e+00 7.44641e+01 161.262 -7.00220e+00 2.37531e+00  0.00000e+00 0.00000e+00 1.19618e+02 161.262 4.51543e+01 161.262 0.9297 
1 1 1 -5  80  15 o 17 3.35952e+00 1.08868e+00 2.76388e+01 10.358  2.17995e+00  3.98427e-01  0.00000e+00 0.00000e+00 6.30094e+01 10.358  3.53706e+01 10.358  0.7302 
1 1 1 -5  81  1  o 7  2.24314e+01 6.11483e-01 4.17584e+02 50.988  6.49025e+01  8.01133e+01  0.00000e+00 0.00000e+00 4.15046e+02 50.988  2.53774e+00 230.988 0.9951 
1 1 1 -5  81  2  o 13 2.41964e+01 5.72826e-01 3.59767e+02 207.121 -8.58978e+01 -4.39958e+01 0.00000e+00 0.00000e+00 5.37815e+02 207.121 1.78048e+02 207.121 0.9948 
1 1 1 -5  81  3  o 12 1.67905e+01 5.59430e-01 3.06312e+02 309.458 3.70331e+01  -4.49914e+01 0.00000e+00 0.00000e+00 3.14179e+02 309.458 7.86724e+00 309.458 0.9914 
1 1 1 -5  81  4  o 1  4.11728e+00 7.47303e-01 5.79839e+01 141.094 -2.02963e+00 1.63806e+00  0.00000e+00 0.00000e+00 6.11057e+01 141.094 3.12177e+00 141.094 0.7763 
1 1 1 -5  81  5  o 19 3.71290e+00 7.35552e-01 1.33194e+02 45.249  4.39372e+00  4.43209e+00  0.00000e+00 0.00000e+00 6.53777e+00 225.249 1.39732e+02 225.249 0.9159 
1 1 1 -5  81  6  o 13 3.20511e+00 7.56376e-01 9.17831e+01 38.382  2.85455e+00  2.26107e+00  0.00000e+00 0.00000e+00 9.40634e+00 38.382  8.23767e+01 218.382 0.8482 
1 1 1 -5  81  7  o 19 5.10814e+00 7.07287e-01 7.12861e+01 288.207 1.56721e+00  -4.76466e+00 0.00000e+00 0.00000e+00 9.85492e+01 288.207 2.72631e+01 288.207 0.8937 
1 1 1 -5  81  8  o 10 5.15801e+00 7.51963e-01 1.05304e+02 81.007  1.29342e+00  8.17265e+00  0.00000e+00 0.00000e+00 7.44595e+01 81.007  3.08449e+01 261.007 0.9375 
1 1 1 -5  81  9  o 3  3.45032e+00 8.59433e-01 7.72044e+01 208.493 -3.71582e+00 -2.01698e+00 0.00000e+00 0.00000e+00 3.45337e+01 208.493 4.26707e+01 28.494  0.8717 
1 1 1 -5  81  10 o 1  2.85147e+00 8.28379e-01 8.70633e+01 244.346 -1.82232e+00 -3.79426e+00 0.00000e+00 0.00000e+00 5.14139e+00 244.346 8.19219e+01 64.346  0.8711 
1 1 1 -5  81  11 o 7  3.44556e+00 9.48083e-01 2.12124e+01 137.391 -8.81256e-01 8.10601e-01  0.00000e+00 0.00000e+00 4.42129e+01 137.391 2.30005e+01 137.391 0.5120 
1 1 1 -5  81  12 o 16 3.32817e+00 9.87198e-01 5.42165e+01 291.786 1.20828e+00  -3.02301e+00 0.00000e+00 0.00000e+00 4.78040e+01 291.786 6.41251e+00 111.786 0.8272 
1 1 1 -5  81  13 o 1  4.99708e+00 1.14382e+00 1.01600e+02 172.495 -8.51710e+00 1.12213e+00  0.00000e+00 0.00000e+00 7.22646e+01 172.495 2.93354e+01 352.494 0.9399 
1 1 1 -5  81  14 o 10 4.34832e+00 1.20442e+00 9.07106e+01 289.607 2.45626e+00  -6.89528e+00 0.00000e+00 0.00000e+00 5.86704e+01 289.607 3.20402e+01 109.607 0.9289 
1 1 1 -5  81  15 o 18 3.05260e+00 9.98847e-01 3.85532e+01 207.322 -2.80056e+00 -1.44684e+00 0.00000e+00 0.00000e+00 5.39882e+01 207.322 1.54350e+01 207.322 0.8206 
1 1 1 -5  82  1  o 6  1.33589e+01 5.92598e-01 2.60835e+02 193.019 -3.82241e+01 -8.83786e+00 0.00000e+00 0.00000e+00 2.30956e+02 193.019 2.98795e+01 13.019  0.9872 
1 1 1 -5  82  2  o 6  9.25469e+00 6.52303e-01 1.69507e+02 44.074  1.24650e+01  1.20682e+01  0.00000e+00 0.00000e+00 1.65422e+02 44.074  4.08558e+00 224.073 0.9707 
1 1 1 -5  82  3  o 14 6.38385e+00 7.37145e-01 1.25997e+02 215.586 -7.17719e+00 -5.13579e+00 0.00000e+00 0.00000e+00 9.80007e+01 215.586 2.79968e+01 35.586  0.9415 
1 1 1 -5  82  4  o 4  9.89549e+00 5.39735e-01 1.51038e+02 98.101  -2.70341e+00 1.89923e+01  0.00000e+00 0.00000e+00 2.07852e+02 98.101  5.68145e+01 98.101  0.9736 
1 1 1 -5  82  5  o 14 4.47629e+00 7.05289e-01 8.39027e+01 286.955 1.31473e+00  -4.31228e+00 0.00000e+00 0.00000e+00 6.28649e+01 286.955 2.10379e+01 106.955 0.8806 
1 1 1 -5  82  6  o 8  1.08790e+01 4.85253e-01 1.96205e+02 138.887 -2.32982e+01 2.03335e+01  0.00000e+00 0.00000e+00 2.02050e+02 138.887 5.84495e+00 138.887 0.9837 
1 1 1 -5  82  7  o 10 1.13309e+01 5.01619e-01 1.70081e+02 76.142  7.02773e+00  2.84872e+01  0.00000e+00 0.00000e+00 2.44098e+02 76.142  7.40164e+01 76.142  0.9828 
1 1 1 -5  82  8  o 17 2.58285e+00 7.56573e-01 8.68933e+01 318.305 2.54101e+00  -2.26356e+00 0.00000e+00 0.00000e+00 6.65071e+00 138.305 9.35440e+01 138.305 0.8359 
1 1 1 -5  82  9  o 11 9.10382e+00 6.06007e-01 1.34773e+02 333.764 1.79644e+01  -8.85355e+00 0.00000e+00 0.00000e+00 1.94799e+02 333.764 6.00257e+01 333.764 0.9747 
1 1 1 -5  82  10 o 16 5.67908e+00 8.69022e-01 9.72015e+01 97.909  -1.29251e+00 9.30416e+00  0.00000e+00 0.00000e+00 1.02005e+02 97.909  4.80310e+00 97.909  0.9452 
1 1 1 -5  82  11 o 15 8.27072e+00 7.93373e-01 1.19915e+02 103.417 -3.95782e+00 1.65915e+01  0.00000e+00 0.00000e+00 1.77639e+02 103.417 5.77248e+01 103.417 0.9702 
1 1 1 -5  82  12 o 2  5.40379e+00 1.03651e+00 1.18021e+02 201.200 -1.05075e+01 -4.07565e+00 0.00000e+00 0.00000e+00 7.30753e+01 201.200 4.49456e+01 21.200  0.9545 
1 1 1 -5  82  13 o 2  3.25159e+00 1.00778e+00 4.78794e+01 221.106 -2.32270e+00 -2.02668e+00 0.00000e+00 0.00000e+00 5.03122e+01 221.106 2.43279e+00 221.106 0.8159 
1 1 1 -5  82  14 o 1  5.71088e+00 1.32163e+00 1.00893e+02 95.018  -8.42280e-01 9.59330e+00  0.00000e+00 0.00000e+00 9.89748e+01 95.018  1.91783e+00 275.018 0.9466 
1 1 1 -5  82  15 o 8  3.00992e+00 1.01003e+00 4.19001e+01 351.851 3.32964e+00  -4.76802e-01 0.00000e+00 0.00000e+00 5.07736e+01 351.851 8.87345e+00 351.851 0.8336 
1 1 1 -5  83  1  o 17 8.30010e+00 6.90081e-01 1.70788e+02 256.543 -3.38349e+00 -1.41399e+01 0.00000e+00 0.00000e+00 1.27829e+02 256.543 4.29590e+01 76.543  0.9650 
1 1 1 -5  83  2  o 16 5.84176e+00 7.66445e-01 9.67503e+01 313.694 4.24262e+00  -4.44063e+00 0.00000e+00 0.00000e+00 1.02372e+02 313.694 5.62152e+00 313.694 0.9145 
1 1 1 -5  83  3  o 13 3.35239e+00 8.44122e-01 8.70229e+01 39.759  2.61746e+00  2.17762e+00  0.00000e+00 0.00000e+00 1.73973e+01 39.759  6.96256e+01 219.759 0.8360 
1 1 1 -5  83  4  o 11 9.46937e+00 5.51712e-01 1.50176e+02 108.817 -6.12161e+00 1.79651e+01  0.00000e+00 0.00000e+00 1.93080e+02 108.817 4.29043e+01 108.817 0.9733 
1 1 1 -5  83  5  o 4  1.07160e+01 5.31033e-01 2.71418e+02 15.972  3.70952e+01  1.06174e+01  0.00000e+00 0.00000e+00 1.22294e+02 15.972  1.49124e+02 195.972 0.9870 
1 1 1 -5  83  6  o 13 6.30473e+00 6.39817e-01 8.98537e+01 217.751 -6.09342e+00 -4.71820e+00 0.00000e+00 0.00000e+00 1.28926e+02 217.751 3.90718e+01 217.751 0.9327 
1 1 1 -5  83  7  o 3  1.25149e+01 5.04824e-01 1.90958e+02 4.764   4.09446e+01  3.41237e+00  0.00000e+00 0.00000e+00 2.68696e+02 4.764   7.77382e+01 4.764   0.9878 
1 1 1 -5  83  8  o 15 4.91614e+00 8.18391e-01 5.70990e+01 224.517 -2.96741e+00 -2.91782e+00 0.00000e+00 0.00000e+00 1.01735e+02 224.517 4.46357e+01 224.517 0.8695 
1 1 1 -5  83  9  o 15 9.96830e+00 6.08227e-01 1.97949e+02 246.529 -1.33180e+01 -3.06719e+01 0.00000e+00 0.00000e+00 1.66622e+02 246.529 3.13263e+01 66.529  0.9849 
1 1 1 -5  83  10 o 5  1.18561e+01 6.21083e-01 2.16284e+02 135.623 -3.46812e+01 3.39351e+01  0.00000e+00 0.00000e+00 2.19062e+02 135.623 2.77805e+00 135.623 0.9896 
1 1 1 -5  83  11 o 8  5.42755e+00 9.29560e-01 1.17999e+02 146.222 -9.15291e+00 6.12218e+00  0.00000e+00 0.00000e+00 7.38465e+01 146.222 4.41529e+01 326.222 0.9535 
1 1 1 -5  83  12 o 1  4.43350e+00 1.05875e+00 1.03792e+02 327.598 6.75101e+00  -4.28458e+00 0.00000e+00 0.00000e+00 4.97783e+01 327.598 5.40140e+01 147.598 0.9352 
1 1 1 -5  83  13 o 10 3.04772e+00 9.74397e-01 6.21174e+01 358.545 4.07688e+00  -1.03581e-01 0.00000e+00 0.00000e+00 3.55980e+01 358.545 2.65194e+01 178.545 0.8665 
1 1 1 -5  83  14 o 6  3.60629e+00 1.09951e+00 7.20555e+01 261.675 -7.87482e-01 -5.38168e+00 0.00000e+00 0.00000e+00 4.82747e+01 261.675 2.37808e+01 81.675  0.9027 
1 1 1 -5  83  15 o 11 4.71712e+00 1.30046e+00 1.10257e+02 99.580  -1.69989e+00 1.00719e+01  0.00000e+00 0.00000e+00 5.51627e+01 99.580  5.50944e+01 279.580 0.9497 
1 1 1 -5  84  1  o 10 4.14732e+00 8.76433e-01 8.76149e+01 209.108 -3.47923e+00 -1.93717e+00 0.00000e+00 0.00000e+00 4.57717e+01 209.108 4.18433e+01 29.108  0.8628 
1 1 1 -5  84  2  o 4  4.41919e+00 9.41203e-01 3.68817e+01 122.972 -9.97132e-01 1.53710e+00  0.00000e+00 0.00000e+00 7.31556e+01 122.972 3.62738e+01 122.972 0.6682 
1 1 1 -5  84  3  o 2  3.44132e+00 1.00646e+00 1.06987e+02 146.823 -3.49923e+00 2.28783e+00  0.00000e+00 0.00000e+00 4.55744e+00 146.823 1.02429e+02 326.823 0.8701 
1 1 1 -5  84  4  o 11 1.02213e+01 5.71319e-01 1.98461e+02 214.656 -2.29243e+01 -1.58478e+01 0.00000e+00 0.00000e+00 1.75241e+02 214.656 2.32195e+01 34.657  0.9819 
1 1 1 -5  84  5  o 13 1.31578e+01 5.42178e-01 2.35569e+02 240.447 -2.18041e+01 -3.84553e+01 0.00000e+00 0.00000e+00 2.48564e+02 240.447 1.29947e+01 240.447 0.9886 
1 1 1 -5  84  6  o 12 1.77705e+01 4.88849e-01 3.39312e+02 36.283  7.62439e+01  5.59713e+01  0.00000e+00 0.00000e+00 3.18205e+02 36.283  2.11069e+01 216.283 0.9947 
1 1 1 -5  84  7  o 5  7.86400e+00 5.99498e-01 1.62483e+02 318.990 1.57090e+01  -1.36604e+01 0.00000e+00 0.00000e+00 1.22754e+02 318.990 3.97288e+01 138.990 0.9757 
1 1 1 -5  84  8  o 9  1.18720e+01 5.41850e-01 1.91494e+02 225.309 -2.56121e+01 -2.58902e+01 0.00000e+00 0.00000e+00 2.43462e+02 225.309 5.19687e+01 225.309 0.9862 
1 1 1 -5  84  9  o 18 8.19621e+00 7.03076e-01 1.56116e+02 38.335  1.76989e+01  1.39955e+01  0.00000e+00 0.00000e+00 1.41340e+02 38.335  1.47753e+01 218.335 0.9776 
1 1 1 -5  84  10 o 1  2.48973e+00 7.67898e-01 2.25448e+01 183.291 -9.36907e-01 -5.38817e-02 0.00000e+00 0.00000e+00 1.66291e+01 183.291 5.91569e+00 3.291   0.4242 
1 1 1 -5  84  11 o 2  4.46513e+00 9.96838e-01 1.19758e+02 10.976  8.90469e+00  1.72704e+00  0.00000e+00 0.00000e+00 3.63290e+01 10.976  8.34286e+01 190.976 0.9432 
1 1 1 -5  84  12 o 18 3.56347e+00 1.01561e+00 6.63480e+01 184.946 -4.47204e+00 -3.87036e-01 0.00000e+00 0.00000e+00 4.97736e+01 184.946 1.65744e+01 4.946   0.8800 
1 1 1 -5  84  13 o 13 4.03952e+00 1.12178e+00 7.51222e+01 129.354 -3.89064e+00 4.74429e+00  0.00000e+00 0.00000e+00 6.15286e+01 129.354 1.35936e+01 309.354 0.9144 
1 1 1 -5  84  14 o 7  4.30852e+00 1.21637e+00 7.44834e+01 70.849  2.13248e+00  6.14056e+00  0.00000e+00 0.00000e+00 7.19257e+01 70.849  2.55767e+00 250.849 0.9195 
1 1 1 -5  85  1  o 2  2.66690e+00 7.32528e-01 4.13802e+01 149.068 -1.19780e+00 7.17770e-01  0.00000e+00 0.00000e+00 1.52157e+01 149.068 2.61645e+01 329.068 0.5695 
1 1 1 -5  85  2  o 7  1.20019e+01 6.01060e-01 2.26985e+02 274.301 2.68929e+00  -3.57606e+01 0.00000e+00 0.00000e+00 2.13873e+02 274.301 1.31119e+01 94.301  0.9860 
1 1 1 -5  85  3  o 5  7.92953e+00 8.09929e-01 1.32082e+02 81.268  2.01634e+00  1.31280e+01  0.00000e+00 0.00000e+00 1.51887e+02 81.268  1.98057e+01 81.268  0.9616 
1 1 1 -5  85  4  o 5  8.61714e+00 5.85132e-01 1.59830e+02 199.992 -1.81294e+01 -6.59583e+00 0.00000e+00 0.00000e+00 1.52530e+02 199.992 7.30007e+00 19.992  0.9737 
1 1 1 -5  85  5  o 19 1.63915e+01 5.84893e-01 2.51370e+02 339.566 5.34244e+01  -1.99047e+01 0.00000e+00 0.00000e+00 3.53167e+02 339.566 1.01797e+02 339.566 0.9912 
1 1 1 -5  85  6  o 6  5.59032e+00 7.46523e-01 1.25679e+02 246.656 -3.83098e+00 -8.87661e+00 0.00000e+00 0.00000e+00 7.11547e+01 246.656 5.45244e+01 66.656  0.9468 
1 1 1 -5  85  7  f 0  7.36101e+00 6.05865e-01 1.56054e+02 169.193 -1.82704e+01 3.48771e+00  0.00000e+00 0.00000e+00 1.10072e+02 169.193 4.59824e+01 349.193 0.9727 
1 1 1 -5  85  8  o 7  1.89848e+01 5.38727e-01 3.23194e+02 1.515   1.02566e+02  2.71200e+00  0.00000e+00 0.00000e+00 3.78502e+02 1.515   5.53079e+01 1.515   0.9951 
1 1 1 -5  85  9  o 2  8.16883e+00 6.72046e-01 1.43137e+02 161.858 -1.91290e+01 6.26794e+00  0.00000e+00 0.00000e+00 1.52424e+02 161.858 9.28657e+00 161.858 0.9748 
1 1 1 -5  85  10 o 9  7.65640e+00 7.39638e-01 7.60811e+01 204.019 -9.75479e+00 -4.34709e+00 0.00000e+00 0.00000e+00 1.94228e+02 204.019 1.18147e+02 204.019 0.9520 
1 1 1 -5  85  11 o 5  3.71149e+00 9.83573e-01 7.00983e+01 322.488 3.73596e+00  -2.86796e+00 0.00000e+00 0.00000e+00 5.17793e+01 322.488 1.83190e+01 142.488 0.8862 
1 1 1 -5  85  12 o 11 6.24990e+00 1.03372e+00 9.48485e+01 182.716 -1.10493e+01 -5.24251e-01 0.00000e+00 0.00000e+00 1.25813e+02 182.716 3.09648e+01 182.716 0.9537 
1 1 1 -5  85  13 o 19 3.42667e+00 1.04895e+00 7.82301e+01 321.600 4.18266e+00  -3.31510e+00 0.00000e+00 0.00000e+00 3.59176e+01 321.600 4.23125e+01 141.600 0.9007 
1 1 1 -5  85  14 o 6  2.85300e+00 9.51317e-01 3.35535e+01 112.179 -9.10981e-01 2.23465e+00  0.00000e+00 0.00000e+00 4.60559e+01 112.179 1.25024e+01 112.179 0.7552 
1 1 1 -5  86  1  o 13 8.83480e+00 5.38629e-01 1.35949e+02 327.111 1.27022e+01  -8.21381e+00 0.00000e+00 0.00000e+00 1.82141e+02 327.111 4.61916e+01 327.111 0.9664 
1 1 1 -5  86  2  f 0  4.57010e+00 8.12154e-01 1.36008e+02 15.540  7.58221e+00  2.10838e+00  0.00000e+00 0.00000e+00 2.29988e+01 15.540  1.13009e+02 195.540 0.9341 
1 1 1 -5  86  3  o 16 5.31798e+00 7.45424e-01 9.88601e+01 139.540 -5.31261e+00 4.53102e+00  0.00000e+00 0.00000e+00 8.43627e+01 139.540 1.44973e+01 319.540 0.9253 
1 1 1 -5  86  4  o 16 8.83237e+00 5.95839e-01 1.19390e+02 60.689  7.52749e+00  1.34076e+01  0.00000e+00 0.00000e+00 1.98458e+02 60.689  7.90677e+01 60.689  0.9669 
1 1 1 -5  86  5  f 0  3.03562e+00 8.53081e-01 1.04929e+02 144.228 -3.54721e+00 2.55572e+00  0.00000e+00 0.00000e+00 5.95575e+00 324.228 1.10885e+02 324.228 0.8764 
1 1 1 -5  86  6  o 4  9.03041e+00 7.31486e-01 2.04231e+02 256.540 -6.59835e+00 -2.75679e+01 0.00000e+00 0.00000e+00 1.25546e+02 256.540 7.86848e+01 76.540  0.9822 
1 1 1 -5  86  7  o 7  1.10740e+01 5.38782e-01 1.75441e+02 21.631  3.13174e+01  1.24188e+01  0.00000e+00 0.00000e+00 2.29895e+02 21.631  5.44539e+01 21.631  0.9850 
1 1 1 -5  86  8  o 13 7.18892e+00 6.87164e-01 1.26025e+02 233.302 -8.89139e+00 -1.19296e+01 0.00000e+00 0.00000e+00 1.31792e+02 233.302 5.76732e+00 233.302 0.9658 
1 1 1 -5  86  9  o 19 7.54111e+00 6.92541e-01 1.61191e+02 169.957 -2.34146e+01 4.14670e+00  0.00000e+00 0.00000e+00 1.12687e+02 169.957 4.85044e+01 349.957 0.9787 
1 1 1 -5  86  10 o 16 5.55492e+00 9.01903e-01 1.27563e+02 347.236 1.12181e+01  -2.54121e+00 0.00000e+00 0.00000e+00 6.92339e+01 347.236 5.83286e+01 167.236 0.9555 
1 1 1 -5  86  11 o 4  5.50577e+00 9.63412e-01 1.31210e+02 162.168 -1.27738e+01 4.10919e+00  0.00000e+00 0.00000e+00 6.50056e+01 162.168 6.62044e+01 342.167 0.9620 
1 1 1 -5  86  12 o 4  7.30818e+00 9.76686e-01 6.90454e+01 333.731 8.69448e+00  -4.29129e+00 0.00000e+00 0.00000e+00 1.87099e+02 333.731 1.18053e+02 333.731 0.9469 
1 1 1 -5  86  13 o 10 6.42023e+00 1.17445e+00 1.16305e+02 55.972  7.94863e+00  1.17719e+01  0.00000e+00 0.00000e+00 1.12582e+02 55.972  3.72311e+00 235.972 0.9641 
1 1 1 -5  86  14 o 4  4.45068e+00 1.17580e+00 5.19703e+01 234.408 -2.89529e+00 -4.04529e+00 0.00000e+00 0.00000e+00 9.48096e+01 234.408 4.28393e+01 234.408 0.8928 
1 1 1 -5  87  1  o 7  4.80857e+00 7.29026e-01 6.68964e+01 121.696 -2.11267e+00 3.42122e+00  0.00000e+00 0.00000e+00 8.79156e+01 121.696 2.10192e+01 121.696 0.8643 
1 1 1 -5  87  2  o 13 3.89266e+00 7.47310e-01 1.27394e+02 170.659 -6.48871e+00 1.06737e+00  0.00000e+00 0.00000e+00 6.03220e+00 170.659 1.21361e+02 350.659 0.9205 
1 1 1 -5  87  3  o 10 2.85033e+00 7.79332e-01 6.42691e+01 83.872  2.67046e-01  2.48724e+00  0.00000e+00 0.00000e+00 1.69166e+01 83.872  4.73526e+01 263.872 0.7652 
1 1 1 -5  87  4  o 11 6.19562e+00 7.88209e-01 1.74834e+02 92.977  -7.51207e-01 1.44450e+01  0.00000e+00 0.00000e+00 4.75830e+01 92.977  1.27251e+02 272.977 0.9648 
1 1 1 -5  87  5  o 10 1.68711e+01 6.63691e-01 2.86674e+02 290.077 2.35436e+01  -6.44155e+01 0.00000e+00 0.00000e+00 3.36197e+02 290.077 4.95226e+01 290.077 0.9927 
1 1 1 -5  87  6  o 17 1.33610e+01 5.60365e-01 2.42800e+02 96.323  -5.84348e+00 5.27321e+01  0.00000e+00 0.00000e+00 2.49144e+02 96.323  6.34448e+00 96.323  0.9905 
1 1 1 -5  87  7  o 5  7.70457e+00 6.33160e-01 1.52941e+02 216.310 -1.67237e+01 -1.22895e+01 0.00000e+00 0.00000e+00 1.26295e+02 216.310 2.66456e+01 36.310  0.9756 
1 1 1 -5  87  8  o 10 1.45386e+01 5.57153e-01 2.16701e+02 10.773  5.80813e+01  1.10509e+01  0.00000e+00 0.00000e+00 3.18456e+02 10.773  1.01755e+02 10.773  0.9915 
1 1 1 -5  87  9  o 18 7.85981e+00 7.14383e-01 1.19174e+02 311.142 1.14240e+01  -1.30760e+01 0.00000e+00 0.00000e+00 1.63884e+02 311.142 4.47097e+01 311.142 0.9708 
1 1 1 -5  87  10 o 8  3.73003e+00 9.67491e-01 8.80070e+00 227.141 -3.74964e-01 -4.04083e-01 0.00000e+00 0.00000e+00 2.79318e+01 227.141 1.91311e+01 227.141 0.2657 
1 1 1 -5  87  11 o 19 3.98435e+00 1.02368e+00 9.55566e+01 264.078 -6.99391e-01 -6.74295e+00 0.00000e+00 0.00000e+00 4.06486e+01 264.078 5.49080e+01 84.078  0.9230 
1 1 1 -5  87  12 o 12 2.66848e+00 8.82642e-01 5.09747e+01 147.396 -2.48448e+00 1.58912e+00  0.00000e+00 0.00000e+00 2.86296e+01 147.396 2.23451e+01 327.396 0.8062 
1 1 1 -5  87  13 f 0  3.15459e+00 9.84684e-01 9.41030e+01 301.939 3.45324e+00  -5.53938e+00 0.00000e+00 0.00000e+00 1.31701e+01 301.939 8.09329e+01 121.939 0.9198 
1 1 1 -5  87  14 o 17 4.20888e+00 1.16643e+00 6.23639e+01 194.888 -5.39596e+00 -1.43451e+00 0.00000e+00 0.00000e+00 7.83618e+01 194.888 1.59979e+01 194.888 0.9054 
1 1 1 -5  88  1  o 12 1.04184e+01 5.09858e-01 1.90809e+02 195.410 -2.87346e+01 -7.92011e+00 0.00000e+00 0.00000e+00 1.90604e+02 195.410 2.04763e-01 15.410  0.9831 
1 1 1 -5  88  2  o 8  7.38623e+00 5.47822e-01 1.56561e+02 332.392 1.51685e+01  -7.93247e+00 0.00000e+00 0.00000e+00 1.10264e+02 332.392 4.62969e+01 152.392 0.9703 
1 1 1 -5  88  3  o 18 1.12627e+01 6.18377e-01 1.51294e+02 358.120 2.41958e+01  -7.93978e-01 0.00000e+00 0.00000e+00 2.59104e+02 358.120 1.07810e+02 358.120 0.9791 
1 1 1 -5  88  4  o 15 4.81618e+00 8.57472e-01 9.02358e+01 272.435 2.47118e-01  -5.81107e+00 0.00000e+00 0.00000e+00 7.26966e+01 272.435 1.75391e+01 92.435  0.9094 
1 1 1 -5  88  5  o 4  6.83973e+00 7.53239e-01 1.56839e+02 122.721 -8.89489e+00 1.38442e+01  0.00000e+00 0.00000e+00 8.96271e+01 122.721 6.72117e+01 302.721 0.9691 
1 1 1 -5  88  6  o 8  4.41886e+00 8.61775e-01 8.71086e+01 113.709 -2.24884e+00 5.12089e+00  0.00000e+00 0.00000e+00 6.15943e+01 113.709 2.55143e+01 293.709 0.9055 
1 1 1 -5  88  7  o 16 5.11740e+00 8.41203e-01 1.07670e+02 241.059 -4.35134e+00 -7.86916e+00 0.00000e+00 0.00000e+00 7.14890e+01 241.059 3.61814e+01 61.059  0.9426 
1 1 1 -5  88  8  o 10 8.32073e+00 6.48169e-01 1.11319e+02 158.031 -1.49383e+01 6.02589e+00  0.00000e+00 0.00000e+00 1.87766e+02 158.031 7.64469e+01 158.031 0.9684 
1 1 1 -5  88  9  o 7  3.37992e+00 8.30541e-01 4.60604e+01 280.689 5.12511e-01  -2.71533e+00 0.00000e+00 0.00000e+00 5.30776e+01 280.689 7.01721e+00 280.689 0.7908 
1 1 1 -5  88  10 o 17 4.53050e+00 9.96847e-01 8.44056e+01 149.651 -5.59148e+00 3.27383e+00  0.00000e+00 0.00000e+00 6.99317e+01 149.651 1.44738e+01 329.651 0.9192 
1 1 1 -5  88  11 o 9  3.72925e+00 1.01988e+00 2.41327e+01 235.918 -9.54936e-01 -1.41140e+00 0.00000e+00 0.00000e+00 6.46164e+01 235.918 4.04837e+01 235.918 0.6427 
1 1 1 -5  88  12 o 17 2.59699e+00 8.64084e-01 5.16884e+01 49.281  2.10659e+00  2.44751e+00  0.00000e+00 0.00000e+00 2.76327e+01 49.281  2.40557e+01 229.281 0.8256 
1 1 1 -5  88  13 o 13 3.28853e+00 9.59589e-01 2.59750e+01 322.871 1.60351e+00  -1.21399e+00 0.00000e+00 0.00000e+00 5.90578e+01 322.871 3.30828e+01 322.871 0.6996 
1 1 1 -5  88  14 o 3  3.41123e+00 1.07106e+00 2.85823e+01 278.578 3.52323e-01  -2.33572e+00 0.00000e+00 0.00000e+00 6.57698e+01 278.578 3.71875e+01 278.578 0.7491 
1 1 1 -5  89  1  o 17 1.11234e+01 5.03951e-01 2.04653e+02 246.372 -1.34345e+01 -3.07099e+01 0.00000e+00 0.00000e+00 2.03254e+02 246.372 1.39926e+00 66.372  0.9850 
1 1 1 -5  89  2  o 17 7.25749e+00 5.72518e-01 1.03770e+02 66.123  4.66911e+00  1.05478e+01  0.00000e+00 0.00000e+00 1.54364e+02 66.123  5.05941e+01 66.123  0.9556 
1 1 1 -5  89  3  o 18 6.51193e+00 6.81158e-01 1.35460e+02 350.252 1.24852e+01  -2.14484e+00 0.00000e+00 0.00000e+00 9.70589e+01 350.252 3.84010e+01 170.252 0.9597 
1 1 1 -5  89  4  f 0  7.19761e+00 7.48874e-01 7.01422e+01 128.840 -4.95578e+00 6.15486e+00  0.00000e+00 0.00000e+00 1.79985e+02 128.840 1.09843e+02 128.840 0.9344 
1 1 1 -5  89  5  f 0  1.58254e+01 7.28584e-01 2.68211e+02 278.551 9.74613e+00  -6.48144e+01 0.00000e+00 0.00000e+00 3.15569e+02 278.551 4.73573e+01 278.551 0.9923 
1 1 1 -5  89  6  o 6  5.89276e+00 7.93028e-01 7.76342e+01 223.910 -4.79855e+00 -4.61940e+00 0.00000e+00 0.00000e+00 1.24124e+02 223.910 4.64900e+01 223.910 0.9215 
1 1 1 -5  89  7  o 11 9.34286e+00 6.70533e-01 1.34238e+02 163.701 -2.16571e+01 6.33261e+00  0.00000e+00 0.00000e+00 2.04898e+02 163.701 7.06602e+01 163.701 0.9776 
1 1 1 -5  89  8  o 17 9.19629e+00 6.33342e-01 1.48653e+02 301.263 1.42832e+01  -2.35259e+01 0.00000e+00 0.00000e+00 1.86334e+02 301.263 3.76814e+01 301.263 0.9817 
1 1 1 -5  89  9  o 15 8.20126e+00 7.08564e-01 9.89764e+01 294.959 6.14532e+00  -1.32036e+01 0.00000e+00 0.00000e+00 1.94493e+02 294.959 9.55169e+01 294.959 0.9650 
1 1 1 -5  89  10 o 6  4.69940e+00 9.53013e-01 3.06989e+01 117.527 -1.22996e+00 2.36002e+00  0.00000e+00 0.00000e+00 1.05367e+02 117.527 7.46682e+01 117.527 0.7815 
1 1 1 -5  89  11 o 5  8.39467e+00 8.71466e-01 1.39024e+02 287.003 7.13169e+00  -2.33221e+01 0.00000e+00 0.00000e+00 1.65306e+02 287.003 2.62825e+01 287.003 0.9793 
1 1 1 -5  89  12 o 6  7.68457e+00 1.01887e+00 9.64530e+01 172.081 -1.62199e+01 2.25610e+00  0.00000e+00 0.00000e+00 1.78952e+02 172.081 8.24991e+01 172.081 0.9690 
1 1 1 -5  89  13 o 3  7.77250e+00 1.09434e+00 1.15962e+02 264.145 -2.00517e+00 -1.95533e+01 0.00000e+00 0.00000e+00 1.63834e+02 264.145 4.78714e+01 264.145 0.9742 
1 1 1 -5  89  14 o 17 3.25829e+00 1.03164e+00 3.16812e+01 62.580  1.29117e+00  2.48883e+00  0.00000e+00 0.00000e+00 6.38593e+01 62.580  3.21781e+01 62.580  0.7944 
1 1 1 -5  90  1  o 17 7.62210e+00 5.76306e-01 9.98308e+01 324.439 9.22316e+00  -6.59371e+00 0.00000e+00 0.00000e+00 1.71060e+02 324.439 7.12296e+01 324.439 0.9548 
1 1 1 -5  90  2  o 2  4.26259e+00 7.80003e-01 8.52334e+01 10.452  4.86003e+00  8.96571e-01  0.00000e+00 0.00000e+00 5.62537e+01 10.452  2.89796e+01 190.452 0.8920 
1 1 1 -5  90  3  o 7  2.20627e+00 6.66492e-01 4.16831e+01 266.137 -1.00424e-01 -1.48724e+00 0.00000e+00 0.00000e+00 7.04928e+00 266.137 3.46338e+01 86.137  0.5938 
1 1 1 -5  90  4  o 6  7.08204e+00 7.17946e-01 1.17259e+02 185.326 -1.27608e+01 -1.18968e+00 0.00000e+00 0.00000e+00 1.35575e+02 185.326 1.83167e+01 185.326 0.9602 
1 1 1 -5  90  5  o 13 9.64327e+00 7.38307e-01 1.34639e+02 324.665 1.69806e+01  -1.20384e+01 0.00000e+00 0.00000e+00 2.15030e+02 324.665 8.03905e+01 324.665 0.9757 
1 1 1 -5  90  6  o 13 4.48547e+00 8.82681e-01 1.02942e+02 101.654 -1.49110e+00 7.22943e+00  0.00000e+00 0.00000e+00 5.19326e+01 101.654 5.10093e+01 281.654 0.9296 
1 1 1 -5  90  7  o 6  5.40794e+00 8.75456e-01 1.42976e+02 252.104 -3.93039e+00 -1.21718e+01 0.00000e+00 0.00000e+00 4.97632e+01 252.104 9.32132e+01 72.104  0.9601 
1 1 1 -5  90  8  o 1  1.34788e+01 6.65600e-01 2.24558e+02 124.976 -3.04450e+01 4.35191e+01  0.00000e+00 0.00000e+00 2.70745e+02 124.976 4.61866e+01 124.976 0.9905 
1 1 1 -5  90  9  o 19 3.45342e+00 9.31751e-01 7.14584e+01 95.965  -4.40543e-01 4.21600e+00  0.00000e+00 0.00000e+00 4.01917e+01 95.965  3.12667e+01 275.965 0.8721 
1 1 1 -5  90  10 o 17 3.15903e+00 9.23915e-01 2.21542e+01 296.870 6.33172e-01  -1.24967e+00 0.00000e+00 0.00000e+00 4.46237e+01 296.870 2.24695e+01 296.870 0.5707 
1 1 1 -5  90  11 o 15 3.60060e+00 1.01542e+00 4.56001e+01 95.606  -3.00000e-01 3.05618e+00  0.00000e+00 0.00000e+00 6.30196e+01 95.606  1.74195e+01 95.606  0.8151 
1 1 1 -5  90  12 o 1  3.37314e+00 1.00551e+00 6.73748e+01 31.327  4.24893e+00  2.58611e+00  0.00000e+00 0.00000e+00 4.39811e+01 31.327  2.33937e+01 211.327 0.8928 
1 1 1 -5  90  13 o 8  5.34327e+00 1.16181e+00 7.52694e+01 349.304 8.79787e+00  -1.66173e+00 0.00000e+00 0.00000e+00 1.10746e+02 349.304 3.54770e+01 349.304 0.9424 
1 1 1 -5  90  14 o 6  2.34893e+00 8.21223e-01 3.77877e+01 5.950   2.76516e+00  2.88178e-01  0.00000e+00 0.00000e+00 3.08941e+01 5.950   6.89362e+00 185.950 0.7923 
1 1 1 -5  91  1  o 17 4.02532e+00 7.49868e-01 5.22346e+01 166.174 -3.19766e+00 7.86965e-01  0.00000e+00 0.00000e+00 7.20202e+01 166.174 1.97856e+01 166.174 0.8295 
1 1 1 -5  91  2  o 4  8.99090e+00 5.40010e-01 1.46263e+02 182.653 -2.17289e+01 -1.00669e+00 0.00000e+00 0.00000e+00 1.80431e+02 182.653 3.41687e+01 182.653 0.9767 
1 1 1 -5  91  3  o 2  8.39237e+00 5.61297e-01 9.59368e+01 341.370 1.25890e+01  -4.24403e+00 0.00000e+00 0.00000e+00 2.04175e+02 341.370 1.08239e+02 341.370 0.9616 
1 1 1 -5  91  4  o 19 2.71233e+00 7.20523e-01 3.15368e+01 98.830  -2.03426e-01 1.30947e+00  0.00000e+00 0.00000e+00 2.39023e+01 98.830  7.63456e+00 278.830 0.5499 
1 1 1 -5  91  5  o 1  8.93929e+00 7.04794e-01 1.36650e+02 285.444 5.55650e+00  -2.01120e+01 0.00000e+00 0.00000e+00 1.87431e+02 285.444 5.07810e+01 285.444 0.9757 
1 1 1 -5  91  6  o 15 9.62247e+00 6.82059e-01 2.07256e+02 128.311 -2.21444e+01 2.80288e+01  0.00000e+00 0.00000e+00 1.45039e+02 128.311 6.22174e+01 308.311 0.9859 
1 1 1 -5  91  7  o 14 8.74295e+00 7.09663e-01 1.70484e+02 80.615  4.49246e+00  2.71812e+01  0.00000e+00 0.00000e+00 1.48048e+02 80.615  2.24359e+01 260.615 0.9817 
1 1 1 -5  91  8  o 13 5.06723e+00 9.88255e-01 8.05825e+01 297.269 2.99549e+00  -5.81136e+00 0.00000e+00 0.00000e+00 9.23151e+01 297.269 1.17326e+01 297.269 0.9200 
1 1 1 -5  91  9  o 1  1.14401e+01 6.42409e-01 2.43583e+02 225.668 -4.04125e+01 -4.13658e+01 0.00000e+00 0.00000e+00 1.76726e+02 225.668 6.68571e+01 45.668  0.9913 
1 1 1 -5  91  10 o 15 4.58233e+00 9.62758e-01 1.05623e+02 42.677  6.54869e+00  6.03816e+00  0.00000e+00 0.00000e+00 5.42434e+01 42.677  5.13799e+01 222.677 0.9421 
1 1 1 -5  91  11 o 18 3.81022e+00 1.02293e+00 1.02879e+02 242.837 -3.50382e+00 -6.82855e+00 0.00000e+00 0.00000e+00 2.85709e+01 242.837 7.43082e+01 62.837  0.9324 
1 1 1 -5  91  12 o 8  3.00573e+00 9.45160e-01 9.25966e+00 88.218  1.96680e-02  6.32168e-01  0.00000e+00 0.00000e+00 2.42320e+01 88.218  1.49723e+01 88.218  0.3014 
1 1 1 -5  91  13 o 11 3.39444e+00 1.04264e+00 7.08563e+01 35.407  5.02943e+00  3.57521e+00  0.00000e+00 0.00000e+00 4.38443e+01 35.407  2.70120e+01 215.407 0.9149 
1 1 1 -5  92  1  o 14 1.10367e+01 5.10571e-01 1.53821e+02 236.578 -1.57073e+01 -2.38014e+01 0.00000e+00 0.00000e+00 2.49514e+02 236.578 9.56925e+01 236.578 0.9823 
1 1 1 -5  92  2  o 5  6.21770e+00 6.49673e-01 8.14801e+01 74.118  2.19769e+00  7.72441e+00  0.00000e+00 0.00000e+00 1.34853e+02 74.118  5.33729e+01 74.118  0.9355 
1 1 1 -5  92  3  o 17 8.95973e+00 5.54025e-01 1.55751e+02 136.855 -1.68123e+01 1.57574e+01  0.00000e+00 0.00000e+00 1.70052e+02 136.855 1.43012e+01 136.855 0.9781 
1 1 1 -5  92  4  o 19 3.72829e+00 7.68526e-01 1.17361e+02 28.557  5.66159e+00  3.08132e+00  0.00000e+00 0.00000e+00 9.94106e+00 28.557  1.07420e+02 208.557 0.9188 
1 1 1 -5  92  5  o 18 2.40560e+00 7.66874e-01 5.30043e+01 95.073  -1.90922e-01 2.15073e+00  0.00000e+00 0.00000e+00 1.15353e+01 95.073  4.14690e+01 275.073 0.7223 
1 1 1 -5  92  6  o 5  4.62671e+00 8.98001e-01 1.11066e+02 52.854  5.07363e+00  6.69742e+00  0.00000e+00 0.00000e+00 5.01338e+01 52.854  6.09318e+01 232.854 0.9385 
1 1 1 -5  92  7  o 18 1.59865e+01 6.18164e-01 3.26814e+02 168.891 -9.96276e+01 1.95619e+01  0.00000e+00 0.00000e+00 2.63417e+02 168.891 6.33975e+01 348.891 0.9951 
1 1 1 -5  92  8  o 11 5.14413e+00 9.98777e-01 9.35223e+01 290.809 2.63071e+00  -6.92219e+00 0.00000e+00 0.00000e+00 8.38272e+01 290.809 9.69511e+00 110.809 0.9298 
1 1 1 -5  92  9  o 18 3.30780e+00 8.91786e-01 3.18380e+01 41.624  1.51193e+00  1.34348e+00  0.00000e+00 0.00000e+00 5.41333e+01 41.624  2.22953e+01 41.624  0.7014 
1 1 1 -5  92  10 o 16 3.03315e+00 9.23606e-01 8.54657e+01 72.196  1.59091e+00  4.95401e+00  0.00000e+00 0.00000e+00 1.53656e+01 72.196  7.01001e+01 252.196 0.8979 
1 1 1 -5  92  11 o 12 4.01729e+00 1.06666e+00 7.95919e+01 261.372 -9.82667e-01 -6.47592e+00 0.00000e+00 0.00000e+00 5.71485e+01 261.372 2.24434e+01 81.372  0.9201 
1 1 1 -5  92  12 o 17 3.94336e+00 1.07795e+00 5.83700e+01 284.330 1.21524e+00  -4.75715e+00 0.00000e+00 0.00000e+00 7.15230e+01 284.330 1.31530e+01 284.330 0.8913 
1 1 1 -5  92  13 o 19 3.08917e+00 9.86393e-01 7.32248e+01 72.847  1.82138e+00  5.90107e+00  0.00000e+00 0.00000e+00 3.11427e+01 72.847  4.20822e+01 252.847 0.9150 
1 1 1 -5  93  1  o 2  8.08746e+00 5.68567e-01 1.55519e+02 320.421 1.59023e+01  -1.31459e+01 0.00000e+00 0.00000e+00 1.37901e+02 320.421 1.76176e+01 140.421 0.9755 
1 1 1 -5  93  2  o 4  2.28676e+00 6.94198e-01 6.80449e+01 355.345 2.42679e+00  -1.97609e-01 0.00000e+00 0.00000e+00 3.61764e+00 175.345 7.16626e+01 175.345 0.7577 
1 1 1 -5  93  3  o 11 1.19003e+01 5.12623e-01 1.79879e+02 180.971 -3.46567e+01 -5.87364e-01 0.00000e+00 0.00000e+00 2.56023e+02 180.971 7.61445e+01 180.971 0.9855 
1 1 1 -5  93  4  o 3  4.18875e+00 8.03547e-01 1.08846e+02 12.017  6.71903e+00  1.43022e+00  0.00000e+00 0.00000e+00 3.49625e+01 12.017  7.38836e+01 192.017 0.9240 
1 1 1 -5  93  5  o 4  3.61256e+00 8.84531e-01 2.03785e+01 222.722 -8.75586e-01 -8.08588e-01 0.00000e+00 0.00000e+00 4.80747e+01 222.722 2.76962e+01 222.722 0.5102 
1 1 1 -5  93  6  o 4  5.25600e+00 8.92683e-01 5.55811e+01 51.122  3.08125e+00  3.82163e+00  0.00000e+00 0.00000e+00 1.18284e+02 51.122  6.27029e+01 51.122  0.8912 
1 1 1 -5  93  7  o 17 9.94867e+00 7.76212e-01 1.78688e+02 349.503 3.20013e+01  -5.92958e+00 0.00000e+00 0.00000e+00 1.84636e+02 349.503 5.94722e+00 349.503 0.9845 
1 1 1 -5  93  8  o 13 1.35315e+01 6.75373e-01 2.34911e+02 230.192 -4.01978e+01 -4.82324e+01 0.00000e+00 0.00000e+00 2.62687e+02 230.192 2.77752e+01 230.192 0.9920 
1 1 1 -5  93  9  o 10 5.21321e+00 1.08194e+00 4.99837e+01 60.096  2.22587e+00  3.87036e+00  0.00000e+00 0.00000e+00 1.19818e+02 60.096  6.98344e+01 60.096  0.8793 
1 1 1 -5  93  10 o 3  4.18412e+00 1.02811e+00 4.25399e+01 255.849 -7.99862e-01 -3.17239e+00 0.00000e+00 0.00000e+00 8.57283e+01 255.849 4.31885e+01 255.849 0.8282 
1 1 1 -5  93  11 o 10 4.08544e+00 1.00614e+00 5.14055e+01 169.464 -4.25372e+00 7.91152e-01  0.00000e+00 0.00000e+00 8.08003e+01 169.464 2.93948e+01 169.464 0.8750 
1 1 1 -5  93  12 o 8  3.62267e+00 1.00995e+00 6.68251e+01 324.522 4.82384e+00  -3.43797e+00 0.00000e+00 0.00000e+00 5.51383e+01 324.522 1.16869e+01 144.522 0.9112 
1 1 1 -5  93  13 o 5  3.53444e+00 1.05204e+00 3.26961e+01 152.803 -2.56022e+00 1.31560e+00  0.00000e+00 0.00000e+00 7.17555e+01 152.803 3.90594e+01 152.803 0.8006 
1 1 1 -5  94  1  o 12 5.84605e+00 7.03907e-01 6.30908e+01 64.088  2.61998e+00  5.39272e+00  0.00000e+00 0.00000e+00 1.35223e+02 64.088  7.21318e+01 64.088  0.9123 
1 1 1 -5  94  2  o 16 1.31013e+01 5.10199e-01 2.07549e+02 269.260 -5.68226e-01 -4.40042e+01 0.00000e+00 0.00000e+00 2.73902e+02 269.260 6.63531e+01 269.260 0.9886 
1 1 1 -5  94  3  o 6  1.16788e+01 5.22796e-01 2.48213e+02 91.850  -1.57460e+00 4.87597e+01  0.00000e+00 0.00000e+00 1.81302e+02 91.850  6.69116e+01 271.850 0.9897 
1 1 1 -5  94  4  f 0  5.57191e+00 7.04925e-01 4.45221e+01 14.351  3.91770e+00  1.00236e+00  0.00000e+00 0.00000e+00 1.34543e+02 14.351  9.00208e+01 14.351  0.8652 
1 1 1 -5  94  5  o 14 5.29131e+00 7.84809e-01 1.01228e+02 331.632 8.17172e+00  -4.41256e+00 0.00000e+00 0.00000e+00 8.43235e+01 331.632 1.69042e+01 151.632 0.9445 
1 1 1 -5  94  6  o 11 5.18359e+00 9.31933e-01 1.36126e+02 30.875  9.79882e+00  5.85858e+00  0.00000e+00 0.00000e+00 4.75934e+01 30.875  8.85331e+01 210.875 0.9551 
1 1 1 -5  94  7  o 16 9.28390e+00 7.77788e-01 1.68538e+02 78.709  5.82990e+00  2.91997e+01  0.00000e+00 0.00000e+00 1.69922e+02 78.709  1.38417e+00 78.709  0.9831 
1 1 1 -5  94  8  o 4  2.77080e+00 8.60122e-01 3.62926e+01 206.333 -1.65964e+00 -8.21438e-01 0.00000e+00 0.00000e+00 3.26997e+01 206.333 3.59288e+00 26.333  0.6719 
1 1 1 -5  94  9  o 6  2.48063e+00 8.24799e-01 6.35631e+01 198.959 -3.01801e+00 -1.03678e+00 0.00000e+00 0.00000e+00 1.20593e+01 198.959 5.15038e+01 18.959  0.8232 
1 1 1 -5  94  10 o 11 3.07448e+00 9.22185e-01 4.98388e+01 269.603 -2.23568e-02 -3.23006e+00 0.00000e+00 0.00000e+00 4.40963e+01 269.603 5.74247e+00 89.603  0.8257 
1 1 1 -5  94  11 o 16 8.22987e+00 9.05192e-01 1.14338e+02 239.949 -1.11724e+01 -1.93117e+01 0.00000e+00 0.00000e+00 1.83049e+02 239.949 6.87107e+01 239.949 0.9773 
1 1 1 -5  94  12 o 12 6.35262e+00 1.13180e+00 1.01624e+02 106.045 -3.82752e+00 1.33090e+01  0.00000e+00 0.00000e+00 1.24404e+02 106.045 2.27799e+01 106.045 0.9632 
1 1 1 -5  94  13 o 6  2.88201e+00 9.48449e-01 5.03209e+01 336.276 3.76303e+00  -1.65373e+00 0.00000e+00 0.00000e+00 4.19597e+01 336.276 8.36117e+00 156.276 0.8676 
1 1 1 -5  95  1  o 6  5.96262e+00 6.95859e-01 1.05129e+02 10.919  9.72585e+00  1.87622e+00  0.00000e+00 0.00000e+00 1.05022e+02 10.919  1.06730e-01 190.919 0.9481 
1 1 1 -5  95  2  o 6  6.63003e+00 6.28408e-01 8.28938e+01 244.212 -4.31634e+00 -8.93356e+00 0.00000e+00 0.00000e+00 1.50734e+02 244.212 6.78402e+01 244.212 0.9482 
1 1 1 -5  95  3  o 15 2.30516e+00 7.09333e-01 2.96573e+01 109.172 -3.65444e-01 1.05104e+00  0.00000e+00 0.00000e+00 1.18702e+01 109.172 1.77872e+01 289.172 0.4849 
1 1 1 -5  95  4  o 5  3.78585e+00 8.38681e-01 7.07795e+01 14.952  4.37285e+00  1.16774e+00  0.00000e+00 0.00000e+00 5.30909e+01 14.952  1.76885e+01 194.952 0.8811 
1 1 1 -5  95  5  o 10 1.05917e+01 5.44134e-01 1.23994e+02 252.414 -8.32882e+00 -2.62787e+01 0.00000e+00 0.00000e+00 2.61942e+02 252.414 1.37948e+02 252.414 0.9817 
1 1 1 -5  95  6  o 6  5.48315e+00 9.47570e-01 8.16033e+01 351.806 7.37175e+00  -1.06143e+00 0.00000e+00 0.00000e+00 1.07612e+02 351.806 2.60089e+01 351.806 0.9302 
1 1 1 -5  95  7  o 11 1.11472e+01 7.29284e-01 1.22367e+02 202.726 -2.37152e+01 -9.93274e+00 0.00000e+00 0.00000e+00 2.82797e+02 202.726 1.60430e+02 202.726 0.9804 
1 1 1 -5  95  8  o 5  4.38043e+00 9.57956e-01 8.41706e+01 161.674 -6.39727e+00 2.11887e+00  0.00000e+00 0.00000e+00 6.55489e+01 161.674 1.86217e+01 341.674 0.9225 
1 1 1 -5  95  9  o 16 4.30298e+00 1.08199e+00 1.05175e+02 197.958 -7.73198e+00 -2.50600e+00 0.00000e+00 0.00000e+00 4.39900e+01 197.958 6.11847e+01 17.958  0.9363 
1 1 1 -5  95  10 o 1  4.15279e+00 1.07185e+00 7.02092e+01 64.547  2.49987e+00  5.25224e+00  0.00000e+00 0.00000e+00 6.95067e+01 64.547  7.02538e-01 244.547 0.9094 
1 1 1 -5  95  11 o 4  3.35369e+00 9.61157e-01 4.56912e+01 84.114  3.52274e-01  3.41703e+00  0.00000e+00 0.00000e+00 5.81475e+01 84.114  1.24563e+01 84.114  0.8376 
1 1 1 -5  95  12 o 2  4.09245e+00 1.10709e+00 3.32973e+01 277.517 4.08738e-01  -3.09746e+00 0.00000e+00 0.00000e+00 9.04485e+01 277.517 5.71512e+01 277.517 0.8188 
1 1 1 -5  95  13 o 9  3.88005e+00 1.12048e+00 6.18611e+01 53.525  3.51652e+00  4.75666e+00  0.00000e+00 0.00000e+00 6.85554e+01 53.525  6.69428e+00 53.525  0.9110 
1 1 1 -5  96  1  o 13 2.64887e+00 7.63637e-01 6.14703e+01 261.015 -4.04407e-01 -2.55778e+00 0.00000e+00 0.00000e+00 1.47647e+01 261.015 4.67056e+01 81.015  0.7744 
1 1 1 -5  96  2  o 16 7.54058e+00 6.20618e-01 1.19363e+02 305.787 9.68708e+00  -1.34380e+01 0.00000e+00 0.00000e+00 1.52206e+02 305.787 3.28428e+01 305.787 0.9693 
1 1 1 -5  96  3  o 2  6.27162e+00 6.75899e-01 6.51808e+01 327.718 6.17082e+00  -3.89825e+00 0.00000e+00 0.00000e+00 1.51150e+02 327.718 8.59690e+01 327.718 0.9287 
1 1 1 -5  96  4  o 13 9.69398e+00 5.59726e-01 1.77242e+02 265.168 -2.86644e+00 -3.39085e+01 0.00000e+00 0.00000e+00 1.77322e+02 265.168 8.01095e-02 265.168 0.9852 
1 1 1 -5  96  5  o 18 4.40781e+00 8.31969e-01 9.81213e+01 234.723 -4.36274e+00 -6.16695e+00 0.00000e+00 0.00000e+00 5.41959e+01 234.723 4.39253e+01 54.723  0.9312 
1 1 1 -5  96  6  o 15 3.19058e+00 8.07026e-01 4.39870e+01 20.203  2.46681e+00  9.07737e-01  0.00000e+00 0.00000e+00 4.81080e+01 20.203  4.12104e+00 20.203  0.7783 
1 1 1 -5  96  7  o 16 7.35888e+00 9.24740e-01 1.18028e+02 97.168  -1.89317e+00 1.50539e+01  0.00000e+00 0.00000e+00 1.45584e+02 97.168  2.75562e+01 97.168  0.9665 
1 1 1 -5  96  8  o 7  9.35048e+00 8.42880e-01 1.35163e+02 81.859  3.78180e+00  2.64352e+01  0.00000e+00 0.00000e+00 2.04640e+02 81.859  6.94766e+01 81.859  0.9811 
1 1 1 -5  96  9  o 19 5.17925e+00 1.06305e+00 1.06555e+02 134.459 -6.93477e+00 7.06703e+00  0.00000e+00 0.00000e+00 7.51959e+01 134.459 3.13591e+01 314.459 0.9481 
1 1 1 -5  96  10 o 1  9.22967e+00 9.76461e-01 1.39063e+02 195.428 -2.83475e+01 -7.82337e+00 0.00000e+00 0.00000e+00 1.96444e+02 195.428 5.73815e+01 195.428 0.9828 
1 1 1 -5  96  11 o 9  3.71892e+00 1.06731e+00 7.11048e+01 307.524 3.46375e+00  -4.51014e+00 0.00000e+00 0.00000e+00 5.35711e+01 307.524 1.75337e+01 127.524 0.9072 
1 1 1 -5  96  12 o 14 3.60012e+00 1.05836e+00 3.99588e+01 113.821 -1.47718e+00 3.34588e+00  0.00000e+00 0.00000e+00 7.28795e+01 113.821 3.29208e+01 113.821 0.8489 
1 1 1 -5  97  1  o 1  1.06853e+01 5.38985e-01 1.80534e+02 332.815 3.24528e+01  -1.66678e+01 0.00000e+00 0.00000e+00 2.10996e+02 332.815 3.04622e+01 332.815 0.9862 
1 1 1 -5  97  2  o 8  5.64807e+00 7.19994e-01 5.88328e+01 53.292  3.55855e+00  4.77285e+00  0.00000e+00 0.00000e+00 1.32420e+02 53.292  7.35870e+01 53.292  0.9116 
1 1 1 -5  97  3  o 14 6.10061e+00 6.90070e-01 1.25072e+02 268.731 -3.15959e-01 -1.42587e+01 0.00000e+00 0.00000e+00 9.33570e+01 268.731 3.17152e+01 88.731  0.9643 
1 1 1 -5  97  4  o 2  4.60142e+00 9.32158e-01 8.19004e+01 283.816 1.45663e+00  -5.92307e+00 0.00000e+00 0.00000e+00 7.41754e+01 283.816 7.72504e+00 103.816 0.9139 
1 1 1 -5  97  5  o 11 5.95871e+00 7.67477e-01 1.24859e+02 100.109 -2.39917e+00 1.34571e+01  0.00000e+00 0.00000e+00 8.79499e+01 100.109 3.69087e+01 280.109 0.9627 
1 1 1 -5  97  6  o 11 4.20488e+00 8.91069e-01 7.90605e+01 215.365 -4.68217e+00 -3.32311e+00 0.00000e+00 0.00000e+00 6.25267e+01 215.365 1.65338e+01 35.365  0.9081 
1 1 1 -5  97  7  o 16 3.81277e+00 9.83593e-01 9.10182e+01 95.538  -6.06454e-01 6.25472e+00  0.00000e+00 0.00000e+00 3.84775e+01 95.538  5.25408e+01 275.538 0.9166 
1 1 1 -5  97  8  f 0  8.36138e+00 8.91320e-01 1.16307e+02 111.303 -6.80429e+00 1.74495e+01  0.00000e+00 0.00000e+00 1.84942e+02 111.303 6.86346e+01 111.303 0.9729 
1 1 1 -5  97  9  o 18 2.64481e+00 8.55653e-01 4.94810e+01 52.789  1.74939e+00  2.30381e+00  0.00000e+00 0.00000e+00 2.89843e+01 52.789  2.04966e+01 232.789 0.8017 
1 1 1 -5  97  10 o 13 5.12618e+00 9.85610e-01 9.54443e+01 7.210   1.08990e+01  1.37875e+00  0.00000e+00 0.00000e+00 8.52549e+01 7.210   1.01894e+01 187.210 0.9533 
1 1 1 -5  97  11 o 10 3.84007e+00 1.10049e+00 1.19833e+02 124.307 -5.62480e+00 8.24336e+00  0.00000e+00 0.00000e+00 1.47283e+01 124.307 1.05105e+02 304.307 0.9485 
1 1 1 -5  97  12 o 12 2.58242e+00 8.70988e-01 7.24935e+01 258.692 -1.08884e+00 -5.44510e+00 0.00000e+00 0.00000e+00 1.37517e+01 258.692 5.87418e+01 78.692  0.9048 
1 1 1 -5  98  1  o 16 3.20409e+00 8.30937e-01 6.77146e+01 182.301 -3.77397e+00 -1.51665e-01 0.00000e+00 0.00000e+00 3.39684e+01 182.301 3.37462e+01 2.301   0.8544 
1 1 1 -5  98  2  o 16 6.39507e+00 6.77869e-01 1.08973e+02 257.670 -2.79353e+00 -1.27802e+01 0.00000e+00 0.00000e+00 1.19237e+02 257.670 1.02643e+01 257.670 0.9610 
1 1 1 -5  98  3  o 2  8.52189e+00 5.96736e-01 1.41546e+02 79.730  4.11537e+00  2.27138e+01  0.00000e+00 0.00000e+00 1.67864e+02 79.730  2.63176e+01 79.730  0.9781 
1 1 1 -5  98  4  o 4  7.28818e+00 7.60406e-01 1.75338e+02 213.309 -1.79145e+01 -1.17717e+01 0.00000e+00 0.00000e+00 8.87081e+01 213.309 8.66300e+01 33.309  0.9764 
1 1 1 -5  98  5  o 10 2.27813e+00 7.16957e-01 5.35314e+01 182.123 -2.39324e+00 -8.87201e-02 0.00000e+00 0.00000e+00 1.00954e+01 182.123 4.34360e+01 2.123   0.7531 
1 1 1 -5  98  6  o 9  6.60984e+00 7.65294e-01 1.09661e+02 113.959 -5.63394e+00 1.26783e+01  0.00000e+00 0.00000e+00 1.26350e+02 113.959 1.66887e+01 113.959 0.9633 
1 1 1 -5  98  7  o 8  8.55398e+00 7.35685e-01 1.71669e+02 69.013  1.12656e+01  2.93686e+01  0.00000e+00 0.00000e+00 1.40141e+02 69.013  3.15282e+01 249.013 0.9840 
1 1 1 -5  98  8  o 5  8.02558e+00 9.07236e-01 1.36342e+02 346.399 2.15672e+01  -5.21793e+00 0.00000e+00 0.00000e+00 1.54001e+02 346.399 1.76587e+01 346.399 0.9772 
1 1 1 -5  98  9  f 0  3.11077e+00 9.37617e-01 4.46402e+01 96.354  -3.40489e-01 3.05790e+00  0.00000e+00 0.00000e+00 4.92096e+01 96.354  4.56936e+00 96.354  0.8155 
1 1 1 -5  98  10 o 5  2.77960e+00 9.05900e-01 1.24698e+01 304.722 4.79693e-01  -6.92206e-01 0.00000e+00 0.00000e+00 2.73649e+01 304.722 1.48951e+01 304.722 0.3877 
1 1 1 -5  98  11 o 5  3.91623e+00 1.08815e+00 3.21484e+01 209.346 -2.62089e+00 -1.47355e+00 0.00000e+00 0.00000e+00 8.50827e+01 209.346 5.29343e+01 209.346 0.8105 
1 1 1 -5  98  12 o 1  2.75281e+00 9.19842e-01 2.95423e+01 333.309 2.11867e+00  -1.06517e+00 0.00000e+00 0.00000e+00 4.66692e+01 333.309 1.71269e+01 333.309 0.7502 
1 1 1 -5  99  1  o 2  3.35296e+00 7.85636e-01 4.91190e+01 40.189  2.20443e+00  1.86219e+00  0.00000e+00 0.00000e+00 5.06357e+01 40.189  1.51669e+00 40.189  0.8012 
1 1 1 -5  99  2  o 1  7.77910e+00 6.24553e-01 1.61776e+02 65.514  1.01063e+01  2.21908e+01  0.00000e+00 0.00000e+00 1.21030e+02 65.514  4.07459e+01 245.514 0.9793 
1 1 1 -5  99  3  o 5  4.75406e+00 8.39839e-01 8.00273e+01 135.369 -4.36960e+00 4.31369e+00  0.00000e+00 0.00000e+00 8.13126e+01 135.369 1.28526e+00 135.369 0.9145 
1 1 1 -5  99  4  o 11 4.78135e+00 8.41478e-01 8.25415e+01 220.697 -5.49702e+00 -4.72767e+00 0.00000e+00 0.00000e+00 8.20948e+01 220.697 4.46667e-01 40.697  0.9282 
1 1 1 -5  99  5  o 7  3.87240e+00 8.39219e-01 6.63368e+01 98.532  -6.90523e-01 4.60293e+00  0.00000e+00 0.00000e+00 6.06884e+01 98.532  5.64839e+00 278.532 0.8847 
1 1 1 -5  99  6  o 6  4.34625e+00 8.77326e-01 1.00133e+02 213.469 -7.04100e+00 -4.65495e+00 0.00000e+00 0.00000e+00 5.10641e+01 213.469 4.90690e+01 33.469  0.9387 
1 1 1 -5  99  7  o 6  9.14432e+00 6.89670e-01 1.85276e+02 22.748  3.42554e+01  1.43632e+01  0.00000e+00 0.00000e+00 1.48800e+02 22.748  3.64768e+01 202.748 0.9864 
1 1 1 -5  99  8  o 9  4.85796e+00 1.08666e+00 4.88426e+01 66.149  1.70787e+00  3.86291e+00  0.00000e+00 0.00000e+00 1.07871e+02 66.149  5.90281e+01 66.149  0.8716 
1 1 1 -5  99  9  o 15 4.70381e+00 1.10254e+00 3.56616e+01 313.834 2.39551e+00  -2.49509e+00 0.00000e+00 0.00000e+00 1.10285e+02 313.834 7.46236e+01 313.834 0.8389 
1 1 1 -5  99  10 o 12 3.52925e+00 1.04057e+00 6.46297e+01 95.829  -5.10249e-01 4.99789e+00  0.00000e+00 0.00000e+00 5.19621e+01 95.829  1.26676e+01 275.829 0.8939 
1 1 1 -5  99  11 o 11 3.13014e+00 9.95249e-01 5.74496e+01 53.683  2.86141e+00  3.89294e+00  0.00000e+00 0.00000e+00 4.53372e+01 53.683  1.21124e+01 233.683 0.8893 
1 1 1 -5  100 1  o 16 1.37144e+01 5.38888e-01 2.22190e+02 103.077 -1.27142e+01 5.47367e+01  0.00000e+00 0.00000e+00 2.82402e+02 103.077 6.02123e+01 103.077 0.9911 
1 1 1 -5  100 2  o 12 2.15736e+00 6.96116e-01 3.59594e+01 291.332 5.37916e-01  -1.37741e+00 0.00000e+00 0.00000e+00 1.13470e+01 291.332 2.46124e+01 111.332 0.5908 
1 1 1 -5  100 3  o 5  2.51804e+00 7.22946e-01 6.40296e+01 117.327 -1.45162e+00 2.80924e+00  0.00000e+00 0.00000e+00 1.26965e+01 117.327 5.13331e+01 297.327 0.8213 
1 1 1 -5  100 4  o 10 3.16873e+00 9.04324e-01 5.21017e+01 252.157 -8.67162e-01 -2.69395e+00 0.00000e+00 0.00000e+00 4.15087e+01 252.157 1.05930e+01 72.157  0.7966 
1 1 1 -5  100 5  o 17 2.87375e+00 8.12804e-01 5.70769e+01 195.999 -2.98507e+00 -8.55926e-01 0.00000e+00 0.00000e+00 3.00040e+01 195.999 2.70730e+01 15.999  0.8175 
1 1 1 -5  100 6  o 2  6.77661e+00 7.68643e-01 8.00532e+01 2.666   1.13828e+01  5.29982e-01  0.00000e+00 0.00000e+00 1.59723e+02 2.666   7.96693e+01 2.666   0.9551 
1 1 1 -5  100 7  f 0  3.30282e+00 8.86544e-01 6.37857e+01 7.005   4.30596e+00  5.29091e-01  0.00000e+00 0.00000e+00 4.32635e+01 7.005   2.05222e+01 187.005 0.8754 
1 1 1 -5  100 8  o 2  4.76826e+00 1.02701e+00 1.00927e+02 232.613 -5.70702e+00 -7.46808e+00 0.00000e+00 0.00000e+00 6.58368e+01 232.613 3.50900e+01 52.613  0.9452 
1 1 1 -5  100 9  o 14 3.49778e+00 1.04306e+00 7.69437e+01 225.242 -4.05785e+00 -4.09234e+00 0.00000e+00 0.00000e+00 4.05530e+01 225.242 3.63906e+01 45.242  0.9085 
1 1 1 -5  100 10 o 6  3.33979e+00 1.02005e+00 4.94988e+01 79.634  7.21171e-01  3.94262e+00  0.00000e+00 0.00000e+00 5.70897e+01 79.634  7.59092e+00 79.634  0.8638 
1 1 1 -5  100 11 o 15 3.10951e+00 9.68563e-01 3.41183e+01 1.589   2.83727e+00  7.87285e-02  0.00000e+00 0.00000e+00 5.73989e+01 1.589   2.32806e+01 1.589   0.7973 
1 1 1 -5  101 1  o 1  3.57890e+00 8.78670e-01 6.37852e+01 148.824 -3.51321e+00 2.12570e+00  0.00000e+00 0.00000e+00 5.14425e+01 148.824 1.23427e+01 328.824 0.8675 
1 1 1 -5  101 2  o 15 3.57248e+00 8.32957e-01 1.24482e+02 197.073 -7.83774e+00 -2.40710e+00 0.00000e+00 0.00000e+00 2.97510e-01 17.073  1.24779e+02 17.073  0.9369 
1 1 1 -5  101 3  o 18 2.21544e+00 7.05746e-01 5.83298e+01 312.529 1.66691e+00  -1.81723e+00 0.00000e+00 0.00000e+00 4.22284e+00 312.529 5.41070e+01 132.529 0.7612 
1 1 1 -5  101 4  o 6  8.28397e+00 6.48722e-01 1.45997e+02 0.626   2.45837e+01  2.68587e-01  0.00000e+00 0.00000e+00 1.54820e+02 0.626   8.82210e+00 0.626   0.9794 
1 1 1 -5  101 5  f 0  2.45928e+00 7.59397e-01 8.95201e+01 129.769 -2.91003e+00 3.49660e+00  0.00000e+00 0.00000e+00 9.16136e+00 309.769 9.86815e+01 309.769 0.8818 
1 1 1 -5  101 6  o 18 3.79247e+00 9.58445e-01 8.27976e+01 347.420 5.69375e+00  -1.27062e+00 0.00000e+00 0.00000e+00 4.49818e+01 347.420 3.78158e+01 167.420 0.9097 
1 1 1 -5  101 7  o 6  6.78543e+00 8.31189e-01 1.22750e+02 204.372 -1.59300e+01 -7.21665e+00 0.00000e+00 0.00000e+00 1.21126e+02 204.372 1.62389e+00 24.372  0.9710 
1 1 1 -5  101 8  o 17 8.59089e+00 7.73990e-01 1.94448e+02 357.124 4.29481e+01  -2.15721e+00 0.00000e+00 0.00000e+00 1.19620e+02 357.124 7.48279e+01 177.124 0.9883 
1 1 1 -5  101 9  o 6  7.52150e+00 1.04373e+00 9.73600e+01 152.199 -1.36041e+01 7.17285e+00  0.00000e+00 0.00000e+00 1.71470e+02 152.199 7.41103e+01 152.199 0.9669 
1 1 1 -5  101 10 o 11 8.97245e+00 9.88045e-01 1.38434e+02 41.645  2.26396e+01  2.01321e+01  0.00000e+00 0.00000e+00 1.87451e+02 41.645  4.90179e+01 41.645  0.9834 
1 1 1 -5  101 11 o 11 4.17441e+00 1.07284e+00 6.92116e+01 240.272 -3.73157e+00 -6.53463e+00 0.00000e+00 0.00000e+00 7.42071e+01 240.272 4.99546e+00 240.272 0.9310 
1 1 1 -5  102 1  f 0  3.10352e+00 8.42076e-01 7.97185e+01 63.269  1.97678e+00  3.92507e+00  0.00000e+00 0.00000e+00 2.12891e+01 63.269  5.84294e+01 243.269 0.8772 
1 1 1 -5  102 2  o 14 6.10027e+00 7.38021e-01 1.33965e+02 181.371 -1.56445e+01 -3.74310e-01 0.00000e+00 0.00000e+00 8.49608e+01 181.371 4.90043e+01 1.371   0.9675 
1 1 1 -5  102 3  o 14 1.25737e+01 5.54665e-01 2.20392e+02 353.335 5.84440e+01  -6.82891e+00 0.00000e+00 0.00000e+00 2.41865e+02 353.335 2.14723e+01 353.335 0.9915 
1 1 1 -5  102 4  o 12 3.84765e+00 8.79211e-01 1.05663e+02 180.811 -7.87319e+00 -1.11511e-01 0.00000e+00 0.00000e+00 2.75588e+01 180.811 7.81045e+01 0.811   0.9342 
1 1 1 -5  102 5  o 11 2.73768e+00 7.90141e-01 5.19590e+01 98.245  -4.45914e-01 3.07723e+00  0.00000e+00 0.00000e+00 3.09807e+01 98.245  2.09783e+01 278.245 0.8178 
1 1 1 -5  102 6  o 5  5.51254e+00 9.88307e-01 1.06104e+02 270.714 1.39929e-01  -1.12243e+01 0.00000e+00 0.00000e+00 8.86944e+01 270.714 1.74099e+01 90.714  0.9544 
1 1 1 -5  102 7  o 15 4.13183e+00 9.35078e-01 6.65006e+01 224.700 -4.07762e+00 -4.03514e+00 0.00000e+00 0.00000e+00 7.23409e+01 224.700 5.84031e+00 224.700 0.9081 
1 1 1 -5  102 8  o 3  6.25807e+00 9.47141e-01 1.03123e+02 290.242 4.80973e+00  -1.30431e+01 0.00000e+00 0.00000e+00 1.19819e+02 290.242 1.66953e+01 290.242 0.9633 
1 1 1 -5  102 9  o 18 7.43332e+00 9.19291e-01 1.21635e+02 109.688 -7.42362e+00 2.07474e+01  0.00000e+00 0.00000e+00 1.46749e+02 109.688 2.51147e+01 109.688 0.9770 
1 1 1 -5  102 10 o 17 3.89178e+00 1.10528e+00 7.19748e+01 219.108 -5.24238e+00 -4.26153e+00 0.00000e+00 0.00000e+00 6.06216e+01 219.108 1.13532e+01 39.108  0.9227 
1 1 1 -5  102 11 o 7  2.75229e+00 9.08263e-01 4.71027e+01 38.899  3.18941e+00  2.57343e+00  0.00000e+00 0.00000e+00 4.09548e+01 38.899  6.14786e+00 218.899 0.8672 
1 1 1 -5  103 1  o 10 6.25978e+00 7.26988e-01 9.90263e+01 141.822 -9.52278e+00 7.48778e+00  0.00000e+00 0.00000e+00 1.23372e+02 141.822 2.43456e+01 141.822 0.9578 
1 1 1 -5  103 2  o 13 4.76874e+00 7.94266e-01 1.47885e+02 111.661 -4.98026e+00 1.25396e+01  0.00000e+00 0.00000e+00 2.22689e+01 111.661 1.25616e+02 291.661 0.9622 
1 1 1 -5  103 3  o 10 3.75192e+00 9.06912e-01 1.13545e+02 182.438 -8.09905e+00 -3.44837e-01 0.00000e+00 0.00000e+00 1.66526e+01 182.438 9.68928e+01 2.438   0.9361 
1 1 1 -5  103 4  o 9  3.98978e+00 9.28260e-01 5.73198e+01 179.175 -4.34379e+00 6.25788e-02  0.00000e+00 0.00000e+00 7.21229e+01 179.175 1.48031e+01 179.175 0.8756 
1 1 1 -5  103 5  o 6  6.79533e+00 7.89324e-01 1.13764e+02 276.312 1.74233e+00  -1.57507e+01 0.00000e+00 0.00000e+00 1.29838e+02 276.312 1.60744e+01 276.312 0.9679 
1 1 1 -5  103 6  o 19 7.42483e+00 8.69412e-01 1.68014e+02 190.170 -2.51352e+01 -4.50912e+00 0.00000e+00 0.00000e+00 1.01393e+02 190.170 6.66208e+01 10.170  0.9802 
1 1 1 -5  103 7  o 11 3.24003e+00 8.46424e-01 7.26288e+01 108.718 -1.84314e+00 5.43973e+00  0.00000e+00 0.00000e+00 3.62293e+01 108.718 3.63995e+01 288.718 0.9082 
1 1 1 -5  103 8  o 5  2.51533e+00 8.18729e-01 3.27894e+01 299.226 1.02067e+00  -1.82433e+00 0.00000e+00 0.00000e+00 3.34287e+01 299.226 6.39319e-01 299.226 0.7121 
1 1 1 -5  103 9  o 10 2.99605e+00 8.64505e-01 5.36822e+01 340.492 4.22849e+00  -1.49806e+00 0.00000e+00 0.00000e+00 4.37115e+01 340.492 9.97070e+00 160.492 0.8799 
1 1 1 -5  103 10 o 16 3.05732e+00 9.71816e-01 4.44352e+01 318.538 2.81901e+00  -2.49075e+00 0.00000e+00 0.00000e+00 5.19125e+01 318.538 7.47735e+00 318.538 0.8537 
1 1 1 -5  104 1  o 8  4.58632e+00 8.53783e-01 8.05736e+01 263.181 -8.63611e-01 -7.22191e+00 0.00000e+00 0.00000e+00 7.73355e+01 263.181 3.23800e+00 83.181  0.9285 
1 1 1 -5  104 2  o 5  4.33605e+00 8.69227e-01 1.10082e+02 112.947 -3.59833e+00 8.49887e+00  0.00000e+00 0.00000e+00 4.16896e+01 112.947 6.83926e+01 292.947 0.9442 
1 1 1 -5  104 3  o 3  1.12586e+01 6.55225e-01 1.85495e+02 183.955 -4.66750e+01 -3.22691e+00 0.00000e+00 0.00000e+00 2.27256e+02 183.955 4.17613e+01 183.955 0.9893 
1 1 1 -5  104 4  o 15 5.61902e+00 8.25633e-01 9.19044e+01 209.958 -8.98615e+00 -5.17937e+00 0.00000e+00 0.00000e+00 1.05942e+02 209.958 1.40373e+01 209.958 0.9505 
1 1 1 -5  104 5  o 4  2.85942e+00 8.36112e-01 3.74767e+01 321.123 1.78612e+00  -1.44002e+00 0.00000e+00 0.00000e+00 4.09381e+01 321.123 3.46137e+00 321.123 0.7406 
1 1 1 -5  104 6  o 10 3.17137e+00 9.07604e-01 3.91536e+01 110.826 -9.41413e-01 2.47496e+00  0.00000e+00 0.00000e+00 5.24084e+01 110.826 1.32548e+01 110.826 0.7802 
1 1 1 -5  104 7  o 15 6.06066e+00 8.87395e-01 8.81198e+01 308.312 8.15123e+00  -1.03168e+01 0.00000e+00 0.00000e+00 1.27329e+02 308.312 3.92090e+01 308.312 0.9612 
1 1 1 -5  104 8  o 7  2.80679e+00 8.37117e-01 4.00236e+01 343.432 2.72579e+00  -8.10933e-01 0.00000e+00 0.00000e+00 4.27332e+01 343.432 2.70960e+00 343.432 0.7977 
1 1 1 -5  104 9  o 7  5.20696e+00 9.23857e-01 8.56623e+01 308.868 7.82713e+00  -9.71129e+00 0.00000e+00 0.00000e+00 9.87692e+01 308.868 1.31069e+01 308.868 0.9590 
1 1 1 -5  104 10 o 8  2.70379e+00 8.89631e-01 6.42173e+01 24.526  4.97656e+00  2.27072e+00  0.00000e+00 0.00000e+00 2.59107e+01 24.526  3.83065e+01 204.526 0.9033 
1 1 1 -5  105 1  o 10 3.67020e+00 8.43397e-01 6.14782e+01 149.350 -3.89375e+00 2.30736e+00  0.00000e+00 0.00000e+00 5.84067e+01 149.350 3.07147e+00 329.350 0.8811 
1 1 1 -5  105 2  o 7  1.37286e+01 5.76717e-01 2.33867e+02 153.058 -7.09205e+01 3.60451e+01  0.00000e+00 0.00000e+00 2.71732e+02 153.058 3.78641e+01 153.058 0.9937 
1 1 1 -5  105 3  o 12 8.07293e+00 7.12733e-01 1.68945e+02 63.888  1.28870e+01  2.62915e+01  0.00000e+00 0.00000e+00 1.24993e+02 63.888  4.39515e+01 243.888 0.9828 
1 1 1 -5  105 4  f 0  4.33471e+00 8.84105e-01 7.86243e+01 250.733 -2.31756e+00 -6.63023e+00 0.00000e+00 0.00000e+00 6.99921e+01 250.733 8.63221e+00 70.733  0.9258 
1 1 1 -5  105 5  o 11 4.48324e+00 9.16647e-01 9.92772e+01 112.682 -3.43624e+00 8.22196e+00  0.00000e+00 0.00000e+00 5.70638e+01 112.682 4.22133e+01 292.682 0.9421 
1 1 1 -5  105 6  o 19 3.99166e+00 9.52092e-01 5.57620e+01 346.264 4.85762e+00  -1.18739e+00 0.00000e+00 0.00000e+00 7.61699e+01 346.264 2.04079e+01 346.264 0.8934 
1 1 1 -5  105 7  o 2  2.90418e+00 8.75255e-01 3.96822e+01 253.449 -7.97172e-01 -2.68239e+00 0.00000e+00 0.00000e+00 4.55645e+01 253.449 5.88234e+00 253.449 0.7939 
1 1 1 -5  105 8  o 10 3.69297e+00 9.99903e-01 8.37076e+01 11.946  7.66515e+00  1.62168e+00  0.00000e+00 0.00000e+00 4.37131e+01 11.946  3.99945e+01 191.946 0.9338 
1 1 1 -5  105 9  o 10 3.34674e+00 9.76506e-01 5.94657e+01 255.427 -1.37055e+00 -5.27176e+00 0.00000e+00 0.00000e+00 5.20950e+01 255.427 7.37073e+00 75.427  0.9028 
1 1 1 -5  105 10 o 19 2.57543e+00 8.02741e-01 1.84987e+01 93.487  -1.02442e-01 1.68092e+00  0.00000e+00 0.00000e+00 4.21646e+01 93.487  2.36659e+01 93.487  0.6384 
1 1 1 -5  106 1  o 10 3.61291e+00 8.91564e-01 4.36030e+01 336.516 2.78454e+00  -1.20980e+00 0.00000e+00 0.00000e+00 6.52069e+01 336.516 2.16038e+01 336.516 0.8126 
1 1 1 -5  106 2  o 3  3.44926e+00 8.70710e-01 6.20273e+01 129.832 -2.88176e+00 3.45489e+00  0.00000e+00 0.00000e+00 5.04739e+01 129.832 1.15534e+01 309.832 0.8803 
1 1 1 -5  106 3  o 5  5.17044e+00 8.72033e-01 6.20173e+01 261.613 -9.71537e-01 -6.58957e+00 0.00000e+00 0.00000e+00 1.14459e+02 261.613 5.24420e+01 261.613 0.9215 
1 1 1 -5  106 4  o 4  3.82223e+00 9.05494e-01 5.88084e+01 153.845 -4.07658e+00 2.00198e+00  0.00000e+00 0.00000e+00 6.59376e+01 153.845 7.12921e+00 153.845 0.8815 
1 1 1 -5  106 5  o 16 5.64767e+00 8.99208e-01 9.08210e+01 231.649 -7.27085e+00 -9.18979e+00 0.00000e+00 0.00000e+00 1.09044e+02 231.649 1.82227e+01 231.649 0.9563 
1 1 1 -5  106 6  o 5  3.99480e+00 9.74646e-01 5.38660e+01 286.201 1.26704e+00  -4.36088e+00 0.00000e+00 0.00000e+00 7.63779e+01 286.201 2.25119e+01 286.201 0.8815 
1 1 1 -5  106 7  o 19 2.27140e+00 7.58581e-01 3.76451e+01 63.765  9.89921e-01  2.00865e+00  0.00000e+00 0.00000e+00 2.39303e+01 63.765  1.37148e+01 243.765 0.7334 
1 1 1 -5  106 8  o 1  3.78335e+00 9.23695e-01 5.15891e+01 328.203 4.28847e+00  -2.65868e+00 0.00000e+00 0.00000e+00 7.34091e+01 328.203 2.18199e+01 328.203 0.8944 
1 1 1 -5  106 9  o 16 4.19313e+00 1.05365e+00 5.54650e+01 259.839 -1.01152e+00 -5.64401e+00 0.00000e+00 0.00000e+00 8.50745e+01 259.839 2.96095e+01 259.839 0.9080 
1 1 1 -5  106 10 o 7  3.08261e+00 9.41528e-01 2.52074e+01 94.156  -1.76316e-01 2.42649e+00  0.00000e+00 0.00000e+00 6.09168e+01 94.156  3.57094e+01 94.156  0.7575 
1 1 1 -5  107 1  o 12 9.56251e+00 6.38523e-01 1.98039e+02 67.631  1.73236e+01  4.20947e+01  0.00000e+00 0.00000e+00 1.52349e+02 67.631  4.56901e+01 247.631 0.9890 
1 1 1 -5  107 2  o 19 2.72855e+00 8.02939e-01 3.84362e+01 240.760 -1.12014e+00 -2.00094e+00 0.00000e+00 0.00000e+00 3.64026e+01 240.760 2.03353e+00 60.760  0.7405 
1 1 1 -5  107 3  o 5  3.23603e+00 7.95360e-01 5.09603e+01 321.867 2.81736e+00  -2.21173e+00 0.00000e+00 0.00000e+00 5.03200e+01 321.867 6.40307e-01 141.867 0.8453 
1 1 1 -5  107 4  o 12 3.15706e+00 8.53954e-01 9.78127e+01 97.925  -9.42223e-01 6.76815e+00  0.00000e+00 0.00000e+00 1.01111e+01 97.925  8.77017e+01 277.925 0.9236 
1 1 1 -5  107 5  o 17 5.14984e+00 9.21279e-01 6.77413e+01 352.993 8.26753e+00  -1.01612e+00 0.00000e+00 0.00000e+00 1.10941e+02 352.993 4.32001e+01 352.993 0.9379 
1 1 1 -5  107 6  o 9  3.47097e+00 8.86235e-01 2.34718e+01 277.870 2.68317e-01  -1.94112e+00 0.00000e+00 0.00000e+00 6.52113e+01 277.870 4.17395e+01 277.870 0.6910 
1 1 1 -5  107 7  o 11 4.27393e+00 9.80280e-01 6.62426e+01 126.687 -4.36848e+00 5.86348e+00  0.00000e+00 0.00000e+00 8.04526e+01 126.687 1.42099e+01 126.687 0.9289 
1 1 1 -5  107 8  f 0  7.41216e+00 9.02028e-01 9.51132e+01 267.461 -8.67712e-01 -1.95699e+01 0.00000e+00 0.00000e+00 1.71520e+02 267.461 7.64071e+01 267.461 0.9741 
1 1 1 -5  107 9  o 13 3.75295e+00 1.03810e+00 7.03066e+01 75.539  1.77822e+00  6.89506e+00  0.00000e+00 0.00000e+00 5.80518e+01 75.539  1.22549e+01 255.539 0.9269 
1 1 1 -5  107 10 o 9  2.28180e+00 7.73628e-01 1.35435e+01 15.110  1.19554e+00  3.22798e-01  0.00000e+00 0.00000e+00 3.05852e+01 15.110  1.70417e+01 15.110  0.5245 
1 1 1 -5  108 1  o 6  3.58421e+00 7.46961e-01 7.06425e+01 327.805 4.79799e+00  -3.02085e+00 0.00000e+00 0.00000e+00 4.97576e+01 327.805 2.08849e+01 147.805 0.9069 
1 1 1 -5  108 2  o 13 3.03207e+00 8.18459e-01 3.09814e+01 28.095  1.88177e+00  1.00457e+00  0.00000e+00 0.00000e+00 4.96851e+01 28.095  1.87037e+01 28.095  0.7185 
1 1 1 -5  108 3  o 2  7.58042e+00 6.87056e-01 1.48971e+02 99.927  -4.81366e+00 2.75032e+01  0.00000e+00 0.00000e+00 1.26556e+02 99.927  2.24146e+01 279.927 0.9819 
1 1 1 -5  108 4  o 12 7.62491e+00 7.31437e-01 9.82399e+01 215.984 -1.68224e+01 -1.22152e+01 0.00000e+00 0.00000e+00 1.77017e+02 215.984 7.87768e+01 215.984 0.9756 
1 1 1 -5  108 5  o 16 3.24906e+00 9.16104e-01 7.61183e+01 144.593 -4.79067e+00 3.40538e+00  0.00000e+00 0.00000e+00 3.32778e+01 144.593 4.28405e+01 324.593 0.9104 
1 1 1 -5  108 6  o 1  2.79076e+00 8.07784e-01 2.44918e+01 56.835  9.68395e-01  1.48182e+00  0.00000e+00 0.00000e+00 4.31977e+01 56.835  1.87059e+01 56.835  0.6562 
1 1 1 -5  108 7  o 12 7.03403e+00 8.44905e-01 9.17959e+01 275.485 1.66925e+00  -1.73837e+01 0.00000e+00 0.00000e+00 1.60497e+02 275.485 6.87008e+01 275.485 0.9709 
1 1 1 -5  108 8  o 18 3.48017e+00 9.52425e-01 6.64670e+01 47.287  4.43260e+00  4.80145e+00  0.00000e+00 0.00000e+00 5.17239e+01 47.287  1.47432e+01 227.287 0.9199 
1 1 1 -5  108 9  o 11 3.40313e+00 9.66825e-01 7.57678e+01 126.920 -4.21465e+00 5.60923e+00  0.00000e+00 0.00000e+00 4.04480e+01 126.920 3.53199e+01 306.920 0.9257 
1 1 1 -5  109 1  o 12 3.15920e+00 8.63307e-01 5.92075e+01 283.698 9.73430e-01  -3.99369e+00 0.00000e+00 0.00000e+00 4.22917e+01 283.698 1.69157e+01 103.698 0.8676 
1 1 1 -5  109 2  o 13 5.82758e+00 8.20383e-01 7.21245e+01 30.291  8.78789e+00  5.13337e+00  0.00000e+00 0.00000e+00 1.32713e+02 30.291  6.05885e+01 30.291  0.9495 
1 1 1 -5  109 3  o 18 3.89607e+00 9.32214e-01 4.78917e+01 320.333 3.40160e+00  -2.82074e+00 0.00000e+00 0.00000e+00 7.86795e+01 320.333 3.07879e+01 320.333 0.8779 
1 1 1 -5  109 4  f 0  3.83170e+00 9.15316e-01 1.13317e+02 164.240 -9.21031e+00 2.59937e+00  0.00000e+00 0.00000e+00 2.07938e+01 164.240 9.25231e+01 344.240 0.9462 
1 1 1 -5  109 5  o 1  9.85729e+00 6.63518e-01 1.27906e+02 14.148  3.58207e+01  9.02956e+00  0.00000e+00 0.00000e+00 2.31573e+02 14.148  1.03667e+02 14.148  0.9864 
1 1 1 -5  109 6  o 17 1.01596e+01 6.89920e-01 1.62412e+02 196.395 -5.31466e+01 -1.56369e+01 0.00000e+00 0.00000e+00 2.09603e+02 196.395 4.71917e+01 196.395 0.9909 
1 1 1 -5  109 7  o 6  3.69321e+00 9.45032e-01 5.22500e+01 345.350 4.98659e+00  -1.30359e+00 0.00000e+00 0.00000e+00 7.00707e+01 345.350 1.78208e+01 345.350 0.8968 
1 1 1 -5  109 8  o 14 3.56526e+00 9.84023e-01 5.95702e+01 175.866 -5.63397e+00 4.07204e-01  0.00000e+00 0.00000e+00 5.97099e+01 175.866 1.39661e-01 175.866 0.9065 
1 1 1 -5  109 9  o 19 6.83803e+00 9.74288e-01 8.31099e+01 129.719 -1.09622e+01 1.31951e+01  0.00000e+00 0.00000e+00 1.61607e+02 129.719 7.84972e+01 129.719 0.9704 
1 1 1 -5  110 1  o 3  5.53400e+00 8.51777e-01 7.77663e+01 229.272 -7.09558e+00 -8.24134e+00 0.00000e+00 0.00000e+00 1.17433e+02 229.272 3.96664e+01 229.272 0.9529 
1 1 1 -5  110 2  o 9  8.74618e+00 7.14564e-01 1.71267e+02 39.313  3.26851e+01  2.67647e+01  0.00000e+00 0.00000e+00 1.48550e+02 39.313  2.27168e+01 219.313 0.9881 
1 1 1 -5  110 3  o 12 8.83877e+00 6.86876e-01 1.22042e+02 186.850 -3.03806e+01 -3.64956e+00 0.00000e+00 0.00000e+00 1.99551e+02 186.850 7.75091e+01 186.850 0.9835 
1 1 1 -5  110 4  o 8  5.16003e+00 9.17284e-01 1.05724e+02 42.830  9.64116e+00  8.93721e+00  0.00000e+00 0.00000e+00 7.76804e+01 42.830  2.80433e+01 222.830 0.9612 
1 1 1 -5  110 5  o 4  4.52996e+00 9.40828e-01 6.66053e+01 176.214 -7.20649e+00 4.76874e-01  0.00000e+00 0.00000e+00 8.87608e+01 176.214 2.21556e+01 176.214 0.9279 
1 1 1 -5  110 6  f 0  2.69237e+00 8.01564e-01 5.39404e+00 153.546 -3.73594e-01 1.85889e-01  0.00000e+00 0.00000e+00 1.49185e+01 153.546 9.52444e+00 153.546 0.2042 
1 1 1 -5  110 7  o 14 2.61658e+00 8.19320e-01 3.32536e+01 344.718 2.44688e+00  -6.68551e-01 0.00000e+00 0.00000e+00 4.10252e+01 344.718 7.77163e+00 344.718 0.7689 
1 1 1 -5  110 8  o 12 2.06808e+00 7.08304e-01 5.09507e+01 329.080 3.52488e+00  -2.11129e+00 0.00000e+00 0.00000e+00 1.52468e+01 329.080 3.57039e+01 149.080 0.8676 
1 1 1 -5  110 9  o 18 2.65946e+00 8.54080e-01 8.49252e+01 76.783  1.83353e+00  7.80688e+00  0.00000e+00 0.00000e+00 6.78985e+00 76.783  7.81353e+01 256.783 0.9354 
1 1 1 -5  111 1  o 6  2.24117e+00 7.29842e-01 9.06443e+01 94.113  -4.00523e-01 5.56931e+00  0.00000e+00 0.00000e+00 1.55549e+01 274.113 1.06199e+02 274.113 0.9054 
1 1 1 -5  111 2  o 11 5.78063e+00 8.25338e-01 1.07012e+02 271.868 5.09371e-01  -1.56200e+01 0.00000e+00 0.00000e+00 9.98882e+01 271.868 7.12407e+00 91.868  0.9675 
1 1 1 -5  111 3  o 2  2.97524e+00 8.69409e-01 5.61599e+01 134.228 -2.91832e+00 2.99807e+00  0.00000e+00 0.00000e+00 3.95949e+01 134.228 1.65649e+01 314.228 0.8702 
1 1 1 -5  111 4  o 10 2.86771e+00 8.46852e-01 5.88178e+01 50.535  2.68897e+00  3.26602e+00  0.00000e+00 0.00000e+00 3.36072e+01 50.535  2.52106e+01 230.535 0.8718 
1 1 1 -5  111 5  o 13 4.15277e+00 9.77779e-01 8.74645e+01 173.493 -8.71744e+00 9.94309e-01  0.00000e+00 0.00000e+00 5.69511e+01 173.493 3.05134e+01 353.493 0.9412 
1 1 1 -5  111 6  o 12 2.70867e+00 8.46715e-01 6.19386e+01 41.386  3.67814e+00  3.24111e+00  0.00000e+00 0.00000e+00 2.71961e+01 41.386  3.47425e+01 221.386 0.8911 
1 1 1 -5  111 7  o 9  4.37566e+00 9.93113e-01 6.93616e+01 355.102 7.97446e+00  -6.83421e-01 0.00000e+00 0.00000e+00 8.16808e+01 355.102 1.23192e+01 355.102 0.9353 
1 1 1 -5  111 8  o 4  2.93897e+00 9.00934e-01 4.44869e+01 255.493 -1.00966e+00 -3.90223e+00 0.00000e+00 0.00000e+00 4.92454e+01 255.493 4.75851e+00 255.493 0.8647 
1 1 1 -5  112 1  o 1  4.30734e+00 8.71524e-01 4.64579e+01 19.609  4.71098e+00  1.67833e+00  0.00000e+00 0.00000e+00 9.59083e+01 19.609  4.94503e+01 19.609  0.8934 
1 1 1 -5  112 2  o 4  3.02290e+00 8.69707e-01 8.52739e+01 72.445  1.87303e+00  5.92075e+00  0.00000e+00 0.00000e+00 1.70800e+01 72.445  6.81938e+01 252.445 0.9155 
1 1 1 -5  112 3  o 4  4.61685e+00 9.27028e-01 9.71237e+01 60.174  5.40287e+00  9.42402e+00  0.00000e+00 0.00000e+00 6.55114e+01 60.174  3.16124e+01 240.174 0.9528 
1 1 1 -5  112 4  o 14 2.92272e+00 8.60627e-01 6.50994e+01 239.881 -2.67343e+00 -4.60838e+00 0.00000e+00 0.00000e+00 3.21620e+01 239.881 3.29374e+01 59.881  0.9005 
1 1 1 -5  112 5  o 13 3.54375e+00 8.71779e-01 6.52022e+01 94.827  -5.70925e-01 6.76060e+00  0.00000e+00 0.00000e+00 5.56256e+01 94.827  9.57661e+00 274.827 0.9230 
1 1 1 -5  112 6  o 16 2.63864e+00 8.11321e-01 2.37616e+01 349.601 2.00052e+00  -3.67120e-01 0.00000e+00 0.00000e+00 4.47475e+01 349.601 2.09859e+01 349.601 0.7033 
1 1 1 -5  112 7  o 11 3.31671e+00 9.46281e-01 3.62480e+01 237.637 -1.95583e+00 -3.08634e+00 0.00000e+00 0.00000e+00 6.76186e+01 237.637 3.13706e+01 237.637 0.8488 
1 1 1 -5  112 8  o 14 2.70349e+00 8.32156e-01 2.31574e+01 276.314 2.58014e-01  -2.33173e+00 0.00000e+00 0.00000e+00 5.13213e+01 276.314 2.81638e+01 276.314 0.7472 
1 1 1 -5  113 1  o 9  8.30507e+00 7.05142e-01 1.37046e+02 80.548  5.40348e+00  3.24557e+01  0.00000e+00 0.00000e+00 1.65405e+02 80.548  2.83585e+01 80.548  0.9847 
1 1 1 -5  113 2  o 12 3.01464e+00 8.53841e-01 5.83265e+01 239.500 -2.59186e+00 -4.40006e+00 0.00000e+00 0.00000e+00 4.15202e+01 239.500 1.68063e+01 59.500  0.8958 
1 1 1 -5  113 3  o 19 1.91430e+00 6.48828e-01 4.15643e+01 81.361  4.00771e-01  2.63775e+00  0.00000e+00 0.00000e+00 1.37714e+01 81.361  2.77929e+01 261.361 0.7821 
1 1 1 -5  113 4  o 12 3.06598e+00 8.10242e-01 6.31634e+01 330.190 5.23138e+00  -2.99725e+00 0.00000e+00 0.00000e+00 4.02324e+01 330.190 2.29309e+01 150.190 0.9128 
1 1 1 -5  113 5  o 16 3.87253e+00 1.00663e+00 4.07201e+01 290.308 1.34878e+00  -3.64466e+00 0.00000e+00 0.00000e+00 8.21184e+01 290.308 4.13983e+01 290.308 0.8590 
1 1 1 -5  113 6  f 0  2.65021e+00 8.28454e-01 2.32488e+01 132.643 -1.40026e+00 1.52049e+00  0.00000e+00 0.00000e+00 4.60493e+01 132.643 2.28005e+01 132.643 0.7085 
1 1 1 -5  113 7  o 10 3.35473e+00 9.45589e-01 9.80135e+01 329.273 8.32443e+00  -4.94806e+00 0.00000e+00 0.00000e+00 1.91521e+01 329.273 7.88614e+01 149.273 0.9469 
1 1 1 -5  113 8  o 2  3.14308e+00 9.14584e-01 1.33552e+01 323.746 1.13665e+00  -8.33540e-01 0.00000e+00 0.00000e+00 5.30260e+01 323.746 3.96707e+01 323.746 0.5730 
1 1 1 -5  114 1  o 12 6.77928e+00 8.06655e-01 1.16017e+02 82.159  3.00146e+00  2.17947e+01  0.00000e+00 0.00000e+00 1.28866e+02 82.159  1.28486e+01 82.159  0.9770 
1 1 1 -5  114 2  o 6  2.07585e+00 6.81226e-01 7.23493e+01 357.153 4.63502e+00  -2.30530e-01 0.00000e+00 0.00000e+00 4.49772e+00 177.153 7.68470e+01 177.153 0.8843 
1 1 1 -5  114 3  o 19 3.76619e+00 8.86100e-01 1.16905e+02 303.297 7.00355e+00  -1.06629e+01 0.00000e+00 0.00000e+00 1.66799e+01 303.297 1.00225e+02 123.297 0.9600 
1 1 1 -5  114 4  f 0  3.31542e+00 8.82674e-01 2.95232e+00 20.971  2.74252e-01  1.05115e-01  0.00000e+00 0.00000e+00 1.48386e+01 20.971  1.18862e+01 20.971  0.1453 
1 1 1 -5  114 5  o 4  2.25289e+00 7.65435e-01 2.47942e+01 123.507 -1.01104e+00 1.52711e+00  0.00000e+00 0.00000e+00 3.07665e+01 123.507 5.97228e+00 123.507 0.6681 
1 1 1 -5  114 6  o 14 3.60223e+00 8.62437e-01 7.76377e+01 135.774 -6.64939e+00 6.47216e+00  0.00000e+00 0.00000e+00 4.78896e+01 135.774 2.97481e+01 315.774 0.9445 
1 1 1 -5  114 7  o 19 3.23041e+00 9.04190e-01 3.08368e+01 192.354 -3.35644e+00 -7.35117e-01 0.00000e+00 0.00000e+00 6.89467e+01 192.354 3.81100e+01 192.354 0.8377 
1 1 1 -5  115 1  o 2  4.02896e+00 9.24681e-01 3.25689e+01 205.921 -3.29536e+00 -1.60163e+00 0.00000e+00 0.00000e+00 9.38935e+01 205.921 6.13246e+01 205.921 0.8492 
1 1 1 -5  115 2  f 0  3.81829e+00 8.92499e-01 3.51501e+01 18.310  3.57191e+00  1.18199e+00  0.00000e+00 0.00000e+00 8.52982e+01 18.310  5.01481e+01 18.310  0.8537 
1 1 1 -5  115 3  o 4  3.67057e+00 9.35366e-01 1.14717e+02 225.136 -7.81396e+00 -7.85123e+00 0.00000e+00 0.00000e+00 1.45900e+01 225.136 1.00127e+02 45.136  0.9537 
1 1 1 -5  115 4  o 10 7.36851e+00 7.77413e-01 9.53576e+01 336.541 2.06274e+01  -8.95144e+00 0.00000e+00 0.00000e+00 1.70580e+02 336.541 7.52226e+01 336.541 0.9775 
1 1 1 -5  115 5  o 15 5.13348e+00 9.55806e-01 7.95160e+01 268.162 -3.68404e-01 -1.14803e+01 0.00000e+00 0.00000e+00 1.01486e+02 268.162 2.19701e+01 268.162 0.9554 
1 1 1 -5  115 6  o 9  2.40850e+00 7.78427e-01 5.10415e+01 104.021 -1.11181e+00 4.45226e+00  0.00000e+00 0.00000e+00 2.73906e+01 104.021 2.36509e+01 284.021 0.8829 
1 1 1 -5  115 7  o 4  2.04465e+00 6.92852e-01 8.02642e+00 7.227   7.01384e-01  8.89383e-02  0.00000e+00 0.00000e+00 1.70799e+01 7.227   9.05350e+00 7.227   0.3331 
1 1 1 -5  116 1  o 7  7.22192e+00 8.07219e-01 1.09602e+02 289.820 7.91636e+00  -2.19639e+01 0.00000e+00 0.00000e+00 1.51464e+02 289.820 4.18627e+01 289.820 0.9783 
1 1 1 -5  116 2  o 19 6.57689e+00 8.33668e-01 1.06500e+02 333.264 1.98639e+01  -1.00059e+01 0.00000e+00 0.00000e+00 1.30914e+02 333.264 2.44146e+01 333.264 0.9773 
1 1 1 -5  116 3  o 15 3.14575e+00 8.82555e-01 8.47824e+01 211.131 -6.70311e+00 -4.04860e+00 0.00000e+00 0.00000e+00 2.36832e+01 211.131 6.10992e+01 31.131  0.9338 
1 1 1 -5  116 4  o 13 2.31160e+00 7.45517e-01 5.30346e+01 194.851 -4.09861e+00 -1.08680e+00 0.00000e+00 0.00000e+00 2.13795e+01 194.851 3.16551e+01 14.851  0.8722 
1 1 1 -5  116 5  o 11 5.36530e+00 8.81226e-01 6.12162e+01 314.909 7.29964e+00  -7.32280e+00 0.00000e+00 0.00000e+00 1.26893e+02 314.909 6.56763e+01 314.909 0.9503 
1 1 1 -5  116 6  o 4  5.47628e+00 9.89333e-01 7.65429e+01 102.538 -2.77801e+00 1.24911e+01  0.00000e+00 0.00000e+00 1.17324e+02 102.538 4.07807e+01 102.538 0.9601 
1 1 1 -5  116 7  o 12 1.86476e+00 6.48164e-01 3.31052e+01 129.464 -1.87922e+00 2.28263e+00  0.00000e+00 0.00000e+00 2.23312e+01 129.464 1.07740e+01 309.463 0.8067 
1 1 1 -5  117 1  o 6  6.81019e+00 8.20579e-01 1.03076e+02 184.956 -2.17707e+01 -1.88790e+00 0.00000e+00 0.00000e+00 1.42650e+02 184.956 3.95734e+01 184.956 0.9768 
1 1 1 -5  117 2  o 17 2.90967e+00 8.21625e-01 4.70917e+01 122.109 -2.46114e+00 3.92195e+00  0.00000e+00 0.00000e+00 4.78929e+01 122.109 8.01180e-01 122.109 0.8840 
1 1 1 -5  117 3  o 8  5.11688e+00 9.47474e-01 9.38467e+01 132.379 -9.18349e+00 1.00647e+01  0.00000e+00 0.00000e+00 8.79660e+01 132.379 5.88071e+00 312.379 0.9626 
1 1 1 -5  117 4  o 7  3.28667e+00 7.91469e-01 7.86803e+01 291.348 3.24882e+00  -8.31227e+00 0.00000e+00 0.00000e+00 3.55811e+01 291.348 4.30992e+01 111.348 0.9422 
1 1 1 -5  117 5  o 12 3.65802e+00 8.90647e-01 6.94654e+01 303.636 4.93306e+00  -7.41468e+00 0.00000e+00 0.00000e+00 5.76281e+01 303.636 1.18372e+01 123.636 0.9421 
1 1 1 -5  117 6  o 16 2.42728e+00 7.96639e-01 6.03334e+01 70.633  1.94236e+00  5.52571e+00  0.00000e+00 0.00000e+00 2.10927e+01 70.633  3.92408e+01 250.633 0.9101 
1 1 1 -5  117 7  f 0  3.28105e+00 9.63783e-01 5.16720e+01 204.255 -5.15097e+00 -2.32091e+00 0.00000e+00 0.00000e+00 5.79021e+01 204.255 6.23009e+00 204.255 0.9065 
1 1 1 -5  118 1  o 3  4.79549e+00 9.48704e-01 5.74225e+01 112.319 -3.17072e+00 7.72360e+00  0.00000e+00 0.00000e+00 1.08684e+02 112.319 5.12611e+01 112.319 0.9380 
1 1 1 -5  118 2  o 14 5.79228e+00 9.04152e-01 6.72205e+01 65.758  5.07542e+00  1.12712e+01  0.00000e+00 0.00000e+00 1.37760e+02 65.758  7.05393e+01 65.758  0.9587 
1 1 1 -5  118 3  o 6  2.71330e+00 7.59320e-01 2.59219e+01 109.018 -8.16283e-01 2.36828e+00  0.00000e+00 0.00000e+00 5.07279e+01 109.018 2.48060e+01 109.018 0.7655 
1 1 1 -5  118 4  o 17 3.74441e+00 8.94286e-01 5.81480e+01 123.216 -3.99233e+00 6.09715e+00  0.00000e+00 0.00000e+00 7.01097e+01 123.216 1.19617e+01 123.216 0.9286 
1 1 1 -5  118 5  o 19 2.21878e+00 7.28609e-01 1.29468e+01 271.157 2.40268e-02  -1.18978e+00 0.00000e+00 0.00000e+00 2.87469e+01 271.157 1.58001e+01 271.157 0.5097 
1 1 1 -5  118 6  o 11 5.43138e+00 1.03466e+00 1.01031e+02 244.013 -7.36263e+00 -1.51046e+01 0.00000e+00 0.00000e+00 9.30593e+01 244.013 7.97188e+00 64.013  0.9698 
1 1 1 -5  119 1  o 17 2.49189e+00 7.79021e-01 2.35356e+01 124.651 -1.16384e+00 1.68387e+00  0.00000e+00 0.00000e+00 4.13443e+01 124.651 1.78087e+01 124.651 0.7053 
1 1 1 -5  119 2  o 18 3.31339e+00 9.19033e-01 9.39259e+01 126.698 -5.96192e+00 7.99909e+00  0.00000e+00 0.00000e+00 2.20468e+01 126.698 7.18791e+01 306.698 0.9485 
1 1 1 -5  119 3  o 3  3.86320e+00 9.18651e-01 4.19543e+01 6.224   5.46713e+00  5.96280e-01  0.00000e+00 0.00000e+00 8.68493e+01 6.224   4.48950e+01 6.224   0.9038 
1 1 1 -5  119 4  o 14 5.58539e+00 9.78898e-01 9.35417e+01 151.688 -1.37895e+01 7.42854e+00  0.00000e+00 0.00000e+00 1.05729e+02 151.688 1.21870e+01 151.688 0.9675 
1 1 1 -5  119 5  o 13 7.04108e+00 8.55438e-01 1.09705e+02 273.568 1.80590e+00  -2.89652e+01 0.00000e+00 0.00000e+00 1.45295e+02 273.568 3.55899e+01 273.568 0.9826 
1 1 1 -5  119 6  o 3  2.57877e+00 8.15315e-01 1.72892e+01 74.028  5.22830e-01  1.82669e+00  0.00000e+00 0.00000e+00 4.73688e+01 74.028  3.00796e+01 74.028  0.6807 
1 1 1 -5  120 1  o 10 4.28070e+00 9.94375e-01 7.37894e+01 281.544 1.96574e+00  -9.62393e+00 0.00000e+00 0.00000e+00 7.59039e+01 281.544 2.11452e+00 281.544 0.9476 
1 1 1 -5  120 2  o 1  4.83754e+00 9.69564e-01 1.00872e+02 75.989  3.68572e+00  1.47709e+01  0.00000e+00 0.00000e+00 7.16235e+01 75.989  2.92481e+01 255.989 0.9666 
1 1 1 -5  120 3  o 4  2.33232e+00 7.48880e-01 2.14571e+01 358.302 2.02551e+00  -6.00323e-02 0.00000e+00 0.00000e+00 3.89273e+01 358.302 1.74702e+01 358.302 0.7021 
1 1 1 -5  120 4  o 5  2.78192e+00 8.45678e-01 6.28196e+01 96.569  -7.60235e-01 6.60129e+00  0.00000e+00 0.00000e+00 3.16616e+01 96.569  3.11581e+01 276.569 0.9213 
1 1 1 -5  120 5  f 0  1.93694e+00 6.64784e-01 4.09953e+01 283.698 8.93907e-01  -3.66737e+00 0.00000e+00 0.00000e+00 1.99702e+01 283.698 2.10251e+01 103.698 0.8543 
1 1 1 -5  120 6  o 13 2.72327e+00 8.35676e-01 4.85372e+01 46.964  3.69931e+00  3.96202e+00  0.00000e+00 0.00000e+00 4.19492e+01 46.964  6.58802e+00 226.964 0.9023 
1 1 1 -5  121 1  o 13 2.61152e+00 8.13444e-01 8.25686e+01 235.318 -4.61779e+00 -6.67332e+00 0.00000e+00 0.00000e+00 7.62147e+00 235.318 7.49472e+01 55.318  0.9362 
1 1 1 -5  121 2  o 14 2.54909e+00 7.71829e-01 4.81209e+01 321.264 3.93825e+00  -3.15920e+00 0.00000e+00 0.00000e+00 3.59681e+01 321.264 1.21528e+01 141.264 0.8945 
1 1 1 -5  121 3  o 15 3.39896e+00 9.14257e-01 5.01830e+01 199.083 -5.69592e+00 -1.97056e+00 0.00000e+00 0.00000e+00 6.41917e+01 199.083 1.40087e+01 199.083 0.9128 
1 1 1 -5  121 4  o 19 2.86867e+00 8.46388e-01 6.35003e+00 77.359  1.52829e-01  6.81447e-01  0.00000e+00 0.00000e+00 2.84811e+01 77.359  2.21311e+01 77.359  0.3295 
1 1 1 -5  121 5  o 3  3.22059e+00 9.16527e-01 4.12861e+01 117.600 -2.37649e+00 4.54577e+00  0.00000e+00 0.00000e+00 6.50353e+01 117.600 2.37492e+01 117.600 0.8963 
1 1 1 -5  122 1  f 0  2.61166e+00 8.15037e-01 1.03898e+02 254.717 -2.84359e+00 -1.04066e+01 0.00000e+00 0.00000e+00 1.21663e+01 74.717  1.16064e+02 74.717  0.9525 
1 1 1 -5  122 2  o 4  2.68115e+00 8.25189e-01 6.01737e+01 310.958 3.94147e+00  -4.54091e+00 0.00000e+00 0.00000e+00 3.00268e+01 310.958 3.01468e+01 130.958 0.9126 
1 1 1 -5  122 3  o 19 2.53826e+00 7.76411e-01 4.36123e+01 79.503  8.40110e-01  4.53401e+00  0.00000e+00 0.00000e+00 3.90336e+01 79.503  4.57876e+00 259.503 0.8835 
1 1 1 -5  122 4  o 7  2.75780e+00 8.42801e-01 3.51465e+01 140.190 -3.16483e+00 2.63777e+00  0.00000e+00 0.00000e+00 5.30328e+01 140.190 1.78863e+01 140.190 0.8680 
1 1 1 -5  122 5  o 15 2.63419e+00 8.13873e-01 5.44003e+01 177.210 -5.71728e+00 2.78579e-01  0.00000e+00 0.00000e+00 3.36529e+01 177.210 2.07474e+01 357.210 0.9078 
1 1 1 -5  123 1  o 12 2.57004e+00 7.99454e-01 6.80679e+01 204.802 -6.90933e+00 -3.19283e+00 0.00000e+00 0.00000e+00 2.02125e+01 204.802 4.78554e+01 24.802  0.9318 
1 1 1 -5  123 2  o 1  3.93827e+00 9.46125e-01 1.08783e+02 167.336 -1.43697e+01 3.22883e+00  0.00000e+00 0.00000e+00 3.13396e+01 167.336 7.74432e+01 347.336 0.9654 
1 1 1 -5  123 3  o 8  1.93781e+00 6.67405e-01 2.63125e+01 310.495 1.77418e+00  -2.07764e+00 0.00000e+00 0.00000e+00 2.99464e+01 310.495 3.63393e+00 310.495 0.7880 
1 1 1 -5  124 1  o 4  2.60800e+00 8.18956e-01 5.54631e+01 219.653 -4.66602e+00 -3.86734e+00 0.00000e+00 0.00000e+00 3.23130e+01 219.653 2.31500e+01 39.653  0.9133 
1 1 1 -4  0   1  o 7  2.00774e+01 6.26932e-01 1.86572e+02 180.000 -8.98976e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.53978e+02 180.000 1.67406e+02 180.000 0.7158 
1 1 1 -4  0   2  o 19 1.30848e+01 4.99785e-01 1.50586e+02 180.000 -5.09331e-01 -0.00000e+00 0.00000e+00 0.00000e+00 8.03856e+01 180.000 7.01999e+01 0.000   0.4694 
1 1 1 -4  0   3  o 8  3.04941e+01 8.66011e-01 7.20433e+02 180.000 -6.85021e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.25883e+02 180.000 2.94550e+02 0.000   1.0000 
1 1 1 -4  0   4  o 5  3.27336e+01 9.22025e-01 4.00869e+02 0.000   5.30208e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.29113e+02 0.000   4.28244e+02 0.000   1.0000 
1 1 1 -4  0   6  o 15 2.16307e+01 5.48398e-01 7.14648e+02 0.000   7.40888e+00  0.00000e+00  0.00000e+00 0.00000e+00 9.74192e+01 0.000   6.17229e+02 180.000 1.0000 
1 1 1 -4  0   7  o 14 2.13529e+01 5.37482e-01 3.65139e+02 0.000   4.65272e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.35906e+02 0.000   7.07664e+01 0.000   0.9998 
1 1 1 -4  0   8  o 10 3.18489e+01 7.42293e-01 6.23680e+02 0.000   1.26877e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.70594e+02 0.000   5.30854e+01 180.000 1.0000 
1 1 1 -4  0   9  o 13 5.04815e+01 1.12873e+00 1.04423e+03 180.000 -4.56567e+01 -0.00000e+00 0.00000e+00 0.00000e+00 8.47449e+02 180.000 1.96776e+02 0.000   1.0000 
1 1 1 -4  0   10 o 19 9.28477e+00 4.71794e-01 1.02322e+02 0.000   1.16917e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.84157e+02 0.000   8.18351e+01 0.000   0.8240 
1 1 1 -4  0   11 o 6  1.72906e+01 7.89475e-01 2.23109e+02 180.000 -6.20544e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.23808e+02 180.000 2.00699e+02 180.000 1.0000 
1 1 1 -4  0   12 o 5  1.04412e+01 6.45028e-01 1.37080e+02 180.000 -3.07609e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.51579e+02 180.000 1.14500e+02 180.000 0.9958 
1 1 1 -4  0   13 o 5  2.97978e+01 7.54777e-01 5.89583e+02 180.000 -5.06603e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.23304e+02 180.000 6.62796e+01 0.000   1.0000 
1 1 1 -4  0   14 o 9  1.78285e+01 6.75103e-01 3.34833e+02 180.000 -2.38786e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.30367e+02 180.000 4.46567e+00 0.000   1.0000 
1 1 1 -4  0   15 o 11 1.65752e+01 7.58396e-01 2.84842e+02 0.000   2.64226e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.32951e+02 0.000   4.81088e+01 0.000   1.0000 
1 1 1 -4  0   16 o 13 2.50470e+00 1.55462e+00 1.20845e+01 180.000 -1.63470e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.02506e+00 180.000 9.05947e+00 0.000   0.1620 
1 1 1 -4  0   17 o 12 3.24922e+00 1.84920e+00 6.89537e+01 180.000 -1.28640e+00 -0.00000e+00 0.00000e+00 0.00000e+00 3.47400e+01 180.000 3.42137e+01 0.000   0.8582 
1 1 1 -4  0   18 f 0  1.16098e+01 1.30941e+00 1.78243e+02 0.000   1.70637e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.52961e+02 0.000   7.47182e+01 0.000   1.0000 
1 1 1 -4  0   19 o 8  3.20753e+00 2.04865e+00 7.09720e+01 180.000 -1.49353e+00 -0.00000e+00 0.00000e+00 0.00000e+00 3.65815e+01 180.000 3.43905e+01 0.000   0.9040 
1 1 1 -4  0   20 f 0  1.83787e+01 1.57442e+00 1.11847e+02 0.000   2.02799e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.68962e+02 0.000   4.57114e+02 0.000   1.0000 
1 1 1 -4  1   1  o 12 6.05217e+01 1.16416e+00 1.27823e+03 113.090 -1.43903e+01 3.37547e+01  0.00000e+00 0.00000e+00 9.66919e+02 113.090 3.11315e+02 293.090 0.9863 
1 1 1 -4  1   2  o 11 3.66360e+01 7.21796e-01 9.98432e+02 322.481 1.49233e+01  -1.14589e+01 0.00000e+00 0.00000e+00 3.42077e+02 322.481 6.56355e+02 142.481 0.9731 
1 1 1 -4  1   3  o 3  3.51246e+01 6.94013e-01 3.32902e+02 151.731 -6.40851e+00 3.44618e+00  0.00000e+00 0.00000e+00 8.93069e+02 151.731 5.60168e+02 151.731 0.9285 
1 1 1 -4  1   4  o 4  4.58014e+01 8.89986e-01 1.03353e+03 44.197  2.72576e+01  2.65037e+01  0.00000e+00 0.00000e+00 6.64777e+02 44.197  3.68753e+02 224.196 0.9868 
1 1 1 -4  1   5  o 14 2.85807e+01 5.79295e-01 6.32723e+02 227.141 -1.05748e+01 -1.13964e+01 0.00000e+00 0.00000e+00 4.05676e+02 227.141 2.27047e+02 47.141  0.9673 
1 1 1 -4  1   6  o 10 1.83530e+01 3.75992e-01 1.87372e+02 58.636  1.71549e+00  2.81443e+00  0.00000e+00 0.00000e+00 3.84299e+02 58.636  1.96927e+02 58.636  0.8297 
1 1 1 -4  1   7  o 6  1.73645e+01 3.33179e-01 2.75194e+02 281.069 1.09566e+00  -5.60046e+00 0.00000e+00 0.00000e+00 3.16108e+02 281.069 4.09145e+01 281.069 0.9075 
1 1 1 -4  1   8  o 3  6.39076e+01 1.00307e+00 1.36672e+03 215.313 -8.94749e+01 -6.33832e+01 0.00000e+00 0.00000e+00 1.01874e+03 215.313 3.47979e+02 35.313  0.9954 
1 1 1 -4  1   9  o 12 3.50083e+01 5.72110e-01 6.25860e+02 299.708 1.89988e+01  -3.32972e+01 0.00000e+00 0.00000e+00 6.68768e+02 299.708 4.29078e+01 299.708 0.9869 
1 1 1 -4  1   10 o 11 6.74237e+00 3.59785e-01 1.80419e+02 137.491 -2.20515e+00 2.02128e+00  0.00000e+00 0.00000e+00 2.39141e+01 137.491 1.56505e+02 317.491 0.8093 
1 1 1 -4  1   11 o 10 3.55983e+01 6.00683e-01 6.74077e+02 276.810 9.12605e+00  -7.64245e+01 0.00000e+00 0.00000e+00 6.49143e+02 276.810 2.49346e+01 96.810  0.9935 
1 1 1 -4  1   12 o 4  1.35642e+01 4.73622e-01 2.84023e+02 139.603 -1.25942e+01 1.07175e+01  0.00000e+00 0.00000e+00 2.07463e+02 139.603 7.65602e+01 319.603 0.9693 
1 1 1 -4  1   13 o 1  4.55374e+00 7.98962e-01 1.01289e+02 189.742 -2.52550e+00 -4.33621e-01 0.00000e+00 0.00000e+00 2.99426e+01 189.742 7.13467e+01 9.742   0.7716 
1 1 1 -4  1   14 o 11 7.90063e+00 6.11035e-01 1.92106e+02 316.026 8.55218e+00  -8.25118e+00 0.00000e+00 0.00000e+00 8.99857e+01 316.026 1.02120e+02 136.026 0.9570 
1 1 1 -4  1   15 o 3  1.05055e+01 5.98699e-01 1.87350e+02 101.029 -4.15310e+00 2.13076e+01  0.00000e+00 0.00000e+00 1.95085e+02 101.029 7.73482e+00 101.029 0.9767 
1 1 1 -4  1   16 o 3  6.67537e+00 8.95312e-01 1.48346e+02 290.280 4.03763e+00  -1.09268e+01 0.00000e+00 0.00000e+00 8.92635e+01 290.280 5.90827e+01 110.280 0.9561 
1 1 1 -4  1   17 o 6  1.21763e+01 7.62824e-01 2.13347e+02 97.156  -4.89495e+00 3.89873e+01  0.00000e+00 0.00000e+00 2.33657e+02 97.156  2.03099e+01 97.156  0.9872 
1 1 1 -4  1   18 o 18 3.91010e+00 1.17435e+00 1.02216e+02 144.370 -4.61914e+00 3.31059e+00  0.00000e+00 0.00000e+00 2.95239e+01 144.370 7.26926e+01 324.370 0.9071 
1 1 1 -4  1   19 o 5  3.56321e+00 1.17422e+00 1.34113e+02 279.407 1.24246e+00  -7.49952e+00 0.00000e+00 0.00000e+00 1.09694e+01 99.407  1.45083e+02 99.407  0.9317 
1 1 1 -4  1   20 o 17 6.03956e+00 1.64604e+00 9.60497e+01 63.145  3.36349e+00  6.64280e+00  0.00000e+00 0.00000e+00 1.12059e+02 63.145  1.60096e+01 63.145  0.9302 
1 1 1 -4  2   1  o 15 3.67032e+01 7.24774e-01 8.00174e+02 116.342 -6.20039e+00 1.25223e+01  0.00000e+00 0.00000e+00 5.29978e+02 116.342 2.70196e+02 296.342 0.9635 
1 1 1 -4  2   2  o 7  2.95222e+01 5.95567e-01 4.86762e+02 96.735  -8.65108e-01 7.32581e+00  0.00000e+00 0.00000e+00 5.45117e+02 96.735  5.83549e+01 96.735  0.9295 
1 1 1 -4  2   3  o 13 1.87724e+01 4.19014e-01 5.40509e+02 350.243 6.22802e+00  -1.07100e+00 0.00000e+00 0.00000e+00 1.06636e+02 350.243 4.33873e+02 170.243 0.9171 
1 1 1 -4  2   4  f 0  9.86755e+00 3.16024e-01 2.54521e+02 9.906   2.00423e+00  3.50009e-01  0.00000e+00 0.00000e+00 6.28469e+00 9.906   2.48236e+02 189.906 0.7034 
1 1 1 -4  2   5  o 17 3.20002e+01 6.40477e-01 4.15422e+02 297.239 5.21835e+00  -1.01368e+01 0.00000e+00 0.00000e+00 7.32543e+02 297.239 3.17121e+02 297.239 0.9551 
1 1 1 -4  2   6  o 17 1.43705e+01 3.28435e-01 3.32516e+02 268.774 -9.79352e-02 -4.57827e+00 0.00000e+00 0.00000e+00 1.43656e+02 268.774 1.88860e+02 88.775  0.8826 
1 1 1 -4  2   7  o 14 2.44584e+01 4.22707e-01 6.17291e+02 176.895 -1.67649e+01 9.09523e-01  0.00000e+00 0.00000e+00 2.72652e+02 176.895 3.44639e+02 356.895 0.9697 
1 1 1 -4  2   8  o 17 2.69499e+01 4.56030e-01 4.00914e+02 29.377  1.20423e+01  6.77909e+00  0.00000e+00 0.00000e+00 5.72374e+02 29.377  1.71460e+02 29.377  0.9631 
1 1 1 -4  2   9  o 10 2.35904e+01 4.15242e-01 6.26219e+02 78.115  5.34928e+00  2.54163e+01  0.00000e+00 0.00000e+00 2.40585e+02 78.115  3.85634e+02 258.115 0.9806 
1 1 1 -4  2   10 o 10 2.22613e+01 4.09264e-01 4.10031e+02 297.807 1.04507e+01  -1.98158e+01 0.00000e+00 0.00000e+00 4.04714e+02 297.807 5.31685e+00 117.807 0.9774 
1 1 1 -4  2   11 o 8  1.44198e+01 3.91578e-01 1.29075e+02 241.876 -2.84911e+00 -5.33049e+00 0.00000e+00 0.00000e+00 3.63520e+02 241.876 2.34445e+02 241.876 0.9130 
1 1 1 -4  2   12 o 1  9.08057e+00 5.80324e-01 6.88283e+01 36.658  2.13264e+00  1.58717e+00  0.00000e+00 0.00000e+00 1.96347e+02 36.658  1.27518e+02 36.658  0.7812 
1 1 1 -4  2   13 o 12 1.54207e+01 4.42899e-01 1.65609e+02 215.403 -1.21190e+01 -8.61340e+00 0.00000e+00 0.00000e+00 3.90600e+02 215.403 2.24991e+02 215.403 0.9658 
1 1 1 -4  2   14 o 16 1.59441e+01 4.74671e-01 2.83150e+02 90.494  -3.11202e-01 3.61230e+01  0.00000e+00 0.00000e+00 3.03446e+02 90.494  2.02955e+01 90.494  0.9861 
1 1 1 -4  2   15 o 19 6.50153e+00 8.74176e-01 1.05167e+02 72.067  2.14306e+00  6.62221e+00  0.00000e+00 0.00000e+00 1.19004e+02 72.067  1.38366e+01 72.067  0.9251 
1 1 1 -4  2   16 o 6  8.94414e+00 7.39290e-01 2.06197e+02 279.020 3.60231e+00  -2.26921e+01 0.00000e+00 0.00000e+00 1.19469e+02 279.020 8.67282e+01 99.020  0.9780 
1 1 1 -4  2   17 o 10 1.02257e+01 8.19420e-01 2.23244e+02 215.276 -2.74948e+01 -1.94499e+01 0.00000e+00 0.00000e+00 1.51330e+02 215.276 7.19139e+01 35.276  0.9850 
1 1 1 -4  2   18 o 9  1.10288e+01 9.72844e-01 2.57552e+02 22.365  4.21654e+01  1.73495e+01  0.00000e+00 0.00000e+00 1.47554e+02 22.365  1.09999e+02 202.365 0.9890 
1 1 1 -4  2   19 o 1  8.23266e+00 1.42508e+00 1.01386e+02 129.338 -7.05834e+00 8.61181e+00  0.00000e+00 0.00000e+00 1.89938e+02 129.338 8.85523e+01 129.338 0.9540 
1 1 1 -4  2   20 o 10 1.44553e+01 1.29916e+00 2.29898e+02 294.613 2.34630e+01  -5.12170e+01 0.00000e+00 0.00000e+00 3.00799e+02 294.613 7.09008e+01 294.613 0.9911 
1 1 1 -4  3   1  o 19 3.59349e+01 7.10088e-01 7.48244e+02 333.489 1.13678e+01  -5.67040e+00 0.00000e+00 0.00000e+00 5.49014e+02 333.489 1.99229e+02 153.489 0.9598 
1 1 1 -4  3   2  o 12 3.40881e+01 6.76510e-01 7.93653e+02 196.563 -1.32184e+01 -3.93118e+00 0.00000e+00 0.00000e+00 4.40771e+02 196.563 3.52882e+02 16.563  0.9630 
1 1 1 -4  3   3  o 13 2.76495e+01 5.62436e-01 4.89505e+02 202.241 -7.75442e+00 -3.17097e+00 0.00000e+00 0.00000e+00 4.85707e+02 202.241 3.79826e+00 22.241  0.9383 
1 1 1 -4  3   4  o 11 1.61135e+01 3.78365e-01 4.16415e+02 347.082 5.27811e+00  -1.21054e+00 0.00000e+00 0.00000e+00 1.29860e+02 347.082 2.86555e+02 167.082 0.9022 
1 1 1 -4  3   5  o 7  1.12967e+01 3.95803e-01 3.68748e+02 57.228  1.93783e+00  3.01021e+00  0.00000e+00 0.00000e+00 1.01318e+01 237.228 3.78880e+02 237.228 0.8452 
1 1 1 -4  3   6  f 0  1.71277e+01 3.61480e-01 2.26307e+02 123.651 -2.05495e+00 3.08703e+00  0.00000e+00 0.00000e+00 3.21081e+02 123.651 9.47739e+01 123.651 0.8513 
1 1 1 -4  3   7  o 14 4.60742e+01 7.33224e-01 7.58373e+02 274.337 2.91431e+00  -3.84278e+01 0.00000e+00 0.00000e+00 9.47797e+02 274.337 1.89424e+02 274.337 0.9869 
1 1 1 -4  3   8  o 12 1.38975e+01 3.01389e-01 3.30986e+02 67.828  2.22542e+00  5.46081e+00  0.00000e+00 0.00000e+00 1.43617e+02 67.828  1.87369e+02 247.828 0.9107 
1 1 1 -4  3   9  o 11 2.07065e+01 3.80160e-01 3.13531e+02 239.804 -5.74387e+00 -9.87040e+00 0.00000e+00 0.00000e+00 4.27594e+02 239.804 1.14063e+02 239.804 0.9552 
1 1 1 -4  3   10 o 16 2.88186e+01 4.65151e-01 5.13634e+02 225.703 -2.53074e+01 -2.59358e+01 0.00000e+00 0.00000e+00 5.50468e+02 225.703 3.68335e+01 225.703 0.9861 
1 1 1 -4  3   11 o 6  1.24013e+01 3.92485e-01 2.69979e+02 131.802 -7.24483e+00 8.10224e+00  0.00000e+00 0.00000e+00 1.72117e+02 131.802 9.78614e+01 311.802 0.9528 
1 1 1 -4  3   12 o 7  1.06007e+01 4.50966e-01 1.69275e+02 3.384   7.69891e+00  4.55293e-01  0.00000e+00 0.00000e+00 2.00336e+02 3.384   3.10611e+01 3.384   0.9327 
1 1 1 -4  3   13 o 17 9.24585e+00 6.04622e-01 1.23817e+02 202.119 -6.06158e+00 -2.46370e+00 0.00000e+00 0.00000e+00 1.93884e+02 202.119 7.00666e+01 202.119 0.9200 
1 1 1 -4  3   14 o 14 5.87987e+00 7.53140e-01 1.19593e+02 215.263 -4.37026e+00 -3.09003e+00 0.00000e+00 0.00000e+00 7.80616e+01 215.263 4.15310e+01 35.263  0.9010 
1 1 1 -4  3   15 o 17 1.59482e+01 6.08878e-01 2.37829e+02 315.490 2.97516e+01  -2.92468e+01 0.00000e+00 0.00000e+00 3.49419e+02 315.490 1.11591e+02 315.490 0.9879 
1 1 1 -4  3   16 o 16 9.39400e+00 7.50668e-01 1.76083e+02 209.979 -1.77782e+01 -1.02555e+01 0.00000e+00 0.00000e+00 1.65029e+02 209.979 1.10541e+01 29.979  0.9753 
1 1 1 -4  3   17 o 17 1.24016e+01 7.40355e-01 2.26119e+02 91.762  -1.31640e+00 4.27952e+01  0.00000e+00 0.00000e+00 2.29640e+02 91.762  3.52179e+00 91.762  0.9883 
1 1 1 -4  3   18 o 10 4.79102e+00 1.26897e+00 6.50454e+01 48.453  2.76931e+00  3.12502e+00  0.00000e+00 0.00000e+00 8.97561e+01 48.453  2.47107e+01 48.453  0.8699 
1 1 1 -4  3   19 o 5  3.65895e+00 1.20624e+00 2.02413e+01 296.443 5.13020e-01  -1.03151e+00 0.00000e+00 0.00000e+00 4.73041e+01 296.443 2.70629e+01 296.443 0.4977 
1 1 1 -4  3   20 o 1  5.70461e+00 1.56149e+00 7.64577e+01 2.527   5.97770e+00  2.63826e-01  0.00000e+00 0.00000e+00 1.16284e+02 2.527   3.98263e+01 2.527   0.9121 
1 1 1 -4  4   1  o 19 1.62407e+01 3.86775e-01 8.32723e+02 324.302 5.15382e+00  -3.70308e+00 0.00000e+00 0.00000e+00 2.72318e+02 144.302 1.10504e+03 144.302 0.9174 
1 1 1 -4  4   2  o 17 5.06663e+01 9.79592e-01 9.67520e+02 84.847  2.21522e+00  2.45636e+01  0.00000e+00 0.00000e+00 8.98628e+02 84.847  6.88927e+01 264.847 0.9795 
1 1 1 -4  4   3  o 19 3.79956e+01 7.45911e-01 9.92510e+02 236.875 -1.26415e+01 -1.93734e+01 0.00000e+00 0.00000e+00 4.04549e+02 236.875 5.87962e+02 56.875  0.9781 
1 1 1 -4  4   4  o 7  1.28260e+01 3.39475e-01 3.50560e+02 292.460 1.38089e+00  -3.34037e+00 0.00000e+00 0.00000e+00 5.75956e+01 292.460 2.92965e+02 112.460 0.8469 
1 1 1 -4  4   5  o 14 3.21799e+01 6.44680e-01 6.39493e+02 307.235 1.06272e+01  -1.39831e+01 0.00000e+00 0.00000e+00 5.34260e+02 307.235 1.05234e+02 127.235 0.9711 
1 1 1 -4  4   6  o 10 2.76037e+01 5.08473e-01 4.85342e+02 114.513 -5.29677e+00 1.16156e+01  0.00000e+00 0.00000e+00 5.09491e+02 114.513 2.41492e+01 114.513 0.9600 
1 1 1 -4  4   7  o 6  8.00321e+00 3.75648e-01 1.42523e+02 61.133  6.11727e-01  1.10967e+00  0.00000e+00 0.00000e+00 1.75517e+01 61.133  1.24972e+02 241.133 0.5331 
1 1 1 -4  4   8  f 0  3.50530e+01 5.70376e-01 5.14574e+02 76.466  5.37715e+00  2.23390e+01  0.00000e+00 0.00000e+00 7.70892e+02 76.466  2.56318e+02 76.466  0.9780 
1 1 1 -4  4   9  o 2  5.81419e+01 9.15521e-01 9.40794e+02 320.609 7.26589e+01  -5.96635e+01 0.00000e+00 0.00000e+00 1.22627e+03 320.609 2.85479e+02 320.609 0.9947 
1 1 1 -4  4   10 o 17 4.28373e+01 7.01022e-01 7.75863e+02 166.346 -7.80469e+01 1.89597e+01  0.00000e+00 0.00000e+00 8.18121e+02 166.346 4.22581e+01 166.346 0.9938 
1 1 1 -4  4   11 o 15 2.66317e+01 5.94270e-01 3.58581e+02 66.390  1.22629e+01  2.80557e+01  0.00000e+00 0.00000e+00 6.21408e+02 66.390  2.62826e+02 66.390  0.9835 
1 1 1 -4  4   12 o 14 2.87994e+01 5.84351e-01 4.73144e+02 322.753 4.60911e+01  -3.50444e+01 0.00000e+00 0.00000e+00 5.94087e+02 322.753 1.20943e+02 322.753 0.9913 
1 1 1 -4  4   13 o 17 1.30318e+01 4.70967e-01 2.40893e+02 281.434 3.61136e+00  -1.78556e+01 0.00000e+00 0.00000e+00 2.32253e+02 281.434 8.64044e+00 101.434 0.9722 
1 1 1 -4  4   14 o 12 6.42788e+00 8.27156e-01 1.10509e+02 60.543  2.61471e+00  4.62949e+00  0.00000e+00 0.00000e+00 1.05393e+02 60.543  5.11594e+00 240.542 0.9002 
1 1 1 -4  4   15 o 9  3.15680e+00 8.85475e-01 4.70126e+01 101.224 -2.92870e-01 1.47584e+00  0.00000e+00 0.00000e+00 2.32613e+01 101.224 2.37513e+01 281.224 0.5973 
1 1 1 -4  4   16 o 11 5.25365e+00 9.87599e-01 1.25584e+02 184.427 -7.45168e+00 -5.76939e-01 0.00000e+00 0.00000e+00 5.64105e+01 184.427 6.91732e+01 4.427   0.9305 
1 1 1 -4  4   17 o 17 1.05048e+01 8.35601e-01 1.25606e+02 154.719 -1.75843e+01 8.30508e+00  0.00000e+00 0.00000e+00 2.54851e+02 154.719 1.29245e+02 154.719 0.9739 
1 1 1 -4  4   18 o 8  1.17184e+01 9.84379e-01 2.13688e+02 1.556   3.99003e+01  1.08359e+00  0.00000e+00 0.00000e+00 2.16055e+02 1.556   2.36779e+00 1.556   0.9874 
1 1 1 -4  4   19 o 4  6.37787e+00 1.49948e+00 6.63833e+01 133.795 -3.70853e+00 3.86787e+00  0.00000e+00 0.00000e+00 1.46788e+02 133.795 8.04051e+01 133.795 0.9011 
1 1 1 -4  4   20 o 18 8.96012e+00 1.66000e+00 9.80656e+01 258.906 -2.19208e+00 -1.11795e+01 0.00000e+00 0.00000e+00 2.18921e+02 258.906 1.20855e+02 258.906 0.9550 
1 1 1 -4  5   1  o 3  3.69264e+01 7.29267e-01 5.92685e+02 335.218 9.17725e+00  -4.23699e+00 0.00000e+00 0.00000e+00 7.25573e+02 335.218 1.32888e+02 335.218 0.9492 
1 1 1 -4  5   2  o 3  2.36247e+01 4.96930e-01 3.97165e+02 182.441 -4.69871e+00 -2.00339e-01 0.00000e+00 0.00000e+00 3.89906e+02 182.441 7.25899e+00 2.441   0.8860 
1 1 1 -4  5   3  o 11 2.38098e+01 4.96671e-01 4.20853e+02 222.689 -6.01585e+00 -5.54904e+00 0.00000e+00 0.00000e+00 4.17557e+02 222.689 3.29670e+00 42.689  0.9368 
1 1 1 -4  5   4  o 10 2.65399e+01 5.43977e-01 5.39379e+02 266.324 -7.31710e-01 -1.13903e+01 0.00000e+00 0.00000e+00 4.13145e+02 266.324 1.26234e+02 86.324  0.9551 
1 1 1 -4  5   5  o 6  3.35953e+01 6.70119e-01 5.22600e+02 58.965  7.69391e+00  1.27869e+01  0.00000e+00 0.00000e+00 6.96191e+02 58.965  1.73590e+02 58.965  0.9659 
1 1 1 -4  5   6  o 1  2.54214e+01 4.75743e-01 4.65022e+02 216.711 -9.01595e+00 -6.72295e+00 0.00000e+00 0.00000e+00 4.45856e+02 216.711 1.91652e+01 36.711  0.9545 
1 1 1 -4  5   7  o 10 3.20847e+01 5.27638e-01 6.50205e+02 98.272  -3.32038e+00 2.28371e+01  0.00000e+00 0.00000e+00 5.27240e+02 98.272  1.22964e+02 278.272 0.9781 
1 1 1 -4  5   8  o 12 4.74823e+01 7.53253e-01 1.00161e+03 50.370  3.83842e+01  4.63492e+01  0.00000e+00 0.00000e+00 7.63979e+02 50.370  2.37627e+02 230.370 0.9917 
1 1 1 -4  5   9  o 12 2.44405e+01 4.07816e-01 4.62650e+02 310.656 1.29325e+01  -1.50589e+01 0.00000e+00 0.00000e+00 4.29793e+02 310.656 3.28561e+01 130.656 0.9745 
1 1 1 -4  5   10 o 11 3.39715e+01 5.48707e-01 7.42296e+02 33.824  5.10362e+01  3.41968e+01  0.00000e+00 0.00000e+00 5.19322e+02 33.824  2.22974e+02 213.824 0.9918 
1 1 1 -4  5   11 o 7  1.46280e+01 3.75064e-01 2.85891e+02 273.766 8.91573e-01  -1.35454e+01 0.00000e+00 0.00000e+00 2.40832e+02 273.766 4.50595e+01 93.766  0.9624 
1 1 1 -4  5   12 o 18 2.67426e+01 5.11092e-01 4.60620e+02 327.782 4.45460e+01  -2.80713e+01 0.00000e+00 0.00000e+00 5.29512e+02 327.782 6.88916e+01 327.782 0.9905 
1 1 1 -4  5   13 o 14 1.32448e+01 4.73255e-01 2.10815e+02 116.850 -7.82214e+00 1.54519e+01  0.00000e+00 0.00000e+00 2.69332e+02 116.850 5.85168e+01 116.850 0.9707 
1 1 1 -4  5   14 o 17 4.28857e+00 8.55049e-01 1.01523e+02 318.105 2.40909e+00  -2.16117e+00 0.00000e+00 0.00000e+00 3.06494e+01 318.105 7.08741e+01 138.105 0.8261 
1 1 1 -4  5   15 o 10 4.50749e+00 9.41429e-01 4.93470e+01 48.479  1.46622e+00  1.65603e+00  0.00000e+00 0.00000e+00 7.32358e+01 48.479  2.38888e+01 48.479  0.7297 
1 1 1 -4  5   16 o 1  5.84525e+00 9.38605e-01 1.01252e+02 63.784  3.21640e+00  6.53208e+00  0.00000e+00 0.00000e+00 1.00813e+02 63.784  4.38911e-01 243.784 0.9285 
1 1 1 -4  5   17 o 5  5.31000e+00 1.09534e+00 1.34261e+02 231.922 -5.69622e+00 -7.27036e+00 0.00000e+00 0.00000e+00 5.21794e+01 231.922 8.20817e+01 51.922  0.9442 
1 1 1 -4  5   18 o 14 5.43475e+00 1.29218e+00 1.06787e+02 359.830 7.93706e+00  -2.35741e-02 0.00000e+00 0.00000e+00 8.18805e+01 359.830 2.49066e+01 179.830 0.9347 
1 1 1 -4  5   19 o 3  6.64584e+00 1.44940e+00 4.77105e+01 120.800 -2.12831e+00 3.57031e+00  0.00000e+00 0.00000e+00 1.66576e+02 120.800 1.18866e+02 120.800 0.8693 
1 1 1 -4  5   20 o 18 3.69086e+00 1.25579e+00 4.39674e+01 285.200 7.69284e-01  -2.83145e+00 0.00000e+00 0.00000e+00 6.60891e+01 285.200 2.21217e+01 285.200 0.8050 
1 1 1 -4  6   1  o 16 2.11098e+01 4.57995e-01 3.93504e+02 338.037 3.51502e+00  -1.41751e+00 0.00000e+00 0.00000e+00 2.85282e+02 338.037 1.08222e+02 158.037 0.8549 
1 1 1 -4  6   2  o 5  2.80387e+01 5.70193e-01 3.91072e+02 51.026  3.41107e+00  4.21625e+00  0.00000e+00 0.00000e+00 5.60276e+02 51.026  1.69204e+02 51.026  0.9024 
1 1 1 -4  6   3  o 7  2.46764e+01 5.11635e-01 6.42494e+02 314.048 8.91605e+00  -9.21725e+00 0.00000e+00 0.00000e+00 2.48150e+02 314.048 3.94343e+02 134.048 0.9602 
1 1 1 -4  6   4  o 9  1.25429e+01 3.33834e-01 1.73449e+02 270.392 1.18146e-02  -1.72797e+00 0.00000e+00 0.00000e+00 1.31798e+02 270.392 4.16517e+01 90.392  0.6477 
1 1 1 -4  6   5  o 11 1.20424e+01 3.29161e-01 1.47009e+02 337.385 1.39070e+00  -5.79317e-01 0.00000e+00 0.00000e+00 1.23353e+02 337.385 2.36552e+01 157.385 0.5977 
1 1 1 -4  6   6  o 9  1.50297e+01 3.37216e-01 5.40615e+02 56.961  4.21184e+00  6.47607e+00  0.00000e+00 0.00000e+00 1.42896e+01 236.961 5.54905e+02 236.961 0.9328 
1 1 1 -4  6   7  o 9  2.47873e+01 4.26812e-01 4.32292e+02 105.660 -3.20067e+00 1.14175e+01  0.00000e+00 0.00000e+00 4.57593e+02 105.660 2.53017e+01 105.660 0.9569 
1 1 1 -4  6   8  o 3  2.12972e+01 3.81785e-01 5.17287e+02 267.313 -6.59297e-01 -1.40501e+01 0.00000e+00 0.00000e+00 2.52349e+02 267.313 2.64938e+02 87.313  0.9638 
1 1 1 -4  6   9  o 10 4.45153e+01 6.63602e-01 7.26879e+02 242.952 -2.55772e+01 -5.00935e+01 0.00000e+00 0.00000e+00 9.26248e+02 242.952 1.99369e+02 242.952 0.9911 
1 1 1 -4  6   10 o 11 3.68232e+01 5.86334e-01 6.62192e+02 335.360 5.38548e+01  -2.47018e+01 0.00000e+00 0.00000e+00 7.04895e+02 335.360 4.27033e+01 335.360 0.9915 
1 1 1 -4  6   11 o 16 1.93385e+01 3.98944e-01 3.18404e+02 298.407 9.49176e+00  -1.75497e+01 0.00000e+00 0.00000e+00 3.86735e+02 298.407 6.83314e+01 298.407 0.9746 
1 1 1 -4  6   12 f 0  1.77211e+01 4.35822e-01 4.43294e+02 209.504 -2.93743e+01 -1.66216e+01 0.00000e+00 0.00000e+00 2.09244e+02 209.504 2.34050e+02 29.504  0.9851 
1 1 1 -4  6   13 o 15 1.41944e+01 4.72456e-01 3.18155e+02 10.556  2.75247e+01  5.12902e+00  0.00000e+00 0.00000e+00 2.02395e+02 10.556  1.15760e+02 190.556 0.9820 
1 1 1 -4  6   14 o 3  1.48084e+01 5.02876e-01 2.35253e+02 175.914 -3.02891e+01 2.16360e+00  0.00000e+00 0.00000e+00 3.08063e+02 175.914 7.28099e+01 175.914 0.9834 
1 1 1 -4  6   15 o 9  7.15717e+00 7.46173e-01 9.14450e+01 5.615   6.89611e+00  6.78023e-01  0.00000e+00 0.00000e+00 1.55227e+02 5.615   6.37825e+01 5.615   0.9247 
1 1 1 -4  6   16 o 3  9.75433e+00 7.21681e-01 1.54746e+02 168.367 -1.98171e+01 4.07974e+00  0.00000e+00 0.00000e+00 1.99307e+02 168.367 4.45610e+01 168.367 0.9750 
1 1 1 -4  6   17 o 17 4.88865e+00 1.11779e+00 8.07447e+01 346.484 4.91228e+00  -1.18082e+00 0.00000e+00 0.00000e+00 8.18781e+01 346.484 1.13337e+00 346.484 0.8946 
1 1 1 -4  6   18 o 2  1.08904e+01 1.32604e+00 1.90557e+02 335.083 2.51689e+01  -1.16920e+01 0.00000e+00 0.00000e+00 2.06554e+02 335.083 1.59966e+01 335.083 0.9818 
1 1 1 -4  6   19 o 19 1.06448e+01 1.29299e+00 1.37888e+02 164.221 -2.06678e+01 5.84003e+00  0.00000e+00 0.00000e+00 2.47644e+02 164.221 1.09756e+02 164.221 0.9764 
1 1 1 -4  6   20 o 8  5.97400e+00 1.60718e+00 9.58996e+01 183.457 -7.73313e+00 -4.67169e-01 0.00000e+00 0.00000e+00 1.10568e+02 183.457 1.46683e+01 183.457 0.9330 
1 1 1 -4  7   1  o 5  3.75895e+01 7.41160e-01 7.44153e+02 277.166 1.56040e+00  -1.24111e+01 0.00000e+00 0.00000e+00 6.11857e+02 277.166 1.32296e+02 97.166  0.9592 
1 1 1 -4  7   2  o 5  3.36126e+01 6.68327e-01 6.99904e+02 66.442  4.57837e+00  1.05006e+01  0.00000e+00 0.00000e+00 5.07465e+02 66.442  1.92439e+02 246.442 0.9553 
1 1 1 -4  7   3  o 6  2.16522e+01 4.63301e-01 4.04722e+02 176.024 -6.99888e+00 4.86478e-01  0.00000e+00 0.00000e+00 3.48697e+02 176.024 5.60246e+01 356.024 0.9257 
1 1 1 -4  7   4  o 18 1.29964e+01 3.38953e-01 1.18224e+01 36.221  9.77017e-02  7.15616e-02  0.00000e+00 0.00000e+00 1.76940e+01 36.221  5.87152e+00 36.221  0.0604 
1 1 1 -4  7   5  o 11 9.43516e+00 2.91456e-01 1.19508e+02 198.528 -9.05648e-01 -3.03515e-01 0.00000e+00 0.00000e+00 3.29687e+01 198.528 8.65391e+01 18.528  0.4303 
1 1 1 -4  7   6  o 9  1.78908e+01 3.71308e-01 3.00243e+02 118.065 -2.39438e+00 4.49080e+00  0.00000e+00 0.00000e+00 3.01130e+02 118.065 8.87669e-01 118.065 0.8954 
1 1 1 -4  7   7  o 7  2.00143e+01 3.65306e-01 3.26226e+02 10.737  7.09245e+00  1.34486e+00  0.00000e+00 0.00000e+00 3.70547e+02 10.737  4.43205e+01 10.737  0.9279 
1 1 1 -4  7   8  o 8  1.77969e+01 3.39744e-01 4.48471e+02 193.877 -9.88717e+00 -2.44255e+00 0.00000e+00 0.00000e+00 1.85177e+02 193.877 2.63294e+02 13.877  0.9496 
1 1 1 -4  7   9  o 7  4.49863e+01 6.69680e-01 7.68047e+02 77.430  1.27906e+01  5.73613e+01  0.00000e+00 0.00000e+00 9.03194e+02 77.430  1.35147e+02 77.430  0.9915 
1 1 1 -4  7   10 o 5  1.26952e+01 3.33783e-01 2.49914e+02 317.993 5.71454e+00  -5.14656e+00 0.00000e+00 0.00000e+00 1.93346e+02 317.993 5.65679e+01 137.994 0.9325 
1 1 1 -4  7   11 o 12 1.84366e+01 3.93174e-01 3.32431e+02 223.114 -1.44908e+01 -1.35668e+01 0.00000e+00 0.00000e+00 3.39722e+02 223.114 7.29113e+00 223.114 0.9745 
1 1 1 -4  7   12 o 9  1.35018e+01 5.45171e-01 2.58029e+02 312.340 1.03228e+01  -1.13288e+01 0.00000e+00 0.00000e+00 2.29916e+02 312.340 2.81124e+01 132.340 0.9668 
1 1 1 -4  7   13 f 0  2.79142e+01 5.76843e-01 3.22726e+02 20.994  5.14594e+01  1.97469e+01  0.00000e+00 0.00000e+00 7.10241e+02 20.994  3.87515e+02 20.994  0.9909 
1 1 1 -4  7   14 o 12 4.21216e+00 8.92856e-01 4.83184e+01 74.318  4.40307e-01  1.56834e+00  0.00000e+00 0.00000e+00 5.01262e+01 74.318  1.80774e+00 74.318  0.6264 
1 1 1 -4  7   15 o 4  7.32332e+00 7.59072e-01 8.30227e+01 315.356 4.56085e+00  -4.50459e+00 0.00000e+00 0.00000e+00 1.67615e+02 315.356 8.45919e+01 315.356 0.9183 
1 1 1 -4  7   16 o 7  9.29120e+00 7.54620e-01 1.39904e+02 92.894  -8.68859e-01 1.71870e+01  0.00000e+00 0.00000e+00 1.95786e+02 92.894  5.58818e+01 92.894  0.9705 
1 1 1 -4  7   17 o 11 7.69164e+00 1.06673e+00 1.07637e+02 32.962  9.13063e+00  5.92095e+00  0.00000e+00 0.00000e+00 1.64899e+02 32.962  5.72625e+01 32.962  0.9529 
1 1 1 -4  7   18 o 15 1.17109e+01 9.67247e-01 1.20949e+02 280.515 4.34353e+00  -2.34008e+01 0.00000e+00 0.00000e+00 3.04745e+02 280.515 1.83796e+02 280.515 0.9788 
1 1 1 -4  7   19 o 19 4.46624e+00 1.35076e+00 9.87786e+01 20.841  5.76559e+00  2.19488e+00  0.00000e+00 0.00000e+00 5.27836e+01 20.841  4.59950e+01 200.841 0.9149 
1 1 1 -4  7   20 o 5  4.38612e+00 1.39993e+00 1.34471e+02 175.140 -9.41524e+00 8.00613e-01  0.00000e+00 0.00000e+00 1.91417e+01 175.140 1.15329e+02 355.140 0.9455 
1 1 1 -4  8   1  o 4  1.44627e+01 3.62618e-01 3.57059e+02 8.301   2.24938e+00  3.28206e-01  0.00000e+00 0.00000e+00 4.43158e+01 8.301   3.12743e+02 188.301 0.7379 
1 1 1 -4  8   2  o 3  1.77499e+01 5.87129e-01 1.15005e+02 132.577 -6.62288e-01 7.20814e-01  0.00000e+00 0.00000e+00 1.77886e+02 132.577 6.28808e+01 132.577 0.4389 
1 1 1 -4  8   3  o 3  1.75951e+01 3.98830e-01 2.59672e+02 153.443 -3.23450e+00 1.61671e+00  0.00000e+00 0.00000e+00 3.00468e+02 153.443 4.07966e+01 153.443 0.8469 
1 1 1 -4  8   4  o 5  6.85497e+00 2.98148e-01 9.51037e+01 297.847 2.38062e-01  -4.50620e-01 0.00000e+00 0.00000e+00 3.15125e+01 117.847 1.26616e+02 117.847 0.2469 
1 1 1 -4  8   5  o 8  2.00956e+01 4.00654e-01 3.22664e+02 51.535  3.14778e+00  3.96228e+00  0.00000e+00 0.00000e+00 3.52657e+02 51.535  2.99927e+01 51.535  0.8948 
1 1 1 -4  8   6  o 17 4.27817e+01 7.53211e-01 9.24017e+02 300.037 1.79135e+01  -3.09811e+01 0.00000e+00 0.00000e+00 6.59369e+02 300.037 2.64648e+02 120.037 0.9859 
1 1 1 -4  8   7  o 5  3.14132e+01 5.67939e-01 7.58987e+02 28.441  2.30390e+01  1.24785e+01  0.00000e+00 0.00000e+00 3.96865e+02 28.441  3.62122e+02 208.441 0.9807 
1 1 1 -4  8   8  o 11 1.20904e+01 2.98065e-01 7.52948e+01 95.516  -1.16314e-01 1.20445e+00  0.00000e+00 0.00000e+00 1.58569e+02 95.516  8.32746e+01 95.516  0.5159 
1 1 1 -4  8   9  o 13 4.22829e+01 6.32835e-01 7.57091e+02 96.643  -6.30004e+00 5.40975e+01  0.00000e+00 0.00000e+00 8.12609e+02 96.643  5.55180e+01 96.643  0.9908 
1 1 1 -4  8   10 o 17 5.04323e+01 7.73237e-01 8.06979e+02 268.679 -2.22372e+00 -9.64271e+01 0.00000e+00 0.00000e+00 1.07147e+03 268.679 2.64492e+02 268.679 0.9948 
1 1 1 -4  8   11 o 13 1.36113e+01 3.62533e-01 9.67753e+01 30.909  3.66248e+00  2.19271e+00  0.00000e+00 0.00000e+00 3.47833e+02 30.909  2.51057e+02 30.909  0.8731 
1 1 1 -4  8   12 o 14 1.91452e+01 4.57041e-01 2.84462e+02 175.751 -2.40510e+01 1.78697e+00  0.00000e+00 0.00000e+00 4.16172e+02 175.751 1.31710e+02 175.751 0.9790 
1 1 1 -4  8   13 o 15 8.68349e+00 5.23209e-01 2.51379e+02 83.665  1.48256e+00  1.33542e+01  0.00000e+00 0.00000e+00 6.05924e+01 83.665  1.90786e+02 263.665 0.9620 
1 1 1 -4  8   14 o 13 3.24277e+00 7.87184e-01 9.11743e+01 157.421 -2.24316e+00 9.32777e-01  0.00000e+00 0.00000e+00 4.19208e-01 157.421 9.07551e+01 337.421 0.7571 
1 1 1 -4  8   15 o 14 1.52159e+01 5.44502e-01 2.37509e+02 299.004 1.88641e+01  -3.40258e+01 0.00000e+00 0.00000e+00 3.22234e+02 299.004 8.47248e+01 299.004 0.9871 
1 1 1 -4  8   16 o 4  7.54232e+00 8.36039e-01 1.60308e+02 43.474  1.12524e+01  1.06686e+01  0.00000e+00 0.00000e+00 1.11263e+02 43.474  4.90448e+01 223.474 0.9672 
1 1 1 -4  8   17 o 4  4.97896e+00 1.17498e+00 5.64804e+01 276.796 4.12800e-01  -3.46392e+00 0.00000e+00 0.00000e+00 9.91272e+01 276.796 4.26468e+01 276.796 0.8405 
1 1 1 -4  8   18 o 12 7.74641e+00 1.28843e+00 1.05570e+02 239.631 -5.66511e+00 -9.66782e+00 0.00000e+00 0.00000e+00 1.68965e+02 239.631 6.33955e+01 239.631 0.9543 
1 1 1 -4  8   19 f 0  4.98676e+00 1.42034e+00 1.99488e+02 104.297 -3.27091e+00 1.28351e+01  0.00000e+00 0.00000e+00 2.16523e+01 284.297 2.21140e+02 284.297 0.9615 
1 1 1 -4  8   20 o 11 6.90353e+00 1.74917e+00 1.42026e+02 213.787 -9.84173e+00 -6.58517e+00 0.00000e+00 0.00000e+00 1.02635e+02 213.787 3.93915e+01 33.787  0.9568 
1 1 1 -4  9   1  o 3  4.11899e+01 8.06470e-01 5.77590e+02 308.698 7.62059e+00  -9.51261e+00 0.00000e+00 0.00000e+00 9.06532e+02 308.698 3.28942e+02 308.698 0.9581 
1 1 1 -4  9   2  o 9  2.09370e+01 4.52658e-01 2.98846e+02 292.515 1.58736e+00  -3.82928e+00 0.00000e+00 0.00000e+00 3.85150e+02 292.515 8.63046e+01 292.515 0.8689 
1 1 1 -4  9   3  o 14 3.33361e+01 9.54776e-01 5.94009e+02 129.105 -9.64504e+00 1.18662e+01  0.00000e+00 0.00000e+00 6.17317e+02 129.105 2.33087e+01 129.105 0.9667 
1 1 1 -4  9   4  o 8  9.38796e+00 3.06437e-01 9.67259e+01 145.542 -5.71591e-01 3.92220e-01  0.00000e+00 0.00000e+00 1.87351e+01 145.542 7.79908e+01 325.542 0.3273 
1 1 1 -4  9   5  o 12 2.42636e+01 4.61213e-01 5.17115e+02 296.501 4.33933e+00  -8.70281e+00 0.00000e+00 0.00000e+00 3.45941e+02 296.501 1.71174e+02 116.501 0.9471 
1 1 1 -4  9   6  o 15 2.03742e+01 4.04481e-01 3.76677e+02 149.572 -6.00862e+00 3.52922e+00  0.00000e+00 0.00000e+00 3.30909e+02 149.572 4.57673e+01 329.572 0.9252 
1 1 1 -4  9   7  o 7  1.57546e+01 3.44417e-01 4.08158e+02 52.083  4.35052e+00  5.58512e+00  0.00000e+00 0.00000e+00 1.39416e+02 52.083  2.68742e+02 232.083 0.9264 
1 1 1 -4  9   8  o 6  6.36825e+01 9.28267e-01 1.19308e+03 129.540 -6.29713e+01 7.62820e+01  0.00000e+00 0.00000e+00 1.18253e+03 129.540 1.05470e+01 309.540 0.9949 
1 1 1 -4  9   9  o 17 3.79540e+01 5.75105e-01 6.15513e+02 337.605 3.67760e+01  -1.51538e+01 0.00000e+00 0.00000e+00 7.88573e+02 337.605 1.73060e+02 337.605 0.9873 
1 1 1 -4  9   10 o 19 2.07757e+01 3.90134e-01 3.24554e+02 274.122 1.17093e+00  -1.62479e+01 0.00000e+00 0.00000e+00 4.29037e+02 274.122 1.04483e+02 274.122 0.9688 
1 1 1 -4  9   11 o 15 3.43818e+01 5.97569e-01 5.96806e+02 291.927 2.37166e+01  -5.89153e+01 0.00000e+00 0.00000e+00 6.79275e+02 291.927 8.24690e+01 291.927 0.9921 
1 1 1 -4  9   12 o 1  1.57337e+01 4.19129e-01 3.51105e+02 184.539 -2.44344e+01 -1.93963e+00 0.00000e+00 0.00000e+00 2.24871e+02 184.539 1.26234e+02 4.539   0.9794 
1 1 1 -4  9   13 f 0  1.08138e+01 5.94708e-01 1.33407e+02 29.934  7.61921e+00  4.38719e+00  0.00000e+00 0.00000e+00 2.46711e+02 29.934  1.13304e+02 29.934  0.9413 
1 1 1 -4  9   14 o 15 1.20645e+01 5.02816e-01 2.57808e+02 242.117 -1.26551e+01 -2.39184e+01 0.00000e+00 0.00000e+00 1.83885e+02 242.117 7.39230e+01 62.117  0.9813 
1 1 1 -4  9   15 o 19 1.75198e+01 5.58427e-01 1.91226e+02 353.667 3.57174e+01  -3.96391e+00 0.00000e+00 0.00000e+00 4.52552e+02 353.667 2.61327e+02 353.667 0.9860 
1 1 1 -4  9   16 o 12 1.28149e+01 6.39886e-01 2.30844e+02 2.807   4.06861e+01  1.99497e+00  0.00000e+00 0.00000e+00 2.40321e+02 2.807   9.47662e+00 2.807   0.9876 
1 1 1 -4  9   17 o 4  3.88032e+00 1.08613e+00 1.18739e+02 286.606 1.71217e+00  -5.74117e+00 0.00000e+00 0.00000e+00 1.28783e+01 286.606 1.05861e+02 106.606 0.9122 
1 1 1 -4  9   18 o 16 4.44146e+00 1.23134e+00 1.21155e+02 189.024 -7.55660e+00 -1.20010e+00 0.00000e+00 0.00000e+00 3.25987e+01 189.024 8.85563e+01 9.024   0.9322 
1 1 1 -4  9   19 o 16 7.29219e+00 1.52654e+00 1.27982e+02 10.323  1.13449e+01  2.06650e+00  0.00000e+00 0.00000e+00 1.30475e+02 10.323  2.49263e+00 10.323  0.9556 
1 1 1 -4  9   20 o 15 4.31788e+00 1.39364e+00 4.72642e+01 232.974 -1.97828e+00 -2.62281e+00 0.00000e+00 0.00000e+00 8.53262e+01 232.974 3.80620e+01 232.974 0.8290 
1 1 1 -4  10  1  o 19 3.34816e+01 9.40445e-01 5.93910e+02 266.559 -5.96483e-01 -9.92097e+00 0.00000e+00 0.00000e+00 6.00125e+02 266.559 6.21418e+00 266.559 0.9483 
1 1 1 -4  10  2  o 15 1.20010e+01 3.31696e-01 5.39236e+02 150.211 -3.65423e+00 2.09185e+00  0.00000e+00 0.00000e+00 1.46156e+02 330.211 6.85392e+02 330.211 0.8712 
1 1 1 -4  10  3  o 19 1.65030e+01 5.23875e-01 3.25834e+02 105.939 -1.13419e+00 3.97138e+00  0.00000e+00 0.00000e+00 2.12790e+02 105.939 1.13045e+02 285.939 0.8683 
1 1 1 -4  10  4  o 4  2.66075e+01 5.45374e-01 4.96820e+02 256.553 -2.31609e+00 -9.68679e+00 0.00000e+00 0.00000e+00 4.51286e+02 256.553 4.55333e+01 76.553  0.9484 
1 1 1 -4  10  5  o 11 2.16874e+01 5.03770e-01 3.78350e+02 171.845 -6.24966e+00 8.95586e-01  0.00000e+00 0.00000e+00 3.68514e+02 171.845 9.83585e+00 351.845 0.9170 
1 1 1 -4  10  6  o 4  8.64438e+00 2.87178e-01 2.51347e+02 56.754  1.07848e+00  1.64522e+00  0.00000e+00 0.00000e+00 2.67011e+01 236.754 2.78048e+02 236.754 0.6923 
1 1 1 -4  10  7  o 7  1.86569e+01 3.81205e-01 4.99044e+02 162.301 -1.16925e+01 3.73130e+00  0.00000e+00 0.00000e+00 1.71744e+02 162.301 3.27301e+02 342.301 0.9584 
1 1 1 -4  10  8  f 0  1.92646e+01 3.34915e-01 3.35509e+02 215.051 -7.00373e+00 -4.91332e+00 0.00000e+00 0.00000e+00 3.43151e+02 215.051 7.64139e+00 215.051 0.9396 
1 1 1 -4  10  9  o 19 2.19391e+01 3.75428e-01 4.32676e+02 224.306 -1.16177e+01 -1.13398e+01 0.00000e+00 0.00000e+00 3.63595e+02 224.306 6.90810e+01 44.306  0.9687 
1 1 1 -4  10  10 o 14 1.44263e+01 3.32149e-01 4.16601e+02 289.220 4.78478e+00  -1.37244e+01 0.00000e+00 0.00000e+00 1.04591e+02 289.220 3.12010e+02 109.220 0.9650 
1 1 1 -4  10  11 o 10 2.38400e+01 4.35061e-01 4.97806e+02 73.421  1.05730e+01  3.55150e+01  0.00000e+00 0.00000e+00 3.81925e+02 73.421  1.15881e+02 253.421 0.9864 
1 1 1 -4  10  12 o 16 6.01904e+00 8.05408e-01 1.37803e+02 348.525 3.46764e+00  -7.03936e-01 0.00000e+00 0.00000e+00 5.18707e+01 348.525 8.59319e+01 168.525 0.8431 
1 1 1 -4  10  13 o 1  8.93368e+00 6.57821e-01 7.99649e+01 280.808 8.08394e-01  -4.23452e+00 0.00000e+00 0.00000e+00 2.11776e+02 280.808 1.31811e+02 280.808 0.8745 
1 1 1 -4  10  14 o 9  1.33991e+01 5.03411e-01 1.67298e+02 145.167 -1.59936e+01 1.11295e+01  0.00000e+00 0.00000e+00 3.19568e+02 145.167 1.52269e+02 145.167 0.9740 
1 1 1 -4  10  15 o 10 5.88745e+00 8.76217e-01 9.02638e+01 279.464 8.58539e-01  -5.15041e+00 0.00000e+00 0.00000e+00 1.06825e+02 279.464 1.65612e+01 279.464 0.8983 
1 1 1 -4  10  16 o 6  3.64265e+00 9.87644e-01 7.38515e+01 151.607 -2.84456e+00 1.53758e+00  0.00000e+00 0.00000e+00 3.81365e+01 151.607 3.57150e+01 331.607 0.8259 
1 1 1 -4  10  17 o 13 3.51645e+00 1.06162e+00 1.18390e+02 146.200 -4.56370e+00 3.05508e+00  0.00000e+00 0.00000e+00 2.36957e-01 326.200 1.18627e+02 326.200 0.9037 
1 1 1 -4  10  18 o 16 7.46053e+00 1.26224e+00 1.05430e+02 17.912  1.04269e+01  3.37015e+00  0.00000e+00 0.00000e+00 1.58666e+02 17.912  5.32355e+01 17.912  0.9532 
1 1 1 -4  10  19 o 11 4.91042e+00 1.42652e+00 8.26929e+01 89.281  6.75506e-02  5.37936e+00  0.00000e+00 0.00000e+00 8.14890e+01 89.281  1.20390e+00 269.280 0.9015 
1 1 1 -4  10  20 o 19 6.55676e+00 1.68448e+00 1.13715e+02 180.260 -9.49677e+00 -4.31698e-02 0.00000e+00 0.00000e+00 1.15972e+02 180.260 2.25697e+00 180.260 0.9458 
1 1 1 -4  11  1  o 12 1.99279e+01 4.71437e-01 2.04312e+02 328.677 1.70791e+00  -1.03938e+00 0.00000e+00 0.00000e+00 3.18530e+02 328.677 1.14218e+02 328.677 0.6977 
1 1 1 -4  11  2  o 19 2.87014e+01 6.20848e-01 7.88947e+02 222.575 -1.05951e+01 -9.73415e+00 0.00000e+00 0.00000e+00 2.51938e+02 222.575 5.37009e+02 42.575  0.9646 
1 1 1 -4  11  3  o 10 2.31022e+01 4.88217e-01 4.44883e+02 18.172  5.66618e+00  1.85992e+00  0.00000e+00 0.00000e+00 3.46828e+02 18.172  9.80552e+01 198.172 0.9118 
1 1 1 -4  11  4  o 1  1.58145e+01 3.72551e-01 2.61168e+02 303.744 1.71360e+00  -2.56517e+00 0.00000e+00 0.00000e+00 2.23715e+02 303.744 3.74533e+01 123.744 0.8161 
1 1 1 -4  11  5  o 18 5.93451e+00 4.25826e-01 2.62948e+02 167.728 -1.16607e+00 2.53640e-01  0.00000e+00 0.00000e+00 1.49125e+02 347.728 4.12073e+02 347.728 0.5107 
1 1 1 -4  11  6  o 3  3.00388e+01 5.50158e-01 7.75235e+02 125.785 -1.22272e+01 1.69630e+01  0.00000e+00 0.00000e+00 3.25005e+02 125.785 4.50230e+02 305.785 0.9758 
1 1 1 -4  11  7  o 19 1.94217e+01 4.18969e-01 3.35865e+02 10.126  8.43323e+00  1.50620e+00  0.00000e+00 0.00000e+00 3.48795e+02 10.126  1.29301e+01 10.126  0.9397 
1 1 1 -4  11  8  o 3  3.29056e+01 5.04929e-01 6.92590e+02 87.484  1.31703e+00  2.99691e+01  0.00000e+00 0.00000e+00 5.20364e+02 87.484  1.72226e+02 267.484 0.9832 
1 1 1 -4  11  9  o 13 1.84698e+01 3.81969e-01 3.92627e+02 273.859 8.33155e-01  -1.23504e+01 0.00000e+00 0.00000e+00 2.70802e+02 273.859 1.21825e+02 93.859  0.9587 
1 1 1 -4  11  10 o 18 2.35316e+01 4.56260e-01 4.57943e+02 212.929 -2.17573e+01 -1.40910e+01 0.00000e+00 0.00000e+00 4.05884e+02 212.929 5.20582e+01 32.929  0.9805 
1 1 1 -4  11  11 o 3  3.50061e+01 7.63653e-01 5.76120e+02 315.580 4.39177e+01  -4.30369e+01 0.00000e+00 0.00000e+00 7.22716e+02 315.580 1.46596e+02 315.580 0.9918 
1 1 1 -4  11  12 o 10 2.42039e+01 6.81834e-01 4.71099e+02 291.692 1.82294e+01  -4.58261e+01 0.00000e+00 0.00000e+00 4.24334e+02 291.692 4.67647e+01 111.693 0.9898 
1 1 1 -4  11  13 o 12 8.05653e+00 5.50753e-01 1.75972e+02 320.679 6.86569e+00  -5.62369e+00 0.00000e+00 0.00000e+00 1.07380e+02 320.679 6.85920e+01 140.679 0.9419 
1 1 1 -4  11  14 o 8  1.25927e+01 5.22827e-01 3.02409e+02 142.934 -2.67151e+01 2.01797e+01  0.00000e+00 0.00000e+00 1.60290e+02 142.934 1.42120e+02 322.934 0.9850 
1 1 1 -4  11  15 o 6  1.97533e+01 5.56044e-01 3.55739e+02 262.114 -1.03350e+01 -7.46096e+01 0.00000e+00 0.00000e+00 3.75483e+02 262.114 1.97442e+01 262.114 0.9933 
1 1 1 -4  11  16 o 4  4.24029e+00 1.05840e+00 8.62310e+01 69.074  1.52924e+00  3.99927e+00  0.00000e+00 0.00000e+00 5.16516e+01 69.074  3.45794e+01 249.074 0.8735 
1 1 1 -4  11  17 o 10 6.66999e+00 1.13154e+00 1.21385e+02 90.990  -1.77731e-01 1.02862e+01  0.00000e+00 0.00000e+00 1.14233e+02 90.990  7.15256e+00 270.990 0.9501 
1 1 1 -4  11  18 o 2  8.54732e+00 1.20630e+00 1.67305e+02 238.226 -1.03699e+01 -1.67416e+01 0.00000e+00 0.00000e+00 1.41936e+02 238.226 2.53683e+01 58.226  0.9743 
1 1 1 -4  11  19 f 0  8.45468e+00 1.45530e+00 1.62102e+02 320.938 1.38126e+01  -1.12099e+01 0.00000e+00 0.00000e+00 1.42515e+02 320.938 1.95874e+01 140.938 0.9715 
1 1 1 -4  11  20 o 5  3.38636e+00 1.16591e+00 4.28060e+01 204.449 -2.57958e+00 -1.17282e+00 0.00000e+00 0.00000e+00 5.71419e+01 204.449 1.43359e+01 204.449 0.7969 
1 1 1 -4  12  1  o 1  3.17227e+01 5.99683e-01 6.73477e+02 253.279 -2.94011e+00 -9.78701e+00 0.00000e+00 0.00000e+00 4.59503e+02 253.279 2.13974e+02 73.279  0.9497 
1 1 1 -4  12  2  o 12 1.83184e+01 3.91086e-01 2.00388e+02 349.200 2.24879e+00  -4.28971e-01 0.00000e+00 0.00000e+00 3.09249e+02 349.200 1.08861e+02 349.200 0.7400 
1 1 1 -4  12  3  o 1  8.93946e+00 3.63916e-01 2.13667e+02 313.253 7.47958e-01  -7.95014e-01 0.00000e+00 0.00000e+00 5.31045e+01 133.253 2.66772e+02 133.253 0.4779 
1 1 1 -4  12  4  o 8  1.03852e+01 2.91722e-01 2.72645e+02 96.704  -2.44222e-01 2.07773e+00  0.00000e+00 0.00000e+00 5.28238e+00 96.704  2.67363e+02 276.704 0.7123 
1 1 1 -4  12  5  o 11 6.98110e+00 4.00473e-01 1.12816e+02 60.127  3.39087e-01  5.90341e-01  0.00000e+00 0.00000e+00 2.83761e+01 240.127 1.41192e+02 240.127 0.3221 
1 1 1 -4  12  6  o 9  2.03017e+01 4.04881e-01 3.45385e+02 311.475 4.15962e+00  -4.70575e+00 0.00000e+00 0.00000e+00 3.53016e+02 311.475 7.63155e+00 311.475 0.9165 
1 1 1 -4  12  7  o 6  2.48531e+01 4.38911e-01 5.64940e+02 92.688  -8.61652e-01 1.83526e+01  0.00000e+00 0.00000e+00 3.41659e+02 92.688  2.23282e+02 272.688 0.9724 
1 1 1 -4  12  8  o 19 2.56969e+01 4.50510e-01 6.04816e+02 310.323 1.37055e+01  -1.61480e+01 0.00000e+00 0.00000e+00 3.35556e+02 310.323 2.69260e+02 130.323 0.9761 
1 1 1 -4  12  9  f 0  3.51758e+01 6.48839e-01 5.50239e+02 124.429 -1.86909e+01 2.72680e+01  0.00000e+00 0.00000e+00 7.47542e+02 124.429 1.97303e+02 124.429 0.9848 
1 1 1 -4  12  10 o 7  2.17900e+01 5.60315e-01 4.11017e+02 317.987 1.77770e+01  -1.60140e+01 0.00000e+00 0.00000e+00 3.87510e+02 317.987 2.35074e+01 137.987 0.9789 
1 1 1 -4  12  11 o 15 3.92890e+01 8.37007e-01 6.91932e+02 90.174  -2.49057e-01 8.22386e+01  0.00000e+00 0.00000e+00 7.68806e+02 90.174  7.68734e+01 90.174  0.9939 
1 1 1 -4  12  12 o 7  1.42538e+01 6.56975e-01 1.92105e+02 164.596 -1.19962e+01 3.30526e+00  0.00000e+00 0.00000e+00 3.18757e+02 164.596 1.26651e+02 164.596 0.9589 
1 1 1 -4  12  13 o 7  1.32269e+01 5.06767e-01 2.34144e+02 183.465 -1.94370e+01 -1.17685e+00 0.00000e+00 0.00000e+00 2.46902e+02 183.465 1.27585e+01 183.465 0.9740 
1 1 1 -4  12  14 o 3  1.36134e+01 5.98659e-01 2.55568e+02 98.430  -4.41878e+00 2.98142e+01  0.00000e+00 0.00000e+00 2.43767e+02 98.430  1.18011e+01 278.430 0.9833 
1 1 1 -4  12  15 o 5  1.69461e+01 7.91727e-01 2.39651e+02 289.212 1.34610e+01  -3.86281e+01 0.00000e+00 0.00000e+00 3.84071e+02 289.212 1.44420e+02 289.212 0.9877 
1 1 1 -4  12  16 o 5  3.09644e+00 9.26097e-01 9.72678e+01 136.883 -2.72963e+00 2.55585e+00  0.00000e+00 0.00000e+00 1.01420e+00 136.883 9.62536e+01 316.883 0.8527 
1 1 1 -4  12  17 o 11 5.35598e+00 1.14298e+00 9.35143e+01 31.782  5.37370e+00  3.32953e+00  0.00000e+00 0.00000e+00 8.91090e+01 31.782  4.40528e+00 211.782 0.9171 
1 1 1 -4  12  18 o 13 1.13377e+01 9.39699e-01 1.13207e+02 255.914 -5.03653e+00 -2.00722e+01 0.00000e+00 0.00000e+00 2.97509e+02 255.914 1.84303e+02 255.914 0.9755 
1 1 1 -4  12  19 o 13 7.34550e+00 1.46543e+00 7.69494e+01 242.828 -3.37825e+00 -6.58118e+00 0.00000e+00 0.00000e+00 1.76323e+02 242.828 9.93734e+01 242.828 0.9297 
1 1 1 -4  12  20 o 3  5.79450e+00 1.81953e+00 1.43607e+02 118.754 -4.58473e+00 8.35555e+00  0.00000e+00 0.00000e+00 5.94073e+01 118.754 8.41995e+01 298.754 0.9460 
1 1 1 -4  13  1  o 1  3.91234e+01 9.59327e-01 8.09101e+02 175.677 -2.05136e+01 1.55084e+00  0.00000e+00 0.00000e+00 6.25884e+02 175.677 1.83217e+02 355.677 0.9754 
1 1 1 -4  13  2  o 8  2.53158e+01 6.51197e-01 3.90862e+02 39.977  6.16136e+00  5.16585e+00  0.00000e+00 0.00000e+00 4.99558e+02 39.977  1.08697e+02 39.977  0.9356 
1 1 1 -4  13  3  o 8  1.89850e+01 5.17364e-01 4.89318e+02 230.960 -3.28252e+00 -4.04779e+00 0.00000e+00 0.00000e+00 1.51461e+02 230.960 3.37857e+02 50.960  0.8981 
1 1 1 -4  13  4  o 6  9.00861e+00 2.86057e-01 4.10457e+02 206.744 -2.52469e+00 -1.27220e+00 0.00000e+00 0.00000e+00 1.40941e+02 26.744  5.51398e+02 26.744  0.7963 
1 1 1 -4  13  5  o 19 9.30193e+00 4.10918e-01 3.06293e+02 18.590  2.31545e+00  7.78767e-01  0.00000e+00 0.00000e+00 4.12929e+01 198.590 3.47586e+02 198.590 0.7586 
1 1 1 -4  13  6  o 15 9.15090e+00 4.30939e-01 2.82921e+02 192.667 -2.68898e+00 -6.04382e-01 0.00000e+00 0.00000e+00 1.15137e+01 12.667  2.94435e+02 12.667  0.7902 
1 1 1 -4  13  7  o 1  1.85136e+01 3.39216e-01 4.85638e+02 323.917 9.49436e+00  -6.91917e+00 0.00000e+00 0.00000e+00 1.78610e+02 323.917 3.07029e+02 143.917 0.9564 
1 1 1 -4  13  8  o 11 1.12174e+01 2.79981e-01 1.98250e+02 188.758 -2.99816e+00 -4.61887e-01 0.00000e+00 0.00000e+00 1.43405e+02 188.758 5.48449e+01 8.758   0.8124 
1 1 1 -4  13  9  o 9  6.33539e+00 5.11523e-01 3.24273e+02 227.600 -2.37580e+00 -2.60188e+00 0.00000e+00 0.00000e+00 1.24350e+02 47.600  4.48623e+02 47.600  0.8423 
1 1 1 -4  13  10 o 14 2.91193e+01 6.65527e-01 4.02551e+02 114.962 -1.31148e+01 2.81740e+01  0.00000e+00 0.00000e+00 6.69880e+02 114.962 2.67329e+02 114.962 0.9838 
1 1 1 -4  13  11 o 13 2.14094e+01 5.88595e-01 5.70031e+02 230.037 -2.50012e+01 -2.98342e+01 0.00000e+00 0.00000e+00 2.20458e+02 230.037 3.49573e+02 50.037  0.9871 
1 1 1 -4  13  12 o 16 1.10622e+01 6.33711e-01 2.22618e+02 2.346   1.11945e+01  4.58557e-01  0.00000e+00 0.00000e+00 1.71914e+02 2.346   5.07049e+01 182.346 0.9543 
1 1 1 -4  13  13 o 1  1.30765e+01 7.03128e-01 2.63440e+02 344.517 2.02851e+01  -5.61910e+00 0.00000e+00 0.00000e+00 2.13085e+02 344.517 5.03557e+01 164.517 0.9759 
1 1 1 -4  13  14 o 9  8.57463e+00 9.54411e-01 8.01398e+01 108.934 -1.77174e+00 5.16469e+00  0.00000e+00 0.00000e+00 2.08709e+02 108.934 1.28570e+02 108.934 0.9031 
1 1 1 -4  13  15 o 13 1.60985e+01 8.46428e-01 2.58844e+02 133.992 -3.02294e+01 3.13121e+01  0.00000e+00 0.00000e+00 3.34109e+02 133.992 7.52647e+01 133.992 0.9884 
1 1 1 -4  13  16 o 6  9.46011e+00 1.08453e+00 1.66598e+02 147.277 -1.53272e+01 9.84866e+00  0.00000e+00 0.00000e+00 1.75723e+02 147.277 9.12454e+00 147.277 0.9722 
1 1 1 -4  13  17 o 3  1.91263e+01 1.15464e+00 3.23449e+02 60.591  3.80764e+01  6.75506e+01  0.00000e+00 0.00000e+00 3.83040e+02 60.591  5.95913e+01 60.591  0.9935 
1 1 1 -4  13  18 o 18 6.60273e+00 1.71577e+00 1.32404e+02 266.979 -4.59238e-01 -8.70247e+00 0.00000e+00 0.00000e+00 9.82462e+01 266.979 3.41578e+01 86.979  0.9407 
1 1 1 -4  13  19 o 9  4.30953e+00 1.44161e+00 3.06815e+01 310.727 1.14794e+00  -1.33330e+00 0.00000e+00 0.00000e+00 7.38452e+01 310.727 4.31636e+01 310.727 0.6540 
1 1 1 -4  13  20 o 11 4.55025e+00 1.54880e+00 5.72874e+01 50.380  2.35968e+00  2.85038e+00  0.00000e+00 0.00000e+00 8.61085e+01 50.380  2.88211e+01 50.380  0.8509 
1 1 1 -4  14  1  o 19 1.64608e+01 3.99781e-01 3.47710e+02 252.147 -1.12090e+00 -3.48018e+00 0.00000e+00 0.00000e+00 1.77714e+02 252.147 1.69996e+02 72.147  0.8489 
1 1 1 -4  14  2  o 14 2.18505e+01 5.80182e-01 1.75581e+02 20.874  2.85103e+00  1.08721e+00  0.00000e+00 0.00000e+00 4.92824e+02 20.874  3.17243e+02 20.874  0.8137 
1 1 1 -4  14  3  o 14 1.15725e+01 3.88338e-01 2.98942e+02 21.091  2.63386e+00  1.01584e+00  0.00000e+00 0.00000e+00 4.72438e+01 21.091  2.51698e+02 201.091 0.7960 
1 1 1 -4  14  4  f 0  2.62202e+01 4.69780e-01 6.44749e+02 55.632  7.19186e+00  1.05158e+01  0.00000e+00 0.00000e+00 3.00788e+02 55.632  3.43961e+02 235.631 0.9599 
1 1 1 -4  14  5  o 13 1.38432e+01 3.74866e-01 3.05917e+02 282.773 7.96548e-01  -3.51366e+00 0.00000e+00 0.00000e+00 1.34011e+02 282.773 1.71906e+02 102.773 0.8463 
1 1 1 -4  14  6  o 8  3.08497e+01 6.43112e-01 8.22433e+02 55.774  1.50432e+01  2.21139e+01  0.00000e+00 0.00000e+00 3.13571e+02 55.774  5.08862e+02 235.774 0.9811 
1 1 1 -4  14  7  o 1  2.98142e+01 4.81300e-01 6.34475e+02 224.166 -1.61312e+01 -1.56686e+01 0.00000e+00 0.00000e+00 4.58738e+02 224.166 1.75737e+02 44.166  0.9775 
1 1 1 -4  14  8  o 1  7.34667e+00 2.51173e-01 8.24910e+01 174.056 -8.20646e-01 8.54383e-02  0.00000e+00 0.00000e+00 2.24416e+01 174.056 6.00493e+01 354.056 0.3810 
1 1 1 -4  14  9  o 4  2.17610e+01 5.40481e-01 6.46124e+02 344.625 2.32040e+01  -6.38068e+00 0.00000e+00 0.00000e+00 1.51978e+02 344.625 4.94146e+02 164.625 0.9790 
1 1 1 -4  14  10 o 7  3.31733e+01 7.24472e-01 6.82342e+02 173.087 -5.92558e+01 7.18467e+00  0.00000e+00 0.00000e+00 5.49048e+02 173.087 1.33294e+02 353.087 0.9916 
1 1 1 -4  14  11 o 11 1.19692e+01 5.79209e-01 2.81702e+02 72.837  3.17025e+00  1.02651e+01  0.00000e+00 0.00000e+00 1.44630e+02 72.837  1.37072e+02 252.837 0.9523 
1 1 1 -4  14  12 o 17 7.18790e+00 8.04735e-01 1.36908e+02 304.933 2.50747e+00  -3.59001e+00 0.00000e+00 0.00000e+00 9.85891e+01 304.933 3.83193e+01 124.933 0.8767 
1 1 1 -4  14  13 o 14 1.11218e+01 7.67083e-01 2.50076e+02 235.498 -1.04446e+01 -1.51961e+01 0.00000e+00 0.00000e+00 1.53767e+02 235.498 9.63088e+01 55.498  0.9725 
1 1 1 -4  14  14 o 16 1.80432e+01 7.58946e-01 2.47641e+02 18.823  3.53239e+01  1.20410e+01  0.00000e+00 0.00000e+00 4.16312e+02 18.823  1.68671e+02 18.823  0.9865 
1 1 1 -4  14  15 o 4  2.03511e+01 8.36382e-01 3.06260e+02 133.286 -4.47474e+01 4.75076e+01  0.00000e+00 0.00000e+00 4.46231e+02 133.286 1.39971e+02 133.286 0.9923 
1 1 1 -4  14  16 o 5  7.24134e+00 1.32398e+00 7.09712e+01 127.909 -3.34121e+00 4.29060e+00  0.00000e+00 0.00000e+00 1.72316e+02 127.909 1.01345e+02 127.909 0.9026 
1 1 1 -4  14  17 o 3  5.86945e+00 1.52626e+00 2.14811e+02 40.010  1.01093e+01  8.48570e+00  0.00000e+00 0.00000e+00 5.03709e+00 220.010 2.19848e+02 220.010 0.9613 
1 1 1 -4  14  18 o 5  6.56414e+00 1.60879e+00 1.36788e+02 246.701 -3.84361e+00 -8.92503e+00 0.00000e+00 0.00000e+00 9.40451e+01 246.701 4.27425e+01 66.701  0.9471 
1 1 1 -4  14  19 o 1  8.99172e+00 1.80111e+00 1.73740e+02 211.844 -1.37095e+01 -8.51494e+00 0.00000e+00 0.00000e+00 1.49204e+02 211.844 2.45359e+01 31.844  0.9685 
1 1 1 -4  14  20 o 9  4.66870e+00 1.57613e+00 2.98507e+01 25.341  1.66207e+00  7.87111e-01  0.00000e+00 0.00000e+00 8.59021e+01 25.341  5.60514e+01 25.341  0.6695 
1 1 1 -4  15  1  o 18 2.00656e+01 4.00551e-01 4.32751e+02 132.669 -3.65939e+00 3.96997e+00  0.00000e+00 0.00000e+00 2.47714e+02 132.669 1.85037e+02 312.669 0.9019 
1 1 1 -4  15  2  o 4  1.50115e+01 3.30889e-01 5.81672e+02 288.612 2.17267e+00  -6.45155e+00 0.00000e+00 0.00000e+00 6.06340e+01 108.612 6.42306e+02 108.612 0.9233 
1 1 1 -4  15  3  o 14 1.39990e+01 5.35978e-01 3.20144e+02 91.398  -8.74262e-02 3.58299e+00  0.00000e+00 0.00000e+00 1.24591e+02 91.398  1.95553e+02 271.398 0.8454 
1 1 1 -4  15  4  o 6  1.87611e+01 3.65584e-01 2.32654e+02 338.913 3.03375e+00  -1.16982e+00 0.00000e+00 0.00000e+00 3.50186e+02 338.913 1.17533e+02 338.913 0.8270 
1 1 1 -4  15  5  o 5  1.96006e+01 4.03429e-01 3.73672e+02 216.960 -5.24412e+00 -3.94598e+00 0.00000e+00 0.00000e+00 3.03662e+02 216.960 7.00092e+01 36.960  0.9203 
1 1 1 -4  15  6  o 13 2.27214e+01 3.91678e-01 4.88650e+02 119.452 -5.75309e+00 1.01885e+01  0.00000e+00 0.00000e+00 3.26806e+02 119.452 1.61844e+02 299.452 0.9563 
1 1 1 -4  15  7  o 12 2.68157e+01 4.42102e-01 6.17497e+02 214.629 -1.61474e+01 -1.11516e+01 0.00000e+00 0.00000e+00 3.62382e+02 214.629 2.55114e+02 34.629  0.9742 
1 1 1 -4  15  8  o 17 1.86257e+01 3.58996e-01 3.59323e+02 168.054 -1.04740e+01 2.21603e+00  0.00000e+00 0.00000e+00 3.05437e+02 168.054 5.38856e+01 348.054 0.9521 
1 1 1 -4  15  9  o 1  5.67724e+01 1.12827e+00 1.12144e+03 6.415   1.27678e+02  1.43553e+01  0.00000e+00 0.00000e+00 9.97026e+02 6.415   1.24411e+02 186.415 0.9961 
1 1 1 -4  15  10 f 0  6.01073e+00 6.84052e-01 6.63274e+01 79.878  1.81272e-01  1.01542e+00  0.00000e+00 0.00000e+00 3.65957e+01 79.878  2.97317e+01 259.878 0.4574 
1 1 1 -4  15  11 o 5  1.19628e+01 5.77643e-01 2.85888e+02 20.935  1.01612e+01  3.88724e+00  0.00000e+00 0.00000e+00 1.40471e+02 20.935  1.45417e+02 200.935 0.9529 
1 1 1 -4  15  12 o 14 2.96099e+01 8.57703e-01 5.01447e+02 319.808 5.28735e+01  -4.46686e+01 0.00000e+00 0.00000e+00 5.97082e+02 319.808 9.56341e+01 319.808 0.9927 
1 1 1 -4  15  13 o 18 8.84088e+00 8.60879e-01 1.85995e+02 70.226  3.61512e+00  1.00559e+01  0.00000e+00 0.00000e+00 1.28245e+02 70.226  5.77496e+01 250.226 0.9520 
1 1 1 -4  15  14 o 12 4.29484e+00 1.12939e+00 3.54785e+01 241.201 -5.78553e-01 -1.05243e+00 0.00000e+00 0.00000e+00 4.67150e+01 241.201 1.12365e+01 241.201 0.5131 
1 1 1 -4  15  15 o 7  7.95508e+00 1.09613e+00 1.43471e+02 232.979 -6.54893e+00 -8.68402e+00 0.00000e+00 0.00000e+00 1.38967e+02 232.979 4.50341e+00 52.979  0.9529 
1 1 1 -4  15  16 o 14 9.33684e+00 1.16208e+00 1.32607e+02 327.065 1.19369e+01  -7.73259e+00 0.00000e+00 0.00000e+00 2.02455e+02 327.065 6.98482e+01 327.065 0.9642 
1 1 1 -4  15  17 o 6  6.96958e+00 1.36720e+00 9.96109e+01 7.363   7.91297e+00  1.02248e+00  0.00000e+00 0.00000e+00 1.42662e+02 7.363   4.30509e+01 7.363   0.9351 
1 1 1 -4  15  18 o 9  4.60665e+00 1.42646e+00 8.19885e+01 39.389  3.55270e+00  2.91705e+00  0.00000e+00 0.00000e+00 6.90633e+01 39.389  1.29252e+01 219.389 0.8831 
1 1 1 -4  15  19 o 12 5.81224e+00 1.76415e+00 1.44340e+02 244.784 -3.89258e+00 -8.26605e+00 0.00000e+00 0.00000e+00 5.90294e+01 244.784 8.53108e+01 64.784  0.9436 
1 1 1 -4  15  20 o 11 4.85474e+00 1.64597e+00 6.62071e+01 55.952  2.25001e+00  3.32981e+00  0.00000e+00 0.00000e+00 8.91664e+01 55.952  2.29594e+01 55.952  0.8642 
1 1 1 -4  16  1  o 13 2.70503e+01 6.31073e-01 3.35818e+02 197.268 -6.99602e+00 -2.17470e+00 0.00000e+00 0.00000e+00 6.09055e+02 197.268 2.73236e+02 197.268 0.9290 
1 1 1 -4  16  2  o 12 2.94365e+01 5.29605e-01 5.57055e+02 266.652 -5.57924e-01 -9.53753e+00 0.00000e+00 0.00000e+00 4.89849e+02 266.652 6.72060e+01 86.652  0.9461 
1 1 1 -4  16  3  f 0  5.32965e+00 2.85892e-01 1.54481e+02 136.865 -4.73171e-01 4.43324e-01  0.00000e+00 0.00000e+00 9.27397e+01 316.865 2.47221e+02 316.865 0.3083 
1 1 1 -4  16  4  o 1  1.76566e+01 3.56611e-01 3.38355e+02 78.147  1.06427e+00  5.07101e+00  0.00000e+00 0.00000e+00 2.56868e+02 78.147  8.14870e+01 258.147 0.8974 
1 1 1 -4  16  5  o 12 1.11078e+01 2.80492e-01 4.69344e+02 178.024 -4.63438e+00 1.59882e-01  0.00000e+00 0.00000e+00 1.00557e+02 358.024 5.69901e+02 358.024 0.8842 
1 1 1 -4  16  6  o 3  4.25673e+01 6.91705e-01 7.94913e+02 189.182 -3.47069e+01 -5.61013e+00 0.00000e+00 0.00000e+00 7.79718e+02 189.182 1.51950e+01 9.182   0.9857 
1 1 1 -4  16  7  o 17 1.58131e+01 3.59037e-01 4.27552e+02 302.324 4.27329e+00  -6.75348e+00 0.00000e+00 0.00000e+00 1.27114e+02 302.324 3.00439e+02 122.324 0.9352 
1 1 1 -4  16  8  o 18 3.49488e+01 7.39836e-01 5.53375e+02 61.901  1.43428e+01  2.68632e+01  0.00000e+00 0.00000e+00 7.34987e+02 61.901  1.81612e+02 61.901  0.9834 
1 1 1 -4  16  9  o 6  1.53789e+01 4.89292e-01 2.76957e+02 109.175 -2.93165e+00 8.43058e+00  0.00000e+00 0.00000e+00 2.65829e+02 109.175 1.11278e+01 289.175 0.9422 
1 1 1 -4  16  10 o 1  7.47225e+00 5.85396e-01 1.01410e+02 21.970  1.82728e+00  7.37153e-01  0.00000e+00 0.00000e+00 9.23788e+01 21.970  9.03116e+00 201.970 0.6928 
1 1 1 -4  16  11 o 1  3.01470e+01 7.04844e-01 5.56112e+02 44.704  3.87846e+01  3.83861e+01  0.00000e+00 0.00000e+00 5.61056e+02 44.704  4.94465e+00 44.704  0.9908 
1 1 1 -4  16  12 o 15 5.81237e+00 8.65546e-01 1.70828e+02 187.106 -4.58228e+00 -5.71220e-01 0.00000e+00 0.00000e+00 2.11141e+01 187.106 1.49714e+02 7.106   0.8837 
1 1 1 -4  16  13 o 11 2.12935e+01 7.36717e-01 3.54506e+02 20.078  4.71446e+01  1.72320e+01  0.00000e+00 0.00000e+00 4.32523e+02 20.078  7.80175e+01 20.078  0.9900 
1 1 1 -4  16  14 o 7  8.90750e+00 8.68213e-01 1.37174e+02 83.143  1.24365e+00  1.03425e+01  0.00000e+00 0.00000e+00 1.78685e+02 83.143  4.15105e+01 83.143  0.9507 
1 1 1 -4  16  15 o 5  8.09721e+00 1.13230e+00 1.24873e+02 63.035  4.07991e+00  8.01923e+00  0.00000e+00 0.00000e+00 1.59526e+02 63.035  3.46526e+01 63.035  0.9427 
1 1 1 -4  16  16 o 13 7.62585e+00 1.26316e+00 1.15587e+02 335.100 8.72268e+00  -4.04899e+00 0.00000e+00 0.00000e+00 1.53041e+02 335.100 3.74547e+01 335.100 0.9465 
1 1 1 -4  16  17 o 15 7.13762e+00 1.41172e+00 1.45827e+02 242.285 -5.41746e+00 -1.03121e+01 0.00000e+00 0.00000e+00 1.07850e+02 242.285 3.79778e+01 62.285  0.9561 
1 1 1 -4  16  18 o 2  6.63548e+00 1.66729e+00 7.39994e+01 173.347 -5.07837e+00 5.92323e-01  0.00000e+00 0.00000e+00 1.46728e+02 173.347 7.27284e+01 173.347 0.8959 
1 1 1 -4  16  19 o 14 4.19205e+00 1.41042e+00 4.56677e+01 325.513 2.22132e+00  -1.52594e+00 0.00000e+00 0.00000e+00 7.62991e+01 325.513 3.06314e+01 325.513 0.7846 
1 1 1 -4  16  20 o 1  6.84405e+00 1.99847e+00 1.47484e+02 141.577 -7.61852e+00 6.04333e+00  0.00000e+00 0.00000e+00 9.25464e+01 141.577 5.49378e+01 321.577 0.9471 
1 1 1 -4  17  1  o 1  3.07230e+01 5.53601e-01 5.86654e+02 211.442 -1.20853e+01 -7.38917e+00 0.00000e+00 0.00000e+00 5.26916e+02 211.442 5.97384e+01 31.442  0.9640 
1 1 1 -4  17  2  o 2  1.05296e+01 3.58477e-01 2.12103e+02 334.328 1.14737e+00  -5.51495e-01 0.00000e+00 0.00000e+00 4.26172e-01 154.328 2.12529e+02 154.328 0.5348 
1 1 1 -4  17  3  o 1  1.00406e+01 3.48983e-01 1.28561e+02 275.146 8.82019e-02  -9.79310e-01 0.00000e+00 0.00000e+00 3.76105e+01 275.146 9.09505e+01 95.146  0.4404 
1 1 1 -4  17  4  o 14 3.48258e+01 5.98361e-01 7.89073e+02 342.957 2.24013e+01  -6.86714e+00 0.00000e+00 0.00000e+00 4.90845e+02 342.957 2.98227e+02 162.957 0.9784 
1 1 1 -4  17  5  o 6  1.44470e+01 3.13777e-01 3.38356e+02 30.227  3.72223e+00  2.16873e+00  0.00000e+00 0.00000e+00 1.35944e+02 30.227  2.02412e+02 210.227 0.8744 
1 1 1 -4  17  6  o 17 3.24160e+01 5.18920e-01 5.95151e+02 11.843  1.95809e+01  4.10610e+00  0.00000e+00 0.00000e+00 5.90537e+02 11.843  4.61455e+00 191.843 0.9747 
1 1 1 -4  17  7  o 19 1.05810e+01 4.19470e-01 1.44090e+02 87.808  7.17264e-02  1.87430e+00  0.00000e+00 0.00000e+00 1.24290e+02 87.808  1.98006e+01 267.808 0.6763 
1 1 1 -4  17  8  o 12 1.88261e+01 5.02390e-01 2.47026e+02 136.401 -5.33107e+00 5.07651e+00  0.00000e+00 0.00000e+00 4.08790e+02 136.401 1.61765e+02 136.401 0.9294 
1 1 1 -4  17  9  f 0  3.29341e+01 7.14718e-01 5.15866e+02 259.192 -6.59148e+00 -3.45272e+01 0.00000e+00 0.00000e+00 7.00096e+02 259.192 1.84230e+02 259.192 0.9857 
1 1 1 -4  17  10 o 16 1.87304e+01 5.43814e-01 3.65377e+02 64.553  7.65508e+00  1.60875e+01  0.00000e+00 0.00000e+00 3.15733e+02 64.553  4.96438e+01 244.553 0.9715 
1 1 1 -4  17  11 o 13 1.30072e+01 5.81168e-01 3.29734e+02 269.026 -2.39265e-01 -1.40700e+01 0.00000e+00 0.00000e+00 1.39121e+02 269.026 1.90613e+02 89.026  0.9638 
1 1 1 -4  17  12 o 12 1.22927e+01 6.16037e-01 2.08020e+02 1.689   1.22657e+01  3.61651e-01  0.00000e+00 0.00000e+00 2.32196e+02 1.689   2.41768e+01 1.689   0.9583 
1 1 1 -4  17  13 o 19 1.30241e+01 7.46116e-01 2.54638e+02 273.493 1.38669e+00  -2.27180e+01 0.00000e+00 0.00000e+00 2.20787e+02 273.493 3.38517e+01 93.493  0.9778 
1 1 1 -4  17  14 o 14 3.61485e+00 1.04059e+00 9.60666e+01 117.108 -1.28161e+00 2.50365e+00  0.00000e+00 0.00000e+00 1.11318e+01 117.108 8.49349e+01 297.108 0.7951 
1 1 1 -4  17  15 o 11 1.16385e+01 9.68267e-01 2.41399e+02 222.508 -1.95248e+01 -1.78964e+01 0.00000e+00 0.00000e+00 1.83954e+02 222.508 5.74451e+01 42.508  0.9809 
1 1 1 -4  17  16 o 16 6.22848e+00 1.29124e+00 3.68240e+01 174.427 -2.35845e+00 2.30136e-01  0.00000e+00 0.00000e+00 1.37035e+02 174.427 1.00211e+02 174.427 0.7500 
1 1 1 -4  17  17 o 14 4.16498e+00 1.27614e+00 4.19430e+01 215.825 -1.62535e+00 -1.17333e+00 0.00000e+00 0.00000e+00 6.62056e+01 215.825 2.42626e+01 215.825 0.6985 
1 1 1 -4  17  18 o 9  4.18697e+00 1.35487e+00 4.62344e+01 21.949  2.16770e+00  8.73566e-01  0.00000e+00 0.00000e+00 6.97388e+01 21.949  2.35043e+01 21.949  0.7461 
1 1 1 -4  17  19 o 13 4.99759e+00 1.60454e+00 4.73988e+01 319.043 2.18354e+00  -1.89524e+00 0.00000e+00 0.00000e+00 1.01145e+02 319.043 5.37463e+01 319.043 0.8016 
1 1 1 -4  17  20 o 13 4.41414e+00 1.51894e+00 1.10719e+02 5.099   7.03087e+00  6.27379e-01  0.00000e+00 0.00000e+00 4.06655e+01 5.099   7.00538e+01 185.099 0.9262 
1 1 1 -4  18  1  o 18 2.55523e+01 5.31489e-01 4.86509e+02 178.833 -7.29410e+00 1.48578e-01  0.00000e+00 0.00000e+00 4.05657e+02 178.833 8.08523e+01 358.833 0.9287 
1 1 1 -4  18  2  o 18 1.58330e+01 3.42749e-01 3.37824e+02 140.606 -2.30161e+00 1.89015e+00  0.00000e+00 0.00000e+00 1.43243e+02 140.606 1.94581e+02 320.606 0.8084 
1 1 1 -4  18  3  o 3  3.96356e+00 5.39470e-01 8.02878e+01 108.256 -7.43650e-02 2.25439e-01  0.00000e+00 0.00000e+00 6.27341e+01 288.256 1.43022e+02 288.256 0.1179 
1 1 1 -4  18  4  o 12 1.79231e+01 3.63199e-01 4.38504e+02 355.356 6.13474e+00  -4.98349e-01 0.00000e+00 0.00000e+00 1.77279e+02 355.356 2.61225e+02 175.356 0.9147 
1 1 1 -4  18  5  o 8  1.15352e+01 3.17975e-01 2.26091e+02 286.451 7.09986e-01  -2.40437e+00 0.00000e+00 0.00000e+00 1.05544e+02 286.451 1.20546e+02 106.451 0.7658 
1 1 1 -4  18  6  o 8  1.01983e+01 2.68037e-01 1.98532e+02 210.100 -2.11883e+00 -1.22825e+00 0.00000e+00 0.00000e+00 9.20664e+01 210.100 1.06466e+02 30.100  0.7593 
1 1 1 -4  18  7  o 10 1.67272e+01 4.73900e-01 3.14935e+02 44.118  4.62922e+00  4.48885e+00  0.00000e+00 0.00000e+00 2.61477e+02 44.118  5.34582e+01 224.118 0.9188 
1 1 1 -4  18  8  o 17 2.41550e+01 5.73689e-01 2.58822e+02 127.226 -5.84129e+00 7.68836e+00  0.00000e+00 0.00000e+00 5.98295e+02 127.226 3.39473e+02 127.226 0.9467 
1 1 1 -4  18  9  o 4  1.55720e+01 4.97705e-01 1.85359e+02 105.607 -1.62224e+00 5.80752e+00  0.00000e+00 0.00000e+00 3.47059e+02 105.607 1.61699e+02 105.607 0.9128 
1 1 1 -4  18  10 o 4  1.09108e+01 5.37555e-01 7.13957e+01 224.661 -1.51851e+00 -1.50063e+00 0.00000e+00 0.00000e+00 2.22111e+02 224.661 1.50716e+02 224.661 0.7187 
1 1 1 -4  18  11 o 19 1.49982e+01 5.72622e-01 3.05436e+02 223.112 -1.09589e+01 -1.02595e+01 0.00000e+00 0.00000e+00 2.36454e+02 223.112 6.89813e+01 43.112  0.9661 
1 1 1 -4  18  12 o 17 1.26982e+01 7.25231e-01 2.58217e+02 190.983 -1.49096e+01 -2.89346e+00 0.00000e+00 0.00000e+00 2.00367e+02 190.983 5.78496e+01 10.983  0.9665 
1 1 1 -4  18  13 o 8  4.55138e+00 1.08746e+00 5.07824e+01 154.077 -1.31912e+00 6.41173e-01  0.00000e+00 0.00000e+00 4.90886e+01 154.077 1.69381e+00 334.077 0.5878 
1 1 1 -4  18  14 o 12 1.05081e+01 8.36947e-01 2.01611e+02 345.129 1.75818e+01  -4.66854e+00 0.00000e+00 0.00000e+00 1.79357e+02 345.129 2.22535e+01 165.129 0.9721 
1 1 1 -4  18  15 f 0  2.06430e+01 8.46155e-01 3.69990e+02 30.738  6.96182e+01  4.13990e+01  0.00000e+00 0.00000e+00 3.94314e+02 30.738  2.43245e+01 30.738  0.9938 
1 1 1 -4  18  16 o 3  1.31650e+01 1.03047e+00 2.38838e+02 221.990 -2.73033e+01 -2.45752e+01 0.00000e+00 0.00000e+00 2.44372e+02 221.990 5.53433e+00 221.990 0.9863 
1 1 1 -4  18  17 o 7  6.27599e+00 1.39097e+00 9.21757e+01 118.600 -2.98103e+00 5.46755e+00  0.00000e+00 0.00000e+00 1.21454e+02 118.600 2.92786e+01 118.600 0.9158 
1 1 1 -4  18  18 o 12 6.23960e+00 1.63805e+00 6.18866e+01 336.583 3.59278e+00  -1.55596e+00 0.00000e+00 0.00000e+00 1.37371e+02 336.583 7.54841e+01 336.583 0.8602 
1 1 1 -4  18  19 o 13 4.62977e+00 1.49693e+00 4.39193e+01 19.019  2.45681e+00  8.46865e-01  0.00000e+00 0.00000e+00 8.91704e+01 19.019  4.52510e+01 19.019  0.7753 
1 1 1 -4  18  20 o 8  4.99543e+00 1.64388e+00 1.11933e+02 94.267  -5.43216e-01 7.28111e+00  0.00000e+00 0.00000e+00 5.98544e+01 94.267  5.20786e+01 274.267 0.9288 
1 1 1 -4  19  1  o 13 4.08507e+01 7.88489e-01 6.82363e+02 140.208 -1.21937e+01 1.01565e+01  0.00000e+00 0.00000e+00 8.04186e+02 140.208 1.21823e+02 140.208 0.9680 
1 1 1 -4  19  2  o 10 1.41939e+01 3.60544e-01 1.33711e+02 326.226 1.26870e+00  -8.48498e-01 0.00000e+00 0.00000e+00 1.87742e+02 326.226 5.40305e+01 326.226 0.6026 
1 1 1 -4  19  3  o 2  9.34036e+00 2.79782e-01 3.58667e+02 295.525 1.11053e+00  -2.32560e+00 0.00000e+00 0.00000e+00 8.73396e+01 115.525 4.46006e+02 115.525 0.7731 
1 1 1 -4  19  4  o 10 2.83324e+01 4.77432e-01 4.80962e+02 302.464 5.64422e+00  -8.87202e+00 0.00000e+00 0.00000e+00 5.31232e+02 302.464 5.02694e+01 302.464 0.9512 
1 1 1 -4  19  5  o 10 1.71013e+01 4.25364e-01 2.87866e+02 243.824 -2.06553e+00 -4.20214e+00 0.00000e+00 0.00000e+00 2.80616e+02 243.824 7.25014e+00 63.824  0.8855 
1 1 1 -4  19  6  o 1  9.33683e+00 4.54055e-01 1.72478e+02 270.427 1.43939e-02  -1.92986e+00 0.00000e+00 0.00000e+00 6.78370e+01 270.427 1.04641e+02 90.427  0.6859 
1 1 1 -4  19  7  o 4  2.90513e+01 4.73449e-01 5.85567e+02 154.248 -1.99888e+01 9.64229e+00  0.00000e+00 0.00000e+00 4.79104e+02 154.248 1.06463e+02 334.248 0.9772 
1 1 1 -4  19  8  o 5  2.33239e+01 4.78464e-01 3.90320e+02 219.813 -1.07963e+01 -8.99929e+00 0.00000e+00 0.00000e+00 4.52154e+02 219.813 6.18343e+01 219.813 0.9637 
1 1 1 -4  19  9  o 17 3.12503e+01 6.92692e-01 5.77332e+02 200.764 -3.48468e+01 -1.32120e+01 0.00000e+00 0.00000e+00 5.77308e+02 200.764 2.43492e-02 20.764  0.9865 
1 1 1 -4  19  10 o 12 2.64784e+01 6.38182e-01 4.30619e+02 2.860   3.09736e+01  1.54737e+00  0.00000e+00 0.00000e+00 5.44260e+02 2.860   1.13642e+02 2.860   0.9837 
1 1 1 -4  19  11 o 11 2.77142e+01 6.75739e-01 5.00677e+02 217.187 -3.88547e+01 -2.94787e+01 0.00000e+00 0.00000e+00 5.25052e+02 217.187 2.43747e+01 217.187 0.9897 
1 1 1 -4  19  12 o 14 2.05596e+01 6.31253e-01 4.01750e+02 55.248  2.20053e+01  3.17186e+01  0.00000e+00 0.00000e+00 3.56424e+02 55.248  4.53266e+01 235.248 0.9870 
1 1 1 -4  19  13 o 13 3.45569e+01 8.92171e-01 6.27299e+02 226.538 -9.90314e+01 -1.04494e+02 0.00000e+00 0.00000e+00 6.58205e+02 226.538 3.09062e+01 226.538 0.9965 
1 1 1 -4  19  14 o 13 1.57725e+01 7.75468e-01 3.29889e+02 337.369 4.18541e+01  -1.74486e+01 0.00000e+00 0.00000e+00 2.51787e+02 337.369 7.81014e+01 157.369 0.9889 
1 1 1 -4  19  15 o 10 1.25009e+01 9.29160e-01 2.72686e+02 138.895 -2.64417e+01 2.30702e+01  0.00000e+00 0.00000e+00 1.86335e+02 138.895 8.63504e+01 318.896 0.9856 
1 1 1 -4  19  16 o 17 7.87034e+00 1.26942e+00 1.54745e+02 97.678  -1.69689e+00 1.25861e+01  0.00000e+00 0.00000e+00 1.26351e+02 97.678  2.83945e+01 277.678 0.9598 
1 1 1 -4  19  17 o 13 2.88335e+00 9.99366e-01 4.94311e+01 27.054  1.87119e+00  9.55650e-01  0.00000e+00 0.00000e+00 2.70563e+01 27.054  2.23748e+01 207.054 0.7137 
1 1 1 -4  19  18 f 0  3.91634e+00 1.27704e+00 4.14924e+01 110.477 -7.71673e-01 2.06646e+00  0.00000e+00 0.00000e+00 6.44712e+01 110.477 2.29788e+01 110.477 0.7288 
1 1 1 -4  19  19 o 11 8.32246e+00 1.80705e+00 1.49476e+02 241.574 -6.08686e+00 -1.12451e+01 0.00000e+00 0.00000e+00 1.46759e+02 241.574 2.71657e+00 61.574  0.9601 
1 1 1 -4  20  1  o 8  4.57455e+00 3.54590e-01 2.95527e+02 253.142 -2.18548e-01 -7.21212e-01 0.00000e+00 0.00000e+00 2.34933e+02 73.142  5.30459e+02 73.142  0.3524 
1 1 1 -4  20  2  o 18 1.32966e+01 3.51806e-01 2.56096e+02 217.431 -2.12486e+00 -1.62643e+00 0.00000e+00 0.00000e+00 1.35109e+02 217.431 1.20987e+02 37.431  0.7828 
1 1 1 -4  20  3  o 16 9.58739e+00 2.69939e-01 3.88541e+02 15.403  2.71301e+00  7.47422e-01  0.00000e+00 0.00000e+00 1.02090e+02 195.403 4.90631e+02 195.403 0.7952 
1 1 1 -4  20  4  o 2  2.64386e+01 4.50185e-01 4.79356e+02 67.731  3.65843e+00  8.93416e+00  0.00000e+00 0.00000e+00 4.60670e+02 67.731  1.86859e+01 247.731 0.9467 
1 1 1 -4  20  5  o 11 2.36453e+01 3.93215e-01 3.08923e+02 221.768 -4.96196e+00 -4.43154e+00 0.00000e+00 0.00000e+00 5.08995e+02 221.768 2.00072e+02 221.768 0.9214 
1 1 1 -4  20  6  o 6  1.33248e+01 2.94410e-01 2.71851e+02 253.086 -1.17404e+00 -3.86082e+00 0.00000e+00 0.00000e+00 1.60559e+02 253.086 1.11292e+02 73.086  0.8649 
1 1 1 -4  20  7  o 19 2.72236e+01 5.69436e-01 3.52587e+02 9.297   1.22801e+01  2.01019e+00  0.00000e+00 0.00000e+00 6.26398e+02 9.297   2.73811e+02 9.297   0.9589 
1 1 1 -4  20  8  o 17 1.46035e+01 3.75882e-01 2.52508e+02 195.405 -6.75983e+00 -1.86265e+00 0.00000e+00 0.00000e+00 2.54112e+02 195.405 1.60414e+00 195.405 0.9257 
1 1 1 -4  20  9  o 19 2.98918e+01 6.74019e-01 6.69910e+02 295.023 1.82670e+01  -3.91335e+01 0.00000e+00 0.00000e+00 4.36564e+02 295.023 2.33346e+02 115.023 0.9884 
1 1 1 -4  20  10 o 18 2.31228e+01 5.98378e-01 4.28185e+02 129.782 -1.76877e+01 2.12432e+01  0.00000e+00 0.00000e+00 4.21369e+02 129.782 6.81636e+00 309.782 0.9817 
1 1 1 -4  20  11 o 8  7.53673e+00 7.39971e-01 1.58171e+02 176.007 -4.14581e+00 2.89383e-01  0.00000e+00 0.00000e+00 8.68128e+01 176.007 7.13585e+01 356.007 0.8693 
1 1 1 -4  20  12 o 13 8.82431e+00 7.12074e-01 1.09561e+02 150.782 -4.19586e+00 2.34668e+00  0.00000e+00 0.00000e+00 1.83445e+02 150.782 7.38841e+01 150.782 0.8887 
1 1 1 -4  20  13 o 11 2.89368e+00 9.24406e-01 6.26366e+01 67.653  4.78173e-01  1.16320e+00  0.00000e+00 0.00000e+00 5.35943e+00 247.653 6.79960e+01 247.653 0.5303 
1 1 1 -4  20  14 o 5  1.12871e+01 8.54078e-01 2.66784e+02 334.499 2.32046e+01  -1.10683e+01 0.00000e+00 0.00000e+00 1.45850e+02 334.499 1.20935e+02 154.499 0.9804 
1 1 1 -4  20  15 o 3  1.57907e+01 8.84132e-01 3.55915e+02 164.880 -5.94011e+01 1.60500e+01  0.00000e+00 0.00000e+00 2.27515e+02 164.880 1.28399e+02 344.880 0.9918 
1 1 1 -4  20  16 o 1  5.98276e+00 1.54350e+00 1.95578e+02 293.966 4.41758e+00  -9.93809e+00 0.00000e+00 0.00000e+00 1.65468e+01 293.966 1.79031e+02 113.966 0.9529 
1 1 1 -4  20  17 o 6  8.76177e+00 1.46365e+00 1.38790e+02 334.345 1.22976e+01  -5.90640e+00 0.00000e+00 0.00000e+00 1.74686e+02 334.345 3.58963e+01 334.345 0.9626 
1 1 1 -4  20  18 o 6  8.06917e+00 1.67658e+00 1.67735e+02 259.974 -2.46417e+00 -1.39378e+01 0.00000e+00 0.00000e+00 1.21018e+02 259.974 4.67171e+01 79.974  0.9640 
1 1 1 -4  20  19 o 6  5.38070e+00 1.63482e+00 7.04513e+01 175.325 -4.35908e+00 3.56491e-01  0.00000e+00 0.00000e+00 1.04392e+02 175.325 3.39407e+01 175.325 0.8765 
1 1 1 -4  21  1  o 4  2.10018e+01 4.61781e-01 4.08154e+02 81.161  1.05653e+00  6.79423e+00  0.00000e+00 0.00000e+00 3.21402e+02 81.161  8.67519e+01 261.161 0.9241 
1 1 1 -4  21  2  o 3  2.54189e+01 4.74296e-01 6.54163e+02 225.834 -8.76129e+00 -9.02030e+00 0.00000e+00 0.00000e+00 2.62286e+02 225.834 3.91877e+02 45.834  0.9594 
1 1 1 -4  21  3  o 9  2.50986e+01 4.35245e-01 6.53473e+02 61.317  6.87774e+00  1.25712e+01  0.00000e+00 0.00000e+00 2.55930e+02 61.317  3.97543e+02 241.317 0.9645 
1 1 1 -4  21  4  o 10 2.73958e+01 4.63851e-01 4.99658e+02 182.429 -1.17039e+01 -4.96520e-01 0.00000e+00 0.00000e+00 4.84241e+02 182.429 1.54167e+01 2.429   0.9563 
1 1 1 -4  21  5  o 5  2.57464e+01 4.16958e-01 6.23635e+02 334.004 1.30199e+01  -6.34894e+00 0.00000e+00 0.00000e+00 3.08861e+02 334.004 3.14775e+02 154.004 0.9648 
1 1 1 -4  21  6  o 18 2.25793e+01 4.43335e-01 4.52202e+02 141.806 -8.86452e+00 6.97415e+00  0.00000e+00 0.00000e+00 3.56492e+02 141.806 9.57097e+01 321.806 0.9546 
1 1 1 -4  21  7  o 17 3.74130e+01 6.43111e-01 7.25074e+02 297.423 1.59370e+01  -3.07151e+01 0.00000e+00 0.00000e+00 6.57445e+02 297.423 6.76292e+01 117.423 0.9854 
1 1 1 -4  21  8  o 16 1.46859e+01 4.75917e-01 2.54622e+02 55.273  4.02337e+00  5.80462e+00  0.00000e+00 0.00000e+00 2.55137e+02 55.273  5.15281e-01 55.273  0.9262 
1 1 1 -4  21  9  o 1  2.28584e+01 5.81349e-01 2.95115e+02 89.326  1.71516e-01  1.45793e+01  0.00000e+00 0.00000e+00 5.31033e+02 89.326  2.35919e+02 89.326  0.9651 
1 1 1 -4  21  10 o 17 9.13481e+00 5.96780e-01 2.19799e+02 177.285 -5.58886e+00 2.65009e-01  0.00000e+00 0.00000e+00 8.97661e+01 177.285 1.30033e+02 357.285 0.9056 
1 1 1 -4  21  11 o 13 3.71453e+01 8.22289e-01 6.53156e+02 109.694 -2.75263e+01 7.69017e+01  0.00000e+00 0.00000e+00 7.27259e+02 109.694 7.41032e+01 109.694 0.9939 
1 1 1 -4  21  12 o 12 1.72783e+01 6.13162e-01 3.04910e+02 166.835 -2.57594e+01 6.02511e+00  0.00000e+00 0.00000e+00 3.28285e+02 166.835 2.33755e+01 166.835 0.9809 
1 1 1 -4  21  13 o 4  4.94629e+00 1.06138e+00 7.20530e+01 275.523 2.29511e-01  -2.37376e+00 0.00000e+00 0.00000e+00 6.67579e+01 275.523 5.29515e+00 95.523  0.7519 
1 1 1 -4  21  14 o 6  1.65686e+01 8.08754e-01 2.82514e+02 9.458   3.98549e+01  6.63947e+00  0.00000e+00 0.00000e+00 3.27610e+02 9.458   4.50954e+01 9.458   0.9875 
1 1 1 -4  21  15 o 16 3.95831e+00 1.15630e+00 9.48152e+01 200.769 -3.44743e+00 -1.30743e+00 0.00000e+00 0.00000e+00 3.05587e+01 200.769 6.42566e+01 20.769  0.8503 
1 1 1 -4  21  16 o 18 1.64737e+01 9.88505e-01 2.73568e+02 26.265  4.95745e+01  2.44638e+01  0.00000e+00 0.00000e+00 3.33821e+02 26.265  6.02527e+01 26.265  0.9909 
1 1 1 -4  21  17 o 17 8.81930e+00 1.49373e+00 1.31274e+02 292.396 4.60717e+00  -1.11801e+01 0.00000e+00 0.00000e+00 1.82634e+02 292.396 5.13598e+01 292.396 0.9577 
1 1 1 -4  21  18 o 18 5.85659e+00 1.67105e+00 3.53962e+01 25.505  1.96243e+00  9.36260e-01  0.00000e+00 0.00000e+00 1.22087e+02 25.505  8.66907e+01 25.505  0.7244 
1 1 1 -4  21  19 o 10 4.98139e+00 1.59296e+00 4.33082e+01 123.088 -1.39839e+00 2.14610e+00  0.00000e+00 0.00000e+00 9.91661e+01 123.088 5.58578e+01 123.088 0.7715 
1 1 1 -4  22  1  o 12 9.32544e+00 3.29967e-01 1.90333e+02 22.980  1.27986e+00  5.42746e-01  0.00000e+00 0.00000e+00 8.69158e+00 22.980  1.81641e+02 202.980 0.5678 
1 1 1 -4  22  2  o 17 1.58195e+01 3.52652e-01 4.43503e+02 97.375  -6.67020e-01 5.15359e+00  0.00000e+00 0.00000e+00 9.01841e+01 97.375  3.53319e+02 277.375 0.8978 
1 1 1 -4  22  3  f 0  2.02750e+01 3.77846e-01 2.79816e+02 64.815  2.07361e+00  4.40961e+00  0.00000e+00 0.00000e+00 3.98327e+02 64.815  1.18511e+02 64.815  0.8903 
1 1 1 -4  22  4  o 7  1.53752e+01 3.19654e-01 3.32482e+02 188.057 -4.28363e+00 -6.06356e-01 0.00000e+00 0.00000e+00 1.72718e+02 188.057 1.59764e+02 8.057   0.8750 
1 1 1 -4  22  5  o 1  1.09234e+01 3.09531e-01 7.62532e+01 5.270   8.87536e-01  8.18730e-02  0.00000e+00 0.00000e+00 9.04421e+01 5.270   1.41890e+01 5.270   0.4066 
1 1 1 -4  22  6  o 5  2.25724e+01 4.40586e-01 4.56907e+02 228.677 -8.98071e+00 -1.02143e+01 0.00000e+00 0.00000e+00 3.58200e+02 228.677 9.87065e+01 48.677  0.9625 
1 1 1 -4  22  7  o 10 2.99894e+01 4.76739e-01 4.78284e+02 109.259 -6.03489e+00 1.72724e+01  0.00000e+00 0.00000e+00 6.15039e+02 109.259 1.36755e+02 109.259 0.9723 
1 1 1 -4  22  8  o 16 1.59379e+01 4.10641e-01 3.53358e+02 70.368  3.33878e+00  9.35998e+00  0.00000e+00 0.00000e+00 2.12989e+02 70.368  1.40369e+02 250.368 0.9483 
1 1 1 -4  22  9  o 7  3.81905e+01 8.10943e-01 6.65903e+02 268.541 -1.41401e+00 -5.55144e+01 0.00000e+00 0.00000e+00 7.51311e+02 268.541 8.54074e+01 268.541 0.9910 
1 1 1 -4  22  10 o 2  3.93318e+01 8.41780e-01 7.70308e+02 93.991  -6.22143e+00 8.91722e+01  0.00000e+00 0.00000e+00 6.93233e+02 93.991  7.70749e+01 273.991 0.9944 
1 1 1 -4  22  11 o 10 2.84470e+01 6.93925e-01 5.77820e+02 188.815 -5.52569e+01 -8.56870e+00 0.00000e+00 0.00000e+00 4.76259e+02 188.815 1.01561e+02 8.815   0.9910 
1 1 1 -4  22  12 o 5  1.53839e+01 6.16850e-01 2.67186e+02 95.970  -2.30609e+00 2.20505e+01  0.00000e+00 0.00000e+00 2.94407e+02 95.970  2.72210e+01 95.970  0.9772 
1 1 1 -4  22  13 o 2  1.81141e+01 7.41018e-01 2.88248e+02 122.274 -2.02316e+01 3.20354e+01  0.00000e+00 0.00000e+00 3.78846e+02 122.274 9.05982e+01 122.274 0.9867 
1 1 1 -4  22  14 o 2  5.92678e+00 1.10959e+00 9.60711e+01 241.239 -2.27072e+00 -4.13717e+00 0.00000e+00 0.00000e+00 9.98217e+01 241.239 3.75060e+00 241.239 0.8864 
1 1 1 -4  22  15 o 13 5.91432e+00 1.19929e+00 5.87843e+01 283.598 8.24378e-01  -3.40811e+00 0.00000e+00 0.00000e+00 1.26578e+02 283.598 6.77938e+01 283.598 0.8414 
1 1 1 -4  22  16 o 17 5.12071e+00 1.35511e+00 1.29645e+02 76.932  1.60688e+00  6.92248e+00  0.00000e+00 0.00000e+00 4.69122e+01 76.932  8.27327e+01 256.932 0.9267 
1 1 1 -4  22  17 o 19 4.40848e+00 1.33469e+00 2.77500e+01 312.548 9.45844e-01  -1.03046e+00 0.00000e+00 0.00000e+00 6.56473e+01 312.548 3.78973e+01 312.548 0.5701 
1 1 1 -4  22  18 o 10 9.39871e+00 1.58387e+00 1.80684e+02 136.325 -1.35125e+01 1.29014e+01  0.00000e+00 0.00000e+00 1.58698e+02 136.325 2.19855e+01 316.325 0.9729 
1 1 1 -4  22  19 o 7  3.83261e+00 1.31897e+00 8.48718e+01 188.465 -4.89433e+00 -7.28383e-01 0.00000e+00 0.00000e+00 4.18794e+01 188.465 4.29924e+01 8.465   0.8922 
1 1 1 -4  23  1  o 18 2.39843e+01 4.60795e-01 5.10160e+02 281.744 1.87363e+00  -9.01272e+00 0.00000e+00 0.00000e+00 3.40834e+02 281.744 1.69326e+02 101.744 0.9440 
1 1 1 -4  23  2  o 13 3.81866e+01 7.51759e-01 8.04494e+02 172.805 -2.29938e+01 2.90256e+00  0.00000e+00 0.00000e+00 5.99104e+02 172.805 2.05390e+02 352.805 0.9782 
1 1 1 -4  23  3  o 9  2.87393e+01 5.52893e-01 6.83642e+02 327.691 1.29703e+01  -8.20234e+00 0.00000e+00 0.00000e+00 3.60140e+02 327.691 3.23502e+02 147.691 0.9668 
1 1 1 -4  23  4  o 15 1.31501e+01 3.03958e-01 1.45730e+02 122.264 -9.08521e-01 1.43915e+00  0.00000e+00 0.00000e+00 1.71397e+02 122.264 2.56674e+01 122.264 0.6422 
1 1 1 -4  23  5  o 18 1.48891e+01 3.35362e-01 3.72499e+02 23.707  5.38381e+00  2.36415e+00  0.00000e+00 0.00000e+00 1.36302e+02 23.707  2.36197e+02 203.707 0.9105 
1 1 1 -4  23  6  o 14 2.77801e+01 6.29351e-01 6.35896e+02 113.981 -9.36131e+00 2.10447e+01  0.00000e+00 0.00000e+00 3.83398e+02 113.981 2.52498e+02 293.981 0.9780 
1 1 1 -4  23  7  o 11 2.00681e+01 3.55230e-01 3.37089e+02 309.955 5.76519e+00  -6.88158e+00 0.00000e+00 0.00000e+00 3.72114e+02 309.955 3.50256e+01 309.955 0.9425 
1 1 1 -4  23  8  o 1  1.13071e+01 2.65615e-01 2.06190e+02 356.408 4.10355e+00  -2.57603e-01 0.00000e+00 0.00000e+00 1.61438e+02 356.408 4.47518e+01 176.408 0.8677 
1 1 1 -4  23  9  o 7  3.73111e+01 7.99853e-01 6.60296e+02 92.880  -2.69846e+00 5.36384e+01  0.00000e+00 0.00000e+00 7.23767e+02 92.880  6.34705e+01 92.880  0.9906 
1 1 1 -4  23  10 o 2  2.32235e+01 6.06801e-01 5.05466e+02 89.954  2.80304e-02  3.52002e+01  0.00000e+00 0.00000e+00 3.51069e+02 89.954  1.54398e+02 269.954 0.9857 
1 1 1 -4  23  11 o 14 1.40073e+01 6.01404e-01 1.57448e+02 3.966   8.56325e+00  5.93623e-01  0.00000e+00 0.00000e+00 3.34728e+02 3.966   1.77279e+02 3.966   0.9398 
1 1 1 -4  23  12 o 17 4.65109e+00 9.51318e-01 2.09952e+02 222.310 -3.69187e+00 -3.36048e+00 0.00000e+00 0.00000e+00 5.47643e+01 42.310  2.64717e+02 42.310  0.8932 
1 1 1 -4  23  13 o 15 8.51635e+00 8.79787e-01 1.47951e+02 232.714 -5.36719e+00 -7.04914e+00 0.00000e+00 0.00000e+00 1.51373e+02 232.714 3.42272e+00 232.714 0.9418 
1 1 1 -4  23  14 o 10 1.24531e+01 8.02665e-01 2.32725e+02 302.943 1.43435e+01  -2.21350e+01 0.00000e+00 0.00000e+00 2.22690e+02 302.943 1.00356e+01 122.943 0.9809 
1 1 1 -4  23  15 o 9  1.02296e+01 1.01420e+00 1.20187e+02 195.413 -1.29386e+01 -3.56701e+00 0.00000e+00 0.00000e+00 2.46335e+02 195.413 1.26147e+02 195.413 0.9620 
1 1 1 -4  23  16 o 18 6.93219e+00 1.36266e+00 1.02360e+02 58.308  3.97162e+00  6.43267e+00  0.00000e+00 0.00000e+00 1.37826e+02 58.308  3.54660e+01 58.308  0.9313 
1 1 1 -4  23  17 o 12 1.18520e+01 1.30050e+00 1.50226e+02 225.496 -1.57004e+01 -1.59749e+01 0.00000e+00 0.00000e+00 2.80249e+02 225.496 1.30023e+02 225.496 0.9774 
1 1 1 -4  23  18 o 4  7.40073e+00 1.66720e+00 1.40203e+02 231.074 -7.02210e+00 -8.69443e+00 0.00000e+00 0.00000e+00 1.21880e+02 231.074 1.83225e+01 51.074  0.9542 
1 1 1 -4  23  19 o 14 6.65015e+00 1.84765e+00 1.31566e+02 312.920 6.15440e+00  -6.61819e+00 0.00000e+00 0.00000e+00 1.00866e+02 312.920 3.06999e+01 132.920 0.9429 
1 1 1 -4  24  1  o 11 7.36083e+00 5.23223e-01 1.21965e+02 164.155 -6.63877e-01 1.88425e-01  0.00000e+00 0.00000e+00 3.17750e+01 344.155 1.53740e+02 344.155 0.3260 
1 1 1 -4  24  2  o 7  1.61401e+01 3.39859e-01 1.97468e+02 21.140  2.21034e+00  8.54689e-01  0.00000e+00 0.00000e+00 2.57403e+02 21.140  5.99347e+01 21.140  0.7501 
1 1 1 -4  24  3  o 13 1.85073e+01 3.58349e-01 3.34495e+02 340.995 4.50712e+00  -1.55238e+00 0.00000e+00 0.00000e+00 2.82593e+02 340.995 5.19020e+01 160.995 0.8877 
1 1 1 -4  24  4  o 11 1.78722e+01 3.33331e-01 5.98197e+02 174.490 -1.02708e+01 9.90743e-01  0.00000e+00 0.00000e+00 3.94690e+01 174.490 5.58728e+02 354.490 0.9502 
1 1 1 -4  24  5  o 1  2.59396e+01 6.03197e-01 5.81583e+02 260.136 -2.69719e+00 -1.55114e+01 0.00000e+00 0.00000e+00 3.60520e+02 260.136 2.21063e+02 80.136  0.9677 
1 1 1 -4  24  6  o 1  2.87614e+01 5.25343e-01 6.98635e+02 135.603 -1.70871e+01 1.67311e+01  0.00000e+00 0.00000e+00 3.57481e+02 135.603 3.41154e+02 315.603 0.9789 
1 1 1 -4  24  7  o 3  1.21958e+01 2.78795e-01 1.91447e+02 213.525 -2.57411e+00 -1.70539e+00 0.00000e+00 0.00000e+00 1.81786e+02 213.525 9.66072e+00 33.525  0.8163 
1 1 1 -4  24  8  o 15 4.15645e+01 6.83092e-01 6.49691e+02 88.485  1.21275e+00  4.58678e+01  0.00000e+00 0.00000e+00 8.90606e+02 88.485  2.40915e+02 88.485  0.9890 
1 1 1 -4  24  9  o 12 3.98719e+01 8.42532e-01 7.92858e+02 139.487 -5.75963e+01 4.92149e+01  0.00000e+00 0.00000e+00 6.90182e+02 139.487 1.02676e+02 319.487 0.9934 
1 1 1 -4  24  10 o 12 1.90110e+01 5.75873e-01 3.87869e+02 282.826 4.68503e+00  -2.05781e+01 0.00000e+00 0.00000e+00 3.06371e+02 282.826 8.14978e+01 102.826 0.9760 
1 1 1 -4  24  11 o 11 3.95699e+01 8.69061e-01 6.71591e+02 249.996 -3.43228e+01 -9.42793e+01 0.00000e+00 0.00000e+00 8.00349e+02 249.996 1.28757e+02 249.996 0.9950 
1 1 1 -4  24  12 o 18 1.43637e+01 6.23784e-01 2.92765e+02 111.091 -8.95406e+00 2.32158e+01  0.00000e+00 0.00000e+00 2.32867e+02 111.091 5.98980e+01 291.091 0.9797 
1 1 1 -4  24  13 f 0  5.71972e+00 1.03874e+00 1.78479e+02 80.155  1.15934e+00  6.68052e+00  0.00000e+00 0.00000e+00 1.85347e+01 80.155  1.59944e+02 260.155 0.9230 
1 1 1 -4  24  14 o 17 2.68638e+01 8.44069e-01 5.33345e+02 305.929 7.65365e+01  -1.05619e+02 0.00000e+00 0.00000e+00 4.64337e+02 305.929 6.90080e+01 125.929 0.9962 
1 1 1 -4  24  15 o 10 8.63770e+00 1.09119e+00 1.76953e+02 228.218 -1.11774e+01 -1.25092e+01 0.00000e+00 0.00000e+00 1.34997e+02 228.218 4.19559e+01 48.218  0.9697 
1 1 1 -4  24  16 o 8  5.13275e+00 1.34017e+00 9.54474e+01 94.325  -3.91372e-01 5.17474e+00  0.00000e+00 0.00000e+00 7.59451e+01 94.325  1.95022e+01 274.325 0.8976 
1 1 1 -4  24  17 o 19 6.33578e+00 1.44010e+00 6.17671e+01 283.057 1.02018e+00  -4.39897e+00 0.00000e+00 0.00000e+00 1.45593e+02 283.057 8.38255e+01 283.057 0.8808 
1 1 1 -4  24  18 o 4  5.33551e+00 1.56308e+00 4.72984e+01 302.742 1.57509e+00  -2.44948e+00 0.00000e+00 0.00000e+00 1.11761e+02 302.742 6.44622e+01 302.742 0.8033 
1 1 1 -4  24  19 o 3  4.22815e+00 1.41962e+00 4.50496e+01 246.057 -1.08366e+00 -2.44050e+00 0.00000e+00 0.00000e+00 7.75496e+01 246.057 3.25000e+01 246.057 0.7823 
1 1 1 -4  25  1  o 13 1.61053e+01 3.63937e-01 3.72841e+02 326.944 3.78898e+00  -2.46590e+00 0.00000e+00 0.00000e+00 1.60345e+02 326.944 2.12496e+02 146.944 0.8809 
1 1 1 -4  25  2  o 4  3.16365e+01 5.28283e-01 6.67632e+02 297.232 8.28443e+00  -1.60979e+01 0.00000e+00 0.00000e+00 4.87680e+02 297.232 1.79952e+02 117.232 0.9720 
1 1 1 -4  25  3  o 8  2.56788e+01 4.69198e-01 5.16194e+02 179.617 -1.14173e+01 7.63387e-02  0.00000e+00 0.00000e+00 4.05028e+02 179.617 1.11166e+02 359.617 0.9552 
1 1 1 -4  25  4  o 4  2.34058e+01 3.95461e-01 6.18503e+02 12.838  1.34449e+01  3.06406e+00  0.00000e+00 0.00000e+00 2.27784e+02 12.838  3.90719e+02 192.838 0.9630 
1 1 1 -4  25  5  o 14 2.62568e+01 4.28020e-01 6.45523e+02 181.084 -1.75899e+01 -3.32702e-01 0.00000e+00 0.00000e+00 3.11436e+02 181.084 3.34086e+02 1.084   0.9712 
1 1 1 -4  25  6  o 3  2.77759e+01 4.45761e-01 5.35151e+02 218.331 -1.38087e+01 -1.09175e+01 0.00000e+00 0.00000e+00 4.76688e+02 218.331 5.84626e+01 38.331  0.9712 
1 1 1 -4  25  7  o 4  2.77505e+01 4.91522e-01 4.36523e+02 56.689  9.03889e+00  1.37547e+01  0.00000e+00 0.00000e+00 5.71705e+02 56.689  1.35182e+02 56.689  0.9691 
1 1 1 -4  25  8  o 11 1.69041e+01 3.59859e-01 4.86069e+02 73.681  3.94883e+00  1.34871e+01  0.00000e+00 0.00000e+00 1.24293e+02 73.681  3.61777e+02 253.681 0.9637 
1 1 1 -4  25  9  o 7  3.20643e+01 7.19846e-01 5.53141e+02 144.032 -3.45955e+01 2.51055e+01  0.00000e+00 0.00000e+00 6.33238e+02 144.032 8.00973e+01 144.032 0.9882 
1 1 1 -4  25  10 o 4  3.43024e+01 7.70212e-01 8.12370e+02 4.413   7.81944e+01  6.03394e+00  0.00000e+00 0.00000e+00 4.62769e+02 4.413   3.49601e+02 184.413 0.9936 
1 1 1 -4  25  11 o 7  2.94191e+01 7.21455e-01 5.17691e+02 83.847  6.88208e+00  6.38380e+01  0.00000e+00 0.00000e+00 5.73479e+02 83.847  5.57876e+01 83.847  0.9922 
1 1 1 -4  25  12 o 15 1.14274e+01 6.63909e-01 1.45400e+02 277.259 1.23244e+00  -9.67524e+00 0.00000e+00 0.00000e+00 2.58909e+02 277.259 1.13509e+02 277.259 0.9473 
1 1 1 -4  25  13 o 10 1.62894e+01 6.63409e-01 3.65722e+02 301.114 2.34428e+01  -3.88395e+01 0.00000e+00 0.00000e+00 2.35394e+02 301.114 1.30329e+02 121.114 0.9889 
1 1 1 -4  25  14 o 9  1.01872e+01 9.03272e-01 1.49593e+02 245.395 -5.68481e+00 -1.24138e+01 0.00000e+00 0.00000e+00 2.15995e+02 245.395 6.64024e+01 245.395 0.9627 
1 1 1 -4  25  15 o 1  1.63600e+01 8.90783e-01 2.70546e+02 26.881  4.71028e+01  2.38771e+01  0.00000e+00 0.00000e+00 3.32905e+02 26.881  6.23587e+01 26.881  0.9905 
1 1 1 -4  25  16 f 0  6.00565e+00 1.39776e+00 1.67429e+02 63.081  4.61938e+00  9.09771e+00  0.00000e+00 0.00000e+00 4.47270e+01 63.081  1.22702e+02 243.081 0.9497 
1 1 1 -4  25  17 o 17 6.14521e+00 1.51713e+00 4.84798e+01 316.218 2.26914e+00  -2.17464e+00 0.00000e+00 0.00000e+00 1.38754e+02 316.218 9.02738e+01 316.218 0.8200 
1 1 1 -4  25  18 o 12 6.08673e+00 1.64437e+00 2.47272e+01 84.619  1.46131e-01  1.55154e+00  0.00000e+00 0.00000e+00 1.13113e+02 84.619  8.83856e+01 84.619  0.6102 
1 1 1 -4  25  19 o 3  4.16319e+00 1.42706e+00 9.42311e+01 288.544 1.73825e+00  -5.18170e+00 0.00000e+00 0.00000e+00 4.51229e+01 288.544 4.91081e+01 108.544 0.9032 
1 1 1 -4  26  1  o 19 1.46466e+01 3.50723e-01 2.26301e+02 148.074 -2.44423e+00 1.52296e+00  0.00000e+00 0.00000e+00 2.14394e+02 148.074 1.19068e+01 328.074 0.8007 
1 1 1 -4  26  2  o 4  1.44810e+01 3.45546e-01 9.92359e+01 8.668   1.11036e+00  1.69278e-01  0.00000e+00 0.00000e+00 1.66436e+02 8.668   6.72001e+01 8.668   0.4883 
1 1 1 -4  26  3  o 5  3.47105e+00 3.63419e-01 1.99163e+02 215.738 -4.76461e-01 -3.42858e-01 0.00000e+00 0.00000e+00 1.62460e+02 35.739  3.61623e+02 35.739  0.2815 
1 1 1 -4  26  4  o 12 7.89326e+00 2.74016e-01 2.14082e+02 148.884 -1.31706e+00 7.95003e-01  0.00000e+00 0.00000e+00 3.46571e+01 328.884 2.48739e+02 328.884 0.6055 
1 1 1 -4  26  5  o 17 3.99003e+01 6.85918e-01 8.06499e+02 108.942 -1.24791e+01 3.63612e+01  0.00000e+00 0.00000e+00 6.71202e+02 108.942 1.35297e+02 288.942 0.9869 
1 1 1 -4  26  6  o 11 1.87892e+01 4.35298e-01 2.42745e+02 166.184 -5.45225e+00 1.34081e+00  0.00000e+00 0.00000e+00 3.95693e+02 166.184 1.52948e+02 166.184 0.9059 
1 1 1 -4  26  7  o 12 9.10868e+00 4.68831e-01 2.79384e+02 41.000  2.59967e+00  2.25984e+00  0.00000e+00 0.00000e+00 6.80705e+00 41.000  2.72577e+02 221.000 0.8382 
1 1 1 -4  26  8  o 4  1.88682e+01 3.89797e-01 3.84640e+02 3.475   1.24749e+01  7.57558e-01  0.00000e+00 0.00000e+00 2.93328e+02 3.475   9.13121e+01 183.475 0.9591 
1 1 1 -4  26  9  o 14 2.00639e+01 5.64854e-01 4.06507e+02 29.013  1.70942e+01  9.48039e+00  0.00000e+00 0.00000e+00 3.25173e+02 29.013  8.13339e+01 209.012 0.9741 
1 1 1 -4  26  10 o 7  2.24312e+01 6.16861e-01 4.35789e+02 294.754 1.30929e+01  -2.83953e+01 0.00000e+00 0.00000e+00 3.89835e+02 294.754 4.59540e+01 114.754 0.9839 
1 1 1 -4  26  11 o 18 5.62114e+00 9.40445e-01 1.22329e+02 116.911 -1.27101e+00 2.50415e+00  0.00000e+00 0.00000e+00 4.46616e+01 116.911 7.76678e+01 296.910 0.7947 
1 1 1 -4  26  12 o 5  8.16880e+00 7.80776e-01 1.95274e+02 141.992 -6.96224e+00 5.44101e+00  0.00000e+00 0.00000e+00 9.19929e+01 141.992 1.03281e+02 321.992 0.9416 
1 1 1 -4  26  13 o 2  1.50699e+01 6.68342e-01 2.16607e+02 159.006 -2.31419e+01 8.88062e+00  0.00000e+00 0.00000e+00 3.34239e+02 159.006 1.17632e+02 159.006 0.9796 
1 1 1 -4  26  14 o 4  7.38386e+00 1.05031e+00 9.07146e+01 224.488 -4.07877e+00 -4.00655e+00 0.00000e+00 0.00000e+00 1.59134e+02 224.488 6.84192e+01 224.488 0.9077 
1 1 1 -4  26  15 o 1  9.87329e+00 1.08920e+00 1.99325e+02 71.311  6.90748e+00  2.04199e+01  0.00000e+00 0.00000e+00 1.59700e+02 71.311  3.96246e+01 251.311 0.9765 
1 1 1 -4  26  16 o 13 1.40285e+01 1.32375e+00 2.38563e+02 1.831   3.52553e+01  1.12690e+00  0.00000e+00 0.00000e+00 2.75796e+02 1.831   3.72333e+01 1.831   0.9857 
1 1 1 -4  26  17 o 3  8.09607e+00 1.50450e+00 1.96018e+02 226.897 -1.15167e+01 -1.23056e+01 0.00000e+00 0.00000e+00 9.57089e+01 226.897 1.00309e+02 46.897  0.9699 
1 1 1 -4  26  18 o 15 6.86554e+00 1.75320e+00 7.86648e+01 253.799 -1.45562e+00 -5.00982e+00 0.00000e+00 0.00000e+00 1.50157e+02 253.799 7.14919e+01 253.799 0.8982 
1 1 1 -4  26  19 o 18 8.01913e+00 1.99962e+00 1.21470e+02 106.852 -2.61859e+00 8.64491e+00  0.00000e+00 0.00000e+00 1.58745e+02 106.852 3.72751e+01 106.852 0.9429 
1 1 1 -4  27  1  o 17 1.49452e+01 4.47330e-01 2.84940e+02 0.659   3.61751e+00  4.16334e-02  0.00000e+00 0.00000e+00 1.90725e+02 0.659   9.42149e+01 180.659 0.8470 
1 1 1 -4  27  2  o 10 1.35006e+01 3.22730e-01 1.68827e+02 343.632 1.67791e+00  -4.92812e-01 0.00000e+00 0.00000e+00 1.61789e+02 343.632 7.03786e+00 163.632 0.6519 
1 1 1 -4  27  3  o 1  2.12479e+01 4.96491e-01 4.51798e+02 39.106  6.60758e+00  5.37107e+00  0.00000e+00 0.00000e+00 2.97713e+02 39.106  1.54085e+02 219.106 0.9393 
1 1 1 -4  27  4  o 1  1.04116e+01 2.81266e-01 3.92786e+02 351.685 3.64112e+00  -5.32124e-01 0.00000e+00 0.00000e+00 6.05744e+01 171.685 4.53360e+02 171.685 0.8500 
1 1 1 -4  27  5  o 7  2.76146e+01 4.45531e-01 4.65650e+02 204.424 -1.39518e+01 -6.33593e+00 0.00000e+00 0.00000e+00 5.36144e+02 204.424 7.04935e+01 204.424 0.9668 
1 1 1 -4  27  6  f 0  3.05225e+01 5.31395e-01 5.02913e+02 237.798 -9.98882e+00 -1.58608e+01 0.00000e+00 0.00000e+00 6.10860e+02 237.798 1.07947e+02 237.798 0.9729 
1 1 1 -4  27  7  o 10 1.15592e+01 3.55062e-01 2.93787e+02 25.895  4.86334e+00  2.36098e+00  0.00000e+00 0.00000e+00 9.70456e+01 25.895  1.96741e+02 205.895 0.9020 
1 1 1 -4  27  8  o 18 2.50851e+01 4.64673e-01 4.24216e+02 16.731  1.74775e+01  5.25384e+00  0.00000e+00 0.00000e+00 4.89371e+02 16.731  6.51546e+01 16.731  0.9722 
1 1 1 -4  27  9  o 6  1.81156e+01 5.59151e-01 2.19929e+02 340.567 1.00376e+01  -3.54123e+00 0.00000e+00 0.00000e+00 4.25544e+02 340.567 2.05615e+02 340.567 0.9518 
1 1 1 -4  27  10 o 15 5.52689e+00 8.34249e-01 2.01803e+02 60.144  1.68543e+00  2.93621e+00  0.00000e+00 0.00000e+00 2.91907e+01 240.144 2.30993e+02 240.144 0.8349 
1 1 1 -4  27  11 o 19 2.82952e+01 7.06564e-01 5.14318e+02 4.734   6.08556e+01  5.03915e+00  0.00000e+00 0.00000e+00 5.34588e+02 4.734   2.02701e+01 4.734   0.9918 
1 1 1 -4  27  12 o 2  7.31727e+00 8.37387e-01 1.40308e+02 231.578 -3.52745e+00 -4.44697e+00 0.00000e+00 0.00000e+00 1.07546e+02 231.578 3.27620e+01 51.578  0.9070 
1 1 1 -4  27  13 o 18 6.19468e+00 9.31551e-01 2.14591e+02 43.843  7.40031e+00  7.10726e+00  0.00000e+00 0.00000e+00 4.96679e+00 43.843  2.09624e+02 223.843 0.9499 
1 1 1 -4  27  14 o 14 6.18272e+00 1.18850e+00 8.10566e+01 309.804 2.84578e+00  -3.41517e+00 0.00000e+00 0.00000e+00 1.21444e+02 309.804 4.03877e+01 309.804 0.8787 
1 1 1 -4  27  15 o 15 1.37488e+01 9.56130e-01 3.23042e+02 251.038 -1.67218e+01 -4.86676e+01 0.00000e+00 0.00000e+00 1.83894e+02 251.038 1.39148e+02 71.038  0.9902 
1 1 1 -4  27  16 o 16 1.18775e+01 1.13774e+00 1.67627e+02 54.413  1.49539e+01  2.08971e+01  0.00000e+00 0.00000e+00 2.65456e+02 54.413  9.78291e+01 54.413  0.9803 
1 1 1 -4  27  17 o 5  7.69085e+00 1.48999e+00 1.11027e+02 76.252  2.29456e+00  9.37858e+00  0.00000e+00 0.00000e+00 1.59462e+02 76.252  4.84348e+01 76.252  0.9467 
1 1 1 -4  27  18 o 10 9.64952e+00 1.67402e+00 1.81435e+02 244.090 -8.04262e+00 -1.65558e+01 0.00000e+00 0.00000e+00 1.66738e+02 244.090 1.46970e+01 64.090  0.9724 
1 1 1 -4  27  19 o 14 6.87811e+00 1.74950e+00 5.39813e+01 109.721 -1.36983e+00 3.82141e+00  0.00000e+00 0.00000e+00 1.66686e+02 109.721 1.12704e+02 109.721 0.8658 
1 1 1 -4  28  1  o 2  1.59911e+01 5.32957e-01 1.08829e+02 247.676 -5.09912e-01 -1.24180e+00 0.00000e+00 0.00000e+00 2.24444e+02 247.676 1.15616e+02 247.676 0.5547 
1 1 1 -4  28  2  o 19 1.67576e+01 4.30704e-01 3.05159e+02 145.292 -3.60300e+00 2.49559e+00  0.00000e+00 0.00000e+00 2.46746e+02 145.292 5.84127e+01 325.292 0.8768 
1 1 1 -4  28  3  o 16 7.61672e+00 2.94804e-01 2.49449e+02 258.999 -3.49791e-01 -1.79941e+00 0.00000e+00 0.00000e+00 5.82848e+01 78.999  3.07734e+02 78.999  0.6684 
1 1 1 -4  28  4  o 7  5.46233e+00 2.91769e-01 6.04684e+01 147.760 -2.97122e-01 1.87394e-01  0.00000e+00 0.00000e+00 2.49995e+01 327.760 8.54680e+01 327.760 0.1730 
1 1 1 -4  28  5  o 18 1.68037e+01 3.28907e-01 3.10531e+02 354.288 5.73684e+00  -5.73843e-01 0.00000e+00 0.00000e+00 2.62301e+02 354.288 4.82297e+01 174.288 0.9086 
1 1 1 -4  28  6  o 15 1.91104e+01 3.41013e-01 3.56546e+02 112.909 -3.45979e+00 8.18669e+00  0.00000e+00 0.00000e+00 3.18524e+02 112.909 3.80218e+01 292.909 0.9419 
1 1 1 -4  28  7  o 3  3.11327e+01 5.45192e-01 6.33357e+02 84.030  3.17001e+00  3.03118e+01  0.00000e+00 0.00000e+00 5.14223e+02 84.030  1.19134e+02 264.030 0.9835 
1 1 1 -4  28  8  o 2  3.96251e+01 6.61828e-01 7.86790e+02 21.624  6.02392e+01  2.38791e+01  0.00000e+00 0.00000e+00 6.85983e+02 21.624  1.00807e+02 201.624 0.9923 
1 1 1 -4  28  9  o 9  2.79817e+01 4.62615e-01 4.57066e+02 207.303 -3.04297e+01 -1.57079e+01 0.00000e+00 0.00000e+00 5.74948e+02 207.303 1.17882e+02 207.303 0.9853 
1 1 1 -4  28  10 o 6  3.90910e+01 8.55161e-01 7.28222e+02 346.569 8.36457e+01  -1.99753e+01 0.00000e+00 0.00000e+00 7.25436e+02 346.569 2.78600e+00 166.569 0.9942 
1 1 1 -4  28  11 o 19 1.94505e+01 6.32711e-01 3.62539e+02 146.025 -2.54806e+01 1.71705e+01  0.00000e+00 0.00000e+00 3.52488e+02 146.025 1.00514e+01 326.025 0.9836 
1 1 1 -4  28  12 o 2  1.39475e+01 6.68700e-01 3.48092e+02 17.097  2.62913e+01  8.08677e+00  0.00000e+00 0.00000e+00 1.63185e+02 17.097  1.84907e+02 197.097 0.9817 
1 1 1 -4  28  13 o 19 1.60517e+01 7.80427e-01 2.92209e+02 178.991 -3.75009e+01 6.60731e-01  0.00000e+00 0.00000e+00 2.98607e+02 178.991 6.39808e+00 178.991 0.9866 
1 1 1 -4  28  14 o 4  5.74321e+00 1.11450e+00 1.18617e+02 336.811 5.70643e+00  -2.44453e+00 0.00000e+00 0.00000e+00 7.73451e+01 336.811 4.12720e+01 156.811 0.9155 
1 1 1 -4  28  15 o 18 7.11770e+00 1.23470e+00 1.09320e+02 305.887 4.45592e+00  -6.15863e+00 0.00000e+00 0.00000e+00 1.37584e+02 305.887 2.82647e+01 305.887 0.9317 
1 1 1 -4  28  16 o 1  9.23568e+00 1.25957e+00 1.53561e+02 197.914 -1.62663e+01 -5.25830e+00 0.00000e+00 0.00000e+00 1.79719e+02 197.914 2.61581e+01 197.914 0.9703 
1 1 1 -4  28  17 o 19 5.61246e+00 1.47522e+00 7.48663e+01 318.961 3.60831e+00  -3.14094e+00 0.00000e+00 0.00000e+00 1.10295e+02 318.961 3.54288e+01 318.961 0.8881 
1 1 1 -4  28  18 o 17 5.07439e+00 1.53472e+00 1.18343e+02 187.759 -6.93763e+00 -9.45341e-01 0.00000e+00 0.00000e+00 5.59087e+01 187.759 6.24345e+01 7.759   0.9256 
1 1 1 -4  28  19 o 1  5.38732e+00 1.69931e+00 1.15040e+02 31.335  5.99341e+00  3.64913e+00  0.00000e+00 0.00000e+00 6.97531e+01 31.335  4.52865e+01 211.335 0.9257 
1 1 1 -4  29  1  o 17 1.07482e+01 3.12463e-01 3.71947e+01 192.822 -3.36815e-01 -7.66610e-02 0.00000e+00 0.00000e+00 3.15283e+01 192.822 5.66632e+00 12.822  0.1702 
1 1 1 -4  29  2  o 5  2.32171e+01 4.26846e-01 4.22134e+02 57.465  4.71966e+00  7.39845e+00  0.00000e+00 0.00000e+00 3.98600e+02 57.465  2.35340e+01 237.465 0.9412 
1 1 1 -4  29  3  o 9  1.97589e+01 3.82289e-01 4.05467e+02 237.671 -4.07104e+00 -6.43252e+00 0.00000e+00 0.00000e+00 2.85842e+02 237.671 1.19625e+02 57.671  0.9318 
1 1 1 -4  29  4  o 19 1.42616e+01 3.07629e-01 5.08311e+02 348.321 7.45301e+00  -1.54054e+00 0.00000e+00 0.00000e+00 9.53364e+00 168.321 5.17844e+02 168.321 0.9318 
1 1 1 -4  29  5  o 17 2.17781e+01 3.79990e-01 3.66005e+02 174.062 -1.04300e+01 1.08486e+00  0.00000e+00 0.00000e+00 4.11068e+02 174.062 4.50633e+01 174.062 0.9511 
1 1 1 -4  29  6  o 12 2.28492e+01 3.96184e-01 6.12168e+02 103.235 -4.10798e+00 1.74668e+01  0.00000e+00 0.00000e+00 2.20427e+02 103.235 3.91741e+02 283.235 0.9717 
1 1 1 -4  29  7  o 15 3.48032e+01 5.94695e-01 4.69103e+02 71.969  7.75971e+00  2.38374e+01  0.00000e+00 0.00000e+00 8.08971e+02 71.969  3.39867e+02 71.969  0.9798 
1 1 1 -4  29  8  o 15 2.82564e+01 4.87016e-01 5.62142e+02 272.014 1.16694e+00  -3.31845e+01 0.00000e+00 0.00000e+00 4.80138e+02 272.014 8.20045e+01 92.014  0.9848 
1 1 1 -4  29  9  o 7  1.09105e+01 3.59592e-01 2.78763e+02 131.151 -5.25849e+00 6.01717e+00  0.00000e+00 0.00000e+00 1.03132e+02 131.151 1.75631e+02 311.151 0.9352 
1 1 1 -4  29  10 o 16 2.38101e+01 6.43640e-01 3.78263e+02 253.453 -8.13612e+00 -2.73847e+01 0.00000e+00 0.00000e+00 4.96548e+02 253.453 1.18284e+02 253.453 0.9823 
1 1 1 -4  29  11 o 17 2.07127e+01 6.39302e-01 4.08555e+02 359.391 3.85560e+01  -4.09989e-01 0.00000e+00 0.00000e+00 3.55410e+02 359.391 5.31455e+01 179.391 0.9869 
1 1 1 -4  29  12 o 13 6.44092e+00 9.36932e-01 1.47766e+02 1.278   5.47575e+00  1.22166e-01  0.00000e+00 0.00000e+00 6.94988e+01 1.278   7.82669e+01 181.278 0.9034 
1 1 1 -4  29  13 o 15 1.05535e+01 7.26379e-01 1.90311e+02 183.419 -1.53491e+01 -9.16897e-01 0.00000e+00 0.00000e+00 1.90359e+02 183.419 4.80479e-02 183.419 0.9669 
1 1 1 -4  29  14 o 1  8.75248e+00 9.89440e-01 1.60632e+02 252.880 -3.88576e+00 -1.26149e+01 0.00000e+00 0.00000e+00 1.52947e+02 252.880 7.68467e+00 72.880  0.9613 
1 1 1 -4  29  15 o 4  8.21019e+00 1.17585e+00 6.89471e+01 292.901 2.38471e+00  -5.64518e+00 0.00000e+00 0.00000e+00 2.10518e+02 292.901 1.41571e+02 292.901 0.9143 
1 1 1 -4  29  16 o 17 6.83934e+00 1.29922e+00 9.88424e+01 322.291 6.18451e+00  -4.78152e+00 0.00000e+00 0.00000e+00 1.38625e+02 322.291 3.97823e+01 322.291 0.9337 
1 1 1 -4  29  17 o 5  5.53396e+00 1.56084e+00 6.86012e+01 353.567 4.06744e+00  -4.58584e-01 0.00000e+00 0.00000e+00 1.09618e+02 353.567 4.10170e+01 353.567 0.8670 
1 1 1 -4  29  18 o 4  7.99352e+00 1.56045e+00 9.58427e+01 203.675 -8.03458e+00 -3.52274e+00 0.00000e+00 0.00000e+00 1.83255e+02 203.675 8.74128e+01 203.675 0.9412 
1 1 1 -4  29  19 o 11 3.50736e+00 1.22750e+00 5.10106e+01 94.190  -2.10042e-01 2.86738e+00  0.00000e+00 0.00000e+00 5.29898e+01 94.190  1.97917e+00 94.190  0.8003 
1 1 1 -4  30  1  o 3  1.09601e+01 4.44800e-01 3.52841e+02 60.897  1.59339e+00  2.86236e+00  0.00000e+00 0.00000e+00 1.17267e+01 240.897 3.64567e+02 240.897 0.8285 
1 1 1 -4  30  2  o 3  3.35348e+01 6.50501e-01 6.94293e+02 44.163  1.46552e+01  1.42332e+01  0.00000e+00 0.00000e+00 5.33949e+02 44.163  1.60344e+02 224.163 0.9752 
1 1 1 -4  30  3  o 19 1.10013e+01 2.95321e-01 1.69249e+02 163.053 -1.61426e+00 4.91891e-01  0.00000e+00 0.00000e+00 9.47657e+01 163.053 7.44835e+01 343.053 0.6392 
1 1 1 -4  30  4  o 13 7.37331e+00 2.87545e-01 2.85720e+02 350.682 2.15958e+00  -3.54355e-01 0.00000e+00 0.00000e+00 8.46995e+01 170.682 3.70419e+02 170.682 0.7264 
1 1 1 -4  30  5  o 17 8.14929e+00 2.93257e-01 2.07475e+02 120.603 -1.02992e+00 1.74127e+00  0.00000e+00 0.00000e+00 6.99414e+00 120.603 2.00481e+02 300.603 0.7015 
1 1 1 -4  30  6  o 18 1.38885e+01 2.99746e-01 1.49678e+02 156.148 -2.42813e+00 1.07355e+00  0.00000e+00 0.00000e+00 2.56957e+02 156.148 1.07279e+02 156.148 0.7808 
1 1 1 -4  30  7  o 17 2.99494e+01 4.64531e-01 4.58017e+02 228.494 -1.71750e+01 -1.94085e+01 0.00000e+00 0.00000e+00 6.42470e+02 228.494 1.84454e+02 228.494 0.9805 
1 1 1 -4  30  8  o 1  1.83652e+01 3.44978e-01 3.90306e+02 207.563 -1.39116e+01 -7.26138e+00 0.00000e+00 0.00000e+00 2.75218e+02 207.563 1.15088e+02 27.563  0.9676 
1 1 1 -4  30  9  o 19 1.70048e+01 3.99138e-01 3.23440e+02 112.323 -5.76575e+00 1.40419e+01  0.00000e+00 0.00000e+00 2.91656e+02 112.323 3.17847e+01 292.324 0.9665 
1 1 1 -4  30  10 o 10 2.41049e+01 6.55082e-01 4.91468e+02 277.858 5.29480e+00  -3.83626e+01 0.00000e+00 0.00000e+00 3.98307e+02 277.858 9.31616e+01 97.858  0.9870 
1 1 1 -4  30  11 o 13 2.15782e+01 6.40525e-01 3.35439e+02 156.220 -3.00782e+01 1.32532e+01  0.00000e+00 0.00000e+00 4.58548e+02 156.220 1.23109e+02 156.220 0.9847 
1 1 1 -4  30  12 o 9  4.06332e+00 9.28962e-01 4.25094e+01 321.856 7.97980e-01  -6.26675e-01 0.00000e+00 0.00000e+00 2.59956e+01 321.856 1.65139e+01 141.856 0.4516 
1 1 1 -4  30  13 o 5  8.01854e+00 8.24114e-01 1.51855e+02 62.164  4.62971e+00  8.76752e+00  0.00000e+00 0.00000e+00 1.31741e+02 62.164  2.01140e+01 242.164 0.9481 
1 1 1 -4  30  14 o 9  9.55544e+00 9.67029e-01 1.83660e+02 285.696 4.68133e+00  -1.66592e+01 0.00000e+00 0.00000e+00 1.61978e+02 285.696 2.16817e+01 105.696 0.9707 
1 1 1 -4  30  15 o 3  9.76302e+00 1.11479e+00 1.58005e+02 254.916 -4.46618e+00 -1.65710e+01 0.00000e+00 0.00000e+00 1.94681e+02 254.916 3.66764e+01 254.916 0.9704 
1 1 1 -4  30  16 o 16 1.20968e+01 1.32151e+00 2.23288e+02 73.330  8.89080e+00  2.96907e+01  0.00000e+00 0.00000e+00 2.19212e+02 73.330  4.07527e+00 253.330 0.9837 
1 1 1 -4  30  17 o 7  7.29620e+00 1.51963e+00 1.06740e+02 75.088  2.25008e+00  8.44956e+00  0.00000e+00 0.00000e+00 1.48249e+02 75.088  4.15091e+01 75.088  0.9410 
1 1 1 -4  30  18 o 11 7.39995e+00 1.83117e+00 1.31472e+02 206.007 -8.44844e+00 -4.12189e+00 0.00000e+00 0.00000e+00 1.27994e+02 206.007 3.47814e+00 26.007  0.9452 
1 1 1 -4  30  19 o 1  9.29873e+00 1.86350e+00 2.13741e+02 105.903 -5.67697e+00 1.99252e+01  0.00000e+00 0.00000e+00 1.22337e+02 105.903 9.14043e+01 285.903 0.9756 
1 1 1 -4  31  1  o 4  1.34998e+01 3.36868e-01 2.31291e+02 326.229 2.29963e+00  -1.53779e+00 0.00000e+00 0.00000e+00 1.69883e+02 326.229 6.14070e+01 146.229 0.7911 
1 1 1 -4  31  2  o 17 2.16511e+01 4.09986e-01 4.52944e+02 95.829  -9.51007e-01 9.31494e+00  0.00000e+00 0.00000e+00 3.15408e+02 95.829  1.37535e+02 275.829 0.9450 
1 1 1 -4  31  3  o 1  1.08918e+01 4.41441e-01 2.24169e+02 203.557 -2.38843e+00 -1.04133e+00 0.00000e+00 0.00000e+00 9.31407e+01 203.557 1.31029e+02 23.557  0.7760 
1 1 1 -4  31  4  o 10 2.69240e+01 4.42876e-01 5.68109e+02 251.909 -5.69359e+00 -1.74288e+01 0.00000e+00 0.00000e+00 4.14342e+02 251.909 1.53767e+02 71.909  0.9723 
1 1 1 -4  31  5  o 4  2.29330e+01 3.85999e-01 5.24620e+02 287.158 4.20563e+00  -1.36213e+01 0.00000e+00 0.00000e+00 3.04889e+02 287.158 2.19731e+02 107.158 0.9643 
1 1 1 -4  31  6  o 7  1.10119e+01 2.80812e-01 3.19381e+02 347.086 4.53785e+00  -1.04047e+00 0.00000e+00 0.00000e+00 4.58955e+01 347.086 2.73485e+02 167.086 0.8847 
1 1 1 -4  31  7  o 11 2.82297e+01 4.87524e-01 5.49596e+02 187.084 -2.70632e+01 -3.36346e+00 0.00000e+00 0.00000e+00 4.88648e+02 187.084 6.09479e+01 7.084   0.9815 
1 1 1 -4  31  8  o 12 1.23139e+01 3.51570e-01 1.72588e+02 75.918  1.12751e+00  4.49474e+00  0.00000e+00 0.00000e+00 2.35125e+02 75.918  6.25375e+01 75.918  0.8841 
1 1 1 -4  31  9  o 1  8.51824e+00 3.32766e-01 5.30368e+01 59.314  6.36271e-01  1.07219e+00  0.00000e+00 0.00000e+00 1.14970e+02 59.314  6.19332e+01 59.314  0.5270 
1 1 1 -4  31  10 o 1  4.11304e+01 8.98141e-01 6.84551e+02 249.095 -3.20012e+01 -8.37797e+01 0.00000e+00 0.00000e+00 8.44945e+02 249.095 1.60394e+02 249.095 0.9944 
1 1 1 -4  31  11 o 5  6.58018e+00 8.76885e-01 1.41392e+02 138.524 -3.23694e+00 2.86134e+00  0.00000e+00 0.00000e+00 7.36966e+01 138.524 6.76956e+01 318.524 0.8748 
1 1 1 -4  31  12 o 14 1.21623e+01 6.90685e-01 2.12566e+02 39.613  1.21830e+01  1.00834e+01  0.00000e+00 0.00000e+00 2.26894e+02 39.613  1.43281e+01 39.613  0.9678 
1 1 1 -4  31  13 o 7  6.99869e+00 8.51105e-01 1.34915e+02 129.168 -4.88125e+00 5.99186e+00  0.00000e+00 0.00000e+00 1.08601e+02 129.168 2.63137e+01 309.168 0.9329 
1 1 1 -4  31  14 o 2  6.18673e+00 1.12086e+00 1.28368e+02 334.724 6.67691e+00  -3.15269e+00 0.00000e+00 0.00000e+00 8.59292e+01 334.724 4.24384e+01 154.724 0.9296 
1 1 1 -4  31  15 o 19 3.74800e+00 1.13240e+00 6.39734e+01 86.018  1.77218e-01  2.54582e+00  0.00000e+00 0.00000e+00 4.35253e+01 86.018  2.04481e+01 266.018 0.7705 
1 1 1 -4  31  16 o 7  8.03908e+00 1.30033e+00 1.36156e+02 93.717  -8.18937e-01 1.26066e+01  0.00000e+00 0.00000e+00 1.50665e+02 93.717  1.45087e+01 93.717  0.9596 
1 1 1 -4  31  17 o 11 3.73103e+00 1.21577e+00 7.29236e+01 319.907 2.70196e+00  -2.27469e+00 0.00000e+00 0.00000e+00 4.38520e+01 319.907 2.90716e+01 139.907 0.8428 
1 1 1 -4  31  18 o 15 4.69218e+00 1.49811e+00 2.49808e+01 28.519  1.25435e+00  6.81606e-01  0.00000e+00 0.00000e+00 7.55675e+01 28.519  5.05867e+01 28.519  0.5777 
1 1 1 -4  31  19 o 16 1.07447e+01 2.00227e+00 1.71668e+02 188.511 -1.72207e+01 -2.57708e+00 0.00000e+00 0.00000e+00 2.14764e+02 188.511 4.30962e+01 188.511 0.9708 
1 1 1 -4  32  1  o 9  1.80221e+01 3.78564e-01 3.16896e+02 116.656 -2.45668e+00 4.89402e+00  0.00000e+00 0.00000e+00 2.94602e+02 116.656 2.22941e+01 296.656 0.9034 
1 1 1 -4  32  2  o 12 1.26442e+01 3.27168e-01 1.47325e+02 145.506 -1.39653e+00 9.59583e-01  0.00000e+00 0.00000e+00 1.56855e+02 145.506 9.53016e+00 145.506 0.6407 
1 1 1 -4  32  3  o 18 9.67912e+00 4.98135e-01 1.88857e+02 174.113 -1.91481e+00 1.97425e-01  0.00000e+00 0.00000e+00 6.00534e+01 174.113 1.28803e+02 354.113 0.6851 
1 1 1 -4  32  4  o 8  1.96457e+01 3.98047e-01 3.67236e+02 280.710 1.48604e+00  -7.85705e+00 0.00000e+00 0.00000e+00 3.22197e+02 280.710 4.50398e+01 100.710 0.9352 
1 1 1 -4  32  5  o 16 1.31716e+01 3.46157e-01 2.37141e+02 59.306  1.96226e+00  3.30562e+00  0.00000e+00 0.00000e+00 1.86380e+02 59.306  5.07610e+01 239.306 0.8573 
1 1 1 -4  32  6  o 1  2.08838e+01 3.65957e-01 4.88787e+02 204.446 -1.26563e+01 -5.75342e+00 0.00000e+00 0.00000e+00 2.65436e+02 204.446 2.23351e+02 24.446  0.9633 
1 1 1 -4  32  7  o 1  4.15924e+01 6.10234e-01 5.60617e+02 196.155 -3.82039e+01 -1.10664e+01 0.00000e+00 0.00000e+00 9.78079e+02 196.155 4.17462e+02 196.155 0.9873 
1 1 1 -4  32  8  o 6  8.85145e+00 3.04388e-01 2.15486e+02 25.744  3.83629e+00  1.84995e+00  0.00000e+00 0.00000e+00 7.37987e+01 25.744  1.41688e+02 205.744 0.8728 
1 1 1 -4  32  9  o 9  1.60004e+01 4.78694e-01 1.09703e+02 276.481 5.55836e-01  -4.89283e+00 0.00000e+00 0.00000e+00 4.24127e+02 276.481 3.14424e+02 276.481 0.8916 
1 1 1 -4  32  10 o 10 2.52779e+01 6.73752e-01 3.43783e+02 290.125 1.05019e+01  -2.86589e+01 0.00000e+00 0.00000e+00 5.85800e+02 290.125 2.42017e+02 290.125 0.9835 
1 1 1 -4  32  11 o 8  2.65284e+01 7.00298e-01 4.72060e+02 75.962  1.41222e+01  5.64809e+01  0.00000e+00 0.00000e+00 5.10552e+02 75.962  3.84926e+01 75.962  0.9914 
1 1 1 -4  32  12 o 12 6.54239e+00 8.84673e-01 1.45087e+02 302.228 3.26949e+00  -5.18616e+00 0.00000e+00 0.00000e+00 7.82211e+01 302.228 6.68661e+01 122.228 0.9143 
1 1 1 -4  32  13 o 11 5.32042e+00 9.72310e-01 1.16693e+02 114.660 -2.04647e+00 4.45746e+00  0.00000e+00 0.00000e+00 6.01311e+01 114.660 5.65623e+01 294.660 0.8911 
1 1 1 -4  32  14 o 7  5.92983e+00 1.09264e+00 5.45571e+01 97.080  -3.63199e-01 2.92418e+00  0.00000e+00 0.00000e+00 1.23511e+02 97.080  6.89535e+01 97.080  0.8060 
1 1 1 -4  32  15 o 8  1.18027e+01 1.07645e+00 1.68407e+02 86.001  1.60198e+00  2.29143e+01  0.00000e+00 0.00000e+00 2.61215e+02 86.001  9.28080e+01 86.001  0.9780 
1 1 1 -4  32  16 o 7  5.11272e+00 1.34582e+00 8.77647e+01 294.481 2.09002e+00  -4.59023e+00 0.00000e+00 0.00000e+00 8.22432e+01 294.481 5.52151e+00 114.481 0.8944 
1 1 1 -4  32  17 o 15 5.50733e+00 1.53108e+00 3.83567e+01 41.391  1.69999e+00  1.49828e+00  0.00000e+00 0.00000e+00 1.12363e+02 41.391  7.40067e+01 41.391  0.7370 
1 1 1 -4  32  18 o 8  4.84299e+00 1.51008e+00 5.45235e+01 58.252  1.67672e+00  2.70975e+00  0.00000e+00 0.00000e+00 9.32860e+01 58.252  3.87625e+01 58.252  0.8229 
1 1 1 -4  32  19 o 7  4.42431e+00 1.49287e+00 4.09096e+01 64.347  1.07436e+00  2.23708e+00  0.00000e+00 0.00000e+00 8.41317e+01 64.347  4.32221e+01 64.347  0.7630 
1 1 1 -4  33  1  o 3  3.52007e+01 5.89255e-01 6.11544e+02 166.178 -1.89937e+01 4.67312e+00  0.00000e+00 0.00000e+00 6.76229e+02 166.178 6.46848e+01 166.178 0.9741 
1 1 1 -4  33  2  o 12 1.51286e+01 5.20425e-01 2.11053e+02 127.427 -1.73565e+00 2.26788e+00  0.00000e+00 0.00000e+00 2.42657e+02 127.427 3.16047e+01 127.427 0.7987 
1 1 1 -4  33  3  o 8  2.54968e+01 4.30810e-01 6.35805e+02 339.113 1.57467e+01  -6.00887e+00 0.00000e+00 0.00000e+00 2.92388e+02 339.113 3.43416e+02 159.113 0.9699 
1 1 1 -4  33  4  o 12 3.68650e+01 5.67976e-01 8.18158e+02 238.359 -2.07854e+01 -3.37322e+01 0.00000e+00 0.00000e+00 5.47500e+02 238.359 2.70658e+02 58.359  0.9873 
1 1 1 -4  33  5  o 3  3.69964e+01 5.51673e-01 9.36875e+02 347.611 4.40745e+01  -9.68114e+00 0.00000e+00 0.00000e+00 4.35214e+02 347.611 5.01661e+02 167.611 0.9889 
1 1 1 -4  33  6  o 11 3.29533e+01 5.42041e-01 5.34027e+02 195.324 -2.69850e+01 -7.39463e+00 0.00000e+00 0.00000e+00 6.78993e+02 195.324 1.44966e+02 195.324 0.9820 
1 1 1 -4  33  7  o 7  1.19920e+01 3.04381e-01 1.40359e+02 155.950 -2.63079e+00 1.17407e+00  0.00000e+00 0.00000e+00 2.19418e+02 155.950 7.90582e+01 155.950 0.8008 
1 1 1 -4  33  8  o 15 2.00052e+01 3.64437e-01 4.17470e+02 202.736 -1.89596e+01 -7.94517e+00 0.00000e+00 0.00000e+00 3.13119e+02 202.736 1.04351e+02 22.736  0.9754 
1 1 1 -4  33  9  o 19 1.95758e+01 3.73538e-01 4.28517e+02 2.333   2.54983e+01  1.03870e+00  0.00000e+00 0.00000e+00 2.89446e+02 2.333   1.39072e+02 182.333 0.9802 
1 1 1 -4  33  10 o 9  7.60846e+00 9.15041e-01 2.63655e+02 2.520   6.67890e+00  2.93899e-01  0.00000e+00 0.00000e+00 1.41655e+00 182.520 2.65072e+02 182.520 0.9218 
1 1 1 -4  33  11 o 17 1.73213e+01 6.34614e-01 2.70428e+02 6.278   2.17314e+01  2.39072e+00  0.00000e+00 0.00000e+00 3.61701e+02 6.278   9.12733e+01 6.278   0.9769 
1 1 1 -4  33  12 o 15 1.56475e+01 6.52829e-01 3.75280e+02 172.905 -4.06287e+01 5.05684e+00  0.00000e+00 0.00000e+00 2.01611e+02 172.905 1.73668e+02 352.905 0.9877 
1 1 1 -4  33  13 o 14 1.56593e+01 6.78770e-01 2.68171e+02 322.119 2.96423e+01  -2.30603e+01 0.00000e+00 0.00000e+00 3.07970e+02 322.119 3.97985e+01 322.119 0.9866 
1 1 1 -4  33  14 f 0  9.89765e+00 1.00070e+00 2.30418e+02 108.971 -7.33268e+00 2.13303e+01  0.00000e+00 0.00000e+00 1.30054e+02 108.971 1.00364e+02 288.971 0.9776 
1 1 1 -4  33  15 o 12 4.54414e+00 1.21212e+00 1.20966e+02 343.395 5.73167e+00  -1.70917e+00 0.00000e+00 0.00000e+00 3.32792e+01 343.395 8.76869e+01 163.396 0.9121 
1 1 1 -4  33  16 o 14 5.55199e+00 1.36845e+00 5.74130e+01 282.786 7.85923e-01  -3.46316e+00 0.00000e+00 0.00000e+00 1.16731e+02 282.786 5.93179e+01 282.786 0.8437 
1 1 1 -4  33  17 o 13 1.13845e+01 1.42457e+00 1.60772e+02 20.268  2.08372e+01  7.69478e+00  0.00000e+00 0.00000e+00 2.52327e+02 20.268  9.15551e+01 20.268  0.9772 
1 1 1 -4  33  18 o 8  9.64785e+00 1.81941e+00 1.26026e+02 253.556 -3.40491e+00 -1.15360e+01 0.00000e+00 0.00000e+00 2.16562e+02 253.556 9.05359e+01 253.556 0.9575 
1 1 1 -4  33  19 o 18 7.04932e+00 2.00848e+00 1.16467e+02 114.891 -3.33892e+00 7.19604e+00  0.00000e+00 0.00000e+00 1.27568e+02 114.891 1.11013e+01 114.891 0.9347 
1 1 1 -4  34  1  o 6  1.64320e+01 6.58879e-01 1.25977e+02 179.153 -1.85057e+00 2.73573e-02  0.00000e+00 0.00000e+00 2.88499e+02 179.153 1.62522e+02 179.153 0.6717 
1 1 1 -4  34  2  f 0  1.75608e+01 4.37860e-01 4.86032e+02 83.970  9.46899e-01  8.96444e+00  0.00000e+00 0.00000e+00 1.35542e+02 83.970  3.50490e+02 263.970 0.9428 
1 1 1 -4  34  3  o 5  4.24649e+01 6.41119e-01 8.78866e+02 312.838 3.03221e+01  -3.27017e+01 0.00000e+00 0.00000e+00 6.96953e+02 312.838 1.81912e+02 132.838 0.9887 
1 1 1 -4  34  4  o 14 2.41396e+01 4.02763e-01 4.13973e+02 45.560  9.14215e+00  9.32253e+00  0.00000e+00 0.00000e+00 4.56292e+02 45.560  4.23196e+01 45.560  0.9609 
1 1 1 -4  34  5  o 10 7.29079e+00 2.95787e-01 2.81291e+02 231.239 -1.65285e+00 -2.05860e+00 0.00000e+00 0.00000e+00 6.81887e+01 51.239  3.49480e+02 51.239  0.7794 
1 1 1 -4  34  6  o 14 3.78274e+01 5.63834e-01 7.61341e+02 229.719 -2.93760e+01 -3.46624e+01 0.00000e+00 0.00000e+00 6.40846e+02 229.719 1.20495e+02 49.719  0.9889 
1 1 1 -4  34  7  f 0  1.88048e+01 3.88006e-01 2.95125e+02 198.940 -9.03222e+00 -3.09954e+00 0.00000e+00 0.00000e+00 3.71365e+02 198.940 7.62406e+01 198.940 0.9461 
1 1 1 -4  34  8  o 5  3.74362e+01 5.62861e-01 5.50541e+02 111.382 -1.80438e+01 4.60860e+01  0.00000e+00 0.00000e+00 8.36791e+02 111.382 2.86250e+02 111.382 0.9898 
1 1 1 -4  34  9  o 9  2.35704e+01 4.51932e-01 3.65768e+02 58.395  1.30236e+01  2.11654e+01  0.00000e+00 0.00000e+00 4.98149e+02 58.395  1.32381e+02 58.395  0.9797 
1 1 1 -4  34  10 o 12 1.70338e+01 7.28856e-01 2.88432e+02 213.349 -1.57942e+01 -1.03942e+01 0.00000e+00 0.00000e+00 3.31309e+02 213.349 4.28765e+01 213.349 0.9732 
1 1 1 -4  34  11 o 5  1.38212e+01 6.53022e-01 1.92053e+02 27.048  1.18120e+01  6.03109e+00  0.00000e+00 0.00000e+00 3.04384e+02 27.048  1.12331e+02 27.048  0.9615 
1 1 1 -4  34  12 o 13 1.22660e+01 6.91150e-01 2.12584e+02 357.367 1.90157e+01  -8.74565e-01 0.00000e+00 0.00000e+00 2.33031e+02 357.367 2.04475e+01 357.367 0.9734 
1 1 1 -4  34  13 o 7  1.51275e+01 7.05823e-01 2.43933e+02 28.646  2.87403e+01  1.56997e+01  0.00000e+00 0.00000e+00 3.11474e+02 28.646  6.75410e+01 28.646  0.9846 
1 1 1 -4  34  14 o 11 3.72109e+00 1.08305e+00 6.26417e+01 223.313 -1.53697e+00 -1.44901e+00 0.00000e+00 0.00000e+00 3.65236e+01 223.313 2.61181e+01 43.313  0.7154 
1 1 1 -4  34  15 o 12 5.09612e+00 1.27905e+00 3.29240e+01 28.431  1.55150e+00  8.39989e-01  0.00000e+00 0.00000e+00 9.12939e+01 28.431  5.83699e+01 28.431  0.6550 
1 1 1 -4  34  16 o 15 3.54247e+00 1.15561e+00 7.92122e+01 166.215 -3.41763e+00 8.38477e-01  0.00000e+00 0.00000e+00 3.16739e+01 166.215 4.75383e+01 346.215 0.8421 
1 1 1 -4  34  17 o 10 5.29411e+00 1.44955e+00 1.53407e+01 268.479 -2.65556e-02 -1.00017e+00 0.00000e+00 0.00000e+00 7.24389e+01 268.479 5.70982e+01 268.479 0.4466 
1 1 1 -4  34  18 o 12 6.19673e+00 1.69166e+00 8.02692e+01 43.748  3.97654e+00  3.80640e+00  0.00000e+00 0.00000e+00 1.27441e+02 43.748  4.71715e+01 43.748  0.9039 
1 1 1 -4  35  1  o 16 2.25758e+01 4.29185e-01 5.67582e+02 309.915 8.70015e+00  -1.03998e+01 0.00000e+00 0.00000e+00 2.48246e+02 309.915 3.19336e+02 129.915 0.9624 
1 1 1 -4  35  2  o 6  1.46357e+01 4.05908e-01 3.56304e+02 8.295   5.37271e+00  7.83271e-01  0.00000e+00 0.00000e+00 1.39541e+02 8.295   2.16763e+02 188.294 0.9025 
1 1 1 -4  35  3  o 16 7.51767e+00 4.31189e-01 1.03422e+02 53.961  5.07014e-01  6.96847e-01  0.00000e+00 0.00000e+00 8.09686e+00 53.961  9.53248e+01 233.961 0.3953 
1 1 1 -4  35  4  o 10 2.50668e+00 4.60183e-01 2.06027e+02 75.840  1.49579e-01  5.92876e-01  0.00000e+00 0.00000e+00 1.78543e+02 255.840 3.84570e+02 255.840 0.2923 
1 1 1 -4  35  5  o 13 2.10663e+01 4.05159e-01 2.40185e+02 33.145  5.40462e+00  3.52927e+00  0.00000e+00 0.00000e+00 4.85690e+02 33.145  2.45505e+02 33.145  0.9189 
1 1 1 -4  35  6  o 9  9.60785e+00 2.96433e-01 2.39307e+02 256.851 -8.10078e-01 -3.46765e+00 0.00000e+00 0.00000e+00 6.46960e+01 256.851 1.74611e+02 76.851  0.8442 
1 1 1 -4  35  7  o 14 3.10722e+01 5.51992e-01 5.28279e+02 6.653   3.41047e+01  3.97805e+00  0.00000e+00 0.00000e+00 6.18558e+02 6.653   9.02791e+01 6.653   0.9853 
1 1 1 -4  35  8  o 15 1.04048e+01 3.64090e-01 2.01668e+02 204.523 -4.60806e+00 -2.10225e+00 0.00000e+00 0.00000e+00 1.46889e+02 204.523 5.47783e+01 24.523  0.8949 
1 1 1 -4  35  9  o 4  9.20032e+00 4.30196e-01 1.77222e+02 113.302 -2.09179e+00 4.85657e+00  0.00000e+00 0.00000e+00 1.32424e+02 113.302 4.47984e+01 293.302 0.8997 
1 1 1 -4  35  10 o 14 1.83836e+01 4.19080e-01 3.35153e+02 338.409 2.25501e+01  -8.92423e+00 0.00000e+00 0.00000e+00 3.37740e+02 338.409 2.58708e+00 338.409 0.9792 
1 1 1 -4  35  11 o 9  1.76507e+01 6.60641e-01 3.28502e+02 240.699 -1.51974e+01 -2.70799e+01 0.00000e+00 0.00000e+00 3.20083e+02 240.699 8.41924e+00 60.699  0.9838 
1 1 1 -4  35  12 o 12 1.34390e+01 6.71066e-01 2.72367e+02 154.523 -2.43297e+01 1.15924e+01  0.00000e+00 0.00000e+00 2.19779e+02 154.523 5.25874e+01 334.523 0.9813 
1 1 1 -4  35  13 o 15 4.46685e+00 1.03224e+00 8.78381e+01 153.888 -2.85594e+00 1.39986e+00  0.00000e+00 0.00000e+00 4.91468e+01 153.888 3.86912e+01 333.888 0.8225 
1 1 1 -4  35  14 o 8  4.15742e+00 1.10891e+00 6.40034e+01 70.811  8.41982e-01  2.41939e+00  0.00000e+00 0.00000e+00 5.54765e+01 70.811  8.52689e+00 250.811 0.7715 
1 1 1 -4  35  15 o 9  6.12243e+00 1.35994e+00 1.53037e+02 329.909 8.41024e+00  -4.87353e+00 0.00000e+00 0.00000e+00 6.27183e+01 329.909 9.03188e+01 149.909 0.9471 
1 1 1 -4  35  16 o 4  3.76900e+00 1.20576e+00 6.01637e+01 60.461  1.41057e+00  2.48923e+00  0.00000e+00 0.00000e+00 5.17897e+01 60.461  8.37401e+00 240.461 0.7992 
1 1 1 -4  35  17 o 4  8.75732e+00 1.70798e+00 1.59760e+02 307.087 8.45599e+00  -1.11861e+01 0.00000e+00 0.00000e+00 1.53538e+02 307.087 6.22227e+00 127.087 0.9637 
1 1 1 -4  35  18 o 9  6.25156e+00 1.58196e+00 7.51718e+01 126.133 -3.29464e+00 4.51264e+00  0.00000e+00 0.00000e+00 1.34709e+02 126.133 5.95376e+01 126.133 0.9054 
1 1 1 -4  36  1  o 8  1.53510e+01 3.56958e-01 3.48402e+02 113.016 -2.18177e+00 5.13592e+00  0.00000e+00 0.00000e+00 1.73383e+02 113.016 1.75019e+02 293.016 0.9053 
1 1 1 -4  36  2  o 1  1.48181e+01 4.40152e-01 4.25521e+02 193.080 -7.37727e+00 -1.71397e+00 0.00000e+00 0.00000e+00 9.25580e+01 193.080 3.32963e+02 13.080  0.9314 
1 1 1 -4  36  3  o 15 1.65657e+01 3.46772e-01 3.70829e+02 307.664 4.95435e+00  -6.41849e+00 0.00000e+00 0.00000e+00 2.11094e+02 307.664 1.59735e+02 127.664 0.9361 
1 1 1 -4  36  4  o 17 1.99753e+01 3.65115e-01 2.84172e+02 40.893  5.27734e+00  4.57018e+00  0.00000e+00 0.00000e+00 4.09160e+02 40.893  1.24988e+02 40.893  0.9253 
1 1 1 -4  36  5  o 2  3.61278e+01 5.43971e-01 6.83262e+02 340.504 3.06288e+01  -1.08437e+01 0.00000e+00 0.00000e+00 6.50316e+02 340.504 3.29460e+01 160.504 0.9845 
1 1 1 -4  36  6  f 0  2.10876e+01 3.74326e-01 2.82598e+02 39.756  8.67836e+00  7.21919e+00  0.00000e+00 0.00000e+00 4.71814e+02 39.756  1.89215e+02 39.756  0.9546 
1 1 1 -4  36  7  o 15 2.56348e+01 4.25062e-01 3.01521e+02 308.098 9.99374e+00  -1.27465e+01 0.00000e+00 0.00000e+00 6.28497e+02 308.098 3.26975e+02 308.098 0.9686 
1 1 1 -4  36  8  o 10 1.13051e+01 3.79087e-01 1.76152e+02 210.295 -4.62234e+00 -2.70053e+00 0.00000e+00 0.00000e+00 2.05113e+02 210.295 2.89616e+01 210.295 0.9010 
1 1 1 -4  36  9  o 18 8.81763e+00 4.46240e-01 1.40997e+02 220.869 -3.03417e+00 -2.62546e+00 0.00000e+00 0.00000e+00 1.43978e+02 220.869 2.98095e+00 220.869 0.8640 
1 1 1 -4  36  10 o 10 2.06341e+01 4.36648e-01 3.81085e+02 12.501  3.31852e+01  7.35784e+00  0.00000e+00 0.00000e+00 3.78752e+02 12.501  2.33259e+00 192.501 0.9852 
1 1 1 -4  36  11 o 2  1.02377e+01 7.73249e-01 1.38941e+02 54.608  4.76266e+00  6.70358e+00  0.00000e+00 0.00000e+00 2.19355e+02 54.608  8.04139e+01 54.608  0.9371 
1 1 1 -4  36  12 o 9  9.79563e+00 7.39087e-01 1.10489e+02 72.603  2.34601e+00  7.48732e+00  0.00000e+00 0.00000e+00 2.30889e+02 72.603  1.20400e+02 72.603  0.9339 
1 1 1 -4  36  13 o 14 2.43519e+01 9.34429e-01 3.38938e+02 330.877 6.33116e+01  -3.52714e+01 0.00000e+00 0.00000e+00 5.62654e+02 330.877 2.23716e+02 330.877 0.9931 
1 1 1 -4  36  14 o 2  4.64523e+00 1.13600e+00 1.12146e+01 213.308 -4.13860e-01 -2.71934e-01 0.00000e+00 0.00000e+00 3.03617e+01 213.308 1.91471e+01 213.308 0.2403 
1 1 1 -4  36  15 o 17 5.32929e+00 1.33128e+00 6.48474e+01 194.324 -3.38796e+00 -8.65124e-01 0.00000e+00 0.00000e+00 1.01893e+02 194.324 3.70455e+01 194.324 0.8409 
1 1 1 -4  36  16 o 4  3.66306e+00 1.17343e+00 9.92273e+01 147.869 -3.73374e+00 2.34497e+00  0.00000e+00 0.00000e+00 2.02456e+01 147.869 7.89817e+01 327.869 0.8776 
1 1 1 -4  36  17 o 5  6.26946e+00 1.62318e+00 5.03138e+01 132.290 -2.27567e+00 2.50184e+00  0.00000e+00 0.00000e+00 1.43945e+02 132.290 9.36308e+01 132.290 0.8347 
1 1 1 -4  36  18 o 3  3.33494e+00 1.16959e+00 7.88102e+01 137.457 -3.12583e+00 2.86857e+00  0.00000e+00 0.00000e+00 2.90380e+01 137.457 4.97722e+01 317.457 0.8722 
1 1 1 -4  37  1  o 5  2.05484e+01 4.08567e-01 5.45205e+02 324.213 1.09326e+01  -7.88115e+00 0.00000e+00 0.00000e+00 1.97034e+02 324.213 3.48171e+02 144.213 0.9622 
1 1 1 -4  37  2  o 16 4.45901e+01 8.06674e-01 9.39099e+02 165.463 -4.44841e+01 1.15348e+01  0.00000e+00 0.00000e+00 7.16182e+02 165.463 2.22917e+02 345.463 0.9891 
1 1 1 -4  37  3  o 16 2.55813e+01 4.57942e-01 5.62356e+02 168.077 -1.83509e+01 3.87484e+00  0.00000e+00 0.00000e+00 3.71530e+02 168.077 1.90825e+02 348.077 0.9730 
1 1 1 -4  37  4  o 17 3.67419e+01 5.54413e-01 6.68933e+02 325.833 2.64431e+01  -1.79485e+01 0.00000e+00 0.00000e+00 6.87409e+02 325.833 1.84765e+01 325.833 0.9842 
1 1 1 -4  37  5  o 15 2.48650e+01 4.52484e-01 4.27427e+02 343.012 1.38029e+01  -4.21678e+00 0.00000e+00 0.00000e+00 4.71878e+02 343.012 4.44510e+01 343.012 0.9647 
1 1 1 -4  37  6  o 7  1.49160e+01 3.25491e-01 3.88590e+02 185.896 -1.01675e+01 -1.04992e+00 0.00000e+00 0.00000e+00 1.42255e+02 185.896 2.46335e+02 5.896   0.9497 
1 1 1 -4  37  7  o 4  1.53749e+01 3.35884e-01 2.93078e+02 158.307 -9.16224e+00 3.64482e+00  0.00000e+00 0.00000e+00 2.52700e+02 158.307 4.03784e+01 338.307 0.9479 
1 1 1 -4  37  8  o 10 1.85353e+01 4.04226e-01 1.58929e+02 188.708 -7.63588e+00 -1.16955e+00 0.00000e+00 0.00000e+00 4.88208e+02 188.708 3.29279e+02 188.708 0.9328 
1 1 1 -4  37  9  o 3  1.57344e+01 3.79441e-01 3.23315e+02 221.235 -1.19531e+01 -1.04772e+01 0.00000e+00 0.00000e+00 2.46365e+02 221.235 7.69493e+01 41.235  0.9680 
1 1 1 -4  37  10 o 1  1.65277e+01 3.84988e-01 3.79965e+02 27.173  2.41155e+01  1.23794e+01  0.00000e+00 0.00000e+00 2.26249e+02 27.173  1.53716e+02 207.173 0.9814 
1 1 1 -4  37  11 o 4  2.59083e+01 6.90871e-01 3.55562e+02 122.291 -2.76649e+01 4.37763e+01  0.00000e+00 0.00000e+00 6.02587e+02 122.291 2.47025e+02 122.291 0.9903 
1 1 1 -4  37  12 o 17 9.65706e+00 7.78363e-01 2.03121e+02 343.164 1.32347e+01  -4.00496e+00 0.00000e+00 0.00000e+00 1.43922e+02 343.164 5.91993e+01 163.164 0.9631 
1 1 1 -4  37  13 o 18 6.33377e+00 9.77124e-01 9.28108e+01 275.686 5.03443e-01  -5.05649e+00 0.00000e+00 0.00000e+00 1.18564e+02 275.686 2.57531e+01 275.686 0.8952 
1 1 1 -4  37  14 o 2  5.61545e+00 1.17556e+00 1.02580e+02 139.468 -4.26279e+00 3.64485e+00  0.00000e+00 0.00000e+00 8.68486e+01 139.468 1.57319e+01 319.468 0.9058 
1 1 1 -4  37  15 o 13 1.06053e+01 1.10897e+00 1.34722e+02 216.454 -1.33383e+01 -9.85332e+00 0.00000e+00 0.00000e+00 2.47729e+02 216.454 1.13007e+02 216.454 0.9694 
1 1 1 -4  37  16 f 0  6.72172e+00 1.54270e+00 1.54402e+02 153.767 -9.19952e+00 4.53322e+00  0.00000e+00 0.00000e+00 8.28746e+01 153.767 7.15272e+01 333.767 0.9499 
1 1 1 -4  37  17 o 1  4.23605e+00 1.33346e+00 5.01929e+01 228.804 -1.71318e+00 -1.95725e+00 0.00000e+00 0.00000e+00 7.17502e+01 228.804 2.15573e+01 228.804 0.7756 
1 1 1 -4  37  18 o 18 4.16280e+00 1.39838e+00 4.34983e+01 298.949 1.20178e+00  -2.17267e+00 0.00000e+00 0.00000e+00 7.42689e+01 298.949 3.07707e+01 298.949 0.7631 
1 1 1 -4  38  1  o 12 1.30471e+01 3.44925e-01 1.80652e+02 204.598 -2.37926e+00 -1.08921e+00 0.00000e+00 0.00000e+00 1.99955e+02 204.598 1.93031e+01 204.598 0.7771 
1 1 1 -4  38  2  o 16 3.60020e+01 6.10059e-01 7.71448e+02 260.982 -5.70530e+00 -3.59493e+01 0.00000e+00 0.00000e+00 5.60978e+02 260.982 2.10470e+02 80.982  0.9862 
1 1 1 -4  38  3  o 19 1.75564e+01 4.59814e-01 2.41472e+02 204.362 -4.56417e+00 -2.06678e+00 0.00000e+00 0.00000e+00 3.47125e+02 204.362 1.05652e+02 204.362 0.8936 
1 1 1 -4  38  4  o 19 2.42485e+01 4.10562e-01 3.42113e+02 190.049 -1.04730e+01 -1.85582e+00 0.00000e+00 0.00000e+00 5.23413e+02 190.049 1.81300e+02 190.049 0.9518 
1 1 1 -4  38  5  o 10 2.81908e+01 4.93443e-01 4.57576e+02 3.830   2.04435e+01  1.36867e+00  0.00000e+00 0.00000e+00 5.73084e+02 3.830   1.15508e+02 3.830   0.9753 
1 1 1 -4  38  6  f 0  1.04602e+01 3.46375e-01 1.59685e+02 30.307  2.47445e+00  1.44637e+00  0.00000e+00 0.00000e+00 1.53689e+02 30.307  5.99577e+00 210.307 0.7996 
1 1 1 -4  38  7  o 4  1.74548e+01 3.50231e-01 2.72076e+02 30.225  9.17083e+00  5.34282e+00  0.00000e+00 0.00000e+00 3.49958e+02 30.225  7.78824e+01 30.225  0.9517 
1 1 1 -4  38  8  o 14 1.64195e+01 3.92399e-01 4.83710e+02 244.382 -9.47065e+00 -1.97513e+01 0.00000e+00 0.00000e+00 1.16579e+02 244.382 3.67131e+02 64.382  0.9769 
1 1 1 -4  38  9  o 3  1.51452e+01 4.06913e-01 1.30408e+02 178.243 -6.34828e+00 1.94748e-01  0.00000e+00 0.00000e+00 3.89268e+02 178.243 2.58859e+02 178.243 0.9175 
1 1 1 -4  38  10 o 7  9.23940e+00 4.22156e-01 2.41092e+02 166.969 -9.62452e+00 2.22744e+00  0.00000e+00 0.00000e+00 8.62196e+01 166.969 1.54872e+02 346.969 0.9480 
1 1 1 -4  38  11 o 7  2.71467e+01 5.23892e-01 4.96284e+02 35.781  6.31975e+01  4.55478e+01  0.00000e+00 0.00000e+00 5.10867e+02 35.781  1.45830e+01 35.781  0.9936 
1 1 1 -4  38  12 o 8  1.18277e+01 7.03126e-01 2.94293e+02 221.150 -1.97725e+01 -1.72791e+01 0.00000e+00 0.00000e+00 1.38495e+02 221.150 1.55798e+02 41.150  0.9808 
1 1 1 -4  38  13 o 16 7.74647e+00 9.14298e-01 1.70510e+02 253.304 -3.38103e+00 -1.12726e+01 0.00000e+00 0.00000e+00 1.05678e+02 253.304 6.48321e+01 73.304  0.9565 
1 1 1 -4  38  14 o 19 7.72425e+00 1.12565e+00 1.79432e+02 5.120   1.43678e+01  1.28741e+00  0.00000e+00 0.00000e+00 9.80427e+01 5.120   8.13888e+01 185.120 0.9647 
1 1 1 -4  38  15 o 12 1.06032e+01 1.22686e+00 1.99656e+02 141.341 -1.89457e+01 1.51561e+01  0.00000e+00 0.00000e+00 1.86549e+02 141.341 1.31070e+01 321.341 0.9792 
1 1 1 -4  38  16 o 2  5.25233e+00 1.42848e+00 1.49499e+02 270.952 1.49443e-01  -8.99651e+00 0.00000e+00 0.00000e+00 3.44754e+01 270.952 1.15023e+02 90.952  0.9427 
1 1 1 -4  38  17 o 19 6.96903e+00 1.68029e+00 7.88053e+01 24.890  4.91901e+00  2.28232e+00  0.00000e+00 0.00000e+00 1.54582e+02 24.890  7.57771e+01 24.890  0.9023 
1 1 1 -4  38  18 o 8  7.13038e+00 2.00399e+00 1.52398e+02 14.774  9.67192e+00  2.55068e+00  0.00000e+00 0.00000e+00 9.83295e+01 14.774  5.40684e+01 194.774 0.9486 
1 1 1 -4  39  1  o 5  2.98901e+01 5.22087e-01 4.55478e+02 314.767 1.25989e+01  -1.27018e+01 0.00000e+00 0.00000e+00 6.34611e+02 314.767 1.79133e+02 314.767 0.9716 
1 1 1 -4  39  2  f 0  1.81281e+01 5.25484e-01 4.10600e+02 166.642 -8.62194e+00 2.04730e+00  0.00000e+00 0.00000e+00 2.30039e+02 166.642 1.80560e+02 346.642 0.9418 
1 1 1 -4  39  3  o 7  1.94428e+01 3.65132e-01 3.96198e+02 227.646 -6.36857e+00 -6.98576e+00 0.00000e+00 0.00000e+00 2.93435e+02 227.646 1.02763e+02 47.646  0.9455 
1 1 1 -4  39  4  o 19 1.09926e+01 3.11825e-01 2.70236e+02 289.218 1.29906e+00  -3.72663e+00 0.00000e+00 0.00000e+00 8.48580e+01 289.218 1.85378e+02 109.218 0.8614 
1 1 1 -4  39  5  o 18 2.49484e+01 4.19355e-01 4.01567e+02 204.122 -1.41701e+01 -6.34502e+00 0.00000e+00 0.00000e+00 5.02934e+02 204.122 1.01366e+02 204.122 0.9672 
1 1 1 -4  39  6  o 17 7.49292e+00 3.29430e-01 2.30638e+02 343.975 2.86539e+00  -8.22997e-01 0.00000e+00 0.00000e+00 3.65474e+00 163.975 2.34293e+02 163.975 0.8086 
1 1 1 -4  39  7  o 7  3.30989e+01 5.15197e-01 5.20846e+02 245.813 -1.56262e+01 -3.47905e+01 0.00000e+00 0.00000e+00 7.02125e+02 245.813 1.81279e+02 245.813 0.9868 
1 1 1 -4  39  8  o 5  2.89107e+01 4.71965e-01 5.38925e+02 179.674 -4.37760e+01 2.48858e-01  0.00000e+00 0.00000e+00 5.30486e+02 179.674 8.43915e+00 359.674 0.9885 
1 1 1 -4  39  9  o 4  1.69501e+01 4.08328e-01 2.50631e+02 125.604 -8.20063e+00 1.14526e+01  0.00000e+00 0.00000e+00 3.60281e+02 125.604 1.09650e+02 125.604 0.9638 
1 1 1 -4  39  10 f 0  4.81263e+00 6.70691e-01 1.73440e+02 227.723 -2.54501e+00 -2.79921e+00 0.00000e+00 0.00000e+00 1.97490e+01 47.723  1.93189e+02 47.723  0.8546 
1 1 1 -4  39  11 f 0  2.03688e+01 4.58509e-01 4.26266e+02 8.311   5.33402e+01  7.79209e+00  0.00000e+00 0.00000e+00 3.27153e+02 8.311   9.91134e+01 188.311 0.9907 
1 1 1 -4  39  12 o 14 8.14931e+00 8.62111e-01 1.87390e+02 96.414  -1.33963e+00 1.19169e+01  0.00000e+00 0.00000e+00 1.03652e+02 96.414  8.37375e+01 276.414 0.9574 
1 1 1 -4  39  13 o 15 1.14463e+01 7.50240e-01 2.33532e+02 23.585  2.28695e+01  9.98418e+00  0.00000e+00 0.00000e+00 1.84436e+02 23.585  4.90953e+01 203.585 0.9798 
1 1 1 -4  39  14 o 5  1.27546e+01 9.73709e-01 2.24213e+02 35.759  2.67697e+01  1.92778e+01  0.00000e+00 0.00000e+00 2.43430e+02 35.759  1.92165e+01 35.759  0.9847 
1 1 1 -4  39  15 o 7  1.41205e+01 1.28967e+00 1.93641e+02 103.233 -6.81019e+00 2.89602e+01  0.00000e+00 0.00000e+00 3.22657e+02 103.233 1.29015e+02 103.233 0.9830 
1 1 1 -4  39  16 o 7  4.97455e+00 1.41279e+00 5.14866e+01 222.119 -2.07707e+00 -1.87800e+00 0.00000e+00 0.00000e+00 9.52712e+01 222.119 4.37845e+01 222.119 0.7941 
1 1 1 -4  39  17 o 9  1.04558e+01 1.60952e+00 1.03741e+02 114.320 -4.87825e+00 1.07938e+01  0.00000e+00 0.00000e+00 2.67512e+02 114.320 1.63771e+02 114.320 0.9568 
1 1 1 -4  39  18 o 12 6.18737e+00 1.91755e+00 8.39255e+01 298.274 2.34459e+00  -4.35909e+00 0.00000e+00 0.00000e+00 1.20683e+02 298.274 3.67572e+01 298.274 0.8922 
1 1 1 -4  40  1  o 7  2.21304e+01 4.76155e-01 6.11155e+02 353.376 1.60116e+01  -1.85941e+00 0.00000e+00 0.00000e+00 1.93218e+02 353.376 4.17937e+02 173.376 0.9685 
1 1 1 -4  40  2  o 11 2.72076e+01 4.48858e-01 4.98947e+02 258.550 -3.32593e+00 -1.64205e+01 0.00000e+00 0.00000e+00 4.90954e+02 258.550 7.99219e+00 78.550  0.9697 
1 1 1 -4  40  3  o 3  3.34815e+01 5.20643e-01 6.25738e+02 136.275 -1.96555e+01 1.87996e+01  0.00000e+00 0.00000e+00 6.06815e+02 136.275 1.89234e+01 316.275 0.9814 
1 1 1 -4  40  4  o 12 3.96689e+01 5.92942e-01 6.92255e+02 15.479  3.59237e+01  9.94814e+00  0.00000e+00 0.00000e+00 7.75045e+02 15.479  8.27906e+01 15.479  0.9865 
1 1 1 -4  40  5  o 7  1.92272e+01 3.99668e-01 3.46817e+02 132.319 -8.51979e+00 9.35682e+00  0.00000e+00 0.00000e+00 3.44709e+02 132.319 2.10713e+00 312.319 0.9596 
1 1 1 -4  40  6  o 17 3.99700e+01 5.96829e-01 6.63375e+02 262.582 -7.15649e+00 -5.49650e+01 0.00000e+00 0.00000e+00 8.20337e+02 262.582 1.56961e+02 262.582 0.9909 
1 1 1 -4  40  7  o 12 2.71941e+01 4.49757e-01 5.28467e+02 248.921 -1.26402e+01 -3.27944e+01 0.00000e+00 0.00000e+00 4.75068e+02 248.921 5.33984e+01 68.921  0.9857 
1 1 1 -4  40  8  o 8  8.39975e+00 3.75168e-01 1.05316e+02 322.004 2.12203e+00  -1.65764e+00 0.00000e+00 0.00000e+00 1.41218e+02 322.004 3.59017e+01 322.004 0.7844 
1 1 1 -4  40  9  o 18 2.64890e+01 4.57641e-01 3.95032e+02 224.723 -2.65528e+01 -2.62971e+01 0.00000e+00 0.00000e+00 5.82062e+02 224.723 1.87030e+02 224.723 0.9865 
1 1 1 -4  40  10 o 13 6.21555e+00 7.39126e-01 1.23208e+02 317.105 2.65730e+00  -2.46889e+00 0.00000e+00 0.00000e+00 7.36027e+01 317.105 4.96056e+01 137.105 0.8475 
1 1 1 -4  40  11 o 8  1.21483e+01 4.39960e-01 1.43435e+02 90.162  -3.11525e-02 1.10515e+01  0.00000e+00 0.00000e+00 2.89061e+02 90.162  1.45627e+02 90.162  0.9536 
1 1 1 -4  40  12 o 8  9.66992e+00 6.96526e-01 1.95855e+02 334.970 1.32260e+01  -6.17590e+00 0.00000e+00 0.00000e+00 1.52256e+02 334.970 4.35988e+01 154.970 0.9651 
1 1 1 -4  40  13 o 9  6.40600e+00 9.73734e-01 4.51237e+01 258.507 -5.52751e-01 -2.71864e+00 0.00000e+00 0.00000e+00 1.43901e+02 258.507 9.87777e+01 258.507 0.7918 
1 1 1 -4  40  14 f 0  4.82659e+00 1.04134e+00 7.17919e+01 161.156 -3.66667e+00 1.25135e+00  0.00000e+00 0.00000e+00 8.24745e+01 161.156 1.06826e+01 161.156 0.8585 
1 1 1 -4  40  15 f 0  5.69313e+00 1.37328e+00 1.36011e+02 213.010 -6.67310e+00 -4.33519e+00 0.00000e+00 0.00000e+00 6.19298e+01 213.010 7.40814e+01 33.010  0.9349 
1 1 1 -4  40  16 o 10 7.25787e+00 1.53805e+00 1.26051e+02 123.860 -5.53594e+00 8.25080e+00  0.00000e+00 0.00000e+00 1.29622e+02 123.860 3.57169e+00 123.860 0.9483 
1 1 1 -4  40  17 o 10 4.06641e+00 1.35028e+00 8.90243e+01 4.710   4.61303e+00  3.80101e-01  0.00000e+00 0.00000e+00 4.43592e+01 4.710   4.46651e+01 184.710 0.8840 
1 1 1 -4  40  18 o 12 5.55015e+00 1.76950e+00 1.26702e+02 324.137 5.98496e+00  -4.32646e+00 0.00000e+00 0.00000e+00 6.45060e+01 324.137 6.21959e+01 144.137 0.9296 
1 1 1 -4  41  1  o 10 4.48708e+01 7.27912e-01 7.72213e+02 142.962 -3.38690e+01 2.55574e+01  0.00000e+00 0.00000e+00 8.91656e+02 142.962 1.19443e+02 142.962 0.9881 
1 1 1 -4  41  2  o 13 3.83336e+01 5.78490e-01 6.75227e+02 52.736  1.91066e+01  2.51139e+01  0.00000e+00 0.00000e+00 7.39951e+02 52.736  6.47239e+01 52.736  0.9840 
1 1 1 -4  41  3  o 15 1.30246e+01 3.28115e-01 1.78526e+02 312.611 2.01469e+00  -2.19008e+00 0.00000e+00 0.00000e+00 2.16260e+02 312.611 3.77337e+01 312.611 0.8082 
1 1 1 -4  41  4  o 1  1.09278e+01 3.28355e-01 2.53443e+02 144.287 -3.59865e+00 2.58716e+00  0.00000e+00 0.00000e+00 1.06390e+02 144.287 1.47053e+02 324.287 0.8783 
1 1 1 -4  41  5  o 7  5.16035e+01 7.44084e-01 1.00515e+03 173.880 -8.97732e+01 9.62495e+00  0.00000e+00 0.00000e+00 9.17932e+02 173.880 8.72150e+01 353.880 0.9944 
1 1 1 -4  41  6  o 6  1.84337e+01 4.52878e-01 2.06741e+02 58.502  4.17110e+00  6.80717e+00  0.00000e+00 0.00000e+00 4.38895e+02 58.502  2.32154e+02 58.502  0.9351 
1 1 1 -4  41  7  o 14 1.72738e+01 3.86302e-01 1.99513e+02 128.474 -5.17226e+00 6.50846e+00  0.00000e+00 0.00000e+00 4.06892e+02 128.474 2.07380e+02 128.474 0.9378 
1 1 1 -4  41  8  o 2  2.14798e+01 4.06403e-01 2.75932e+02 59.473  8.69442e+00  1.47444e+01  0.00000e+00 0.00000e+00 5.03826e+02 59.473  2.27894e+02 59.473  0.9703 
1 1 1 -4  41  9  o 1  1.83595e+01 3.92666e-01 2.88129e+02 122.634 -9.92612e+00 1.55007e+01  0.00000e+00 0.00000e+00 3.79353e+02 122.634 9.12238e+01 122.634 0.9724 
1 1 1 -4  41  10 o 12 2.50733e+01 4.64490e-01 3.88489e+02 308.542 2.88902e+01  -3.62646e+01 0.00000e+00 0.00000e+00 5.38060e+02 308.542 1.49571e+02 308.542 0.9892 
1 1 1 -4  41  11 o 14 2.16652e+01 4.88825e-01 3.97836e+02 169.235 -5.32200e+01 1.01187e+01  0.00000e+00 0.00000e+00 4.03397e+02 169.235 5.56173e+00 169.235 0.9907 
1 1 1 -4  41  12 o 4  2.27150e+01 4.87170e-01 3.25977e+02 270.784 8.84127e-01  -6.45999e+01 0.00000e+00 0.00000e+00 5.14630e+02 270.784 1.88653e+02 270.784 0.9922 
1 1 1 -4  41  13 o 9  4.11727e+00 1.04206e+00 5.55059e+01 99.506  -3.47816e-01 2.07706e+00  0.00000e+00 0.00000e+00 5.41005e+01 99.506  1.40544e+00 279.506 0.7144 
1 1 1 -4  41  14 o 17 1.52758e+01 7.86546e-01 2.15256e+02 321.830 3.02362e+01  -2.37679e+01 0.00000e+00 0.00000e+00 3.45947e+02 321.830 1.30691e+02 321.830 0.9869 
1 1 1 -4  41  15 o 14 6.94657e+00 1.32666e+00 1.57781e+02 74.774  3.34197e+00  1.22785e+01  0.00000e+00 0.00000e+00 9.01687e+01 74.774  6.76124e+01 254.774 0.9599 
1 1 1 -4  41  16 o 19 9.78618e+00 1.37076e+00 9.80368e+01 41.222  8.29623e+00  7.26854e+00  0.00000e+00 0.00000e+00 2.48580e+02 41.222  1.50543e+02 41.222  0.9535 
1 1 1 -4  41  17 o 11 4.78752e+00 1.53990e+00 9.68487e+01 21.527  5.05438e+00  1.99375e+00  0.00000e+00 0.00000e+00 6.34664e+01 21.527  3.33823e+01 201.527 0.9025 
1 1 1 -4  42  1  o 13 3.51312e+01 5.95342e-01 4.83910e+02 53.284  1.32437e+01  1.77571e+01  0.00000e+00 0.00000e+00 8.04178e+02 53.284  3.20268e+02 53.284  0.9772 
1 1 1 -4  42  2  f 0  2.41445e+01 4.20168e-01 4.84520e+02 4.450   1.51453e+01  1.17856e+00  0.00000e+00 0.00000e+00 3.90862e+02 4.450   9.36575e+01 184.450 0.9665 
1 1 1 -4  42  3  o 15 4.94589e+01 7.19210e-01 9.58218e+02 143.136 -4.96672e+01 3.72427e+01  0.00000e+00 0.00000e+00 8.81526e+02 143.136 7.66916e+01 323.136 0.9919 
1 1 1 -4  42  4  o 17 3.58474e+01 5.47978e-01 7.22211e+02 162.170 -3.81448e+01 1.22690e+01  0.00000e+00 0.00000e+00 6.04711e+02 162.170 1.17500e+02 342.170 0.9874 
1 1 1 -4  42  5  o 3  3.91734e+01 5.88187e-01 6.48704e+02 351.182 4.28230e+01  -6.64330e+00 0.00000e+00 0.00000e+00 8.02097e+02 351.182 1.53394e+02 351.182 0.9884 
1 1 1 -4  42  6  o 4  2.04693e+01 4.43271e-01 3.80249e+02 186.216 -1.68747e+01 -1.83809e+00 0.00000e+00 0.00000e+00 3.63423e+02 186.216 1.68257e+01 6.216   0.9701 
1 1 1 -4  42  7  o 18 2.63838e+01 4.45822e-01 6.10816e+02 181.052 -4.31752e+01 -7.92942e-01 0.00000e+00 0.00000e+00 3.65245e+02 181.052 2.45571e+02 1.052   0.9884 
1 1 1 -4  42  8  o 18 3.16020e+01 5.08716e-01 6.55138e+02 157.528 -6.17072e+01 2.55247e+01  0.00000e+00 0.00000e+00 5.18129e+02 157.528 1.37009e+02 337.528 0.9925 
1 1 1 -4  42  9  o 10 1.07981e+01 4.26692e-01 2.12611e+02 303.826 5.03917e+00  -7.51997e+00 0.00000e+00 0.00000e+00 1.68050e+02 303.826 4.45607e+01 123.826 0.9430 
1 1 1 -4  42  10 o 4  2.17984e+01 4.61920e-01 3.73438e+02 261.797 -5.93512e+00 -4.11732e+01 0.00000e+00 0.00000e+00 4.30981e+02 261.797 5.75427e+01 261.797 0.9879 
1 1 1 -4  42  11 o 7  1.19154e+01 4.53291e-01 2.54590e+02 132.773 -1.42804e+01 1.54358e+01  0.00000e+00 0.00000e+00 1.79438e+02 132.773 7.51523e+01 312.773 0.9759 
1 1 1 -4  42  12 o 13 3.14681e+01 6.43698e-01 5.97871e+02 234.134 -9.45908e+01 -1.30838e+02 0.00000e+00 0.00000e+00 5.72002e+02 234.134 2.58694e+01 54.134  0.9969 
1 1 1 -4  42  13 f 0  2.03943e+01 7.50027e-01 4.33325e+02 12.435  9.12755e+01  2.01273e+01  0.00000e+00 0.00000e+00 3.22443e+02 12.435  1.10883e+02 192.435 0.9946 
1 1 1 -4  42  14 o 8  4.61724e+00 1.11334e+00 1.65882e+02 278.967 1.33011e+00  -8.42909e+00 0.00000e+00 0.00000e+00 4.43220e+00 98.967  1.70315e+02 98.967  0.9394 
1 1 1 -4  42  15 o 10 4.48391e+00 1.25051e+00 6.11758e+01 114.498 -1.35218e+00 2.96743e+00  0.00000e+00 0.00000e+00 7.67975e+01 114.498 1.56217e+01 114.498 0.8276 
1 1 1 -4  42  16 o 2  4.81055e+00 1.40266e+00 9.88591e+01 277.550 7.46015e-01  -5.62884e+00 0.00000e+00 0.00000e+00 6.32010e+01 277.550 3.56581e+01 97.550  0.9070 
1 1 1 -4  43  1  o 4  6.94862e+01 9.86995e-01 1.38463e+03 97.190  -1.51793e+01 1.20332e+02  0.00000e+00 0.00000e+00 1.21156e+03 97.190  1.73070e+02 277.190 0.9959 
1 1 1 -4  43  2  o 2  2.01882e+01 3.82241e-01 3.04812e+02 299.362 3.84796e+00  -6.83966e+00 0.00000e+00 0.00000e+00 4.02377e+02 299.362 9.75657e+01 299.362 0.9339 
1 1 1 -4  43  3  o 10 8.85193e+00 3.26477e-01 2.45509e+02 214.493 -2.43731e+00 -1.67466e+00 0.00000e+00 0.00000e+00 2.22696e+01 214.493 2.23240e+02 34.493  0.8068 
1 1 1 -4  43  4  o 9  1.54824e+01 3.42442e-01 3.91475e+02 350.313 1.13757e+01  -1.94180e+00 0.00000e+00 0.00000e+00 1.63099e+02 350.313 2.28376e+02 170.313 0.9556 
1 1 1 -4  43  5  o 18 7.97392e+00 3.96630e-01 7.64847e+01 359.473 1.05060e+00  -9.66939e-03 0.00000e+00 0.00000e+00 6.21499e+01 359.473 1.43348e+01 179.473 0.4640 
1 1 1 -4  43  6  o 3  2.79480e+01 5.02515e-01 3.92529e+02 156.556 -2.23600e+01 9.69655e+00  0.00000e+00 0.00000e+00 6.32345e+02 156.556 2.39817e+02 156.556 0.9793 
1 1 1 -4  43  7  o 16 1.46521e+01 3.55369e-01 2.75321e+02 232.059 -6.51136e+00 -8.35180e+00 0.00000e+00 0.00000e+00 2.46484e+02 232.059 2.88372e+01 52.059  0.9515 
1 1 1 -4  43  8  o 4  2.06777e+01 4.67423e-01 4.01879e+02 319.707 1.97610e+01  -1.67541e+01 0.00000e+00 0.00000e+00 3.56456e+02 319.707 4.54235e+01 139.707 0.9805 
1 1 1 -4  43  9  o 6  1.59088e+01 3.93561e-01 2.16516e+02 66.068  6.06805e+00  1.36726e+01  0.00000e+00 0.00000e+00 3.57885e+02 66.068  1.41369e+02 66.068  0.9660 
1 1 1 -4  43  10 o 10 1.00341e+01 4.37307e-01 1.96492e+02 24.441  9.86605e+00  4.48403e+00  0.00000e+00 0.00000e+00 1.60550e+02 24.441  3.59420e+01 204.441 0.9527 
1 1 1 -4  43  11 o 15 2.67725e+01 5.49669e-01 5.30029e+02 124.977 -5.75331e+01 8.22355e+01  0.00000e+00 0.00000e+00 4.64133e+02 124.977 6.58961e+01 304.977 0.9950 
1 1 1 -4  43  12 o 3  1.18052e+01 5.87622e-01 1.51091e+02 35.846  1.31916e+01  9.53022e+00  0.00000e+00 0.00000e+00 2.75351e+02 35.846  1.24261e+02 35.846  0.9688 
1 1 1 -4  43  13 o 19 7.68593e+00 9.59519e-01 1.60700e+02 188.742 -1.16629e+01 -1.79351e+00 0.00000e+00 0.00000e+00 1.13212e+02 188.742 4.74881e+01 8.742   0.9566 
1 1 1 -4  43  14 o 4  1.74294e+01 7.87323e-01 3.69464e+02 266.079 -5.39611e+00 -7.87259e+01 0.00000e+00 0.00000e+00 2.75078e+02 266.079 9.43862e+01 86.079  0.9936 
1 1 1 -4  43  15 f 0  1.14014e+01 1.14292e+00 1.52175e+02 78.365  4.43224e+00  2.15255e+01  0.00000e+00 0.00000e+00 2.61943e+02 78.365  1.09767e+02 78.365  0.9770 
1 1 1 -4  43  16 o 15 1.58256e+01 1.67510e+00 2.36788e+02 318.549 2.82049e+01  -2.49107e+01 0.00000e+00 0.00000e+00 3.43056e+02 318.549 1.06268e+02 318.549 0.9866 
1 1 1 -4  43  17 o 15 4.05731e+00 1.37735e+00 5.51271e+01 20.712  2.66963e+00  1.00939e+00  0.00000e+00 0.00000e+00 6.50592e+01 20.712  9.93205e+00 20.712  0.7986 
1 1 1 -4  44  1  o 11 2.02794e+01 4.56387e-01 4.83264e+02 344.369 1.25191e+01  -3.50261e+00 0.00000e+00 0.00000e+00 2.47606e+02 344.369 2.35658e+02 164.369 0.9607 
1 1 1 -4  44  2  o 13 5.84873e+00 4.64771e-01 1.18215e+02 159.138 -8.80983e-01 3.35743e-01  0.00000e+00 0.00000e+00 2.48274e+01 339.138 1.43043e+02 339.138 0.4258 
1 1 1 -4  44  3  o 8  2.73228e+01 4.55227e-01 6.66915e+02 73.101  8.40655e+00  2.76715e+01  0.00000e+00 0.00000e+00 3.39596e+02 73.101  3.27320e+02 253.101 0.9826 
1 1 1 -4  44  4  f 0  7.50200e+00 3.42684e-01 2.10582e+02 61.823  1.31882e+00  2.46192e+00  0.00000e+00 0.00000e+00 1.24965e+01 61.823  1.98086e+02 241.823 0.7934 
1 1 1 -4  44  5  o 3  3.53635e+01 5.44918e-01 6.71067e+02 271.321 1.14585e+00  -4.96981e+01 0.00000e+00 0.00000e+00 6.40307e+02 271.321 3.07602e+01 91.321  0.9899 
1 1 1 -4  44  6  o 7  2.64628e+01 4.49566e-01 5.71985e+02 142.476 -2.94668e+01 2.26303e+01  0.00000e+00 0.00000e+00 4.05431e+02 142.476 1.66555e+02 322.476 0.9864 
1 1 1 -4  44  7  o 6  3.18504e+01 5.09778e-01 6.06616e+02 64.643  2.26637e+01  4.78231e+01  0.00000e+00 0.00000e+00 5.73970e+02 64.643  3.26454e+01 244.643 0.9905 
1 1 1 -4  44  8  o 16 1.64372e+01 4.19222e-01 3.53325e+02 3.295   1.86672e+01  1.07479e+00  0.00000e+00 0.00000e+00 2.44733e+02 3.295   1.08592e+02 183.295 0.9729 
1 1 1 -4  44  9  o 14 7.63918e+00 4.43299e-01 2.15077e+02 12.403  6.90599e+00  1.51875e+00  0.00000e+00 0.00000e+00 4.93875e+01 12.403  1.65690e+02 192.403 0.9263 
1 1 1 -4  44  10 o 10 3.00676e+01 5.14324e-01 4.76702e+02 287.750 2.62136e+01  -8.18909e+01 0.00000e+00 0.00000e+00 6.39641e+02 287.750 1.62939e+02 287.750 0.9942 
1 1 1 -4  44  11 o 12 8.67337e+00 5.54304e-01 1.47618e+02 182.797 -9.60394e+00 -4.69188e-01 0.00000e+00 0.00000e+00 1.58711e+02 182.797 1.10934e+01 182.797 0.9465 
1 1 1 -4  44  12 o 3  5.00539e+00 9.01652e-01 5.04357e+01 61.898  1.00285e+00  1.87805e+00  0.00000e+00 0.00000e+00 8.35308e+01 61.898  3.30951e+01 61.898  0.7179 
1 1 1 -4  44  13 o 5  1.59236e+01 7.03107e-01 2.06513e+02 221.294 -2.69434e+01 -2.36656e+01 0.00000e+00 0.00000e+00 3.78294e+02 221.294 1.71781e+02 221.294 0.9860 
1 1 1 -4  44  14 o 19 3.36947e+00 1.01016e+00 9.28070e+01 342.093 3.54305e+00  -1.14483e+00 0.00000e+00 0.00000e+00 1.40184e+01 342.093 7.87886e+01 162.093 0.8520 
1 1 1 -4  44  15 o 6  4.11148e+00 1.27812e+00 7.83526e+01 248.840 -1.35853e+00 -3.50984e+00 0.00000e+00 0.00000e+00 5.21358e+01 248.840 2.62168e+01 68.840  0.8538 
1 1 1 -4  44  16 o 5  5.59225e+00 1.55475e+00 1.86306e+02 18.978  1.08173e+01  3.72002e+00  0.00000e+00 0.00000e+00 1.20510e+01 18.978  1.74255e+02 198.978 0.9552 
1 1 1 -4  44  17 o 10 1.21331e+01 2.07635e+00 2.23884e+02 183.597 -2.21994e+01 -1.39563e+00 0.00000e+00 0.00000e+00 2.15883e+02 183.597 8.00116e+00 3.597   0.9773 
1 1 1 -4  45  1  o 12 2.96583e+01 5.89662e-01 5.06113e+02 200.567 -1.90821e+01 -7.16014e+00 0.00000e+00 0.00000e+00 5.78681e+02 200.567 7.25685e+01 200.567 0.9752 
1 1 1 -4  45  2  o 14 2.71806e+01 4.94608e-01 4.75933e+02 126.078 -1.21457e+01 1.66696e+01  0.00000e+00 0.00000e+00 5.18289e+02 126.078 4.23561e+01 126.078 0.9754 
1 1 1 -4  45  3  o 15 5.36699e+00 4.20264e-01 2.16608e+02 37.581  1.42401e+00  1.09589e+00  0.00000e+00 0.00000e+00 8.35314e+01 217.581 3.00139e+02 217.581 0.6614 
1 1 1 -4  45  4  o 19 2.13005e+01 3.95055e-01 3.22591e+02 343.493 1.13111e+01  -3.35198e+00 0.00000e+00 0.00000e+00 4.40990e+02 343.493 1.18400e+02 343.493 0.9566 
1 1 1 -4  45  5  o 3  2.10622e+01 3.92867e-01 4.54987e+02 53.174  1.20478e+01  1.60893e+01  0.00000e+00 0.00000e+00 3.14056e+02 53.174  1.40931e+02 233.174 0.9748 
1 1 1 -4  45  6  o 11 3.31169e+01 5.23018e-01 7.02219e+02 129.365 -3.54632e+01 4.32281e+01  0.00000e+00 0.00000e+00 5.26483e+02 129.365 1.75736e+02 309.365 0.9910 
1 1 1 -4  45  7  o 15 1.24872e+01 3.76078e-01 2.86482e+02 144.147 -8.16339e+00 5.89902e+00  0.00000e+00 0.00000e+00 1.56915e+02 144.147 1.29567e+02 324.147 0.9490 
1 1 1 -4  45  8  o 14 9.28773e+00 3.95406e-01 1.27730e+02 83.026  4.78358e-01  3.91050e+00  0.00000e+00 0.00000e+00 1.71357e+02 83.026  4.36270e+01 83.026  0.8612 
1 1 1 -4  45  9  o 2  2.85904e+01 4.91551e-01 4.84201e+02 237.802 -3.25475e+01 -5.16885e+01 0.00000e+00 0.00000e+00 5.75403e+02 237.802 9.12019e+01 237.802 0.9918 
1 1 1 -4  45  10 o 7  5.05435e+00 7.72477e-01 3.83744e+01 171.822 -1.06540e+00 1.53110e-01  0.00000e+00 0.00000e+00 5.08568e+01 171.822 1.24823e+01 171.822 0.4728 
1 1 1 -4  45  11 o 17 1.00072e+01 4.77717e-01 2.19892e+02 142.402 -1.29661e+01 9.98466e+00  0.00000e+00 0.00000e+00 1.41892e+02 142.402 7.80000e+01 322.402 0.9689 
1 1 1 -4  45  12 o 6  9.50223e+00 5.11035e-01 1.87711e+02 274.555 1.30600e+00  -1.63940e+01 0.00000e+00 0.00000e+00 1.55577e+02 274.555 3.21340e+01 94.555  0.9691 
1 1 1 -4  45  13 o 8  1.09146e+01 7.65027e-01 2.26556e+02 170.009 -2.44700e+01 4.31058e+00  0.00000e+00 0.00000e+00 1.71685e+02 170.009 5.48706e+01 350.009 0.9797 
1 1 1 -4  45  14 o 4  1.21391e+01 8.73705e-01 1.63624e+02 125.502 -1.46334e+01 2.05136e+01  0.00000e+00 0.00000e+00 2.78988e+02 125.502 1.15364e+02 125.502 0.9800 
1 1 1 -4  45  15 o 4  5.38534e+00 1.48647e+00 1.26639e+02 177.778 -7.10039e+00 2.75527e-01  0.00000e+00 0.00000e+00 5.88537e+01 177.778 6.77855e+01 357.778 0.9267 
1 1 1 -4  45  16 o 16 8.61719e+00 1.77641e+00 1.79746e+02 294.106 5.84458e+00  -1.30621e+01 0.00000e+00 0.00000e+00 1.28800e+02 294.106 5.09461e+01 114.106 0.9644 
1 1 1 -4  45  17 o 6  5.13732e+00 1.60030e+00 6.13608e+01 174.384 -3.53089e+00 3.47225e-01  0.00000e+00 0.00000e+00 9.93499e+01 174.384 3.79891e+01 174.384 0.8436 
1 1 1 -4  46  1  o 15 6.55399e+01 1.09307e+00 1.33636e+03 270.765 1.81159e+00  -1.35601e+02 0.00000e+00 0.00000e+00 1.11255e+03 270.765 2.23809e+02 90.765  0.9963 
1 1 1 -4  46  2  f 0  5.65965e+01 8.15247e-01 9.72967e+02 143.752 -6.79895e+01 4.98477e+01  0.00000e+00 0.00000e+00 1.13646e+03 143.752 1.63491e+02 143.752 0.9941 
1 1 1 -4  46  3  o 18 5.01947e+01 7.32002e-01 8.57923e+02 28.297  7.07458e+01  3.80886e+01  0.00000e+00 0.00000e+00 1.01176e+03 28.297  1.53835e+02 28.297  0.9938 
1 1 1 -4  46  4  o 17 1.16472e+01 3.39244e-01 3.22888e+02 46.510  4.46533e+00  4.70720e+00  0.00000e+00 0.00000e+00 7.83124e+01 46.510  2.44576e+02 226.510 0.9193 
1 1 1 -4  46  5  o 6  2.90827e+01 4.77790e-01 4.77052e+02 136.182 -2.17763e+01 2.08959e+01  0.00000e+00 0.00000e+00 5.93960e+02 136.182 1.16907e+02 136.182 0.9833 
1 1 1 -4  46  6  o 1  1.46247e+01 3.59161e-01 2.93188e+02 70.163  3.92088e+00  1.08687e+01  0.00000e+00 0.00000e+00 2.30010e+02 70.163  6.31782e+01 250.163 0.9557 
1 1 1 -4  46  7  f 0  1.92983e+01 4.52826e-01 1.55631e+02 180.333 -9.07650e+00 -5.27266e-02 0.00000e+00 0.00000e+00 5.25352e+02 180.333 3.69721e+02 180.333 0.9432 
1 1 1 -4  46  8  o 1  1.95758e+01 4.67504e-01 3.63532e+02 19.954  2.38826e+01  8.67080e+00  0.00000e+00 0.00000e+00 3.53847e+02 19.954  9.68466e+00 199.954 0.9801 
1 1 1 -4  46  9  o 2  2.98977e+01 5.50869e-01 4.29054e+02 210.681 -5.05991e+01 -3.00213e+01 0.00000e+00 0.00000e+00 6.78513e+02 210.681 2.49459e+02 210.681 0.9915 
1 1 1 -4  46  10 o 11 8.14842e+00 5.46604e-01 9.14322e+01 309.899 2.75332e+00  -3.29305e+00 0.00000e+00 0.00000e+00 1.74435e+02 309.899 8.30027e+01 309.899 0.8739 
1 1 1 -4  46  11 o 4  1.38301e+01 4.58058e-01 2.41404e+02 32.454  2.21712e+01  1.40997e+01  0.00000e+00 0.00000e+00 2.64631e+02 32.454  2.32278e+01 32.454  0.9808 
1 1 1 -4  46  12 o 13 1.01444e+01 5.49765e-01 2.20214e+02 189.474 -2.13051e+01 -3.55537e+00 0.00000e+00 0.00000e+00 1.49050e+02 189.474 7.11643e+01 9.474   0.9766 
1 1 1 -4  46  13 o 12 1.12302e+01 5.00052e-01 1.64799e+02 91.472  -5.54122e-01 2.15678e+01  0.00000e+00 0.00000e+00 2.43600e+02 91.472  7.88003e+01 91.472  0.9765 
1 1 1 -4  46  14 o 12 1.33672e+01 1.33890e+00 2.34715e+02 224.927 -2.33029e+01 -2.32437e+01 0.00000e+00 0.00000e+00 2.54972e+02 224.927 2.02570e+01 224.927 0.9847 
1 1 1 -4  46  15 o 17 4.71616e+00 1.39895e+00 8.23758e+01 11.189  4.17495e+00  8.25847e-01  0.00000e+00 0.00000e+00 7.05814e+01 11.189  1.17944e+01 191.189 0.8727 
1 1 1 -4  46  16 o 1  3.65138e+00 1.22484e+00 1.24357e+01 296.620 2.80345e-01  -5.59337e-01 0.00000e+00 0.00000e+00 2.80203e+01 296.620 1.55846e+01 296.620 0.2985 
1 1 1 -4  46  17 o 12 7.49280e+00 2.10130e+00 1.05707e+02 35.255  5.28201e+00  3.73368e+00  0.00000e+00 0.00000e+00 1.49638e+02 35.255  4.39308e+01 35.255  0.9191 
1 1 1 -4  47  1  o 14 2.48058e+01 6.94391e-01 4.34647e+02 266.487 -1.01536e+00 -1.65419e+01 0.00000e+00 0.00000e+00 4.67032e+02 266.487 3.23845e+01 266.487 0.9693 
1 1 1 -4  47  2  o 16 2.26785e+01 4.14989e-01 4.20896e+02 92.786  -8.80785e-01 1.80974e+01  0.00000e+00 0.00000e+00 4.05505e+02 92.786  1.53908e+01 272.786 0.9720 
1 1 1 -4  47  3  o 16 2.97361e+01 4.86636e-01 5.57803e+02 7.657   2.87857e+01  3.87017e+00  0.00000e+00 0.00000e+00 5.37285e+02 7.657   2.05181e+01 187.657 0.9826 
1 1 1 -4  47  4  o 14 1.37246e+01 3.47068e-01 2.94788e+02 163.751 -8.19097e+00 2.38725e+00  0.00000e+00 0.00000e+00 1.88240e+02 163.751 1.06548e+02 343.751 0.9394 
1 1 1 -4  47  5  o 12 3.16028e+01 5.07706e-01 3.68338e+02 353.089 2.56279e+01  -3.10641e+00 0.00000e+00 0.00000e+00 7.91952e+02 353.089 4.23614e+02 353.089 0.9804 
1 1 1 -4  47  6  o 7  2.32757e+01 4.57467e-01 3.20243e+02 300.134 9.79544e+00  -1.68751e+01 0.00000e+00 0.00000e+00 5.28313e+02 300.134 2.08070e+02 300.134 0.9740 
1 1 1 -4  47  7  o 1  1.41765e+01 4.12825e-01 3.38446e+02 222.522 -1.14756e+01 -1.05235e+01 0.00000e+00 0.00000e+00 1.74543e+02 222.522 1.63903e+02 42.522  0.9673 
1 1 1 -4  47  8  o 12 7.36703e+00 4.84687e-01 1.29039e+02 57.288  1.77770e+00  2.76774e+00  0.00000e+00 0.00000e+00 9.93627e+01 57.288  2.96760e+01 237.288 0.8293 
1 1 1 -4  47  9  o 14 1.91756e+01 4.22800e-01 3.14702e+02 292.616 1.13495e+01  -2.72439e+01 0.00000e+00 0.00000e+00 3.89442e+02 292.616 7.47403e+01 292.616 0.9829 
1 1 1 -4  47  10 o 19 1.26919e+01 4.25552e-01 2.68474e+02 344.392 2.04034e+01  -5.69992e+00 0.00000e+00 0.00000e+00 1.94014e+02 344.392 7.44593e+01 164.392 0.9761 
1 1 1 -4  47  11 o 7  1.48646e+01 4.56858e-01 2.35737e+02 257.817 -6.30757e+00 -2.92148e+01 0.00000e+00 0.00000e+00 3.09379e+02 257.817 7.36416e+01 257.817 0.9831 
1 1 1 -4  47  12 o 7  1.75213e+01 5.14398e-01 3.25487e+02 125.322 -3.24629e+01 4.58114e+01  0.00000e+00 0.00000e+00 3.21681e+02 125.322 3.80612e+00 305.322 0.9911 
1 1 1 -4  47  13 o 1  5.47511e+00 7.49980e-01 7.98000e+01 329.303 4.29561e+00  -2.55023e+00 0.00000e+00 0.00000e+00 1.02309e+02 329.303 2.25090e+01 329.303 0.8933 
1 1 1 -4  47  14 o 11 8.82363e+00 1.57434e+00 1.65098e+02 260.517 -2.14293e+00 -1.28295e+01 0.00000e+00 0.00000e+00 1.50245e+02 260.517 1.48529e+01 80.517  0.9608 
1 1 1 -4  47  15 o 19 4.53509e+00 1.40185e+00 1.39780e+02 96.170  -7.67372e-01 7.09844e+00  0.00000e+00 0.00000e+00 1.64495e+01 96.170  1.23330e+02 276.170 0.9271 
1 1 1 -4  47  16 o 3  6.46961e+00 1.61757e+00 1.46307e+02 230.927 -6.57342e+00 -8.09633e+00 0.00000e+00 0.00000e+00 8.20119e+01 230.927 6.42952e+01 50.927  0.9508 
1 1 1 -4  47  17 o 12 4.61633e+00 1.57689e+00 1.19755e+02 359.347 6.43930e+00  -7.33680e-02 0.00000e+00 0.00000e+00 3.74783e+01 359.347 8.22769e+01 179.347 0.9187 
1 1 1 -4  48  1  o 17 1.44007e+01 4.03812e-01 2.61014e+02 150.647 -6.21206e+00 3.49360e+00  0.00000e+00 0.00000e+00 2.39474e+02 150.647 2.15401e+01 330.647 0.9269 
1 1 1 -4  48  2  o 19 1.68292e+01 5.91002e-01 1.94141e+02 287.529 1.72354e+00  -5.45675e+00 0.00000e+00 0.00000e+00 3.78544e+02 287.529 1.84402e+02 287.529 0.9078 
1 1 1 -4  48  3  o 14 1.55385e+01 3.83129e-01 3.62590e+02 121.981 -5.14700e+00 8.24295e+00  0.00000e+00 0.00000e+00 1.88859e+02 121.981 1.73730e+02 301.981 0.9471 
1 1 1 -4  48  4  f 0  2.20418e+01 4.08800e-01 1.65347e+02 41.186  5.74653e+00  5.02825e+00  0.00000e+00 0.00000e+00 6.04178e+02 41.186  4.38830e+02 41.186  0.9320 
1 1 1 -4  48  5  o 19 3.21066e+01 5.14359e-01 5.60879e+02 318.279 3.28248e+01  -2.92674e+01 0.00000e+00 0.00000e+00 6.27524e+02 318.279 6.66445e+01 318.279 0.9886 
1 1 1 -4  48  6  o 17 6.96234e+00 4.22946e-01 2.01679e+02 240.874 -1.88201e+00 -3.37765e+00 0.00000e+00 0.00000e+00 2.19286e+01 240.874 1.79751e+02 60.874  0.8582 
1 1 1 -4  48  7  o 10 1.99854e+01 4.05412e-01 3.91490e+02 106.851 -7.09465e+00 2.34234e+01  0.00000e+00 0.00000e+00 3.40591e+02 106.851 5.08993e+01 286.851 0.9794 
1 1 1 -4  48  8  f 0  2.28291e+01 4.38933e-01 3.14766e+02 93.563  -1.75805e+00 2.82306e+01  0.00000e+00 0.00000e+00 5.23358e+02 93.563  2.08592e+02 93.563  0.9822 
1 1 1 -4  48  9  o 18 1.43757e+01 4.03935e-01 1.99031e+02 207.369 -1.21241e+01 -6.27635e+00 0.00000e+00 0.00000e+00 3.17908e+02 207.369 1.18877e+02 207.369 0.9626 
1 1 1 -4  48  10 o 5  2.51488e+01 4.79612e-01 4.21374e+02 310.919 4.37190e+01  -5.04375e+01 0.00000e+00 0.00000e+00 5.10291e+02 310.919 8.89175e+01 310.919 0.9925 
1 1 1 -4  48  11 o 6  7.79225e+00 5.78349e-01 1.19572e+02 254.976 -1.90326e+00 -7.09114e+00 0.00000e+00 0.00000e+00 1.50468e+02 254.976 3.08964e+01 254.976 0.9292 
1 1 1 -4  48  12 o 13 1.39457e+01 5.15717e-01 2.45912e+02 114.087 -1.37720e+01 3.08069e+01  0.00000e+00 0.00000e+00 2.66010e+02 114.087 2.00985e+01 114.087 0.9851 
1 1 1 -4  48  13 o 9  3.03700e+00 8.93806e-01 7.57672e+01 326.911 2.20556e+00  -1.43716e+00 0.00000e+00 0.00000e+00 1.22755e+01 326.911 6.34917e+01 146.911 0.7787 
1 1 1 -4  48  14 o 3  9.97001e+00 1.25462e+00 1.11896e+02 155.300 -1.09419e+01 5.03260e+00  0.00000e+00 0.00000e+00 2.43178e+02 155.300 1.31282e+02 155.300 0.9575 
1 1 1 -4  48  16 o 12 4.86817e+00 1.56008e+00 1.03659e+02 345.100 5.36692e+00  -1.42802e+00 0.00000e+00 0.00000e+00 5.98170e+01 345.100 4.38423e+01 165.100 0.9048 
1 1 1 -4  48  17 o 3  5.17862e+00 1.73609e+00 3.53486e+01 192.161 -1.91253e+00 -4.12140e-01 0.00000e+00 0.00000e+00 9.72051e+01 192.161 6.18565e+01 192.161 0.6905 
1 1 1 -4  49  1  o 7  6.83887e+00 4.54653e-01 1.98264e+02 146.888 -1.99556e+00 1.30148e+00  0.00000e+00 0.00000e+00 5.57003e+00 326.888 2.03834e+02 326.888 0.7516 
1 1 1 -4  49  2  o 3  3.40114e+01 5.38488e-01 4.94488e+02 211.370 -2.44895e+01 -1.49308e+01 0.00000e+00 0.00000e+00 7.57825e+02 211.370 2.63337e+02 211.370 0.9824 
1 1 1 -4  49  3  o 9  2.99383e+01 6.30271e-01 5.06309e+02 286.156 8.80686e+00  -3.03995e+01 0.00000e+00 0.00000e+00 5.97553e+02 286.156 9.12443e+01 286.156 0.9841 
1 1 1 -4  49  4  o 2  2.22120e+01 4.09502e-01 3.90389e+02 70.800  6.21258e+00  1.78400e+01  0.00000e+00 0.00000e+00 4.19208e+02 70.800  2.88195e+01 70.800  0.9732 
1 1 1 -4  49  5  o 15 3.34797e+01 5.30038e-01 7.07190e+02 172.097 -5.62558e+01 7.80860e+00  0.00000e+00 0.00000e+00 5.35122e+02 172.097 1.72068e+02 352.098 0.9912 
1 1 1 -4  49  6  o 13 1.90494e+01 3.95195e-01 2.60463e+02 28.880  1.22339e+01  6.74780e+00  0.00000e+00 0.00000e+00 4.26343e+02 28.880  1.65880e+02 28.880  0.9635 
1 1 1 -4  49  7  f 0  2.77540e+01 5.19447e-01 2.55459e+02 196.406 -2.17650e+01 -6.40821e+00 0.00000e+00 0.00000e+00 7.59349e+02 196.406 5.03890e+02 196.406 0.9777 
1 1 1 -4  49  8  o 5  4.32536e+01 6.58685e-01 6.14990e+02 151.960 -9.95371e+01 5.30141e+01  0.00000e+00 0.00000e+00 9.94424e+02 151.960 3.79434e+02 151.960 0.9956 
1 1 1 -4  49  9  o 17 1.10838e+01 4.19602e-01 2.60701e+02 347.263 1.44075e+01  -3.25657e+00 0.00000e+00 0.00000e+00 1.39004e+02 347.263 1.21697e+02 167.263 0.9655 
1 1 1 -4  49  10 o 7  2.54601e+01 4.86622e-01 3.88978e+02 224.706 -4.86173e+01 -4.81210e+01 0.00000e+00 0.00000e+00 5.54265e+02 224.706 1.65287e+02 224.706 0.9927 
1 1 1 -4  49  11 o 4  1.45665e+01 4.68029e-01 2.13652e+02 106.499 -7.73122e+00 2.61023e+01  0.00000e+00 0.00000e+00 3.19485e+02 106.499 1.05833e+02 106.499 0.9815 
1 1 1 -4  49  12 o 19 1.15106e+01 5.08613e-01 2.22592e+02 285.856 7.65573e+00  -2.69535e+01 0.00000e+00 0.00000e+00 1.98562e+02 285.856 2.40302e+01 105.856 0.9820 
1 1 1 -4  49  13 o 5  6.60900e+00 7.79160e-01 9.83985e+01 28.728  7.08376e+00  3.88270e+00  0.00000e+00 0.00000e+00 1.31849e+02 28.728  3.34509e+01 28.728  0.9359 
1 1 1 -4  49  14 o 13 4.73943e+00 1.27664e+00 1.35567e+02 120.083 -3.59238e+00 6.20128e+00  0.00000e+00 0.00000e+00 2.78800e+01 120.083 1.07687e+02 300.083 0.9273 
1 1 1 -4  49  15 o 3  1.46790e+01 1.37223e+00 2.82147e+02 187.357 -4.87067e+01 -6.28899e+00 0.00000e+00 0.00000e+00 2.57589e+02 187.357 2.45581e+01 7.357   0.9898 
1 1 1 -4  49  16 o 18 7.63439e+00 2.09512e+00 1.30079e+02 270.668 8.89854e-02  -7.62660e+00 0.00000e+00 0.00000e+00 1.33937e+02 270.668 3.85772e+00 270.668 0.9319 
1 1 1 -4  49  17 o 4  5.05966e+00 1.68288e+00 7.39306e+01 17.058  4.01350e+00  1.23147e+00  0.00000e+00 0.00000e+00 8.93633e+01 17.058  1.54328e+01 17.058  0.8707 
1 1 1 -4  50  1  o 19 2.02762e+01 4.32518e-01 2.69964e+02 245.676 -3.85141e+00 -8.52032e+00 0.00000e+00 0.00000e+00 4.48200e+02 245.676 1.78235e+02 245.676 0.9449 
1 1 1 -4  50  2  o 14 1.59816e+01 3.73195e-01 4.04176e+02 150.909 -9.71771e+00 5.40673e+00  0.00000e+00 0.00000e+00 1.67132e+02 150.909 2.37044e+02 330.909 0.9539 
1 1 1 -4  50  3  o 13 3.89835e+01 6.91384e-01 7.48667e+02 217.661 -4.78529e+01 -3.69331e+01 0.00000e+00 0.00000e+00 6.99634e+02 217.661 4.90331e+01 37.661  0.9917 
1 1 1 -4  50  4  o 6  7.70060e+00 3.77579e-01 1.92720e+02 226.598 -2.26962e+00 -2.39991e+00 0.00000e+00 0.00000e+00 4.66681e+01 226.598 1.46052e+02 46.598  0.8301 
1 1 1 -4  50  5  o 13 5.15948e+00 4.85181e-01 2.34183e+02 61.305  1.55105e+00  2.83361e+00  0.00000e+00 0.00000e+00 7.47194e+01 241.305 3.08902e+02 241.305 0.8257 
1 1 1 -4  50  6  o 7  3.45373e+01 5.46288e-01 5.38899e+02 83.234  6.59618e+00  5.56007e+01  0.00000e+00 0.00000e+00 7.41684e+02 83.234  2.02785e+02 83.234  0.9910 
1 1 1 -4  50  7  o 9  2.62382e+01 4.63159e-01 4.59770e+02 84.965  3.50049e+00  3.97280e+01  0.00000e+00 0.00000e+00 5.08973e+02 84.965  4.92036e+01 84.965  0.9874 
1 1 1 -4  50  8  o 9  1.01890e+01 4.59922e-01 1.24738e+02 187.569 -5.40324e+00 -7.18003e-01 0.00000e+00 0.00000e+00 2.19045e+02 187.569 9.43078e+01 187.569 0.9029 
1 1 1 -4  50  9  o 5  4.13131e+00 7.17262e-01 4.39861e+01 99.879  -1.82106e-01 1.04569e+00  0.00000e+00 0.00000e+00 2.81763e+01 99.879  1.58098e+01 279.879 0.4677 
1 1 1 -4  50  10 o 18 1.05376e+01 4.50795e-01 1.18785e+02 273.460 5.73181e-01  -9.48110e+00 0.00000e+00 0.00000e+00 2.53127e+02 273.460 1.34342e+02 273.460 0.9458 
1 1 1 -4  50  11 o 3  1.45175e+01 4.66294e-01 2.30953e+02 301.592 1.55467e+01  -2.52786e+01 0.00000e+00 0.00000e+00 3.01156e+02 301.592 7.02036e+01 301.592 0.9830 
1 1 1 -4  50  12 o 11 8.26941e+00 6.98619e-01 1.47277e+02 106.699 -3.76015e+00 1.25338e+01  0.00000e+00 0.00000e+00 1.48780e+02 106.699 1.50303e+00 106.699 0.9610 
1 1 1 -4  50  13 o 11 1.66061e+01 6.94936e-01 2.98587e+02 359.394 5.97791e+01  -6.31781e-01 0.00000e+00 0.00000e+00 3.14304e+02 359.394 1.57170e+01 359.394 0.9916 
1 1 1 -4  50  14 o 18 5.60862e+00 8.27908e-01 7.20345e+01 173.171 -5.34945e+00 6.40615e-01  0.00000e+00 0.00000e+00 1.16004e+02 173.171 4.39697e+01 173.171 0.9017 
1 1 1 -4  50  15 o 8  5.86118e+00 1.71168e+00 8.86232e+01 146.347 -3.97278e+00 2.64477e+00  0.00000e+00 0.00000e+00 1.04666e+02 146.347 1.60431e+01 146.347 0.8878 
1 1 1 -4  50  16 o 4  5.37173e+00 1.69605e+00 5.43156e+01 179.587 -3.01381e+00 2.16979e-02  0.00000e+00 0.00000e+00 1.07325e+02 179.587 5.30098e+01 179.587 0.8110 
1 1 1 -4  50  17 o 18 5.79407e+00 1.85184e+00 5.62167e+01 2.928   3.32914e+00  1.70275e-01  0.00000e+00 0.00000e+00 1.22418e+02 2.928   6.62010e+01 2.928   0.8319 
1 1 1 -4  51  1  o 8  1.89287e+01 3.93200e-01 5.22353e+02 329.454 1.46418e+01  -8.64035e+00 0.00000e+00 0.00000e+00 1.65884e+02 329.454 3.56469e+02 149.454 0.9701 
1 1 1 -4  51  2  o 15 1.78163e+01 3.86991e-01 3.42843e+02 221.390 -9.62374e+00 -8.48160e+00 0.00000e+00 0.00000e+00 2.98150e+02 221.390 4.46925e+01 41.390  0.9602 
1 1 1 -4  51  3  o 10 2.38605e+01 5.00685e-01 5.67982e+02 127.992 -1.81191e+01 2.31982e+01  0.00000e+00 0.00000e+00 3.10462e+02 127.992 2.57520e+02 307.992 0.9829 
1 1 1 -4  51  4  o 5  1.32332e+01 3.62971e-01 3.85344e+02 114.567 -5.20027e+00 1.13756e+01  0.00000e+00 0.00000e+00 8.99162e+01 114.567 2.95428e+02 294.567 0.9592 
1 1 1 -4  51  5  o 18 2.31295e+01 4.25731e-01 4.68897e+02 173.237 -2.96979e+01 3.52158e+00  0.00000e+00 0.00000e+00 3.82177e+02 173.237 8.67193e+01 353.237 0.9831 
1 1 1 -4  51  6  o 14 2.84408e+01 4.81692e-01 5.80391e+02 134.470 -3.73926e+01 3.80915e+01  0.00000e+00 0.00000e+00 4.73527e+02 134.470 1.06864e+02 314.469 0.9906 
1 1 1 -4  51  7  o 13 1.09106e+01 4.38895e-01 1.19692e+02 350.061 4.59332e+00  -8.04839e-01 0.00000e+00 0.00000e+00 2.41296e+02 350.061 1.21604e+02 350.061 0.8849 
1 1 1 -4  51  8  o 8  5.13973e+00 6.76016e-01 5.51262e+01 355.811 1.28178e+00  -9.38812e-02 0.00000e+00 0.00000e+00 4.82676e+01 355.811 6.85862e+00 175.811 0.5384 
1 1 1 -4  51  9  o 4  1.80856e+01 4.23416e-01 3.16011e+02 346.531 3.22528e+01  -7.72453e+00 0.00000e+00 0.00000e+00 3.49031e+02 346.531 3.30201e+01 346.531 0.9848 
1 1 1 -4  51  10 o 8  1.35407e+01 4.28916e-01 1.95043e+02 82.984  2.46364e+00  2.00185e+01  0.00000e+00 0.00000e+00 2.97494e+02 82.984  1.02451e+02 82.984  0.9749 
1 1 1 -4  51  11 o 18 2.31887e+01 4.90629e-01 2.78436e+02 311.378 3.95710e+01  -4.49186e+01 0.00000e+00 0.00000e+00 5.78824e+02 311.378 3.00388e+02 311.378 0.9916 
1 1 1 -4  51  12 o 13 7.17920e+00 7.29801e-01 1.19629e+02 237.995 -4.67403e+00 -7.47851e+00 0.00000e+00 0.00000e+00 1.32140e+02 237.995 1.25115e+01 237.995 0.9415 
1 1 1 -4  51  13 o 19 1.28671e+01 6.68580e-01 2.11009e+02 307.610 2.20896e+01  -2.86736e+01 0.00000e+00 0.00000e+00 2.61178e+02 307.610 5.01689e+01 307.610 0.9861 
1 1 1 -4  51  14 o 16 4.86004e+00 1.04796e+00 8.74003e+01 227.484 -3.88710e+00 -4.23973e+00 0.00000e+00 0.00000e+00 7.67226e+01 227.484 1.06777e+01 47.485  0.9083 
1 1 1 -4  51  15 o 4  8.15360e+00 2.02003e+00 1.00912e+02 107.556 -1.94206e+00 6.13841e+00  0.00000e+00 0.00000e+00 1.77280e+02 107.556 7.63679e+01 107.556 0.9187 
1 1 1 -4  51  16 o 12 1.11410e+01 2.51711e+00 2.12082e+02 167.770 -1.42647e+01 3.09186e+00  0.00000e+00 0.00000e+00 1.86809e+02 167.770 2.52735e+01 347.770 0.9651 
1 1 1 -4  51  17 o 11 5.13118e+00 1.52374e+00 6.53017e+01 267.795 -1.61566e-01 -4.19691e+00 0.00000e+00 0.00000e+00 1.00267e+02 267.795 3.49652e+01 267.795 0.8708 
1 1 1 -4  52  1  o 5  3.87659e+01 5.98362e-01 7.82139e+02 194.323 -6.12024e+01 -1.56263e+01 0.00000e+00 0.00000e+00 6.59014e+02 194.323 1.23125e+02 14.323  0.9921 
1 1 1 -4  52  2  f 0  1.78423e+01 3.86584e-01 1.94222e+02 140.581 -5.85334e+00 4.81122e+00  0.00000e+00 0.00000e+00 4.28407e+02 140.581 2.34185e+02 140.581 0.9315 
1 1 1 -4  52  3  o 3  3.28414e+01 6.15476e-01 5.68223e+02 8.557   4.06772e+01  6.12027e+00  0.00000e+00 0.00000e+00 6.46720e+02 8.557   7.84976e+01 8.557   0.9878 
1 1 1 -4  52  4  o 7  2.74137e+01 4.69493e-01 4.80578e+02 214.239 -2.92339e+01 -1.98962e+01 0.00000e+00 0.00000e+00 5.31126e+02 214.239 5.05484e+01 214.239 0.9858 
1 1 1 -4  52  5  o 12 1.33207e+01 5.22296e-01 2.46112e+02 132.323 -6.18654e+00 6.79349e+00  0.00000e+00 0.00000e+00 2.24413e+02 132.323 2.16987e+01 312.323 0.9439 
1 1 1 -4  52  6  o 12 1.79800e+01 3.99067e-01 3.10907e+02 28.681  1.53414e+01  8.39272e+00  0.00000e+00 0.00000e+00 3.42086e+02 28.681  3.11796e+01 28.681  0.9710 
1 1 1 -4  52  7  o 17 2.51012e+01 4.55377e-01 4.98442e+02 286.567 1.23464e+01  -4.15014e+01 0.00000e+00 0.00000e+00 4.29005e+02 286.567 6.94371e+01 106.567 0.9884 
1 1 1 -4  52  8  o 16 2.69021e+01 4.78857e-01 4.04182e+02 159.452 -4.96183e+01 1.85984e+01  0.00000e+00 0.00000e+00 5.91332e+02 159.452 1.87150e+02 159.452 0.9905 
1 1 1 -4  52  9  o 16 5.84236e+00 6.58663e-01 3.73912e+01 29.485  1.07973e+00  6.10519e-01  0.00000e+00 0.00000e+00 7.71453e+01 29.485  3.97541e+01 29.485  0.5251 
1 1 1 -4  52  10 o 6  1.45445e+01 4.87157e-01 2.20854e+02 142.238 -1.88330e+01 1.45885e+01  0.00000e+00 0.00000e+00 3.10234e+02 142.238 8.93807e+01 142.238 0.9788 
1 1 1 -4  52  11 o 19 4.65893e+00 8.20467e-01 1.14435e+02 349.011 4.51021e+00  -8.75775e-01 0.00000e+00 0.00000e+00 3.89206e+01 349.011 7.55149e+01 169.011 0.8830 
1 1 1 -4  52  12 o 5  5.62923e+00 9.43732e-01 1.16859e+02 59.172  3.40283e+00  5.70197e+00  0.00000e+00 0.00000e+00 7.62930e+01 59.172  4.05656e+01 239.172 0.9213 
1 1 1 -4  52  13 o 14 8.28953e+00 7.61149e-01 1.25911e+02 173.723 -1.28251e+01 1.41075e+00  0.00000e+00 0.00000e+00 1.70334e+02 173.723 4.44230e+01 173.723 0.9604 
1 1 1 -4  52  14 o 16 1.21222e+01 6.75679e-01 2.06526e+02 6.183   3.91408e+01  4.24029e+00  0.00000e+00 0.00000e+00 2.38332e+02 6.183   3.18055e+01 6.183   0.9872 
1 1 1 -4  52  15 o 1  6.02169e+00 1.61096e+00 1.69414e+02 155.386 -9.72381e+00 4.45480e+00  0.00000e+00 0.00000e+00 4.34718e+01 155.386 1.25942e+02 335.386 0.9520 
1 1 1 -4  52  16 o 12 8.06209e+00 2.06223e+00 1.54264e+02 130.248 -6.68387e+00 7.89577e+00  0.00000e+00 0.00000e+00 1.29939e+02 130.248 2.43253e+01 310.248 0.9504 
1 1 1 -4  52  17 o 13 5.38702e+00 1.63703e+00 1.71197e+02 292.042 3.98418e+00  -9.84026e+00 0.00000e+00 0.00000e+00 1.87434e+01 292.042 1.52454e+02 112.042 0.9517 
1 1 1 -4  53  1  o 7  2.32871e+01 4.35907e-01 1.99104e+02 217.802 -7.98418e+00 -6.19369e+00 0.00000e+00 0.00000e+00 6.29055e+02 217.802 4.29950e+02 217.802 0.9491 
1 1 1 -4  53  2  o 19 4.27599e+01 6.49906e-01 8.41134e+02 45.304  5.57780e+01  5.63730e+01  0.00000e+00 0.00000e+00 7.50467e+02 45.304  9.06669e+01 225.304 0.9937 
1 1 1 -4  53  3  o 12 1.72696e+01 4.19139e-01 3.42327e+02 23.432  1.32766e+01  5.75421e+00  0.00000e+00 0.00000e+00 2.81606e+02 23.432  6.07208e+01 203.432 0.9648 
1 1 1 -4  53  4  o 16 2.79803e+01 4.76716e-01 5.67482e+02 206.445 -3.71860e+01 -1.84959e+01 0.00000e+00 0.00000e+00 4.67214e+02 206.445 1.00268e+02 26.445  0.9879 
1 1 1 -4  53  5  o 12 2.14003e+01 4.20066e-01 2.21600e+02 243.605 -6.39491e+00 -1.28855e+01 0.00000e+00 0.00000e+00 5.50772e+02 243.605 3.29172e+02 243.605 0.9646 
1 1 1 -4  53  6  o 7  3.04030e+01 5.06087e-01 5.18000e+02 233.332 -3.00975e+01 -4.04260e+01 0.00000e+00 0.00000e+00 6.07675e+02 233.332 8.96743e+01 233.332 0.9900 
1 1 1 -4  53  7  o 5  1.42262e+01 5.17871e-01 1.96930e+02 260.174 -2.05952e+00 -1.18915e+01 0.00000e+00 0.00000e+00 3.12275e+02 260.174 1.15345e+02 260.174 0.9576 
1 1 1 -4  53  8  o 11 2.42820e+01 4.60429e-01 3.65284e+02 247.785 -1.59469e+01 -3.90486e+01 0.00000e+00 0.00000e+00 5.30929e+02 247.785 1.65645e+02 247.785 0.9881 
1 1 1 -4  53  9  o 12 1.50659e+01 4.28343e-01 2.84383e+02 71.434  8.47213e+00  2.52245e+01  0.00000e+00 0.00000e+00 2.67333e+02 71.434  1.70503e+01 251.434 0.9810 
1 1 1 -4  53  10 f 0  8.15962e+00 5.26986e-01 3.33380e+02 204.728 -1.92193e+01 -8.85121e+00 0.00000e+00 0.00000e+00 3.63001e+01 24.728  3.69680e+02 24.728  0.9761 
1 1 1 -4  53  11 o 15 8.49988e+00 6.77237e-01 2.20691e+02 12.030  1.72630e+01  3.67896e+00  0.00000e+00 0.00000e+00 8.69984e+01 12.030  1.33693e+02 192.030 0.9712 
1 1 1 -4  53  12 o 8  3.93123e+00 9.71071e-01 1.30332e+02 287.752 1.47069e+00  -4.59389e+00 0.00000e+00 0.00000e+00 1.69038e-01 107.752 1.30501e+02 107.752 0.8891 
1 1 1 -4  53  13 o 19 1.05965e+01 6.88824e-01 2.24676e+02 116.167 -1.42060e+01 2.89124e+01  0.00000e+00 0.00000e+00 1.63392e+02 116.167 6.12838e+01 296.167 0.9844 
1 1 1 -4  53  14 o 16 2.98145e+00 9.15142e-01 7.42594e+01 251.084 -1.02051e+00 -2.97796e+00 0.00000e+00 0.00000e+00 1.66472e+01 251.084 5.76122e+01 71.084  0.8204 
1 1 1 -4  53  15 o 11 6.07442e+00 1.62031e+00 1.49780e+02 174.326 -9.40946e+00 9.34900e-01  0.00000e+00 0.00000e+00 6.34741e+01 174.326 8.63056e+01 354.326 0.9455 
1 1 1 -4  53  16 o 17 9.06448e+00 1.63990e+00 1.93798e+02 71.756  5.70461e+00  1.73058e+01  0.00000e+00 0.00000e+00 1.33023e+02 71.756  6.07752e+01 251.756 0.9722 
1 1 1 -4  53  17 o 11 5.00295e+00 1.51693e+00 8.98331e+01 217.421 -4.65938e+00 -3.56509e+00 0.00000e+00 0.00000e+00 7.88620e+01 217.421 1.09711e+01 37.421  0.9102 
1 1 1 -4  54  1  o 19 1.27895e+01 4.42323e-01 3.43462e+02 110.570 -3.43022e+00 9.14033e+00  0.00000e+00 0.00000e+00 1.10423e+02 110.570 2.33039e+02 290.570 0.9473 
1 1 1 -4  54  2  o 4  4.04110e+01 6.19652e-01 7.79899e+02 334.471 6.91019e+01  -3.30027e+01 0.00000e+00 0.00000e+00 7.23710e+02 334.471 5.61883e+01 154.471 0.9934 
1 1 1 -4  54  3  f 0  3.39499e+01 5.83559e-01 6.63252e+02 80.414  1.00015e+01  5.92223e+01  0.00000e+00 0.00000e+00 5.97257e+02 80.414  6.59956e+01 260.414 0.9916 
1 1 1 -4  54  4  o 15 3.62402e+01 5.69263e-01 5.15709e+02 296.996 2.31783e+01  -4.54970e+01 0.00000e+00 0.00000e+00 8.27319e+02 296.996 3.11610e+02 296.996 0.9902 
1 1 1 -4  54  5  o 3  2.12881e+01 4.22705e-01 4.37062e+02 156.297 -2.45123e+01 1.07617e+01  0.00000e+00 0.00000e+00 3.44331e+02 156.297 9.27312e+01 336.297 0.9811 
1 1 1 -4  54  6  o 7  1.73756e+01 4.01697e-01 3.55190e+02 259.706 -3.65413e+00 -2.01190e+01 0.00000e+00 0.00000e+00 2.78436e+02 259.706 7.67537e+01 79.706  0.9752 
1 1 1 -4  54  7  o 14 1.23507e+01 4.01371e-01 2.63753e+02 27.225  1.25016e+01  6.43184e+00  0.00000e+00 0.00000e+00 1.81082e+02 27.225  8.26710e+01 207.225 0.9638 
1 1 1 -4  54  8  o 19 1.59806e+01 4.20972e-01 2.77584e+02 147.120 -1.90488e+01 1.23138e+01  0.00000e+00 0.00000e+00 3.05960e+02 147.120 2.83766e+01 147.120 0.9777 
1 1 1 -4  54  9  o 13 2.18970e+01 4.52588e-01 3.09589e+02 77.228  1.04281e+01  4.60037e+01  0.00000e+00 0.00000e+00 4.98965e+02 77.228  1.89376e+02 77.228  0.9893 
1 1 1 -4  54  10 o 13 1.45878e+01 5.12305e-01 2.19511e+02 40.375  2.05694e+01  1.74903e+01  0.00000e+00 0.00000e+00 3.14374e+02 40.375  9.48629e+01 40.375  0.9813 
1 1 1 -4  54  11 o 9  1.13210e+01 5.67133e-01 2.11912e+02 310.936 1.53160e+01  -1.76588e+01 0.00000e+00 0.00000e+00 2.00844e+02 310.936 1.10684e+01 130.936 0.9784 
1 1 1 -4  54  12 o 4  8.83430e+00 8.29273e-01 1.80670e+02 141.015 -1.31976e+01 1.06813e+01  0.00000e+00 0.00000e+00 1.38422e+02 141.015 4.22476e+01 321.015 0.9701 
1 1 1 -4  54  13 o 15 3.26857e+00 9.19791e-01 3.95799e+01 75.679  4.11991e-01  1.61389e+00  0.00000e+00 0.00000e+00 3.75664e+01 75.679  2.01349e+00 255.679 0.6345 
1 1 1 -4  54  14 o 4  6.52306e+00 9.36988e-01 1.35539e+02 317.616 9.16979e+00  -8.36837e+00 0.00000e+00 0.00000e+00 9.68936e+01 317.616 3.86457e+01 137.616 0.9588 
1 1 1 -4  54  15 o 3  4.99809e+00 1.47715e+00 1.05436e+02 82.690  7.73076e-01  6.02680e+00  0.00000e+00 0.00000e+00 6.40645e+01 82.690  4.13720e+01 262.690 0.9135 
1 1 1 -4  54  16 o 18 7.52687e+00 1.59905e+00 1.38504e+02 296.783 5.24781e+00  -1.03964e+01 0.00000e+00 0.00000e+00 1.28342e+02 296.783 1.01621e+01 116.783 0.9561 
1 1 1 -4  54  17 o 1  6.17657e+00 1.67617e+00 1.40747e+02 155.656 -9.23272e+00 4.17724e+00  0.00000e+00 0.00000e+00 7.64275e+01 155.656 6.43191e+01 335.656 0.9493 
1 1 1 -4  55  1  o 6  2.35432e+01 4.42643e-01 4.26461e+02 228.715 -1.62065e+01 -1.84570e+01 0.00000e+00 0.00000e+00 4.37258e+02 228.715 1.07964e+01 228.715 0.9794 
1 1 1 -4  55  2  o 19 5.87748e+00 5.19652e-01 1.48781e+01 191.452 -2.05652e-01 -4.16616e-02 0.00000e+00 0.00000e+00 8.08726e+00 191.452 6.79085e+00 11.452  0.1043 
1 1 1 -4  55  3  o 16 4.60094e+00 5.73778e-01 9.03122e+01 181.045 -1.08095e+00 -1.97140e-02 0.00000e+00 0.00000e+00 8.60154e+00 1.045   9.89137e+01 1.045   0.4744 
1 1 1 -4  55  4  o 16 2.46042e+01 4.47508e-01 4.66024e+02 301.865 1.69872e+01  -2.73281e+01 0.00000e+00 0.00000e+00 4.40287e+02 301.865 2.57367e+01 121.865 0.9843 
1 1 1 -4  55  5  o 12 5.45694e+01 7.98559e-01 9.42382e+02 153.935 -1.40654e+02 6.88001e+01  0.00000e+00 0.00000e+00 1.09229e+03 153.935 1.49904e+02 153.935 0.9968 
1 1 1 -4  55  6  o 1  1.85190e+01 4.09327e-01 2.86251e+02 253.370 -5.28177e+00 -1.76831e+01 0.00000e+00 0.00000e+00 3.87089e+02 253.370 1.00837e+02 253.370 0.9725 
1 1 1 -4  55  7  o 13 2.18293e+01 4.34869e-01 3.63561e+02 201.818 -3.26194e+01 -1.30584e+01 0.00000e+00 0.00000e+00 4.40423e+02 201.818 7.68625e+01 201.818 0.9857 
1 1 1 -4  55  8  o 18 9.57470e+00 4.43138e-01 2.13982e+02 61.606  5.89425e+00  1.09037e+01  0.00000e+00 0.00000e+00 1.28825e+02 61.606  8.51571e+01 241.606 0.9588 
1 1 1 -4  55  9  o 5  1.15254e+01 4.42291e-01 2.16419e+02 226.683 -1.23019e+01 -1.30466e+01 0.00000e+00 0.00000e+00 2.01509e+02 226.683 1.49098e+01 46.683  0.9717 
1 1 1 -4  55  10 o 7  6.06958e+00 7.01945e-01 9.81378e+01 263.342 -5.78794e-01 -4.95878e+00 0.00000e+00 0.00000e+00 1.04025e+02 263.342 5.88729e+00 263.342 0.8932 
1 1 1 -4  55  11 o 8  1.78288e+01 5.89872e-01 2.78099e+02 87.512  2.08583e+00  4.80002e+01  0.00000e+00 0.00000e+00 3.79248e+02 87.512  1.01149e+02 87.512  0.9895 
1 1 1 -4  55  12 o 3  1.25425e+01 6.64663e-01 2.25303e+02 308.338 2.17292e+01  -2.74768e+01 0.00000e+00 0.00000e+00 2.34913e+02 308.338 9.60944e+00 308.338 0.9856 
1 1 1 -4  55  13 o 5  5.91713e+00 8.86004e-01 9.06021e+01 181.386 -6.66116e+00 -1.61143e-01 0.00000e+00 0.00000e+00 1.12214e+02 181.386 2.16119e+01 181.386 0.9216 
1 1 1 -4  55  14 o 9  8.70682e+00 8.28135e-01 1.19782e+02 107.371 -4.60043e+00 1.47058e+01  0.00000e+00 0.00000e+00 1.93053e+02 107.371 7.32713e+01 107.371 0.9670 
1 1 1 -4  55  15 o 12 4.13352e+00 1.03295e+00 6.63988e+01 333.933 3.82513e+00  -1.87114e+00 0.00000e+00 0.00000e+00 6.75072e+01 333.933 1.10835e+00 333.933 0.8728 
1 1 1 -4  55  16 f 0  8.10093e+00 1.67081e+00 1.47727e+02 124.258 -7.23757e+00 1.06268e+01  0.00000e+00 0.00000e+00 1.40701e+02 124.258 7.02619e+00 304.258 0.9603 
1 1 1 -4  55  17 o 15 4.07013e+00 1.37609e+00 6.50346e+01 258.621 -7.47191e-01 -3.71261e+00 0.00000e+00 0.00000e+00 6.38102e+01 258.621 1.22444e+00 78.621  0.8548 
1 1 1 -4  56  1  f 0  1.90365e+01 4.12070e-01 3.76492e+02 297.715 8.96890e+00  -1.70726e+01 0.00000e+00 0.00000e+00 3.17716e+02 297.715 5.87757e+01 117.715 0.9737 
1 1 1 -4  56  2  o 14 4.13147e+01 6.33584e-01 6.15307e+02 101.199 -1.28153e+01 6.47303e+01  0.00000e+00 0.00000e+00 9.19829e+02 101.199 3.04523e+02 101.199 0.9924 
1 1 1 -4  56  3  o 1  2.72076e+01 4.76591e-01 5.39397e+02 235.068 -2.30604e+01 -3.30167e+01 0.00000e+00 0.00000e+00 4.66265e+02 235.068 7.31319e+01 55.068  0.9875 
1 1 1 -4  56  4  o 3  1.54590e+01 3.90223e-01 1.27983e+02 308.270 3.54144e+00  -4.48899e+00 0.00000e+00 0.00000e+00 3.97067e+02 308.270 2.69084e+02 308.270 0.9077 
1 1 1 -4  56  5  o 6  1.88515e+01 4.49513e-01 2.95089e+02 203.667 -1.63633e+01 -7.17178e+00 0.00000e+00 0.00000e+00 3.89929e+02 203.667 9.48397e+01 203.667 0.9716 
1 1 1 -4  56  6  o 19 2.74356e+01 4.80585e-01 3.80600e+02 341.252 3.88528e+01  -1.31871e+01 0.00000e+00 0.00000e+00 6.32400e+02 341.252 2.51800e+02 341.252 0.9877 
1 1 1 -4  56  7  f 0  7.15013e+00 4.94516e-01 1.29625e+02 128.750 -2.82620e+00 3.52140e+00  0.00000e+00 0.00000e+00 1.05659e+02 128.750 2.39661e+01 308.750 0.8808 
1 1 1 -4  56  8  o 18 1.02336e+01 4.34183e-01 1.66401e+02 120.256 -4.97030e+00 8.52051e+00  0.00000e+00 0.00000e+00 1.95774e+02 120.256 2.93729e+01 120.256 0.9479 
1 1 1 -4  56  9  o 8  2.86335e+01 5.98140e-01 5.05149e+02 358.546 1.07125e+02  -2.71951e+00 0.00000e+00 0.00000e+00 5.58223e+02 358.546 5.30742e+01 358.546 0.9953 
1 1 1 -4  56  10 o 8  7.79948e+00 7.17075e-01 8.85988e+01 164.782 -5.62876e+00 1.53119e+00  0.00000e+00 0.00000e+00 1.75936e+02 164.782 8.73373e+01 164.782 0.9097 
1 1 1 -4  56  11 o 12 4.16711e+00 8.85589e-01 7.50969e+01 157.712 -2.81641e+00 1.15442e+00  0.00000e+00 0.00000e+00 5.11422e+01 157.712 2.39547e+01 337.712 0.8132 
1 1 1 -4  56  12 o 9  4.15107e+00 9.21776e-01 8.11424e+01 49.473  2.57881e+00  3.01656e+00  0.00000e+00 0.00000e+00 5.20936e+01 49.473  2.90488e+01 229.473 0.8623 
1 1 1 -4  56  13 o 13 6.85992e+00 9.14610e-01 1.16694e+02 176.506 -1.01261e+01 6.18230e-01  0.00000e+00 0.00000e+00 1.25491e+02 176.506 8.79652e+00 176.506 0.9494 
1 1 1 -4  56  14 o 3  2.77540e+00 8.69169e-01 8.41386e+01 302.360 1.88369e+00  -2.97284e+00 0.00000e+00 0.00000e+00 2.69048e+00 302.360 8.14481e+01 122.360 0.8421 
1 1 1 -4  56  15 o 8  6.08320e+00 1.10407e+00 1.23965e+02 313.262 7.97711e+00  -8.47630e+00 0.00000e+00 0.00000e+00 9.18679e+01 313.262 3.20975e+01 133.262 0.9560 
1 1 1 -4  56  16 o 17 5.89627e+00 1.63001e+00 5.47008e+01 126.518 -2.13659e+00 2.88556e+00  0.00000e+00 0.00000e+00 1.30151e+02 126.518 7.54504e+01 126.518 0.8457 
1 1 1 -4  56  17 o 10 5.75272e+00 1.72555e+00 1.61656e+02 56.309  5.76217e+00  8.64281e+00  0.00000e+00 0.00000e+00 4.08255e+01 56.309  1.20831e+02 236.309 0.9506 
1 1 1 -4  57  1  o 3  2.69208e+01 4.77980e-01 4.93480e+02 244.796 -1.47933e+01 -3.14313e+01 0.00000e+00 0.00000e+00 4.99969e+02 244.796 6.48922e+00 244.796 0.9855 
1 1 1 -4  57  2  o 16 7.54342e+00 4.89384e-01 2.31529e+02 213.358 -4.00577e+00 -2.63713e+00 0.00000e+00 0.00000e+00 1.93589e+01 213.358 2.12170e+02 33.358  0.8884 
1 1 1 -4  57  3  o 7  2.21305e+01 4.31083e-01 4.45142e+02 263.976 -3.14092e+00 -2.97659e+01 0.00000e+00 0.00000e+00 3.69124e+02 263.976 7.60188e+01 83.976  0.9832 
1 1 1 -4  57  4  o 6  1.73980e+01 4.03792e-01 3.13087e+02 263.583 -1.97159e+00 -1.75304e+01 0.00000e+00 0.00000e+00 3.19053e+02 263.583 5.96670e+00 263.583 0.9712 
1 1 1 -4  57  5  o 12 2.12346e+01 4.65102e-01 4.51971e+02 6.704   3.14729e+01  3.69958e+00  0.00000e+00 0.00000e+00 3.29447e+02 6.704   1.22523e+02 186.704 0.9841 
1 1 1 -4  57  6  o 9  2.49716e+01 5.00174e-01 5.42255e+02 168.828 -5.71690e+01 1.12912e+01  0.00000e+00 0.00000e+00 3.83028e+02 168.828 1.59228e+02 348.827 0.9914 
1 1 1 -4  57  7  o 1  1.50863e+01 4.09251e-01 3.76836e+02 80.358  4.55086e+00  2.67869e+01  0.00000e+00 0.00000e+00 1.76235e+02 80.358  2.00601e+02 260.358 0.9814 
1 1 1 -4  57  8  o 6  2.00463e+01 4.43451e-01 3.91210e+02 310.979 2.99260e+01  -3.44518e+01 0.00000e+00 0.00000e+00 3.48901e+02 310.979 4.23091e+01 130.979 0.9890 
1 1 1 -4  57  9  o 13 1.50902e+01 5.07068e-01 2.69669e+02 255.611 -7.62610e+00 -2.97245e+01 0.00000e+00 0.00000e+00 2.84037e+02 255.611 1.43680e+01 255.611 0.9836 
1 1 1 -4  57  10 o 19 1.46614e+01 5.19109e-01 2.01185e+02 51.922  1.67821e+01  2.14202e+01  0.00000e+00 0.00000e+00 3.35229e+02 51.922  1.34044e+02 51.922  0.9815 
1 1 1 -4  57  11 o 4  5.88260e+00 7.44304e-01 1.54751e+02 273.217 5.41093e-01  -9.62816e+00 0.00000e+00 0.00000e+00 5.26737e+01 273.217 1.02078e+02 93.217  0.9466 
1 1 1 -4  57  12 o 16 1.40558e+01 6.26390e-01 1.98094e+02 60.351  1.79752e+01  3.15789e+01  0.00000e+00 0.00000e+00 3.17763e+02 60.351  1.19669e+02 60.351  0.9861 
1 1 1 -4  57  13 o 3  1.21181e+01 7.09012e-01 2.14451e+02 84.692  3.41853e+00  3.67952e+01  0.00000e+00 0.00000e+00 2.29984e+02 84.692  1.55329e+01 84.692  0.9864 
1 1 1 -4  57  14 o 2  4.15956e+00 8.84008e-01 5.86030e+01 165.372 -3.69655e+00 9.64825e-01  0.00000e+00 0.00000e+00 7.36931e+01 165.372 1.50901e+01 165.372 0.8562 
1 1 1 -4  57  15 f 0  7.94116e+00 9.87331e-01 8.64210e+01 353.879 1.07009e+01  -1.14749e+00 0.00000e+00 0.00000e+00 1.94204e+02 353.879 1.07783e+02 353.879 0.9523 
1 1 1 -4  57  16 o 16 4.02977e+00 1.26972e+00 5.19391e+01 59.951  1.56058e+00  2.69762e+00  0.00000e+00 0.00000e+00 7.02770e+01 59.951  1.83379e+01 59.951  0.8182 
1 1 1 -4  57  17 o 3  4.11869e+00 1.39131e+00 9.19476e+01 179.189 -5.61173e+00 7.94039e-02  0.00000e+00 0.00000e+00 4.61828e+01 179.189 4.57649e+01 359.189 0.9059 
1 1 1 -4  58  1  o 19 2.48945e+01 4.60222e-01 4.89407e+02 115.060 -1.41705e+01 3.03065e+01  0.00000e+00 0.00000e+00 4.28597e+02 115.060 6.08097e+01 295.059 0.9849 
1 1 1 -4  58  2  o 18 1.28132e+01 3.94934e-01 2.88655e+02 127.488 -6.33491e+00 8.25953e+00  0.00000e+00 0.00000e+00 1.67292e+02 127.488 1.21363e+02 307.488 0.9507 
1 1 1 -4  58  3  o 5  3.47877e+01 5.59188e-01 5.47326e+02 79.137  1.02669e+01  5.35040e+01  0.00000e+00 0.00000e+00 7.42374e+02 79.137  1.95048e+02 79.137  0.9908 
1 1 1 -4  58  4  o 12 1.45710e+01 4.01588e-01 2.28733e+02 7.154   1.03121e+01  1.29426e+00  0.00000e+00 0.00000e+00 2.89363e+02 7.154   6.06304e+01 7.154   0.9506 
1 1 1 -4  58  5  f 0  3.37160e+01 5.48931e-01 3.97886e+02 296.782 2.08566e+01  -4.13209e+01 0.00000e+00 0.00000e+00 8.48998e+02 296.782 4.51112e+02 296.782 0.9891 
1 1 1 -4  58  6  o 12 2.01395e+01 4.25467e-01 3.42806e+02 89.390  3.26370e-01  3.06648e+01  0.00000e+00 0.00000e+00 3.97425e+02 89.390  5.46191e+01 89.390  0.9836 
1 1 1 -4  58  7  o 3  8.99166e+00 5.35546e-01 1.16674e+02 184.617 -5.29487e+00 -4.27575e-01 0.00000e+00 0.00000e+00 1.85620e+02 184.617 6.89456e+01 184.617 0.9002 
1 1 1 -4  58  8  o 1  1.62719e+01 5.28784e-01 2.67316e+02 344.741 2.63329e+01  -7.18347e+00 0.00000e+00 0.00000e+00 3.28809e+02 344.741 6.14923e+01 344.741 0.9815 
1 1 1 -4  58  9  o 8  2.14060e+01 5.25992e-01 3.55206e+02 152.639 -5.25938e+01 2.72163e+01  0.00000e+00 0.00000e+00 4.36470e+02 152.639 8.12632e+01 152.639 0.9915 
1 1 1 -4  58  10 o 10 1.04807e+01 5.49932e-01 1.40634e+02 12.551  1.31780e+01  2.93388e+00  0.00000e+00 0.00000e+00 2.35248e+02 12.551  9.46138e+01 12.551  0.9622 
1 1 1 -4  58  11 o 5  1.01387e+01 7.11697e-01 1.99416e+02 190.933 -2.04533e+01 -3.95109e+00 0.00000e+00 0.00000e+00 1.68997e+02 190.933 3.04193e+01 10.933  0.9757 
1 1 1 -4  58  12 o 1  5.37203e+00 9.44237e-01 1.29913e+02 9.954   8.25536e+00  1.44877e+00  0.00000e+00 0.00000e+00 5.76488e+01 9.954   7.22640e+01 189.954 0.9383 
1 1 1 -4  58  13 o 18 8.13919e+00 8.01678e-01 9.99953e+01 88.577  2.72307e-01  1.09595e+01  0.00000e+00 0.00000e+00 1.88438e+02 88.577  8.84431e+01 88.577  0.9532 
1 1 1 -4  58  14 o 4  5.35669e+00 9.44431e-01 7.62445e+01 223.093 -4.20508e+00 -3.93405e+00 0.00000e+00 0.00000e+00 1.04483e+02 223.093 2.82385e+01 223.093 0.9084 
1 1 1 -4  58  15 o 11 8.07668e+00 9.42178e-01 1.07326e+02 268.202 -4.16978e-01 -1.32823e+01 0.00000e+00 0.00000e+00 1.80818e+02 268.202 7.34927e+01 268.202 0.9616 
1 1 1 -4  58  16 o 2  6.22407e+00 1.56019e+00 7.35843e+01 178.397 -5.52539e+00 1.54663e-01  0.00000e+00 0.00000e+00 1.35009e+02 178.397 6.14250e+01 178.397 0.9043 
1 1 1 -4  58  17 o 2  4.11098e+00 1.36287e+00 1.00226e+02 34.513  5.37153e+00  3.69351e+00  0.00000e+00 0.00000e+00 3.97321e+01 34.513  6.04938e+01 214.513 0.9197 
1 1 1 -4  59  1  o 7  8.93945e+00 4.33898e-01 2.36319e+02 126.237 -3.79155e+00 5.17353e+00  0.00000e+00 0.00000e+00 7.09946e+01 126.237 1.65324e+02 306.237 0.9183 
1 1 1 -4  59  2  o 10 1.55354e+01 4.00498e-01 2.00097e+02 75.631  2.22909e+00  8.70101e+00  0.00000e+00 0.00000e+00 3.47916e+02 75.631  1.47819e+02 75.631  0.9426 
1 1 1 -4  59  3  f 0  2.49328e+01 4.61467e-01 4.28077e+02 186.164 -3.42129e+01 -3.69484e+00 0.00000e+00 0.00000e+00 4.91065e+02 186.164 6.29877e+01 186.164 0.9854 
1 1 1 -4  59  4  o 19 1.85240e+01 4.18083e-01 3.63664e+02 301.076 1.15336e+01  -1.91377e+01 0.00000e+00 0.00000e+00 3.13422e+02 301.076 5.02411e+01 121.076 0.9774 
1 1 1 -4  59  5  f 0  2.32810e+01 4.45779e-01 4.06490e+02 153.408 -3.33100e+01 1.66743e+01  0.00000e+00 0.00000e+00 4.52043e+02 153.408 4.55522e+01 153.408 0.9865 
1 1 1 -4  59  6  o 3  6.77899e+00 5.03127e-01 5.38464e+01 45.637  1.17632e+00  1.20277e+00  0.00000e+00 0.00000e+00 1.07774e+02 45.637  5.39274e+01 45.637  0.6381 
1 1 1 -4  59  7  o 5  1.12784e+01 4.82780e-01 1.85647e+02 112.578 -4.84394e+00 1.16492e+01  0.00000e+00 0.00000e+00 2.18468e+02 112.578 3.28213e+01 112.578 0.9595 
1 1 1 -4  59  8  o 15 3.64085e+00 7.83375e-01 1.27786e+01 210.290 -2.64932e-01 -1.54750e-01 0.00000e+00 0.00000e+00 7.82426e+00 210.290 4.95433e+00 30.290  0.1516 
1 1 1 -4  59  9  o 10 2.03432e+01 5.18441e-01 3.70570e+02 258.935 -1.21986e+01 -6.23802e+01 0.00000e+00 0.00000e+00 3.82121e+02 258.935 1.15508e+01 258.935 0.9921 
1 1 1 -4  59  10 o 10 2.07832e+01 4.84501e-01 3.33882e+02 284.116 1.65594e+01  -6.58475e+01 0.00000e+00 0.00000e+00 4.34910e+02 284.116 1.01029e+02 284.116 0.9926 
1 1 1 -4  59  11 o 2  7.63733e+00 7.19529e-01 1.74144e+02 111.607 -4.98893e+00 1.25959e+01  0.00000e+00 0.00000e+00 9.95389e+01 111.607 7.46049e+01 291.607 0.9624 
1 1 1 -4  59  12 o 5  1.44324e+01 6.16607e-01 2.51183e+02 340.167 4.41718e+01  -1.59316e+01 0.00000e+00 0.00000e+00 2.80017e+02 340.167 2.88341e+01 340.167 0.9893 
1 1 1 -4  59  13 o 3  7.80877e+00 7.59329e-01 1.39975e+02 66.518  6.78447e+00  1.56166e+01  0.00000e+00 0.00000e+00 1.41620e+02 66.518  1.64465e+00 66.518  0.9702 
1 1 1 -4  59  14 o 18 1.67665e+01 6.80493e-01 2.74722e+02 153.162 -7.23968e+01 3.66308e+01  0.00000e+00 0.00000e+00 3.44028e+02 153.162 6.93062e+01 153.162 0.9938 
1 1 1 -4  59  15 o 18 5.53184e+00 1.19491e+00 6.55908e+01 337.752 4.80056e+00  -1.96374e+00 0.00000e+00 0.00000e+00 1.18585e+02 337.752 5.29945e+01 337.752 0.8975 
1 1 1 -4  59  16 o 15 4.46907e+00 1.37378e+00 8.46483e+01 306.857 3.16683e+00  -4.22442e+00 0.00000e+00 0.00000e+00 6.43019e+01 306.857 2.03464e+01 126.857 0.8995 
1 1 1 -4  59  17 o 14 4.94039e+00 1.55515e+00 8.50287e+01 122.904 -3.22021e+00 4.97691e+00  0.00000e+00 0.00000e+00 8.15836e+01 122.904 3.44514e+00 302.904 0.9112 
1 1 1 -4  60  1  o 2  2.71352e+01 4.84420e-01 4.56891e+02 42.539  2.62269e+01  2.40656e+01  0.00000e+00 0.00000e+00 5.44343e+02 42.539  8.74524e+01 42.539  0.9859 
1 1 1 -4  60  2  o 16 2.06517e+01 4.85350e-01 4.46012e+02 252.677 -8.84273e+00 -2.83502e+01 0.00000e+00 0.00000e+00 3.13612e+02 252.677 1.32400e+02 72.677  0.9830 
1 1 1 -4  60  3  o 4  7.68667e+00 4.83316e-01 1.83126e+02 191.934 -4.41772e+00 -9.33739e-01 0.00000e+00 0.00000e+00 7.01254e+01 191.934 1.13000e+02 11.935  0.8808 
1 1 1 -4  60  4  o 1  2.41881e+01 4.63331e-01 4.26747e+02 357.869 3.67748e+01  -1.36836e+00 0.00000e+00 0.00000e+00 4.65327e+02 357.869 3.85802e+01 357.869 0.9863 
1 1 1 -4  60  5  o 2  1.28075e+01 4.03278e-01 2.37600e+02 239.458 -6.69514e+00 -1.13471e+01 0.00000e+00 0.00000e+00 2.22554e+02 239.458 1.50460e+01 59.458  0.9613 
1 1 1 -4  60  6  o 4  1.14697e+01 4.16568e-01 2.26646e+02 180.912 -1.27097e+01 -2.02219e-01 0.00000e+00 0.00000e+00 1.84618e+02 180.912 4.20280e+01 0.912   0.9598 
1 1 1 -4  60  7  o 11 2.34392e+01 5.87334e-01 4.30226e+02 2.713   5.73601e+01  2.71853e+00  0.00000e+00 0.00000e+00 4.37261e+02 2.713   7.03494e+00 2.713   0.9913 
1 1 1 -4  60  8  o 3  1.02021e+01 5.18085e-01 1.86003e+02 103.432 -3.13171e+00 1.31129e+01  0.00000e+00 0.00000e+00 1.80270e+02 103.432 5.73378e+00 283.432 0.9622 
1 1 1 -4  60  9  o 15 5.41369e+00 7.31845e-01 1.93946e+02 247.372 -3.36453e+00 -8.07169e+00 0.00000e+00 0.00000e+00 3.99918e+00 67.372  1.97945e+02 67.372  0.9410 
1 1 1 -4  60  10 o 13 7.96614e+00 5.86247e-01 1.23434e+02 334.902 8.63348e+00  -4.04379e+00 0.00000e+00 0.00000e+00 1.57360e+02 334.902 3.39259e+01 334.902 0.9460 
1 1 1 -4  60  11 o 1  8.84490e+00 6.71017e-01 1.49941e+02 289.651 4.98215e+00  -1.39524e+01 0.00000e+00 0.00000e+00 1.68044e+02 289.651 1.81037e+01 289.651 0.9656 
1 1 1 -4  60  12 o 1  5.31409e+00 9.65748e-01 1.50781e+02 34.642  8.04565e+00  5.55907e+00  0.00000e+00 0.00000e+00 3.64978e+01 34.642  1.14283e+02 214.642 0.9474 
1 1 1 -4  60  13 o 12 9.85349e+00 6.70815e-01 2.09661e+02 162.955 -3.13216e+01 9.60289e+00  0.00000e+00 0.00000e+00 1.50901e+02 162.955 5.87605e+01 342.955 0.9846 
1 1 1 -4  60  14 o 13 3.53283e+00 9.54621e-01 5.35512e+01 271.684 8.67039e-02  -2.94959e+00 0.00000e+00 0.00000e+00 5.22051e+01 271.684 1.34609e+00 91.684  0.8063 
1 1 1 -4  60  15 o 19 4.46080e+00 1.19778e+00 9.16396e+01 247.194 -2.23126e+00 -5.30632e+00 0.00000e+00 0.00000e+00 5.86497e+01 247.194 3.29898e+01 67.194  0.9084 
1 1 1 -4  60  16 o 19 5.21945e+00 1.18358e+00 5.76973e+01 110.020 -1.64482e+00 4.51424e+00  0.00000e+00 0.00000e+00 1.14137e+02 110.020 5.64399e+01 110.020 0.8886 
1 1 1 -4  60  17 o 5  3.83794e+00 1.29217e+00 9.02289e+01 350.275 5.99789e+00  -1.02788e+00 0.00000e+00 0.00000e+00 3.95295e+01 350.275 5.06993e+01 170.275 0.9137 
1 1 1 -4  61  1  o 5  3.01530e+01 5.16698e-01 5.16194e+02 93.840  -3.24306e+00 4.83130e+01  0.00000e+00 0.00000e+00 6.00459e+02 93.840  8.42647e+01 93.840  0.9896 
1 1 1 -4  61  2  o 15 4.02912e+01 6.71563e-01 6.51532e+02 243.173 -3.75629e+01 -7.42753e+01 0.00000e+00 0.00000e+00 8.46756e+02 243.173 1.95224e+02 243.173 0.9940 
1 1 1 -4  61  3  o 17 5.02186e+01 7.48817e-01 8.29952e+02 121.644 -7.07109e+01 1.14740e+02  0.00000e+00 0.00000e+00 1.04125e+03 121.644 2.11300e+02 121.644 0.9963 
1 1 1 -4  61  4  o 14 4.59791e+01 6.99625e-01 7.04449e+02 338.179 1.16042e+02  -4.64636e+01 0.00000e+00 0.00000e+00 1.00764e+03 338.179 3.03194e+02 338.179 0.9960 
1 1 1 -4  61  5  o 17 1.52195e+01 4.10660e-01 3.07985e+02 268.707 -4.69903e-01 -2.08129e+01 0.00000e+00 0.00000e+00 2.46932e+02 268.707 6.10532e+01 88.707  0.9757 
1 1 1 -4  61  6  o 8  9.11972e+00 5.16933e-01 2.06057e+02 302.917 5.19255e+00  -8.02112e+00 0.00000e+00 0.00000e+00 1.16226e+02 302.917 8.98306e+01 122.917 0.9461 
1 1 1 -4  61  7  o 19 2.78853e+01 5.81526e-01 4.88325e+02 28.997  6.82195e+01  3.78097e+01  0.00000e+00 0.00000e+00 5.45950e+02 28.997  5.76249e+01 28.997  0.9936 
1 1 1 -4  61  8  o 7  8.32328e+00 5.85548e-01 2.09852e+02 166.217 -1.26615e+01 3.10610e+00  0.00000e+00 0.00000e+00 8.85095e+01 166.217 1.21342e+02 346.216 0.9608 
1 1 1 -4  61  9  o 5  1.14092e+01 4.73176e-01 2.15102e+02 234.677 -1.25509e+01 -1.77114e+01 0.00000e+00 0.00000e+00 2.00340e+02 234.677 1.47625e+01 54.677  0.9767 
1 1 1 -4  61  10 o 12 1.27699e+01 5.24327e-01 2.81595e+02 175.500 -3.91252e+01 3.07913e+00  0.00000e+00 0.00000e+00 1.88039e+02 175.500 9.35557e+01 355.500 0.9872 
1 1 1 -4  61  11 o 17 6.85747e+00 7.34426e-01 1.31052e+02 51.961  6.71530e+00  8.58327e+00  0.00000e+00 0.00000e+00 1.12204e+02 51.961  1.88480e+01 231.961 0.9530 
1 1 1 -4  61  12 o 3  7.60916e+00 7.17114e-01 1.68232e+02 211.303 -1.52873e+01 -9.29587e+00 0.00000e+00 0.00000e+00 1.06744e+02 211.303 6.14880e+01 31.303  0.9716 
1 1 1 -4  61  13 o 1  7.46020e+00 7.90002e-01 9.09800e+01 269.420 -1.02671e-01 -1.01437e+01 0.00000e+00 0.00000e+00 1.72185e+02 269.420 8.12048e+01 269.420 0.9494 
1 1 1 -4  61  14 o 16 1.30799e+01 7.16612e-01 2.07722e+02 61.529  2.27095e+01  4.18757e+01  0.00000e+00 0.00000e+00 2.72698e+02 61.529  6.49759e+01 61.529  0.9894 
1 1 1 -4  61  15 o 14 1.25369e+01 8.36131e-01 2.36444e+02 259.392 -9.18441e+00 -4.90387e+01 0.00000e+00 0.00000e+00 2.23769e+02 259.392 1.26753e+01 79.392  0.9899 
1 1 1 -4  61  16 o 16 2.69590e+00 9.22357e-01 4.03515e+01 292.040 7.70582e-01  -1.90342e+00 0.00000e+00 0.00000e+00 3.01856e+01 292.040 1.01659e+01 112.040 0.7064 
1 1 1 -4  61  17 o 12 3.46902e+00 1.21321e+00 1.52172e+01 32.804  7.77045e-01  5.00852e-01  0.00000e+00 0.00000e+00 3.85585e+01 32.804  2.33413e+01 32.804  0.4190 
1 1 1 -4  62  1  o 14 3.90648e+01 6.16295e-01 6.54621e+02 230.290 -5.18874e+01 -6.24765e+01 0.00000e+00 0.00000e+00 7.97965e+02 230.290 1.43344e+02 230.290 0.9938 
1 1 1 -4  62  2  o 14 1.49576e+01 4.62262e-01 2.75204e+02 320.816 1.05504e+01  -8.59968e+00 0.00000e+00 0.00000e+00 2.63330e+02 320.816 1.18745e+01 140.816 0.9625 
1 1 1 -4  62  3  f 0  1.60041e+01 4.13246e-01 4.92104e+02 28.050  2.41810e+01  1.28842e+01  0.00000e+00 0.00000e+00 9.53260e+01 28.050  3.96779e+02 208.050 0.9816 
1 1 1 -4  62  4  o 5  1.44584e+01 4.15771e-01 2.61231e+02 290.871 5.82921e+00  -1.52880e+01 0.00000e+00 0.00000e+00 2.62436e+02 290.871 1.20450e+00 290.871 0.9689 
1 1 1 -4  62  5  o 12 6.48226e+00 6.19769e-01 7.79512e+01 249.089 -8.20563e-01 -2.14756e+00 0.00000e+00 0.00000e+00 1.01579e+02 249.089 2.36274e+01 249.089 0.7412 
1 1 1 -4  62  6  o 10 2.80292e+01 5.83002e-01 5.49947e+02 6.293   8.28032e+01  9.13103e+00  0.00000e+00 0.00000e+00 4.90501e+02 6.293   5.94463e+01 186.293 0.9940 
1 1 1 -4  62  7  o 16 1.54226e+01 4.85672e-01 3.05549e+02 180.284 -2.96929e+01 -1.47246e-01 0.00000e+00 0.00000e+00 2.60307e+02 180.284 4.52423e+01 0.284   0.9830 
1 1 1 -4  62  8  o 4  9.73047e+00 5.32735e-01 1.52295e+02 279.847 1.86437e+00  -1.07412e+01 0.00000e+00 0.00000e+00 1.93591e+02 279.847 4.12956e+01 279.847 0.9530 
1 1 1 -4  62  9  o 7  7.22370e+00 5.94902e-01 1.56848e+02 122.999 -5.60845e+00 8.63672e+00  0.00000e+00 0.00000e+00 9.89923e+01 122.999 5.78553e+01 302.999 0.9501 
1 1 1 -4  62  10 o 7  1.28481e+01 5.39671e-01 2.49106e+02 341.635 3.23749e+01  -1.07476e+01 0.00000e+00 0.00000e+00 2.22391e+02 341.635 2.67153e+01 161.635 0.9852 
1 1 1 -4  62  11 o 6  1.41858e+01 5.66524e-01 2.38726e+02 268.210 -1.40957e+00 -4.51127e+01 0.00000e+00 0.00000e+00 2.83360e+02 268.210 4.46337e+01 268.210 0.9889 
1 1 1 -4  62  12 o 19 1.10933e+01 6.12173e-01 1.85470e+02 337.005 2.59707e+01  -1.10211e+01 0.00000e+00 0.00000e+00 2.19668e+02 337.005 3.41978e+01 337.005 0.9821 
1 1 1 -4  62  13 o 2  1.01643e+01 6.88574e-01 1.65972e+02 160.088 -2.48931e+01 9.01723e+00  0.00000e+00 0.00000e+00 2.04445e+02 160.088 3.84724e+01 160.088 0.9809 
1 1 1 -4  62  14 o 1  5.24191e+00 1.08110e+00 7.89931e+01 138.177 -4.32889e+00 3.87362e+00  0.00000e+00 0.00000e+00 9.79113e+01 138.177 1.89182e+01 138.177 0.9093 
1 1 1 -4  62  15 o 8  4.21752e+00 1.16683e+00 4.24978e+01 190.084 -2.57836e+00 -4.58554e-01 0.00000e+00 0.00000e+00 7.90523e+01 190.084 3.65545e+01 190.084 0.7773 
1 1 1 -4  62  16 o 19 6.89347e+00 1.11480e+00 7.80738e+01 121.364 -4.91328e+00 8.06073e+00  0.00000e+00 0.00000e+00 1.63299e+02 121.364 8.52257e+01 121.364 0.9455 
1 1 1 -4  62  17 o 7  4.87342e+00 1.45604e+00 1.32541e+02 333.484 8.72803e+00  -4.35459e+00 0.00000e+00 0.00000e+00 3.82280e+01 333.484 9.43130e+01 153.484 0.9473 
1 1 1 -4  63  1  o 13 7.75747e+00 4.87295e-01 1.87826e+02 24.929  4.72006e+00  2.19393e+00  0.00000e+00 0.00000e+00 7.27500e+01 24.929  1.15076e+02 204.929 0.8979 
1 1 1 -4  63  2  o 8  2.13363e+01 5.23826e-01 4.90492e+02 155.596 -3.29615e+01 1.49545e+01  0.00000e+00 0.00000e+00 2.96365e+02 155.596 1.94127e+02 335.596 0.9861 
1 1 1 -4  63  3  o 2  1.14029e+01 4.24803e-01 1.52681e+02 51.219  4.29553e+00  5.34617e+00  0.00000e+00 0.00000e+00 2.41206e+02 51.219  8.85252e+01 51.219  0.9239 
1 1 1 -4  63  4  o 19 2.20975e+01 4.51004e-01 3.50021e+02 78.494  6.83941e+00  3.35982e+01  0.00000e+00 0.00000e+00 4.63705e+02 78.494  1.13684e+02 78.494  0.9853 
1 1 1 -4  63  5  o 14 2.49750e+01 5.46125e-01 4.08540e+02 304.038 2.69923e+01  -3.99609e+01 0.00000e+00 0.00000e+00 5.14731e+02 304.038 1.06190e+02 304.038 0.9896 
1 1 1 -4  63  6  o 13 2.03608e+01 5.05391e-01 3.45847e+02 91.057  -7.47936e-01 4.05362e+01  0.00000e+00 0.00000e+00 4.04959e+02 91.057  5.91118e+01 91.057  0.9876 
1 1 1 -4  63  7  o 6  1.63170e+01 4.89400e-01 3.07935e+02 298.754 1.66857e+01  -3.04095e+01 0.00000e+00 0.00000e+00 2.92134e+02 298.754 1.58010e+01 118.754 0.9855 
1 1 1 -4  63  8  o 1  6.98578e+00 6.14296e-01 2.24819e+02 75.609  3.24120e+00  1.26318e+01  0.00000e+00 0.00000e+00 2.55153e+01 75.609  1.99304e+02 255.609 0.9609 
1 1 1 -4  63  9  o 19 1.15086e+01 5.66337e-01 1.75222e+02 110.109 -6.32682e+00 1.72800e+01  0.00000e+00 0.00000e+00 2.41871e+02 110.109 6.66493e+01 110.109 0.9724 
1 1 1 -4  63  10 o 19 5.88045e+00 7.16469e-01 1.49249e+02 311.113 5.94568e+00  -6.81254e+00 0.00000e+00 0.00000e+00 5.72582e+01 311.113 9.19908e+01 131.113 0.9430 
1 1 1 -4  63  11 o 2  8.61445e+00 6.18107e-01 1.36164e+02 165.521 -1.40144e+01 3.61894e+00  0.00000e+00 0.00000e+00 1.73114e+02 165.521 3.69496e+01 165.521 0.9648 
1 1 1 -4  63  12 o 1  2.60907e+00 8.04393e-01 6.86331e+01 243.657 -1.11400e+00 -2.24978e+00 0.00000e+00 0.00000e+00 5.68482e+00 243.657 6.29482e+01 63.657  0.7661 
1 1 1 -4  63  13 o 2  3.87976e+00 9.58355e-01 6.98304e+01 89.937  4.28085e-03  3.90513e+00  0.00000e+00 0.00000e+00 5.40752e+01 89.937  1.57551e+01 269.937 0.8598 
1 1 1 -4  63  14 o 4  3.46880e+00 1.01149e+00 3.06770e+01 162.316 -1.59144e+00 5.07394e-01  0.00000e+00 0.00000e+00 5.11279e+01 162.316 2.04510e+01 162.316 0.6355 
1 1 1 -4  63  15 f 0  8.23825e+00 1.12179e+00 1.50672e+02 96.638  -2.22037e+00 1.90791e+01  0.00000e+00 0.00000e+00 1.46658e+02 96.638  4.01379e+00 276.638 0.9736 
1 1 1 -4  63  16 o 9  5.97938e+00 1.25469e+00 1.11825e+02 322.509 8.42919e+00  -6.46590e+00 0.00000e+00 0.00000e+00 9.88901e+01 322.509 1.29348e+01 142.509 0.9517 
1 1 1 -4  63  17 o 12 3.59503e+00 1.20574e+00 3.62926e+01 357.984 2.46698e+00  -8.68557e-02 0.00000e+00 0.00000e+00 6.49626e+01 357.984 2.86700e+01 357.984 0.7615 
1 1 1 -4  64  1  o 17 8.46580e+00 5.43167e-01 7.13575e+01 31.961  1.76657e+00  1.10219e+00  0.00000e+00 0.00000e+00 1.53717e+02 31.961  8.23593e+01 31.961  0.7108 
1 1 1 -4  64  2  o 17 1.27531e+01 4.66339e-01 2.53396e+02 132.321 -8.55423e+00 9.39408e+00  0.00000e+00 0.00000e+00 2.04306e+02 132.321 4.90904e+01 312.321 0.9598 
1 1 1 -4  64  3  o 2  2.54892e+01 4.75941e-01 4.55209e+02 82.070  6.88069e+00  4.93982e+01  0.00000e+00 0.00000e+00 4.88000e+02 82.070  3.27911e+01 82.070  0.9899 
1 1 1 -4  64  4  o 18 6.84909e+00 5.95052e-01 1.48097e+02 273.394 2.74216e-01  -4.62303e+00 0.00000e+00 0.00000e+00 7.81609e+01 273.394 6.99357e+01 93.395  0.8841 
1 1 1 -4  64  5  o 15 1.24764e+01 4.94025e-01 1.92115e+02 189.528 -1.20145e+01 -2.01660e+00 0.00000e+00 0.00000e+00 2.54331e+02 189.528 6.22164e+01 189.528 0.9580 
1 1 1 -4  64  6  o 17 9.51204e+00 5.95603e-01 1.73087e+02 111.552 -3.46082e+00 8.76241e+00  0.00000e+00 0.00000e+00 1.62606e+02 111.552 1.04814e+01 291.552 0.9453 
1 1 1 -4  64  7  o 5  1.25568e+01 5.16836e-01 3.20506e+02 298.799 1.45586e+01  -2.64833e+01 0.00000e+00 0.00000e+00 1.40187e+02 298.799 1.80320e+02 118.799 0.9833 
1 1 1 -4  64  8  o 7  1.03559e+01 5.13562e-01 2.13136e+02 142.218 -1.38661e+01 1.07485e+01  0.00000e+00 0.00000e+00 1.61844e+02 142.218 5.12918e+01 322.218 0.9711 
1 1 1 -4  64  9  o 7  1.12278e+01 5.16568e-01 2.18606e+02 231.586 -1.48184e+01 -1.86868e+01 0.00000e+00 0.00000e+00 1.90905e+02 231.586 2.77006e+01 51.586  0.9788 
1 1 1 -4  64  10 f 0  6.81096e+00 6.65194e-01 6.71056e+01 227.339 -3.41026e+00 -3.70068e+00 0.00000e+00 0.00000e+00 1.59651e+02 227.339 9.25458e+01 227.339 0.8941 
1 1 1 -4  64  11 o 6  1.07033e+01 5.42358e-01 1.51314e+02 294.901 9.44540e+00  -2.03472e+01 0.00000e+00 0.00000e+00 2.37924e+02 294.901 8.66094e+01 294.901 0.9775 
1 1 1 -4  64  12 o 9  5.47589e+00 8.76859e-01 1.11945e+02 51.576  5.05375e+00  6.37068e+00  0.00000e+00 0.00000e+00 7.86499e+01 51.576  3.32951e+01 231.576 0.9363 
1 1 1 -4  64  13 o 5  5.95767e+00 8.83898e-01 1.45412e+02 125.222 -7.82913e+00 1.10896e+01  0.00000e+00 0.00000e+00 6.75361e+01 125.222 7.78756e+01 305.222 0.9624 
1 1 1 -4  64  14 o 12 4.90507e+00 1.07133e+00 1.00212e+02 353.237 7.29557e+00  -8.65212e-01 0.00000e+00 0.00000e+00 6.88942e+01 353.237 3.13175e+01 173.237 0.9292 
1 1 1 -4  64  15 o 14 3.07532e+00 9.89305e-01 5.97139e+01 100.933 -5.93158e-01 3.07065e+00  0.00000e+00 0.00000e+00 3.36346e+01 100.933 2.60793e+01 280.933 0.8190 
1 1 1 -4  64  16 o 18 4.51090e+00 1.24654e+00 5.76000e+01 142.951 -3.28791e+00 2.48199e+00  0.00000e+00 0.00000e+00 8.73535e+01 142.951 2.97535e+01 142.951 0.8680 
1 1 1 -4  64  17 o 9  5.84595e+00 1.66258e+00 1.26826e+02 242.473 -4.41252e+00 -8.46679e+00 0.00000e+00 0.00000e+00 7.76957e+01 242.473 4.91305e+01 62.473  0.9461 
1 1 1 -4  65  1  o 19 1.88432e+01 4.32826e-01 2.17490e+02 157.275 -1.63997e+01 6.86855e+00  0.00000e+00 0.00000e+00 4.67050e+02 157.275 2.49561e+02 157.275 0.9715 
1 1 1 -4  65  2  o 2  1.74291e+01 4.90072e-01 3.64958e+02 28.536  2.40124e+01  1.30575e+01  0.00000e+00 0.00000e+00 2.74613e+02 28.536  9.03453e+01 208.536 0.9815 
1 1 1 -4  65  3  o 18 1.74131e+01 4.88940e-01 3.68887e+02 168.746 -2.77816e+01 5.52798e+00  0.00000e+00 0.00000e+00 2.70324e+02 168.746 9.85634e+01 348.746 0.9822 
1 1 1 -4  65  4  o 15 2.20731e+01 5.80792e-01 3.93053e+02 226.268 -2.82694e+01 -2.95494e+01 0.00000e+00 0.00000e+00 4.21457e+02 226.268 2.84038e+01 226.268 0.9877 
1 1 1 -4  65  5  o 13 1.84726e+01 5.01798e-01 2.55782e+02 353.599 2.82111e+01  -3.16497e+00 0.00000e+00 0.00000e+00 4.21799e+02 353.599 1.66018e+02 353.599 0.9822 
1 1 1 -4  65  6  o 19 1.24204e+01 4.90950e-01 1.64963e+02 216.713 -1.03500e+01 -7.71841e+00 0.00000e+00 0.00000e+00 2.80301e+02 216.713 1.15338e+02 216.713 0.9605 
1 1 1 -4  65  7  o 15 2.33875e+01 5.26628e-01 4.64297e+02 256.581 -1.89513e+01 -7.94339e+01 0.00000e+00 0.00000e+00 4.02807e+02 256.581 6.14904e+01 76.581  0.9939 
1 1 1 -4  65  8  o 9  8.88497e+00 5.34407e-01 2.24330e+02 42.210  1.29357e+01  1.17334e+01  0.00000e+00 0.00000e+00 9.72873e+01 42.210  1.27043e+02 222.210 0.9709 
1 1 1 -4  65  9  o 7  7.25627e+00 6.01443e-01 1.56852e+02 152.357 -9.75646e+00 5.10992e+00  0.00000e+00 0.00000e+00 1.00907e+02 152.357 5.59444e+01 332.357 0.9535 
1 1 1 -4  65  10 o 5  1.05477e+01 5.18453e-01 2.31423e+02 303.349 1.55889e+01  -2.36880e+01 0.00000e+00 0.00000e+00 1.54265e+02 303.349 7.71585e+01 123.349 0.9822 
1 1 1 -4  65  11 o 15 1.48486e+01 5.21255e-01 2.72110e+02 61.843  2.72372e+01  5.08886e+01  0.00000e+00 0.00000e+00 2.75430e+02 61.843  3.32023e+00 61.843  0.9913 
1 1 1 -4  65  12 o 5  7.51025e+00 7.64962e-01 1.55121e+02 203.247 -1.66390e+01 -7.14752e+00 0.00000e+00 0.00000e+00 1.16189e+02 203.247 3.89319e+01 23.247  0.9720 
1 1 1 -4  65  13 o 5  5.93162e+00 9.82757e-01 8.11124e+01 288.877 2.15178e+00  -6.29295e+00 0.00000e+00 0.00000e+00 1.21832e+02 288.877 4.07196e+01 288.877 0.9214 
1 1 1 -4  65  14 o 2  6.96963e+00 1.00884e+00 1.02424e+02 71.188  3.63560e+00  1.06719e+01  0.00000e+00 0.00000e+00 1.44372e+02 71.188  4.19482e+01 71.188  0.9546 
1 1 1 -4  65  15 o 19 5.55154e+00 1.24810e+00 5.15351e+01 43.219  3.15108e+00  2.96106e+00  0.00000e+00 0.00000e+00 1.28455e+02 43.219  7.69200e+01 43.219  0.8749 
1 1 1 -4  65  16 o 6  7.59398e+00 1.23743e+00 1.37296e+02 271.866 5.65531e-01  -1.73616e+01 0.00000e+00 0.00000e+00 1.35585e+02 271.866 1.71062e+00 91.866  0.9708 
1 1 1 -4  65  17 o 12 4.09231e+00 1.32890e+00 3.07212e+01 312.247 1.45532e+00  -1.60232e+00 0.00000e+00 0.00000e+00 7.86751e+01 312.247 4.79539e+01 312.247 0.7230 
1 1 1 -4  66  1  o 1  1.60929e+01 4.21928e-01 2.04375e+02 348.211 1.38665e+01  -2.89405e+00 0.00000e+00 0.00000e+00 3.75677e+02 348.211 1.71303e+02 348.211 0.9640 
1 1 1 -4  66  2  o 16 2.72148e+01 5.51874e-01 4.94867e+02 315.614 4.22388e+01  -4.13436e+01 0.00000e+00 0.00000e+00 5.13760e+02 315.614 1.88938e+01 315.614 0.9915 
1 1 1 -4  66  3  o 14 2.44195e+01 5.45190e-01 4.92462e+02 197.162 -5.56748e+01 -1.71941e+01 0.00000e+00 0.00000e+00 4.12173e+02 197.162 8.02896e+01 17.162  0.9914 
1 1 1 -4  66  4  o 8  1.40971e+01 5.32223e-01 2.50405e+02 9.721   1.76281e+01  3.01989e+00  0.00000e+00 0.00000e+00 2.61233e+02 9.721   1.08283e+01 9.721   0.9716 
1 1 1 -4  66  5  o 4  4.71073e+00 7.17737e-01 3.03172e+01 69.753  2.76028e-01  7.48311e-01  0.00000e+00 0.00000e+00 3.47811e+01 69.753  4.46398e+00 69.753  0.3701 
1 1 1 -4  66  6  o 7  6.60278e+00 5.33027e-01 1.19994e+02 235.730 -3.06340e+00 -4.49587e+00 0.00000e+00 0.00000e+00 1.02434e+02 235.730 1.75594e+01 55.730  0.9027 
1 1 1 -4  66  7  o 18 5.68699e+00 6.38555e-01 1.04495e+02 187.202 -4.50381e+00 -5.69152e-01 0.00000e+00 0.00000e+00 8.24795e+01 187.202 2.20152e+01 7.202   0.8815 
1 1 1 -4  66  8  f 0  9.06843e+00 5.26914e-01 2.14286e+02 158.678 -1.66753e+01 6.50865e+00  0.00000e+00 0.00000e+00 1.14157e+02 158.678 1.00129e+02 338.678 0.9717 
1 1 1 -4  66  9  o 1  1.26661e+01 5.12152e-01 2.77303e+02 315.897 2.71043e+01  -2.62683e+01 0.00000e+00 0.00000e+00 1.88208e+02 315.897 8.90948e+01 135.897 0.9867 
1 1 1 -4  66  10 o 6  9.43471e+00 5.43829e-01 1.12272e+02 238.779 -6.65155e+00 -1.09738e+01 0.00000e+00 0.00000e+00 2.24931e+02 238.779 1.12659e+02 238.779 0.9602 
1 1 1 -4  66  11 o 1  2.67136e+00 7.46211e-01 6.80717e+01 317.008 1.77319e+00  -1.65308e+00 0.00000e+00 0.00000e+00 7.08868e+00 317.008 6.09830e+01 137.008 0.7565 
1 1 1 -4  66  12 o 10 1.43693e+01 6.20149e-01 2.43919e+02 60.342  2.80547e+01  4.92684e+01  0.00000e+00 0.00000e+00 2.85313e+02 60.342  4.13946e+01 60.342  0.9911 
1 1 1 -4  66  13 o 3  6.66426e+00 9.06046e-01 1.83372e+02 250.409 -6.08838e+00 -1.71068e+01 0.00000e+00 0.00000e+00 5.71292e+01 250.409 1.26243e+02 70.409  0.9721 
1 1 1 -4  66  14 o 1  4.03606e+00 1.09995e+00 1.02999e+02 12.880  6.15153e+00  1.40663e+00  0.00000e+00 0.00000e+00 3.42582e+01 12.880  6.87409e+01 192.880 0.9169 
1 1 1 -4  66  15 o 9  9.83192e+00 1.10256e+00 2.10288e+02 359.766 3.42791e+01  -1.39898e-01 0.00000e+00 0.00000e+00 1.48632e+02 359.766 6.16559e+01 179.766 0.9853 
1 1 1 -4  66  16 o 3  4.68729e+00 1.23600e+00 1.11347e+02 189.145 -9.02912e+00 -1.45351e+00 0.00000e+00 0.00000e+00 5.23465e+01 189.145 5.90009e+01 9.145   0.9436 
1 1 1 -4  66  17 o 11 3.47962e+00 1.07740e+00 2.03900e+01 263.476 -1.85503e-01 -1.62202e+00 0.00000e+00 0.00000e+00 6.02903e+01 263.476 3.99003e+01 263.476 0.6272 
1 1 1 -4  67  1  o 15 4.64080e+00 6.64706e-01 7.49033e+01 199.090 -1.49167e+00 -5.16254e-01 0.00000e+00 0.00000e+00 3.17782e+01 199.090 4.31251e+01 19.090  0.6149 
1 1 1 -4  67  2  o 5  3.90684e+01 7.28959e-01 5.60410e+02 309.277 6.57951e+01  -8.04503e+01 0.00000e+00 0.00000e+00 8.92631e+02 309.277 3.32221e+02 309.277 0.9952 
1 1 1 -4  67  3  o 19 8.65257e+00 5.42829e-01 1.25814e+02 327.761 4.34197e+00  -2.73840e+00 0.00000e+00 0.00000e+00 1.63958e+02 327.761 3.81445e+01 327.761 0.8964 
1 1 1 -4  67  4  o 6  2.63668e+01 6.26838e-01 5.13475e+02 42.491  5.90601e+01  5.41016e+01  0.00000e+00 0.00000e+00 4.65072e+02 42.491  4.84027e+01 222.491 0.9937 
1 1 1 -4  67  5  o 17 7.49272e+00 6.08082e-01 1.83707e+02 258.791 -1.62880e+00 -8.21902e+00 0.00000e+00 0.00000e+00 7.87359e+01 258.791 1.04971e+02 78.791  0.9383 
1 1 1 -4  67  6  o 2  2.41090e+01 5.34132e-01 3.47425e+02 103.219 -1.43478e+01 6.10820e+01  0.00000e+00 0.00000e+00 5.44930e+02 103.219 1.97505e+02 103.219 0.9920 
1 1 1 -4  67  7  o 12 2.07149e+01 5.09531e-01 4.30773e+02 243.878 -3.13404e+01 -6.39108e+01 0.00000e+00 0.00000e+00 3.36264e+02 243.878 9.45091e+01 63.878  0.9930 
1 1 1 -4  67  8  o 9  1.05337e+01 5.25173e-01 1.30599e+02 53.035  7.60713e+00  1.01080e+01  0.00000e+00 0.00000e+00 2.46122e+02 53.035  1.15522e+02 53.035  0.9596 
1 1 1 -4  67  9  o 16 1.18773e+01 4.70446e-01 1.65098e+02 272.137 8.28837e-01  -2.22090e+01 0.00000e+00 0.00000e+00 2.67174e+02 272.137 1.02076e+02 272.137 0.9772 
1 1 1 -4  67  10 o 11 1.51030e+01 4.87655e-01 2.65353e+02 176.514 -5.44377e+01 3.31575e+00  0.00000e+00 0.00000e+00 2.91529e+02 176.514 2.61759e+01 176.514 0.9908 
1 1 1 -4  67  11 o 3  5.39739e+00 7.72231e-01 1.26374e+02 25.131  8.02871e+00  3.76627e+00  0.00000e+00 0.00000e+00 6.26491e+01 25.131  6.37252e+01 205.131 0.9418 
1 1 1 -4  67  12 o 1  4.69996e+00 9.33367e-01 1.05587e+02 119.155 -3.38163e+00 6.06189e+00  0.00000e+00 0.00000e+00 5.59120e+01 119.155 4.96750e+01 299.155 0.9249 
1 1 1 -4  67  13 o 11 4.74130e+00 1.04761e+00 5.90150e+01 230.233 -2.64627e+00 -3.17983e+00 0.00000e+00 0.00000e+00 9.38483e+01 230.233 3.48333e+01 230.233 0.8686 
1 1 1 -4  67  14 o 19 1.00418e+01 8.72158e-01 1.45576e+02 11.696  2.44684e+01  5.06554e+00  0.00000e+00 0.00000e+00 2.19266e+02 11.696  7.36905e+01 11.696  0.9798 
1 1 1 -4  67  15 o 15 5.74817e+00 1.24927e+00 4.41646e+01 228.224 -2.68115e+00 -3.00128e+00 0.00000e+00 0.00000e+00 1.39905e+02 228.224 9.57404e+01 228.224 0.8645 
1 1 1 -4  67  16 o 19 6.67629e+00 1.33983e+00 1.44575e+02 217.202 -1.26121e+01 -9.57379e+00 0.00000e+00 0.00000e+00 9.45305e+01 217.202 5.00442e+01 37.202  0.9679 
1 1 1 -4  68  1  o 8  1.78641e+01 5.02438e-01 3.31738e+02 244.164 -1.25431e+01 -2.59050e+01 0.00000e+00 0.00000e+00 3.24229e+02 244.164 7.50940e+00 64.164  0.9825 
1 1 1 -4  68  2  o 15 1.33719e+01 4.92837e-01 2.29663e+02 241.634 -6.91508e+00 -1.28071e+01 0.00000e+00 0.00000e+00 2.52505e+02 241.634 2.28416e+01 241.634 0.9650 
1 1 1 -4  68  3  o 13 5.05267e+00 6.93776e-01 7.35674e+01 214.665 -1.63122e+00 -1.12804e+00 0.00000e+00 0.00000e+00 5.76061e+01 214.665 1.59613e+01 34.665  0.6950 
1 1 1 -4  68  4  f 0  9.12881e+00 5.77775e-01 1.46333e+02 21.685  7.06650e+00  2.80994e+00  0.00000e+00 0.00000e+00 1.71261e+02 21.685  2.49281e+01 21.685  0.9317 
1 1 1 -4  68  5  o 8  1.50556e+01 5.32399e-01 1.89166e+02 276.201 2.11900e+00  -1.95014e+01 0.00000e+00 0.00000e+00 3.58246e+02 276.201 1.69080e+02 276.201 0.9742 
1 1 1 -4  68  6  o 19 2.70452e+00 7.36562e-01 9.58804e+01 73.885  5.21824e-01  1.80610e+00  0.00000e+00 0.00000e+00 2.75719e+01 253.885 1.23452e+02 253.885 0.6770 
1 1 1 -4  68  7  o 18 9.91984e+00 5.00034e-01 2.64985e+02 201.118 -2.13298e+01 -8.23834e+00 0.00000e+00 0.00000e+00 9.66880e+01 201.118 1.68297e+02 21.118  0.9779 
1 1 1 -4  68  8  o 3  6.39627e+00 6.33017e-01 1.57624e+02 214.232 -8.01502e+00 -5.45353e+00 0.00000e+00 0.00000e+00 6.80589e+01 214.232 8.95654e+01 34.232  0.9469 
1 1 1 -4  68  9  o 5  5.28291e+00 7.10598e-01 1.00292e+02 231.211 -3.61436e+00 -4.49717e+00 0.00000e+00 0.00000e+00 7.84462e+01 231.211 2.18455e+01 51.211  0.9086 
1 1 1 -4  68  10 o 18 1.12811e+01 5.83294e-01 1.86267e+02 249.686 -9.08694e+00 -2.45464e+01 0.00000e+00 0.00000e+00 2.25383e+02 249.686 3.91163e+01 249.686 0.9807 
1 1 1 -4  68  11 o 10 4.20062e+00 9.04818e-01 7.17377e+01 27.339  3.40616e+00  1.76100e+00  0.00000e+00 0.00000e+00 6.20768e+01 27.339  9.66089e+00 207.339 0.8568 
1 1 1 -4  68  12 o 9  4.82160e+00 9.21494e-01 6.41974e+01 303.256 2.40096e+00  -3.66121e+00 0.00000e+00 0.00000e+00 9.28125e+01 303.256 2.86151e+01 303.256 0.8766 
1 1 1 -4  68  13 o 2  4.45797e+00 1.04402e+00 1.10815e+02 312.049 4.98092e+00  -5.52235e+00 0.00000e+00 0.00000e+00 4.30654e+01 312.049 6.77497e+01 132.049 0.9301 
1 1 1 -4  68  14 o 19 2.77111e+00 9.06500e-01 5.34637e+01 322.700 1.91025e+00  -1.45524e+00 0.00000e+00 0.00000e+00 2.39848e+01 322.700 2.94789e+01 142.700 0.7538 
1 1 1 -4  68  15 o 10 4.05613e+00 1.15279e+00 6.18465e+01 234.364 -2.37943e+00 -3.31915e+00 0.00000e+00 0.00000e+00 6.83491e+01 234.364 6.50265e+00 234.364 0.8667 
1 1 1 -4  68  16 o 6  4.78562e+00 1.28835e+00 8.31604e+01 247.214 -2.71755e+00 -6.46915e+00 0.00000e+00 0.00000e+00 8.07343e+01 247.214 2.42613e+00 67.214  0.9257 
1 1 1 -4  69  1  o 10 7.91711e+00 5.74425e-01 2.22266e+02 190.121 -8.75094e+00 -1.56211e+00 0.00000e+00 0.00000e+00 5.64073e+01 190.121 1.65858e+02 10.121  0.9420 
1 1 1 -4  69  2  o 4  6.20373e+00 6.83755e-01 1.89273e+02 16.506  6.01692e+00  1.78296e+00  0.00000e+00 0.00000e+00 2.31232e+01 16.506  1.66150e+02 196.506 0.9164 
1 1 1 -4  69  3  o 10 2.36079e+01 5.45460e-01 3.74535e+02 240.906 -2.46635e+01 -4.43220e+01 0.00000e+00 0.00000e+00 4.98411e+02 240.906 1.23877e+02 240.906 0.9901 
1 1 1 -4  69  4  o 17 7.57454e+00 5.31347e-01 1.32585e+02 298.747 2.96922e+00  -5.41288e+00 0.00000e+00 0.00000e+00 1.26151e+02 298.747 6.43394e+00 118.747 0.9150 
1 1 1 -4  69  5  f 0  1.81726e+01 4.85060e-01 4.20569e+02 250.559 -1.81701e+01 -5.14795e+01 0.00000e+00 0.00000e+00 2.51330e+02 250.559 1.69239e+02 70.559  0.9908 
1 1 1 -4  69  6  o 2  2.64010e+01 5.62248e-01 4.64950e+02 176.858 -9.48340e+01 5.20616e+00  0.00000e+00 0.00000e+00 5.14557e+02 176.858 4.96079e+01 176.858 0.9947 
1 1 1 -4  69  7  o 11 9.69781e+00 6.60398e-01 1.36455e+02 335.357 1.08114e+01  -4.95972e+00 0.00000e+00 0.00000e+00 2.09506e+02 335.357 7.30508e+01 335.357 0.9570 
1 1 1 -4  69  8  o 16 1.19782e+01 4.56425e-01 3.02168e+02 73.658  1.01293e+01  3.45461e+01  0.00000e+00 0.00000e+00 1.37829e+02 73.658  1.64339e+02 253.658 0.9860 
1 1 1 -4  69  9  o 1  9.78259e+00 5.04824e-01 1.25900e+02 115.748 -5.72541e+00 1.18709e+01  0.00000e+00 0.00000e+00 2.24192e+02 115.748 9.82926e+01 115.748 0.9613 
1 1 1 -4  69  10 o 1  1.00478e+01 5.49278e-01 2.02848e+02 17.885  2.68007e+01  8.64855e+00  0.00000e+00 0.00000e+00 1.64246e+02 17.885  3.86021e+01 197.885 0.9821 
1 1 1 -4  69  11 o 8  1.60344e+01 5.61242e-01 3.36469e+02 332.524 7.15652e+01  -3.72169e+01 0.00000e+00 0.00000e+00 2.55845e+02 332.524 8.06241e+01 152.524 0.9938 
1 1 1 -4  69  12 o 4  4.36542e+00 9.55275e-01 1.15538e+02 85.906  5.19625e-01  7.25997e+00  0.00000e+00 0.00000e+00 3.50012e+01 85.906  8.05365e+01 265.906 0.9285 
1 1 1 -4  69  13 o 1  4.23074e+00 1.04953e+00 1.02075e+02 88.093  2.04812e-01  6.15083e+00  0.00000e+00 0.00000e+00 4.15144e+01 88.093  6.05604e+01 268.093 0.9147 
1 1 1 -4  69  14 o 4  4.01206e+00 1.01069e+00 9.90737e+01 139.539 -4.86495e+00 4.14933e+00  0.00000e+00 0.00000e+00 3.74630e+01 139.539 6.16107e+01 319.539 0.9181 
1 1 1 -4  69  15 o 19 4.54475e+00 1.27249e+00 7.71473e+01 144.436 -4.48863e+00 3.20933e+00  0.00000e+00 0.00000e+00 7.50125e+01 144.436 2.13485e+00 324.436 0.9042 
1 1 1 -4  69  16 o 5  7.94800e+00 1.25903e+00 1.57820e+02 195.543 -2.04104e+01 -5.67693e+00 0.00000e+00 0.00000e+00 1.29140e+02 195.543 2.86804e+01 15.543  0.9761 
1 1 1 -4  70  1  o 3  1.67289e+01 5.01186e-01 3.33643e+02 275.387 3.15232e+00  -3.34277e+01 0.00000e+00 0.00000e+00 2.81985e+02 275.387 5.16576e+01 95.387  0.9850 
1 1 1 -4  70  2  o 9  1.62145e+01 5.02699e-01 3.28021e+02 133.073 -2.09420e+01 2.24003e+01  0.00000e+00 0.00000e+00 2.67657e+02 133.073 6.03633e+01 313.073 0.9836 
1 1 1 -4  70  3  o 18 3.06219e+01 6.21728e-01 5.64378e+02 224.723 -7.00401e+01 -6.93671e+01 0.00000e+00 0.00000e+00 5.73220e+02 224.723 8.84235e+00 224.723 0.9949 
1 1 1 -4  70  4  o 15 1.52532e+01 4.68299e-01 3.06645e+02 322.357 2.57137e+01  -1.98328e+01 0.00000e+00 0.00000e+00 2.53854e+02 322.357 5.27902e+01 142.357 0.9845 
1 1 1 -4  70  5  o 9  1.44186e+01 4.77031e-01 3.25015e+02 143.707 -2.86595e+01 2.10472e+01  0.00000e+00 0.00000e+00 2.05316e+02 143.707 1.19700e+02 323.707 0.9858 
1 1 1 -4  70  6  o 11 1.08165e+01 4.82035e-01 2.01108e+02 112.674 -6.71154e+00 1.60647e+01  0.00000e+00 0.00000e+00 1.90488e+02 112.674 1.06207e+01 292.674 0.9708 
1 1 1 -4  70  7  o 12 6.39806e+00 5.33463e-01 7.92547e+01 213.363 -3.88943e+00 -2.56097e+00 0.00000e+00 0.00000e+00 1.31723e+02 213.363 5.24685e+01 213.363 0.8848 
1 1 1 -4  70  8  o 1  9.33976e+00 4.82608e-01 1.42943e+02 89.794  5.17327e-02  1.44202e+01  0.00000e+00 0.00000e+00 1.92648e+02 89.794  4.97052e+01 89.794  0.9647 
1 1 1 -4  70  9  o 12 7.77993e+00 5.38975e-01 1.35314e+02 11.601  1.25240e+01  2.57099e+00  0.00000e+00 0.00000e+00 1.42702e+02 11.601  7.38859e+00 11.601  0.9601 
1 1 1 -4  70  10 o 1  6.73663e+00 6.80417e-01 1.25700e+02 280.324 2.06138e+00  -1.13165e+01 0.00000e+00 0.00000e+00 1.13711e+02 280.324 1.19893e+01 100.324 0.9555 
1 1 1 -4  70  11 o 5  4.24404e+00 9.07922e-01 1.33832e+02 209.958 -7.15815e+00 -4.12578e+00 0.00000e+00 0.00000e+00 1.40160e+01 209.958 1.19816e+02 29.958  0.9374 
1 1 1 -4  70  12 o 12 4.17391e+00 9.87756e-01 9.83711e+01 189.862 -5.99572e+00 -1.04227e+00 0.00000e+00 0.00000e+00 4.32352e+01 189.862 5.51359e+01 9.862   0.9137 
1 1 1 -4  70  13 o 17 9.06563e+00 8.27990e-01 1.54826e+02 121.327 -1.32867e+01 2.18295e+01  0.00000e+00 0.00000e+00 1.74842e+02 121.327 2.00159e+01 121.327 0.9802 
1 1 1 -4  70  14 o 1  3.76910e+00 1.04450e+00 9.72080e+01 266.081 -4.06711e-01 -5.93691e+00 0.00000e+00 0.00000e+00 3.01294e+01 266.081 6.70786e+01 86.081  0.9116 
1 1 1 -4  70  15 o 2  3.87507e+00 1.20128e+00 7.34551e+01 229.953 -3.02882e+00 -3.60356e+00 0.00000e+00 0.00000e+00 5.36722e+01 229.953 1.97829e+01 49.953  0.8861 
1 1 1 -4  70  16 o 9  4.02497e+00 1.26165e+00 7.81682e+01 328.095 4.72918e+00  -2.94422e+00 0.00000e+00 0.00000e+00 5.65592e+01 328.095 2.16090e+01 148.095 0.9051 
1 1 1 -4  71  1  o 16 6.41012e+00 7.17493e-01 8.35846e+01 359.979 2.99452e+00  -1.10113e-03 0.00000e+00 0.00000e+00 1.10262e+02 359.979 2.66777e+01 359.979 0.8096 
1 1 1 -4  71  2  o 10 6.40139e+00 6.43139e-01 1.72218e+02 356.603 6.25981e+00  -3.71608e-01 0.00000e+00 0.00000e+00 4.68456e+01 356.603 1.25372e+02 176.603 0.9164 
1 1 1 -4  71  3  o 11 1.89992e+01 4.86646e-01 3.48125e+02 230.641 -2.64352e+01 -3.22299e+01 0.00000e+00 0.00000e+00 3.52601e+02 230.641 4.47564e+00 230.641 0.9879 
1 1 1 -4  71  4  o 2  9.45366e+00 4.98008e-01 2.62312e+02 255.268 -4.49489e+00 -1.70948e+01 0.00000e+00 0.00000e+00 8.03547e+01 255.268 1.81958e+02 75.268  0.9713 
1 1 1 -4  71  5  o 7  2.00236e+01 5.04744e-01 3.87970e+02 49.089  3.75565e+01  4.33391e+01  0.00000e+00 0.00000e+00 3.52415e+02 49.089  3.55556e+01 229.089 0.9912 
1 1 1 -4  71  6  o 18 8.42279e+00 5.20221e-01 1.34066e+02 189.406 -9.64948e+00 -1.59846e+00 0.00000e+00 0.00000e+00 1.63452e+02 189.406 2.93865e+01 189.406 0.9474 
1 1 1 -4  71  7  o 6  5.75106e+00 6.70630e-01 8.44933e+01 274.930 3.93203e-01  -4.55891e+00 0.00000e+00 0.00000e+00 1.04631e+02 274.930 2.01379e+01 274.930 0.8825 
1 1 1 -4  71  8  f 0  1.40034e+01 4.54818e-01 3.83726e+02 331.379 5.35743e+01  -2.92349e+01 0.00000e+00 0.00000e+00 1.33466e+02 331.379 2.50261e+02 151.379 0.9918 
1 1 1 -4  71  9  o 4  4.93144e+00 7.33731e-01 5.22492e+01 244.661 -1.39564e+00 -2.94730e+00 0.00000e+00 0.00000e+00 9.96278e+01 244.661 4.73785e+01 244.661 0.8276 
1 1 1 -4  71  10 o 3  3.45634e+00 7.99766e-01 1.03599e+02 78.112  9.99082e-01  4.74585e+00  0.00000e+00 0.00000e+00 1.07648e+01 78.112  9.28342e+01 258.112 0.8898 
1 1 1 -4  71  11 o 9  5.84350e+00 8.31848e-01 1.27056e+02 80.463  1.80912e+00  1.07680e+01  0.00000e+00 0.00000e+00 7.98767e+01 80.463  4.71790e+01 260.463 0.9530 
1 1 1 -4  71  12 o 17 5.28792e+00 9.69723e-01 8.88208e+01 15.886  6.88990e+00  1.96085e+00  0.00000e+00 0.00000e+00 9.32238e+01 15.886  4.40302e+00 15.886  0.9273 
1 1 1 -4  71  13 o 16 3.75389e+00 1.01988e+00 4.02627e+01 315.886 1.70335e+00  -1.65149e+00 0.00000e+00 0.00000e+00 6.42169e+01 315.886 2.39543e+01 315.886 0.7504 
1 1 1 -4  71  14 o 11 5.12698e+00 1.14736e+00 4.00438e+01 335.710 2.92033e+00  -1.31800e+00 0.00000e+00 0.00000e+00 1.16496e+02 335.710 7.64527e+01 335.710 0.8240 
1 1 1 -4  71  15 o 9  3.25278e+00 1.07228e+00 5.24584e+01 12.138  2.97073e+00  6.38938e-01  0.00000e+00 0.00000e+00 4.54053e+01 12.138  7.05315e+00 192.138 0.8128 
1 1 1 -4  71  16 o 19 4.55202e+00 1.27448e+00 7.22107e+01 258.052 -1.18295e+00 -5.59023e+00 0.00000e+00 0.00000e+00 8.05577e+01 258.052 8.34700e+00 258.052 0.9077 
1 1 1 -4  72  1  o 5  1.31359e+01 5.33788e-01 2.34932e+02 240.856 -9.23979e+00 -1.65706e+01 0.00000e+00 0.00000e+00 2.42538e+02 240.856 7.60622e+00 240.856 0.9733 
1 1 1 -4  72  2  o 10 1.96598e+01 4.82368e-01 3.52886e+02 198.839 -4.14025e+01 -1.41264e+01 0.00000e+00 0.00000e+00 3.72711e+02 198.839 1.98255e+01 198.839 0.9885 
1 1 1 -4  72  3  o 4  2.24160e+01 5.15461e-01 3.46873e+02 253.787 -1.54773e+01 -5.32267e+01 0.00000e+00 0.00000e+00 4.82226e+02 253.787 1.35352e+02 253.787 0.9909 
1 1 1 -4  72  4  o 13 1.83653e+01 4.89138e-01 2.94529e+02 265.545 -3.18141e+00 -4.08304e+01 0.00000e+00 0.00000e+00 3.82285e+02 265.545 8.77569e+01 265.545 0.9877 
1 1 1 -4  72  5  o 7  2.14063e+01 5.18517e-01 3.35367e+02 114.752 -2.53483e+01 5.49789e+01  0.00000e+00 0.00000e+00 4.56358e+02 114.752 1.20991e+02 114.752 0.9917 
1 1 1 -4  72  6  o 12 7.04107e+00 5.05648e-01 1.46289e+02 355.454 9.50529e+00  -7.55687e-01 0.00000e+00 0.00000e+00 1.02007e+02 355.454 4.42826e+01 175.454 0.9460 
1 1 1 -4  72  7  o 18 1.41902e+01 4.48763e-01 2.62964e+02 158.960 -3.47300e+01 1.33595e+01  0.00000e+00 0.00000e+00 2.58545e+02 158.960 4.41870e+00 338.960 0.9865 
1 1 1 -4  72  8  o 9  6.64763e+00 5.85951e-01 7.19980e+01 130.943 -3.52682e+00 4.06526e+00  0.00000e+00 0.00000e+00 1.51142e+02 130.943 7.91437e+01 130.943 0.9015 
1 1 1 -4  72  9  o 18 1.08614e+01 5.05749e-01 1.20889e+02 335.395 1.61140e+01  -7.37932e+00 0.00000e+00 0.00000e+00 2.71660e+02 335.395 1.50771e+02 335.395 0.9714 
1 1 1 -4  72  10 o 12 1.58493e+01 5.16219e-01 2.92578e+02 22.347  6.05068e+01  2.48732e+01  0.00000e+00 0.00000e+00 2.92170e+02 22.347  4.07988e-01 202.347 0.9923 
1 1 1 -4  72  11 o 19 1.09987e+01 5.98280e-01 2.26223e+02 198.655 -3.80599e+01 -1.28492e+01 0.00000e+00 0.00000e+00 1.77256e+02 198.655 4.89678e+01 18.655  0.9875 
1 1 1 -4  72  12 o 16 7.40012e+00 8.44633e-01 1.69625e+02 330.515 1.67096e+01  -9.44787e+00 0.00000e+00 0.00000e+00 9.77963e+01 330.515 7.18291e+01 150.515 0.9736 
1 1 1 -4  72  13 o 6  6.03058e+00 1.01789e+00 9.17002e+01 157.371 -7.49100e+00 3.12258e+00  0.00000e+00 0.00000e+00 1.17665e+02 157.371 2.59650e+01 157.371 0.9362 
1 1 1 -4  72  14 o 4  1.19687e+01 8.97917e-01 1.46724e+02 130.856 -2.19579e+01 2.53884e+01  0.00000e+00 0.00000e+00 2.90021e+02 130.856 1.43297e+02 130.856 0.9850 
1 1 1 -4  72  15 o 9  3.53206e+00 1.14392e+00 3.73741e+01 338.134 2.19183e+00  -8.79589e-01 0.00000e+00 0.00000e+00 6.05419e+01 338.134 2.31678e+01 338.134 0.7491 
1 1 1 -4  72  16 f 0  4.81971e+00 1.35735e+00 1.03714e+02 201.429 -7.67006e+00 -3.01036e+00 0.00000e+00 0.00000e+00 6.32662e+01 201.429 4.04479e+01 21.429  0.9372 
1 1 1 -4  73  1  o 18 1.61201e+01 4.75980e-01 2.44248e+02 181.171 -2.73066e+01 -5.58259e-01 0.00000e+00 0.00000e+00 3.46536e+02 181.171 1.02287e+02 181.171 0.9815 
1 1 1 -4  73  2  o 3  6.62403e+00 6.09380e-01 1.42829e+02 221.724 -4.96401e+00 -4.42649e+00 0.00000e+00 0.00000e+00 8.50113e+01 221.724 5.78173e+01 41.724  0.9214 
1 1 1 -4  73  3  o 7  3.25070e+01 6.34055e-01 6.15546e+02 70.996  4.79576e+01  1.39247e+02  0.00000e+00 0.00000e+00 5.93418e+02 70.996  2.21275e+01 250.996 0.9966 
1 1 1 -4  73  4  o 12 2.06244e+01 5.06805e-01 4.13199e+02 182.066 -6.65497e+01 -2.40132e+00 0.00000e+00 0.00000e+00 3.50370e+02 182.066 6.28291e+01 2.067   0.9925 
1 1 1 -4  73  5  o 15 8.00046e+00 4.79550e-01 2.54155e+02 306.801 1.06403e+01  -1.42228e+01 0.00000e+00 0.00000e+00 3.56392e+01 306.801 2.18516e+02 126.801 0.9714 
1 1 1 -4  73  6  o 13 5.25883e+00 6.04221e-01 1.41193e+02 48.262  4.47883e+00  5.02020e+00  0.00000e+00 0.00000e+00 3.95814e+01 48.262  1.01611e+02 228.262 0.9224 
1 1 1 -4  73  7  o 2  6.44370e+00 5.78879e-01 1.25529e+02 191.593 -8.52980e+00 -1.74988e+00 0.00000e+00 0.00000e+00 1.00253e+02 191.593 2.52757e+01 11.593  0.9407 
1 1 1 -4  73  8  o 6  5.93007e+00 6.36825e-01 1.50494e+02 59.297  5.14162e+00  8.65852e+00  0.00000e+00 0.00000e+00 5.89880e+01 59.297  9.15063e+01 239.297 0.9490 
1 1 1 -4  73  9  o 14 4.74602e+00 7.24691e-01 8.69101e+01 90.528  -4.97008e-02 5.39160e+00  0.00000e+00 0.00000e+00 7.22928e+01 90.528  1.46172e+01 270.528 0.9017 
1 1 1 -4  73  10 o 6  1.10509e+01 5.57923e-01 2.16091e+02 193.262 -3.57061e+01 -8.41587e+00 0.00000e+00 0.00000e+00 1.89058e+02 193.262 2.70330e+01 13.262  0.9863 
1 1 1 -4  73  11 o 19 6.77331e+00 7.56652e-01 1.15279e+02 346.200 1.15680e+01  -2.84146e+00 0.00000e+00 0.00000e+00 1.25494e+02 346.200 1.02150e+01 346.200 0.9571 
1 1 1 -4  73  12 o 19 7.23894e+00 8.71126e-01 1.66827e+02 149.096 -1.68249e+01 1.00709e+01  0.00000e+00 0.00000e+00 9.48700e+01 149.096 7.19569e+01 329.096 0.9742 
1 1 1 -4  73  13 o 17 6.25158e+00 1.05387e+00 7.19645e+01 265.579 -5.33542e-01 -6.90109e+00 0.00000e+00 0.00000e+00 1.42353e+02 265.579 7.03887e+01 265.579 0.9246 
1 1 1 -4  73  14 f 0  3.83936e+00 1.12268e+00 6.54724e+01 333.558 3.75006e+00  -1.86498e+00 0.00000e+00 0.00000e+00 5.83033e+01 333.558 7.16915e+00 153.558 0.8704 
1 1 1 -4  73  15 o 16 4.79639e+00 1.33475e+00 1.02827e+02 182.961 -7.97355e+00 -4.12420e-01 0.00000e+00 0.00000e+00 6.31248e+01 182.961 3.97027e+01 2.961   0.9351 
1 1 1 -4  73  16 f 0  3.31679e+00 1.09460e+00 6.24603e+01 179.566 -4.80402e+00 3.63682e-02  0.00000e+00 0.00000e+00 4.64751e+01 179.566 1.59853e+01 359.566 0.8886 
1 1 1 -4  74  1  o 14 1.13705e+01 4.84464e-01 1.94074e+02 332.138 1.39288e+01  -7.36318e+00 0.00000e+00 0.00000e+00 2.16703e+02 332.138 2.26282e+01 332.138 0.9677 
1 1 1 -4  74  2  o 13 2.27386e+01 5.29032e-01 4.60854e+02 89.032  1.32444e+00  7.84211e+01  0.00000e+00 0.00000e+00 3.82369e+02 89.032  7.84846e+01 269.032 0.9936 
1 1 1 -4  74  3  o 10 1.44840e+01 4.70215e-01 2.75104e+02 294.107 1.20937e+01  -2.70274e+01 0.00000e+00 0.00000e+00 2.56090e+02 294.107 1.90140e+01 114.107 0.9830 
1 1 1 -4  74  4  o 8  9.66615e+00 4.86447e-01 2.36868e+02 66.650  7.68321e+00  1.77971e+01  0.00000e+00 0.00000e+00 1.14217e+02 66.650  1.22651e+02 246.650 0.9739 
1 1 1 -4  74  5  f 0  7.62195e+00 4.76634e-01 1.62958e+02 232.541 -7.04037e+00 -9.18895e+00 0.00000e+00 0.00000e+00 1.08623e+02 232.541 5.43344e+01 52.541  0.9558 
1 1 1 -4  74  6  o 11 7.30207e+00 4.93363e-01 7.14659e+01 202.426 -4.70616e+00 -1.94222e+00 0.00000e+00 0.00000e+00 1.72175e+02 202.426 1.00709e+02 202.426 0.8955 
1 1 1 -4  74  7  o 15 5.88825e+00 6.21746e-01 6.72203e+01 128.059 -2.67173e+00 3.41235e+00  0.00000e+00 0.00000e+00 1.24703e+02 128.059 5.74830e+01 128.059 0.8752 
1 1 1 -4  74  8  o 18 1.65459e+01 4.76833e-01 2.58228e+02 89.434  5.50421e-01  5.57274e+01  0.00000e+00 0.00000e+00 3.52019e+02 89.434  9.37909e+01 89.434  0.9910 
1 1 1 -4  74  9  o 3  1.60518e+01 4.90480e-01 2.85942e+02 241.192 -3.18392e+01 -5.78972e+01 0.00000e+00 0.00000e+00 3.06527e+02 241.192 2.05848e+01 241.192 0.9924 
1 1 1 -4  74  10 o 11 3.68016e+00 8.64263e-01 5.08943e+01 357.553 2.45715e+00  -1.04995e-01 0.00000e+00 0.00000e+00 5.31216e+01 357.553 2.22728e+00 357.553 0.7605 
1 1 1 -4  74  11 o 11 3.72623e+00 9.19519e-01 3.14586e+01 328.315 1.46564e+00  -9.04672e-01 0.00000e+00 0.00000e+00 5.79988e+01 328.315 2.65402e+01 328.315 0.6465 
1 1 1 -4  74  12 o 7  2.01508e+01 6.21674e-01 3.47068e+02 292.871 4.78496e+01  -1.13435e+02 0.00000e+00 0.00000e+00 3.97541e+02 292.871 5.04727e+01 292.871 0.9959 
1 1 1 -4  74  13 o 18 1.05231e+01 8.25149e-01 1.77216e+02 23.147  2.90091e+01  1.24016e+01  0.00000e+00 0.00000e+00 2.06627e+02 23.147  2.94111e+01 23.147  0.9840 
1 1 1 -4  74  14 o 13 6.52751e+00 1.20113e+00 1.57197e+02 94.039  -1.13871e+00 1.61271e+01  0.00000e+00 0.00000e+00 7.69299e+01 94.039  8.02672e+01 274.039 0.9686 
1 1 1 -4  74  15 o 17 3.38649e+00 1.08039e+00 2.21180e+01 259.997 -2.63573e-01 -1.49431e+00 0.00000e+00 0.00000e+00 5.30983e+01 259.997 3.09803e+01 259.997 0.6004 
1 1 1 -4  74  16 o 17 5.07092e+00 1.31364e+00 6.34979e+01 224.013 -4.16217e+00 -4.02125e+00 0.00000e+00 0.00000e+00 1.06818e+02 224.013 4.33199e+01 224.013 0.9089 
1 1 1 -4  75  1  o 3  6.97152e+00 6.34403e-01 2.25261e+01 322.764 9.25025e-01  -7.03052e-01 0.00000e+00 0.00000e+00 1.07787e+02 322.764 8.52612e+01 322.764 0.5008 
1 1 1 -4  75  2  o 10 1.28629e+01 4.83812e-01 2.30668e+02 23.993  2.01017e+01  8.94678e+00  0.00000e+00 0.00000e+00 2.38265e+02 23.993  7.59668e+00 23.993  0.9770 
1 1 1 -4  75  3  o 16 4.98984e+00 6.86643e-01 6.80978e+01 356.908 2.77764e+00  -1.50018e-01 0.00000e+00 0.00000e+00 7.94051e+01 356.908 1.13073e+01 356.908 0.7925 
1 1 1 -4  75  4  o 10 1.47072e+01 4.30843e-01 2.45156e+02 268.903 -6.06591e-01 -3.16839e+01 0.00000e+00 0.00000e+00 2.94533e+02 268.903 4.93762e+01 268.903 0.9841 
1 1 1 -4  75  5  o 15 6.92701e+00 5.10840e-01 1.61435e+02 170.980 -1.01850e+01 1.61683e+00  0.00000e+00 0.00000e+00 8.38944e+01 170.980 7.75404e+01 350.980 0.9502 
1 1 1 -4  75  6  o 19 5.20731e+00 6.02389e-01 7.45738e+01 356.193 3.74528e+00  -2.49207e-01 0.00000e+00 0.00000e+00 9.09654e+01 356.193 1.63916e+01 356.193 0.8533 
1 1 1 -4  75  7  o 11 4.55800e+00 7.05294e-01 1.03999e+02 18.132  4.90983e+00  1.60786e+00  0.00000e+00 0.00000e+00 4.82468e+01 18.132  5.57523e+01 198.132 0.8971 
1 1 1 -4  75  8  o 9  8.00972e+00 5.50011e-01 1.24850e+02 356.205 1.33488e+01  -8.85364e-01 0.00000e+00 0.00000e+00 1.61827e+02 356.205 3.69768e+01 356.205 0.9619 
1 1 1 -4  75  9  o 18 8.73063e+00 5.47935e-01 1.39745e+02 88.707  4.07823e-01  1.80644e+01  0.00000e+00 0.00000e+00 1.75785e+02 88.707  3.60399e+01 88.707  0.9719 
1 1 1 -4  75  10 o 11 2.58707e+00 7.84651e-01 1.00238e+02 64.420  1.72410e+00  3.60172e+00  0.00000e+00 0.00000e+00 1.72552e+01 244.420 1.17494e+02 244.420 0.8633 
1 1 1 -4  75  11 o 6  4.46904e+00 9.37547e-01 1.11970e+02 95.978  -7.93334e-01 7.57559e+00  0.00000e+00 0.00000e+00 4.26431e+01 95.978  6.93271e+01 275.978 0.9318 
1 1 1 -4  75  12 o 10 5.40118e+00 9.83451e-01 8.57843e+01 79.627  1.38820e+00  7.58388e+00  0.00000e+00 0.00000e+00 1.01088e+02 79.627  1.53037e+01 79.627  0.9327 
1 1 1 -4  75  13 o 3  9.13192e+00 8.87001e-01 1.64973e+02 116.098 -1.16854e+01 2.38554e+01  0.00000e+00 0.00000e+00 1.67032e+02 116.098 2.05886e+00 116.098 0.9810 
1 1 1 -4  75  14 o 9  8.50196e+00 1.05812e+00 1.40540e+02 214.607 -1.81274e+01 -1.25087e+01 0.00000e+00 0.00000e+00 1.67008e+02 214.607 2.64683e+01 214.607 0.9770 
1 1 1 -4  75  15 o 19 4.93783e+00 1.34374e+00 3.56650e+01 134.830 -2.08868e+00 2.10108e+00  0.00000e+00 0.00000e+00 1.11750e+02 134.830 7.60847e+01 134.830 0.8072 
1 1 1 -4  75  16 o 10 5.17040e+00 1.41850e+00 7.62015e+01 177.563 -6.88697e+00 2.93058e-01  0.00000e+00 0.00000e+00 1.00361e+02 177.563 2.41591e+01 177.563 0.9243 
1 1 1 -4  76  1  o 17 5.09874e+00 7.83252e-01 9.62318e+01 243.414 -1.63024e+00 -3.25751e+00 0.00000e+00 0.00000e+00 6.51551e+01 243.414 3.10767e+01 63.414  0.8482 
1 1 1 -4  76  2  o 7  2.40337e+01 5.43573e-01 3.58151e+02 262.729 -9.16135e+00 -7.18015e+01 0.00000e+00 0.00000e+00 5.32248e+02 262.729 1.74098e+02 262.729 0.9931 
1 1 1 -4  76  3  o 15 5.13967e+00 6.28316e-01 1.19494e+02 308.320 3.24352e+00  -4.10402e+00 0.00000e+00 0.00000e+00 5.27299e+01 308.320 6.67637e+01 128.320 0.8985 
1 1 1 -4  76  4  o 12 1.92848e+01 4.46181e-01 3.33668e+02 179.601 -6.01808e+01 4.18790e-01  0.00000e+00 0.00000e+00 3.79290e+02 179.601 4.56220e+01 179.601 0.9917 
1 1 1 -4  76  5  o 15 1.05434e+01 4.47351e-01 2.04240e+02 347.374 2.06883e+01  -4.63413e+00 0.00000e+00 0.00000e+00 1.79275e+02 347.374 2.49652e+01 167.374 0.9761 
1 1 1 -4  76  6  o 17 1.26635e+01 4.41676e-01 2.73259e+02 134.119 -2.61995e+01 2.70174e+01  0.00000e+00 0.00000e+00 1.92098e+02 134.119 8.11608e+01 314.119 0.9866 
1 1 1 -4  76  7  o 19 6.61899e+00 5.92494e-01 8.30070e+01 83.765  6.81395e-01  6.23638e+00  0.00000e+00 0.00000e+00 1.42791e+02 83.765  5.97839e+01 83.765  0.9164 
1 1 1 -4  76  8  o 5  6.24107e+00 6.02132e-01 1.42299e+02 256.682 -2.53204e+00 -1.06962e+01 0.00000e+00 0.00000e+00 7.90553e+01 256.682 6.32440e+01 76.682  0.9534 
1 1 1 -4  76  9  o 16 8.37827e+00 5.68286e-01 1.48856e+02 61.528  8.26347e+00  1.52370e+01  0.00000e+00 0.00000e+00 1.53500e+02 61.528  4.64461e+00 61.528  0.9707 
1 1 1 -4  76  10 o 7  3.23049e+00 8.06650e-01 7.96544e+01 150.737 -3.35721e+00 1.88112e+00  0.00000e+00 0.00000e+00 2.32459e+01 150.737 5.64085e+01 330.737 0.8574 
1 1 1 -4  76  11 o 8  2.98666e+00 8.62563e-01 5.57848e+01 225.130 -1.89721e+00 -1.90585e+00 0.00000e+00 0.00000e+00 3.11432e+01 225.130 2.46416e+01 45.130  0.7841 
1 1 1 -4  76  12 o 9  3.07612e+00 8.89676e-01 4.77807e+01 26.515  2.17766e+00  1.08645e+00  0.00000e+00 0.00000e+00 3.86485e+01 26.515  9.13224e+00 206.515 0.7576 
1 1 1 -4  76  13 o 6  8.25829e+00 9.94533e-01 1.67263e+02 266.774 -1.30108e+00 -2.30838e+01 0.00000e+00 0.00000e+00 1.32041e+02 266.774 3.52218e+01 86.774  0.9781 
1 1 1 -4  76  14 o 9  6.70518e+00 1.25671e+00 1.45408e+02 18.483  1.46048e+01  4.88178e+00  0.00000e+00 0.00000e+00 9.45961e+01 18.483  5.08122e+01 198.483 0.9670 
1 1 1 -4  76  15 o 18 5.26806e+00 1.41611e+00 7.54355e+01 205.727 -5.62432e+00 -2.71002e+00 0.00000e+00 0.00000e+00 1.02999e+02 205.727 2.75639e+01 205.727 0.9160 
1 1 1 -4  76  16 o 14 4.76665e+00 1.36150e+00 6.59980e+01 105.258 -1.49944e+00 5.49676e+00  0.00000e+00 0.00000e+00 9.37622e+01 105.258 2.77643e+01 105.258 0.9074 
1 1 1 -4  77  1  o 16 1.29641e+01 5.58158e-01 2.65255e+02 147.657 -2.29849e+01 1.45547e+01  0.00000e+00 0.00000e+00 2.09438e+02 147.657 5.58168e+01 327.657 0.9814 
1 1 1 -4  77  2  o 16 1.02755e+01 5.23965e-01 1.77373e+02 336.532 1.45112e+01  -6.30005e+00 0.00000e+00 0.00000e+00 1.93572e+02 336.532 1.61993e+01 336.532 0.9679 
1 1 1 -4  77  3  o 15 1.05838e+01 4.98105e-01 2.30891e+02 117.875 -1.00560e+01 1.90124e+01  0.00000e+00 0.00000e+00 1.54461e+02 117.875 7.64308e+01 297.875 0.9765 
1 1 1 -4  77  4  o 2  8.36156e+00 4.78913e-01 1.61001e+02 307.285 7.56324e+00  -9.93343e+00 0.00000e+00 0.00000e+00 1.37905e+02 307.285 2.30957e+01 127.285 0.9591 
1 1 1 -4  77  5  o 14 9.87010e+00 4.59181e-01 1.94572e+02 331.387 1.67720e+01  -9.14933e+00 0.00000e+00 0.00000e+00 1.63400e+02 331.387 3.11714e+01 151.387 0.9735 
1 1 1 -4  77  6  o 13 4.80434e+00 6.40242e-01 1.17617e+02 96.718  -6.94769e-01 5.89852e+00  0.00000e+00 0.00000e+00 4.54384e+01 96.718  7.21786e+01 276.718 0.9114 
1 1 1 -4  77  7  o 4  5.99095e+00 6.12099e-01 1.00976e+02 179.420 -7.61874e+00 7.71440e-02  0.00000e+00 0.00000e+00 1.06798e+02 179.420 5.82252e+00 179.420 0.9319 
1 1 1 -4  77  8  f 0  1.73864e+01 4.79618e-01 2.87771e+02 269.023 -1.14711e+00 -6.72536e+01 0.00000e+00 0.00000e+00 3.54082e+02 269.023 6.63108e+01 269.023 0.9925 
1 1 1 -4  77  9  o 19 5.33525e+00 7.55901e-01 9.85930e+01 68.127  2.80146e+00  6.97821e+00  0.00000e+00 0.00000e+00 8.60133e+01 68.127  1.25797e+01 248.127 0.9309 
1 1 1 -4  77  10 o 7  4.55791e+00 8.68255e-01 7.28977e+01 41.230  3.62185e+00  3.17405e+00  0.00000e+00 0.00000e+00 7.75874e+01 41.230  4.68976e+00 41.230  0.8889 
1 1 1 -4  77  11 o 4  3.19857e+00 9.10308e-01 2.65361e+01 198.575 -1.28537e+00 -4.31940e-01 0.00000e+00 0.00000e+00 3.97567e+01 198.575 1.32206e+01 198.575 0.5585 
1 1 1 -4  77  12 o 8  6.92421e+00 9.39657e-01 1.33971e+02 120.529 -7.22222e+00 1.22465e+01  0.00000e+00 0.00000e+00 1.13576e+02 120.529 2.03951e+01 300.529 0.9642 
1 1 1 -4  77  13 o 5  3.39966e+00 1.01696e+00 4.96179e+01 298.824 1.38038e+00  -2.50835e+00 0.00000e+00 0.00000e+00 5.10515e+01 298.824 1.43359e+00 298.824 0.7993 
1 1 1 -4  77  14 o 12 4.20577e+00 1.16490e+00 1.21239e+02 31.497  7.24961e+00  4.44210e+00  0.00000e+00 0.00000e+00 2.49496e+01 31.497  9.62897e+01 211.497 0.9392 
1 1 1 -4  77  15 o 11 3.13696e+00 1.06434e+00 4.21602e+01 242.996 -1.28082e+00 -2.51334e+00 0.00000e+00 0.00000e+00 5.01340e+01 242.996 7.97379e+00 242.996 0.7958 
1 1 1 -4  77  16 o 12 3.26415e+00 1.09185e+00 1.02092e+02 126.097 -4.47195e+00 6.13318e+00  0.00000e+00 0.00000e+00 1.02041e+01 126.097 9.18876e+01 306.097 0.9316 
1 1 1 -4  78  1  o 15 1.52303e+01 5.69940e-01 2.98222e+02 260.484 -6.54507e+00 -3.90432e+01 0.00000e+00 0.00000e+00 2.62653e+02 260.484 3.55692e+01 80.484  0.9873 
1 1 1 -4  78  2  o 7  1.73737e+01 5.03838e-01 3.61258e+02 324.900 4.76621e+01  -3.34974e+01 0.00000e+00 0.00000e+00 2.81036e+02 324.900 8.02218e+01 144.900 0.9914 
1 1 1 -4  78  3  o 6  8.43371e+00 5.32351e-01 2.78641e+02 51.888  1.33320e+01  1.69958e+01  0.00000e+00 0.00000e+00 2.83951e+01 51.888  2.50245e+02 231.888 0.9766 
1 1 1 -4  78  4  o 10 6.44669e+00 5.15886e-01 1.11440e+02 356.606 7.06568e+00  -4.19041e-01 0.00000e+00 0.00000e+00 1.11114e+02 356.606 3.25392e-01 176.606 0.9264 
1 1 1 -4  78  5  o 1  3.85558e+00 6.78830e-01 4.32259e+01 216.016 -1.39233e+00 -1.01220e+00 0.00000e+00 0.00000e+00 4.95916e+01 216.016 6.36572e+00 216.016 0.6463 
1 1 1 -4  78  6  o 8  1.13087e+01 4.60388e-01 1.36486e+02 107.711 -5.07803e+00 1.59006e+01  0.00000e+00 0.00000e+00 2.71729e+02 107.711 1.35243e+02 107.711 0.9696 
1 1 1 -4  78  7  o 17 5.64065e+00 6.46856e-01 9.01963e+01 193.064 -6.44403e+00 -1.49526e+00 0.00000e+00 0.00000e+00 1.03102e+02 193.064 1.29062e+01 193.064 0.9210 
1 1 1 -4  78  8  o 14 4.04082e+00 8.11259e-01 8.95882e+01 113.177 -1.85357e+00 4.32958e+00  0.00000e+00 0.00000e+00 4.35736e+01 113.177 4.60147e+01 293.177 0.8862 
1 1 1 -4  78  9  o 3  8.44783e+00 6.01565e-01 1.46627e+02 56.042  1.00220e+01  1.48817e+01  0.00000e+00 0.00000e+00 1.58427e+02 56.042  1.18003e+01 56.042  0.9717 
1 1 1 -4  78  10 o 14 6.36295e+00 7.61550e-01 1.11980e+02 167.361 -1.10232e+01 2.47179e+00  0.00000e+00 0.00000e+00 1.13587e+02 167.361 1.60705e+00 167.361 0.9547 
1 1 1 -4  78  11 o 9  8.49565e+00 7.19514e-01 1.97921e+02 97.761  -4.07058e+00 2.98665e+01  0.00000e+00 0.00000e+00 1.12027e+02 97.761  8.58945e+01 277.761 0.9833 
1 1 1 -4  78  12 o 3  1.00112e+01 7.32392e-01 1.74657e+02 322.449 2.55153e+01  -1.96146e+01 0.00000e+00 0.00000e+00 1.90663e+02 322.449 1.60063e+01 322.449 0.9843 
1 1 1 -4  78  13 o 12 3.91355e+00 1.00913e+00 8.66911e+01 218.402 -4.69348e+00 -3.72033e+00 0.00000e+00 0.00000e+00 4.55293e+01 218.402 4.11618e+01 38.402  0.9122 
1 1 1 -4  78  14 o 18 3.60513e+00 1.08140e+00 2.90456e+01 212.866 -1.64957e+00 -1.06577e+00 0.00000e+00 0.00000e+00 6.32306e+01 212.866 3.41851e+01 212.866 0.6918 
1 1 1 -4  78  15 o 19 5.43982e+00 1.25744e+00 8.31139e+01 359.767 8.10646e+00  -3.30109e-02 0.00000e+00 0.00000e+00 1.05111e+02 359.767 2.19969e+01 359.767 0.9361 
1 1 1 -4  79  1  o 18 1.36197e+01 4.98554e-01 2.72482e+02 111.097 -1.23675e+01 3.20556e+01  0.00000e+00 0.00000e+00 2.27981e+02 111.097 4.45013e+01 291.097 0.9853 
1 1 1 -4  79  2  o 4  7.75583e+00 5.58328e-01 1.76868e+02 11.164  1.23057e+01  2.42847e+00  0.00000e+00 0.00000e+00 1.00514e+02 11.164  7.63534e+01 191.164 0.9593 
1 1 1 -4  79  3  o 11 1.18660e+01 5.25597e-01 1.99576e+02 310.757 1.50185e+01  -1.74254e+01 0.00000e+00 0.00000e+00 2.32961e+02 310.757 3.33854e+01 310.757 0.9780 
1 1 1 -4  79  4  o 8  6.81630e+00 5.02057e-01 7.34626e+01 298.176 2.33076e+00  -4.35127e+00 0.00000e+00 0.00000e+00 1.53036e+02 298.176 7.95733e+01 298.176 0.8919 
1 1 1 -4  79  5  o 9  4.38787e+00 6.55519e-01 7.50410e+01 57.177  1.86985e+00  2.89894e+00  0.00000e+00 0.00000e+00 6.19653e+01 57.177  1.30757e+01 237.178 0.8384 
1 1 1 -4  79  6  o 4  5.88736e+00 6.04059e-01 1.09238e+02 247.700 -2.91795e+00 -7.11462e+00 0.00000e+00 0.00000e+00 9.51132e+01 247.700 1.41250e+01 67.700  0.9325 
1 1 1 -4  79  7  o 4  8.53477e+00 5.16190e-01 2.25432e+02 191.294 -2.38759e+01 -4.76818e+00 0.00000e+00 0.00000e+00 8.54846e+01 191.294 1.39947e+02 11.294  0.9792 
1 1 1 -4  79  8  o 11 4.61183e+00 7.78776e-01 1.10956e+02 97.010  -8.09970e-01 6.58697e+00  0.00000e+00 0.00000e+00 4.69997e+01 97.010  6.39566e+01 277.010 0.9212 
1 1 1 -4  79  9  o 18 9.31955e+00 5.89478e-01 1.57717e+02 72.163  7.31376e+00  2.27294e+01  0.00000e+00 0.00000e+00 1.81204e+02 72.163  2.34869e+01 72.163  0.9788 
1 1 1 -4  79  10 o 9  8.61500e+00 6.43892e-01 1.51417e+02 230.565 -1.45282e+01 -1.76647e+01 0.00000e+00 0.00000e+00 1.61349e+02 230.565 9.93211e+00 230.565 0.9779 
1 1 1 -4  79  11 o 15 4.18327e+00 9.63745e-01 7.44778e+01 78.674  9.13761e-01  4.56222e+00  0.00000e+00 0.00000e+00 6.28051e+01 78.674  1.16727e+01 258.674 0.8847 
1 1 1 -4  79  12 o 3  4.90342e+00 1.03919e+00 1.01137e+02 288.568 2.37491e+00  -7.07005e+00 0.00000e+00 0.00000e+00 6.79390e+01 288.568 3.31979e+01 108.568 0.9303 
1 1 1 -4  79  13 o 11 4.07644e+00 1.09504e+00 5.59818e+01 293.405 1.60725e+00  -3.71323e+00 0.00000e+00 0.00000e+00 7.46302e+01 293.405 1.86484e+01 293.405 0.8653 
1 1 1 -4  79  14 o 6  4.69939e+00 1.23621e+00 4.11986e+01 129.792 -2.17029e+00 2.60560e+00  0.00000e+00 0.00000e+00 1.03998e+02 129.792 6.27990e+01 129.792 0.8352 
1 1 1 -4  79  15 f 0  4.10734e+00 1.26847e+00 4.22583e+01 33.797  2.84596e+00  1.90500e+00  0.00000e+00 0.00000e+00 8.47959e+01 33.797  4.25376e+01 33.797  0.8371 
1 1 1 -4  80  1  o 8  1.39648e+01 5.06441e-01 2.15349e+02 152.138 -2.45157e+01 1.29596e+01  0.00000e+00 0.00000e+00 2.95841e+02 152.138 8.04915e+01 152.138 0.9818 
1 1 1 -4  80  2  f 0  6.01039e+00 6.17816e-01 2.13607e+02 256.500 -2.85521e+00 -1.18932e+01 0.00000e+00 0.00000e+00 1.06546e+00 256.500 2.12541e+02 76.500  0.9582 
1 1 1 -4  80  3  o 2  8.06198e+00 6.51970e-01 1.96813e+02 309.001 9.55675e+00  -1.18010e+01 0.00000e+00 0.00000e+00 9.35338e+01 309.001 1.03279e+02 129.001 0.9665 
1 1 1 -4  80  4  o 11 1.13466e+01 4.40939e-01 2.59766e+02 65.754  1.31554e+01  2.92099e+01  0.00000e+00 0.00000e+00 1.56233e+02 65.754  1.03533e+02 245.754 0.9843 
1 1 1 -4  80  5  o 16 5.31376e+00 6.53871e-01 1.05039e+02 300.500 3.12740e+00  -5.30924e+00 0.00000e+00 0.00000e+00 7.59516e+01 300.500 2.90870e+01 120.500 0.9148 
1 1 1 -4  80  6  o 14 1.19053e+01 4.56571e-01 1.93072e+02 224.621 -2.14013e+01 -2.11203e+01 0.00000e+00 0.00000e+00 2.42544e+02 224.621 4.94719e+01 224.621 0.9832 
1 1 1 -4  80  7  o 11 9.16689e+00 5.09829e-01 1.52045e+02 69.113  6.62840e+00  1.73702e+01  0.00000e+00 0.00000e+00 1.79603e+02 69.113  2.75581e+01 69.113  0.9727 
1 1 1 -4  80  8  o 13 1.35293e+01 5.19664e-01 2.82594e+02 5.961   5.55624e+01  5.80151e+00  0.00000e+00 0.00000e+00 2.15773e+02 5.961   6.68212e+01 185.961 0.9910 
1 1 1 -4  80  9  o 3  7.22207e+00 6.66677e-01 1.45765e+02 156.236 -1.51658e+01 6.67760e+00  0.00000e+00 0.00000e+00 1.14275e+02 156.236 3.14895e+01 336.236 0.9693 
1 1 1 -4  80  10 o 16 2.69562e+00 8.02808e-01 2.21056e+01 358.627 9.91566e-01  -2.37661e-02 0.00000e+00 0.00000e+00 2.22683e+01 358.627 1.62774e-01 358.627 0.4435 
1 1 1 -4  80  11 o 10 3.57596e+00 9.35156e-01 8.51007e+01 67.429  1.99843e+00  4.80777e+00  0.00000e+00 0.00000e+00 3.39912e+01 67.429  5.11095e+01 247.429 0.8980 
1 1 1 -4  80  12 o 10 1.20794e+01 7.21399e-01 2.20741e+02 303.427 2.83666e+01  -4.29761e+01 0.00000e+00 0.00000e+00 2.22503e+02 303.427 1.76221e+00 303.427 0.9902 
1 1 1 -4  80  13 f 0  4.33215e+00 1.14793e+00 1.24713e+02 85.426  6.99461e-01  8.74378e+00  0.00000e+00 0.00000e+00 2.62309e+01 85.426  9.84816e+01 265.426 0.9411 
1 1 1 -4  80  14 o 13 2.96461e+00 9.71975e-01 5.05676e+01 352.028 3.40386e+00  -4.76659e-01 0.00000e+00 0.00000e+00 4.12884e+01 352.028 9.27922e+00 172.028 0.8377 
1 1 1 -4  80  15 o 16 3.87578e+00 1.25289e+00 6.08123e+01 103.340 -1.06530e+00 4.49249e+00  0.00000e+00 0.00000e+00 6.57261e+01 103.340 4.91379e+00 103.340 0.8837 
1 1 1 -4  81  1  o 19 1.41793e+01 5.55846e-01 2.91280e+02 112.502 -1.54359e+01 3.72626e+01  0.00000e+00 0.00000e+00 2.30674e+02 112.502 6.06060e+01 292.502 0.9875 
1 1 1 -4  81  2  o 3  9.58055e+00 5.21979e-01 1.79821e+02 291.533 6.21704e+00  -1.57563e+01 0.00000e+00 0.00000e+00 1.66507e+02 291.533 1.33142e+01 111.533 0.9700 
1 1 1 -4  81  3  o 2  2.05117e+01 5.89432e-01 3.28121e+02 332.719 6.31596e+01  -3.25722e+01 0.00000e+00 0.00000e+00 4.30640e+02 332.719 1.02519e+02 332.719 0.9929 
1 1 1 -4  81  4  o 4  3.09888e+00 7.18419e-01 1.27384e+02 61.047  1.96588e+00  3.55344e+00  0.00000e+00 0.00000e+00 2.74631e+01 241.047 1.54847e+02 241.047 0.8658 
1 1 1 -4  81  5  o 1  6.01397e+00 6.14486e-01 7.85996e+01 279.643 8.97456e-01  -5.28187e+00 0.00000e+00 0.00000e+00 1.23119e+02 279.643 4.45198e+01 279.643 0.9011 
1 1 1 -4  81  6  o 17 2.55985e+00 6.84179e-01 1.02984e+02 30.012  2.92516e+00  1.68967e+00  0.00000e+00 0.00000e+00 2.35069e+01 210.012 1.26491e+02 210.012 0.8345 
1 1 1 -4  81  7  o 19 8.57237e+00 5.38538e-01 1.24636e+02 146.697 -1.27479e+01 8.37487e+00  0.00000e+00 0.00000e+00 1.83497e+02 146.697 5.88612e+01 146.697 0.9666 
1 1 1 -4  81  8  o 8  7.75572e+00 5.90019e-01 6.67524e+01 222.968 -5.60612e+00 -5.22197e+00 0.00000e+00 0.00000e+00 2.01940e+02 222.968 1.35188e+02 222.968 0.9322 
1 1 1 -4  81  9  o 1  4.31767e+00 8.24371e-01 8.06745e+01 131.936 -3.44666e+00 3.83645e+00  0.00000e+00 0.00000e+00 6.31403e+01 131.936 1.75341e+01 311.936 0.8969 
1 1 1 -4  81  10 o 4  8.30999e+00 6.67358e-01 1.28442e+02 58.300  9.27796e+00  1.50221e+01  0.00000e+00 0.00000e+00 1.71073e+02 58.300  4.26303e+01 58.300  0.9713 
1 1 1 -4  81  11 o 5  1.06221e+01 6.65672e-01 1.86196e+02 345.311 3.63117e+01  -9.51882e+00 0.00000e+00 0.00000e+00 2.02385e+02 345.311 1.61891e+01 345.311 0.9866 
1 1 1 -4  81  12 o 8  3.40348e+00 9.78812e-01 1.00354e+02 146.519 -4.88889e+00 3.23361e+00  0.00000e+00 0.00000e+00 1.44078e+01 146.519 8.59462e+01 326.519 0.9102 
1 1 1 -4  81  13 o 7  9.05167e+00 1.01971e+00 9.69334e+01 231.981 -1.01445e+01 -1.29755e+01 0.00000e+00 0.00000e+00 2.27764e+02 231.981 1.30831e+02 231.981 0.9692 
1 1 1 -4  81  14 o 4  7.02541e+00 1.20649e+00 1.23666e+02 163.638 -1.46927e+01 4.31381e+00  0.00000e+00 0.00000e+00 1.27481e+02 163.638 3.81570e+00 163.638 0.9668 
1 1 1 -4  81  15 o 6  4.05526e+00 1.23235e+00 1.98204e+01 90.297  -8.16329e-03 1.57561e+00  0.00000e+00 0.00000e+00 7.21949e+01 90.297  5.23745e+01 90.297  0.6143 
1 1 1 -4  82  1  o 7  2.10053e+01 5.87358e-01 3.76403e+02 80.110  1.46077e+01  8.37846e+01  0.00000e+00 0.00000e+00 4.01797e+02 80.110  2.53938e+01 80.110  0.9941 
1 1 1 -4  82  2  o 5  4.32232e+00 7.46714e-01 1.09192e+02 249.619 -1.66557e+00 -4.48324e+00 0.00000e+00 0.00000e+00 3.38267e+01 249.619 7.53655e+01 69.619  0.8881 
1 1 1 -4  82  3  f 0  4.00610e+00 7.20367e-01 7.01614e+01 25.293  2.61641e+00  1.23637e+00  0.00000e+00 0.00000e+00 4.94802e+01 25.293  2.06812e+01 205.293 0.8018 
1 1 1 -4  82  4  o 8  9.84224e+00 5.35490e-01 2.47998e+02 262.500 -3.38956e+00 -2.57456e+01 0.00000e+00 0.00000e+00 1.11326e+02 262.500 1.36672e+02 82.500  0.9806 
1 1 1 -4  82  5  o 4  3.39827e+00 7.64000e-01 5.66306e+01 291.393 8.41577e-01  -2.14823e+00 0.00000e+00 0.00000e+00 3.72477e+01 291.393 1.93829e+01 111.393 0.7423 
1 1 1 -4  82  6  o 4  8.29626e+00 5.10143e-01 1.38105e+02 341.738 1.51933e+01  -5.01349e+00 0.00000e+00 0.00000e+00 1.60692e+02 341.738 2.25866e+01 341.738 0.9682 
1 1 1 -4  82  7  f 0  8.69681e+00 5.36212e-01 4.97296e+01 178.218 -6.06906e+00 1.88862e-01  0.00000e+00 0.00000e+00 2.45612e+02 178.218 1.95883e+02 178.218 0.9135 
1 1 1 -4  82  8  o 3  1.18880e+01 5.15293e-01 2.14228e+02 57.766  2.32460e+01  3.68657e+01  0.00000e+00 0.00000e+00 2.22360e+02 57.766  8.13130e+00 57.766  0.9885 
1 1 1 -4  82  9  o 5  3.31897e+00 8.36411e-01 4.43577e+01 337.064 2.07390e+00  -8.77605e-01 0.00000e+00 0.00000e+00 4.62278e+01 337.064 1.87016e+00 337.064 0.7351 
1 1 1 -4  82  10 o 17 7.14019e+00 7.66096e-01 1.00506e+02 339.942 1.15315e+01  -4.21043e+00 0.00000e+00 0.00000e+00 1.53373e+02 339.942 5.28672e+01 339.942 0.9584 
1 1 1 -4  82  11 f 0  3.23003e+00 8.94414e-01 4.97537e+01 133.872 -1.90885e+00 1.98555e+00  0.00000e+00 0.00000e+00 4.48471e+01 133.872 4.90667e+00 313.872 0.7900 
1 1 1 -4  82  12 o 11 5.13264e+00 1.05828e+00 1.13586e+02 149.858 -8.32879e+00 4.83609e+00  0.00000e+00 0.00000e+00 6.63657e+01 149.858 4.72202e+01 329.858 0.9466 
1 1 1 -4  82  13 o 14 1.28427e+01 8.12077e-01 2.06789e+02 288.650 1.80650e+01  -5.35251e+01 0.00000e+00 0.00000e+00 2.64232e+02 288.650 5.74433e+01 288.650 0.9911 
1 1 1 -4  82  14 o 11 3.67296e+00 1.13267e+00 1.21019e+02 76.762  2.00681e+00  8.53063e+00  0.00000e+00 0.00000e+00 6.76532e+00 76.762  1.14254e+02 256.762 0.9411 
1 1 1 -4  82  15 f 0  4.90019e+00 1.30763e+00 6.64543e+01 286.353 1.74492e+00  -5.94677e+00 0.00000e+00 0.00000e+00 9.91858e+01 286.353 3.27315e+01 286.353 0.9153 
1 1 1 -4  83  1  o 10 1.52572e+01 5.55842e-01 2.12044e+02 104.252 -8.86620e+00 3.49044e+01  0.00000e+00 0.00000e+00 3.48476e+02 104.252 1.36432e+02 104.252 0.9860 
1 1 1 -4  83  2  o 1  1.08682e+01 5.76643e-01 1.69218e+02 278.973 3.06059e+00  -1.93837e+01 0.00000e+00 0.00000e+00 2.25165e+02 278.973 5.59478e+01 278.973 0.9742 
1 1 1 -4  83  3  o 10 2.40655e+00 6.90885e-01 7.33171e+00 198.702 -1.71593e-01 -5.80884e-02 0.00000e+00 0.00000e+00 7.52460e-01 198.702 6.57925e+00 18.702  0.0902 
1 1 1 -4  83  4  o 6  1.33064e+01 5.03272e-01 2.69602e+02 104.438 -1.09509e+01 4.25332e+01  0.00000e+00 0.00000e+00 2.20043e+02 104.438 4.95589e+01 284.438 0.9885 
1 1 1 -4  83  5  o 11 4.60652e+00 7.57857e-01 1.47603e+02 232.956 -5.11971e+00 -6.78315e+00 0.00000e+00 0.00000e+00 1.33711e+01 232.956 1.34232e+02 52.956  0.9392 
1 1 1 -4  83  6  o 10 1.08555e+01 4.79721e-01 2.07939e+02 17.562  3.10321e+01  9.82147e+00  0.00000e+00 0.00000e+00 1.89520e+02 17.562  1.84187e+01 197.562 0.9845 
1 1 1 -4  83  7  o 12 7.98580e+00 5.71023e-01 1.53151e+02 102.429 -4.02682e+00 1.82713e+01  0.00000e+00 0.00000e+00 1.35625e+02 102.429 1.75256e+01 282.429 0.9729 
1 1 1 -4  83  8  o 9  5.90463e+00 7.46465e-01 1.03662e+02 285.325 2.48333e+00  -9.06180e+00 0.00000e+00 0.00000e+00 1.03646e+02 285.325 1.64593e-02 105.325 0.9452 
1 1 1 -4  83  9  o 1  4.84797e+00 8.44706e-01 9.43862e+01 204.536 -6.64229e+00 -3.03206e+00 0.00000e+00 0.00000e+00 7.27504e+01 204.536 2.16358e+01 24.536  0.9288 
1 1 1 -4  83  10 o 1  7.28641e+00 7.32840e-01 9.23110e+01 77.932  2.35571e+00  1.10181e+01  0.00000e+00 0.00000e+00 1.65674e+02 77.932  7.33632e+01 77.932  0.9545 
1 1 1 -4  83  11 o 14 8.55494e+00 7.85838e-01 1.26524e+02 237.680 -1.09579e+01 -1.73201e+01 0.00000e+00 0.00000e+00 1.82713e+02 237.680 5.61886e+01 237.680 0.9753 
1 1 1 -4  83  12 o 18 7.63205e+00 9.12192e-01 1.31963e+02 339.501 1.77192e+01  -6.62452e+00 0.00000e+00 0.00000e+00 1.43084e+02 339.501 1.11207e+01 339.501 0.9732 
1 1 1 -4  83  13 o 19 4.32022e+00 1.13224e+00 4.18853e+01 99.387  -5.33097e-01 3.22462e+00  0.00000e+00 0.00000e+00 9.04610e+01 99.387  4.85757e+01 99.387  0.8280 
1 1 1 -4  83  14 o 14 4.33189e+00 1.20641e+00 4.84997e+01 131.357 -2.55264e+00 2.89983e+00  0.00000e+00 0.00000e+00 8.88811e+01 131.357 4.03814e+01 131.357 0.8581 
1 1 1 -4  83  15 o 4  3.78137e+00 1.16122e+00 5.15088e+01 220.568 -3.16256e+00 -2.70763e+00 0.00000e+00 0.00000e+00 6.98885e+01 220.568 1.83797e+01 220.568 0.8695 
1 1 1 -4  84  1  o 5  6.67996e+00 7.00447e-01 9.58645e+01 153.132 -6.23450e+00 3.15859e+00  0.00000e+00 0.00000e+00 1.34407e+02 153.132 3.85428e+01 153.132 0.9254 
1 1 1 -4  84  2  o 13 1.20163e+01 5.66321e-01 1.71026e+02 41.753  1.62131e+01  1.44724e+01  0.00000e+00 0.00000e+00 2.66054e+02 41.753  9.50275e+01 41.753  0.9767 
1 1 1 -4  84  3  o 10 9.24633e+00 5.47730e-01 1.50479e+02 151.549 -1.48387e+01 8.04052e+00  0.00000e+00 0.00000e+00 1.83398e+02 151.549 3.29195e+01 151.549 0.9699 
1 1 1 -4  84  4  o 11 1.18252e+01 5.19918e-01 2.12434e+02 183.709 -3.38303e+01 -2.19289e+00 0.00000e+00 0.00000e+00 2.21105e+02 183.709 8.67082e+00 183.709 0.9851 
1 1 1 -4  84  5  o 11 1.13073e+01 6.46559e-01 1.60078e+02 10.364  2.38846e+01  4.36827e+00  0.00000e+00 0.00000e+00 2.51790e+02 10.364  9.17119e+01 10.364  0.9792 
1 1 1 -4  84  6  o 8  9.60621e+00 5.12659e-01 1.62028e+02 44.039  1.67232e+01  1.61716e+01  0.00000e+00 0.00000e+00 1.87376e+02 44.039  2.53474e+01 44.039  0.9783 
1 1 1 -4  84  7  o 18 5.30922e+00 7.01135e-01 7.93222e+01 23.257  5.41609e+00  2.32768e+00  0.00000e+00 0.00000e+00 1.00350e+02 23.257  2.10279e+01 23.257  0.9107 
1 1 1 -4  84  8  o 12 7.62728e+00 6.29920e-01 1.24741e+02 346.941 1.48532e+01  -3.44535e+00 0.00000e+00 0.00000e+00 1.49062e+02 346.941 2.43210e+01 346.941 0.9666 
1 1 1 -4  84  9  o 4  1.24595e+01 5.76592e-01 2.53148e+02 112.297 -2.20024e+01 5.36565e+01  0.00000e+00 0.00000e+00 2.05241e+02 112.297 4.79068e+01 292.297 0.9913 
1 1 1 -4  84  10 o 9  5.07229e+00 9.00855e-01 1.18015e+02 283.183 2.38296e+00  -1.01732e+01 0.00000e+00 0.00000e+00 6.08454e+01 283.183 5.71700e+01 103.183 0.9509 
1 1 1 -4  84  11 f 0  5.51583e+00 9.58380e-01 1.07921e+02 254.645 -2.61761e+00 -9.53259e+00 0.00000e+00 0.00000e+00 8.58338e+01 254.645 2.20874e+01 74.645  0.9480 
1 1 1 -4  84  12 o 8  3.00492e+00 9.33081e-01 9.02712e+01 337.705 4.98268e+00  -2.04303e+00 0.00000e+00 0.00000e+00 1.00329e+01 337.705 8.02384e+01 157.705 0.9016 
1 1 1 -4  84  13 o 11 6.34615e+00 1.07471e+00 1.00829e+02 38.796  9.94050e+00  7.99131e+00  0.00000e+00 0.00000e+00 1.24505e+02 38.796  2.36752e+01 38.796  0.9600 
1 1 1 -4  84  14 o 18 6.02691e+00 1.27948e+00 1.03191e+02 242.007 -5.13268e+00 -9.65599e+00 0.00000e+00 0.00000e+00 1.09073e+02 242.007 5.88195e+00 242.007 0.9531 
1 1 1 -4  84  15 o 4  3.61610e+00 1.17235e+00 8.52303e+01 72.265  2.06512e+00  6.45715e+00  0.00000e+00 0.00000e+00 3.79708e+01 72.265  4.72595e+01 252.265 0.9230 
1 1 1 -4  85  1  o 6  3.62455e+00 8.46274e-01 5.75689e+01 102.154 -4.65226e-01 2.16024e+00  0.00000e+00 0.00000e+00 4.08869e+01 102.154 1.66820e+01 282.153 0.7294 
1 1 1 -4  85  2  o 5  1.18697e+01 5.61761e-01 1.71388e+02 48.150  1.63924e+01  1.83017e+01  0.00000e+00 0.00000e+00 2.61461e+02 48.150  9.00727e+01 48.150  0.9794 
1 1 1 -4  85  3  o 3  1.27183e+01 5.58666e-01 1.79072e+02 236.577 -1.67709e+01 -2.54123e+01 0.00000e+00 0.00000e+00 2.86472e+02 236.577 1.07400e+02 236.577 0.9834 
1 1 1 -4  85  4  o 5  4.20318e+00 7.78904e-01 1.32528e+02 39.800  5.01587e+00  4.17907e+00  0.00000e+00 0.00000e+00 1.13268e+01 39.800  1.21201e+02 219.800 0.9199 
1 1 1 -4  85  5  o 5  3.69881e+00 8.08284e-01 5.56449e+01 42.844  1.95412e+00  1.81231e+00  0.00000e+00 0.00000e+00 5.19043e+01 42.844  3.74067e+00 222.844 0.7818 
1 1 1 -4  85  6  o 17 2.99258e+00 7.04186e-01 5.72648e+01 288.969 7.67488e-01  -2.23287e+00 0.00000e+00 0.00000e+00 2.60549e+01 288.969 3.12099e+01 108.969 0.7490 
1 1 1 -4  85  7  o 11 6.98930e+00 6.16315e-01 9.93879e+01 325.376 9.19501e+00  -6.34889e+00 0.00000e+00 0.00000e+00 1.48368e+02 325.376 4.89802e+01 325.376 0.9541 
1 1 1 -4  85  8  o 10 7.28111e+00 6.46247e-01 1.05102e+02 134.760 -8.96417e+00 9.03947e+00  0.00000e+00 0.00000e+00 1.54389e+02 134.760 4.92866e+01 134.760 0.9599 
1 1 1 -4  85  9  o 8  6.88487e+00 7.43297e-01 1.12496e+02 282.251 2.85559e+00  -1.31507e+01 0.00000e+00 0.00000e+00 1.33271e+02 282.251 2.07751e+01 282.251 0.9621 
1 1 1 -4  85  10 o 15 4.32953e+00 9.51013e-01 7.00242e+01 141.215 -3.85751e+00 3.09987e+00  0.00000e+00 0.00000e+00 7.31885e+01 141.215 3.16434e+00 141.215 0.8922 
1 1 1 -4  85  11 o 18 5.26385e+00 9.63524e-01 1.08541e+02 254.528 -2.60259e+00 -9.40259e+00 0.00000e+00 0.00000e+00 7.61814e+01 254.528 3.23595e+01 74.528  0.9473 
1 1 1 -4  85  12 o 5  2.82143e+00 8.94811e-01 2.59081e+01 5.911   1.39580e+00  1.44521e-01  0.00000e+00 0.00000e+00 3.37534e+01 5.911   7.84527e+00 5.911   0.5713 
1 1 1 -4  85  13 o 18 4.20694e+00 1.14178e+00 2.93553e+01 309.292 1.55660e+00  -1.90233e+00 0.00000e+00 0.00000e+00 8.89335e+01 309.292 5.95781e+01 309.292 0.7604 
1 1 1 -4  85  14 o 18 3.02972e+00 9.97751e-01 2.34150e+01 205.101 -1.63069e+00 -7.63905e-01 0.00000e+00 0.00000e+00 5.07016e+01 205.101 2.72866e+01 205.101 0.6622 
1 1 1 -4  85  15 o 1  4.36536e+00 1.31464e+00 8.32445e+01 58.134  3.91077e+00  6.29125e+00  0.00000e+00 0.00000e+00 6.65513e+01 58.134  1.66932e+01 238.134 0.9298 
1 1 1 -4  86  1  o 8  1.00858e+01 4.95034e-01 1.53218e+02 213.689 -1.66893e+01 -1.11256e+01 0.00000e+00 0.00000e+00 2.12826e+02 213.689 5.96080e+01 213.689 0.9747 
1 1 1 -4  86  2  o 12 3.54440e+00 8.42444e-01 1.85018e+01 348.649 7.81680e-01  -1.56922e-01 0.00000e+00 0.00000e+00 3.03131e+01 348.649 1.18113e+01 348.649 0.3700 
1 1 1 -4  86  3  o 4  1.27542e+01 5.53820e-01 1.87828e+02 198.001 -2.85990e+01 -9.29308e+00 0.00000e+00 0.00000e+00 2.78824e+02 198.001 9.09964e+01 198.001 0.9832 
1 1 1 -4  86  4  o 13 5.91396e+00 6.78756e-01 1.31579e+02 177.568 -9.87914e+00 4.19514e-01  0.00000e+00 0.00000e+00 7.69697e+01 177.568 5.46097e+01 357.568 0.9480 
1 1 1 -4  86  5  o 16 6.99080e+00 6.61202e-01 1.52810e+02 19.954  1.43124e+01  5.19640e+00  0.00000e+00 0.00000e+00 9.84358e+01 19.954  5.43741e+01 199.954 0.9666 
1 1 1 -4  86  6  o 8  7.20638e+00 6.33486e-01 1.01738e+02 8.090   1.05913e+01  1.50550e+00  0.00000e+00 0.00000e+00 1.53234e+02 8.090   5.14961e+01 8.090   0.9520 
1 1 1 -4  86  7  o 10 1.25031e+01 5.15310e-01 1.96274e+02 230.309 -2.60213e+01 -3.13526e+01 0.00000e+00 0.00000e+00 2.62388e+02 230.309 6.61141e+01 230.309 0.9877 
1 1 1 -4  86  8  o 7  4.02507e+00 8.49034e-01 5.12491e+01 77.617  7.04555e-01  3.20904e+00  0.00000e+00 0.00000e+00 7.26204e+01 77.617  2.13713e+01 77.617  0.8291 
1 1 1 -4  86  9  o 18 9.16647e+00 6.60789e-01 1.15849e+02 70.008  6.67623e+00  1.83507e+01  0.00000e+00 0.00000e+00 2.15352e+02 70.008  9.95027e+01 70.008  0.9740 
1 1 1 -4  86  10 o 11 5.94226e+00 9.47230e-01 1.45728e+02 225.265 -1.01266e+01 -1.02206e+01 0.00000e+00 0.00000e+00 6.67351e+01 225.265 7.89932e+01 45.265  0.9646 
1 1 1 -4  86  11 f 0  5.39892e+00 9.63276e-01 5.28636e+01 52.008  3.08621e+00  3.95125e+00  0.00000e+00 0.00000e+00 1.25841e+02 52.008  7.29777e+01 52.008  0.8937 
1 1 1 -4  86  12 o 10 3.96776e+00 1.03866e+00 7.79185e+01 230.013 -3.67489e+00 -4.38166e+00 0.00000e+00 0.00000e+00 5.53652e+01 230.013 2.25534e+01 50.013  0.9078 
1 1 1 -4  86  13 o 14 5.85577e+00 1.25255e+00 1.09164e+02 337.001 1.00027e+01  -4.24576e+00 0.00000e+00 0.00000e+00 9.71143e+01 337.001 1.20496e+01 157.001 0.9528 
1 1 1 -4  86  14 o 9  3.18894e+00 1.02221e+00 7.42515e+01 273.966 3.87923e-01  -5.59537e+00 0.00000e+00 0.00000e+00 3.24377e+01 273.966 4.18138e+01 93.966  0.9058 
1 1 1 -4  87  1  o 19 1.08962e+01 4.89998e-01 2.15976e+02 5.704   3.17540e+01  3.17174e+00  0.00000e+00 0.00000e+00 1.83222e+02 5.704   3.27532e+01 185.704 0.9842 
1 1 1 -4  87  2  o 19 2.52869e+00 7.13856e-01 3.87585e+01 105.130 -3.06373e-01 1.13309e+00  0.00000e+00 0.00000e+00 8.72555e+00 105.130 3.00330e+01 285.130 0.5046 
1 1 1 -4  87  3  o 2  5.79125e+00 7.56374e-01 9.45224e+01 78.936  1.30183e+00  6.65749e+00  0.00000e+00 0.00000e+00 1.04348e+02 78.936  9.82594e+00 78.936  0.9230 
1 1 1 -4  87  4  f 0  5.11798e+00 7.54442e-01 1.48159e+02 310.167 6.49963e+00  -7.70028e+00 0.00000e+00 0.00000e+00 3.24692e+01 310.167 1.15689e+02 130.167 0.9490 
1 1 1 -4  87  5  o 11 9.95310e+00 5.63466e-01 1.56711e+02 242.762 -1.03032e+01 -2.00155e+01 0.00000e+00 0.00000e+00 2.04963e+02 242.762 4.82515e+01 242.762 0.9775 
1 1 1 -4  87  6  o 4  3.12227e+00 7.91129e-01 5.84754e+01 62.458  1.29639e+00  2.48592e+00  0.00000e+00 0.00000e+00 3.36747e+01 62.458  2.48007e+01 242.458 0.7944 
1 1 1 -4  87  7  o 6  3.92972e+00 8.35202e-01 9.85126e+01 331.614 5.01347e+00  -2.70916e+00 0.00000e+00 0.00000e+00 3.39015e+01 331.614 6.46110e+01 151.614 0.9074 
1 1 1 -4  87  8  o 1  5.74598e+00 7.53370e-01 1.13643e+02 31.181  9.51066e+00  5.75567e+00  0.00000e+00 0.00000e+00 8.97665e+01 31.181  2.38761e+01 211.181 0.9539 
1 1 1 -4  87  9  o 17 4.59353e+00 8.64637e-01 7.53221e+01 140.845 -4.57304e+00 3.72370e+00  0.00000e+00 0.00000e+00 7.98252e+01 140.845 4.50309e+00 140.845 0.9107 
1 1 1 -4  87  10 o 4  4.44248e+00 9.56377e-01 6.76188e+01 251.604 -1.62438e+00 -4.88429e+00 0.00000e+00 0.00000e+00 8.00037e+01 251.604 1.23849e+01 251.604 0.8967 
1 1 1 -4  87  11 o 16 4.53923e+00 1.03848e+00 4.70666e+01 120.053 -1.85235e+00 3.20153e+00  0.00000e+00 0.00000e+00 9.59447e+01 120.053 4.88780e+01 120.053 0.8509 
1 1 1 -4  87  12 o 17 3.38487e+00 9.95364e-01 4.18088e+01 7.441   2.63606e+00  3.44292e-01  0.00000e+00 0.00000e+00 5.60178e+01 7.441   1.42090e+01 7.441   0.7812 
1 1 1 -4  87  13 o 12 3.73713e+00 1.03453e+00 6.52917e+01 93.011  -2.73854e-01 5.20684e+00  0.00000e+00 0.00000e+00 5.87680e+01 93.011  6.52367e+00 273.011 0.8981 
1 1 1 -4  87  14 o 2  3.13870e+00 1.01643e+00 8.21733e+00 287.406 1.92854e-01  -6.15173e-01 0.00000e+00 0.00000e+00 2.73269e+01 287.406 1.91096e+01 287.406 0.3067 
1 1 1 -4  88  1  o 14 3.02401e+00 7.59563e-01 9.61389e+01 152.422 -3.32630e+00 1.73730e+00  0.00000e+00 0.00000e+00 1.09816e-01 332.422 9.62487e+01 332.422 0.8533 
1 1 1 -4  88  2  o 9  5.67865e+00 6.32865e-01 6.94600e+01 182.119 -5.08154e+00 -1.88051e-01 0.00000e+00 0.00000e+00 1.19703e+02 182.119 5.02428e+01 182.119 0.8953 
1 1 1 -4  88  3  f 0  4.65889e+00 8.26385e-01 9.79689e+01 3.247   5.89372e+00  3.34366e-01  0.00000e+00 0.00000e+00 5.98633e+01 3.247   3.81056e+01 183.247 0.9108 
1 1 1 -4  88  4  o 12 9.21777e+00 6.02191e-01 1.58360e+02 90.529  -1.85534e-01 2.00865e+01  0.00000e+00 0.00000e+00 1.75718e+02 90.529  1.73588e+01 90.529  0.9748 
1 1 1 -4  88  5  o 15 5.44943e+00 7.20232e-01 1.38438e+02 98.100  -1.50259e+00 1.05583e+01  0.00000e+00 0.00000e+00 5.43431e+01 98.100  8.40951e+01 278.099 0.9519 
1 1 1 -4  88  6  o 19 6.23533e+00 7.11608e-01 6.84172e+01 305.757 3.88283e+00  -5.39216e+00 0.00000e+00 0.00000e+00 1.44979e+02 305.757 7.65619e+01 305.757 0.9213 
1 1 1 -4  88  7  o 2  6.36323e+00 9.06262e-01 8.92586e+01 76.751  1.80248e+00  7.65525e+00  0.00000e+00 0.00000e+00 1.31402e+02 76.751  4.21434e+01 76.751  0.9341 
1 1 1 -4  88  8  o 1  1.06463e+01 5.84221e-01 1.24950e+02 154.629 -2.24102e+01 1.06271e+01  0.00000e+00 0.00000e+00 2.62002e+02 154.629 1.37052e+02 154.629 0.9796 
1 1 1 -4  88  9  o 11 4.88794e+00 9.14885e-01 6.59106e+01 196.175 -5.16351e+00 -1.49770e+00 0.00000e+00 0.00000e+00 9.74555e+01 196.175 3.15449e+01 196.175 0.9014 
1 1 1 -4  88  10 o 3  4.48974e+00 9.77089e-01 1.01319e+02 184.492 -7.44045e+00 -5.84529e-01 0.00000e+00 0.00000e+00 5.34404e+01 184.492 4.78783e+01 4.492   0.9304 
1 1 1 -4  88  11 o 7  5.29090e+00 1.02133e+00 8.95271e+01 26.770  7.89976e+00  3.98527e+00  0.00000e+00 0.00000e+00 9.49149e+01 26.770  5.38783e+00 26.770  0.9417 
1 1 1 -4  88  12 o 3  4.01221e+00 1.06592e+00 6.94789e+01 169.883 -5.21073e+00 9.29760e-01  0.00000e+00 0.00000e+00 6.40474e+01 169.883 5.43149e+00 349.883 0.8998 
1 1 1 -4  88  13 o 19 4.46466e+00 1.02740e+00 8.36844e+01 192.293 -7.76541e+00 -1.69219e+00 0.00000e+00 0.00000e+00 7.05415e+01 192.293 1.31429e+01 12.293  0.9348 
1 1 1 -4  88  14 o 8  3.13786e+00 1.02865e+00 6.86080e+01 239.962 -2.60382e+00 -4.50308e+00 0.00000e+00 0.00000e+00 3.54003e+01 239.962 3.32077e+01 59.962  0.8979 
1 1 1 -4  89  1  o 17 2.86992e+00 7.57213e-01 3.22091e+01 237.794 -6.50577e-01 -1.03287e+00 0.00000e+00 0.00000e+00 2.32248e+01 237.794 8.98431e+00 57.794  0.5191 
1 1 1 -4  89  2  o 12 1.05790e+01 4.83317e-01 1.51078e+02 129.860 -1.48442e+01 1.77789e+01  0.00000e+00 0.00000e+00 2.33840e+02 129.860 8.27612e+01 129.860 0.9782 
1 1 1 -4  89  3  o 18 1.35176e+01 5.59023e-01 2.30917e+02 64.635  1.86565e+01  3.93524e+01  0.00000e+00 0.00000e+00 2.65934e+02 64.635  3.50169e+01 64.635  0.9885 
1 1 1 -4  89  4  o 8  6.34719e+00 6.86588e-01 1.26932e+02 189.985 -1.16488e+01 -2.05092e+00 0.00000e+00 0.00000e+00 9.87967e+01 189.985 2.81355e+01 9.985   0.9567 
1 1 1 -4  89  5  f 0  4.59074e+00 8.03379e-01 9.54488e+01 91.006  -1.17424e-01 6.68864e+00  0.00000e+00 0.00000e+00 6.17984e+01 91.006  3.36503e+01 271.006 0.9219 
1 1 1 -4  89  6  o 6  7.59864e+00 6.69892e-01 1.45688e+02 285.045 4.53386e+00  -1.68671e+01 0.00000e+00 0.00000e+00 1.28300e+02 285.045 1.73882e+01 105.045 0.9709 
1 1 1 -4  89  7  o 9  1.03912e+01 6.34828e-01 1.81190e+02 23.679  2.78545e+01  1.22151e+01  0.00000e+00 0.00000e+00 1.98095e+02 23.679  1.69055e+01 23.679  0.9834 
1 1 1 -4  89  8  o 6  1.43172e+01 5.49903e-01 2.45277e+02 207.504 -6.00189e+01 -3.12489e+01 0.00000e+00 0.00000e+00 2.81852e+02 207.504 3.65751e+01 207.504 0.9926 
1 1 1 -4  89  9  o 13 6.27403e+00 7.91930e-01 1.07674e+02 314.766 8.63481e+00  -8.70552e+00 0.00000e+00 0.00000e+00 1.15195e+02 314.766 7.52173e+00 314.766 0.9583 
1 1 1 -4  89  10 o 4  5.33700e+00 9.84187e-01 1.32098e+02 69.289  4.26438e+00  1.12786e+01  0.00000e+00 0.00000e+00 5.72026e+01 69.289  7.48949e+01 249.289 0.9576 
1 1 1 -4  89  11 o 18 6.39377e+00 9.60299e-01 8.10579e+01 176.431 -9.52247e+00 5.93974e-01  0.00000e+00 0.00000e+00 1.42812e+02 176.431 6.17537e+01 176.431 0.9460 
1 1 1 -4  89  12 f 0  7.50436e+00 9.74715e-01 8.04209e+01 279.507 2.20136e+00  -1.31453e+01 0.00000e+00 0.00000e+00 1.86458e+02 279.507 1.06037e+02 279.507 0.9617 
1 1 1 -4  89  13 o 3  3.22223e+00 1.00348e+00 4.21553e+01 73.074  8.98473e-01  2.95237e+00  0.00000e+00 0.00000e+00 5.50021e+01 73.074  1.28468e+01 73.074  0.8162 
1 1 1 -4  89  14 o 4  2.66210e+00 9.05690e-01 3.77180e+01 310.632 1.85705e+00  -2.16422e+00 0.00000e+00 0.00000e+00 4.07267e+01 310.632 3.00865e+00 310.632 0.7984 
1 1 1 -4  90  1  o 1  1.10476e+01 4.96361e-01 2.07969e+02 208.465 -3.03255e+01 -1.64416e+01 0.00000e+00 0.00000e+00 1.96972e+02 208.465 1.09965e+01 28.465  0.9854 
1 1 1 -4  90  2  o 2  2.89475e+00 6.92125e-01 4.29534e+01 108.534 -5.28091e-01 1.57519e+00  0.00000e+00 0.00000e+00 2.52494e+01 108.534 1.77041e+01 288.534 0.6336 
1 1 1 -4  90  3  o 19 3.46409e+00 7.64522e-01 6.61436e+01 314.119 2.27295e+00  -2.34391e+00 0.00000e+00 0.00000e+00 4.04641e+01 314.119 2.56795e+01 134.119 0.8278 
1 1 1 -4  90  4  o 17 2.80847e+00 7.84231e-01 6.35976e+01 132.021 -1.62006e+00 1.79794e+00  0.00000e+00 0.00000e+00 1.53081e+01 132.021 4.82895e+01 312.021 0.7560 
1 1 1 -4  90  5  o 6  1.18244e+01 5.88910e-01 1.75517e+02 232.057 -2.06807e+01 -2.65245e+01 0.00000e+00 0.00000e+00 2.57134e+02 232.057 8.16167e+01 232.057 0.9850 
1 1 1 -4  90  6  o 10 4.07064e+00 8.62718e-01 1.18160e+02 176.508 -6.78833e+00 4.14202e-01  0.00000e+00 0.00000e+00 2.13726e+01 176.508 9.67870e+01 356.508 0.9232 
1 1 1 -4  90  7  o 16 4.49702e+00 8.86903e-01 6.07636e+01 60.030  2.04513e+00  3.54659e+00  0.00000e+00 0.00000e+00 8.39200e+01 60.030  2.31564e+01 60.030  0.8670 
1 1 1 -4  90  8  o 11 6.11600e+00 8.81437e-01 1.18309e+02 213.663 -1.06435e+01 -7.08833e+00 0.00000e+00 0.00000e+00 9.94395e+01 213.663 1.88692e+01 33.663  0.9601 
1 1 1 -4  90  9  o 17 9.44515e+00 6.40377e-01 1.42147e+02 23.888  2.50817e+01  1.11085e+01  0.00000e+00 0.00000e+00 2.01437e+02 23.888  5.92909e+01 23.888  0.9816 
1 1 1 -4  90  10 o 10 1.06030e+01 7.14585e-01 1.18836e+02 138.502 -2.01744e+01 1.78477e+01  0.00000e+00 0.00000e+00 2.66447e+02 138.502 1.47611e+02 138.502 0.9813 
1 1 1 -4  90  11 o 7  2.71302e+00 8.58229e-01 1.00524e+02 285.354 1.51319e+00  -5.51090e+00 0.00000e+00 0.00000e+00 9.40485e+00 105.354 1.09929e+02 105.354 0.9077 
1 1 1 -4  90  12 o 17 2.68920e+00 8.75929e-01 4.45415e+01 141.699 -2.33782e+00 1.84639e+00  0.00000e+00 0.00000e+00 3.58305e+01 141.699 8.71095e+00 321.699 0.8084 
1 1 1 -4  90  13 o 16 8.06763e+00 1.10830e+00 9.72468e+01 14.173  1.70133e+01  4.29639e+00  0.00000e+00 0.00000e+00 1.92115e+02 14.173  9.48677e+01 14.173  0.9711 
1 1 1 -4  90  14 o 11 5.84113e+00 1.32348e+00 9.92415e+01 201.919 -1.08716e+01 -4.37456e+00 0.00000e+00 0.00000e+00 1.06878e+02 201.919 7.63658e+00 201.919 0.9563 
1 1 1 -4  91  1  o 16 6.56757e+00 6.10337e-01 7.98681e+01 16.804  7.58856e+00  2.29171e+00  0.00000e+00 0.00000e+00 1.48397e+02 16.804  6.85294e+01 16.804  0.9346 
1 1 1 -4  91  2  o 12 4.57345e+00 6.88968e-01 8.68307e+01 15.155  5.62153e+00  1.52262e+00  0.00000e+00 0.00000e+00 6.78220e+01 15.155  1.90087e+01 195.155 0.9095 
1 1 1 -4  91  3  o 15 4.86383e+00 6.76312e-01 9.87610e+01 100.528 -1.23909e+00 6.66752e+00  0.00000e+00 0.00000e+00 6.80949e+01 100.528 3.06662e+01 280.528 0.9230 
1 1 1 -4  91  4  o 8  2.49633e+00 7.48744e-01 7.08838e+01 64.439  1.17270e+00  2.45190e+00  0.00000e+00 0.00000e+00 2.08502e+00 64.439  6.87987e+01 244.439 0.7868 
1 1 1 -4  91  5  o 19 8.09147e+00 7.07204e-01 1.60402e+02 317.914 1.49952e+01  -1.35425e+01 0.00000e+00 0.00000e+00 1.32557e+02 317.914 2.78452e+01 137.914 0.9749 
1 1 1 -4  91  6  o 11 1.52078e+01 5.72974e-01 3.10502e+02 56.407  4.32194e+01  6.50683e+01  0.00000e+00 0.00000e+00 2.50362e+02 56.407  6.01400e+01 236.407 0.9936 
1 1 1 -4  91  7  o 18 8.39397e+00 6.86137e-01 1.99200e+02 222.082 -2.20448e+01 -1.99066e+01 0.00000e+00 0.00000e+00 1.06909e+02 222.082 9.22906e+01 42.082  0.9830 
1 1 1 -4  91  8  o 9  5.41973e+00 9.26976e-01 8.79277e+01 245.150 -3.31791e+00 -7.16432e+00 0.00000e+00 0.00000e+00 9.98139e+01 245.150 1.18862e+01 245.150 0.9343 
1 1 1 -4  91  9  o 1  7.61908e+00 7.56141e-01 1.48610e+02 353.995 2.09367e+01  -2.20244e+00 0.00000e+00 0.00000e+00 1.26885e+02 353.995 2.17244e+01 173.995 0.9760 
1 1 1 -4  91  10 o 14 7.40902e+00 8.86637e-01 9.01097e+01 262.766 -1.64130e+00 -1.29315e+01 0.00000e+00 0.00000e+00 1.73446e+02 262.766 8.33364e+01 262.766 0.9608 
1 1 1 -4  91  11 o 10 7.04205e+00 9.79296e-01 1.39306e+02 269.811 -6.12996e-02 -1.86331e+01 0.00000e+00 0.00000e+00 1.14106e+02 269.811 2.51992e+01 89.811  0.9728 
1 1 1 -4  91  12 o 17 3.97840e+00 1.09132e+00 4.25354e+01 81.823  4.95356e-01  3.44746e+00  0.00000e+00 0.00000e+00 8.10107e+01 81.823  3.84752e+01 81.823  0.8402 
1 1 1 -4  91  13 o 3  4.33164e+00 1.18320e+00 3.70731e+01 178.480 -3.28929e+00 8.72796e-02  0.00000e+00 0.00000e+00 9.55836e+01 178.480 5.85105e+01 178.480 0.8294 
1 1 1 -4  91  14 o 7  3.61637e+00 1.11511e+00 4.74430e+01 247.307 -1.68277e+00 -4.02421e+00 0.00000e+00 0.00000e+00 6.94384e+01 247.307 2.19954e+01 247.307 0.8761 
1 1 1 -4  92  1  o 13 1.52475e+01 4.79671e-01 2.89660e+02 15.043  6.41031e+01  1.72283e+01  0.00000e+00 0.00000e+00 2.72935e+02 15.043  1.67243e+01 195.043 0.9924 
1 1 1 -4  92  2  o 4  8.07443e+00 5.44248e-01 1.77819e+02 140.373 -1.87643e+01 1.55379e+01  0.00000e+00 0.00000e+00 1.16077e+02 140.373 6.17417e+01 320.373 0.9793 
1 1 1 -4  92  3  f 0  1.01039e+01 5.06665e-01 9.99272e+01 72.933  4.94532e+00  1.61076e+01  0.00000e+00 0.00000e+00 2.64192e+02 72.933  1.64265e+02 72.933  0.9699 
1 1 1 -4  92  4  o 15 6.44672e+00 6.57644e-01 9.26787e+01 306.807 5.68338e+00  -7.59519e+00 0.00000e+00 0.00000e+00 1.33780e+02 306.807 4.11012e+01 306.807 0.9457 
1 1 1 -4  92  5  o 19 2.88015e+00 8.32814e-01 4.91899e+01 174.808 -2.02039e+00 1.83570e-01  0.00000e+00 0.00000e+00 2.59233e+01 174.808 2.32666e+01 354.808 0.7024 
1 1 1 -4  92  6  o 3  4.32945e+00 8.55151e-01 6.17407e+01 113.700 -1.63611e+00 3.72713e+00  0.00000e+00 0.00000e+00 7.74208e+01 113.700 1.56801e+01 113.700 0.8662 
1 1 1 -4  92  7  o 5  5.00527e+00 9.38156e-01 1.26342e+02 222.476 -7.05837e+00 -6.46236e+00 0.00000e+00 0.00000e+00 4.93104e+01 222.476 7.70319e+01 42.476  0.9462 
1 1 1 -4  92  8  o 1  5.35060e+00 9.70685e-01 2.30849e+01 343.463 1.94222e+00  -5.76690e-01 0.00000e+00 0.00000e+00 1.16138e+02 343.463 9.30526e+01 343.463 0.7020 
1 1 1 -4  92  9  f 0  3.43415e+00 8.54187e-01 9.95580e+01 320.561 4.81025e+00  -3.95660e+00 0.00000e+00 0.00000e+00 1.69291e+01 320.561 8.26289e+01 140.561 0.9158 
1 1 1 -4  92  10 o 5  3.45798e+00 9.33804e-01 7.32547e+01 278.242 6.86104e-01  -4.73666e+00 0.00000e+00 0.00000e+00 4.04219e+01 278.242 3.28328e+01 98.242  0.8882 
1 1 1 -4  92  11 o 8  5.25881e+00 1.08865e+00 7.94840e+01 117.204 -3.56627e+00 6.93812e+00  0.00000e+00 0.00000e+00 1.02072e+02 117.204 2.25876e+01 117.204 0.9335 
1 1 1 -4  92  12 o 19 6.91161e+00 1.13273e+00 5.01197e+01 40.388  5.31093e+00  4.51796e+00  0.00000e+00 0.00000e+00 1.86175e+02 40.388  1.36055e+02 40.388  0.9252 
1 1 1 -4  92  13 o 17 5.27212e+00 1.25814e+00 9.39019e+01 214.571 -8.12126e+00 -5.59652e+00 0.00000e+00 0.00000e+00 9.05808e+01 214.571 3.32107e+00 34.571  0.9479 
1 1 1 -4  93  1  o 18 9.58869e+00 5.33622e-01 1.55365e+02 92.382  -1.02520e+00 2.46496e+01  0.00000e+00 0.00000e+00 1.93740e+02 92.382  3.83757e+01 92.382  0.9795 
1 1 1 -4  93  2  o 11 6.19736e+00 6.51487e-01 1.29560e+02 281.362 2.52692e+00  -1.25749e+01 0.00000e+00 0.00000e+00 9.15649e+01 281.362 3.79953e+01 101.362 0.9602 
1 1 1 -4  93  3  o 14 9.10101e+00 5.35821e-01 1.34891e+02 338.334 1.87973e+01  -7.46751e+00 0.00000e+00 0.00000e+00 1.94729e+02 338.334 5.98373e+01 338.334 0.9750 
1 1 1 -4  93  4  o 6  5.86533e+00 7.45699e-01 9.11994e+01 315.814 6.12402e+00  -5.95241e+00 0.00000e+00 0.00000e+00 1.13426e+02 315.814 2.22266e+01 315.814 0.9395 
1 1 1 -4  93  5  o 3  7.61809e+00 7.37340e-01 1.36559e+02 55.242  9.19329e+00  1.32484e+01  0.00000e+00 0.00000e+00 1.37297e+02 55.242  7.38740e-01 55.242  0.9685 
1 1 1 -4  93  6  o 3  3.20177e+00 8.61374e-01 5.95799e+01 15.194  3.00406e+00  8.15829e-01  0.00000e+00 0.00000e+00 3.75853e+01 15.194  2.19945e+01 195.194 0.8180 
1 1 1 -4  93  7  o 14 2.50561e+00 7.95109e-01 1.28803e+02 165.299 -5.44040e+00 1.42738e+00  0.00000e+00 0.00000e+00 4.46213e+01 345.299 1.73424e+02 345.299 0.9061 
1 1 1 -4  93  8  o 13 4.05374e+00 9.86694e-01 9.31551e+01 75.584  1.58218e+00  6.15521e+00  0.00000e+00 0.00000e+00 4.46747e+01 75.584  4.84804e+01 255.584 0.9175 
1 1 1 -4  93  9  o 7  8.79990e+00 8.28657e-01 1.45025e+02 198.493 -2.30590e+01 -7.71233e+00 0.00000e+00 0.00000e+00 1.74069e+02 198.493 2.90439e+01 198.493 0.9792 
1 1 1 -4  93  10 o 5  3.51316e+00 9.67569e-01 7.70087e+01 263.504 -6.01132e-01 -5.27942e+00 0.00000e+00 0.00000e+00 4.00132e+01 263.504 3.69955e+01 83.504  0.9002 
1 1 1 -4  93  11 o 19 3.26069e+00 9.72804e-01 8.94915e+01 191.990 -6.31114e+00 -1.34033e+00 0.00000e+00 0.00000e+00 2.12849e+01 191.990 6.82066e+01 11.990  0.9189 
1 1 1 -4  93  12 o 4  5.49804e+00 1.14938e+00 8.46373e+01 334.137 8.20825e+00  -3.97916e+00 0.00000e+00 0.00000e+00 1.06990e+02 334.137 2.23531e+01 334.137 0.9435 
1 1 1 -4  93  13 o 1  3.04063e+00 9.85155e-01 1.32404e+01 283.388 2.34072e-01  -9.83474e-01 0.00000e+00 0.00000e+00 3.72883e+01 283.388 2.40479e+01 283.388 0.4503 
1 1 1 -4  94  1  o 9  8.74337e+00 5.48497e-01 1.47652e+02 330.777 1.85025e+01  -1.03505e+01 0.00000e+00 0.00000e+00 1.69492e+02 330.777 2.18398e+01 330.777 0.9761 
1 1 1 -4  94  2  o 18 2.50319e+00 7.16480e-01 7.41106e+01 121.745 -1.51286e+00 2.44520e+00  0.00000e+00 0.00000e+00 3.15632e-01 121.745 7.37950e+01 301.745 0.8003 
1 1 1 -4  94  3  o 19 1.18055e+01 4.99209e-01 2.33898e+02 284.660 1.22799e+01  -4.69426e+01 0.00000e+00 0.00000e+00 2.00002e+02 284.660 3.38960e+01 104.660 0.9896 
1 1 1 -4  94  4  o 13 8.12103e+00 7.09709e-01 1.19161e+02 99.863  -2.82220e+00 1.62328e+01  0.00000e+00 0.00000e+00 1.73034e+02 99.863  5.38730e+01 99.863  0.9692 
1 1 1 -4  94  5  f 0  1.34071e+01 5.41574e-01 1.80837e+02 184.082 -4.19816e+01 -2.99606e+00 0.00000e+00 0.00000e+00 3.10735e+02 184.082 1.29898e+02 184.082 0.9880 
1 1 1 -4  94  6  o 7  6.76757e+00 7.98333e-01 9.73554e+01 330.905 9.35570e+00  -5.20619e+00 0.00000e+00 0.00000e+00 1.41629e+02 330.905 4.42732e+01 330.905 0.9521 
1 1 1 -4  94  7  o 14 6.54762e+00 8.54348e-01 1.50585e+02 138.466 -1.18312e+01 1.04798e+01  0.00000e+00 0.00000e+00 8.43229e+01 138.466 6.62623e+01 318.466 0.9678 
1 1 1 -4  94  8  o 14 5.48064e+00 9.90001e-01 8.44993e+01 79.876  1.32588e+00  7.42508e+00  0.00000e+00 0.00000e+00 1.04557e+02 79.876  2.00572e+01 79.876  0.9311 
1 1 1 -4  94  9  o 7  6.42494e+00 9.71650e-01 9.21646e+01 259.712 -1.91173e+00 -1.05320e+01 0.00000e+00 0.00000e+00 1.34296e+02 259.712 4.21314e+01 259.712 0.9521 
1 1 1 -4  94  10 o 17 4.16243e+00 1.03377e+00 6.54217e+01 251.751 -1.59026e+00 -4.82301e+00 0.00000e+00 0.00000e+00 7.24203e+01 251.751 6.99865e+00 251.751 0.8952 
1 1 1 -4  94  11 o 15 3.99924e+00 1.03562e+00 5.50168e+01 142.782 -3.81960e+00 2.90111e+00  0.00000e+00 0.00000e+00 7.63197e+01 142.782 2.13029e+01 142.782 0.8884 
1 1 1 -4  94  12 o 19 3.77158e+00 1.03922e+00 6.83103e+01 240.737 -3.07511e+00 -5.48819e+00 0.00000e+00 0.00000e+00 5.93732e+01 240.737 8.93713e+00 60.737  0.9167 
1 1 1 -4  94  13 f 0  3.90892e+00 1.08293e+00 6.15496e+01 46.537  4.00411e+00  4.22491e+00  0.00000e+00 0.00000e+00 6.96264e+01 46.537  8.07673e+00 46.537  0.9095 
1 1 1 -4  95  1  o 10 5.33613e+00 6.78977e-01 4.42925e+01 313.695 2.56726e+00  -2.68700e+00 0.00000e+00 0.00000e+00 1.24537e+02 313.695 8.02445e+01 313.695 0.8517 
1 1 1 -4  95  2  o 16 2.00328e+01 5.03029e-01 3.15041e+02 283.315 2.54802e+01  -1.07665e+02 0.00000e+00 0.00000e+00 4.25623e+02 283.315 1.10582e+02 283.315 0.9955 
1 1 1 -4  95  3  o 4  1.19032e+01 5.01580e-01 1.97359e+02 122.844 -2.35819e+01 3.65305e+01  0.00000e+00 0.00000e+00 2.39486e+02 122.844 4.21272e+01 122.844 0.9884 
1 1 1 -4  95  4  f 0  3.18051e+00 8.34342e-01 8.47066e+01 47.361  2.98556e+00  3.24232e+00  0.00000e+00 0.00000e+00 1.88838e+01 47.361  6.58228e+01 227.361 0.8775 
1 1 1 -4  95  5  o 5  4.06975e+00 7.84189e-01 7.85603e+01 304.241 3.12364e+00  -4.58923e+00 0.00000e+00 0.00000e+00 5.80454e+01 304.241 2.05149e+01 124.241 0.9048 
1 1 1 -4  95  6  o 4  5.47539e+00 9.62769e-01 1.02379e+02 269.917 -1.36396e-02 -9.43049e+00 0.00000e+00 0.00000e+00 8.95642e+01 269.917 1.28151e+01 89.917  0.9454 
1 1 1 -4  95  7  o 9  8.20135e+00 7.98331e-01 1.35992e+02 105.828 -5.41016e+00 1.90830e+01  0.00000e+00 0.00000e+00 1.60185e+02 105.828 2.41935e+01 105.828 0.9745 
1 1 1 -4  95  8  o 12 7.39594e+00 8.69245e-01 2.03423e+02 84.370  2.70738e+00  2.74618e+01  0.00000e+00 0.00000e+00 6.54899e+01 84.370  1.37933e+02 264.370 0.9817 
1 1 1 -4  95  9  o 19 5.06212e+00 1.08758e+00 7.56505e+01 221.748 -4.87161e+00 -4.34779e+00 0.00000e+00 0.00000e+00 9.66948e+01 221.748 2.10444e+01 221.748 0.9199 
1 1 1 -4  95  10 o 5  7.90171e+00 1.01544e+00 1.09606e+02 170.951 -1.68604e+01 2.68532e+00  0.00000e+00 0.00000e+00 1.73940e+02 170.951 6.43341e+01 170.951 0.9703 
1 1 1 -4  95  11 f 0  2.91154e+00 9.10708e-01 7.53075e+01 311.100 3.43724e+00  -3.94011e+00 0.00000e+00 0.00000e+00 2.13588e+01 311.100 5.39486e+01 131.100 0.8984 
1 1 1 -4  95  12 o 6  3.09982e+00 9.66959e-01 5.53952e+01 252.512 -1.28364e+00 -4.07426e+00 0.00000e+00 0.00000e+00 4.45471e+01 252.512 1.08481e+01 72.512  0.8732 
1 1 1 -4  95  13 o 9  2.89656e+00 9.43085e-01 4.86106e+01 311.232 2.64647e+00  -3.01964e+00 0.00000e+00 0.00000e+00 4.37187e+01 311.232 4.89184e+00 131.232 0.8641 
1 1 1 -4  96  1  o 19 4.00829e+00 7.36046e-01 8.59741e+01 179.193 -5.80401e+00 8.17459e-02  0.00000e+00 0.00000e+00 4.93795e+01 179.193 3.65946e+01 359.193 0.9092 
1 1 1 -4  96  2  o 17 4.56836e+00 7.73719e-01 1.15537e+02 86.368  5.11026e-01  8.04994e+00  0.00000e+00 0.00000e+00 4.31990e+01 86.368  7.23378e+01 266.368 0.9358 
1 1 1 -4  96  3  o 19 6.26993e+00 6.92794e-01 5.74978e+01 94.665  -5.13593e-01 6.29367e+00  0.00000e+00 0.00000e+00 1.55918e+02 94.665  9.84198e+01 94.665  0.9170 
1 1 1 -4  96  4  o 9  4.82233e+00 7.90542e-01 1.00084e+02 250.146 -2.77561e+00 -7.68675e+00 0.00000e+00 0.00000e+00 6.75163e+01 250.146 3.25680e+01 70.146  0.9367 
1 1 1 -4  96  5  o 13 6.79634e+00 6.61073e-01 1.03893e+02 251.039 -4.34367e+00 -1.26426e+01 0.00000e+00 0.00000e+00 1.38559e+02 251.039 3.46657e+01 251.039 0.9618 
1 1 1 -4  96  6  o 4  1.98230e+01 6.14845e-01 3.18797e+02 38.753  8.82692e+01  7.08520e+01  0.00000e+00 0.00000e+00 4.12805e+02 38.753  9.40072e+01 38.753  0.9956 
1 1 1 -4  96  7  o 10 9.46505e+00 7.41851e-01 1.62403e+02 153.819 -2.42979e+01 1.19462e+01  0.00000e+00 0.00000e+00 1.81740e+02 153.819 1.93372e+01 153.819 0.9814 
1 1 1 -4  96  8  o 8  4.99857e+00 1.02960e+00 6.29852e+01 211.965 -4.68887e+00 -2.92599e+00 0.00000e+00 0.00000e+00 1.04389e+02 211.965 4.14040e+01 211.965 0.9043 
1 1 1 -4  96  9  o 19 4.46110e+00 1.07518e+00 9.95871e+01 232.975 -4.86718e+00 -6.45320e+00 0.00000e+00 0.00000e+00 5.49059e+01 232.975 4.46812e+01 52.975  0.9359 
1 1 1 -4  96  10 o 14 4.78164e+00 1.14954e+00 7.16348e+01 21.218  5.99417e+00  2.32715e+00  0.00000e+00 0.00000e+00 9.07659e+01 21.218  1.91312e+01 21.218  0.9186 
1 1 1 -4  96  11 o 6  2.63726e+00 8.68299e-01 8.06211e+01 126.627 -3.06217e+00 4.11920e+00  0.00000e+00 0.00000e+00 6.71520e+00 126.627 7.39059e+01 306.627 0.8964 
1 1 1 -4  96  12 o 17 3.51147e+00 1.02530e+00 5.80737e+01 77.353  1.10610e+00  4.92954e+00  0.00000e+00 0.00000e+00 5.78803e+01 77.353  1.93414e-01 257.353 0.8946 
1 1 1 -4  96  13 o 16 3.10693e+00 1.00004e+00 6.35401e+01 296.180 2.29346e+00  -4.66510e+00 0.00000e+00 0.00000e+00 3.93283e+01 296.180 2.42117e+01 116.180 0.8978 
1 1 1 -4  97  1  o 18 8.86967e+00 5.52201e-01 1.79812e+02 268.322 -8.68018e-01 -2.96346e+01 0.00000e+00 0.00000e+00 1.43921e+02 268.322 3.58918e+01 88.322  0.9830 
1 1 1 -4  97  2  o 16 1.31637e+01 4.99539e-01 1.93607e+02 21.641  4.17689e+01  1.65724e+01  0.00000e+00 0.00000e+00 2.89578e+02 21.641  9.59709e+01 21.641  0.9888 
1 1 1 -4  97  3  o 18 8.02781e+00 5.76896e-01 1.38913e+02 148.859 -1.78480e+01 1.07838e+01  0.00000e+00 0.00000e+00 1.51762e+02 148.859 1.28491e+01 148.859 0.9757 
1 1 1 -4  97  4  o 19 7.09658e+00 6.40757e-01 9.25762e+01 206.004 -1.03082e+01 -5.02853e+00 0.00000e+00 0.00000e+00 1.58924e+02 206.004 6.63475e+01 206.004 0.9554 
1 1 1 -4  97  5  o 2  7.48715e+00 6.16557e-01 1.07502e+02 322.128 1.20451e+01  -9.36742e+00 0.00000e+00 0.00000e+00 1.60860e+02 322.128 5.33582e+01 322.128 0.9667 
1 1 1 -4  97  6  o 7  4.49381e+00 9.19539e-01 9.05269e+01 169.632 -6.66137e+00 1.21869e+00  0.00000e+00 0.00000e+00 6.31763e+01 169.632 2.73507e+01 349.632 0.9229 
1 1 1 -4  97  7  o 1  7.54314e+00 8.48664e-01 8.12146e+01 156.314 -1.02629e+01 4.50213e+00  0.00000e+00 0.00000e+00 1.85413e+02 156.314 1.04199e+02 156.314 0.9543 
1 1 1 -4  97  8  o 13 2.76109e+00 8.72298e-01 3.94971e+01 23.652  1.96729e+00  8.61612e-01  0.00000e+00 0.00000e+00 3.41539e+01 23.652  5.34320e+00 203.652 0.7206 
1 1 1 -4  97  9  f 0  4.35136e+00 1.03277e+00 1.29837e+02 111.835 -3.92261e+00 9.79008e+00  0.00000e+00 0.00000e+00 2.32970e+01 111.835 1.06540e+02 291.835 0.9513 
1 1 1 -4  97  10 o 13 2.99948e+00 9.35555e-01 2.38999e+01 229.819 -1.09173e+00 -1.29275e+00 0.00000e+00 0.00000e+00 4.70771e+01 229.819 2.31773e+01 229.819 0.6402 
1 1 1 -4  97  11 o 8  3.56714e+00 1.05031e+00 9.70934e+01 290.059 2.59416e+00  -7.10440e+00 0.00000e+00 0.00000e+00 2.56117e+01 290.059 7.14817e+01 110.059 0.9313 
1 1 1 -4  97  12 o 15 4.18622e+00 1.14442e+00 9.39628e+01 131.415 -5.64808e+00 6.40309e+00  0.00000e+00 0.00000e+00 5.11716e+01 131.415 4.27912e+01 311.415 0.9395 
1 1 1 -4  98  1  o 18 9.61713e+00 5.43844e-01 1.53497e+02 80.101  4.81109e+00  2.75690e+01  0.00000e+00 0.00000e+00 1.97059e+02 80.101  4.35622e+01 80.101  0.9820 
1 1 1 -4  98  2  o 8  2.23847e+00 6.97519e-01 3.23458e+01 34.104  1.06025e+00  7.17951e-01  0.00000e+00 0.00000e+00 1.22639e+01 34.104  2.00819e+01 214.104 0.5370 
1 1 1 -4  98  3  o 8  9.15098e+00 5.70873e-01 1.21677e+02 214.216 -1.65335e+01 -1.12430e+01 0.00000e+00 0.00000e+00 2.09219e+02 214.216 8.75412e+01 214.216 0.9747 
1 1 1 -4  98  4  o 13 3.41206e+00 7.68619e-01 6.54933e+01 58.096  2.22066e+00  3.56705e+00  0.00000e+00 0.00000e+00 4.47036e+01 58.096  2.07897e+01 238.096 0.8709 
1 1 1 -4  98  5  o 4  8.66179e+00 6.05566e-01 9.72544e+01 44.203  1.08366e+01  1.05392e+01  0.00000e+00 0.00000e+00 2.13025e+02 44.203  1.15770e+02 44.203  0.9663 
1 1 1 -4  98  6  f 0  8.01527e+00 7.77479e-01 1.60720e+02 351.455 2.20544e+01  -3.31366e+00 0.00000e+00 0.00000e+00 1.29518e+02 351.455 3.12012e+01 171.455 0.9773 
1 1 1 -4  98  7  o 9  6.68194e+00 8.14748e-01 8.70851e+01 145.417 -9.20745e+00 6.34777e+00  0.00000e+00 0.00000e+00 1.49014e+02 145.417 6.19289e+01 145.417 0.9542 
1 1 1 -4  98  8  o 10 4.72797e+00 1.05553e+00 5.24056e+01 106.968 -1.25860e+00 4.12485e+00  0.00000e+00 0.00000e+00 1.00615e+02 106.968 4.82090e+01 106.968 0.8746 
1 1 1 -4  98  9  o 10 4.61791e+00 1.08576e+00 1.00165e+02 87.912  3.15319e-01  8.64755e+00  0.00000e+00 0.00000e+00 6.04220e+01 87.912  3.97429e+01 267.912 0.9403 
1 1 1 -4  98  10 o 17 4.87940e+00 1.16417e+00 9.23835e+01 255.375 -2.07096e+00 -7.93612e+00 0.00000e+00 0.00000e+00 7.65548e+01 255.375 1.58287e+01 75.375  0.9369 
1 1 1 -4  98  11 o 2  4.00270e+00 1.13204e+00 1.11652e+02 92.126  -3.62832e-01 9.77163e+00  0.00000e+00 0.00000e+00 2.83733e+01 92.126  8.32792e+01 272.126 0.9474 
1 1 1 -4  98  12 o 14 3.45985e+00 1.01509e+00 4.53432e+01 192.950 -3.95053e+00 -9.08412e-01 0.00000e+00 0.00000e+00 6.51406e+01 192.950 1.97974e+01 192.950 0.8656 
1 1 1 -4  99  1  o 14 1.18112e+01 5.30960e-01 1.80368e+02 108.621 -1.24076e+01 3.68234e+01  0.00000e+00 0.00000e+00 2.52277e+02 108.621 7.19089e+01 108.621 0.9870 
1 1 1 -4  99  2  o 6  4.42113e+00 7.81728e-01 1.38458e+02 270.429 7.50331e-02  -1.00229e+01 0.00000e+00 0.00000e+00 1.71602e+01 270.429 1.21298e+02 90.429  0.9487 
1 1 1 -4  99  3  o 5  4.32402e+00 8.04608e-01 1.36696e+02 89.563  8.31666e-02  1.09006e+01  0.00000e+00 0.00000e+00 1.61377e+01 89.563  1.20558e+02 269.563 0.9530 
1 1 1 -4  99  4  o 18 1.79498e+01 5.21360e-01 2.54955e+02 58.452  4.44799e+01  7.24489e+01  0.00000e+00 0.00000e+00 4.06622e+02 58.452  1.51667e+02 58.452  0.9941 
1 1 1 -4  99  5  o 11 1.27067e+01 5.40897e-01 1.88279e+02 209.665 -4.44592e+01 -2.53236e+01 0.00000e+00 0.00000e+00 2.78001e+02 209.665 8.97216e+01 209.665 0.9902 
1 1 1 -4  99  6  o 8  7.29166e+00 8.25711e-01 1.06560e+02 323.951 1.16452e+01  -8.47594e+00 0.00000e+00 0.00000e+00 1.53979e+02 323.951 4.74188e+01 323.951 0.9646 
1 1 1 -4  99  7  o 5  4.71307e+00 9.25499e-01 8.59832e+01 36.049  6.10367e+00  4.44250e+00  0.00000e+00 0.00000e+00 7.64916e+01 36.049  9.49156e+00 216.049 0.9312 
1 1 1 -4  99  8  o 9  9.99974e+00 8.08078e-01 1.62275e+02 172.698 -3.49007e+01 4.47180e+00  0.00000e+00 0.00000e+00 2.02394e+02 172.698 4.01185e+01 172.698 0.9857 
1 1 1 -4  99  9  o 11 6.64502e+00 1.00089e+00 1.02630e+02 21.287  1.34171e+01  5.22754e+00  0.00000e+00 0.00000e+00 1.34361e+02 21.287  3.17315e+01 21.287  0.9646 
1 1 1 -4  99  10 o 2  3.29256e+00 9.98623e-01 8.68411e+01 197.676 -6.13912e+00 -1.95644e+00 0.00000e+00 0.00000e+00 2.49173e+01 197.676 6.19239e+01 17.676  0.9187 
1 1 1 -4  99  11 o 8  2.77049e+00 9.18796e-01 3.47099e+01 177.586 -2.49119e+00 1.05007e-01  0.00000e+00 0.00000e+00 4.34552e+01 177.586 8.74531e+00 177.586 0.7643 
1 1 1 -4  99  12 o 7  4.29131e+00 1.21520e+00 4.72139e+01 188.646 -4.36410e+00 -6.63609e-01 0.00000e+00 0.00000e+00 9.17154e+01 188.646 4.45015e+01 188.646 0.8778 
1 1 1 -4  100 1  o 3  3.10231e+00 8.25409e-01 3.48673e+01 43.770  1.42482e+00  1.36493e+00  0.00000e+00 0.00000e+00 4.49305e+01 43.770  1.00632e+01 43.770  0.6933 
1 1 1 -4  100 2  o 18 3.73146e+00 8.34986e-01 9.16623e+01 318.815 4.39362e+00  -3.84433e+00 0.00000e+00 0.00000e+00 3.42532e+01 318.815 5.74092e+01 138.815 0.9098 
1 1 1 -4  100 3  o 1  2.55645e+00 7.34887e-01 7.83884e+01 289.668 1.23716e+00  -3.46126e+00 0.00000e+00 0.00000e+00 2.16385e+00 289.668 7.62246e+01 109.668 0.8498 
1 1 1 -4  100 4  o 4  2.57484e+00 7.62784e-01 6.09987e+01 70.344  9.57588e-01  2.68090e+00  0.00000e+00 0.00000e+00 1.51595e+01 70.344  4.58392e+01 250.344 0.7980 
1 1 1 -4  100 5  o 10 8.34613e+00 6.29701e-01 8.35599e+01 339.483 1.29196e+01  -4.83479e+00 0.00000e+00 0.00000e+00 2.14231e+02 339.483 1.30672e+02 339.483 0.9630 
1 1 1 -4  100 6  o 18 5.56543e+00 9.37688e-01 1.21902e+02 275.325 1.12391e+00  -1.20580e+01 0.00000e+00 0.00000e+00 7.54898e+01 275.325 4.64121e+01 95.325  0.9578 
1 1 1 -4  100 7  o 17 4.58086e+00 9.54444e-01 5.75085e+01 157.785 -4.54912e+00 1.85786e+00  0.00000e+00 0.00000e+00 9.36096e+01 157.785 3.61011e+01 157.785 0.8913 
1 1 1 -4  100 8  o 12 3.24568e+00 9.03165e-01 4.85285e+01 351.034 3.11465e+00  -4.91416e-01 0.00000e+00 0.00000e+00 4.99960e+01 351.034 1.46749e+00 351.034 0.8207 
1 1 1 -4  100 9  f 0  2.72238e+00 8.74404e-01 4.32395e+01 88.506  7.61118e-02  2.91800e+00  0.00000e+00 0.00000e+00 3.76442e+01 88.506  5.59533e+00 268.506 0.8038 
1 1 1 -4  100 10 f 0  4.25905e+00 1.12077e+00 5.52532e+01 150.194 -4.09995e+00 2.34860e+00  0.00000e+00 0.00000e+00 8.42135e+01 150.194 2.89603e+01 150.194 0.8866 
1 1 1 -4  100 11 o 4  3.45716e+00 1.04833e+00 2.60031e+01 318.732 1.72386e+00  -1.51277e+00 0.00000e+00 0.00000e+00 6.84804e+01 318.732 4.24773e+01 318.732 0.7405 
1 1 1 -4  101 1  o 12 8.09304e+00 6.20386e-01 1.74125e+02 115.424 -1.17229e+01 2.46620e+01  0.00000e+00 0.00000e+00 1.20499e+02 115.424 5.36262e+01 295.424 0.9815 
1 1 1 -4  101 2  o 1  4.41731e+00 8.30077e-01 7.52827e+01 127.064 -3.25057e+00 4.30362e+00  0.00000e+00 0.00000e+00 7.24251e+01 127.064 2.85759e+00 307.064 0.9018 
1 1 1 -4  101 3  o 10 4.97413e+00 8.06690e-01 1.08965e+02 123.116 -5.24645e+00 8.04326e+00  0.00000e+00 0.00000e+00 6.55399e+01 123.116 4.34255e+01 303.116 0.9464 
1 1 1 -4  101 4  o 18 1.30101e+01 5.42126e-01 1.95356e+02 236.872 -2.67120e+01 -4.09321e+01 0.00000e+00 0.00000e+00 2.81779e+02 236.872 8.64222e+01 236.872 0.9897 
1 1 1 -4  101 5  o 6  4.58750e+00 8.80894e-01 6.32478e+01 324.897 4.25408e+00  -2.99016e+00 0.00000e+00 0.00000e+00 8.93072e+01 324.897 2.60594e+01 324.897 0.8978 
1 1 1 -4  101 6  o 15 7.26447e+00 7.76246e-01 1.22690e+02 147.962 -1.54237e+01 9.65192e+00  0.00000e+00 0.00000e+00 1.38748e+02 147.962 1.60584e+01 147.962 0.9721 
1 1 1 -4  101 7  o 13 6.59004e+00 8.31326e-01 1.38403e+02 354.849 1.95908e+01  -1.76602e+00 0.00000e+00 0.00000e+00 9.91474e+01 354.849 3.92561e+01 174.849 0.9742 
1 1 1 -4  101 8  o 19 4.92285e+00 9.56681e-01 7.54215e+01 100.396 -1.37680e+00 7.50462e+00  0.00000e+00 0.00000e+00 9.42253e+01 100.396 1.88038e+01 100.396 0.9320 
1 1 1 -4  101 9  o 10 4.62380e+00 1.06378e+00 3.60189e+01 93.516  -2.15193e-01 3.50188e+00  0.00000e+00 0.00000e+00 1.07767e+02 93.516  7.17476e+01 93.516  0.8415 
1 1 1 -4  101 10 o 1  3.45678e+00 1.02277e+00 4.13781e+01 272.076 1.28497e-01  -3.54430e+00 0.00000e+00 0.00000e+00 6.62867e+01 272.076 2.49086e+01 272.076 0.8435 
1 1 1 -4  101 11 o 18 4.35098e+00 1.09095e+00 4.66413e+01 58.897  2.57914e+00  4.27491e+00  0.00000e+00 0.00000e+00 9.67457e+01 58.897  5.01045e+01 58.897  0.8932 
1 1 1 -4  102 1  o 6  5.91922e+00 6.93556e-01 8.30895e+01 231.932 -5.69328e+00 -7.26939e+00 0.00000e+00 0.00000e+00 1.24145e+02 231.932 4.10555e+01 231.932 0.9442 
1 1 1 -4  102 2  o 2  2.75934e+00 7.77723e-01 5.46033e+01 199.227 -2.70862e+00 -9.44694e-01 0.00000e+00 0.00000e+00 2.72068e+01 199.227 2.73966e+01 19.227  0.7998 
1 1 1 -4  102 3  o 1  1.43770e+01 5.37920e-01 2.03136e+02 204.937 -5.10164e+01 -2.37210e+01 0.00000e+00 0.00000e+00 3.24903e+02 204.937 1.21767e+02 204.937 0.9911 
1 1 1 -4  102 4  o 18 1.02162e+01 5.86702e-01 1.66374e+02 28.960  3.11802e+01  1.72551e+01  0.00000e+00 0.00000e+00 2.06737e+02 28.960  4.03627e+01 28.960  0.9859 
1 1 1 -4  102 5  o 12 2.76587e+00 7.87884e-01 4.90035e+01 57.191  1.50385e+00  2.33276e+00  0.00000e+00 0.00000e+00 3.21018e+01 57.191  1.69016e+01 237.191 0.7919 
1 1 1 -4  102 6  o 7  5.79492e+00 8.43520e-01 1.06643e+02 141.352 -9.66603e+00 7.72956e+00  0.00000e+00 0.00000e+00 9.89742e+01 141.352 7.66840e+00 321.352 0.9587 
1 1 1 -4  102 7  o 9  3.76350e+00 9.64320e-01 7.84288e+01 0.945   5.78004e+00  9.53248e-02  0.00000e+00 0.00000e+00 4.80881e+01 0.945   3.03407e+01 180.945 0.9088 
1 1 1 -4  102 8  o 4  2.81588e+00 8.23598e-01 4.11722e+01 264.730 -2.64381e-01 -2.86651e+00 0.00000e+00 0.00000e+00 4.21657e+01 264.730 9.93490e-01 264.730 0.8006 
1 1 1 -4  102 9  o 8  5.64329e+00 1.03273e+00 1.04337e+02 31.095  1.10389e+01  6.65782e+00  0.00000e+00 0.00000e+00 9.58790e+01 31.095  8.45817e+00 211.095 0.9604 
1 1 1 -4  102 10 o 7  4.26102e+00 1.10185e+00 8.14645e+01 142.703 -6.08731e+00 4.63678e+00  0.00000e+00 0.00000e+00 6.51578e+01 142.703 1.63067e+01 322.703 0.9322 
1 1 1 -4  102 11 o 1  5.04656e+00 1.24345e+00 1.13701e+02 26.966  1.12012e+01  5.69889e+00  0.00000e+00 0.00000e+00 6.48731e+01 26.966  4.88282e+01 206.966 0.9594 
1 1 1 -4  103 1  o 10 5.64461e+00 7.34436e-01 9.69817e+01 276.307 1.06418e+00  -9.62876e+00 0.00000e+00 0.00000e+00 1.01148e+02 276.307 4.16621e+00 276.307 0.9469 
1 1 1 -4  103 2  o 6  3.28330e+00 8.38868e-01 7.19237e+01 74.334  1.13403e+00  4.04358e+00  0.00000e+00 0.00000e+00 3.40325e+01 74.334  3.78912e+01 254.334 0.8708 
1 1 1 -4  103 3  f 0  1.04806e+01 5.69685e-01 1.28082e+02 46.504  1.95222e+01  2.05749e+01  0.00000e+00 0.00000e+00 2.53299e+02 46.504  1.25217e+02 46.504  0.9822 
1 1 1 -4  103 4  o 14 1.33381e+01 5.59064e-01 2.29245e+02 238.583 -3.50012e+01 -5.73020e+01 0.00000e+00 0.00000e+00 2.61032e+02 238.583 3.17870e+01 238.583 0.9925 
1 1 1 -4  103 5  o 9  9.11977e+00 6.45426e-01 1.36528e+02 102.658 -6.14182e+00 2.73478e+01  0.00000e+00 0.00000e+00 1.94994e+02 102.658 5.84661e+01 102.658 0.9820 
1 1 1 -4  103 6  o 17 2.71827e+00 8.16390e-01 5.96199e+01 313.184 2.41485e+00  -2.57297e+00 0.00000e+00 0.00000e+00 2.51245e+01 313.184 3.44954e+01 133.184 0.8426 
1 1 1 -4  103 7  o 6  8.24279e+00 7.42246e-01 9.51911e+01 278.100 2.64055e+00  -1.85526e+01 0.00000e+00 0.00000e+00 2.01374e+02 278.100 1.06183e+02 278.100 0.9729 
1 1 1 -4  103 8  o 16 2.54615e+00 8.11137e-01 5.31288e+01 286.167 9.85243e-01  -3.39864e+00 0.00000e+00 0.00000e+00 2.62035e+01 286.167 2.69253e+01 106.167 0.8431 
1 1 1 -4  103 9  o 13 2.92317e+00 8.90942e-01 5.16908e+01 313.167 2.50351e+00  -2.66908e+00 0.00000e+00 0.00000e+00 3.99664e+01 313.167 1.17244e+01 133.167 0.8490 
1 1 1 -4  103 10 f 0  4.71791e+00 1.10464e+00 9.21473e+01 137.583 -7.37720e+00 6.74040e+00  0.00000e+00 0.00000e+00 7.30062e+01 137.583 1.91411e+01 317.583 0.9486 
1 1 1 -4  103 11 o 18 3.58656e+00 1.05205e+00 1.03041e+02 340.995 9.49186e+00  -3.26919e+00 0.00000e+00 0.00000e+00 2.24407e+01 340.995 8.06003e+01 160.995 0.9488 
1 1 1 -4  104 1  o 15 4.24214e+00 8.19519e-01 7.90959e+01 200.678 -5.84238e+00 -2.20505e+00 0.00000e+00 0.00000e+00 6.49081e+01 200.678 1.41878e+01 20.678  0.9160 
1 1 1 -4  104 2  o 2  4.99629e+00 8.15194e-01 6.57946e+01 142.939 -4.88227e+00 3.68720e+00  0.00000e+00 0.00000e+00 1.03426e+02 142.939 3.76312e+01 142.939 0.9142 
1 1 1 -4  104 3  o 7  7.68826e+00 6.72647e-01 1.09874e+02 281.112 3.38268e+00  -1.72227e+01 0.00000e+00 0.00000e+00 1.66648e+02 281.112 5.67739e+01 281.112 0.9711 
1 1 1 -4  104 4  o 16 9.44505e+00 6.25739e-01 1.61276e+02 120.593 -1.76670e+01 2.98811e+01  0.00000e+00 0.00000e+00 1.83344e+02 120.593 2.20675e+01 120.593 0.9855 
1 1 1 -4  104 5  o 15 7.76941e+00 7.11015e-01 1.10951e+02 297.592 8.57682e+00  -1.64117e+01 0.00000e+00 0.00000e+00 1.68704e+02 297.592 5.77534e+01 297.592 0.9726 
1 1 1 -4  104 6  o 7  4.78031e+00 9.39896e-01 7.76147e+01 32.548  6.11376e+00  3.90204e+00  0.00000e+00 0.00000e+00 8.65202e+01 32.548  8.90551e+00 32.548  0.9283 
1 1 1 -4  104 7  o 18 9.26692e+00 7.15001e-01 1.10058e+02 351.315 2.63060e+01  -4.01836e+00 0.00000e+00 0.00000e+00 2.26030e+02 351.315 1.15971e+02 351.315 0.9810 
1 1 1 -4  104 8  o 4  3.04464e+00 9.08165e-01 4.21551e+01 11.155  2.97907e+00  5.87462e-01  0.00000e+00 0.00000e+00 4.92570e+01 11.155  7.10185e+00 11.155  0.8126 
1 1 1 -4  104 9  o 5  4.85078e+00 1.01302e+00 8.29890e+01 135.691 -7.03041e+00 6.86283e+00  0.00000e+00 0.00000e+00 8.67310e+01 135.691 3.74195e+00 135.691 0.9477 
1 1 1 -4  104 10 o 17 4.01684e+00 1.05493e+00 6.26194e+01 52.000  3.95048e+00  5.05647e+00  0.00000e+00 0.00000e+00 7.34806e+01 52.000  1.08612e+01 52.000  0.9184 
1 1 1 -4  105 1  o 9  2.05705e+00 6.69753e-01 1.45291e+01 31.965  5.27849e-01  3.29389e-01  0.00000e+00 0.00000e+00 8.10175e+00 31.965  6.42736e+00 211.965 0.2970 
1 1 1 -4  105 2  o 11 2.75423e+00 8.19707e-01 2.50402e+01 355.168 1.38042e+00  -1.16688e-01 0.00000e+00 0.00000e+00 3.27490e+01 355.168 7.70882e+00 355.168 0.5665 
1 1 1 -4  105 3  o 2  4.97110e+00 8.11375e-01 8.67313e+01 48.039  5.90451e+00  6.56663e+00  0.00000e+00 0.00000e+00 8.65773e+01 48.039  1.54046e-01 228.039 0.9416 
1 1 1 -4  105 4  o 2  4.01973e+00 8.44238e-01 7.12180e+01 122.735 -3.09731e+00 4.81811e+00  0.00000e+00 0.00000e+00 6.38648e+01 122.735 7.35319e+00 302.735 0.9079 
1 1 1 -4  105 5  f 0  4.94684e+00 8.72241e-01 7.72447e+01 329.967 6.86974e+00  -3.97150e+00 0.00000e+00 0.00000e+00 9.38208e+01 329.967 1.65761e+01 329.967 0.9347 
1 1 1 -4  105 6  o 14 2.72160e+00 8.09416e-01 5.48067e+01 228.916 -2.23691e+00 -2.56569e+00 0.00000e+00 0.00000e+00 2.93220e+01 228.916 2.54848e+01 48.916  0.8359 
1 1 1 -4  105 7  o 14 3.10152e+00 8.04840e-01 1.48200e+01 39.104  9.38589e-01  7.62888e-01  0.00000e+00 0.00000e+00 4.42957e+01 39.104  2.94757e+01 39.104  0.5157 
1 1 1 -4  105 8  o 5  5.14536e+00 1.01381e+00 1.22903e+02 207.990 -1.19982e+01 -6.37695e+00 0.00000e+00 0.00000e+00 6.00104e+01 207.990 6.28922e+01 27.990  0.9625 
1 1 1 -4  105 9  o 14 5.06766e+00 1.04163e+00 8.04177e+01 15.013  9.15282e+00  2.45475e+00  0.00000e+00 0.00000e+00 9.64679e+01 15.013  1.60502e+01 15.013  0.9457 
1 1 1 -4  105 10 o 13 3.24966e+00 9.39532e-01 2.98448e+01 11.152  2.64164e+00  5.20761e-01  0.00000e+00 0.00000e+00 6.41717e+01 11.152  3.43269e+01 11.152  0.7844 
1 1 1 -4  106 1  o 11 1.24073e+01 5.45730e-01 2.21399e+02 30.397  5.46620e+01  3.20666e+01  0.00000e+00 0.00000e+00 2.34498e+02 30.397  1.30988e+01 30.397  0.9921 
1 1 1 -4  106 2  o 7  1.24612e+01 5.57989e-01 2.01490e+02 162.825 -5.64673e+01 1.74521e+01  0.00000e+00 0.00000e+00 2.56007e+02 162.825 5.45171e+01 162.825 0.9915 
1 1 1 -4  106 3  o 18 3.25386e+00 8.60443e-01 9.27991e+01 111.692 -2.21019e+00 5.55609e+00  0.00000e+00 0.00000e+00 1.70536e+01 111.692 7.57455e+01 291.692 0.9120 
1 1 1 -4  106 4  o 2  1.04319e+01 6.00657e-01 1.65324e+02 290.053 1.46748e+01  -4.02017e+01 0.00000e+00 0.00000e+00 2.16148e+02 290.053 5.08231e+01 290.053 0.9882 
1 1 1 -4  106 5  o 4  3.45621e+00 9.02664e-01 7.79992e+01 21.146  5.08824e+00  1.96807e+00  0.00000e+00 0.00000e+00 3.74316e+01 21.146  4.05676e+01 201.146 0.9030 
1 1 1 -4  106 6  o 15 7.53136e+00 7.63450e-01 1.10767e+02 204.049 -1.97932e+01 -8.83270e+00 0.00000e+00 0.00000e+00 1.61154e+02 204.049 5.03869e+01 204.049 0.9767 
1 1 1 -4  106 7  o 5  4.27357e+00 1.00602e+00 1.01291e+02 333.330 8.53747e+00  -4.28832e+00 0.00000e+00 0.00000e+00 4.81003e+01 333.330 5.31904e+01 153.330 0.9461 
1 1 1 -4  106 8  o 13 4.26690e+00 1.00642e+00 8.09882e+01 203.582 -7.98273e+00 -3.48459e+00 0.00000e+00 0.00000e+00 6.72249e+01 203.582 1.37633e+01 23.582  0.9407 
1 1 1 -4  106 9  o 6  6.14083e+00 9.50908e-01 1.26648e+02 7.519   2.16559e+01  2.85834e+00  0.00000e+00 0.00000e+00 9.46971e+01 7.519   3.19509e+01 187.519 0.9768 
1 1 1 -4  106 10 o 13 4.43555e+00 1.07377e+00 7.52241e+01 136.072 -6.38243e+00 6.14791e+00  0.00000e+00 0.00000e+00 7.88001e+01 136.072 3.57596e+00 136.072 0.9418 
1 1 1 -4  107 1  o 4  2.70099e+00 7.84204e-01 1.26636e+01 67.464  2.72187e-01  6.55949e-01  0.00000e+00 0.00000e+00 2.07829e+01 67.464  8.11933e+00 67.464  0.3344 
1 1 1 -4  107 2  o 5  9.99561e+00 5.92717e-01 1.45657e+02 68.139  1.24014e+01  3.09099e+01  0.00000e+00 0.00000e+00 2.18758e+02 68.139  7.31009e+01 68.139  0.9849 
1 1 1 -4  107 3  o 2  6.15804e+00 7.52200e-01 7.12675e+01 235.167 -5.63439e+00 -8.09699e+00 0.00000e+00 0.00000e+00 1.44737e+02 235.167 7.34695e+01 235.167 0.9479 
1 1 1 -4  107 4  o 10 8.79675e+00 6.74087e-01 1.44132e+02 311.415 1.93870e+01  -2.19789e+01 0.00000e+00 0.00000e+00 1.75676e+02 311.415 3.15440e+01 311.415 0.9828 
1 1 1 -4  107 5  o 12 2.83142e+00 8.49317e-01 6.92674e+01 121.092 -2.24779e+00 3.72732e+00  0.00000e+00 0.00000e+00 2.24272e+01 121.092 4.68403e+01 301.092 0.8758 
1 1 1 -4  107 6  o 4  5.39938e+00 9.14086e-01 1.00345e+02 293.907 5.29095e+00  -1.19358e+01 0.00000e+00 0.00000e+00 9.14013e+01 293.907 8.94357e+00 113.907 0.9609 
1 1 1 -4  107 7  o 18 3.01970e+00 8.85952e-01 3.39459e+01 242.471 -1.12756e+00 -2.16334e+00 0.00000e+00 0.00000e+00 5.06288e+01 242.471 1.66829e+01 242.471 0.7583 
1 1 1 -4  107 8  o 12 3.60838e+00 9.68229e-01 9.65101e+01 90.588  -8.69669e-02 8.47315e+00  0.00000e+00 0.00000e+00 2.85635e+01 90.588  6.79466e+01 270.588 0.9390 
1 1 1 -4  107 9  o 13 4.11315e+00 9.66489e-01 2.61962e+01 192.295 -2.92995e+00 -6.38583e-01 0.00000e+00 0.00000e+00 9.66881e+01 192.295 7.04919e+01 192.295 0.8099 
1 1 1 -4  107 10 o 5  3.00324e+00 9.05538e-01 3.67788e+01 188.334 -3.35439e+00 -4.91390e-01 0.00000e+00 0.00000e+00 5.56760e+01 188.334 1.88972e+01 188.334 0.8352 
1 1 1 -4  108 1  o 10 3.56540e+00 8.80895e-01 7.17852e+01 210.899 -4.54044e+00 -2.71731e+00 0.00000e+00 0.00000e+00 4.69581e+01 210.899 2.48271e+01 30.899  0.8997 
1 1 1 -4  108 2  o 1  5.92369e+00 7.96301e-01 8.96346e+01 156.622 -1.06337e+01 4.59681e+00  0.00000e+00 0.00000e+00 1.19895e+02 156.622 3.02602e+01 156.622 0.9558 
1 1 1 -4  108 3  o 6  5.82019e+00 8.38332e-01 1.17201e+02 95.500  -1.36580e+00 1.41847e+01  0.00000e+00 0.00000e+00 9.04189e+01 95.500  2.67819e+01 275.500 0.9642 
1 1 1 -4  108 4  o 19 4.93793e+00 8.72187e-01 1.04719e+02 204.329 -1.03048e+01 -4.65916e+00 0.00000e+00 0.00000e+00 6.96204e+01 204.329 3.50988e+01 24.329  0.9547 
1 1 1 -4  108 5  o 12 6.59062e+00 9.24988e-01 1.22319e+02 250.621 -6.37340e+00 -1.81196e+01 0.00000e+00 0.00000e+00 1.14874e+02 250.621 7.44536e+00 70.621  0.9736 
1 1 1 -4  108 6  o 12 4.39580e+00 9.65814e-01 5.78699e+01 61.112  2.77672e+00  5.03244e+00  0.00000e+00 0.00000e+00 8.96389e+01 61.112  3.17690e+01 61.112  0.9083 
1 1 1 -4  108 7  o 4  2.89598e+00 8.75358e-01 8.97363e+00 343.959 6.30491e-01  -1.81280e-01 0.00000e+00 0.00000e+00 2.43425e+01 343.959 1.53689e+01 343.959 0.3115 
1 1 1 -4  108 8  o 10 3.94815e+00 9.90286e-01 6.10310e+01 177.582 -6.16539e+00 2.60370e-01  0.00000e+00 0.00000e+00 7.22740e+01 177.582 1.12430e+01 177.582 0.9149 
1 1 1 -4  108 9  o 10 4.01292e+00 1.04515e+00 3.65185e+01 236.821 -2.14988e+00 -3.28803e+00 0.00000e+00 0.00000e+00 9.08574e+01 236.821 5.43389e+01 236.821 0.8607 
1 1 1 -4  108 10 o 8  2.64899e+00 8.63065e-01 6.84646e+01 90.733  -8.39691e-02 6.56068e+00  0.00000e+00 0.00000e+00 2.13702e+01 90.733  4.70943e+01 270.733 0.9203 
1 1 1 -4  109 1  o 7  2.44844e+00 7.39724e-01 5.62653e+01 254.513 -8.17798e-01 -2.95148e+00 0.00000e+00 0.00000e+00 1.75331e+01 254.513 3.87323e+01 74.513  0.8145 
1 1 1 -4  109 2  o 18 3.58420e+00 8.72601e-01 5.49178e+01 134.924 -2.86799e+00 2.87558e+00  0.00000e+00 0.00000e+00 5.98921e+01 134.924 4.97432e+00 134.924 0.8658 
1 1 1 -4  109 3  o 18 2.48836e+00 7.70615e-01 7.16693e+01 107.060 -1.22671e+00 3.99737e+00  0.00000e+00 0.00000e+00 8.41006e+00 107.060 6.32592e+01 287.060 0.8702 
1 1 1 -4  109 4  o 12 5.63375e+00 8.33960e-01 1.26338e+02 111.617 -6.45626e+00 1.62924e+01  0.00000e+00 0.00000e+00 7.59099e+01 111.617 5.04277e+01 291.617 0.9710 
1 1 1 -4  109 5  f 0  6.98782e+00 9.95830e-01 1.03371e+02 270.574 1.50094e-01  -1.49779e+01 0.00000e+00 0.00000e+00 1.46082e+02 270.574 4.27106e+01 270.574 0.9660 
1 1 1 -4  109 6  o 8  8.16243e+00 7.55181e-01 1.26554e+02 14.809  2.62157e+01  6.93100e+00  0.00000e+00 0.00000e+00 1.69318e+02 14.809  4.27640e+01 14.809  0.9814 
1 1 1 -4  109 7  o 11 3.03927e+00 8.45565e-01 4.98038e+01 183.051 -4.08852e+00 -2.17929e-01 0.00000e+00 0.00000e+00 4.74746e+01 183.051 2.32916e+00 3.051   0.8671 
1 1 1 -4  109 8  o 3  3.98305e+00 1.00684e+00 7.78775e+01 340.737 7.21022e+00  -2.51978e+00 0.00000e+00 0.00000e+00 5.90777e+01 340.737 1.87999e+01 160.737 0.9320 
1 1 1 -4  109 9  o 7  3.25910e+00 9.55498e-01 5.12263e+01 126.752 -3.00358e+00 4.02191e+00  0.00000e+00 0.00000e+00 5.61711e+01 126.752 4.94477e+00 126.752 0.8938 
1 1 1 -4  110 1  o 1  6.05451e+00 8.01583e-01 1.10886e+02 137.154 -1.13037e+01 1.04841e+01  0.00000e+00 0.00000e+00 1.05703e+02 137.154 5.18373e+00 317.154 0.9670 
1 1 1 -4  110 2  o 17 3.88025e+00 8.70776e-01 9.89135e+01 72.252  2.73132e+00  8.53384e+00  0.00000e+00 0.00000e+00 3.63330e+01 72.252  6.25805e+01 252.252 0.9424 
1 1 1 -4  110 3  o 15 5.00891e+00 9.13554e-01 8.44492e+01 34.526  8.06742e+00  5.55000e+00  0.00000e+00 0.00000e+00 9.10168e+01 34.526  6.56758e+00 34.526  0.9475 
1 1 1 -4  110 4  o 19 2.30896e+00 7.29799e-01 3.69338e+01 202.496 -1.98540e+00 -8.22203e-01 0.00000e+00 0.00000e+00 2.45747e+01 202.496 1.23591e+01 22.496  0.7208 
1 1 1 -4  110 5  o 8  6.83997e+00 9.58360e-01 1.73591e+02 153.413 -2.47343e+01 1.23791e+01  0.00000e+00 0.00000e+00 7.44858e+01 153.413 9.91053e+01 333.413 0.9818 
1 1 1 -4  110 6  o 5  4.33039e+00 9.88092e-01 7.96480e+01 300.738 4.51957e+00  -7.60022e+00 0.00000e+00 0.00000e+00 7.09165e+01 300.738 8.73158e+00 120.738 0.9416 
1 1 1 -4  110 7  o 5  3.54805e+00 9.51252e-01 7.43003e+01 231.091 -4.50610e+00 -5.58262e+00 0.00000e+00 0.00000e+00 4.71342e+01 231.091 2.71661e+01 51.091  0.9274 
1 1 1 -4  110 8  o 7  3.46487e+00 9.40131e-01 6.23448e+01 72.791  1.77433e+00  5.72888e+00  0.00000e+00 0.00000e+00 5.42383e+01 72.791  8.10649e+00 252.791 0.9123 
1 1 1 -4  110 9  o 17 2.93222e+00 9.00207e-01 4.59535e+01 277.887 6.05150e-01  -4.36840e+00 0.00000e+00 0.00000e+00 4.88914e+01 277.887 2.93788e+00 277.887 0.8776 
1 1 1 -4  111 1  o 1  6.46038e+00 8.06032e-01 7.05581e+01 283.081 2.59365e+00  -1.11621e+01 0.00000e+00 0.00000e+00 1.57688e+02 283.081 8.71299e+01 283.081 0.9553 
1 1 1 -4  111 2  o 1  2.78048e+00 8.22699e-01 5.93806e+01 37.870  3.36768e+00  2.61886e+00  0.00000e+00 0.00000e+00 3.03694e+01 37.870  2.90112e+01 217.870 0.8730 
1 1 1 -4  111 3  o 15 5.57711e+00 8.41313e-01 7.44859e+01 94.577  -7.72055e-01 9.64358e+00  0.00000e+00 0.00000e+00 1.20689e+02 94.577  4.62034e+01 94.577  0.9468 
1 1 1 -4  111 4  o 15 4.08817e+00 9.31842e-01 8.11265e+01 243.852 -3.38899e+00 -6.90313e+00 0.00000e+00 0.00000e+00 5.97283e+01 243.852 2.13982e+01 63.852  0.9325 
1 1 1 -4  111 5  o 10 3.48122e+00 9.47852e-01 8.68999e+01 164.506 -6.74384e+00 1.86948e+00  0.00000e+00 0.00000e+00 3.20905e+01 164.506 5.48094e+01 344.506 0.9255 
1 1 1 -4  111 6  o 2  6.88232e+00 8.30027e-01 1.01211e+02 296.859 8.61588e+00  -1.70132e+01 0.00000e+00 0.00000e+00 1.46085e+02 296.859 4.48744e+01 296.859 0.9734 
1 1 1 -4  111 7  o 8  2.62087e+00 7.98846e-01 4.01908e+01 150.704 -2.72837e+00 1.53085e+00  0.00000e+00 0.00000e+00 3.90041e+01 150.704 1.18670e+00 330.704 0.8191 
1 1 1 -4  111 8  f 0  2.70688e+00 8.34959e-01 4.15583e+01 80.557  5.84807e-01  3.51606e+00  0.00000e+00 0.00000e+00 4.27143e+01 80.557  1.15592e+00 80.557  0.8444 
1 1 1 -4  111 9  o 3  2.50893e+00 8.20147e-01 1.48037e+01 204.436 -1.24758e+00 -5.66886e-01 0.00000e+00 0.00000e+00 3.71856e+01 204.436 2.23820e+01 204.436 0.5624 
1 1 1 -4  112 1  o 12 7.74589e+00 7.68371e-01 1.21470e+02 10.420  2.26978e+01  4.17392e+00  0.00000e+00 0.00000e+00 1.58630e+02 10.420  3.71603e+01 10.420  0.9781 
1 1 1 -4  112 2  o 8  4.05936e+00 9.17145e-01 5.06066e+01 272.271 1.93279e-01  -4.87358e+00 0.00000e+00 0.00000e+00 8.29996e+01 272.271 3.23930e+01 272.271 0.8905 
1 1 1 -4  112 3  o 11 3.43424e+00 9.04332e-01 9.29354e+01 142.885 -6.20183e+00 4.69302e+00  0.00000e+00 0.00000e+00 2.54970e+01 142.885 6.74384e+01 322.885 0.9333 
1 1 1 -4  112 4  o 6  3.19799e+00 8.40790e-01 4.44564e+01 84.336  3.53946e-01  3.56849e+00  0.00000e+00 0.00000e+00 5.54129e+01 84.336  1.09565e+01 84.336  0.8455 
1 1 1 -4  112 5  o 14 3.43761e+00 8.99401e-01 9.49878e+01 92.671  -4.11547e-01 8.82057e+00  0.00000e+00 0.00000e+00 2.45114e+01 92.671  7.04764e+01 272.671 0.9415 
1 1 1 -4  112 6  o 6  4.93797e+00 8.81250e-01 9.30241e+01 251.022 -4.23169e+00 -1.23048e+01 0.00000e+00 0.00000e+00 8.20483e+01 251.022 1.09758e+01 71.022  0.9608 
1 1 1 -4  112 7  o 5  2.45665e+00 8.06134e-01 6.11297e+01 340.127 4.45620e+00  -1.61075e+00 0.00000e+00 0.00000e+00 1.92313e+01 340.127 4.18985e+01 160.127 0.8869 
1 1 1 -4  112 8  o 7  4.86510e+00 1.02170e+00 4.52090e+01 66.786  2.36229e+00  5.50803e+00  0.00000e+00 0.00000e+00 1.18377e+02 66.786  7.31678e+01 66.786  0.9123 
1 1 1 -4  112 9  o 18 2.65214e+00 8.50013e-01 3.17078e+01 209.339 -2.64617e+00 -1.48730e+00 0.00000e+00 0.00000e+00 4.76708e+01 209.339 1.59630e+01 209.339 0.8126 
1 1 1 -4  113 1  o 13 2.32226e+00 7.38999e-01 4.57113e+01 226.968 -2.01107e+00 -2.15422e+00 0.00000e+00 0.00000e+00 2.34673e+01 226.968 2.22440e+01 46.968  0.8060 
1 1 1 -4  113 2  o 19 2.90719e+00 8.21849e-01 8.07446e+01 267.239 -2.82876e-01 -5.86606e+00 0.00000e+00 0.00000e+00 1.70458e+01 267.239 6.36987e+01 87.239  0.9103 
1 1 1 -4  113 3  o 8  3.20050e+00 8.67925e-01 6.48293e+01 289.701 1.72614e+00  -4.82066e+00 0.00000e+00 0.00000e+00 4.11104e+01 289.701 2.37188e+01 109.701 0.8961 
1 1 1 -4  113 4  o 4  7.09513e+00 8.02476e-01 9.99617e+01 17.668  1.99342e+01  6.34963e+00  0.00000e+00 0.00000e+00 1.55686e+02 17.668  5.57244e+01 17.668  0.9758 
1 1 1 -4  113 5  o 12 5.87863e+00 9.31617e-01 1.30472e+02 175.718 -2.12294e+01 1.58955e+00  0.00000e+00 0.00000e+00 8.13435e+01 175.718 4.91281e+01 355.718 0.9762 
1 1 1 -4  113 6  o 5  2.73217e+00 8.40883e-01 2.27748e+01 256.474 -4.58966e-01 -1.90790e+00 0.00000e+00 0.00000e+00 4.69214e+01 256.474 2.41465e+01 256.474 0.6915 
1 1 1 -4  113 7  o 14 3.59606e+00 1.01263e+00 5.43837e+01 317.215 3.81678e+00  -3.53246e+00 0.00000e+00 0.00000e+00 6.46574e+01 317.215 1.02737e+01 317.215 0.8978 
1 1 1 -4  113 8  o 18 3.27202e+00 9.27259e-01 3.28876e+01 174.536 -3.59971e+00 3.44332e-01  0.00000e+00 0.00000e+00 6.92243e+01 174.536 3.63367e+01 174.536 0.8469 
1 1 1 -4  114 1  f 0  2.69498e+00 8.09842e-01 1.29176e+01 21.077  8.38802e-01  3.23282e-01  0.00000e+00 0.00000e+00 2.78524e+01 21.077  1.49349e+01 21.077  0.4094 
1 1 1 -4  114 2  o 8  3.47146e+00 8.74203e-01 6.46776e+01 326.517 4.73326e+00  -3.13082e+00 0.00000e+00 0.00000e+00 5.16285e+01 326.517 1.30491e+01 146.517 0.9070 
1 1 1 -4  114 3  o 3  2.69756e+00 8.10538e-01 3.90156e+01 240.250 -1.52897e+00 -2.67517e+00 0.00000e+00 0.00000e+00 4.22512e+01 240.250 3.23558e+00 240.250 0.8158 
1 1 1 -4  114 4  o 19 3.47320e+00 9.00295e-01 5.89496e+01 273.737 3.51776e-01  -5.38552e+00 0.00000e+00 0.00000e+00 5.66738e+01 273.737 2.27589e+00 93.737  0.9018 
1 1 1 -4  114 5  f 0  4.52781e+00 9.44385e-01 8.45969e+01 63.937  4.75266e+00  9.71740e+00  0.00000e+00 0.00000e+00 7.45478e+01 63.937  1.00491e+01 243.937 0.9526 
1 1 1 -4  114 6  o 14 6.40628e+00 9.29899e-01 1.33423e+02 281.352 4.71302e+00  -2.34763e+01 0.00000e+00 0.00000e+00 9.78477e+01 281.352 3.55752e+01 101.352 0.9789 
1 1 1 -4  114 7  o 18 2.40521e+00 8.00678e-01 2.55374e+01 208.871 -1.83754e+00 -1.01317e+00 0.00000e+00 0.00000e+00 3.76967e+01 208.871 1.21593e+01 208.871 0.7133 
1 1 1 -4  114 8  o 3  2.64404e+00 8.40055e-01 5.14494e+01 348.016 4.63428e+00  -9.83718e-01 0.00000e+00 0.00000e+00 3.49319e+01 348.016 1.65175e+01 168.016 0.8869 
1 1 1 -4  115 1  o 6  3.95219e+00 8.94239e-01 8.21721e+01 181.699 -8.82178e+00 -2.61709e-01 0.00000e+00 0.00000e+00 5.52715e+01 181.699 2.69007e+01 1.699   0.9415 
1 1 1 -4  115 2  o 13 5.38782e+00 8.75022e-01 1.16553e+02 274.679 1.35152e+00  -1.65115e+01 0.00000e+00 0.00000e+00 7.63035e+01 274.679 4.02498e+01 94.679  0.9693 
1 1 1 -4  115 3  o 19 2.94437e+00 8.30541e-01 5.62691e+01 327.526 4.27046e+00  -2.71783e+00 0.00000e+00 0.00000e+00 4.09901e+01 327.526 1.52791e+01 147.526 0.8948 
1 1 1 -4  115 4  o 17 3.65487e+00 9.34219e-01 3.29060e+01 58.721  1.78246e+00  2.93404e+00  0.00000e+00 0.00000e+00 8.00530e+01 58.721  4.71469e+01 58.721  0.8375 
1 1 1 -4  115 5  o 10 2.70927e+00 8.15856e-01 2.17073e+01 70.505  6.06057e-01  1.71189e+00  0.00000e+00 0.00000e+00 4.47610e+01 70.505  2.30536e+01 70.505  0.6651 
1 1 1 -4  115 6  o 4  2.62369e+00 7.94525e-01 4.22099e+01 166.576 -3.84040e+00 9.16639e-01  0.00000e+00 0.00000e+00 4.11226e+01 166.576 1.08738e+00 346.576 0.8615 
1 1 1 -4  115 7  o 19 4.01146e+00 1.04620e+00 9.91537e+01 213.773 -9.70113e+00 -6.48783e+00 0.00000e+00 0.00000e+00 4.21746e+01 213.773 5.69791e+01 33.773  0.9561 
1 1 1 -4  116 1  o 5  2.17332e+00 7.14125e-01 9.69593e+00 10.172  7.05111e-01  1.26518e-01  0.00000e+00 0.00000e+00 1.73494e+01 10.172  7.65349e+00 10.172  0.3370 
1 1 1 -4  116 2  o 10 5.20037e+00 8.26300e-01 1.06082e+02 0.833   1.64445e+01  2.39107e-01  0.00000e+00 0.00000e+00 7.99618e+01 0.833   2.61207e+01 180.833 0.9691 
1 1 1 -4  116 3  o 3  4.17974e+00 9.07371e-01 6.30262e+01 144.199 -6.25892e+00 4.51431e+00  0.00000e+00 0.00000e+00 8.08513e+01 144.199 1.78250e+01 144.199 0.9328 
1 1 1 -4  116 4  o 15 2.56036e+00 8.01072e-01 4.15178e+01 216.656 -2.67181e+00 -1.98834e+00 0.00000e+00 0.00000e+00 3.70414e+01 216.656 4.47640e+00 36.656  0.8317 
1 1 1 -4  116 5  o 13 3.09267e+00 8.87727e-01 2.31316e+01 302.861 1.16916e+00  -1.80993e+00 0.00000e+00 0.00000e+00 5.91608e+01 302.861 3.60292e+01 302.861 0.7216 
1 1 1 -4  116 6  o 4  2.55923e+00 8.11359e-01 2.60636e+01 80.959  3.77835e-01  2.37454e+00  0.00000e+00 0.00000e+00 4.50734e+01 80.959  1.90098e+01 80.959  0.7542 
1 1 1 -4  116 7  f 0  3.31046e+00 9.53462e-01 6.19521e+01 295.289 2.69897e+00  -5.71250e+00 0.00000e+00 0.00000e+00 4.98727e+01 295.289 1.20794e+01 115.289 0.9170 
1 1 1 -4  117 1  o 5  3.43147e+00 8.79953e-01 7.28126e+01 80.544  1.23485e+00  7.41452e+00  0.00000e+00 0.00000e+00 4.50994e+01 80.544  2.77131e+01 260.544 0.9309 
1 1 1 -4  117 2  o 5  3.72414e+00 9.06085e-01 4.02174e+01 348.460 3.95950e+00  -8.08452e-01 0.00000e+00 0.00000e+00 7.86763e+01 348.460 3.84589e+01 348.460 0.8651 
1 1 1 -4  117 3  o 15 2.98060e+00 8.56190e-01 5.67310e+01 278.680 7.58996e-01  -4.97168e+00 0.00000e+00 0.00000e+00 4.15806e+01 278.680 1.51504e+01 98.680  0.8941 
1 1 1 -4  117 4  o 12 2.53338e+00 8.00865e-01 3.78157e+01 308.306 2.04633e+00  -2.59050e+00 0.00000e+00 0.00000e+00 3.97293e+01 308.306 1.91359e+00 308.306 0.8300 
1 1 1 -4  117 5  o 7  5.61654e+00 9.04665e-01 1.26491e+02 89.174  3.14795e-01  2.18449e+01  0.00000e+00 0.00000e+00 7.57532e+01 89.174  5.07375e+01 269.174 0.9768 
1 1 1 -4  117 6  o 19 2.29979e+00 7.58537e-01 6.73411e+01 240.420 -3.02076e+00 -5.32179e+00 0.00000e+00 0.00000e+00 1.01204e+01 240.420 5.72207e+01 60.420  0.9142 
1 1 1 -4  117 7  o 10 2.47493e+00 8.09313e-01 4.39314e+01 242.124 -2.01755e+00 -3.81432e+00 0.00000e+00 0.00000e+00 3.57786e+01 242.124 8.15271e+00 62.124  0.8746 
1 1 1 -4  118 1  o 2  3.94544e+00 9.48329e-01 8.35049e+01 40.390  6.83769e+00  5.81728e+00  0.00000e+00 0.00000e+00 5.37217e+01 40.390  2.97832e+01 220.390 0.9425 
1 1 1 -4  118 2  o 10 2.68854e+00 8.08349e-01 6.84452e+01 206.658 -5.17395e+00 -2.59748e+00 0.00000e+00 0.00000e+00 2.17104e+01 206.658 4.67348e+01 26.658  0.9090 
1 1 1 -4  118 3  o 15 2.48738e+00 7.89998e-01 2.48528e+01 77.720  4.35733e-01  2.00188e+00  0.00000e+00 0.00000e+00 3.98777e+01 77.720  1.50249e+01 77.720  0.7056 
1 1 1 -4  118 4  o 19 2.49257e+00 7.76306e-01 4.07477e+01 267.756 -1.29713e-01 -3.31023e+00 0.00000e+00 0.00000e+00 3.55867e+01 267.756 5.16104e+00 87.756  0.8307 
1 1 1 -4  118 5  o 17 3.00891e+00 8.64137e-01 5.43322e+01 256.345 -1.33548e+00 -5.49733e+00 0.00000e+00 0.00000e+00 4.62007e+01 256.345 8.13146e+00 76.345  0.9067 
1 1 1 -4  118 6  o 5  2.11991e+00 7.11542e-01 3.38249e+01 58.798  1.56585e+00  2.58534e+00  0.00000e+00 0.00000e+00 2.95486e+01 58.798  4.27637e+00 238.798 0.8116 
1 1 1 -4  119 1  o 14 3.60411e+00 8.97099e-01 7.14155e+01 312.777 5.21538e+00  -5.63657e+00 0.00000e+00 0.00000e+00 5.25518e+01 312.777 1.88637e+01 132.777 0.9324 
1 1 1 -4  119 2  o 13 4.14390e+00 9.32324e-01 6.11089e+01 7.312   7.74487e+00  9.93739e-01  0.00000e+00 0.00000e+00 8.15673e+01 7.312   2.04584e+01 7.312   0.9336 
1 1 1 -4  119 3  o 16 3.22812e+00 8.83384e-01 6.53405e+01 143.427 -5.32417e+00 3.95013e+00  0.00000e+00 0.00000e+00 4.42907e+01 143.427 2.10498e+01 323.427 0.9211 
1 1 1 -4  119 4  o 5  3.61590e+00 9.47881e-01 3.01191e+01 214.719 -2.82593e+00 -1.95817e+00 0.00000e+00 0.00000e+00 8.15286e+01 214.719 5.14095e+01 214.719 0.8378 
1 1 1 -4  119 5  o 14 3.74309e+00 9.04377e-01 7.57796e+01 58.046  4.87897e+00  7.82206e+00  0.00000e+00 0.00000e+00 5.44021e+01 58.046  2.13775e+01 238.046 0.9441 
1 1 1 -4  119 6  o 8  2.58959e+00 8.21707e-01 5.95811e+01 125.874 -3.56503e+00 4.92954e+00  0.00000e+00 0.00000e+00 2.75336e+01 125.874 3.20475e+01 305.874 0.9136 
1 1 1 -4  120 1  o 6  6.30026e+00 8.81768e-01 8.03383e+01 30.974  1.36574e+01  8.19765e+00  0.00000e+00 0.00000e+00 1.44582e+02 30.974  6.42442e+01 30.974  0.9681 
1 1 1 -4  120 2  o 6  2.64208e+00 8.15281e-01 5.61869e+01 119.036 -2.58646e+00 4.65911e+00  0.00000e+00 0.00000e+00 3.15281e+01 119.036 2.46589e+01 299.036 0.9005 
1 1 1 -4  120 3  o 16 2.42474e+00 7.66874e-01 2.25539e+01 265.933 -1.49297e-01 -2.10000e+00 0.00000e+00 0.00000e+00 4.12838e+01 265.933 1.87299e+01 265.933 0.7143 
1 1 1 -4  120 4  o 3  2.73725e+00 8.10834e-01 7.27614e+01 245.726 -2.94581e+00 -6.53219e+00 0.00000e+00 0.00000e+00 2.07581e+01 245.726 5.20033e+01 65.726  0.9273 
1 1 1 -4  120 5  o 5  1.98039e+00 6.53378e-01 3.85406e+01 275.194 3.29145e-01  -3.62124e+00 0.00000e+00 0.00000e+00 2.32984e+01 275.194 1.52422e+01 95.193  0.8479 
1 1 1 -4  120 6  f 0  2.30427e+00 7.60660e-01 2.35228e+01 88.841  5.01065e-02  2.47766e+00  0.00000e+00 0.00000e+00 4.11577e+01 88.841  1.76349e+01 88.841  0.7626 
1 1 1 -4  121 1  o 1  2.57653e+00 8.00804e-01 5.85051e+01 203.871 -5.35759e+00 -2.37091e+00 0.00000e+00 0.00000e+00 2.79405e+01 203.871 3.05646e+01 23.871  0.9101 
1 1 1 -4  121 2  o 14 2.26104e+00 7.29848e-01 3.25791e+01 302.625 1.61943e+00  -2.52979e+00 0.00000e+00 0.00000e+00 3.49417e+01 302.625 2.36264e+00 302.625 0.8103 
1 1 1 -4  121 3  o 15 2.82941e+00 8.47439e-01 3.81724e+01 110.243 -1.29153e+00 3.50210e+00  0.00000e+00 0.00000e+00 5.06872e+01 110.243 1.25148e+01 110.243 0.8524 
1 1 1 -4  121 4  o 2  2.54622e+00 7.85557e-01 5.41152e+01 163.715 -5.40261e+00 1.57831e+00  0.00000e+00 0.00000e+00 3.08637e+01 163.715 2.32514e+01 343.715 0.9062 
1 1 1 -4  121 5  o 19 1.95269e+00 6.64827e-01 1.96855e+01 9.109   1.80463e+00  2.89348e-01  0.00000e+00 0.00000e+00 2.82879e+01 9.109   8.60245e+00 9.109   0.6673 
1 1 1 -4  122 1  f 0  2.56016e+00 7.97000e-01 4.90294e+01 105.663 -1.30018e+00 4.63691e+00  0.00000e+00 0.00000e+00 3.48401e+01 105.663 1.41893e+01 285.663 0.8889 
1 1 1 -4  122 2  o 9  3.70863e+00 8.80325e-01 5.22071e+01 305.270 3.89836e+00  -5.51192e+00 0.00000e+00 0.00000e+00 7.38619e+01 305.270 2.16548e+01 305.270 0.9226 
1 1 1 -4  122 3  o 8  2.60767e+00 7.82047e-01 5.94292e+01 174.159 -6.31932e+00 6.46433e-01  0.00000e+00 0.00000e+00 2.86932e+01 174.159 3.07360e+01 354.159 0.9175 
1 1 1 -4  122 4  o 13 2.45832e+00 7.76131e-01 5.65373e+01 197.371 -5.53277e+00 -1.73075e+00 0.00000e+00 0.00000e+00 2.57447e+01 197.371 3.07926e+01 17.371  0.9091 
1 1 1 -4  122 5  o 7  3.52233e+00 9.24915e-01 6.39640e+01 354.096 8.55567e+00  -8.84687e-01 0.00000e+00 0.00000e+00 5.78786e+01 354.096 6.08546e+00 174.096 0.9399 
1 1 1 -4  123 1  o 9  2.50706e+00 7.81039e-01 3.95620e+01 35.801  3.29983e+00  2.38000e+00  0.00000e+00 0.00000e+00 4.04327e+01 35.801  8.70633e-01 35.801  0.8661 
1 1 1 -4  123 2  o 4  3.18626e+00 8.61576e-01 3.69502e+01 82.912  5.45979e-01  4.39089e+00  0.00000e+00 0.00000e+00 6.60949e+01 82.912  2.91447e+01 82.912  0.8781 
1 1 1 -4  123 3  o 8  2.89239e+00 8.64560e-01 4.86737e+01 184.403 -5.26500e+00 -4.05365e-01 0.00000e+00 0.00000e+00 4.71206e+01 184.403 1.55304e+00 4.403   0.8995 
1 1 1 -4  124 1  o 1  2.46524e+00 7.51153e-01 2.88440e+01 85.975  2.14221e-01  3.04470e+00  0.00000e+00 0.00000e+00 4.50383e+01 85.975  1.61943e+01 85.975  0.8138 
1 1 1 -4  124 2  o 16 5.64286e+00 9.24875e-01 8.34576e+01 335.052 1.58281e+01  -7.36320e+00 0.00000e+00 0.00000e+00 1.18264e+02 335.052 3.48060e+01 335.052 0.9709 
1 1 1 -4  125 1  o 5  2.19493e+00 6.92837e-01 3.01258e+01 300.808 1.75456e+00  -2.94232e+00 0.00000e+00 0.00000e+00 3.75203e+01 300.808 7.39452e+00 300.808 0.8371 
1 1 1 -4  125 2  o 18 2.60274e+00 8.09378e-01 4.52629e+01 357.679 4.98896e+00  -2.02174e-01 0.00000e+00 0.00000e+00 4.03048e+01 357.679 4.95810e+00 177.679 0.8932 
1 1 1 -4  126 1  o 17 5.10706e+00 9.75869e-01 8.69370e+01 188.816 -1.44374e+01 -2.23921e+00 0.00000e+00 0.00000e+00 9.44657e+01 188.816 7.52860e+00 188.816 0.9651 
1 1 1 -3  0   1  o 4  3.77034e+01 1.03454e+00 5.75630e+02 180.000 -3.26961e+00 0.00000e+00  0.00000e+00 0.00000e+00 8.37700e+02 180.000 2.62069e+02 180.000 0.9971 
1 1 1 -3  0   2  o 4  1.55034e+01 4.94978e-01 3.03388e+02 180.000 -8.05335e-01 0.00000e+00  0.00000e+00 0.00000e+00 8.52851e+01 180.000 2.18103e+02 0.000   0.6670 
1 1 1 -3  0   3  o 14 3.34847e+01 9.24113e-01 5.46202e+02 0.000   4.32546e+00  0.00000e+00  0.00000e+00 0.00000e+00 7.11570e+02 0.000   1.65368e+02 0.000   0.9997 
1 1 1 -3  0   4  o 8  1.65931e+01 5.14390e-01 6.45287e+01 180.000 -3.35104e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.36855e+02 180.000 7.23267e+01 180.000 0.3231 
1 1 1 -3  0   5  o 17 8.96307e+00 3.19594e-01 1.14053e+02 180.000 -3.99040e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.35416e+01 180.000 1.00511e+02 0.000   0.3791 
1 1 1 -3  0   6  o 5  2.23916e+01 5.33961e-01 6.62046e+02 180.000 -5.64360e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.78316e+02 180.000 4.83730e+02 0.000   1.0000 
1 1 1 -3  0   7  o 10 1.55779e+01 4.09704e-01 3.42215e+02 180.000 -2.82357e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.38030e+02 180.000 1.04185e+02 0.000   0.9930 
1 1 1 -3  0   8  o 6  1.51296e+01 3.75936e-01 3.02570e+02 180.000 -2.82784e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.60685e+02 180.000 4.18856e+01 0.000   0.9930 
1 1 1 -3  0   9  o 10 3.16216e+01 6.79910e-01 4.73854e+02 0.000   1.15853e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.10878e+02 0.000   2.37024e+02 0.000   1.0000 
1 1 1 -3  0   10 f 0  6.87096e+01 1.39186e+00 1.22499e+03 180.000 -8.88592e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.34748e+03 180.000 1.22488e+02 180.000 1.0000 
1 1 1 -3  0   11 o 5  1.43400e+01 6.74297e-01 4.85766e+02 0.000   1.05608e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.07105e+01 0.000   4.35055e+02 180.000 1.0000 
1 1 1 -3  0   12 o 19 2.20603e+01 6.92924e-01 1.38091e+02 180.000 -5.97675e+00 -0.00000e+00 0.00000e+00 0.00000e+00 6.86521e+02 180.000 5.48429e+02 180.000 1.0000 
1 1 1 -3  0   13 o 15 9.03884e+00 8.87807e-01 8.72686e+01 180.000 -2.32862e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.43959e+02 180.000 1.56690e+02 180.000 0.9812 
1 1 1 -3  0   14 o 17 2.67555e+01 7.30803e-01 4.40115e+02 0.000   4.58737e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.58187e+02 0.000   1.18072e+02 0.000   1.0000 
1 1 1 -3  0   15 f 0  4.90909e+00 1.47438e+00 2.80498e+02 180.000 -6.45180e+00 0.00000e+00  0.00000e+00 0.00000e+00 9.75155e+01 0.000   3.78014e+02 0.000   1.0000 
1 1 1 -3  0   16 o 2  2.07233e+00 1.32426e+00 6.85839e+01 0.000   7.86472e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.79341e+01 180.000 8.65180e+01 180.000 0.6564 
1 1 1 -3  0   17 o 13 1.01542e+01 1.08164e+00 1.14800e+02 180.000 -8.89611e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.62862e+02 180.000 1.48062e+02 180.000 1.0000 
1 1 1 -3  0   18 o 3  4.43560e+00 2.11949e+00 8.13148e+01 180.000 -1.97585e+00 0.00000e+00  0.00000e+00 0.00000e+00 7.72455e+01 180.000 4.06935e+00 0.000   0.9623 
1 1 1 -3  0   19 o 19 2.37651e+00 1.63657e+00 1.31509e+02 0.000   2.38955e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.48054e+01 180.000 1.76314e+02 180.000 0.9833 
1 1 1 -3  0   20 o 4  2.96224e+00 1.98598e+00 3.87697e+01 180.000 -8.79267e-01 -0.00000e+00 0.00000e+00 0.00000e+00 3.87271e+01 180.000 4.26536e-02 0.000   0.7061 
1 1 1 -3  1   1  o 12 3.22304e+01 6.33207e-01 4.96893e+02 189.673 -4.74704e+00 -8.09129e-01 0.00000e+00 0.00000e+00 5.80185e+02 189.673 8.32919e+01 189.673 0.8889 
1 1 1 -3  1   2  o 17 2.94429e+01 5.82151e-01 2.06400e+02 224.371 -1.48233e+00 -1.45014e+00 0.00000e+00 0.00000e+00 5.78776e+02 224.371 3.72376e+02 224.371 0.7095 
1 1 1 -3  1   3  o 17 4.09300e+01 7.89665e-01 6.24745e+02 47.124  8.20349e+00  8.83550e+00  0.00000e+00 0.00000e+00 8.47997e+02 47.124  2.23252e+02 47.124  0.9576 
1 1 1 -3  1   4  o 3  6.49339e+01 1.24463e+00 1.32560e+03 249.103 -1.88859e+01 -4.94649e+01 0.00000e+00 0.00000e+00 1.09038e+03 249.103 2.35217e+02 69.103  0.9905 
1 1 1 -3  1   5  o 5  1.40813e+01 2.71336e-01 3.04343e+02 58.335  1.73004e+00  2.80503e+00  0.00000e+00 0.00000e+00 1.34327e+02 58.335  1.70017e+02 238.335 0.8297 
1 1 1 -3  1   6  o 13 7.56554e+00 2.16563e-01 4.03739e+02 331.235 2.04083e+00  -1.12033e+00 0.00000e+00 0.00000e+00 1.92220e+02 151.235 5.95959e+02 151.235 0.7449 
1 1 1 -3  1   7  o 7  1.20021e+01 2.38645e-01 2.86529e+02 344.059 3.50403e+00  -1.00086e+00 0.00000e+00 0.00000e+00 9.53891e+01 344.059 1.91140e+02 164.059 0.8483 
1 1 1 -3  1   8  o 14 1.01470e+01 2.30395e-01 3.77988e+01 312.799 3.22046e-01  -3.47788e-01 0.00000e+00 0.00000e+00 4.99168e+01 312.799 1.21180e+01 312.799 0.2306 
1 1 1 -3  1   9  o 10 3.20300e+01 4.84303e-01 5.44990e+02 189.894 -2.65868e+01 -4.63739e+00 0.00000e+00 0.00000e+00 6.32598e+02 189.894 8.76087e+01 189.894 0.9813 
1 1 1 -3  1   10 o 3  6.04260e+00 3.79627e-01 2.37641e+02 22.880  2.88737e+00  1.21846e+00  0.00000e+00 0.00000e+00 5.22614e+01 202.880 2.89902e+02 202.880 0.8194 
1 1 1 -3  1   11 o 18 2.97353e+01 4.84136e-01 5.96863e+02 259.787 -9.53706e+00 -5.29371e+01 0.00000e+00 0.00000e+00 5.05177e+02 259.787 9.16853e+01 79.787  0.9907 
1 1 1 -3  1   12 o 16 3.97050e+00 7.27631e-01 2.10042e+02 56.356  1.77528e+00  2.66752e+00  0.00000e+00 0.00000e+00 8.77423e+01 236.355 2.97785e+02 236.355 0.8240 
1 1 1 -3  1   13 o 19 1.48996e+01 4.24248e-01 2.01336e+02 267.416 -8.17780e-01 -1.81203e+01 0.00000e+00 0.00000e+00 3.39560e+02 267.416 1.38223e+02 267.416 0.9720 
1 1 1 -3  1   14 o 18 6.26295e+00 6.95698e-01 1.61098e+02 269.760 -3.18650e-02 -7.62043e+00 0.00000e+00 0.00000e+00 5.66638e+01 269.760 1.04434e+02 89.760  0.9319 
1 1 1 -3  1   15 o 2  1.69206e+01 5.16244e-01 2.71609e+02 298.892 2.42872e+01  -4.40107e+01 0.00000e+00 0.00000e+00 3.52792e+02 298.892 8.11824e+01 298.892 0.9900 
1 1 1 -3  1   16 o 15 2.81226e+00 8.45003e-01 8.37087e+01 22.659  2.48759e+00  1.03851e+00  0.00000e+00 0.00000e+00 1.53977e+00 202.659 8.52485e+01 202.659 0.7847 
1 1 1 -3  1   17 f 0  2.08077e+01 6.49510e-01 2.68897e+02 254.186 -2.44020e+01 -8.61534e+01 0.00000e+00 0.00000e+00 5.00659e+02 254.186 2.31762e+02 254.186 0.9944 
1 1 1 -3  1   18 o 11 4.96117e+00 1.24241e+00 9.07515e+01 141.341 -4.49449e+00 3.59544e+00  0.00000e+00 0.00000e+00 7.66633e+01 141.341 1.40882e+01 321.341 0.9084 
1 1 1 -3  1   19 o 4  1.19029e+01 1.12902e+00 1.60812e+02 62.796  1.36300e+01  2.65170e+01  0.00000e+00 0.00000e+00 2.73339e+02 62.796  1.12527e+02 62.796  0.9831 
1 1 1 -3  1   20 o 18 4.27149e+00 1.35377e+00 1.62741e+01 213.272 -9.26552e-01 -6.07994e-01 0.00000e+00 0.00000e+00 6.02387e+01 213.272 4.39646e+01 213.272 0.4834 
1 1 1 -3  2   1  o 12 2.32313e+01 4.75970e-01 6.76547e+02 13.318  4.56500e+00  1.08064e+00  0.00000e+00 0.00000e+00 9.69739e+01 13.318  5.79573e+02 193.318 0.8857 
1 1 1 -3  2   2  o 14 3.81558e+01 7.39304e-01 7.81836e+02 204.920 -9.16142e+00 -4.25648e+00 0.00000e+00 0.00000e+00 5.79334e+02 204.920 2.02502e+02 24.920  0.9491 
1 1 1 -3  2   3  o 3  1.60820e+01 3.55536e-01 3.74146e+02 331.822 2.50112e+00  -1.33984e+00 0.00000e+00 0.00000e+00 1.07598e+02 331.822 2.66548e+02 151.822 0.7972 
1 1 1 -3  2   4  o 13 1.70229e+01 3.68754e-01 3.60753e+02 84.266  3.82632e-01  3.81053e+00  0.00000e+00 0.00000e+00 1.87007e+02 84.266  1.73746e+02 264.266 0.8566 
1 1 1 -3  2   5  f 0  1.07402e+01 2.39242e-01 1.39580e+02 93.951  -7.93135e-02 1.14844e+00  0.00000e+00 0.00000e+00 6.10076e+01 93.951  7.85728e+01 273.951 0.4974 
1 1 1 -3  2   6  o 8  1.14006e+01 2.42577e-01 2.77436e+02 12.577  2.67651e+00  5.97133e-01  0.00000e+00 0.00000e+00 6.01451e+01 12.577  2.17291e+02 192.577 0.7890 
1 1 1 -3  2   7  o 7  2.16536e+01 3.45607e-01 3.95270e+02 163.271 -8.67019e+00 2.60599e+00  0.00000e+00 0.00000e+00 3.70723e+02 163.271 2.45471e+01 343.271 0.9430 
1 1 1 -3  2   8  o 9  9.60758e+00 2.50929e-01 3.10788e+02 256.937 -8.33553e-01 -3.59248e+00 0.00000e+00 0.00000e+00 4.50445e+00 76.937  3.15293e+02 76.937  0.8503 
1 1 1 -3  2   9  o 6  8.46998e+00 2.72923e-01 7.07352e+01 133.575 -6.41302e-01 6.74012e-01  0.00000e+00 0.00000e+00 6.29161e+01 133.575 7.81917e+00 313.575 0.4212 
1 1 1 -3  2   10 o 9  3.18410e+01 4.93795e-01 4.28768e+02 42.180  2.19862e+01  1.99216e+01  0.00000e+00 0.00000e+00 7.43080e+02 42.180  3.14312e+02 42.180  0.9830 
1 1 1 -3  2   11 o 19 1.47755e+01 3.48893e-01 1.82592e+02 69.794  2.84177e+00  7.72130e+00  0.00000e+00 0.00000e+00 3.35406e+02 69.794  1.52814e+02 69.794  0.9371 
1 1 1 -3  2   12 f 0  3.41263e+00 8.11093e-01 7.51775e+01 348.904 9.58317e-01  -1.87944e-01 0.00000e+00 0.00000e+00 1.93008e+01 168.904 9.44783e+01 168.904 0.4380 
1 1 1 -3  2   13 o 17 1.77841e+01 4.30058e-01 3.26920e+02 239.994 -1.75684e+01 -3.04216e+01 0.00000e+00 0.00000e+00 3.27742e+02 239.994 8.21530e-01 239.994 0.9857 
1 1 1 -3  2   14 o 9  5.89471e+00 6.89294e-01 1.28055e+02 244.801 -2.43019e+00 -5.16460e+00 0.00000e+00 0.00000e+00 7.15569e+01 244.801 5.64982e+01 64.801  0.9076 
1 1 1 -3  2   15 o 13 1.00051e+01 5.73846e-01 2.61709e+02 349.529 2.78035e+01  -5.13868e+00 0.00000e+00 0.00000e+00 1.04567e+02 349.529 1.57143e+02 169.529 0.9822 
1 1 1 -3  2   16 f 0  1.00615e+01 6.50227e-01 2.91124e+02 141.186 -2.78629e+01 2.24133e+01  0.00000e+00 0.00000e+00 7.82334e+01 141.186 2.12891e+02 321.186 0.9859 
1 1 1 -3  2   17 o 4  8.01859e+00 8.88580e-01 6.50553e+01 265.180 -6.32218e-01 -7.49774e+00 0.00000e+00 0.00000e+00 2.12585e+02 265.180 1.47530e+02 265.180 0.9310 
1 1 1 -3  2   18 o 14 1.69654e+01 7.42299e-01 2.25133e+02 181.474 -6.38567e+01 -1.64268e+00 0.00000e+00 0.00000e+00 4.00149e+02 181.474 1.75016e+02 181.474 0.9921 
1 1 1 -3  2   19 o 3  8.15760e+00 1.33267e+00 7.61514e+01 345.859 8.19521e+00  -2.06477e+00 0.00000e+00 0.00000e+00 2.07995e+02 345.859 1.31844e+02 345.859 0.9388 
1 1 1 -3  2   20 o 12 5.08119e+00 1.49858e+00 9.65238e+01 141.296 -5.43813e+00 4.35738e+00  0.00000e+00 0.00000e+00 7.76630e+01 141.296 1.88608e+01 321.296 0.9252 
1 1 1 -3  3   1  o 8  1.86471e+01 3.99795e-01 1.57131e+02 275.390 8.10563e-02  -8.59119e-01 0.00000e+00 0.00000e+00 1.20277e+02 275.390 3.68533e+01 95.390  0.3957 
1 1 1 -3  3   2  o 9  3.73759e+01 7.25207e-01 7.84339e+02 83.562  1.10176e+00  9.76355e+00  0.00000e+00 0.00000e+00 5.46925e+02 83.562  2.37414e+02 263.562 0.9477 
1 1 1 -3  3   3  f 0  1.82922e+01 3.89029e-01 2.28137e+02 242.859 -8.91185e-01 -1.73844e+00 0.00000e+00 0.00000e+00 2.46124e+02 242.859 1.79872e+01 242.859 0.6900 
1 1 1 -3  3   4  o 13 2.13683e+01 4.39875e-01 3.76131e+02 60.305  2.47004e+00  4.33138e+00  0.00000e+00 0.00000e+00 3.40685e+02 60.305  3.54463e+01 240.305 0.8931 
1 1 1 -3  3   5  o 13 1.85492e+01 3.57294e-01 5.68509e+02 331.657 7.10008e+00  -3.82990e+00 0.00000e+00 0.00000e+00 8.32582e+01 331.657 4.85251e+02 151.657 0.9358 
1 1 1 -3  3   6  o 12 1.80309e+01 3.18845e-01 4.57289e+02 334.551 6.44012e+00  -3.06476e+00 0.00000e+00 0.00000e+00 1.70008e+02 334.551 2.87281e+02 154.551 0.9270 
1 1 1 -3  3   7  o 12 2.07715e+01 3.34914e-01 4.59599e+02 81.254  1.53422e+00  9.97252e+00  0.00000e+00 0.00000e+00 2.79884e+02 81.254  1.79715e+02 261.254 0.9491 
1 1 1 -3  3   8  o 19 3.72150e+01 5.54849e-01 6.55638e+02 221.784 -2.23316e+01 -1.99553e+01 0.00000e+00 0.00000e+00 7.16042e+02 221.784 6.04045e+01 221.784 0.9832 
1 1 1 -3  3   9  o 2  2.37979e+01 4.69141e-01 5.02181e+02 347.010 1.79988e+01  -4.15205e+00 0.00000e+00 0.00000e+00 3.64939e+02 347.010 1.37241e+02 167.010 0.9725 
1 1 1 -3  3   10 o 5  1.58535e+01 3.25376e-01 2.94612e+02 244.161 -4.44739e+00 -9.18406e+00 0.00000e+00 0.00000e+00 2.69051e+02 244.161 2.55603e+01 64.161  0.9497 
1 1 1 -3  3   11 o 9  1.26224e+01 3.65362e-01 1.48487e+02 113.255 -2.25456e+00 5.24632e+00  0.00000e+00 0.00000e+00 2.80098e+02 113.255 1.31612e+02 113.255 0.9076 
1 1 1 -3  3   12 o 8  7.79993e+00 7.92320e-01 2.08203e+02 217.372 -4.92202e+00 -3.75935e+00 0.00000e+00 0.00000e+00 5.86524e+01 217.372 1.49551e+02 37.372  0.9153 
1 1 1 -3  3   13 o 2  1.68816e+01 4.75423e-01 2.74701e+02 205.570 -2.51538e+01 -1.20355e+01 0.00000e+00 0.00000e+00 3.44365e+02 205.570 6.96637e+01 205.570 0.9819 
1 1 1 -3  3   14 o 5  1.96965e+01 4.70791e-01 3.44371e+02 133.819 -3.68212e+01 3.83720e+01  0.00000e+00 0.00000e+00 3.83594e+02 133.819 3.92228e+01 133.819 0.9906 
1 1 1 -3  3   15 o 9  2.01768e+01 5.13241e-01 2.90731e+02 228.476 -4.25484e+01 -4.80525e+01 0.00000e+00 0.00000e+00 4.55456e+02 228.476 1.64725e+02 228.476 0.9922 
1 1 1 -3  3   16 o 15 4.38809e+00 8.40581e-01 7.49520e+01 256.138 -9.03557e-01 -3.66159e+00 0.00000e+00 0.00000e+00 6.46002e+01 256.138 1.03518e+01 76.138  0.8541 
1 1 1 -3  3   17 o 11 7.41119e+00 9.19268e-01 9.03483e+01 144.568 -7.75332e+00 5.51643e+00  0.00000e+00 0.00000e+00 1.70377e+02 144.568 8.00290e+01 144.568 0.9459 
1 1 1 -3  3   18 o 3  7.54571e+00 1.10856e+00 1.55768e+02 9.290   1.60230e+01  2.62113e+00  0.00000e+00 0.00000e+00 1.15765e+02 9.290   4.00036e+01 189.290 0.9687 
1 1 1 -3  3   19 o 9  1.09484e+01 1.16003e+00 1.60812e+02 107.272 -7.97712e+00 2.56561e+01  0.00000e+00 0.00000e+00 2.37756e+02 107.272 7.69449e+01 107.272 0.9812 
1 1 1 -3  3   20 o 2  6.23423e+00 1.54745e+00 4.70672e+01 311.557 2.66119e+00  -3.00190e+00 0.00000e+00 0.00000e+00 1.52506e+02 311.557 1.05439e+02 311.557 0.8640 
1 1 1 -3  4   1  o 4  2.41699e+01 4.91902e-01 9.20810e+02 199.674 -6.05426e+00 -2.16463e+00 0.00000e+00 0.00000e+00 8.61878e+01 19.674  1.00700e+03 19.674  0.9186 
1 1 1 -3  4   2  o 10 2.45211e+01 4.95269e-01 2.24904e+02 23.366  1.67561e+00  7.23907e-01  0.00000e+00 0.00000e+00 3.89726e+02 23.366  1.64821e+02 23.366  0.6669 
1 1 1 -3  4   3  o 18 4.07435e+01 7.86309e-01 6.45973e+02 194.111 -1.17849e+01 -2.96256e+00 0.00000e+00 0.00000e+00 8.20547e+02 194.111 1.74573e+02 194.111 0.9579 
1 1 1 -3  4   5  o 8  1.69894e+01 3.36761e-01 2.46620e+02 304.012 1.78641e+00  -2.64723e+00 0.00000e+00 0.00000e+00 2.78595e+02 304.012 3.19750e+01 304.012 0.8233 
1 1 1 -3  4   6  o 15 1.32373e+01 2.70193e-01 2.16811e+02 144.882 -2.02697e+00 1.42553e+00  0.00000e+00 0.00000e+00 1.62043e+02 144.882 5.47672e+01 324.882 0.7626 
1 1 1 -3  4   7  o 5  2.51173e+01 3.90450e-01 4.87150e+02 275.892 1.32476e+00  -1.28368e+01 0.00000e+00 0.00000e+00 4.17747e+02 275.892 6.94029e+01 95.892  0.9604 
1 1 1 -3  4   8  o 17 1.23089e+01 2.83334e-01 2.01482e+02 202.394 -2.82696e+00 -1.16482e+00 0.00000e+00 0.00000e+00 1.74207e+02 202.394 2.72747e+01 22.394  0.8142 
1 1 1 -3  4   9  o 17 4.04084e+01 5.78346e-01 7.33479e+02 195.643 -4.39409e+01 -1.23044e+01 0.00000e+00 0.00000e+00 7.63747e+02 195.643 3.02683e+01 195.643 0.9890 
1 1 1 -3  4   10 o 12 1.25019e+01 3.03529e-01 1.47053e+02 242.936 -1.82772e+00 -3.57721e+00 0.00000e+00 0.00000e+00 2.57431e+02 242.936 1.10378e+02 242.936 0.8642 
1 1 1 -3  4   11 o 6  3.19328e+01 5.07380e-01 4.46109e+02 264.192 -4.35960e+00 -4.28573e+01 0.00000e+00 0.00000e+00 7.34562e+02 264.192 2.88452e+02 264.192 0.9883 
1 1 1 -3  4   12 o 1  2.49809e+01 4.65980e-01 3.86216e+02 267.637 -1.56259e+00 -3.78598e+01 0.00000e+00 0.00000e+00 5.35153e+02 267.637 1.48937e+02 267.637 0.9867 
1 1 1 -3  4   13 o 5  1.73806e+01 4.60538e-01 3.03118e+02 150.096 -2.74952e+01 1.58127e+01  0.00000e+00 0.00000e+00 3.35670e+02 150.096 3.25520e+01 150.096 0.9841 
1 1 1 -3  4   14 o 5  2.03448e+01 4.70321e-01 2.49314e+02 77.464  8.63036e+00  3.88124e+01  0.00000e+00 0.00000e+00 5.00169e+02 77.464  2.50856e+02 77.464  0.9873 
1 1 1 -3  4   15 o 15 7.77196e+00 6.51495e-01 1.02252e+02 237.249 -4.55334e+00 -7.07862e+00 0.00000e+00 0.00000e+00 1.69641e+02 237.249 6.73890e+01 237.249 0.9386 
1 1 1 -3  4   16 o 8  4.04293e+00 9.40705e-01 6.86233e+01 321.412 2.61034e+00  -2.08294e+00 0.00000e+00 0.00000e+00 5.66602e+01 321.412 1.19631e+01 141.412 0.8323 
1 1 1 -3  4   17 o 7  7.55032e+00 9.07594e-01 1.78971e+02 83.805  2.08351e+00  1.91962e+01  0.00000e+00 0.00000e+00 9.44679e+01 83.805  8.45033e+01 263.805 0.9738 
1 1 1 -3  4   18 o 2  3.64393e+00 1.08929e+00 1.14332e+02 262.461 -7.63251e-01 -5.76687e+00 0.00000e+00 0.00000e+00 8.77049e+00 262.461 1.05561e+02 82.461  0.9094 
1 1 1 -3  4   19 o 12 8.18955e+00 1.34125e+00 1.43946e+02 205.621 -1.43741e+01 -6.89350e+00 0.00000e+00 0.00000e+00 1.50206e+02 205.621 6.25999e+00 205.621 0.9681 
1 1 1 -3  4   20 o 4  3.19812e+00 1.09724e+00 6.44794e+01 52.068  2.48112e+00  3.18345e+00  0.00000e+00 0.00000e+00 3.80092e+01 52.068  2.64702e+01 232.068 0.8649 
1 1 1 -3  5   1  o 11 2.85274e+01 5.67749e-01 5.28249e+02 155.192 -3.85835e+00 1.78344e+00  0.00000e+00 0.00000e+00 4.07451e+02 155.192 1.20798e+02 335.192 0.8725 
1 1 1 -3  5   2  o 16 3.27162e+01 6.42566e-01 6.29686e+02 287.822 2.04756e+00  -6.36878e+00 0.00000e+00 0.00000e+00 5.03906e+02 287.822 1.25780e+02 107.823 0.9219 
1 1 1 -3  5   3  o 5  2.08181e+01 4.30698e-01 6.99190e+02 329.391 5.73462e+00  -3.39272e+00 0.00000e+00 0.00000e+00 2.16850e+01 329.391 6.77505e+02 149.391 0.9216 
1 1 1 -3  5   4  o 11 3.04636e+01 5.42626e-01 7.37045e+02 116.012 -8.04286e+00 1.64818e+01  0.00000e+00 0.00000e+00 3.75579e+02 116.012 3.61467e+02 296.012 0.9723 
1 1 1 -3  5   5  o 16 1.38534e+01 2.97044e-01 2.95485e+02 192.835 -3.02836e+00 -6.89972e-01 0.00000e+00 0.00000e+00 1.29751e+02 192.835 1.65733e+02 12.835  0.8175 
1 1 1 -3  5   6  o 2  2.64240e+01 4.05380e-01 5.52276e+02 28.031  1.10739e+01  5.89580e+00  0.00000e+00 0.00000e+00 3.99030e+02 28.031  1.53246e+02 208.031 0.9593 
1 1 1 -3  5   7  o 10 2.43724e+01 3.80197e-01 6.74847e+02 358.362 1.73139e+01  -4.95194e-01 0.00000e+00 0.00000e+00 2.12578e+02 358.362 4.62270e+02 178.362 0.9707 
1 1 1 -3  5   8  o 10 4.20774e+01 6.40068e-01 8.02231e+02 182.196 -4.12293e+01 -1.58107e+00 0.00000e+00 0.00000e+00 7.55962e+02 182.196 4.62691e+01 2.196   0.9878 
1 1 1 -3  5   9  o 11 2.74945e+01 4.18434e-01 6.48345e+02 162.914 -2.63336e+01 8.09431e+00  0.00000e+00 0.00000e+00 3.62858e+02 162.914 2.85488e+02 342.914 0.9817 
1 1 1 -3  5   10 o 4  1.83453e+01 3.44038e-01 4.56444e+02 222.625 -1.34408e+01 -1.23703e+01 0.00000e+00 0.00000e+00 2.11303e+02 222.625 2.45141e+02 42.625  0.9722 
1 1 1 -3  5   11 o 8  4.57264e+00 7.40197e-01 1.14720e+02 39.085  1.21075e+00  9.83413e-01  0.00000e+00 0.00000e+00 1.02735e+01 219.085 1.24993e+02 219.085 0.6106 
1 1 1 -3  5   12 o 6  3.22772e+01 5.28646e-01 5.96012e+02 139.323 -5.70143e+01 4.90005e+01  0.00000e+00 0.00000e+00 6.02429e+02 139.323 6.41730e+00 139.323 0.9933 
1 1 1 -3  5   13 o 11 2.29545e+01 5.72830e-01 5.28185e+02 50.123  4.44479e+01  5.32030e+01  0.00000e+00 0.00000e+00 3.22869e+02 50.123  2.05316e+02 230.123 0.9928 
1 1 1 -3  5   14 o 8  1.08663e+01 4.77308e-01 1.86597e+02 280.337 3.09743e+00  -1.69816e+01 0.00000e+00 0.00000e+00 2.06907e+02 280.337 2.03109e+01 280.337 0.9706 
1 1 1 -3  5   15 o 18 1.24518e+01 5.30558e-01 2.41667e+02 207.927 -2.89672e+01 -1.53547e+01 0.00000e+00 0.00000e+00 2.15317e+02 207.927 2.63504e+01 27.927  0.9846 
1 1 1 -3  5   16 o 10 6.96495e+00 8.30780e-01 1.60896e+02 71.007  4.58945e+00  1.33337e+01  0.00000e+00 0.00000e+00 8.90621e+01 71.007  7.18334e+01 251.007 0.9639 
1 1 1 -3  5   17 o 5  1.71408e+01 6.46445e-01 3.36670e+02 280.251 1.64451e+01  -9.09317e+01 0.00000e+00 0.00000e+00 2.97363e+02 280.251 3.93076e+01 100.251 0.9946 
1 1 1 -3  5   18 o 11 5.99772e+00 1.22452e+00 8.26446e+01 158.811 -5.96768e+00 2.31336e+00  0.00000e+00 0.00000e+00 1.21920e+02 158.811 3.92759e+01 158.811 0.9182 
1 1 1 -3  5   19 o 14 4.66356e+00 1.29559e+00 8.78846e+01 106.783 -1.67235e+00 5.54506e+00  0.00000e+00 0.00000e+00 6.93912e+01 106.783 1.84934e+01 286.783 0.9090 
1 1 1 -3  5   20 o 4  9.41680e+00 1.49829e+00 1.20698e+02 321.344 1.26104e+01  -1.00869e+01 0.00000e+00 0.00000e+00 2.17231e+02 321.344 9.65334e+01 321.344 0.9685 
1 1 1 -3  6   1  f 0  2.90909e+01 8.13734e-01 5.86843e+02 79.524  1.17699e+00  6.36528e+00  0.00000e+00 0.00000e+00 4.18313e+02 79.524  1.68530e+02 259.524 0.9191 
1 1 1 -3  6   2  o 6  2.31180e+01 4.71389e-01 6.06879e+02 54.478  4.02693e+00  5.64107e+00  0.00000e+00 0.00000e+00 1.96611e+02 54.478  4.10268e+02 234.478 0.9248 
1 1 1 -3  6   3  o 15 3.76045e+01 7.29097e-01 8.51072e+02 54.546  8.34923e+00  1.17250e+01  0.00000e+00 0.00000e+00 5.11874e+02 54.546  3.39197e+02 234.546 0.9646 
1 1 1 -3  6   4  o 7  1.25219e+01 4.43737e-01 2.65981e+02 272.664 1.25446e-01  -2.69572e+00 0.00000e+00 0.00000e+00 1.03227e+02 272.664 1.62755e+02 92.664  0.7850 
1 1 1 -3  6   5  o 3  2.62482e+01 4.74088e-01 6.20671e+02 279.747 2.07646e+00  -1.20881e+01 0.00000e+00 0.00000e+00 3.23783e+02 279.747 2.96888e+02 99.747  0.9583 
1 1 1 -3  6   6  o 4  1.31251e+01 2.46227e-01 1.92937e+02 44.565  1.54821e+00  1.52489e+00  0.00000e+00 0.00000e+00 1.63808e+02 44.565  2.91287e+01 224.565 0.7242 
1 1 1 -3  6   7  o 6  1.42520e+01 2.60779e-01 2.36512e+02 333.995 3.18229e+00  -1.55244e+00 0.00000e+00 0.00000e+00 2.14256e+02 333.995 2.22564e+01 153.995 0.8432 
1 1 1 -3  6   8  o 2  1.84307e+01 3.26499e-01 3.15032e+02 304.327 4.02505e+00  -5.89449e+00 0.00000e+00 0.00000e+00 3.25489e+02 304.327 1.04575e+01 304.327 0.9270 
1 1 1 -3  6   9  o 18 7.68544e+00 4.31090e-01 1.32048e+02 180.552 -1.56636e+00 -1.50896e-02 0.00000e+00 0.00000e+00 4.42024e+01 180.552 8.78454e+01 0.552   0.6121 
1 1 1 -3  6   10 o 5  2.58050e+01 5.38570e-01 5.11206e+02 110.903 -1.01892e+01 2.66783e+01  0.00000e+00 0.00000e+00 4.37811e+02 110.903 7.33945e+01 290.903 0.9823 
1 1 1 -3  6   11 o 18 2.49792e+01 5.12226e-01 4.75614e+02 280.176 6.33793e+00  -3.53080e+01 0.00000e+00 0.00000e+00 4.45721e+02 280.176 2.98924e+01 100.176 0.9860 
1 1 1 -3  6   12 o 14 1.37709e+01 3.88182e-01 3.30481e+02 65.955  7.31133e+00  1.63869e+01  0.00000e+00 0.00000e+00 1.69700e+02 65.955  1.60780e+02 245.955 0.9717 
1 1 1 -3  6   13 o 8  1.01864e+01 4.53243e-01 1.35313e+02 234.104 -4.67956e+00 -6.46542e+00 0.00000e+00 0.00000e+00 2.20406e+02 234.104 8.50929e+01 234.104 0.9351 
1 1 1 -3  6   14 o 11 4.48784e+00 7.69583e-01 1.45440e+02 122.962 -2.85645e+00 4.40491e+00  0.00000e+00 0.00000e+00 5.06951e+00 122.962 1.40370e+02 302.962 0.8989 
1 1 1 -3  6   15 f 0  1.36997e+01 5.14343e-01 1.84942e+02 29.302  2.41458e+01  1.35511e+01  0.00000e+00 0.00000e+00 3.16374e+02 29.302  1.31432e+02 29.302  0.9818 
1 1 1 -3  6   16 o 9  1.16045e+01 6.01127e-01 1.88407e+02 38.664  2.32682e+01  1.86176e+01  0.00000e+00 0.00000e+00 2.36350e+02 38.664  4.79436e+01 38.664  0.9831 
1 1 1 -3  6   17 o 13 3.54702e+00 9.98760e-01 5.24451e+01 173.108 -2.52136e+00 3.04751e-01  0.00000e+00 0.00000e+00 4.90314e+01 173.108 3.41370e+00 353.108 0.7692 
1 1 1 -3  6   18 o 8  1.32488e+01 8.30431e-01 1.80230e+02 104.543 -9.60531e+00 3.70269e+01  0.00000e+00 0.00000e+00 3.05443e+02 104.543 1.25214e+02 104.543 0.9868 
1 1 1 -3  6   19 o 2  9.75854e+00 1.24698e+00 1.30843e+02 211.484 -1.58989e+01 -9.73682e+00 0.00000e+00 0.00000e+00 2.21352e+02 211.484 9.05089e+01 211.484 0.9728 
1 1 1 -3  6   20 o 12 4.97181e+00 1.45185e+00 6.51646e+01 94.393  -3.65757e-01 4.76058e+00  0.00000e+00 0.00000e+00 9.83940e+01 94.393  3.32293e+01 94.393  0.8879 
1 1 1 -3  7   1  o 11 3.15462e+01 6.21495e-01 4.59524e+02 60.495  2.62853e+00  4.64488e+00  0.00000e+00 0.00000e+00 6.08533e+02 60.495  1.49010e+02 60.495  0.9007 
1 1 1 -3  7   2  o 1  3.85787e+01 7.47701e-01 7.68267e+02 96.592  -1.63522e+00 1.41506e+01  0.00000e+00 0.00000e+00 6.29798e+02 96.592  1.38469e+02 276.592 0.9642 
1 1 1 -3  7   3  o 3  1.66468e+01 3.63983e-01 4.61410e+02 269.400 -3.56820e-02 -3.40786e+00 0.00000e+00 0.00000e+00 6.15829e+01 269.400 3.99827e+02 89.400  0.8362 
1 1 1 -3  7   4  o 6  2.76241e+01 4.96452e-01 5.94759e+02 340.253 1.23830e+01  -4.44512e+00 0.00000e+00 0.00000e+00 4.02574e+02 340.253 1.92186e+02 160.253 0.9612 
1 1 1 -3  7   5  o 3  2.34918e+01 4.31115e-01 3.71093e+02 52.971  3.92779e+00  5.20692e+00  0.00000e+00 0.00000e+00 4.40167e+02 52.971  6.90744e+01 52.971  0.9198 
1 1 1 -3  7   6  o 7  1.53761e+01 2.69758e-01 4.05266e+02 263.277 -6.23362e-01 -5.28825e+00 0.00000e+00 0.00000e+00 1.14310e+02 263.277 2.90956e+02 83.277  0.9004 
1 1 1 -3  7   7  o 10 2.80350e+01 4.27820e-01 4.66008e+02 267.403 -6.18985e-01 -1.36447e+01 0.00000e+00 0.00000e+00 5.46306e+02 267.403 8.02976e+01 267.403 0.9627 
1 1 1 -3  7   8  o 3  9.21820e+00 2.69042e-01 2.07750e+02 290.951 8.41227e-01  -2.19710e+00 0.00000e+00 0.00000e+00 5.07239e+01 290.951 1.57026e+02 110.951 0.7480 
1 1 1 -3  7   9  o 17 5.45528e+01 8.20646e-01 8.74847e+02 315.483 5.17393e+01  -5.08746e+01 0.00000e+00 0.00000e+00 1.15476e+03 315.483 2.79912e+02 315.483 0.9931 
1 1 1 -3  7   10 o 9  2.96046e+01 5.36140e-01 5.71956e+02 300.086 1.83630e+01  -3.16960e+01 0.00000e+00 0.00000e+00 5.21124e+02 300.086 5.08321e+01 120.086 0.9863 
1 1 1 -3  7   11 o 5  2.22379e+01 4.88588e-01 5.17964e+02 173.264 -3.45580e+01 4.08134e+00  0.00000e+00 0.00000e+00 3.01883e+02 173.264 2.16082e+02 353.264 0.9855 
1 1 1 -3  7   12 o 9  3.73653e+01 5.90101e-01 5.70938e+02 50.744  5.77955e+01  7.07219e+01  0.00000e+00 0.00000e+00 8.18029e+02 50.744  2.47091e+02 50.744  0.9945 
1 1 1 -3  7   13 o 2  2.24601e+01 5.00335e-01 4.27096e+02 132.350 -3.72109e+01 4.08228e+01  0.00000e+00 0.00000e+00 4.04044e+02 132.350 2.30525e+01 312.350 0.9909 
1 1 1 -3  7   14 f 0  8.42204e+00 5.19295e-01 7.15225e+01 5.691   5.06313e+00  5.04555e-01  0.00000e+00 0.00000e+00 2.09828e+02 5.691   1.38306e+02 5.691   0.8954 
1 1 1 -3  7   15 o 11 1.43216e+01 6.07564e-01 2.55002e+02 43.180  2.80347e+01  2.63077e+01  0.00000e+00 0.00000e+00 2.71804e+02 43.180  1.68016e+01 43.180  0.9869 
1 1 1 -3  7   16 f 0  1.39592e+01 5.82615e-01 2.46430e+02 252.648 -1.40566e+01 -4.49865e+01 0.00000e+00 0.00000e+00 2.67757e+02 252.648 2.13263e+01 252.648 0.9893 
1 1 1 -3  7   17 f 0  1.18270e+01 7.14911e-01 1.54812e+02 139.225 -2.15899e+01 1.86197e+01  0.00000e+00 0.00000e+00 2.77253e+02 139.225 1.22441e+02 139.225 0.9823 
1 1 1 -3  7   18 o 5  1.11556e+01 8.89016e-01 1.09667e+02 105.309 -5.02215e+00 1.83468e+01  0.00000e+00 0.00000e+00 2.93673e+02 105.309 1.84006e+02 105.309 0.9733 
1 1 1 -3  7   19 f 0  1.12883e+01 1.07151e+00 8.97377e+01 43.250  1.21040e+01  1.13865e+01  0.00000e+00 0.00000e+00 3.16250e+02 43.250  2.26513e+02 43.250  0.9694 
1 1 1 -3  7   20 o 11 5.40083e+00 1.50152e+00 1.11460e+02 207.622 -7.55632e+00 -3.95407e+00 0.00000e+00 0.00000e+00 7.65185e+01 207.622 3.49418e+01 27.622  0.9394 
1 1 1 -3  8   1  o 14 1.58442e+01 4.90465e-01 2.09994e+02 310.635 7.71351e-01  -8.98839e-01 0.00000e+00 0.00000e+00 9.25302e+01 310.635 1.17463e+02 130.635 0.5079 
1 1 1 -3  8   2  o 8  3.55191e+01 6.91960e-01 7.12385e+02 65.776  4.85998e+00  1.08019e+01  0.00000e+00 0.00000e+00 5.64863e+02 65.776  1.47522e+02 245.776 0.9568 
1 1 1 -3  8   3  o 4  2.51019e+01 5.05145e-01 4.66791e+02 298.993 2.95042e+00  -5.32412e+00 0.00000e+00 0.00000e+00 3.94947e+02 298.993 7.18445e+01 118.994 0.9137 
1 1 1 -3  8   4  o 3  1.87879e+01 3.62941e-01 2.37116e+02 326.721 2.95077e+00  -1.93673e+00 0.00000e+00 0.00000e+00 3.57507e+02 326.721 1.20391e+02 326.721 0.8426 
1 1 1 -3  8   5  o 5  1.58754e+01 3.46719e-01 6.83813e+01 82.193  1.09588e-01  7.99249e-01  0.00000e+00 0.00000e+00 1.54391e+02 82.193  8.60093e+01 82.193  0.3738 
1 1 1 -3  8   6  o 3  2.78612e+01 4.62542e-01 4.86855e+02 311.778 7.67018e+00  -8.58522e+00 0.00000e+00 0.00000e+00 5.12218e+02 311.778 2.53633e+01 311.778 0.9555 
1 1 1 -3  8   7  o 5  7.45487e+00 2.18731e-01 7.80872e+01 316.011 4.37815e-01  -4.22628e-01 0.00000e+00 0.00000e+00 3.28050e+00 316.011 7.48067e+01 136.011 0.2910 
1 1 1 -3  8   8  o 7  2.64509e+01 4.63853e-01 5.33875e+02 196.603 -1.65430e+01 -4.93264e+00 0.00000e+00 0.00000e+00 4.28518e+02 196.603 1.05357e+02 16.603  0.9706 
1 1 1 -3  8   9  o 3  5.18569e+01 7.80954e-01 8.20370e+02 201.448 -7.40163e+01 -2.90780e+01 0.00000e+00 0.00000e+00 1.11008e+03 201.448 2.89707e+02 201.448 0.9937 
1 1 1 -3  8   10 o 10 4.06311e+01 6.51069e-01 8.04131e+02 132.312 -4.85142e+01 5.32949e+01  0.00000e+00 0.00000e+00 7.06362e+02 132.312 9.77683e+01 312.311 0.9930 
1 1 1 -3  8   11 o 10 3.58772e+01 5.78593e-01 6.23662e+02 252.746 -1.99238e+01 -6.41490e+01 0.00000e+00 0.00000e+00 7.08401e+02 252.746 8.47385e+01 252.746 0.9925 
1 1 1 -3  8   12 o 7  6.68545e+00 5.03143e-01 1.89510e+02 93.416  -3.25367e-01 5.45162e+00  0.00000e+00 0.00000e+00 3.61548e+01 93.416  1.53356e+02 273.416 0.9031 
1 1 1 -3  8   13 o 1  6.03209e+00 6.94806e-01 1.33357e+02 317.632 3.33620e+00  -3.04299e+00 0.00000e+00 0.00000e+00 6.50511e+01 317.632 6.83059e+01 137.632 0.8808 
1 1 1 -3  8   14 o 15 8.42819e+00 5.10108e-01 1.98453e+02 312.413 9.53629e+00  -1.04389e+01 0.00000e+00 0.00000e+00 1.04660e+02 312.413 9.37930e+01 132.413 0.9640 
1 1 1 -3  8   15 o 18 7.93179e+00 7.83734e-01 1.24272e+02 287.859 3.03471e+00  -9.41891e+00 0.00000e+00 0.00000e+00 1.55995e+02 287.859 3.17228e+01 287.859 0.9480 
1 1 1 -3  8   16 o 8  9.57232e+00 6.51193e-01 1.21652e+02 335.104 1.41610e+01  -6.57194e+00 0.00000e+00 0.00000e+00 2.23128e+02 335.104 1.01476e+02 335.104 0.9674 
1 1 1 -3  8   17 o 5  3.86066e+00 9.96409e-01 5.41838e+01 173.985 -2.84185e+00 2.99419e-01  0.00000e+00 0.00000e+00 6.05157e+01 173.985 6.33192e+00 173.985 0.7989 
1 1 1 -3  8   18 o 15 5.19182e+00 1.21142e+00 2.45195e+01 314.288 1.15562e+00  -1.18472e+00 0.00000e+00 0.00000e+00 9.73969e+01 314.288 7.28773e+01 314.288 0.6322 
1 1 1 -3  8   19 o 9  1.24089e+01 1.04889e+00 2.26680e+02 93.021  -2.46697e+00 4.67476e+01  0.00000e+00 0.00000e+00 2.28732e+02 93.021  2.05221e+00 93.021  0.9893 
1 1 1 -3  8   20 o 18 3.41088e+00 1.15090e+00 9.82488e+01 224.452 -4.58373e+00 -4.49683e+00 0.00000e+00 0.00000e+00 1.78178e+01 224.452 8.04310e+01 44.452  0.9184 
1 1 1 -3  9   1  o 1  1.59834e+01 3.85345e-01 3.36342e+02 232.040 -1.13475e+00 -1.45449e+00 0.00000e+00 0.00000e+00 6.65419e+01 232.040 2.69800e+02 52.040  0.6706 
1 1 1 -3  9   2  o 4  4.43855e+01 1.06185e+00 1.10344e+03 100.242 -3.93679e+00 2.17875e+01  0.00000e+00 0.00000e+00 5.26535e+02 100.242 5.76901e+02 280.242 0.9771 
1 1 1 -3  9   3  o 17 1.07405e+01 2.80152e-01 4.39255e+01 35.775  1.95102e-01  1.40581e-01  0.00000e+00 0.00000e+00 4.24699e+00 35.775  3.96785e+01 215.775 0.1194 
1 1 1 -3  9   4  o 14 5.86100e+01 1.15615e+00 1.11498e+03 217.223 -3.99626e+01 -3.03590e+01 0.00000e+00 0.00000e+00 1.06431e+03 217.223 5.06669e+01 37.223  0.9900 
1 1 1 -3  9   5  o 6  9.23406e+00 2.32117e-01 1.40682e+02 219.806 -7.36027e-01 -6.13367e-01 0.00000e+00 0.00000e+00 8.85935e+00 219.806 1.31822e+02 39.806  0.4313 
1 1 1 -3  9   6  o 11 3.42952e+01 5.55971e-01 5.79639e+02 93.699  -1.08135e+00 1.67273e+01  0.00000e+00 0.00000e+00 6.68357e+02 93.699  8.87177e+01 93.699  0.9697 
1 1 1 -3  9   7  o 13 4.98331e+01 7.87975e-01 9.69201e+02 111.594 -1.83184e+01 4.62809e+01  0.00000e+00 0.00000e+00 8.81042e+02 111.594 8.81589e+01 291.594 0.9899 
1 1 1 -3  9   8  o 7  1.17878e+01 2.79651e-01 1.67472e+02 159.580 -2.42367e+00 9.02301e-01  0.00000e+00 0.00000e+00 1.74565e+02 159.580 7.09339e+00 159.580 0.7741 
1 1 1 -3  9   9  o 14 2.05151e+01 4.96363e-01 2.83347e+02 38.613  8.58662e+00  6.85778e+00  0.00000e+00 0.00000e+00 4.49337e+02 38.613  1.65990e+02 38.613  0.9534 
1 1 1 -3  9   10 o 14 1.99563e+01 4.76164e-01 3.48343e+02 298.323 7.32792e+00  -1.35960e+01 0.00000e+00 0.00000e+00 3.74127e+02 298.323 2.57835e+01 298.323 0.9671 
1 1 1 -3  9   11 o 7  1.90911e+01 3.91359e-01 2.60628e+02 27.827  1.27294e+01  6.71926e+00  0.00000e+00 0.00000e+00 4.28241e+02 27.827  1.67614e+02 27.827  0.9646 
1 1 1 -3  9   12 o 4  2.31063e+01 4.46099e-01 3.86323e+02 16.873  3.69484e+01  1.12067e+01  0.00000e+00 0.00000e+00 4.66044e+02 16.873  7.97210e+01 16.873  0.9870 
1 1 1 -3  9   13 o 15 1.18970e+01 4.84648e-01 1.59162e+02 228.292 -7.25378e+00 -8.13928e+00 0.00000e+00 0.00000e+00 2.64217e+02 228.292 1.05054e+02 228.292 0.9530 
1 1 1 -3  9   14 o 5  5.52791e+00 6.71822e-01 1.42496e+02 310.191 4.16797e+00  -4.93368e+00 0.00000e+00 0.00000e+00 4.70219e+01 310.191 9.54740e+01 130.191 0.9189 
1 1 1 -3  9   15 o 16 5.81257e+00 7.28746e-01 9.41668e+01 135.047 -3.94805e+00 3.94157e+00  0.00000e+00 0.00000e+00 1.01948e+02 135.047 7.78157e+00 135.047 0.9053 
1 1 1 -3  9   16 o 5  6.95112e+00 7.86644e-01 1.27483e+02 192.523 -1.10550e+01 -2.45559e+00 0.00000e+00 0.00000e+00 1.19606e+02 192.523 7.87634e+00 12.524  0.9548 
1 1 1 -3  9   17 o 15 3.25506e+00 9.25750e-01 3.21222e+01 229.322 -9.58098e-01 -1.11474e+00 0.00000e+00 0.00000e+00 3.91288e+01 229.322 7.00656e+00 229.322 0.5886 
1 1 1 -3  9   18 o 1  1.28107e+01 8.17852e-01 2.21598e+02 40.255  3.79808e+01  3.21586e+01  0.00000e+00 0.00000e+00 2.49439e+02 40.255  2.78411e+01 40.255  0.9899 
1 1 1 -3  9   19 o 7  3.83155e+00 1.19997e+00 1.02267e+02 169.703 -5.80515e+00 1.05465e+00  0.00000e+00 0.00000e+00 2.71932e+01 169.703 7.50739e+01 349.703 0.9108 
1 1 1 -3  9   20 o 12 7.77123e+00 1.57643e+00 1.23207e+02 313.153 8.88503e+00  -9.47714e+00 0.00000e+00 0.00000e+00 1.53397e+02 313.153 3.01904e+01 313.153 0.9607 
1 1 1 -3  10  1  o 13 1.47757e+01 5.06805e-01 2.50313e+02 53.964  7.17278e-01  9.85945e-01  0.00000e+00 0.00000e+00 3.77762e+01 53.964  2.12537e+02 233.964 0.5187 
1 1 1 -3  10  2  o 7  1.34472e+01 3.01455e-01 4.38787e+02 27.697  2.30906e+00  1.21213e+00  0.00000e+00 0.00000e+00 4.65081e+01 207.697 4.85295e+02 207.697 0.7762 
1 1 1 -3  10  3  o 18 1.66674e+01 3.19167e-01 1.61666e+02 269.876 -2.91048e-03 -1.34293e+00 0.00000e+00 0.00000e+00 1.85777e+02 269.876 2.41110e+01 269.876 0.5548 
1 1 1 -3  10  4  o 19 8.25410e+00 3.53634e-01 1.62020e+02 311.600 6.83840e-01  -7.70227e-01 0.00000e+00 0.00000e+00 2.03721e+01 131.600 1.82392e+02 131.600 0.4569 
1 1 1 -3  10  5  o 14 2.23495e+01 4.29495e-01 3.14845e+02 295.920 2.34984e+00  -4.83499e+00 0.00000e+00 0.00000e+00 4.41515e+02 295.920 1.26670e+02 295.920 0.9014 
1 1 1 -3  10  6  o 4  2.05109e+01 4.01125e-01 3.47555e+02 347.134 6.20767e+00  -1.41784e+00 0.00000e+00 0.00000e+00 3.58805e+02 347.134 1.12503e+01 347.134 0.9177 
1 1 1 -3  10  7  o 17 1.88330e+01 3.52681e-01 6.20222e+02 255.871 -2.95702e+00 -1.17469e+01 0.00000e+00 0.00000e+00 5.63227e+01 255.871 5.63899e+02 75.871  0.9578 
1 1 1 -3  10  8  f 0  2.78808e+01 5.22229e-01 5.03188e+02 12.325  1.78354e+01  3.89693e+00  0.00000e+00 0.00000e+00 5.12880e+02 12.325  9.69172e+00 12.325  0.9722 
1 1 1 -3  10  9  o 18 1.12503e+01 4.02809e-01 1.36315e+02 357.148 2.89927e+00  -1.44414e-01 0.00000e+00 0.00000e+00 2.01911e+02 357.148 6.55964e+01 357.148 0.8025 
1 1 1 -3  10  10 o 11 9.65245e+00 6.67137e-01 1.78786e+02 156.491 -3.48071e+00 1.51410e+00  0.00000e+00 0.00000e+00 1.30221e+02 156.491 4.85650e+01 336.491 0.8552 
1 1 1 -3  10  11 o 15 2.09198e+01 4.98479e-01 4.26568e+02 170.802 -2.53232e+01 4.10035e+00  0.00000e+00 0.00000e+00 3.40553e+02 170.802 8.60146e+01 350.802 0.9803 
1 1 1 -3  10  12 o 14 1.39555e+01 4.38399e-01 3.66016e+02 298.457 1.05227e+01  -1.94147e+01 0.00000e+00 0.00000e+00 1.43624e+02 298.457 2.22392e+02 118.457 0.9771 
1 1 1 -3  10  13 o 8  1.34953e+01 4.22108e-01 1.91151e+02 67.366  5.74493e+00  1.37785e+01  0.00000e+00 0.00000e+00 2.95610e+02 67.366  1.04459e+02 67.366  0.9659 
1 1 1 -3  10  14 o 14 1.32342e+01 4.56883e-01 2.21557e+02 300.005 1.24740e+01  -2.16007e+01 0.00000e+00 0.00000e+00 2.62171e+02 300.005 4.06144e+01 300.005 0.9797 
1 1 1 -3  10  15 o 7  3.10010e+00 7.84280e-01 9.68712e+01 71.151  9.72777e-01  2.84949e+00  0.00000e+00 0.00000e+00 3.19337e+00 251.151 1.00065e+02 251.151 0.8108 
1 1 1 -3  10  16 o 2  6.03735e+00 8.40015e-01 7.33522e+01 338.799 4.96772e+00  -1.92698e+00 0.00000e+00 0.00000e+00 1.29047e+02 338.799 5.56944e+01 338.799 0.9005 
1 1 1 -3  10  17 o 4  1.26310e+01 6.68497e-01 1.59742e+02 65.001  1.34209e+01  2.87823e+01  0.00000e+00 0.00000e+00 3.02518e+02 65.001  1.42775e+02 65.001  0.9841 
1 1 1 -3  10  18 o 18 1.00548e+01 9.07935e-01 1.41321e+02 337.334 2.18687e+01  -9.13280e+00 0.00000e+00 0.00000e+00 2.24180e+02 337.334 8.28586e+01 337.334 0.9787 
1 1 1 -3  10  19 o 4  6.69767e+00 1.34048e+00 1.30605e+02 147.473 -1.00952e+01 6.43796e+00  0.00000e+00 0.00000e+00 1.07244e+02 147.473 2.33615e+01 327.473 0.9573 
1 1 1 -3  10  20 o 4  4.56453e+00 1.38512e+00 8.51712e+01 357.154 6.14122e+00  -3.05323e-01 0.00000e+00 0.00000e+00 6.94964e+01 357.154 1.56748e+01 177.154 0.9146 
1 1 1 -3  11  1  o 17 2.46812e+01 5.68641e-01 4.82537e+02 337.685 5.40745e+00  -2.21935e+00 0.00000e+00 0.00000e+00 3.61572e+02 337.685 1.20965e+02 157.686 0.9099 
1 1 1 -3  11  2  o 11 1.92535e+01 3.84981e-01 4.35932e+02 19.540  3.88954e+00  1.38043e+00  0.00000e+00 0.00000e+00 1.92280e+02 19.540  2.43652e+02 199.540 0.8682 
1 1 1 -3  11  3  o 19 4.99901e+01 8.14509e-01 8.88903e+02 154.505 -1.94249e+01 9.26310e+00  0.00000e+00 0.00000e+00 9.45032e+02 154.505 5.61286e+01 154.505 0.9765 
1 1 1 -3  11  4  o 10 2.56992e+01 4.41284e-01 4.24882e+02 261.584 -9.28210e-01 -6.27377e+00 0.00000e+00 0.00000e+00 4.60544e+02 261.584 3.56621e+01 261.584 0.9174 
1 1 1 -3  11  5  o 10 1.07714e+01 3.45973e-01 4.43179e+02 13.426  3.51592e+00  8.39319e-01  0.00000e+00 0.00000e+00 1.00718e+02 193.426 5.43897e+02 193.426 0.8469 
1 1 1 -3  11  6  o 15 1.67935e+01 3.50888e-01 3.48245e+02 79.441  9.52202e-01  5.10830e+00  0.00000e+00 0.00000e+00 2.17489e+02 79.441  1.30756e+02 259.441 0.8977 
1 1 1 -3  11  7  o 13 2.79116e+01 5.89910e-01 5.09447e+02 33.184  1.43007e+01  9.35241e+00  0.00000e+00 0.00000e+00 5.06281e+02 33.184  3.16659e+00 213.184 0.9703 
1 1 1 -3  11  8  o 6  3.78193e+01 7.67972e-01 7.54742e+02 283.064 8.31449e+00  -3.58306e+01 0.00000e+00 0.00000e+00 6.43462e+02 283.064 1.11281e+02 103.064 0.9863 
1 1 1 -3  11  9  o 6  3.28899e+01 6.91745e-01 5.72669e+02 289.160 1.15505e+01  -3.32430e+01 0.00000e+00 0.00000e+00 6.41747e+02 289.160 6.90776e+01 289.160 0.9857 
1 1 1 -3  11  10 o 5  2.17559e+01 4.61809e-01 2.63101e+02 303.840 7.07053e+00  -1.05459e+01 0.00000e+00 0.00000e+00 5.18538e+02 303.840 2.55437e+02 303.840 0.9598 
1 1 1 -3  11  11 o 9  2.92524e+01 5.35483e-01 5.20183e+02 266.980 -2.29659e+00 -4.35373e+01 0.00000e+00 0.00000e+00 5.61379e+02 266.980 4.11967e+01 266.980 0.9885 
1 1 1 -3  11  12 o 5  2.83402e+01 6.12315e-01 6.32505e+02 335.289 6.92961e+01  -3.18887e+01 0.00000e+00 0.00000e+00 4.19719e+02 335.289 2.12786e+02 155.289 0.9934 
1 1 1 -3  11  13 o 10 1.48973e+01 4.18635e-01 2.99391e+02 186.440 -2.59059e+01 -2.92407e+00 0.00000e+00 0.00000e+00 2.46114e+02 186.440 5.32776e+01 6.440   0.9806 
1 1 1 -3  11  14 o 16 1.71468e+01 4.51747e-01 2.43391e+02 46.700  2.30186e+01  2.44266e+01  0.00000e+00 0.00000e+00 3.86681e+02 46.700  1.43290e+02 46.700  0.9850 
1 1 1 -3  11  15 o 12 5.53076e+00 7.48174e-01 1.07333e+02 206.907 -5.35930e+00 -2.71980e+00 0.00000e+00 0.00000e+00 8.07557e+01 206.907 2.65774e+01 26.907  0.9125 
1 1 1 -3  11  16 o 10 1.35009e+01 5.75502e-01 2.47443e+02 148.518 -3.73940e+01 2.28992e+01  0.00000e+00 0.00000e+00 2.49410e+02 148.518 1.96730e+00 148.518 0.9885 
1 1 1 -3  11  17 o 5  7.14044e+00 9.20114e-01 1.38953e+02 295.037 5.91436e+00  -1.26620e+01 0.00000e+00 0.00000e+00 1.16892e+02 295.037 2.20611e+01 115.037 0.9635 
1 1 1 -3  11  18 o 11 6.41818e+00 1.12875e+00 4.15378e+01 357.601 3.89752e+00  -1.63302e-01 0.00000e+00 0.00000e+00 1.63379e+02 357.601 1.21841e+02 357.601 0.8596 
1 1 1 -3  11  19 o 4  7.69774e+00 1.41922e+00 1.37275e+02 350.454 1.39645e+01  -2.34846e+00 0.00000e+00 0.00000e+00 1.38004e+02 350.454 7.28205e-01 350.454 0.9640 
1 1 1 -3  11  20 o 15 2.85819e+00 9.93050e-01 5.85536e+01 73.206  1.05179e+00  3.48494e+00  0.00000e+00 0.00000e+00 3.12503e+01 73.206  2.73033e+01 253.206 0.8481 
1 1 1 -3  12  1  f 0  1.93310e+01 4.67927e-01 5.31936e+02 256.303 -1.14661e+00 -4.70465e+00 0.00000e+00 0.00000e+00 1.14431e+02 256.303 4.17504e+02 76.303  0.8896 
1 1 1 -3  12  2  o 15 2.32693e+01 5.37099e-01 3.49203e+02 74.868  1.00675e+00  3.72298e+00  0.00000e+00 0.00000e+00 4.00862e+02 74.868  5.16586e+01 74.868  0.8578 
1 1 1 -3  12  3  o 10 4.78079e+01 7.80639e-01 7.34716e+02 212.710 -1.95997e+01 -1.25874e+01 0.00000e+00 0.00000e+00 1.02236e+03 212.710 2.87644e+02 212.710 0.9783 
1 1 1 -3  12  4  o 1  1.22814e+01 3.02260e-01 2.61223e+02 232.195 -1.12486e+00 -1.44987e+00 0.00000e+00 0.00000e+00 4.72234e+01 232.195 2.14000e+02 52.195  0.6687 
1 1 1 -3  12  5  o 18 9.02668e+00 2.55331e-01 1.53742e+02 213.281 -8.70118e-01 -5.71144e-01 0.00000e+00 0.00000e+00 2.36478e+00 213.281 1.51377e+02 33.281  0.4607 
1 1 1 -3  12  6  o 6  1.94010e+01 3.99441e-01 3.02353e+02 326.611 4.32203e+00  -2.84866e+00 0.00000e+00 0.00000e+00 3.50894e+02 326.611 4.85410e+01 326.611 0.8973 
1 1 1 -3  12  7  o 18 7.18696e+00 3.57583e-01 2.03997e+02 163.290 -1.68915e+00 5.07092e-01  0.00000e+00 0.00000e+00 2.74794e+01 343.290 2.31476e+02 343.290 0.6549 
1 1 1 -3  12  8  o 7  2.18101e+01 5.08065e-01 4.87708e+02 335.233 1.25192e+01  -5.77595e+00 0.00000e+00 0.00000e+00 2.99561e+02 335.233 1.88147e+02 155.233 0.9630 
1 1 1 -3  12  9  o 19 2.06287e+01 5.07036e-01 2.91757e+02 327.922 8.97089e+00  -5.62263e+00 0.00000e+00 0.00000e+00 4.43514e+02 327.922 1.51757e+02 327.922 0.9515 
1 1 1 -3  12  10 o 10 2.18464e+01 5.42922e-01 3.80722e+02 132.092 -1.36331e+01 1.50923e+01  0.00000e+00 0.00000e+00 4.16674e+02 132.092 3.59527e+01 132.092 0.9751 
1 1 1 -3  12  11 o 15 2.29498e+01 7.80127e-01 3.98908e+02 212.029 -2.18306e+01 -1.36566e+01 0.00000e+00 0.00000e+00 4.42664e+02 212.029 4.37561e+01 212.029 0.9804 
1 1 1 -3  12  12 o 6  6.15023e+00 5.57304e-01 1.55308e+02 297.272 1.86814e+00  -3.62371e+00 0.00000e+00 0.00000e+00 4.38398e+01 297.272 1.11468e+02 117.273 0.8664 
1 1 1 -3  12  13 o 11 1.29143e+01 4.23146e-01 2.59140e+02 356.548 1.95006e+01  -1.17627e+00 0.00000e+00 0.00000e+00 2.10573e+02 356.548 4.85669e+01 176.548 0.9741 
1 1 1 -3  12  14 o 19 1.31604e+01 4.55879e-01 2.36063e+02 288.878 8.07085e+00  -2.36030e+01 0.00000e+00 0.00000e+00 2.44939e+02 288.878 8.87525e+00 288.878 0.9797 
1 1 1 -3  12  15 o 1  1.14791e+01 5.01277e-01 1.15390e+02 14.524  1.44653e+01  3.74737e+00  0.00000e+00 0.00000e+00 2.97830e+02 14.524  1.82440e+02 14.524  0.9659 
1 1 1 -3  12  16 o 1  1.39699e+01 5.56323e-01 2.49938e+02 337.618 4.25751e+01  -1.75325e+01 0.00000e+00 0.00000e+00 2.64445e+02 337.618 1.45072e+01 337.618 0.9891 
1 1 1 -3  12  17 f 0  5.05870e+00 9.52923e-01 1.21094e+02 59.978  4.24676e+00  7.34908e+00  0.00000e+00 0.00000e+00 5.55602e+01 59.978  6.55333e+01 239.978 0.9391 
1 1 1 -3  12  18 o 18 1.10345e+01 8.58129e-01 1.85417e+02 212.315 -2.96127e+01 -1.87313e+01 0.00000e+00 0.00000e+00 2.18525e+02 212.315 3.31077e+01 212.315 0.9856 
1 1 1 -3  12  19 o 16 1.55073e+01 9.00354e-01 1.47971e+02 90.872  -6.67681e-01 4.38451e+01  0.00000e+00 0.00000e+00 4.20670e+02 90.872  2.72699e+02 90.872  0.9885 
1 1 1 -3  12  20 o 14 5.03195e+00 1.46387e+00 5.74517e+01 353.581 4.26081e+00  -4.79367e-01 0.00000e+00 0.00000e+00 1.05425e+02 353.581 4.79736e+01 353.581 0.8737 
1 1 1 -3  13  1  o 17 2.35672e+01 4.78258e-01 4.84019e+02 212.474 -4.34036e+00 -2.76239e+00 0.00000e+00 0.00000e+00 3.10205e+02 212.474 1.73814e+02 32.474  0.8966 
1 1 1 -3  13  2  o 5  2.44006e+01 5.55568e-01 3.66077e+02 307.682 2.50206e+00  -3.23935e+00 0.00000e+00 0.00000e+00 4.28893e+02 307.682 6.28156e+01 307.682 0.8670 
1 1 1 -3  13  3  o 10 4.79793e+01 7.44276e-01 8.46044e+02 102.017 -5.46827e+00 2.56878e+01  0.00000e+00 0.00000e+00 9.21742e+02 102.017 7.56983e+01 102.017 0.9808 
1 1 1 -3  13  4  o 8  2.36501e+01 5.13764e-01 4.99423e+02 193.401 -6.44864e+00 -1.53644e+00 0.00000e+00 0.00000e+00 3.18704e+02 193.401 1.80719e+02 13.401  0.9211 
1 1 1 -3  13  5  o 12 1.41565e+01 3.86589e-01 1.77844e+02 3.119   1.86291e+00  1.01509e-01  0.00000e+00 0.00000e+00 1.80569e+02 3.119   2.72473e+00 3.119   0.6744 
1 1 1 -3  13  6  o 6  1.71780e+01 3.61726e-01 4.17369e+02 59.306  3.20990e+00  5.40741e+00  0.00000e+00 0.00000e+00 1.73449e+02 59.306  2.43920e+02 239.306 0.9166 
1 1 1 -3  13  7  o 12 2.83520e+01 6.02724e-01 6.14982e+02 326.353 1.72964e+01  -1.15123e+01 0.00000e+00 0.00000e+00 4.22391e+02 326.353 1.92591e+02 146.353 0.9756 
1 1 1 -3  13  8  o 5  4.69598e+01 9.33895e-01 9.65500e+02 346.790 5.56828e+01  -1.30701e+01 0.00000e+00 0.00000e+00 7.79158e+02 346.790 1.86342e+02 166.790 0.9912 
1 1 1 -3  13  9  o 10 2.19378e+01 5.28429e-01 4.58954e+02 121.558 -9.24315e+00 1.50491e+01  0.00000e+00 0.00000e+00 3.39164e+02 121.558 1.19790e+02 301.558 0.9713 
1 1 1 -3  13  10 o 18 4.38936e+01 8.94625e-01 8.41622e+02 113.657 -3.53734e+01 8.07456e+01  0.00000e+00 0.00000e+00 7.92014e+02 113.657 4.96088e+01 293.657 0.9943 
1 1 1 -3  13  11 o 1  2.71288e+01 6.84001e-01 4.10957e+02 233.968 -2.09029e+01 -2.87371e+01 0.00000e+00 0.00000e+00 5.89347e+02 233.968 1.78390e+02 233.968 0.9858 
1 1 1 -3  13  12 f 0  2.66751e+01 6.03751e-01 5.31900e+02 175.846 -6.00624e+01 4.36257e+00  0.00000e+00 0.00000e+00 4.56682e+02 175.846 7.52173e+01 355.846 0.9917 
1 1 1 -3  13  13 o 3  1.31344e+01 7.29612e-01 1.13814e+02 211.623 -7.14843e+00 -4.40174e+00 0.00000e+00 0.00000e+00 3.46397e+02 211.623 2.32583e+02 211.623 0.9384 
1 1 1 -3  13  14 o 7  1.81324e+01 4.59973e-01 2.54306e+02 270.872 5.62300e-01  -3.69576e+01 0.00000e+00 0.00000e+00 4.12881e+02 270.872 1.58575e+02 270.872 0.9864 
1 1 1 -3  13  15 o 3  2.75516e+00 7.88312e-01 2.38870e+01 191.884 -6.73638e-01 -1.41761e-01 0.00000e+00 0.00000e+00 9.51232e+00 191.884 1.43747e+01 11.884  0.3253 
1 1 1 -3  13  16 o 8  1.43419e+01 5.39592e-01 2.35441e+02 89.350  5.07059e-01  4.46943e+01  0.00000e+00 0.00000e+00 2.92444e+02 89.350  5.70028e+01 89.350  0.9887 
1 1 1 -3  13  17 o 19 4.22015e+00 1.03135e+00 3.75431e+01 186.892 -2.10699e+00 -2.54673e-01 0.00000e+00 0.00000e+00 7.49502e+01 186.892 3.74071e+01 186.892 0.7169 
1 1 1 -3  13  18 o 8  1.09194e+01 8.47730e-01 1.26927e+02 245.721 -1.02759e+01 -2.27808e+01 0.00000e+00 0.00000e+00 2.70417e+02 245.721 1.43490e+02 245.721 0.9798 
1 1 1 -3  13  19 o 1  3.63244e+00 1.12712e+00 7.96315e+01 356.534 4.74197e+00  -2.87198e-01 0.00000e+00 0.00000e+00 3.99172e+01 356.534 3.97143e+01 176.534 0.8873 
1 1 1 -3  13  20 o 10 4.10293e+00 1.30085e+00 8.36597e+01 247.051 -2.32971e+00 -5.50200e+00 0.00000e+00 0.00000e+00 5.49520e+01 247.051 2.87078e+01 67.051  0.9120 
1 1 1 -3  14  1  o 8  4.11255e+01 7.80570e-01 1.04447e+03 314.550 1.29734e+01  -1.31787e+01 0.00000e+00 0.00000e+00 4.58797e+02 314.550 5.85673e+02 134.550 0.9726 
1 1 1 -3  14  2  o 8  4.25185e+01 9.19102e-01 6.41438e+02 292.892 4.67064e+00  -1.10615e+01 0.00000e+00 0.00000e+00 8.88185e+02 292.892 2.46747e+02 292.892 0.9574 
1 1 1 -3  14  3  o 12 1.19792e+01 2.57079e-01 2.28287e+02 121.518 -9.06439e-01 1.47815e+00  0.00000e+00 0.00000e+00 6.37114e+01 121.518 1.64576e+02 301.518 0.6489 
1 1 1 -3  14  4  o 14 1.70129e+01 3.81843e-01 3.93627e+02 212.322 -4.61992e+00 -2.92312e+00 0.00000e+00 0.00000e+00 1.83410e+02 212.322 2.10217e+02 32.322  0.9032 
1 1 1 -3  14  5  o 14 1.39112e+01 2.68494e-01 2.36761e+02 70.871  9.33949e-01  2.69262e+00  0.00000e+00 0.00000e+00 1.80089e+02 70.871  5.66721e+01 250.871 0.7983 
1 1 1 -3  14  6  o 5  2.05239e+01 4.76966e-01 4.19789e+02 162.230 -7.85228e+00 2.51660e+00  0.00000e+00 0.00000e+00 3.01959e+02 162.230 1.17830e+02 342.230 0.9372 
1 1 1 -3  14  7  o 11 1.24819e+01 3.91122e-01 3.26605e+02 43.938  3.49951e+00  3.37210e+00  0.00000e+00 0.00000e+00 9.00080e+01 43.938  2.36597e+02 223.938 0.8900 
1 1 1 -3  14  8  f 0  2.56995e+01 5.73931e-01 5.93525e+02 192.513 -1.89753e+01 -4.21120e+00 0.00000e+00 0.00000e+00 3.44577e+02 192.513 2.48949e+02 12.513  0.9739 
1 1 1 -3  14  9  o 2  3.24034e+01 6.88317e-01 6.15689e+02 178.751 -3.46869e+01 7.56519e-01  0.00000e+00 0.00000e+00 5.80389e+02 178.751 3.53008e+01 358.750 0.9855 
1 1 1 -3  14  10 o 14 1.96651e+01 5.27222e-01 2.37562e+02 43.214  8.30479e+00  7.80267e+00  0.00000e+00 0.00000e+00 4.65417e+02 43.214  2.27855e+02 43.214  0.9551 
1 1 1 -3  14  11 o 1  1.37101e+01 5.99736e-01 2.19795e+02 238.715 -5.01255e+00 -8.24895e+00 0.00000e+00 0.00000e+00 2.65643e+02 238.715 4.58480e+01 238.715 0.9467 
1 1 1 -3  14  12 o 1  4.57287e+00 8.88887e-01 1.54746e+02 3.561   2.89576e+00  1.80216e-01  0.00000e+00 0.00000e+00 1.76205e+01 183.561 1.72366e+02 183.561 0.8024 
1 1 1 -3  14  13 o 14 1.85906e+01 7.04995e-01 2.51831e+02 57.271  1.52124e+01  2.36697e+01  0.00000e+00 0.00000e+00 4.29842e+02 57.271  1.78011e+02 57.271  0.9821 
1 1 1 -3  14  14 o 2  1.36216e+01 4.96953e-01 1.90908e+02 244.314 -9.83361e+00 -2.04452e+01 0.00000e+00 0.00000e+00 3.05876e+02 244.314 1.14967e+02 244.314 0.9777 
1 1 1 -3  14  15 o 9  1.97074e+01 5.43266e-01 3.75862e+02 331.169 7.24287e+01  -3.98692e+01 0.00000e+00 0.00000e+00 3.54070e+02 331.169 2.17920e+01 151.169 0.9939 
1 1 1 -3  14  16 o 14 1.09751e+01 7.50453e-01 1.62563e+02 274.011 1.65491e+00  -2.36009e+01 0.00000e+00 0.00000e+00 2.37250e+02 274.011 7.46866e+01 274.011 0.9786 
1 1 1 -3  14  17 o 18 7.22481e+00 9.13760e-01 1.31061e+02 190.635 -1.32109e+01 -2.48074e+00 0.00000e+00 0.00000e+00 1.27382e+02 190.635 3.67948e+00 10.635  0.9621 
1 1 1 -3  14  18 o 11 4.04310e+00 1.13446e+00 7.41758e+01 134.143 -3.16265e+00 3.25871e+00  0.00000e+00 0.00000e+00 5.81891e+01 134.143 1.59867e+01 314.143 0.8815 
1 1 1 -3  14  19 o 10 9.96092e+00 1.12855e+00 1.74973e+02 0.055   2.84313e+01  2.72152e-02  0.00000e+00 0.00000e+00 1.87940e+02 0.055   1.29670e+01 0.055   0.9823 
1 1 1 -3  14  20 o 14 4.85631e+00 1.46095e+00 1.17251e+02 157.497 -8.01148e+00 3.31889e+00  0.00000e+00 0.00000e+00 5.19288e+01 157.497 6.53219e+01 337.497 0.9404 
1 1 1 -3  15  1  o 3  1.24111e+01 3.15254e-01 3.72943e+02 135.320 -1.56717e+00 1.54975e+00  0.00000e+00 0.00000e+00 3.31003e+01 315.320 4.06043e+02 315.320 0.7286 
1 1 1 -3  15  2  o 10 3.54289e+01 7.76031e-01 8.11469e+02 302.371 7.82101e+00  -1.23377e+01 0.00000e+00 0.00000e+00 4.73348e+02 302.371 3.38120e+02 122.371 0.9651 
1 1 1 -3  15  3  o 2  1.51899e+01 2.92833e-01 4.97996e+02 54.167  2.73352e+00  3.78559e+00  0.00000e+00 0.00000e+00 7.04044e+00 54.167  4.90956e+02 234.168 0.8851 
1 1 1 -3  15  4  o 14 2.33879e+01 3.68670e-01 5.45427e+02 126.620 -6.10095e+00 8.20901e+00  0.00000e+00 0.00000e+00 2.88718e+02 126.620 2.56709e+02 306.620 0.9498 
1 1 1 -3  15  5  o 1  9.26539e+00 3.47548e-01 1.62476e+02 200.380 -1.20596e+00 -4.48023e-01 0.00000e+00 0.00000e+00 2.48993e+01 200.380 1.37577e+02 20.380  0.5388 
1 1 1 -3  15  6  o 12 1.49992e+01 3.38267e-01 2.91499e+02 151.375 -3.65423e+00 1.99438e+00  0.00000e+00 0.00000e+00 1.97829e+02 151.375 9.36702e+01 331.375 0.8695 
1 1 1 -3  15  7  o 11 1.43931e+01 4.13374e-01 2.66940e+02 169.218 -4.17799e+00 7.95637e-01  0.00000e+00 0.00000e+00 2.04038e+02 169.218 6.29024e+01 349.218 0.8726 
1 1 1 -3  15  8  o 15 7.44801e+00 4.36792e-01 1.13827e+02 136.398 -7.82586e-01 7.45295e-01  0.00000e+00 0.00000e+00 1.85561e+01 136.398 9.52709e+01 316.398 0.4743 
1 1 1 -3  15  9  f 0  2.66565e+01 7.19695e-01 4.07437e+02 114.708 -7.70711e+00 1.67503e+01  0.00000e+00 0.00000e+00 5.63503e+02 114.708 1.56066e+02 114.708 0.9725 
1 1 1 -3  15  10 o 13 3.01017e+01 6.68901e-01 4.61625e+02 340.444 3.16385e+01  -1.12387e+01 0.00000e+00 0.00000e+00 6.48119e+02 340.444 1.86495e+02 340.444 0.9850 
1 1 1 -3  15  11 o 15 1.37709e+01 5.92216e-01 3.21050e+02 294.973 5.97249e+00  -1.28236e+01 0.00000e+00 0.00000e+00 1.75425e+02 294.973 1.45626e+02 114.973 0.9640 
1 1 1 -3  15  12 o 6  3.02132e+01 9.15445e-01 4.78822e+02 110.282 -2.11120e+01 5.71292e+01  0.00000e+00 0.00000e+00 6.40902e+02 110.282 1.62080e+02 110.282 0.9918 
1 1 1 -3  15  13 o 1  1.01367e+01 7.81137e-01 1.54661e+02 73.832  2.58718e+00  8.92394e+00  0.00000e+00 0.00000e+00 2.02813e+02 73.832  4.81513e+01 73.832  0.9445 
1 1 1 -3  15  14 o 19 3.19996e+01 7.25588e-01 5.51772e+02 164.017 -1.41478e+02 4.05216e+01  0.00000e+00 0.00000e+00 6.37768e+02 164.017 8.59955e+01 164.017 0.9966 
1 1 1 -3  15  15 o 18 6.40309e+00 7.16448e-01 2.18368e+02 79.674  2.58515e+00  1.41884e+01  0.00000e+00 0.00000e+00 1.18030e+01 79.674  2.06565e+02 259.674 0.9647 
1 1 1 -3  15  16 o 19 4.81933e+00 9.54149e-01 1.11701e+02 127.451 -3.99531e+00 5.21606e+00  0.00000e+00 0.00000e+00 5.34097e+01 127.451 5.82914e+01 307.451 0.9204 
1 1 1 -3  15  17 o 11 1.15793e+01 7.07670e-01 2.13562e+02 291.137 1.38728e+01  -3.58834e+01 0.00000e+00 0.00000e+00 2.11336e+02 291.137 2.22633e+00 111.137 0.9869 
1 1 1 -3  15  18 o 5  8.37321e+00 1.03804e+00 1.26835e+02 136.812 -1.24524e+01 1.16887e+01  0.00000e+00 0.00000e+00 1.74875e+02 136.812 4.80403e+01 136.812 0.9703 
1 1 1 -3  15  19 o 9  6.05707e+00 1.41796e+00 9.72505e+01 15.308  7.57466e+00  2.07329e+00  0.00000e+00 0.00000e+00 1.12576e+02 15.308  1.53255e+01 15.308  0.9340 
1 1 1 -3  15  20 o 10 4.35416e+00 1.35069e+00 6.29414e+01 50.643  2.89914e+00  3.53494e+00  0.00000e+00 0.00000e+00 7.93777e+01 50.643  1.64364e+01 50.643  0.8824 
1 1 1 -3  16  1  o 19 2.09546e+01 4.38291e-01 1.83278e+02 237.855 -9.31081e-01 -1.48168e+00 0.00000e+00 0.00000e+00 3.30269e+02 237.855 1.46990e+02 237.855 0.6521 
1 1 1 -3  16  2  o 15 3.37879e+01 5.40978e-01 9.04449e+02 335.780 1.37019e+01  -6.16365e+00 0.00000e+00 0.00000e+00 3.22053e+02 335.780 5.82396e+02 155.780 0.9661 
1 1 1 -3  16  3  o 19 1.44231e+01 2.84233e-01 2.63146e+02 333.168 2.72341e+00  -1.37760e+00 0.00000e+00 0.00000e+00 1.77724e+02 333.168 8.54219e+01 153.168 0.8138 
1 1 1 -3  16  4  f 0  3.18057e+00 3.04180e-01 4.03034e+02 260.619 -1.64568e-01 -9.96124e-01 0.00000e+00 0.00000e+00 3.49315e+02 80.619  7.52349e+02 80.619  0.4498 
1 1 1 -3  16  5  o 5  1.68244e+01 3.36134e-01 2.68907e+02 109.920 -1.20751e+00 3.33207e+00  0.00000e+00 0.00000e+00 2.63689e+02 109.920 5.21817e+00 289.920 0.8434 
1 1 1 -3  16  6  f 0  6.13817e+00 3.65066e-01 5.65703e+01 342.121 3.12258e-01  -1.00729e-01 0.00000e+00 0.00000e+00 1.92900e+01 162.121 7.58602e+01 162.121 0.1619 
1 1 1 -3  16  7  o 9  2.45083e+01 5.49928e-01 5.41478e+02 190.016 -1.43623e+01 -2.53660e+00 0.00000e+00 0.00000e+00 3.45460e+02 190.016 1.96018e+02 10.016  0.9651 
1 1 1 -3  16  8  o 1  4.42238e+01 8.89997e-01 6.92589e+02 357.597 3.99450e+01  -1.67596e+00 0.00000e+00 0.00000e+00 9.43919e+02 357.597 2.51330e+02 357.597 0.9874 
1 1 1 -3  16  9  f 0  3.35303e+01 7.12226e-01 6.12892e+02 255.325 -8.81815e+00 -3.36717e+01 0.00000e+00 0.00000e+00 6.24738e+02 255.325 1.18460e+01 255.325 0.9855 
1 1 1 -3  16  10 o 1  1.35772e+01 4.90898e-01 4.56904e+02 114.111 -6.09680e+00 1.36227e+01  0.00000e+00 0.00000e+00 3.39133e+01 114.111 4.22991e+02 294.111 0.9659 
1 1 1 -3  16  11 o 2  2.40740e+01 6.63503e-01 4.29320e+02 187.701 -3.15398e+01 -4.26489e+00 0.00000e+00 0.00000e+00 4.56743e+02 187.701 2.74232e+01 187.701 0.9842 
1 1 1 -3  16  12 o 19 1.03403e+01 6.94055e-01 2.58405e+02 172.010 -1.14451e+01 1.60643e+00  0.00000e+00 0.00000e+00 1.10870e+02 172.010 1.47535e+02 352.010 0.9557 
1 1 1 -3  16  13 o 7  2.14377e+01 7.02168e-01 4.41281e+02 319.902 4.33868e+01  -3.65320e+01 0.00000e+00 0.00000e+00 3.51992e+02 319.902 8.92886e+01 139.902 0.9911 
1 1 1 -3  16  14 o 13 1.43648e+01 7.63667e-01 1.53282e+02 79.858  3.19942e+00  1.78855e+01  0.00000e+00 0.00000e+00 3.67548e+02 79.858  2.14267e+02 79.858  0.9721 
1 1 1 -3  16  15 o 19 5.64678e+00 9.62368e-01 1.05579e+02 56.746  3.12142e+00  4.76027e+00  0.00000e+00 0.00000e+00 8.53220e+01 56.746  2.02574e+01 236.746 0.9073 
1 1 1 -3  16  16 f 0  1.69127e+01 1.00299e+00 2.32529e+02 261.890 -6.62238e+00 -4.64748e+01 0.00000e+00 0.00000e+00 3.90248e+02 261.890 1.57719e+02 261.890 0.9893 
1 1 1 -3  16  17 f 0  5.76478e+00 1.03287e+00 1.16520e+02 120.244 -4.52912e+00 7.76800e+00  0.00000e+00 0.00000e+00 8.55175e+01 120.244 3.10025e+01 300.244 0.9426 
1 1 1 -3  16  18 f 0  1.55115e+01 7.61276e-01 3.04809e+02 226.383 -5.78866e+01 -6.07514e+01 0.00000e+00 0.00000e+00 2.67774e+02 226.383 3.70344e+01 46.383  0.9940 
1 1 1 -3  16  19 o 9  6.89379e+00 1.37617e+00 1.21381e+02 58.045  6.07652e+00  9.74148e+00  0.00000e+00 0.00000e+00 1.22900e+02 58.045  1.51953e+00 58.045  0.9554 
1 1 1 -3  16  20 o 6  4.21506e+00 1.31573e+00 1.02921e+02 342.107 7.11298e+00  -2.29644e+00 0.00000e+00 0.00000e+00 4.23513e+01 342.107 6.05699e+01 162.107 0.9305 
1 1 1 -3  17  1  o 7  2.96289e+01 6.65649e-01 2.80901e+02 241.648 -2.05610e+00 -3.81038e+00 0.00000e+00 0.00000e+00 6.93462e+02 241.648 4.12561e+02 241.648 0.8751 
1 1 1 -3  17  2  o 4  1.14853e+01 5.15268e-01 1.12480e+02 257.432 -1.87325e-01 -8.40262e-01 0.00000e+00 0.00000e+00 5.79411e+01 257.432 5.45389e+01 77.432  0.3949 
1 1 1 -3  17  3  o 10 1.11556e+01 2.41465e-01 3.70434e+02 306.694 1.93350e+00  -2.59457e+00 0.00000e+00 0.00000e+00 2.43251e+01 126.694 3.94759e+02 126.694 0.8260 
1 1 1 -3  17  4  o 1  1.27997e+01 2.95512e-01 4.29341e+02 199.299 -3.95358e+00 -1.38448e+00 0.00000e+00 0.00000e+00 1.10122e+01 19.299  4.40353e+02 19.299  0.8704 
1 1 1 -3  17  5  o 7  6.39650e+00 3.58289e-01 3.45847e+02 294.727 7.16091e-01  -1.55495e+00 0.00000e+00 0.00000e+00 1.91156e+02 114.727 5.37003e+02 114.727 0.6443 
1 1 1 -3  17  6  o 18 1.49080e+01 3.47065e-01 1.82455e+02 163.211 -2.35934e+00 7.11851e-01  0.00000e+00 0.00000e+00 2.43203e+02 163.211 6.07479e+01 163.211 0.7611 
1 1 1 -3  17  7  o 16 2.24468e+01 6.15233e-01 3.34994e+02 271.431 2.46184e-01  -9.85323e+00 0.00000e+00 0.00000e+00 4.62776e+02 271.431 1.27782e+02 271.431 0.9478 
1 1 1 -3  17  8  o 7  1.02890e+01 4.27450e-01 2.40655e+02 97.157  -4.07396e-01 3.24461e+00  0.00000e+00 0.00000e+00 7.86542e+01 97.157  1.62001e+02 277.157 0.8281 
1 1 1 -3  17  9  o 9  1.80921e+01 4.91780e-01 3.45155e+02 90.064  -1.19551e-02 1.06367e+01  0.00000e+00 0.00000e+00 2.99734e+02 90.064  4.54209e+01 270.064 0.9518 
1 1 1 -3  17  10 o 19 2.72275e+01 7.39849e-01 5.53030e+02 121.333 -1.85548e+01 3.04776e+01  0.00000e+00 0.00000e+00 4.51574e+02 121.333 1.01455e+02 301.333 0.9859 
1 1 1 -3  17  11 o 12 1.18698e+01 6.32717e-01 3.57622e+02 18.100  1.24323e+01  4.06359e+00  0.00000e+00 0.00000e+00 6.89435e+01 18.100  2.88679e+02 198.100 0.9610 
1 1 1 -3  17  12 o 18 8.25222e+00 7.96126e-01 1.38446e+02 297.600 2.25828e+00  -4.31976e+00 0.00000e+00 0.00000e+00 1.36104e+02 297.600 2.34276e+00 117.600 0.8904 
1 1 1 -3  17  13 o 8  9.92810e+00 7.59295e-01 7.77757e+01 59.336  2.38828e+00  4.02810e+00  0.00000e+00 0.00000e+00 2.50416e+02 59.336  1.72640e+02 59.336  0.8855 
1 1 1 -3  17  14 o 15 1.82596e+01 7.64259e-01 3.55680e+02 123.844 -3.02466e+01 4.51072e+01  0.00000e+00 0.00000e+00 3.19053e+02 123.844 3.66275e+01 303.844 0.9908 
1 1 1 -3  17  15 o 17 7.35493e+00 1.04455e+00 2.33055e+02 43.257  1.15694e+01  1.08862e+01  0.00000e+00 0.00000e+00 3.22166e+01 43.257  2.00839e+02 223.257 0.9680 
1 1 1 -3  17  16 o 7  3.45329e+00 1.06831e+00 6.41095e+01 330.623 2.24811e+00  -1.26555e+00 0.00000e+00 0.00000e+00 3.52979e+01 330.623 2.88116e+01 150.623 0.7734 
1 1 1 -3  17  17 o 17 7.88663e+00 1.07336e+00 1.71344e+02 281.638 3.57003e+00  -1.73341e+01 0.00000e+00 0.00000e+00 1.13456e+02 281.638 5.78875e+01 101.638 0.9713 
1 1 1 -3  17  18 o 17 7.30855e+00 1.35492e+00 1.45236e+02 166.069 -1.29244e+01 3.20589e+00  0.00000e+00 0.00000e+00 1.15759e+02 166.069 2.94771e+01 346.069 0.9617 
1 1 1 -3  17  19 o 11 6.61208e+00 1.59194e+00 7.58308e+01 280.777 1.12163e+00  -5.89284e+00 0.00000e+00 0.00000e+00 1.47896e+02 280.777 7.20653e+01 280.777 0.9123 
1 1 1 -3  17  20 f 0  4.52436e+00 1.54055e+00 7.02264e+01 123.753 -2.52333e+00 3.77602e+00  0.00000e+00 0.00000e+00 7.74984e+01 123.753 7.27202e+00 123.753 0.8815 
1 1 1 -3  18  1  o 2  2.22940e+01 4.65336e-01 4.65383e+02 224.159 -3.72124e+00 -3.61360e+00 0.00000e+00 0.00000e+00 2.86538e+02 224.159 1.78845e+02 44.159  0.8975 
1 1 1 -3  18  2  o 11 2.51562e+01 5.11604e-01 3.69944e+02 301.293 3.10962e+00  -5.11587e+00 0.00000e+00 0.00000e+00 4.92133e+02 301.293 1.22189e+02 301.293 0.9122 
1 1 1 -3  18  3  o 19 2.19679e+01 3.56825e-01 4.23841e+02 310.665 3.54218e+00  -4.12330e+00 0.00000e+00 0.00000e+00 3.20884e+02 310.665 1.02957e+02 130.665 0.9026 
1 1 1 -3  18  4  o 3  1.43226e+01 3.14137e-01 3.86096e+02 70.606  1.37371e+00  3.90217e+00  0.00000e+00 0.00000e+00 8.09989e+01 70.606  3.05097e+02 250.606 0.8686 
1 1 1 -3  18  5  o 4  1.42132e+01 2.64948e-01 2.50175e+02 6.750   2.70203e+00  3.19796e-01  0.00000e+00 0.00000e+00 1.69662e+02 6.750   8.05125e+01 186.750 0.7870 
1 1 1 -3  18  6  o 6  1.59114e+01 3.10902e-01 2.91092e+02 315.668 2.98008e+00  -2.91144e+00 0.00000e+00 0.00000e+00 2.27991e+02 315.668 6.31006e+01 135.668 0.8696 
1 1 1 -3  18  7  o 9  5.07746e+01 1.00814e+00 1.09658e+03 105.025 -1.85369e+01 6.90612e+01  0.00000e+00 0.00000e+00 7.93852e+02 105.025 3.02733e+02 285.025 0.9930 
1 1 1 -3  18  8  o 14 3.00885e+01 6.51101e-01 4.04718e+02 231.954 -9.81942e+00 -1.25476e+01 0.00000e+00 0.00000e+00 6.86820e+02 231.954 2.82101e+02 231.954 0.9681 
1 1 1 -3  18  9  o 16 1.57916e+01 4.77366e-01 2.14546e+02 63.351  2.61100e+00  5.20298e+00  0.00000e+00 0.00000e+00 3.23315e+02 63.351  1.08770e+02 63.351  0.9095 
1 1 1 -3  18  10 o 5  3.05634e+01 6.82443e-01 6.28543e+02 107.469 -1.52841e+01 4.85675e+01  0.00000e+00 0.00000e+00 5.03945e+02 107.469 1.24598e+02 287.469 0.9901 
1 1 1 -3  18  11 o 8  2.22965e+01 6.49515e-01 3.41497e+02 176.370 -2.33431e+01 1.48103e+00  0.00000e+00 0.00000e+00 4.74247e+02 176.370 1.32750e+02 176.370 0.9784 
1 1 1 -3  18  12 o 4  1.30469e+01 8.05651e-01 3.09891e+02 208.332 -1.58671e+01 -8.55490e+00 0.00000e+00 0.00000e+00 1.63872e+02 208.332 1.46019e+02 28.332  0.9719 
1 1 1 -3  18  13 o 3  5.26688e+00 1.04382e+00 5.35613e+01 339.542 1.51276e+00  -5.64330e-01 0.00000e+00 0.00000e+00 6.89720e+01 339.542 1.54107e+01 339.542 0.6232 
1 1 1 -3  18  14 o 19 2.86927e+01 8.31567e-01 5.53542e+02 66.685  5.16332e+01  1.19804e+02  0.00000e+00 0.00000e+00 5.12454e+02 66.685  4.10884e+01 246.685 0.9962 
1 1 1 -3  18  15 o 9  1.25366e+01 8.98594e-01 2.21928e+02 262.891 -3.53384e+00 -2.83335e+01 0.00000e+00 0.00000e+00 2.36904e+02 262.891 1.49760e+01 262.891 0.9823 
1 1 1 -3  18  16 f 0  7.63635e+00 1.12270e+00 1.04564e+02 25.284  8.19690e+00  3.87184e+00  0.00000e+00 0.00000e+00 1.63480e+02 25.284  5.89168e+01 25.284  0.9431 
1 1 1 -3  18  17 o 5  1.15567e+01 1.24490e+00 2.31839e+02 199.329 -3.01632e+01 -1.05804e+01 0.00000e+00 0.00000e+00 1.91020e+02 199.329 4.08188e+01 19.329  0.9842 
1 1 1 -3  18  18 o 7  1.12873e+01 1.52372e+00 1.68405e+02 118.466 -1.02051e+01 1.88220e+01  0.00000e+00 0.00000e+00 2.40805e+02 118.466 7.24005e+01 118.466 0.9764 
1 1 1 -3  18  19 o 10 4.11882e+00 1.38551e+00 2.72979e+01 5.802   1.54867e+00  1.57364e-01  0.00000e+00 0.00000e+00 6.58519e+01 5.802   3.85540e+01 5.802   0.6098 
1 1 1 -3  18  20 o 5  5.29932e+00 1.67226e+00 1.17373e+02 357.505 7.61931e+00  -3.32057e-01 0.00000e+00 0.00000e+00 6.55357e+01 357.505 5.18377e+01 177.505 0.9319 
1 1 1 -3  19  1  o 11 1.55259e+01 3.31543e-01 2.09278e+02 74.994  4.04062e-01  1.50734e+00  0.00000e+00 0.00000e+00 1.47029e+02 74.994  6.22485e+01 254.994 0.6108 
1 1 1 -3  19  2  o 10 2.35366e+01 4.03781e-01 5.12182e+02 301.091 3.87232e+00  -6.42154e+00 0.00000e+00 0.00000e+00 3.10763e+02 301.091 2.01419e+02 121.091 0.9307 
1 1 1 -3  19  3  o 1  4.98058e+00 2.27050e-01 2.93832e+02 310.296 5.38603e-01  -6.35190e-01 0.00000e+00 0.00000e+00 2.21997e+02 130.296 5.15830e+02 130.296 0.3840 
1 1 1 -3  19  4  o 2  3.83920e+00 3.61828e-01 8.81276e+01 255.581 -6.47692e-02 -2.51909e-01 0.00000e+00 0.00000e+00 6.95386e+01 75.581  1.57666e+02 75.581  0.1290 
1 1 1 -3  19  5  o 10 2.22565e+01 3.57469e-01 5.34105e+02 6.587   1.01574e+01  1.17292e+00  0.00000e+00 0.00000e+00 2.59212e+02 6.587   2.74893e+02 186.587 0.9498 
1 1 1 -3  19  6  o 4  2.87338e+01 4.84453e-01 6.44849e+02 115.981 -8.63717e+00 1.77235e+01  0.00000e+00 0.00000e+00 4.05327e+02 115.981 2.39522e+02 295.981 0.9743 
1 1 1 -3  19  7  o 8  1.40384e+01 4.26760e-01 2.85529e+02 274.735 4.31519e-01  -5.20918e+00 0.00000e+00 0.00000e+00 1.87335e+02 274.735 9.81940e+01 94.735  0.8984 
1 1 1 -3  19  8  o 16 1.53341e+01 5.15933e-01 3.06961e+02 323.549 5.13610e+00  -3.79364e+00 0.00000e+00 0.00000e+00 2.20490e+02 323.549 8.64705e+01 143.549 0.9180 
1 1 1 -3  19  9  o 19 1.46853e+01 5.61145e-01 2.75356e+02 66.285  2.78241e+00  6.33407e+00  0.00000e+00 0.00000e+00 2.33110e+02 66.285  4.22466e+01 246.285 0.9246 
1 1 1 -3  19  10 o 1  1.19357e+01 5.03378e-01 2.54938e+02 146.517 -6.78568e+00 4.48852e+00  0.00000e+00 0.00000e+00 1.63286e+02 146.517 9.16521e+01 326.517 0.9364 
1 1 1 -3  19  11 o 9  2.15954e+01 6.45030e-01 2.70850e+02 186.770 -1.84247e+01 -2.18720e+00 0.00000e+00 0.00000e+00 5.14588e+02 186.770 2.43738e+02 186.770 0.9727 
1 1 1 -3  19  12 o 13 1.92473e+01 6.67152e-01 2.74782e+02 177.732 -2.39202e+01 9.47259e-01  0.00000e+00 0.00000e+00 4.29149e+02 177.732 1.54367e+02 177.732 0.9789 
1 1 1 -3  19  13 o 2  2.48574e+01 7.46057e-01 4.59708e+02 319.225 5.75900e+01  -4.96670e+01 0.00000e+00 0.00000e+00 4.62067e+02 319.225 2.35835e+00 319.225 0.9934 
1 1 1 -3  19  14 f 0  2.25452e+01 7.80959e-01 4.39542e+02 226.064 -5.71116e+01 -5.92733e+01 0.00000e+00 0.00000e+00 3.96126e+02 226.064 4.34163e+01 46.064  0.9939 
1 1 1 -3  19  15 o 10 9.75200e+00 9.84955e-01 1.92215e+02 68.882  6.71519e+00  1.73864e+01  0.00000e+00 0.00000e+00 1.61221e+02 68.882  3.09940e+01 248.882 0.9728 
1 1 1 -3  19  16 o 10 8.79494e+00 1.16837e+00 2.05398e+02 141.827 -1.62662e+01 1.27879e+01  0.00000e+00 0.00000e+00 1.13907e+02 141.827 9.14906e+01 321.827 0.9755 
1 1 1 -3  19  17 o 8  3.90702e+00 1.22783e+00 1.08369e+02 98.768  -8.04069e-01 5.21293e+00  0.00000e+00 0.00000e+00 2.22575e+01 98.768  8.61118e+01 278.768 0.8994 
1 1 1 -3  19  18 o 7  9.61361e+00 1.64020e+00 1.27656e+02 154.065 -1.17009e+01 5.69045e+00  0.00000e+00 0.00000e+00 2.15294e+02 154.065 8.76380e+01 154.065 0.9608 
1 1 1 -3  19  19 o 17 4.58878e+00 1.49836e+00 4.43619e+01 110.858 -9.57005e-01 2.51164e+00  0.00000e+00 0.00000e+00 8.90445e+01 110.858 4.46826e+01 110.858 0.7840 
1 1 1 -3  19  20 o 18 4.26771e+00 1.44413e+00 5.95962e+01 156.523 -3.40899e+00 1.48061e+00  0.00000e+00 0.00000e+00 7.50136e+01 156.523 1.54174e+01 156.523 0.8517 
1 1 1 -3  20  1  o 17 1.90743e+01 3.52168e-01 3.54091e+02 53.724  2.59054e+00  3.52973e+00  0.00000e+00 0.00000e+00 2.74188e+02 53.724  7.99037e+01 233.724 0.8766 
1 1 1 -3  20  2  o 10 2.00550e+01 3.59929e-01 3.26859e+02 217.999 -4.15625e+00 -3.24716e+00 0.00000e+00 0.00000e+00 3.50709e+02 217.999 2.38495e+01 217.999 0.8994 
1 1 1 -3  20  3  o 4  1.39306e+01 2.71401e-01 4.15635e+02 40.241  3.62387e+00  3.06687e+00  0.00000e+00 0.00000e+00 4.85062e+01 40.241  3.67129e+02 220.241 0.8872 
1 1 1 -3  20  4  o 16 5.27568e+00 2.78843e-01 2.88255e+02 277.729 1.54505e-01  -1.13835e+00 0.00000e+00 0.00000e+00 1.89891e+02 97.729  4.78147e+02 97.729  0.4966 
1 1 1 -3  20  5  o 18 2.02934e+01 3.27739e-01 4.47294e+02 110.726 -2.73101e+00 7.21744e+00  0.00000e+00 0.00000e+00 2.63061e+02 110.726 1.84233e+02 290.726 0.9328 
1 1 1 -3  20  6  o 5  8.21995e+00 2.09088e-01 2.32436e+02 349.813 1.99331e+00  -3.58186e-01 0.00000e+00 0.00000e+00 1.60237e+01 169.813 2.48460e+02 169.813 0.7019 
1 1 1 -3  20  7  o 14 9.56585e+00 4.03630e-01 1.56576e+02 253.119 -5.16801e-01 -1.70307e+00 0.00000e+00 0.00000e+00 7.94342e+01 253.119 7.71421e+01 73.119  0.6581 
1 1 1 -3  20  8  o 2  2.63668e+01 5.98364e-01 4.56028e+02 218.663 -1.26647e+01 -1.01328e+01 0.00000e+00 0.00000e+00 5.00962e+02 218.663 4.49343e+01 218.663 0.9687 
1 1 1 -3  20  9  o 19 1.00300e+01 4.82607e-01 1.72208e+02 284.911 9.33859e-01  -3.50690e+00 0.00000e+00 0.00000e+00 1.46121e+02 284.911 2.60867e+01 104.911 0.8476 
1 1 1 -3  20  10 o 17 1.88532e+01 5.38125e-01 3.81097e+02 184.652 -1.86856e+01 -1.52062e+00 0.00000e+00 0.00000e+00 3.05295e+02 184.652 7.58018e+01 4.652   0.9730 
1 1 1 -3  20  11 o 11 1.46186e+01 8.12022e-01 1.68943e+02 5.912   7.66382e+00  7.93573e-01  0.00000e+00 0.00000e+00 3.40840e+02 5.912   1.71897e+02 5.912   0.9326 
1 1 1 -3  20  12 o 11 1.06919e+01 9.34739e-01 1.56287e+02 124.318 -4.33785e+00 6.35478e+00  0.00000e+00 0.00000e+00 2.16220e+02 124.318 5.99324e+01 124.318 0.9325 
1 1 1 -3  20  13 o 17 2.38116e+01 7.40650e-01 4.11634e+02 317.442 4.80128e+01  -4.40854e+01 0.00000e+00 0.00000e+00 4.70334e+02 317.442 5.86996e+01 317.442 0.9923 
1 1 1 -3  20  14 o 8  5.21151e+00 9.33217e-01 1.17809e+02 121.563 -2.69135e+00 4.38107e+00  0.00000e+00 0.00000e+00 5.64348e+01 121.563 6.13745e+01 301.563 0.8966 
1 1 1 -3  20  15 o 7  4.86717e+00 1.15714e+00 7.87301e+01 237.285 -1.82630e+00 -2.84311e+00 0.00000e+00 0.00000e+00 7.25888e+01 237.285 6.14135e+00 57.285  0.8345 
1 1 1 -3  20  16 o 3  6.69231e+00 1.23430e+00 1.09758e+02 116.681 -3.65220e+00 7.26759e+00  0.00000e+00 0.00000e+00 1.23438e+02 116.681 1.36804e+01 116.681 0.9363 
1 1 1 -3  20  17 o 5  5.72545e+00 1.44851e+00 1.74195e+02 343.537 1.04754e+01  -3.09550e+00 0.00000e+00 0.00000e+00 2.86441e+01 343.537 1.45551e+02 163.538 0.9531 
1 1 1 -3  20  18 o 13 5.27961e+00 1.54554e+00 1.19243e+02 267.429 -3.18162e-01 -7.08449e+00 0.00000e+00 0.00000e+00 6.23787e+01 267.429 5.68648e+01 87.429  0.9265 
1 1 1 -3  20  19 o 17 4.71208e+00 1.51141e+00 1.07872e+02 275.890 6.81687e-01  -6.60827e+00 0.00000e+00 0.00000e+00 5.31119e+01 275.890 5.47598e+01 95.890  0.9213 
1 1 1 -3  20  20 o 13 6.10821e+00 1.82984e+00 4.97383e+01 243.810 -1.45973e+00 -2.96783e+00 0.00000e+00 0.00000e+00 1.38096e+02 243.810 8.83579e+01 243.810 0.8304 
1 1 1 -3  21  1  o 9  1.80308e+01 3.41557e-01 4.56846e+02 148.157 -4.36355e+00 2.71005e+00  0.00000e+00 0.00000e+00 1.50452e+02 148.157 3.06393e+02 328.157 0.8965 
1 1 1 -3  21  2  o 11 1.10603e+01 2.99950e-01 8.89434e+01 30.915  6.57222e-01  3.93566e-01  0.00000e+00 0.00000e+00 5.95534e+01 30.915  2.93899e+01 210.915 0.3574 
1 1 1 -3  21  3  o 4  1.00069e+01 2.42697e-01 2.62159e+02 252.680 -6.24260e-01 -2.00183e+00 0.00000e+00 0.00000e+00 5.80206e+00 252.680 2.56356e+02 72.680  0.7131 
1 1 1 -3  21  4  o 9  2.15030e+01 3.55642e-01 5.89712e+02 32.014  7.97180e+00  4.98414e+00  0.00000e+00 0.00000e+00 1.73300e+02 32.014  4.16412e+02 212.014 0.9452 
1 1 1 -3  21  5  o 16 1.79514e+01 3.19320e-01 5.08307e+02 359.355 8.14616e+00  -9.17332e-02 0.00000e+00 0.00000e+00 1.22520e+02 359.355 3.85787e+02 179.355 0.9364 
1 1 1 -3  21  6  o 1  1.39011e+01 2.86701e-01 1.19151e+02 198.213 -1.65040e+00 -5.43026e-01 0.00000e+00 0.00000e+00 2.19551e+02 198.213 1.00400e+02 198.213 0.6496 
1 1 1 -3  21  7  o 14 2.21258e+01 5.26851e-01 3.46995e+02 242.005 -4.24822e+00 -7.99134e+00 0.00000e+00 0.00000e+00 4.35216e+02 242.005 8.82214e+01 242.005 0.9430 
1 1 1 -3  21  8  o 11 1.67829e+01 4.76603e-01 3.35233e+02 191.461 -8.76449e+00 -1.77692e+00 0.00000e+00 0.00000e+00 2.57301e+02 191.461 7.79320e+01 11.461  0.9423 
1 1 1 -3  21  9  o 16 8.71929e+00 4.97634e-01 9.15952e+01 159.535 -1.56678e+00 5.84688e-01  0.00000e+00 0.00000e+00 1.16024e+02 159.535 2.44293e+01 159.535 0.6359 
1 1 1 -3  21  10 o 7  1.49940e+01 5.26773e-01 2.03417e+02 75.978  1.92671e+00  7.71478e+00  0.00000e+00 0.00000e+00 3.21048e+02 75.978  1.17631e+02 75.978  0.9348 
1 1 1 -3  21  11 o 2  2.18174e+01 6.10222e-01 4.59224e+02 292.940 1.27971e+01  -3.02364e+01 0.00000e+00 0.00000e+00 3.43977e+02 292.940 1.15247e+02 112.940 0.9847 
1 1 1 -3  21  12 o 10 9.78758e+00 7.69737e-01 1.35214e+02 223.358 -4.53314e+00 -4.28054e+00 0.00000e+00 0.00000e+00 1.99663e+02 223.358 6.44483e+01 223.358 0.9159 
1 1 1 -3  21  13 o 9  2.34631e+01 7.47534e-01 3.40108e+02 260.374 -8.84640e+00 -5.21583e+01 0.00000e+00 0.00000e+00 5.27329e+02 260.374 1.87221e+02 260.374 0.9905 
1 1 1 -3  21  14 o 10 1.06207e+01 8.83751e-01 1.61761e+02 189.266 -1.43777e+01 -2.34564e+00 0.00000e+00 0.00000e+00 2.20434e+02 189.266 5.86727e+01 189.266 0.9650 
1 1 1 -3  21  15 o 3  1.04519e+01 9.67672e-01 1.55923e+02 77.715  3.26986e+00  1.50160e+01  0.00000e+00 0.00000e+00 2.20542e+02 77.715  6.46189e+01 77.715  0.9669 
1 1 1 -3  21  16 o 5  6.65089e+00 1.20436e+00 1.41573e+02 30.596  8.73792e+00  5.16682e+00  0.00000e+00 0.00000e+00 9.33947e+01 30.596  4.81785e+01 210.596 0.9494 
1 1 1 -3  21  17 o 4  3.94826e+00 1.24471e+00 6.01531e+01 187.576 -2.74779e+00 -3.65470e-01 0.00000e+00 0.00000e+00 5.60210e+01 187.576 4.13213e+00 7.576   0.7916 
1 1 1 -3  21  18 o 18 6.80665e+00 1.74091e+00 6.59725e+01 128.599 -2.66739e+00 3.34145e+00  0.00000e+00 0.00000e+00 1.54723e+02 128.599 8.87508e+01 128.599 0.8733 
1 1 1 -3  21  19 o 10 5.34822e+00 1.70599e+00 1.28719e+02 110.399 -2.64763e+00 7.11949e+00  0.00000e+00 0.00000e+00 5.60331e+01 110.399 7.26863e+01 290.399 0.9316 
1 1 1 -3  21  20 o 10 5.15639e+00 1.68936e+00 7.73893e+01 143.205 -4.02584e+00 3.01118e+00  0.00000e+00 0.00000e+00 9.33188e+01 143.205 1.59295e+01 143.205 0.8940 
1 1 1 -3  22  1  o 7  3.06371e+01 5.53344e-01 4.60186e+02 181.722 -1.12909e+01 -3.39381e-01 0.00000e+00 0.00000e+00 6.38631e+02 181.722 1.78445e+02 181.722 0.9547 
1 1 1 -3  22  2  o 3  4.77299e+00 3.59597e-01 2.92048e+01 113.920 -3.26519e-02 7.36129e-02  0.00000e+00 0.00000e+00 2.19921e+01 293.920 5.11969e+01 293.920 0.0402 
1 1 1 -3  22  3  o 9  4.35337e+00 2.46393e-01 2.00730e+02 210.806 -5.76804e-01 -3.43926e-01 0.00000e+00 0.00000e+00 1.48718e+02 30.806  3.49448e+02 30.806  0.3182 
1 1 1 -3  22  4  f 0  2.13913e+01 3.53049e-01 5.71635e+02 340.983 9.93200e+00  -3.42308e+00 0.00000e+00 0.00000e+00 1.92127e+02 340.983 3.79508e+02 160.983 0.9511 
1 1 1 -3  22  5  o 11 2.86650e+01 4.29642e-01 6.15439e+02 25.556  1.40234e+01  6.70549e+00  0.00000e+00 0.00000e+00 4.24975e+02 25.556  1.90464e+02 205.555 0.9673 
1 1 1 -3  22  6  o 7  1.64542e+01 3.33118e-01 2.33104e+02 86.989  2.09569e-01  3.98385e+00  0.00000e+00 0.00000e+00 2.99552e+02 86.989  6.64487e+01 86.989  0.8631 
1 1 1 -3  22  7  o 8  2.66083e+01 4.63256e-01 5.45552e+02 62.793  8.15180e+00  1.58569e+01  0.00000e+00 0.00000e+00 4.23518e+02 62.793  1.22035e+02 242.793 0.9715 
1 1 1 -3  22  8  f 0  3.69519e+01 7.72465e-01 6.40146e+02 30.109  3.20286e+01  1.85731e+01  0.00000e+00 0.00000e+00 7.25434e+02 30.109  8.52881e+01 30.109  0.9864 
1 1 1 -3  22  9  o 9  2.33347e+01 5.75260e-01 4.11632e+02 331.960 1.76724e+01  -9.41240e+00 0.00000e+00 0.00000e+00 4.39942e+02 331.960 2.83093e+01 331.960 0.9747 
1 1 1 -3  22  10 o 19 5.37796e+01 1.08724e+00 9.26850e+02 199.882 -1.22896e+02 -4.44451e+01 0.00000e+00 0.00000e+00 1.07759e+03 199.882 1.50743e+02 199.882 0.9962 
1 1 1 -3  22  11 o 12 1.60848e+01 5.77949e-01 2.17150e+02 232.294 -7.00127e+00 -9.05656e+00 0.00000e+00 0.00000e+00 3.57305e+02 232.294 1.40155e+02 232.294 0.9553 
1 1 1 -3  22  12 f 0  2.22380e+01 6.89637e-01 4.81134e+02 105.300 -1.31398e+01 4.80296e+01  0.00000e+00 0.00000e+00 3.41193e+02 105.300 1.39941e+02 285.300 0.9899 
1 1 1 -3  22  13 f 0  2.59009e+01 7.64888e-01 3.32316e+02 270.426 4.37275e-01  -5.87808e+01 0.00000e+00 0.00000e+00 6.26112e+02 270.426 2.93796e+02 270.426 0.9915 
1 1 1 -3  22  14 f 0  2.21586e+01 9.34682e-01 3.29306e+02 137.692 -4.50826e+01 4.10340e+01  0.00000e+00 0.00000e+00 4.90123e+02 137.692 1.60817e+02 137.692 0.9918 
1 1 1 -3  22  15 o 9  8.52074e+00 1.03558e+00 7.80133e+01 225.605 -4.60670e+00 -4.70499e+00 0.00000e+00 0.00000e+00 2.14175e+02 225.605 1.36161e+02 225.605 0.9206 
1 1 1 -3  22  16 o 13 3.82689e+00 1.17240e+00 1.29482e+02 316.689 3.94348e+00  -3.71759e+00 0.00000e+00 0.00000e+00 9.98983e-01 136.689 1.30481e+02 136.689 0.9023 
1 1 1 -3  22  17 o 15 7.18989e+00 1.48141e+00 1.18057e+02 114.024 -3.53557e+00 7.93201e+00  0.00000e+00 0.00000e+00 1.33284e+02 114.024 1.52268e+01 114.024 0.9405 
1 1 1 -3  22  18 o 19 5.03896e+00 1.50993e+00 1.03676e+02 157.472 -5.29302e+00 2.19542e+00  0.00000e+00 0.00000e+00 6.61700e+01 157.472 3.75064e+01 337.472 0.9080 
1 1 1 -3  22  19 o 10 5.76763e+00 1.70022e+00 4.59272e+01 303.758 1.62972e+00  -2.43828e+00 0.00000e+00 0.00000e+00 1.26197e+02 303.758 8.02699e+01 303.758 0.8049 
1 1 1 -3  22  20 o 13 4.19261e+00 1.45384e+00 1.06168e+02 270.216 2.55520e-02  -6.77451e+00 0.00000e+00 0.00000e+00 3.71128e+01 270.216 6.90556e+01 90.216  0.9229 
1 1 1 -3  23  1  o 16 2.31568e+01 4.09545e-01 2.94784e+02 164.347 -5.08950e+00 1.42606e+00  0.00000e+00 0.00000e+00 4.87809e+02 164.347 1.93025e+02 164.347 0.8996 
1 1 1 -3  23  2  o 6  1.11507e+01 3.79752e-01 2.23019e+02 346.302 1.35286e+00  -3.29745e-01 0.00000e+00 0.00000e+00 1.50321e+01 346.302 2.07987e+02 166.302 0.5684 
1 1 1 -3  23  3  o 7  1.92751e+01 3.33571e-01 3.85675e+02 95.523  -5.36271e-01 5.54609e+00  0.00000e+00 0.00000e+00 2.69428e+02 95.523  1.16247e+02 275.523 0.9051 
1 1 1 -3  23  4  o 9  1.84645e+01 4.23593e-01 4.22831e+02 193.050 -5.95112e+00 -1.37942e+00 0.00000e+00 0.00000e+00 2.10661e+02 193.050 2.12170e+02 13.050  0.9140 
1 1 1 -3  23  5  o 7  1.23559e+01 2.50704e-01 8.56739e+01 188.273 -1.00627e+00 -1.46323e-01 0.00000e+00 0.00000e+00 1.24029e+02 188.273 3.83551e+01 188.273 0.4523 
1 1 1 -3  23  6  o 14 2.17738e+01 4.03704e-01 5.04644e+02 205.475 -1.19519e+01 -5.69447e+00 0.00000e+00 0.00000e+00 2.80487e+02 205.475 2.24157e+02 25.475  0.9615 
1 1 1 -3  23  7  o 5  2.82989e+01 4.47049e-01 5.74701e+02 26.138  1.78490e+01  8.75892e+00  0.00000e+00 0.00000e+00 4.59040e+02 26.138  1.15661e+02 206.138 0.9745 
1 1 1 -3  23  8  o 13 2.08877e+01 5.28934e-01 3.62872e+02 73.515  3.32024e+00  1.12195e+01  0.00000e+00 0.00000e+00 3.85417e+02 73.515  2.25451e+01 73.515  0.9563 
1 1 1 -3  23  9  o 13 3.11569e+01 6.91991e-01 4.73635e+02 221.301 -2.29136e+01 -2.01308e+01 0.00000e+00 0.00000e+00 6.73556e+02 221.301 1.99921e+02 221.301 0.9835 
1 1 1 -3  23  10 o 15 1.45811e+01 5.23937e-01 3.93616e+02 148.910 -1.34606e+01 8.11689e+00  0.00000e+00 0.00000e+00 1.34253e+02 148.910 2.59362e+02 328.909 0.9676 
1 1 1 -3  23  11 o 5  1.64833e+01 5.91448e-01 2.75683e+02 113.204 -6.33837e+00 1.47855e+01  0.00000e+00 0.00000e+00 3.21059e+02 113.204 4.53763e+01 113.204 0.9684 
1 1 1 -3  23  12 o 19 2.84668e+01 7.76322e-01 6.39658e+02 238.450 -4.37467e+01 -7.12480e+01 0.00000e+00 0.00000e+00 4.17292e+02 238.450 2.22365e+02 58.450  0.9940 
1 1 1 -3  23  13 o 12 9.55876e+00 8.16404e-01 2.75955e+02 286.822 5.15107e+00  -1.70379e+01 0.00000e+00 0.00000e+00 7.06093e+01 286.822 2.05346e+02 106.822 0.9715 
1 1 1 -3  23  14 o 1  8.78525e+00 9.09198e-01 1.33735e+02 83.560  1.10752e+00  9.81211e+00  0.00000e+00 0.00000e+00 1.76766e+02 83.560  4.30310e+01 83.560  0.9479 
1 1 1 -3  23  15 o 15 1.35629e+01 9.28162e-01 2.24382e+02 350.271 3.08766e+01  -5.29376e+00 0.00000e+00 0.00000e+00 2.72670e+02 350.271 4.82880e+01 350.271 0.9839 
1 1 1 -3  23  16 o 4  8.50980e+00 1.27927e+00 1.69430e+02 94.155  -1.11519e+00 1.53522e+01  0.00000e+00 0.00000e+00 1.36736e+02 94.155  3.26938e+01 274.155 0.9670 
1 1 1 -3  23  17 o 3  9.32125e+00 1.89394e+00 1.61975e+02 139.301 -9.87122e+00 8.49030e+00  0.00000e+00 0.00000e+00 1.70874e+02 139.301 8.89980e+00 139.301 0.9608 
1 1 1 -3  23  18 o 18 8.10683e+00 1.68259e+00 1.15012e+02 27.077  8.64977e+00  4.42191e+00  0.00000e+00 0.00000e+00 1.69988e+02 27.077  5.49751e+01 27.077  0.9470 
1 1 1 -3  23  19 o 17 5.42098e+00 1.66609e+00 7.53538e+01 265.077 -3.95808e-01 -4.59493e+00 0.00000e+00 0.00000e+00 1.02221e+02 265.077 2.68671e+01 265.077 0.8835 
1 1 1 -3  23  20 o 1  5.33594e+00 1.72814e+00 5.61631e+01 97.562  -4.79270e-01 3.60998e+00  0.00000e+00 0.00000e+00 1.11411e+02 97.562  5.52482e+01 97.562  0.8482 
1 1 1 -3  24  1  o 3  4.06993e+01 7.09789e-01 7.58565e+02 119.219 -8.61097e+00 1.53953e+01  0.00000e+00 0.00000e+00 7.26289e+02 119.219 3.22765e+01 299.219 0.9712 
1 1 1 -3  24  2  o 12 1.54940e+01 2.98092e-01 5.75418e+02 48.218  4.77692e+00  5.34607e+00  0.00000e+00 0.00000e+00 3.57783e+01 228.218 6.11196e+02 228.218 0.9274 
1 1 1 -3  24  3  o 12 1.44572e+01 2.85911e-01 3.39413e+02 82.947  4.62199e-01  3.73567e+00  0.00000e+00 0.00000e+00 1.24037e+02 82.947  2.15376e+02 262.947 0.8538 
1 1 1 -3  24  4  o 13 1.27120e+01 2.71824e-01 7.25496e+01 141.549 -5.56509e-01 4.41897e-01  0.00000e+00 0.00000e+00 8.71045e+01 141.549 1.45549e+01 141.549 0.3346 
1 1 1 -3  24  5  o 9  7.95295e+00 3.28836e-01 2.30356e+02 303.442 9.57947e-01  -1.45046e+00 0.00000e+00 0.00000e+00 3.64790e+01 123.442 2.66835e+02 123.442 0.6498 
1 1 1 -3  24  6  o 18 8.68442e+00 2.28675e-01 1.65739e+02 308.480 1.07336e+00  -1.35036e+00 0.00000e+00 0.00000e+00 4.49869e+01 308.480 1.20752e+02 128.480 0.6470 
1 1 1 -3  24  7  o 15 3.55539e+01 5.18818e-01 7.32491e+02 13.473  3.29145e+01  7.88572e+00  0.00000e+00 0.00000e+00 5.80307e+02 13.473  1.52184e+02 193.473 0.9851 
1 1 1 -3  24  8  o 3  3.32101e+01 6.62873e-01 5.33917e+02 319.465 2.06236e+01  -1.76360e+01 0.00000e+00 0.00000e+00 6.87003e+02 319.465 1.53086e+02 319.465 0.9814 
1 1 1 -3  24  9  o 13 3.03771e+01 6.81580e-01 4.01610e+02 108.976 -8.55311e+00 2.48732e+01  0.00000e+00 0.00000e+00 7.13768e+02 108.976 3.12157e+02 108.976 0.9808 
1 1 1 -3  24  10 o 12 7.90474e+00 5.97634e-01 7.89251e+01 20.854  1.62754e+00  6.19986e-01  0.00000e+00 0.00000e+00 1.13423e+02 20.854  3.44979e+01 20.854  0.6504 
1 1 1 -3  24  11 o 17 3.85911e+01 8.44057e-01 6.39435e+02 144.682 -6.94252e+01 4.91885e+01  0.00000e+00 0.00000e+00 7.94660e+02 144.682 1.55225e+02 144.682 0.9941 
1 1 1 -3  24  12 o 18 2.23585e+01 7.06273e-01 3.47881e+02 265.612 -2.96004e+00 -3.85721e+01 0.00000e+00 0.00000e+00 4.76361e+02 265.612 1.28481e+02 265.612 0.9870 
1 1 1 -3  24  13 f 0  1.35473e+01 7.48775e-01 2.07176e+02 105.569 -5.43047e+00 1.94905e+01  0.00000e+00 0.00000e+00 2.85723e+02 105.569 7.85473e+01 105.569 0.9750 
1 1 1 -3  24  14 o 18 6.12689e+00 1.03544e+00 1.22905e+02 254.169 -1.66231e+00 -5.86251e+00 0.00000e+00 0.00000e+00 8.58289e+01 254.169 3.70758e+01 74.169  0.9138 
1 1 1 -3  24  15 o 13 2.01465e+01 9.15025e-01 3.67570e+02 319.268 6.07097e+01  -5.22779e+01 0.00000e+00 0.00000e+00 3.78088e+02 319.268 1.05181e+01 319.268 0.9937 
1 1 1 -3  24  16 o 9  1.83895e+01 1.00672e+00 2.28023e+02 127.517 -3.10791e+01 4.04783e+01  0.00000e+00 0.00000e+00 4.49427e+02 127.517 2.21404e+02 127.517 0.9902 
1 1 1 -3  24  17 o 1  8.17538e+00 1.52798e+00 1.99889e+02 163.074 -1.68561e+01 5.12971e+00  0.00000e+00 0.00000e+00 9.51831e+01 163.074 1.04706e+02 343.074 0.9712 
1 1 1 -3  24  18 o 13 6.88270e+00 1.72820e+00 1.09754e+02 1.201   7.63395e+00  1.60070e-01  0.00000e+00 0.00000e+00 1.28355e+02 1.201   1.86014e+01 1.201   0.9320 
1 1 1 -3  24  19 o 2  6.96069e+00 1.73715e+00 9.51861e+01 252.339 -2.15875e+00 -6.78006e+00 0.00000e+00 0.00000e+00 1.43975e+02 252.339 4.87893e+01 252.339 0.9268 
1 1 1 -3  24  20 o 8  4.19894e+00 1.44390e+00 6.40948e+01 60.905  2.02968e+00  3.64740e+00  0.00000e+00 0.00000e+00 7.11410e+01 60.905  7.04622e+00 60.905  0.8699 
1 1 1 -3  25  1  o 18 4.60009e+00 3.50701e-01 1.12362e+02 114.992 -1.79237e-01 3.84514e-01  0.00000e+00 0.00000e+00 7.65108e+01 294.992 1.88872e+02 294.992 0.2075 
1 1 1 -3  25  2  o 13 1.08481e+01 3.53772e-01 3.54102e+02 229.615 -1.94324e+00 -2.28453e+00 0.00000e+00 0.00000e+00 2.41484e+01 49.615  3.78250e+02 49.615  0.8099 
1 1 1 -3  25  3  o 18 1.03027e+01 2.58264e-01 2.65748e+02 78.842  3.97442e-01  2.01502e+00  0.00000e+00 0.00000e+00 7.49521e+00 78.842  2.58253e+02 258.842 0.7064 
1 1 1 -3  25  4  o 8  1.35591e+01 3.11727e-01 8.60632e+01 168.042 -9.85121e-01 2.08632e-01  0.00000e+00 0.00000e+00 1.42353e+02 168.042 5.62895e+01 168.042 0.4489 
1 1 1 -3  25  5  o 15 2.45840e+01 3.83488e-01 3.94570e+02 102.072 -1.83708e+00 8.58991e+00  0.00000e+00 0.00000e+00 4.73524e+02 102.072 7.89535e+01 102.072 0.9412 
1 1 1 -3  25  6  o 3  1.13940e+01 2.79789e-01 2.58735e+02 277.296 4.15202e-01  -3.24274e+00 0.00000e+00 0.00000e+00 9.50696e+01 277.296 1.63665e+02 97.296  0.8281 
1 1 1 -3  25  7  o 3  2.94236e+01 4.65418e-01 5.81859e+02 72.884  6.46079e+00  2.09800e+01  0.00000e+00 0.00000e+00 4.95506e+02 72.884  8.63530e+01 252.884 0.9770 
1 1 1 -3  25  8  o 16 3.89138e+01 6.69291e-01 8.14688e+02 79.877  1.04423e+01  5.84846e+01  0.00000e+00 0.00000e+00 6.30620e+02 79.877  1.84068e+02 259.877 0.9915 
1 1 1 -3  25  9  o 8  1.33212e+01 5.92656e-01 5.29407e+01 125.981 -8.94706e-01 1.23230e+00  0.00000e+00 0.00000e+00 2.47120e+02 125.981 1.94179e+02 125.981 0.6017 
1 1 1 -3  25  10 f 0  2.30681e+01 6.01860e-01 3.57685e+02 71.122  7.43281e+00  2.17371e+01  0.00000e+00 0.00000e+00 4.86243e+02 71.122  1.28558e+02 71.122  0.9780 
1 1 1 -3  25  11 o 17 1.63244e+01 8.03042e-01 2.38776e+02 255.959 -3.18787e+00 -1.27469e+01 0.00000e+00 0.00000e+00 3.47716e+02 255.959 1.08940e+02 255.959 0.9612 
1 1 1 -3  25  12 o 6  1.15823e+01 7.30455e-01 1.90407e+02 63.774  4.81746e+00  9.77939e+00  0.00000e+00 0.00000e+00 2.21829e+02 63.774  3.14222e+01 63.774  0.9530 
1 1 1 -3  25  13 o 9  1.33887e+01 7.61310e-01 1.91824e+02 318.310 1.38691e+01  -1.23525e+01 0.00000e+00 0.00000e+00 2.94139e+02 318.310 1.02315e+02 318.310 0.9727 
1 1 1 -3  25  14 f 0  9.00122e+00 9.59796e-01 1.45906e+02 244.432 -4.93708e+00 -1.03192e+01 0.00000e+00 0.00000e+00 1.74640e+02 244.432 2.87340e+01 244.432 0.9552 
1 1 1 -3  25  15 f 0  5.81897e+00 1.27164e+00 1.04367e+02 359.860 5.67131e+00  -1.38948e-02 0.00000e+00 0.00000e+00 9.21760e+01 359.860 1.21913e+01 179.860 0.9069 
1 1 1 -3  25  16 o 17 9.36979e+00 1.24494e+00 1.57116e+02 190.658 -1.64264e+01 -3.09133e+00 0.00000e+00 0.00000e+00 1.80872e+02 190.658 2.37558e+01 190.658 0.9696 
1 1 1 -3  25  17 o 19 4.26700e+00 1.30044e+00 3.51785e+01 308.116 1.08024e+00  -1.37691e+00 0.00000e+00 0.00000e+00 6.82309e+01 308.116 3.30524e+01 308.116 0.6522 
1 1 1 -3  25  18 o 4  6.29466e+00 1.60069e+00 8.72514e+01 353.748 5.94151e+00  -6.50899e-01 0.00000e+00 0.00000e+00 1.25825e+02 353.748 3.85738e+01 353.748 0.9120 
1 1 1 -3  25  19 o 1  6.43087e+00 1.59264e+00 8.81170e+01 42.864  5.15924e+00  4.78824e+00  0.00000e+00 0.00000e+00 1.32626e+02 42.864  4.45095e+01 42.864  0.9260 
1 1 1 -3  25  20 o 11 4.47275e+00 1.49697e+00 5.78276e+01 201.559 -3.56825e+00 -1.40981e+00 0.00000e+00 0.00000e+00 8.40705e+01 201.559 2.62429e+01 201.559 0.8569 
1 1 1 -3  26  1  o 17 1.74381e+01 3.81743e-01 3.06690e+02 27.284  3.77785e+00  1.94857e+00  0.00000e+00 0.00000e+00 2.64773e+02 27.284  4.19173e+01 207.284 0.8725 
1 1 1 -3  26  2  o 12 4.80811e+00 4.13158e-01 2.07993e+02 23.740  6.85084e-01  3.01298e-01  0.00000e+00 0.00000e+00 1.44758e+02 203.740 3.52752e+02 203.740 0.3502 
1 1 1 -3  26  3  o 15 2.80667e+01 4.41484e-01 7.00563e+02 72.857  5.00808e+00  1.62360e+01  0.00000e+00 0.00000e+00 3.21595e+02 72.857  3.78968e+02 252.857 0.9701 
1 1 1 -3  26  4  o 5  2.71758e+00 3.24863e-01 9.76289e+01 1.836   2.25210e-01  7.22042e-03  0.00000e+00 0.00000e+00 8.62112e+01 181.836 1.83840e+02 181.836 0.1120 
1 1 1 -3  26  5  o 7  1.61466e+01 2.93250e-01 5.11030e+02 130.797 -4.83406e+00 5.60083e+00  0.00000e+00 0.00000e+00 5.21214e+01 130.797 4.58909e+02 310.797 0.9297 
1 1 1 -3  26  6  o 3  2.63717e+01 4.07155e-01 6.47296e+02 43.531  1.36000e+01  1.29198e+01  0.00000e+00 0.00000e+00 3.14818e+02 43.531  3.32477e+02 223.531 0.9730 
1 1 1 -3  26  7  o 14 2.06942e+01 3.96325e-01 5.27432e+02 194.006 -1.35260e+01 -3.37382e+00 0.00000e+00 0.00000e+00 2.19767e+02 194.006 3.07665e+02 14.006  0.9634 
1 1 1 -3  26  8  o 12 1.54505e+01 4.94605e-01 3.72713e+02 115.999 -4.43986e+00 9.10338e+00  0.00000e+00 0.00000e+00 1.76633e+02 115.999 1.96080e+02 295.999 0.9493 
1 1 1 -3  26  9  o 3  1.79587e+01 5.28428e-01 3.30575e+02 3.845   1.31266e+01  8.82301e-01  0.00000e+00 0.00000e+00 3.15566e+02 3.845   1.50094e+01 183.845 0.9612 
1 1 1 -3  26  10 o 4  9.54996e+00 6.05016e-01 2.00147e+02 70.878  1.88088e+00  5.42483e+00  0.00000e+00 0.00000e+00 1.24258e+02 70.878  7.58883e+01 250.878 0.9081 
1 1 1 -3  26  11 o 12 1.46462e+01 5.84707e-01 2.86953e+02 250.577 -5.45326e+00 -1.54654e+01 0.00000e+00 0.00000e+00 2.43507e+02 250.577 4.34462e+01 70.577  0.9690 
1 1 1 -3  26  12 o 13 2.81786e+01 7.74499e-01 6.02255e+02 44.921  6.33342e+01  6.31606e+01  0.00000e+00 0.00000e+00 4.44197e+02 44.921  1.58057e+02 224.921 0.9944 
1 1 1 -3  26  13 o 13 1.55615e+01 7.37215e-01 3.27504e+02 190.204 -3.63866e+01 -6.54964e+00 0.00000e+00 0.00000e+00 2.45230e+02 190.204 8.22746e+01 10.204  0.9864 
1 1 1 -3  26  14 o 15 1.54587e+01 7.88668e-01 2.39369e+02 19.132  3.19492e+01  1.10831e+01  0.00000e+00 0.00000e+00 3.28306e+02 19.132  8.89374e+01 19.132  0.9851 
1 1 1 -3  26  15 o 16 1.15049e+01 1.09319e+00 1.63680e+02 189.239 -1.96286e+01 -3.19283e+00 0.00000e+00 0.00000e+00 2.53848e+02 189.239 9.01684e+01 189.239 0.9745 
1 1 1 -3  26  16 o 6  5.88130e+00 1.31258e+00 7.01008e+01 76.589  1.04666e+00  4.38960e+00  0.00000e+00 0.00000e+00 1.22584e+02 76.589  5.24831e+01 76.589  0.8807 
1 1 1 -3  26  17 o 6  7.56892e+00 1.47505e+00 1.59009e+02 139.248 -1.03032e+01 8.87836e+00  0.00000e+00 0.00000e+00 1.11693e+02 139.248 4.73167e+01 319.248 0.9625 
1 1 1 -3  26  18 f 0  5.45301e+00 1.55195e+00 8.73002e+01 3.481   5.52785e+00  3.36274e-01  0.00000e+00 0.00000e+00 9.57607e+01 3.481   8.46049e+00 3.481   0.9045 
1 1 1 -3  26  19 o 14 5.86308e+00 1.78231e+00 5.89185e+01 56.164  2.08121e+00  3.10459e+00  0.00000e+00 0.00000e+00 1.26381e+02 56.164  6.74623e+01 56.164  0.8526 
1 1 1 -3  26  20 o 15 4.52127e+00 1.54241e+00 7.16515e+01 326.715 3.78774e+00  -2.48666e+00 0.00000e+00 0.00000e+00 7.58434e+01 326.715 4.19188e+00 326.715 0.8812 
1 1 1 -3  27  1  o 13 1.65535e+01 3.35406e-01 3.84181e+02 178.381 -4.83565e+00 1.36686e-01  0.00000e+00 0.00000e+00 1.68797e+02 178.381 2.15384e+02 358.381 0.8895 
1 1 1 -3  27  2  o 7  2.32699e+01 4.18751e-01 3.49667e+02 196.194 -5.96509e+00 -1.73233e+00 0.00000e+00 0.00000e+00 4.50275e+02 196.194 1.00608e+02 196.194 0.9155 
1 1 1 -3  27  3  o 1  1.27145e+01 2.78481e-01 2.86802e+02 21.215  2.88195e+00  1.11868e+00  0.00000e+00 0.00000e+00 1.02909e+02 21.215  1.83893e+02 201.214 0.8165 
1 1 1 -3  27  4  o 1  3.05396e+01 4.58699e-01 6.41451e+02 76.736  3.98816e+00  1.69186e+01  0.00000e+00 0.00000e+00 4.71098e+02 76.736  1.70353e+02 256.736 0.9708 
1 1 1 -3  27  5  o 9  5.62582e+00 2.77458e-01 9.93816e+01 87.482  2.60502e-02  5.92458e-01  0.00000e+00 0.00000e+00 3.94070e+01 267.482 1.38789e+02 267.482 0.2842 
1 1 1 -3  27  6  o 1  3.07634e+01 4.62165e-01 4.86634e+02 125.528 -1.13833e+01 1.59421e+01  0.00000e+00 0.00000e+00 6.36960e+02 125.528 1.50326e+02 125.528 0.9741 
1 1 1 -3  27  7  o 14 2.19232e+01 4.83869e-01 2.08163e+02 165.405 -5.83804e+00 1.52013e+00  0.00000e+00 0.00000e+00 5.41804e+02 165.405 3.33641e+02 165.405 0.9129 
1 1 1 -3  27  8  o 1  1.14772e+01 3.34418e-01 2.64214e+02 336.486 4.89027e+00  -2.12779e+00 0.00000e+00 0.00000e+00 1.22896e+02 336.486 1.41318e+02 156.486 0.9006 
1 1 1 -3  27  9  o 12 2.59079e+01 4.97215e-01 3.66427e+02 82.833  2.62070e+00  2.08414e+01  0.00000e+00 0.00000e+00 5.79898e+02 82.833  2.13471e+02 82.833  0.9759 
1 1 1 -3  27  10 o 14 3.48554e+01 7.78002e-01 4.05671e+02 352.870 4.14560e+01  -5.18570e+00 0.00000e+00 0.00000e+00 8.82305e+02 352.870 4.76633e+02 352.870 0.9880 
1 1 1 -3  27  11 o 5  3.03221e+01 7.27382e-01 5.65040e+02 20.809  6.14940e+01  2.33703e+01  0.00000e+00 0.00000e+00 5.59565e+02 20.809  5.47521e+00 200.809 0.9924 
1 1 1 -3  27  12 o 2  2.09383e+01 7.01761e-01 3.70065e+02 9.316   4.47594e+01  7.34244e+00  0.00000e+00 0.00000e+00 4.03167e+02 9.316   3.31024e+01 9.316   0.9889 
1 1 1 -3  27  13 o 8  1.77501e+01 7.22137e-01 2.75451e+02 191.251 -3.42286e+01 -6.80915e+00 0.00000e+00 0.00000e+00 3.77248e+02 191.251 1.01797e+02 191.251 0.9856 
1 1 1 -3  27  14 o 3  5.70373e+00 1.09942e+00 1.02672e+02 64.766  2.09638e+00  4.44822e+00  0.00000e+00 0.00000e+00 8.68514e+01 64.766  1.58202e+01 244.766 0.8914 
1 1 1 -3  27  15 o 7  2.99481e+00 9.79577e-01 6.61220e+01 134.301 -1.59324e+00 1.63257e+00  0.00000e+00 0.00000e+00 1.62840e+01 134.301 4.98380e+01 314.301 0.7389 
1 1 1 -3  27  16 o 12 6.79249e+00 1.39190e+00 1.28642e+02 151.523 -7.91560e+00 4.29366e+00  0.00000e+00 0.00000e+00 1.09550e+02 151.523 1.90923e+01 331.523 0.9427 
1 1 1 -3  27  17 o 6  3.53272e+00 1.17183e+00 5.93171e+01 337.080 2.62056e+00  -1.10802e+00 0.00000e+00 0.00000e+00 4.54093e+01 337.080 1.39078e+01 157.080 0.7979 
1 1 1 -3  27  18 o 17 9.70908e+00 1.60054e+00 1.37571e+02 42.894  1.10114e+01  1.02304e+01  0.00000e+00 0.00000e+00 2.10545e+02 42.894  7.29741e+01 42.894  0.9661 
1 1 1 -3  27  19 o 10 5.64636e+00 1.71024e+00 3.37294e+01 86.715  1.23739e-01  2.15566e+00  0.00000e+00 0.00000e+00 1.17426e+02 86.715  8.36970e+01 86.715  0.7223 
1 1 1 -3  28  1  o 10 1.92196e+01 3.46958e-01 4.24699e+02 302.231 3.21783e+00  -5.10376e+00 0.00000e+00 0.00000e+00 2.34184e+02 302.231 1.90514e+02 122.231 0.9129 
1 1 1 -3  28  2  o 2  2.66070e+01 4.62144e-01 6.37430e+02 333.141 1.12608e+01  -5.70285e+00 0.00000e+00 0.00000e+00 3.21119e+02 333.141 3.16312e+02 153.141 0.9595 
1 1 1 -3  28  3  o 7  9.75871e+00 2.51297e-01 1.86520e+02 147.981 -1.18978e+00 7.44007e-01  0.00000e+00 0.00000e+00 2.27419e+01 147.981 1.63779e+02 327.981 0.5713 
1 1 1 -3  28  4  o 16 8.98740e+00 2.48456e-01 9.43179e+01 83.050  9.89686e-02  8.11946e-01  0.00000e+00 0.00000e+00 3.32217e+01 83.050  6.10961e+01 263.050 0.3782 
1 1 1 -3  28  5  o 1  9.95152e+00 3.08480e-01 1.14972e+02 194.548 -1.15984e+00 -3.00992e-01 0.00000e+00 0.00000e+00 7.62279e+01 194.548 3.87445e+01 14.548  0.5122 
1 1 1 -3  28  6  o 6  1.58364e+01 3.45586e-01 2.16286e+02 163.107 -3.90628e+00 1.18633e+00  0.00000e+00 0.00000e+00 2.98242e+02 163.107 8.19554e+01 163.107 0.8666 
1 1 1 -3  28  7  o 5  2.04259e+01 3.77079e-01 3.29858e+02 354.896 8.84366e+00  -7.89896e-01 0.00000e+00 0.00000e+00 3.91045e+02 354.896 6.11875e+01 354.896 0.9419 
1 1 1 -3  28  8  f 0  3.43644e+01 5.13501e-01 4.33698e+02 83.624  2.82445e+00  2.52766e+01  0.00000e+00 0.00000e+00 8.27679e+02 83.624  3.93981e+02 83.624  0.9801 
1 1 1 -3  28  9  o 2  1.60652e+01 5.34685e-01 2.01423e+02 282.104 1.65449e+00  -7.71478e+00 0.00000e+00 0.00000e+00 3.60323e+02 282.104 1.58901e+02 282.104 0.9343 
1 1 1 -3  28  10 o 9  2.97938e+01 7.05403e-01 5.67035e+02 262.531 -6.21738e+00 -4.74238e+01 0.00000e+00 0.00000e+00 5.35529e+02 262.531 3.15059e+01 82.531  0.9895 
1 1 1 -3  28  11 o 18 1.47763e+01 5.91939e-01 3.44989e+02 14.576  2.10941e+01  5.48531e+00  0.00000e+00 0.00000e+00 1.94394e+02 14.576  1.50594e+02 194.576 0.9768 
1 1 1 -3  28  12 o 3  2.15356e+01 7.21471e-01 3.75755e+02 186.636 -4.67885e+01 -5.44374e+00 0.00000e+00 0.00000e+00 4.19805e+02 186.636 4.40499e+01 186.636 0.9893 
1 1 1 -3  28  13 o 16 6.35234e+00 1.01566e+00 1.43197e+02 308.170 3.94927e+00  -5.02412e+00 0.00000e+00 0.00000e+00 7.43647e+01 308.170 6.88324e+01 128.170 0.9180 
1 1 1 -3  28  14 o 10 3.42741e+00 9.87657e-01 1.80224e+01 34.754  4.41771e-01  3.06511e-01  0.00000e+00 0.00000e+00 1.51373e+01 34.754  2.88509e+00 214.754 0.2596 
1 1 1 -3  28  15 o 8  5.37730e+00 1.25681e+00 1.46839e+02 336.860 7.37438e+00  -3.15154e+00 0.00000e+00 0.00000e+00 4.04470e+01 336.860 1.06392e+02 156.860 0.9354 
1 1 1 -3  28  16 o 16 6.71103e+00 1.39232e+00 7.74140e+01 314.715 3.71939e+00  -3.75654e+00 0.00000e+00 0.00000e+00 1.47146e+02 314.715 6.97316e+01 314.715 0.8996 
1 1 1 -3  28  17 o 7  1.08359e+01 1.43234e+00 2.24633e+02 189.405 -2.66345e+01 -4.41189e+00 0.00000e+00 0.00000e+00 1.70420e+02 189.405 5.42128e+01 9.405   0.9813 
1 1 1 -3  28  18 o 2  9.80883e+00 1.59728e+00 1.64845e+02 55.194  9.84289e+00  1.41587e+01  0.00000e+00 0.00000e+00 1.88429e+02 55.194  2.35836e+01 55.194  0.9706 
1 1 1 -3  28  19 o 1  4.62044e+00 1.51726e+00 2.28681e+01 12.679  1.34990e+00  3.03686e-01  0.00000e+00 0.00000e+00 7.40593e+01 12.679  5.11912e+01 12.679  0.5660 
1 1 1 -3  29  1  o 15 8.16879e+00 4.02175e-01 2.50920e+02 175.064 -1.53797e+00 1.32821e-01  0.00000e+00 0.00000e+00 6.48034e+01 355.064 3.15724e+02 355.064 0.6068 
1 1 1 -3  29  2  o 8  7.13819e+00 5.10326e-01 9.31089e+01 291.405 2.07750e-01  -5.29964e-01 0.00000e+00 0.00000e+00 1.97671e+01 111.406 1.12876e+02 111.406 0.2737 
1 1 1 -3  29  3  o 6  2.11598e+01 3.52891e-01 5.28265e+02 185.101 -9.58196e+00 -8.55409e-01 0.00000e+00 0.00000e+00 2.23427e+02 185.101 3.04838e+02 5.101   0.9465 
1 1 1 -3  29  4  o 9  2.19030e+01 3.61140e-01 4.79423e+02 210.876 -8.56327e+00 -5.12010e+00 0.00000e+00 0.00000e+00 3.00037e+02 210.876 1.79386e+02 30.876  0.9485 
1 1 1 -3  29  5  o 9  1.31769e+01 2.74858e-01 1.93843e+02 70.947  8.64616e-01  2.50356e+00  0.00000e+00 0.00000e+00 1.91754e+02 70.947  2.08865e+00 250.947 0.7802 
1 1 1 -3  29  6  o 16 2.26918e+01 3.89525e-01 4.97683e+02 156.087 -1.22024e+01 5.41079e+00  0.00000e+00 0.00000e+00 3.20472e+02 156.087 1.77211e+02 336.087 0.9618 
1 1 1 -3  29  7  o 3  3.96990e+01 5.78906e-01 6.76630e+02 51.589  2.25653e+01  2.84589e+01  0.00000e+00 0.00000e+00 7.90208e+02 51.589  1.13578e+02 51.589  0.9861 
1 1 1 -3  29  8  o 10 1.49037e+01 4.60140e-01 2.77594e+02 164.189 -6.84529e+00 1.93839e+00  0.00000e+00 0.00000e+00 2.39642e+02 164.189 3.79527e+01 344.189 0.9268 
1 1 1 -3  29  9  o 10 3.25707e+01 6.33129e-01 6.48699e+02 300.558 2.56619e+01  -4.34649e+01 0.00000e+00 0.00000e+00 5.58052e+02 300.558 9.06478e+01 120.558 0.9900 
1 1 1 -3  29  10 o 6  1.29758e+01 5.85259e-01 2.63300e+02 125.226 -6.32103e+00 8.95193e+00  0.00000e+00 0.00000e+00 1.99252e+02 125.226 6.40476e+01 305.226 0.9532 
1 1 1 -3  29  11 o 1  7.03079e+00 8.16979e-01 8.94175e+01 214.095 -2.16442e+00 -1.46514e+00 0.00000e+00 0.00000e+00 1.14673e+02 214.095 2.52558e+01 214.095 0.7768 
1 1 1 -3  29  12 o 14 1.00644e+01 8.62991e-01 1.95075e+02 32.512  9.04526e+00  5.76516e+00  0.00000e+00 0.00000e+00 1.62731e+02 32.512  3.23435e+01 212.512 0.9522 
1 1 1 -3  29  13 f 0  8.09406e+00 1.23377e+00 1.83393e+02 303.287 5.36793e+00  -8.17587e+00 0.00000e+00 0.00000e+00 1.02670e+02 303.287 8.07231e+01 123.287 0.9474 
1 1 1 -3  29  14 o 10 7.59412e+00 1.07906e+00 7.34942e+01 185.457 -4.69568e+00 -4.48580e-01 0.00000e+00 0.00000e+00 1.77374e+02 185.457 1.03879e+02 185.457 0.8864 
1 1 1 -3  29  15 o 17 1.63448e+01 8.87516e-01 2.70335e+02 136.813 -3.84033e+01 3.60468e+01  0.00000e+00 0.00000e+00 3.32401e+02 136.813 6.20668e+01 136.813 0.9905 
1 1 1 -3  29  16 o 18 5.82749e+00 1.41518e+00 1.00080e+02 8.209   5.79814e+00  8.36462e-01  0.00000e+00 0.00000e+00 9.71690e+01 8.209   2.91133e+00 188.209 0.9101 
1 1 1 -3  29  17 o 5  4.62948e+00 1.37773e+00 1.55041e+01 246.683 -3.44736e-01 -7.99798e-01 0.00000e+00 0.00000e+00 5.30822e+01 246.683 3.75781e+01 246.683 0.3988 
1 1 1 -3  29  18 o 14 4.59485e+00 1.44198e+00 9.28115e+01 18.272  4.95918e+00  1.63745e+00  0.00000e+00 0.00000e+00 6.03437e+01 18.272  3.24678e+01 198.272 0.8983 
1 1 1 -3  29  19 o 14 4.53740e+00 1.49902e+00 5.51016e+01 146.177 -2.75408e+00 1.84530e+00  0.00000e+00 0.00000e+00 8.46044e+01 146.177 2.95027e+01 146.177 0.8308 
1 1 1 -3  30  1  o 16 1.12520e+01 3.34686e-01 2.11081e+02 83.438  2.35252e-01  2.04497e+00  0.00000e+00 0.00000e+00 8.76776e+01 83.438  1.23403e+02 263.438 0.7071 
1 1 1 -3  30  2  o 15 2.99725e+01 5.58200e-01 5.56925e+02 230.562 -8.23157e+00 -1.00079e+01 0.00000e+00 0.00000e+00 5.23907e+02 230.562 3.30181e+01 50.562  0.9606 
1 1 1 -3  30  3  o 3  1.59391e+01 3.02242e-01 3.39387e+02 234.389 -2.66400e+00 -3.71954e+00 0.00000e+00 0.00000e+00 1.88511e+02 234.389 1.50876e+02 54.389  0.8825 
1 1 1 -3  30  4  o 19 1.23384e+01 2.73237e-01 8.82944e+01 267.485 -4.33171e-02 -9.86256e-01 0.00000e+00 0.00000e+00 1.16231e+02 267.485 2.79365e+01 267.485 0.4418 
1 1 1 -3  30  5  o 8  4.58447e+00 3.32089e-01 1.56898e+02 217.702 -6.82475e-01 -5.27518e-01 0.00000e+00 0.00000e+00 8.88861e+01 37.702  2.45785e+02 37.702  0.3956 
1 1 1 -3  30  6  o 7  1.74596e+01 3.18916e-01 4.05510e+02 118.184 -4.10992e+00 7.67026e+00  0.00000e+00 0.00000e+00 2.10122e+02 118.184 1.95389e+02 298.183 0.9407 
1 1 1 -3  30  7  o 7  2.20587e+01 4.00595e-01 3.82443e+02 323.836 1.08512e+01  -7.93129e+00 0.00000e+00 0.00000e+00 4.12633e+02 323.836 3.01904e+01 323.836 0.9620 
1 1 1 -3  30  8  o 5  1.60175e+01 3.16883e-01 1.65204e+02 308.093 2.81073e+00  -3.58558e+00 0.00000e+00 0.00000e+00 3.63750e+02 308.093 1.98546e+02 308.093 0.8820 
1 1 1 -3  30  9  o 8  1.19165e+01 4.38931e-01 2.54282e+02 334.583 7.35772e+00  -3.49631e+00 0.00000e+00 0.00000e+00 1.63290e+02 334.583 9.09915e+01 154.583 0.9364 
1 1 1 -3  30  10 o 6  6.94034e+00 7.44325e-01 2.04696e+02 308.178 2.77229e+00  -3.52567e+00 0.00000e+00 0.00000e+00 2.36564e+01 308.178 1.81040e+02 128.179 0.8799 
1 1 1 -3  30  11 o 7  3.30651e+01 7.70325e-01 5.60342e+02 78.805  1.49825e+01  7.56992e+01  0.00000e+00 0.00000e+00 6.67105e+02 78.805  1.06763e+02 78.805  0.9935 
1 1 1 -3  30  12 o 3  8.21273e+00 8.68378e-01 1.23705e+02 83.496  6.32663e-01  5.54908e+00  0.00000e+00 0.00000e+00 1.53901e+02 83.496  3.01964e+01 83.496  0.9054 
1 1 1 -3  30  13 o 10 1.25827e+01 7.54791e-01 1.41222e+02 166.281 -1.39162e+01 3.39719e+00  0.00000e+00 0.00000e+00 3.11439e+02 166.281 1.70217e+02 166.281 0.9644 
1 1 1 -3  30  14 o 3  4.62269e+00 1.12596e+00 1.18633e+02 191.797 -4.87680e+00 -1.01853e+00 0.00000e+00 0.00000e+00 3.51971e+01 191.797 8.34361e+01 11.797  0.8930 
1 1 1 -3  30  15 o 1  6.27789e+00 1.30894e+00 1.35188e+02 122.722 -4.33642e+00 6.74890e+00  0.00000e+00 0.00000e+00 8.34346e+01 122.722 5.17537e+01 302.722 0.9354 
1 1 1 -3  30  16 o 5  4.60531e+00 1.27832e+00 1.84308e+02 10.307  9.96357e+00  1.81196e+00  0.00000e+00 0.00000e+00 2.17314e+01 190.307 2.06039e+02 190.307 0.9493 
1 1 1 -3  30  17 o 11 1.68124e+01 1.24894e+00 2.80506e+02 111.695 -2.28776e+01 5.75027e+01  0.00000e+00 0.00000e+00 3.38953e+02 111.695 5.84469e+01 111.695 0.9919 
1 1 1 -3  30  18 o 8  6.46188e+00 1.46915e+00 1.02695e+02 79.185  1.49638e+00  7.83317e+00  0.00000e+00 0.00000e+00 1.21479e+02 79.185  1.87836e+01 79.185  0.9350 
1 1 1 -3  30  19 o 5  7.26692e+00 1.92268e+00 1.98680e+02 265.334 -1.13712e+00 -1.39327e+01 0.00000e+00 0.00000e+00 6.07859e+01 265.334 1.37894e+02 85.334  0.9635 
1 1 1 -3  31  1  o 5  5.15664e+00 2.99760e-01 1.93055e+02 127.899 -5.17535e-01 6.64820e-01  0.00000e+00 0.00000e+00 1.17972e+02 307.899 3.11027e+02 307.899 0.3878 
1 1 1 -3  31  2  o 5  3.13037e+01 5.52808e-01 6.42174e+02 208.423 -1.34391e+01 -7.27352e+00 0.00000e+00 0.00000e+00 4.93736e+02 208.423 1.48438e+02 28.423  0.9667 
1 1 1 -3  31  3  o 7  2.17204e+01 3.63780e-01 5.99372e+02 151.265 -1.00793e+01 5.52620e+00  0.00000e+00 0.00000e+00 1.79408e+02 151.265 4.19964e+02 331.265 0.9555 
1 1 1 -3  31  4  o 1  3.23757e+01 4.85942e-01 6.11377e+02 71.706  6.62222e+00  2.00309e+01  0.00000e+00 0.00000e+00 5.74012e+02 71.706  3.73651e+01 251.706 0.9760 
1 1 1 -3  31  5  o 15 3.86849e+01 5.64548e-01 7.60014e+02 281.074 6.23119e+00  -3.18375e+01 0.00000e+00 0.00000e+00 6.68090e+02 281.074 9.19241e+01 101.074 0.9845 
1 1 1 -3  31  6  f 0  2.86444e+01 4.42533e-01 4.13922e+02 93.016  -8.13415e-01 1.54369e+01  0.00000e+00 0.00000e+00 6.24391e+02 93.016  2.10469e+02 93.016  0.9671 
1 1 1 -3  31  7  o 10 6.70033e+00 3.70683e-01 1.66048e+02 178.933 -1.72897e+00 3.21973e-02  0.00000e+00 0.00000e+00 3.41432e+00 358.933 1.69462e+02 358.933 0.6479 
1 1 1 -3  31  8  o 7  1.10215e+01 3.31747e-01 2.13798e+02 87.411  2.24192e-01  4.95755e+00  0.00000e+00 0.00000e+00 1.54499e+02 87.411  5.92985e+01 267.411 0.8925 
1 1 1 -3  31  9  o 12 4.25722e+01 7.32112e-01 7.57975e+02 227.257 -5.77069e+01 -6.24430e+01 0.00000e+00 0.00000e+00 8.25538e+02 227.257 6.75627e+01 227.257 0.9941 
1 1 1 -3  31  10 o 8  2.03575e+01 4.85814e-01 4.39776e+02 170.494 -2.74363e+01 4.59416e+00  0.00000e+00 0.00000e+00 3.07590e+02 170.494 1.32186e+02 350.494 0.9819 
1 1 1 -3  31  11 o 2  4.89529e+00 8.70692e-01 1.28364e+02 294.638 1.10871e+00  -2.41745e+00 0.00000e+00 0.00000e+00 1.45325e+01 294.638 1.13831e+02 114.638 0.7813 
1 1 1 -3  31  12 o 19 4.48828e+00 9.89068e-01 1.02418e+02 97.724  -3.31281e-01 2.44240e+00  0.00000e+00 0.00000e+00 2.51073e+01 97.724  7.73111e+01 277.724 0.7611 
1 1 1 -3  31  13 o 2  1.76409e+01 7.46407e-01 3.09658e+02 229.339 -2.71850e+01 -3.16492e+01 0.00000e+00 0.00000e+00 3.40379e+02 229.339 3.07212e+01 229.339 0.9879 
1 1 1 -3  31  14 o 15 5.97256e+00 1.09946e+00 7.62504e+01 82.649  5.26525e-01  4.08111e+00  0.00000e+00 0.00000e+00 1.16883e+02 82.649  4.06324e+01 82.649  0.8678 
1 1 1 -3  31  15 o 5  9.53421e+00 1.08095e+00 2.58414e+02 13.716  2.49894e+01  6.09933e+00  0.00000e+00 0.00000e+00 8.95321e+01 13.716  1.68882e+02 193.716 0.9804 
1 1 1 -3  31  16 o 17 6.74876e+00 1.23409e+00 1.56001e+02 163.456 -1.21056e+01 3.59607e+00  0.00000e+00 0.00000e+00 8.48045e+01 163.456 7.11969e+01 343.456 0.9596 
1 1 1 -3  31  17 o 5  4.86849e+00 1.44749e+00 6.78087e+01 126.764 -2.28766e+00 3.06198e+00  0.00000e+00 0.00000e+00 8.70426e+01 126.764 1.92339e+01 126.764 0.8563 
1 1 1 -3  31  18 o 14 8.11875e+00 1.75001e+00 1.85269e+02 255.790 -3.73223e+00 -1.47387e+01 0.00000e+00 0.00000e+00 1.05852e+02 255.790 7.94164e+01 75.790  0.9665 
1 1 1 -3  31  19 o 8  5.18540e+00 1.62777e+00 9.77306e+01 29.364  5.29742e+00  2.98051e+00  0.00000e+00 0.00000e+00 7.77963e+01 29.364  1.99342e+01 209.364 0.9136 
1 1 1 -3  32  1  o 19 1.14111e+01 2.94562e-01 7.36298e+01 160.759 -6.08828e-01 2.12509e-01  0.00000e+00 0.00000e+00 5.77778e+01 160.759 1.58520e+01 340.759 0.3067 
1 1 1 -3  32  2  o 16 1.14523e+01 3.49553e-01 2.37753e+02 134.348 -1.61930e+00 1.65658e+00  0.00000e+00 0.00000e+00 8.18259e+01 134.348 1.55928e+02 314.348 0.7435 
1 1 1 -3  32  3  o 9  2.23951e+01 3.72060e-01 1.42380e+02 19.222  2.87859e+00  1.00368e+00  0.00000e+00 0.00000e+00 5.41240e+02 19.222  3.98859e+02 19.222  0.8135 
1 1 1 -3  32  4  o 18 3.09990e+01 4.70683e-01 5.86686e+02 176.313 -1.91139e+01 1.23181e+00  0.00000e+00 0.00000e+00 5.45328e+02 176.313 4.13579e+01 356.313 0.9735 
1 1 1 -3  32  5  o 6  1.41926e+01 2.92142e-01 2.51060e+02 56.736  2.58032e+00  3.93360e+00  0.00000e+00 0.00000e+00 2.20457e+02 56.736  3.06025e+01 236.736 0.8860 
1 1 1 -3  32  6  o 9  3.66584e+01 5.42176e-01 6.69723e+02 151.563 -2.76307e+01 1.49626e+01  0.00000e+00 0.00000e+00 6.82137e+02 151.563 1.24147e+01 151.563 0.9840 
1 1 1 -3  32  7  o 5  1.76841e+01 3.60383e-01 3.75855e+02 123.482 -5.66866e+00 8.57039e+00  0.00000e+00 0.00000e+00 2.53465e+02 123.482 1.22390e+02 303.482 0.9500 
1 1 1 -3  32  8  f 0  1.77988e+01 3.39160e-01 3.78617e+02 345.332 1.36922e+01  -3.58388e+00 0.00000e+00 0.00000e+00 2.63733e+02 345.332 1.14884e+02 165.332 0.9640 
1 1 1 -3  32  9  o 8  3.44137e+01 5.69551e-01 5.09697e+02 265.768 -3.36745e+00 -4.55069e+01 0.00000e+00 0.00000e+00 7.63650e+02 265.768 2.53953e+02 265.768 0.9890 
1 1 1 -3  32  10 o 15 1.91293e+01 4.04766e-01 3.48858e+02 176.150 -2.14261e+01 1.44175e+00  0.00000e+00 0.00000e+00 3.49479e+02 176.150 6.21292e-01 176.150 0.9764 
1 1 1 -3  32  11 f 0  1.63372e+01 6.16306e-01 3.13887e+02 345.911 2.27021e+01  -5.69760e+00 0.00000e+00 0.00000e+00 2.83265e+02 345.911 3.06218e+01 165.911 0.9784 
1 1 1 -3  32  12 o 5  8.53996e+00 8.39864e-01 1.42609e+02 272.370 2.95122e-01  -7.12918e+00 0.00000e+00 0.00000e+00 1.52903e+02 272.370 1.02936e+01 272.370 0.9270 
1 1 1 -3  32  13 o 15 4.93000e+00 1.10463e+00 1.28521e+02 85.956  3.11017e-01  4.39971e+00  0.00000e+00 0.00000e+00 3.28460e+01 85.956  9.56754e+01 265.956 0.8776 
1 1 1 -3  32  14 o 17 8.70433e+00 9.90729e-01 1.43761e+02 304.477 6.64270e+00  -9.67333e+00 0.00000e+00 0.00000e+00 1.66416e+02 304.477 2.26547e+01 304.477 0.9564 
1 1 1 -3  32  15 o 6  6.03217e+00 1.11491e+00 1.00351e+02 95.246  -6.16145e-01 6.71060e+00  0.00000e+00 0.00000e+00 1.06776e+02 95.246  6.42499e+00 95.246  0.9225 
1 1 1 -3  32  16 o 7  5.93029e+00 1.36465e+00 8.00437e+01 204.492 -4.81266e+00 -2.19246e+00 0.00000e+00 0.00000e+00 1.18336e+02 204.492 3.82920e+01 204.492 0.8997 
1 1 1 -3  32  17 o 18 3.92910e+00 1.23978e+00 4.74786e+01 356.137 2.49174e+00  -1.68230e-01 0.00000e+00 0.00000e+00 6.41151e+01 356.137 1.66366e+01 356.137 0.7647 
1 1 1 -3  32  18 o 13 5.47069e+00 1.62405e+00 5.12824e+01 220.205 -2.37577e+00 -2.00803e+00 0.00000e+00 0.00000e+00 1.14693e+02 220.205 6.34109e+01 220.205 0.8178 
1 1 1 -3  32  19 o 9  4.12527e+00 1.40517e+00 1.79679e+01 22.085  9.67999e-01  3.92776e-01  0.00000e+00 0.00000e+00 5.26427e+01 22.085  3.46748e+01 22.085  0.4620 
1 1 1 -3  33  1  o 19 9.60052e+00 3.20852e-01 1.59869e+01 181.844 -1.31245e-01 -4.22659e-03 0.00000e+00 0.00000e+00 7.62374e+00 181.844 8.36314e+00 1.845   0.0655 
1 1 1 -3  33  2  f 0  2.11380e+01 3.91948e-01 5.48204e+02 142.931 -8.20036e+00 6.19497e+00  0.00000e+00 0.00000e+00 2.05459e+02 142.931 3.42745e+02 322.931 0.9500 
1 1 1 -3  33  3  o 14 1.34268e+01 2.86843e-01 2.96204e+02 329.611 3.12258e+00  -1.83121e+00 0.00000e+00 0.00000e+00 1.30552e+02 329.611 1.65652e+02 149.611 0.8471 
1 1 1 -3  33  4  o 8  2.28134e+01 3.77264e-01 6.50727e+02 7.754   1.52994e+01  2.08331e+00  0.00000e+00 0.00000e+00 1.76748e+02 7.754   4.73979e+02 187.754 0.9671 
1 1 1 -3  33  5  o 9  1.26122e+01 3.26790e-01 2.26147e+02 187.336 -3.69916e+00 -4.76252e-01 0.00000e+00 0.00000e+00 1.76851e+02 187.336 4.92959e+01 7.336   0.8523 
1 1 1 -3  33  6  o 4  7.36866e+00 3.10903e-01 2.84028e+02 230.264 -1.70885e+00 -2.05566e+00 0.00000e+00 0.00000e+00 6.79222e+01 50.264  3.51950e+02 50.264  0.7826 
1 1 1 -3  33  7  o 18 9.43763e+00 3.55556e-01 1.43064e+02 307.764 1.56696e+00  -2.02271e+00 0.00000e+00 0.00000e+00 1.29561e+02 307.764 1.35029e+01 127.764 0.7712 
1 1 1 -3  33  8  o 2  8.36558e+00 3.22943e-01 2.44035e+02 240.558 -2.19713e+00 -3.89255e+00 0.00000e+00 0.00000e+00 3.13676e+01 240.558 2.12667e+02 60.558  0.8794 
1 1 1 -3  33  9  o 3  1.11240e+01 3.59036e-01 2.08116e+02 213.502 -5.33291e+00 -3.53007e+00 0.00000e+00 0.00000e+00 1.73949e+02 213.502 3.41663e+01 33.502  0.9181 
1 1 1 -3  33  10 o 3  2.31208e+01 4.47273e-01 4.41135e+02 258.975 -6.46116e+00 -3.31619e+01 0.00000e+00 0.00000e+00 4.10321e+02 258.975 3.08139e+01 78.975  0.9851 
1 1 1 -3  33  11 o 9  1.26627e+01 5.30904e-01 2.47645e+02 250.765 -4.73778e+00 -1.35785e+01 0.00000e+00 0.00000e+00 2.08621e+02 250.765 3.90240e+01 70.765  0.9646 
1 1 1 -3  33  12 o 17 1.38926e+01 1.00294e+00 2.99553e+02 155.924 -2.19533e+01 9.80893e+00  0.00000e+00 0.00000e+00 2.08083e+02 155.924 9.14697e+01 335.924 0.9790 
1 1 1 -3  33  13 o 15 8.39865e+00 9.12264e-01 1.61981e+02 118.177 -5.10656e+00 9.53278e+00  0.00000e+00 0.00000e+00 1.36365e+02 118.177 2.56160e+01 298.177 0.9526 
1 1 1 -3  33  14 o 19 3.80419e+00 1.11150e+00 1.29375e+02 33.988  3.81062e+00  2.56909e+00  0.00000e+00 0.00000e+00 4.21594e+00 213.988 1.33591e+02 213.988 0.8831 
1 1 1 -3  33  15 o 11 4.93532e+00 1.25302e+00 8.02728e+01 194.334 -3.86727e+00 -9.88180e-01 0.00000e+00 0.00000e+00 7.82850e+01 194.334 1.98779e+00 14.334  0.8632 
1 1 1 -3  33  16 o 12 5.68038e+00 1.33940e+00 6.18151e+01 311.814 2.65747e+00  -2.97079e+00 0.00000e+00 0.00000e+00 1.20439e+02 311.814 5.86237e+01 311.814 0.8630 
1 1 1 -3  33  17 o 6  7.32097e+00 1.64145e+00 1.46016e+02 153.312 -9.92155e+00 4.98741e+00  0.00000e+00 0.00000e+00 1.13318e+02 153.312 3.26977e+01 333.312 0.9539 
1 1 1 -3  33  18 o 16 4.93223e+00 1.50983e+00 1.12955e+02 69.429  2.34011e+00  6.23528e+00  0.00000e+00 0.00000e+00 5.56396e+01 69.429  5.73150e+01 249.429 0.9215 
1 1 1 -3  33  19 o 13 5.71660e+00 1.75802e+00 1.36446e+02 203.375 -8.05324e+00 -3.48081e+00 0.00000e+00 0.00000e+00 6.28721e+01 203.375 7.35742e+01 23.375  0.9412 
1 1 1 -3  34  1  f 0  1.55626e+01 3.88950e-01 2.56541e+02 310.472 2.30826e+00  -2.70528e+00 0.00000e+00 0.00000e+00 2.36462e+02 310.472 2.00791e+01 130.472 0.8440 
1 1 1 -3  34  2  o 18 1.86674e+01 3.40258e-01 4.32363e+02 5.895   7.70546e+00  7.95552e-01  0.00000e+00 0.00000e+00 2.21240e+02 5.895   2.11123e+02 185.895 0.9330 
1 1 1 -3  34  3  o 17 8.86450e+00 2.71804e-01 1.58523e+02 202.743 -1.16265e+00 -4.87371e-01 0.00000e+00 0.00000e+00 1.81253e+01 202.743 1.40397e+02 22.743  0.5312 
1 1 1 -3  34  4  o 5  3.87165e+01 5.69403e-01 7.60305e+02 151.811 -3.10492e+01 1.66406e+01  0.00000e+00 0.00000e+00 6.70946e+02 151.811 8.93594e+01 331.811 0.9857 
1 1 1 -3  34  5  o 10 1.52149e+01 3.05373e-01 3.62610e+02 82.575  8.46098e-01  6.49244e+00  0.00000e+00 0.00000e+00 1.62207e+02 82.575  2.00404e+02 262.575 0.9201 
1 1 1 -3  34  6  o 15 3.70276e+01 5.48136e-01 7.22098e+02 183.224 -3.51335e+01 -1.97923e+00 0.00000e+00 0.00000e+00 6.45529e+02 183.224 7.65690e+01 3.224   0.9857 
1 1 1 -3  34  7  o 15 3.51316e+01 5.28404e-01 7.76964e+02 13.166  4.66232e+01  1.09058e+01  0.00000e+00 0.00000e+00 5.24980e+02 13.166  2.51984e+02 193.165 0.9895 
1 1 1 -3  34  8  o 17 2.04604e+01 4.09882e-01 3.27924e+02 188.979 -1.44120e+01 -2.27714e+00 0.00000e+00 0.00000e+00 4.11194e+02 188.979 8.32706e+01 188.979 0.9651 
1 1 1 -3  34  9  o 7  2.14818e+01 4.32075e-01 3.59704e+02 325.385 1.79190e+01  -1.23682e+01 0.00000e+00 0.00000e+00 4.25180e+02 325.385 6.54762e+01 325.385 0.9768 
1 1 1 -3  34  10 o 13 2.57294e+01 4.85593e-01 5.40177e+02 4.788   4.56149e+01  3.82047e+00  0.00000e+00 0.00000e+00 4.11032e+02 4.788   1.29145e+02 184.788 0.9890 
1 1 1 -3  34  11 o 14 2.87768e+01 5.61814e-01 5.42496e+02 221.395 -5.65452e+01 -4.98426e+01 0.00000e+00 0.00000e+00 5.25217e+02 221.395 1.72792e+01 41.395  0.9933 
1 1 1 -3  34  12 o 8  1.45509e+01 6.50769e-01 2.94332e+02 132.526 -1.95729e+01 2.13406e+01  0.00000e+00 0.00000e+00 2.39265e+02 132.526 5.50662e+01 312.526 0.9826 
1 1 1 -3  34  13 f 0  8.88063e+00 9.05948e-01 1.80375e+02 47.883  8.65492e+00  9.57280e+00  0.00000e+00 0.00000e+00 1.37667e+02 47.883  4.27076e+01 227.883 0.9604 
1 1 1 -3  34  14 o 19 1.66689e+01 8.44072e-01 2.64649e+02 196.231 -4.20409e+01 -1.22384e+01 0.00000e+00 0.00000e+00 3.49183e+02 196.231 8.45338e+01 196.231 0.9885 
1 1 1 -3  34  15 f 0  1.70576e+01 9.13102e-01 1.97217e+02 328.989 3.58435e+01  -2.15462e+01 0.00000e+00 0.00000e+00 4.29951e+02 328.989 2.32734e+02 328.989 0.9880 
1 1 1 -3  34  16 f 0  1.10162e+01 1.16661e+00 2.79037e+02 151.465 -3.35177e+01 1.82252e+01  0.00000e+00 0.00000e+00 1.25095e+02 151.465 1.53941e+02 331.465 0.9868 
1 1 1 -3  34  17 o 8  9.57071e+00 1.52833e+00 1.42132e+02 80.494  2.41474e+00  1.44203e+01  0.00000e+00 0.00000e+00 2.00887e+02 80.494  5.87552e+01 80.494  0.9652 
1 1 1 -3  34  18 o 10 4.75078e+00 1.49494e+00 8.68475e+01 37.929  3.96862e+00  3.09273e+00  0.00000e+00 0.00000e+00 7.06977e+01 37.929  1.61498e+01 217.929 0.8941 
1 1 1 -3  34  19 o 19 5.39325e+00 1.62767e+00 1.36248e+02 339.755 8.54141e+00  -3.15025e+00 0.00000e+00 0.00000e+00 5.22212e+01 339.755 8.40263e+01 159.755 0.9434 
1 1 1 -3  35  1  o 16 7.37652e+00 3.51589e-01 1.02852e+02 269.605 -5.03405e-03 -7.30553e-01 0.00000e+00 0.00000e+00 7.92097e+00 89.605  1.10773e+02 89.605  0.3429 
1 1 1 -3  35  2  o 4  1.30928e+01 2.94364e-01 2.38842e+02 56.364  1.58007e+00  2.37493e+00  0.00000e+00 0.00000e+00 1.53427e+02 56.364  8.54158e+01 236.364 0.7985 
1 1 1 -3  35  3  o 6  3.09453e+01 4.74734e-01 8.92462e+02 258.423 -5.84541e+00 -2.85355e+01 0.00000e+00 0.00000e+00 2.48274e+02 258.423 6.44187e+02 78.423  0.9827 
1 1 1 -3  35  4  o 16 2.34034e+01 3.86212e-01 4.83196e+02 224.461 -8.94850e+00 -8.78187e+00 0.00000e+00 0.00000e+00 3.58673e+02 224.461 1.24523e+02 44.461  0.9593 
1 1 1 -3  35  5  o 6  2.48616e+01 4.03580e-01 3.98417e+02 294.159 4.98177e+00  -1.11061e+01 0.00000e+00 0.00000e+00 4.94385e+02 294.159 9.59685e+01 294.159 0.9580 
1 1 1 -3  35  6  o 9  4.22524e+01 6.15927e-01 9.00267e+02 115.093 -2.18150e+01 4.65856e+01  0.00000e+00 0.00000e+00 6.67388e+02 115.093 2.32880e+02 295.093 0.9902 
1 1 1 -3  35  7  o 17 2.21375e+01 3.81001e-01 3.03121e+02 310.623 7.49790e+00  -8.74089e+00 0.00000e+00 0.00000e+00 4.89044e+02 310.623 1.85923e+02 310.623 0.9555 
1 1 1 -3  35  8  f 0  3.70487e+01 5.57586e-01 7.65274e+02 185.081 -6.24197e+01 -5.55037e+00 0.00000e+00 0.00000e+00 6.10242e+02 185.081 1.55032e+02 5.081   0.9920 
1 1 1 -3  35  9  o 16 2.33474e+01 4.47379e-01 4.60029e+02 294.723 1.26056e+01  -2.73775e+01 0.00000e+00 0.00000e+00 3.98625e+02 294.723 6.14046e+01 114.723 0.9833 
1 1 1 -3  35  10 o 9  2.02786e+01 4.28763e-01 3.16785e+02 298.327 1.08821e+01  -2.01873e+01 0.00000e+00 0.00000e+00 4.24453e+02 298.327 1.07668e+02 298.327 0.9779 
1 1 1 -3  35  11 o 12 5.47527e+00 5.79619e-01 1.22432e+02 88.349  9.08223e-02  3.15190e+00  0.00000e+00 0.00000e+00 4.53959e+01 88.349  7.70358e+01 268.349 0.8207 
1 1 1 -3  35  12 o 15 9.67744e+00 7.26546e-01 2.13481e+02 237.620 -7.36054e+00 -1.16071e+01 0.00000e+00 0.00000e+00 1.34262e+02 237.620 7.92189e+01 57.620  0.9629 
1 1 1 -3  35  13 o 15 2.07097e+01 7.74164e-01 3.60047e+02 152.192 -5.77156e+01 3.04398e+01  0.00000e+00 0.00000e+00 4.06167e+02 152.192 4.61200e+01 152.192 0.9923 
1 1 1 -3  35  14 o 7  7.55723e+00 1.13022e+00 2.42671e+02 29.928  1.49671e+01  8.61601e+00  0.00000e+00 0.00000e+00 3.05551e+01 29.928  2.12116e+02 209.927 0.9706 
1 1 1 -3  35  15 o 6  5.57504e+00 1.27800e+00 1.25140e+02 239.184 -3.74423e+00 -6.27690e+00 0.00000e+00 0.00000e+00 6.75528e+01 239.184 5.75868e+01 59.183  0.9288 
1 1 1 -3  35  16 f 0  5.78082e+00 1.40129e+00 1.06572e+02 240.884 -3.27884e+00 -5.88712e+00 0.00000e+00 0.00000e+00 9.16577e+01 240.884 1.49146e+01 60.884  0.9225 
1 1 1 -3  35  17 o 3  4.21455e+00 1.33822e+00 6.70378e+01 89.185  5.15458e-02  3.62412e+00  0.00000e+00 0.00000e+00 6.55616e+01 89.185  1.47626e+00 269.185 0.8474 
1 1 1 -3  35  18 o 14 3.94499e+00 1.32893e+00 2.82536e+01 269.949 -1.37892e-03 -1.53862e+00 0.00000e+00 0.00000e+00 6.03387e+01 269.949 3.20851e+01 269.949 0.6055 
1 1 1 -3  35  19 o 14 5.79849e+00 1.86102e+00 1.11952e+02 13.490  6.79305e+00  1.62963e+00  0.00000e+00 0.00000e+00 8.67940e+01 13.490  2.51582e+01 193.490 0.9254 
1 1 1 -3  36  1  o 2  8.54117e+00 2.86133e-01 1.93210e+02 328.957 1.33898e+00  -8.05913e-01 0.00000e+00 0.00000e+00 2.72166e+00 328.957 1.90488e+02 148.957 0.6113 
1 1 1 -3  36  2  o 8  2.02629e+01 3.58984e-01 2.37458e+02 331.299 3.78739e+00  -2.07358e+00 0.00000e+00 0.00000e+00 4.27550e+02 331.299 1.90092e+02 331.299 0.8747 
1 1 1 -3  36  3  o 7  2.05427e+01 3.59412e-01 3.40458e+02 198.314 -6.91045e+00 -2.28736e+00 0.00000e+00 0.00000e+00 3.75005e+02 198.314 3.45469e+01 198.314 0.9285 
1 1 1 -3  36  4  o 15 1.85867e+01 3.38633e-01 3.91130e+02 55.918  5.37519e+00  7.94441e+00  0.00000e+00 0.00000e+00 2.68411e+02 55.918  1.22718e+02 235.918 0.9463 
1 1 1 -3  36  5  o 17 2.53749e+01 4.11310e-01 3.36278e+02 308.885 6.98916e+00  -8.66624e+00 0.00000e+00 0.00000e+00 5.71041e+02 308.885 2.34763e+02 308.885 0.9540 
1 1 1 -3  36  6  o 12 2.19155e+01 3.76182e-01 3.50034e+02 322.049 9.64605e+00  -7.52306e+00 0.00000e+00 0.00000e+00 4.36708e+02 322.049 8.66744e+01 322.049 0.9582 
1 1 1 -3  36  7  o 11 2.76050e+01 4.43542e-01 5.07633e+02 304.707 1.35881e+01  -1.96186e+01 0.00000e+00 0.00000e+00 5.04145e+02 304.707 3.48808e+00 124.707 0.9788 
1 1 1 -3  36  8  o 11 1.20115e+01 4.54679e-01 1.67516e+02 108.256 -1.54378e+00 4.67993e+00  0.00000e+00 0.00000e+00 2.33308e+02 108.256 6.57924e+01 108.256 0.8917 
1 1 1 -3  36  9  o 6  4.27215e+01 6.83265e-01 7.75673e+02 357.634 9.87078e+01  -4.07766e+00 0.00000e+00 0.00000e+00 8.13982e+02 357.634 3.83090e+01 357.634 0.9949 
1 1 1 -3  36  10 o 3  1.23695e+01 4.04743e-01 1.61304e+02 101.902 -1.42913e+00 6.78061e+00  0.00000e+00 0.00000e+00 2.66189e+02 101.902 1.04885e+02 101.902 0.9247 
1 1 1 -3  36  11 o 17 1.96400e+01 5.83434e-01 3.36675e+02 102.095 -6.99162e+00 3.26261e+01  0.00000e+00 0.00000e+00 3.85700e+02 102.095 4.90243e+01 102.095 0.9849 
1 1 1 -3  36  12 o 12 7.43107e+00 6.80933e-01 1.70522e+02 110.596 -3.08774e+00 8.21673e+00  0.00000e+00 0.00000e+00 9.04534e+01 110.596 8.00681e+01 290.596 0.9412 
1 1 1 -3  36  13 o 9  1.02221e+01 8.94089e-01 1.27743e+02 36.220  8.91086e+00  6.52652e+00  0.00000e+00 0.00000e+00 2.35662e+02 36.220  1.07919e+02 36.220  0.9536 
1 1 1 -3  36  14 o 19 6.83986e+00 1.13379e+00 7.22891e+01 139.223 -3.33179e+00 2.87356e+00  0.00000e+00 0.00000e+00 1.51211e+02 139.223 7.89215e+01 139.223 0.8773 
1 1 1 -3  36  15 o 1  1.18310e+01 1.07946e+00 2.57118e+02 222.770 -2.58686e+01 -2.39298e+01 0.00000e+00 0.00000e+00 1.76801e+02 222.770 8.03167e+01 42.770  0.9857 
1 1 1 -3  36  16 o 8  1.38395e+01 1.14116e+00 2.66326e+02 56.786  2.55248e+01  3.89845e+01  0.00000e+00 0.00000e+00 2.42517e+02 56.786  2.38088e+01 236.786 0.9892 
1 1 1 -3  36  17 o 3  8.04860e+00 1.60427e+00 1.01580e+02 106.960 -2.65185e+00 8.69542e+00  0.00000e+00 0.00000e+00 1.80289e+02 106.960 7.87091e+01 106.960 0.9433 
1 1 1 -3  36  18 o 6  4.79426e+00 1.54216e+00 4.17328e+01 194.641 -2.37842e+00 -6.21342e-01 0.00000e+00 0.00000e+00 9.34491e+01 194.641 5.17163e+01 194.641 0.7604 
1 1 1 -3  36  19 o 17 4.19613e+00 1.45005e+00 1.03437e+02 349.714 6.41178e+00  -1.16355e+00 0.00000e+00 0.00000e+00 3.94919e+01 349.714 6.39454e+01 169.714 0.9197 
1 1 1 -3  37  1  o 12 1.80626e+01 3.71439e-01 2.92478e+02 278.592 7.09586e-01  -4.69626e+00 0.00000e+00 0.00000e+00 3.08864e+02 278.592 1.63857e+01 278.592 0.8872 
1 1 1 -3  37  2  o 10 1.54510e+01 3.40267e-01 2.29801e+02 227.578 -2.53262e+00 -2.77144e+00 0.00000e+00 0.00000e+00 2.64854e+02 227.578 3.50533e+01 227.578 0.8534 
1 1 1 -3  37  3  o 5  2.90727e+01 4.55149e-01 5.39958e+02 13.411  1.83106e+01  4.36583e+00  0.00000e+00 0.00000e+00 5.21053e+02 13.411  1.89052e+01 193.411 0.9731 
1 1 1 -3  37  4  o 16 2.82313e+01 4.45636e-01 5.46834e+02 268.208 -6.29039e-01 -2.01123e+01 0.00000e+00 0.00000e+00 4.84988e+02 268.208 6.18461e+01 88.209  0.9748 
1 1 1 -3  37  5  o 11 2.18976e+01 3.77626e-01 4.74300e+02 109.404 -4.42798e+00 1.25709e+01  0.00000e+00 0.00000e+00 3.14961e+02 109.404 1.59339e+02 289.404 0.9617 
1 1 1 -3  37  6  o 2  2.59453e+01 4.23354e-01 5.26972e+02 25.907  1.90766e+01  9.26591e+00  0.00000e+00 0.00000e+00 4.21761e+02 25.907  1.05211e+02 205.907 0.9761 
1 1 1 -3  37  7  o 17 2.86027e+01 4.55375e-01 4.86319e+02 134.689 -1.67799e+01 1.69627e+01  0.00000e+00 0.00000e+00 5.61915e+02 134.689 7.55963e+01 134.689 0.9788 
1 1 1 -3  37  8  o 9  1.94266e+01 4.09361e-01 3.90047e+02 351.030 1.80658e+01  -2.85176e+00 0.00000e+00 0.00000e+00 3.16727e+02 351.030 7.33200e+01 171.030 0.9723 
1 1 1 -3  37  9  o 18 2.05690e+01 4.29145e-01 4.56898e+02 291.212 9.79108e+00  -2.52273e+01 0.00000e+00 0.00000e+00 2.97944e+02 291.212 1.58955e+02 111.212 0.9813 
1 1 1 -3  37  10 o 4  1.14529e+01 4.89436e-01 2.27904e+02 246.779 -4.03739e+00 -9.41033e+00 0.00000e+00 0.00000e+00 1.78616e+02 246.779 4.92879e+01 66.779  0.9498 
1 1 1 -3  37  11 o 1  1.54585e+01 5.68815e-01 2.18758e+02 135.309 -1.30382e+01 1.28986e+01  0.00000e+00 0.00000e+00 3.42512e+02 135.309 1.23753e+02 135.309 0.9723 
1 1 1 -3  37  12 o 4  1.35261e+01 5.63833e-01 1.84078e+02 172.962 -1.84013e+01 2.27170e+00  0.00000e+00 0.00000e+00 3.06781e+02 172.962 1.22703e+02 172.962 0.9726 
1 1 1 -3  37  13 o 6  1.24400e+01 8.23174e-01 2.99394e+02 130.415 -2.07779e+01 2.44011e+01  0.00000e+00 0.00000e+00 1.57042e+02 130.415 1.42352e+02 310.415 0.9843 
1 1 1 -3  37  14 o 16 5.30315e+00 1.17504e+00 7.61571e+01 45.437  2.47703e+00  2.51508e+00  0.00000e+00 0.00000e+00 9.02680e+01 45.437  1.41109e+01 45.437  0.8427 
1 1 1 -3  37  15 o 9  9.93985e+00 1.14451e+00 2.16642e+02 18.608  2.36368e+01  7.95845e+00  0.00000e+00 0.00000e+00 1.45674e+02 18.608  7.09686e+01 198.608 0.9797 
1 1 1 -3  37  16 o 2  4.49498e+00 1.29912e+00 6.37256e+01 134.313 -2.39388e+00 2.45199e+00  0.00000e+00 0.00000e+00 7.61306e+01 134.313 1.24050e+01 134.313 0.8372 
1 1 1 -3  37  17 o 3  5.06782e+00 1.49523e+00 9.21554e+01 278.013 7.47323e-01  -5.30861e+00 0.00000e+00 0.00000e+00 7.73764e+01 278.013 1.47791e+01 98.013  0.9011 
1 1 1 -3  37  18 o 12 5.50838e+00 1.69712e+00 1.03117e+02 262.227 -8.43166e-01 -6.17723e+00 0.00000e+00 0.00000e+00 8.39404e+01 262.227 1.91769e+01 82.227  0.9159 
1 1 1 -3  38  1  o 7  2.35053e+01 4.18523e-01 5.94609e+02 165.452 -1.43079e+01 3.71318e+00  0.00000e+00 0.00000e+00 2.56928e+02 165.452 3.37681e+02 345.452 0.9656 
1 1 1 -3  38  2  o 13 1.95206e+01 3.56263e-01 3.42402e+02 153.258 -6.21035e+00 3.12916e+00  0.00000e+00 0.00000e+00 3.34940e+02 153.258 7.46215e+00 333.258 0.9250 
1 1 1 -3  38  3  o 4  5.40173e+01 7.71239e-01 1.18037e+03 2.959   6.98493e+01  3.61072e+00  0.00000e+00 0.00000e+00 8.30820e+02 2.959   3.49551e+02 182.959 0.9928 
1 1 1 -3  38  4  o 19 4.11008e+01 6.02791e-01 8.30587e+02 98.210  -5.73879e+00 3.97776e+01  0.00000e+00 0.00000e+00 6.90943e+02 98.210  1.39643e+02 278.210 0.9875 
1 1 1 -3  38  5  o 6  2.65617e+01 4.28878e-01 3.73193e+02 275.112 1.17152e+00  -1.30945e+01 0.00000e+00 0.00000e+00 5.83542e+02 275.112 2.10349e+02 275.112 0.9612 
1 1 1 -3  38  6  o 16 2.65585e+01 4.28648e-01 5.78298e+02 56.060  1.62821e+01  2.41941e+01  0.00000e+00 0.00000e+00 3.99292e+02 56.060  1.79006e+02 236.060 0.9827 
1 1 1 -3  38  7  o 10 2.60202e+01 4.29251e-01 4.81796e+02 230.699 -1.66503e+01 -2.03421e+01 0.00000e+00 0.00000e+00 4.73622e+02 230.699 8.17476e+00 50.699  0.9808 
1 1 1 -3  38  8  o 12 1.18455e+01 3.33520e-01 3.17711e+02 264.362 -9.97186e-01 -1.01002e+01 0.00000e+00 0.00000e+00 1.03064e+02 264.362 2.14647e+02 84.361  0.9494 
1 1 1 -3  38  9  o 17 2.70211e+01 4.60489e-01 5.44929e+02 287.288 1.41341e+01  -4.54128e+01 0.00000e+00 0.00000e+00 4.54762e+02 287.288 9.01678e+01 107.288 0.9894 
1 1 1 -3  38  10 o 13 1.13205e+01 4.21854e-01 1.23961e+02 52.272  3.72094e+00  4.80939e+00  0.00000e+00 0.00000e+00 2.62489e+02 52.272  1.38528e+02 52.272  0.9136 
1 1 1 -3  38  11 o 11 2.02707e+01 4.49366e-01 3.08380e+02 342.003 3.59406e+01  -1.16756e+01 0.00000e+00 0.00000e+00 4.38389e+02 342.003 1.30009e+02 342.003 0.9867 
1 1 1 -3  38  12 o 6  7.96457e+00 6.79262e-01 2.37009e+02 75.281  3.51933e+00  1.33967e+01  0.00000e+00 0.00000e+00 4.91847e+01 75.281  1.87825e+02 255.281 0.9632 
1 1 1 -3  38  13 o 8  1.50569e+01 7.85190e-01 2.64169e+02 308.227 2.13687e+01  -2.71285e+01 0.00000e+00 0.00000e+00 2.88866e+02 308.227 2.46974e+01 308.227 0.9854 
1 1 1 -3  38  14 o 4  7.10334e+00 1.05614e+00 1.37192e+02 55.117  5.46882e+00  7.84435e+00  0.00000e+00 0.00000e+00 1.13085e+02 55.117  2.41066e+01 235.117 0.9462 
1 1 1 -3  38  15 o 15 1.12128e+01 1.08229e+00 1.91480e+02 201.143 -2.28488e+01 -8.83648e+00 0.00000e+00 0.00000e+00 2.17038e+02 201.143 2.55585e+01 201.143 0.9794 
1 1 1 -3  38  16 o 14 5.38027e+00 1.34240e+00 8.62429e+01 326.487 4.50796e+00  -2.98520e+00 0.00000e+00 0.00000e+00 9.41062e+01 326.487 7.86327e+00 326.487 0.9020 
1 1 1 -3  38  17 o 13 1.52235e+01 1.35244e+00 2.50626e+02 329.559 4.20020e+01  -2.46824e+01 0.00000e+00 0.00000e+00 3.08625e+02 329.559 5.79997e+01 329.559 0.9897 
1 1 1 -3  38  18 o 17 5.09402e+00 1.65119e+00 1.12418e+02 130.009 -4.22521e+00 5.03375e+00  0.00000e+00 0.00000e+00 6.14122e+01 130.009 5.10062e+01 310.009 0.9204 
1 1 1 -3  39  1  o 1  3.79579e+01 5.66688e-01 6.29351e+02 151.583 -2.17992e+01 1.17951e+01  0.00000e+00 0.00000e+00 7.65637e+02 151.583 1.36286e+02 151.583 0.9796 
1 1 1 -3  39  2  o 10 3.08627e+01 4.79892e-01 5.67894e+02 317.516 1.54755e+01  -1.41726e+01 0.00000e+00 0.00000e+00 5.61766e+02 317.516 6.12788e+00 137.516 0.9759 
1 1 1 -3  39  3  o 7  3.45546e+00 3.93054e-01 1.39986e+02 295.355 2.72422e-01  -5.74872e-01 0.00000e+00 0.00000e+00 1.00726e+02 115.355 2.40711e+02 115.355 0.3030 
1 1 1 -3  39  4  o 7  2.15790e+01 3.76456e-01 3.84933e+02 192.060 -9.96086e+00 -2.12814e+00 0.00000e+00 0.00000e+00 3.83159e+02 192.060 1.77404e+00 12.060  0.9496 
1 1 1 -3  39  5  o 12 3.54344e+01 5.34195e-01 7.99769e+02 150.701 -3.24469e+01 1.82078e+01  0.00000e+00 0.00000e+00 5.09993e+02 150.701 2.89776e+02 330.701 0.9865 
1 1 1 -3  39  6  o 18 3.17940e+01 4.92307e-01 6.08487e+02 228.790 -2.39849e+01 -2.73886e+01 0.00000e+00 0.00000e+00 5.65823e+02 228.790 4.26636e+01 48.790  0.9862 
1 1 1 -3  39  7  f 0  9.66401e+00 3.80185e-01 1.05513e+02 342.885 2.03995e+00  -6.28164e-01 0.00000e+00 0.00000e+00 1.54471e+02 342.885 4.89576e+01 342.885 0.7187 
1 1 1 -3  39  8  o 10 2.52763e+01 4.31058e-01 5.74070e+02 190.661 -3.73839e+01 -7.03754e+00 0.00000e+00 0.00000e+00 3.59051e+02 190.661 2.15019e+02 10.661  0.9868 
1 1 1 -3  39  9  o 18 1.48501e+01 3.80670e-01 2.80191e+02 261.856 -1.84396e+00 -1.28852e+01 0.00000e+00 0.00000e+00 2.53249e+02 261.856 2.69423e+01 81.856  0.9608 
1 1 1 -3  39  10 o 7  9.13780e+00 5.47615e-01 1.50090e+02 304.715 3.33438e+00  -4.81278e+00 0.00000e+00 0.00000e+00 1.60602e+02 304.715 1.05123e+01 304.715 0.9100 
1 1 1 -3  39  11 o 19 1.93187e+01 4.46618e-01 3.29266e+02 220.146 -2.81825e+01 -2.37702e+01 0.00000e+00 0.00000e+00 3.82112e+02 220.146 5.28458e+01 220.146 0.9863 
1 1 1 -3  39  12 o 3  1.46670e+01 4.49559e-01 2.67236e+02 326.402 2.43202e+01  -1.61571e+01 0.00000e+00 0.00000e+00 2.70427e+02 326.402 3.19060e+00 326.402 0.9827 
1 1 1 -3  39  13 f 0  1.09920e+01 8.80678e-01 1.96283e+02 62.129  8.98088e+00  1.69826e+01  0.00000e+00 0.00000e+00 2.02576e+02 62.129  6.29311e+00 62.129  0.9736 
1 1 1 -3  39  14 o 5  6.45410e+00 1.09077e+00 9.09849e+01 148.770 -5.06640e+00 3.07193e+00  0.00000e+00 0.00000e+00 1.27983e+02 148.770 3.69983e+01 148.770 0.9112 
1 1 1 -3  39  15 o 5  7.77554e+00 1.24668e+00 1.56299e+02 319.064 9.95900e+00  -8.63781e+00 0.00000e+00 0.00000e+00 1.21731e+02 319.064 3.45677e+01 139.064 0.9613 
1 1 1 -3  39  16 o 17 9.39658e+00 1.37761e+00 1.53048e+02 62.000  7.31977e+00  1.37664e+01  0.00000e+00 0.00000e+00 1.84713e+02 62.000  3.16650e+01 62.000  0.9674 
1 1 1 -3  39  17 o 11 6.92490e+00 1.68313e+00 1.32365e+02 273.877 6.11718e-01  -9.02577e+00 0.00000e+00 0.00000e+00 1.10002e+02 273.877 2.23632e+01 93.877  0.9430 
1 1 1 -3  39  18 o 15 4.98233e+00 1.63093e+00 1.07798e+02 113.734 -2.59125e+00 5.89357e+00  0.00000e+00 0.00000e+00 6.18799e+01 113.734 4.59184e+01 293.734 0.9187 
1 1 1 -3  40  1  o 8  1.13783e+01 3.72112e-01 1.54974e+02 32.795  1.77948e+00  1.14656e+00  0.00000e+00 0.00000e+00 1.50656e+02 32.795  4.31779e+00 212.795 0.7161 
1 1 1 -3  40  2  o 10 1.37413e+01 3.10049e-01 2.49846e+02 247.960 -1.42579e+00 -3.52186e+00 0.00000e+00 0.00000e+00 1.90954e+02 247.960 5.88920e+01 67.960  0.8553 
1 1 1 -3  40  3  o 13 2.45264e+01 4.08981e-01 5.39598e+02 197.025 -1.50701e+01 -4.61469e+00 0.00000e+00 0.00000e+00 3.50312e+02 197.025 1.89286e+02 17.025  0.9677 
1 1 1 -3  40  4  o 3  4.26852e+01 6.25269e-01 8.67182e+02 267.406 -2.16760e+00 -4.78383e+01 0.00000e+00 0.00000e+00 7.15901e+02 267.406 1.51281e+02 87.406  0.9895 
1 1 1 -3  40  5  f 0  1.48365e+01 3.24393e-01 2.82483e+02 319.334 4.31469e+00  -3.70675e+00 0.00000e+00 0.00000e+00 2.21810e+02 319.334 6.06722e+01 139.334 0.9072 
1 1 1 -3  40  6  o 15 1.12992e+01 3.54207e-01 2.79653e+02 172.712 -5.50540e+00 7.04125e-01  0.00000e+00 0.00000e+00 1.03185e+02 172.712 1.76468e+02 352.712 0.9048 
1 1 1 -3  40  7  o 3  1.91797e+01 3.70350e-01 2.47270e+02 220.698 -7.83767e+00 -6.74106e+00 0.00000e+00 0.00000e+00 4.34958e+02 220.698 1.87688e+02 220.698 0.9503 
1 1 1 -3  40  8  o 5  1.61023e+01 3.59606e-01 2.85643e+02 298.372 6.04135e+00  -1.11861e+01 0.00000e+00 0.00000e+00 2.92511e+02 298.372 6.86795e+00 298.372 0.9598 
1 1 1 -3  40  9  o 2  1.57410e+01 4.30388e-01 1.74267e+02 147.797 -7.46518e+00 4.70163e+00  0.00000e+00 0.00000e+00 3.79763e+02 147.797 2.05496e+02 147.797 0.9415 
1 1 1 -3  40  10 o 19 2.05850e+01 4.50860e-01 2.87470e+02 45.910  1.82358e+01  1.88242e+01  0.00000e+00 0.00000e+00 4.66720e+02 45.910  1.79250e+02 45.910  0.9807 
1 1 1 -3  40  11 o 10 7.11842e+00 5.40400e-01 9.05982e+01 76.915  8.34247e-01  3.58923e+00  0.00000e+00 0.00000e+00 1.35323e+02 76.915  4.47251e+01 76.915  0.8502 
1 1 1 -3  40  12 o 19 2.90588e+01 5.44592e-01 5.55498e+02 71.301  4.01713e+01  1.18685e+02  0.00000e+00 0.00000e+00 5.24018e+02 71.301  3.14801e+01 251.301 0.9960 
1 1 1 -3  40  13 o 14 1.58182e+01 6.35978e-01 3.09427e+02 256.807 -1.07222e+01 -4.57386e+01 0.00000e+00 0.00000e+00 2.73736e+02 256.807 3.56915e+01 76.807  0.9893 
1 1 1 -3  40  14 o 10 5.02947e+00 1.07165e+00 5.35913e+01 249.661 -9.98053e-01 -2.69239e+00 0.00000e+00 0.00000e+00 9.62094e+01 249.661 4.26181e+01 249.661 0.8000 
1 1 1 -3  40  15 o 1  9.19393e+00 1.25597e+00 1.67118e+02 208.338 -1.52631e+01 -8.23143e+00 0.00000e+00 0.00000e+00 1.64819e+02 208.338 2.29901e+00 28.338  0.9707 
1 1 1 -3  40  16 o 6  5.89254e+00 1.46013e+00 4.27466e+01 227.746 -1.90370e+00 -2.09550e+00 0.00000e+00 0.00000e+00 1.31667e+02 227.746 8.89207e+01 227.746 0.7967 
1 1 1 -3  40  17 f 0  5.86010e+00 1.67964e+00 7.46179e+01 166.378 -4.43809e+00 1.07546e+00  0.00000e+00 0.00000e+00 1.17250e+02 166.378 4.26321e+01 166.378 0.8823 
1 1 1 -3  40  18 o 15 5.92081e+00 1.82651e+00 7.65821e+01 354.137 4.69607e+00  -4.82230e-01 0.00000e+00 0.00000e+00 1.17970e+02 354.137 4.13880e+01 354.137 0.8865 
1 1 1 -3  41  1  o 17 1.42839e+01 3.63758e-01 2.82236e+02 32.917  3.74341e+00  2.42332e+00  0.00000e+00 0.00000e+00 1.88759e+02 32.917  9.34772e+01 212.917 0.8791 
1 1 1 -3  41  2  o 7  1.13741e+01 3.03091e-01 3.34385e+02 202.487 -4.61959e+00 -1.91230e+00 0.00000e+00 0.00000e+00 4.66622e+01 202.487 2.87723e+02 22.487  0.8934 
1 1 1 -3  41  3  o 6  4.66649e+01 6.77302e-01 8.53570e+02 253.041 -1.42234e+01 -4.66418e+01 0.00000e+00 0.00000e+00 8.77826e+02 253.041 2.42566e+01 253.041 0.9897 
1 1 1 -3  41  4  o 15 2.03523e+01 3.66876e-01 5.27574e+02 103.543 -3.21411e+00 1.33431e+01  0.00000e+00 0.00000e+00 2.06826e+02 103.543 3.20747e+02 283.543 0.9629 
1 1 1 -3  41  5  o 9  1.56202e+01 3.28119e-01 2.89027e+02 44.650  5.10033e+00  5.03841e+00  0.00000e+00 0.00000e+00 2.53639e+02 44.650  3.53883e+01 224.650 0.9274 
1 1 1 -3  41  6  o 11 1.89355e+01 3.77828e-01 3.92518e+02 297.459 5.85363e+00  -1.12642e+01 0.00000e+00 0.00000e+00 2.87988e+02 297.459 1.04531e+02 117.459 0.9598 
1 1 1 -3  41  7  o 5  2.04859e+01 3.84570e-01 2.90066e+02 324.067 1.07102e+01  -7.76220e+00 0.00000e+00 0.00000e+00 4.47047e+02 324.067 1.56981e+02 324.067 0.9614 
1 1 1 -3  41  8  o 2  1.41955e+01 4.54912e-01 2.11235e+02 192.083 -8.25310e+00 -1.76673e+00 0.00000e+00 0.00000e+00 2.87203e+02 192.083 7.59679e+01 192.083 0.9387 
1 1 1 -3  41  9  o 16 3.10073e+01 5.07332e-01 5.01009e+02 318.574 3.84397e+01  -3.39204e+01 0.00000e+00 0.00000e+00 6.46673e+02 318.574 1.45664e+02 318.574 0.9902 
1 1 1 -3  41  10 o 8  1.46545e+01 4.30459e-01 4.32030e+02 29.378  2.55977e+01  1.44104e+01  0.00000e+00 0.00000e+00 1.05968e+02 29.378  3.26062e+02 209.378 0.9828 
1 1 1 -3  41  11 o 2  1.47257e+01 4.39009e-01 2.43602e+02 83.592  2.32905e+00  2.07391e+01  0.00000e+00 0.00000e+00 2.92702e+02 83.592  4.91004e+01 83.592  0.9757 
1 1 1 -3  41  12 o 16 1.63510e+01 4.52389e-01 2.87249e+02 310.627 2.60798e+01  -3.03991e+01 0.00000e+00 0.00000e+00 3.14889e+02 310.627 2.76401e+01 310.627 0.9874 
1 1 1 -3  41  13 o 17 8.62854e+00 5.07753e-01 1.56874e+02 294.929 5.62468e+00  -1.21013e+01 0.00000e+00 0.00000e+00 1.52346e+02 294.929 4.52777e+00 114.929 0.9618 
1 1 1 -3  41  14 o 19 5.49327e+00 1.20952e+00 1.47429e+02 86.905  4.54125e-01  8.39953e+00  0.00000e+00 0.00000e+00 4.44933e+01 86.905  1.02936e+02 266.905 0.9385 
1 1 1 -3  41  15 o 14 5.78589e+00 1.15941e+00 1.50237e+02 300.656 5.15460e+00  -8.69655e+00 0.00000e+00 0.00000e+00 5.39963e+01 300.656 9.62403e+01 120.656 0.9492 
1 1 1 -3  41  16 o 7  4.11315e+00 1.24109e+00 1.07381e+02 194.075 -5.16064e+00 -1.29386e+00 0.00000e+00 0.00000e+00 3.01864e+01 194.075 7.71948e+01 14.075  0.9003 
1 1 1 -3  41  17 o 14 7.59562e+00 1.96417e+00 1.68355e+02 13.386  1.08078e+01  2.57196e+00  0.00000e+00 0.00000e+00 1.00495e+02 13.386  6.78593e+01 193.386 0.9539 
1 1 1 -3  41  18 f 0  5.17336e+00 1.66773e+00 3.48921e+01 87.263  9.75886e-02  2.04118e+00  0.00000e+00 0.00000e+00 1.00244e+02 87.263  6.53522e+01 87.263  0.7048 
1 1 1 -3  42  1  f 0  7.98318e+00 4.88700e-01 3.50843e+02 177.005 -3.66346e+00 1.91668e-01  0.00000e+00 0.00000e+00 9.65250e+01 357.005 4.47368e+02 357.005 0.8494 
1 1 1 -3  42  2  o 16 1.09115e+01 3.79968e-01 1.61954e+02 345.043 2.02924e+00  -5.42083e-01 0.00000e+00 0.00000e+00 1.29997e+02 345.043 3.19569e+01 165.043 0.7136 
1 1 1 -3  42  3  o 16 1.47266e+01 3.21647e-01 4.97946e+02 204.041 -8.76437e+00 -3.90963e+00 0.00000e+00 0.00000e+00 2.44734e+01 204.041 4.73472e+02 24.041  0.9464 
1 1 1 -3  42  4  o 15 1.70590e+01 4.17965e-01 4.01121e+02 339.649 8.47022e+00  -3.14176e+00 0.00000e+00 0.00000e+00 2.01629e+02 339.649 1.99493e+02 159.649 0.9429 
1 1 1 -3  42  5  o 13 8.36850e+00 3.45694e-01 1.50489e+02 272.820 9.57757e-02  -1.94430e+00 0.00000e+00 0.00000e+00 6.54296e+01 272.820 8.50595e+01 92.820  0.6888 
1 1 1 -3  42  6  o 7  1.31168e+01 3.73915e-01 2.23215e+02 134.405 -3.52230e+00 3.59620e+00  0.00000e+00 0.00000e+00 2.15906e+02 134.405 7.30912e+00 314.405 0.8942 
1 1 1 -3  42  7  o 8  2.20140e+01 3.97944e-01 3.58447e+02 154.227 -1.74355e+01 8.41860e+00  0.00000e+00 0.00000e+00 4.43776e+02 154.227 8.53290e+01 154.227 0.9738 
1 1 1 -3  42  8  o 5  1.15414e+01 3.64466e-01 2.07333e+02 153.242 -6.01300e+00 3.03190e+00  0.00000e+00 0.00000e+00 1.90828e+02 153.242 1.65049e+01 333.242 0.9224 
1 1 1 -3  42  9  o 19 1.42949e+01 3.99001e-01 3.99577e+02 290.275 7.09804e+00  -1.92147e+01 0.00000e+00 0.00000e+00 1.21490e+02 290.275 2.78087e+02 110.275 0.9753 
1 1 1 -3  42  10 o 12 1.09856e+01 4.64759e-01 2.14504e+02 18.067  1.09334e+01  3.56653e+00  0.00000e+00 0.00000e+00 1.77535e+02 18.067  3.69688e+01 198.067 0.9555 
1 1 1 -3  42  11 o 10 6.70873e+00 5.71396e-01 1.35381e+02 317.802 4.10723e+00  -3.72390e+00 0.00000e+00 0.00000e+00 9.11178e+01 317.802 4.42632e+01 137.802 0.9046 
1 1 1 -3  42  12 o 2  8.41388e+00 6.61841e-01 1.47562e+02 137.784 -7.13583e+00 6.47404e+00  0.00000e+00 0.00000e+00 1.49435e+02 137.784 1.87296e+00 137.784 0.9466 
1 1 1 -3  42  13 o 14 3.93434e+00 6.64611e-01 1.53295e+02 346.522 6.18884e+00  -1.48331e+00 0.00000e+00 0.00000e+00 1.87809e+01 166.522 1.72076e+02 166.522 0.9177 
1 1 1 -3  42  14 o 2  1.57117e+01 8.79959e-01 2.49948e+02 178.920 -4.69223e+01 8.84685e-01  0.00000e+00 0.00000e+00 3.28607e+02 178.920 7.86591e+01 178.920 0.9893 
1 1 1 -3  42  15 o 2  7.15710e+00 1.32007e+00 1.21492e+02 179.756 -9.18626e+00 3.90535e-02  0.00000e+00 0.00000e+00 1.29708e+02 179.756 8.21595e+00 179.756 0.9439 
1 1 1 -3  42  16 o 15 3.49084e+00 1.17132e+00 2.66713e+01 87.174  6.23360e-02  1.26284e+00  0.00000e+00 0.00000e+00 4.23461e+01 87.174  1.56749e+01 87.174  0.5323 
1 1 1 -3  42  17 o 13 4.23500e+00 1.40137e+00 2.63569e+01 255.067 -3.55828e-01 -1.33417e+00 0.00000e+00 0.00000e+00 6.24620e+01 255.067 3.61051e+01 255.067 0.5653 
1 1 1 -3  42  18 o 8  4.40887e+00 1.46954e+00 7.89478e+01 269.886 -8.99502e-03 -4.50609e+00 0.00000e+00 0.00000e+00 6.49159e+01 269.886 1.40319e+01 89.886  0.8805 
1 1 1 -3  43  1  o 12 2.35727e+01 4.68056e-01 5.79191e+02 193.482 -1.57494e+01 -3.77575e+00 0.00000e+00 0.00000e+00 2.77018e+02 193.482 3.02172e+02 13.482  0.9686 
1 1 1 -3  43  2  o 18 1.11643e+01 4.50597e-01 5.64254e+01 119.428 -3.80174e-01 6.73932e-01  0.00000e+00 0.00000e+00 9.44857e+01 119.428 3.80604e+01 119.428 0.3605 
1 1 1 -3  43  3  o 1  1.52830e+01 3.29515e-01 2.72207e+02 9.396   5.27236e+00  8.72460e-01  0.00000e+00 0.00000e+00 2.43781e+02 9.396   2.84266e+01 189.396 0.9008 
1 1 1 -3  43  4  o 10 2.83147e+00 4.92631e-01 3.77308e+01 252.422 -4.37241e-02 -1.38022e-01 0.00000e+00 0.00000e+00 3.00709e+01 72.422  6.78017e+01 72.422  0.0722 
1 1 1 -3  43  5  o 10 1.26455e+01 3.19918e-01 1.48790e+02 208.916 -3.11675e+00 -1.72170e+00 0.00000e+00 0.00000e+00 2.51041e+02 208.916 1.02251e+02 208.916 0.8442 
1 1 1 -3  43  6  o 1  7.44587e+00 3.99308e-01 1.64122e+02 12.292  2.50513e+00  5.45858e-01  0.00000e+00 0.00000e+00 5.10059e+01 12.292  1.13116e+02 192.292 0.7718 
1 1 1 -3  43  7  o 13 2.28449e+01 4.46038e-01 3.89107e+02 204.905 -1.94170e+01 -9.01513e+00 0.00000e+00 0.00000e+00 4.45466e+02 204.905 5.63593e+01 204.905 0.9764 
1 1 1 -3  43  8  o 17 3.75274e+01 5.77482e-01 5.47242e+02 152.955 -5.48451e+01 2.79996e+01  0.00000e+00 0.00000e+00 8.44655e+02 152.955 2.97412e+02 152.955 0.9918 
1 1 1 -3  43  9  o 13 3.86083e+01 5.98909e-01 5.93155e+02 229.200 -5.13999e+01 -5.95481e+01 0.00000e+00 0.00000e+00 8.40477e+02 229.200 2.47321e+02 229.200 0.9936 
1 1 1 -3  43  10 o 2  2.33332e+01 4.82091e-01 3.90751e+02 72.867  1.27703e+01  4.14250e+01  0.00000e+00 0.00000e+00 4.70514e+02 72.867  7.97623e+01 72.867  0.9884 
1 1 1 -3  43  11 o 7  8.31079e+00 5.39276e-01 1.11302e+02 254.699 -1.52500e+00 -5.57400e+00 0.00000e+00 0.00000e+00 1.70537e+02 254.699 5.92357e+01 254.699 0.9088 
1 1 1 -3  43  12 o 18 1.29312e+01 4.56011e-01 2.97646e+02 77.479  7.31429e+00  3.29366e+01  0.00000e+00 0.00000e+00 1.77302e+02 77.479  1.20344e+02 257.479 0.9851 
1 1 1 -3  43  13 o 8  6.35806e+00 6.19525e-01 1.14532e+02 211.643 -6.49425e+00 -4.00204e+00 0.00000e+00 0.00000e+00 1.06203e+02 211.643 8.32858e+00 31.643  0.9319 
1 1 1 -3  43  14 o 3  9.74347e+00 7.70840e-01 2.02548e+02 86.362  1.47189e+00  2.31529e+01  0.00000e+00 0.00000e+00 1.52176e+02 86.362  5.03726e+01 266.362 0.9782 
1 1 1 -3  43  15 o 7  5.51076e+00 1.36142e+00 1.25019e+02 1.066   7.83835e+00  1.45910e-01  0.00000e+00 0.00000e+00 6.63187e+01 1.066   5.87006e+01 181.066 0.9339 
1 1 1 -3  43  16 o 19 4.15021e+00 1.34076e+00 6.96041e+01 27.808  2.98860e+00  1.57625e+00  0.00000e+00 0.00000e+00 5.90282e+01 27.808  1.05759e+01 207.808 0.8345 
1 1 1 -3  43  17 o 6  7.44097e+00 1.93935e+00 1.44458e+02 260.483 -1.59918e+00 -9.53860e+00 0.00000e+00 0.00000e+00 1.16905e+02 260.483 2.75526e+01 80.483  0.9468 
1 1 1 -3  43  18 o 13 6.80174e+00 2.15430e+00 1.39194e+02 355.194 7.89108e+00  -6.63439e-01 0.00000e+00 0.00000e+00 9.63426e+01 355.194 4.28516e+01 175.194 0.9345 
1 1 1 -3  44  1  o 11 2.13440e+01 4.39677e-01 4.46412e+02 153.891 -1.05067e+01 5.14923e+00  0.00000e+00 0.00000e+00 3.18867e+02 153.891 1.27545e+02 333.891 0.9563 
1 1 1 -3  44  2  o 16 3.15411e+01 4.94611e-01 7.63767e+02 42.880  2.29627e+01  2.13234e+01  0.00000e+00 0.00000e+00 3.99574e+02 42.880  3.64193e+02 222.880 0.9839 
1 1 1 -3  44  3  o 6  3.23952e+01 5.87587e-01 4.14876e+02 300.032 8.87648e+00  -1.53546e+01 0.00000e+00 0.00000e+00 7.64433e+02 300.032 3.49557e+02 300.032 0.9714 
1 1 1 -3  44  4  o 8  3.28705e+01 5.07834e-01 4.38830e+02 119.626 -1.12937e+01 1.98594e+01  0.00000e+00 0.00000e+00 7.65356e+02 119.626 3.26525e+02 119.626 0.9779 
1 1 1 -3  44  5  o 17 5.12911e+01 7.39805e-01 7.57976e+02 104.135 -1.64480e+01 6.53131e+01  0.00000e+00 0.00000e+00 1.14850e+03 104.135 3.90523e+02 104.135 0.9925 
1 1 1 -3  44  6  o 14 1.31574e+01 3.34297e-01 2.18068e+02 219.972 -4.60421e+00 -3.85954e+00 0.00000e+00 0.00000e+00 2.31332e+02 219.972 1.32648e+01 219.972 0.9125 
1 1 1 -3  44  7  o 13 6.39870e+00 4.56697e-01 1.39762e+02 151.746 -2.11086e+00 1.13437e+00  0.00000e+00 0.00000e+00 4.05551e+01 151.746 9.92068e+01 331.746 0.7532 
1 1 1 -3  44  8  o 13 1.46727e+01 3.73766e-01 2.40333e+02 67.865  4.31873e+00  1.06171e+01  0.00000e+00 0.00000e+00 2.83780e+02 67.865  4.34475e+01 67.865  0.9553 
1 1 1 -3  44  9  o 2  1.31424e+01 4.50050e-01 2.33922e+02 200.677 -1.13260e+01 -4.27449e+00 0.00000e+00 0.00000e+00 2.36423e+02 200.677 2.50089e+00 200.677 0.9578 
1 1 1 -3  44  10 o 9  3.41945e+01 5.96199e-01 4.83306e+02 78.437  1.67043e+01  8.16420e+01  0.00000e+00 0.00000e+00 7.85847e+02 78.437  3.02541e+02 78.437  0.9940 
1 1 1 -3  44  11 o 2  1.30775e+01 4.52784e-01 2.26665e+02 120.148 -1.03189e+01 1.77666e+01  0.00000e+00 0.00000e+00 2.49256e+02 120.148 2.25902e+01 120.148 0.9754 
1 1 1 -3  44  12 o 15 9.49207e+00 5.11171e-01 1.44742e+02 304.117 6.77675e+00  -1.00030e+01 0.00000e+00 0.00000e+00 1.94158e+02 304.117 4.94157e+01 304.117 0.9577 
1 1 1 -3  44  13 o 18 7.53721e+00 5.55663e-01 1.43376e+02 0.648   1.20260e+01  1.35912e-01  0.00000e+00 0.00000e+00 1.25434e+02 0.648   1.79421e+01 180.647 0.9575 
1 1 1 -3  44  14 o 14 7.56180e+00 9.09283e-01 1.02826e+02 341.339 8.97247e+00  -3.03013e+00 0.00000e+00 0.00000e+00 1.63273e+02 341.339 6.04472e+01 341.339 0.9456 
1 1 1 -3  44  15 o 3  7.15347e+00 1.57443e+00 2.05378e+02 118.532 -6.93776e+00 1.27608e+01  0.00000e+00 0.00000e+00 5.12320e+01 118.532 1.54146e+02 298.532 0.9649 
1 1 1 -3  44  16 o 18 5.28954e+00 1.52846e+00 9.58875e+01 234.608 -3.24140e+00 -4.56239e+00 0.00000e+00 0.00000e+00 8.20010e+01 234.608 1.38864e+01 54.608  0.9056 
1 1 1 -3  44  17 o 5  4.73653e+00 1.43427e+00 5.71150e+01 199.452 -3.01186e+00 -1.06370e+00 0.00000e+00 0.00000e+00 8.75494e+01 199.452 3.04345e+01 199.452 0.8234 
1 1 1 -3  44  18 o 11 5.46750e+00 1.83334e+00 4.10473e+01 133.608 -1.60695e+00 1.68698e+00  0.00000e+00 0.00000e+00 1.09898e+02 133.608 6.88510e+01 133.608 0.7452 
1 1 1 -3  45  1  o 19 3.05028e+01 5.59790e-01 5.05016e+02 172.106 -1.98034e+01 2.74586e+00  0.00000e+00 0.00000e+00 6.09549e+02 172.106 1.04533e+02 172.106 0.9747 
1 1 1 -3  45  2  f 0  3.86142e+01 5.79203e-01 5.02995e+02 353.035 2.45546e+01  -2.99972e+00 0.00000e+00 0.00000e+00 9.14773e+02 353.035 4.11779e+02 353.035 0.9796 
1 1 1 -3  45  3  o 8  2.81349e+01 5.27702e-01 4.03578e+02 210.228 -1.33223e+01 -7.76241e+00 0.00000e+00 0.00000e+00 6.15897e+02 210.228 2.12318e+02 210.228 0.9670 
1 1 1 -3  45  4  o 15 8.07468e+00 3.24398e-01 1.66405e+02 270.955 3.46581e-02  -2.07963e+00 0.00000e+00 0.00000e+00 4.84905e+01 270.955 1.17915e+02 90.955  0.7105 
1 1 1 -3  45  5  o 17 1.41168e+01 3.33745e-01 2.90955e+02 205.626 -6.32710e+00 -3.03501e+00 0.00000e+00 0.00000e+00 1.98375e+02 205.626 9.25799e+01 25.626  0.9257 
1 1 1 -3  45  6  o 11 3.67276e+01 5.59145e-01 6.18656e+02 213.964 -4.07220e+01 -2.74297e+01 0.00000e+00 0.00000e+00 7.41878e+02 213.964 1.23221e+02 213.964 0.9898 
1 1 1 -3  45  7  o 14 1.06786e+01 3.59823e-01 2.92406e+02 338.270 7.61392e+00  -3.03462e+00 0.00000e+00 0.00000e+00 8.18285e+01 338.270 2.10578e+02 158.270 0.9368 
1 1 1 -3  45  8  o 5  3.29942e+00 6.54747e-01 1.45852e+02 350.116 1.46044e+00  -2.54475e-01 0.00000e+00 0.00000e+00 7.28572e+01 170.116 2.18710e+02 170.116 0.5918 
1 1 1 -3  45  9  o 6  2.02600e+01 4.70726e-01 4.10708e+02 108.855 -1.16161e+01 3.40140e+01  0.00000e+00 0.00000e+00 3.35643e+02 108.855 7.50648e+01 288.855 0.9860 
1 1 1 -3  45  10 o 6  9.19210e+00 5.78450e-01 1.09300e+02 119.850 -2.70837e+00 4.71953e+00  0.00000e+00 0.00000e+00 2.00503e+02 119.850 9.12030e+01 119.850 0.9027 
1 1 1 -3  45  11 o 10 6.19377e+00 6.20627e-01 1.25994e+02 9.240   5.38694e+00  8.76397e-01  0.00000e+00 0.00000e+00 8.26697e+01 9.240   4.33239e+01 189.240 0.9030 
1 1 1 -3  45  12 o 7  8.78766e+00 5.23518e-01 1.53263e+02 308.674 7.76939e+00  -9.70668e+00 0.00000e+00 0.00000e+00 1.60849e+02 308.674 7.58525e+00 308.674 0.9589 
1 1 1 -3  45  13 o 10 4.45897e+00 7.90072e-01 1.10473e+02 54.903  2.85519e+00  4.06304e+00  0.00000e+00 0.00000e+00 3.77576e+01 54.903  7.27153e+01 234.903 0.8926 
1 1 1 -3  45  14 o 6  7.64977e+00 5.62776e-01 2.09448e+02 293.933 8.55166e+00  -1.92677e+01 0.00000e+00 0.00000e+00 6.83530e+01 293.933 1.41095e+02 113.933 0.9760 
1 1 1 -3  45  15 o 1  6.75153e+00 1.60862e+00 9.93395e+01 7.552   6.46799e+00  8.57558e-01  0.00000e+00 0.00000e+00 1.31497e+02 7.552   3.21576e+01 7.552   0.9198 
1 1 1 -3  45  16 o 13 5.00372e+00 1.49535e+00 6.59383e+01 162.499 -3.53419e+00 1.11442e+00  0.00000e+00 0.00000e+00 9.22048e+01 162.499 2.62666e+01 162.499 0.8512 
1 1 1 -3  45  17 o 5  7.05927e+00 2.20567e+00 1.28918e+02 240.798 -3.35604e+00 -6.00431e+00 0.00000e+00 0.00000e+00 1.13047e+02 240.798 1.58712e+01 60.798  0.9242 
1 1 1 -3  45  18 o 12 6.25377e+00 2.08902e+00 1.49308e+02 181.637 -8.07488e+00 -2.30717e-01 0.00000e+00 0.00000e+00 6.75117e+01 181.637 8.17967e+01 1.637   0.9359 
1 1 1 -3  46  1  o 9  5.65135e+00 5.60415e-01 2.34852e+02 194.278 -1.63766e+00 -4.16777e-01 0.00000e+00 0.00000e+00 9.93400e+01 14.278  3.34192e+02 14.278  0.6397 
1 1 1 -3  46  2  o 2  3.96375e+01 5.93085e-01 8.84338e+02 299.931 2.29984e+01  -3.99459e+01 0.00000e+00 0.00000e+00 5.84956e+02 299.931 2.99383e+02 119.931 0.9891 
1 1 1 -3  46  3  o 16 1.26455e+01 3.73668e-01 5.46928e+02 64.978  4.66400e+00  9.99207e+00  0.00000e+00 0.00000e+00 9.51626e+01 244.978 6.42090e+02 244.978 0.9535 
1 1 1 -3  46  4  o 18 1.91371e+01 4.22867e-01 2.71375e+02 40.991  7.40196e+00  6.43247e+00  0.00000e+00 0.00000e+00 4.07800e+02 40.991  1.36425e+02 40.991  0.9476 
1 1 1 -3  46  5  o 11 3.59865e+01 5.50975e-01 6.20717e+02 124.115 -2.14133e+01 3.16092e+01  0.00000e+00 0.00000e+00 7.08834e+02 124.115 8.81165e+01 124.115 0.9868 
1 1 1 -3  46  6  o 16 1.33952e+01 3.46080e-01 4.08244e+02 171.376 -1.20256e+01 1.82381e+00  0.00000e+00 0.00000e+00 7.19661e+01 171.376 3.36278e+02 351.376 0.9580 
1 1 1 -3  46  7  o 16 1.35198e+01 3.64564e-01 2.73555e+02 338.149 9.46434e+00  -3.79522e+00 0.00000e+00 0.00000e+00 2.06650e+02 338.149 6.69048e+01 158.149 0.9496 
1 1 1 -3  46  8  o 15 3.16812e+01 5.16627e-01 5.73843e+02 173.883 -5.78850e+01 6.20365e+00  0.00000e+00 0.00000e+00 6.00228e+02 173.883 2.63850e+01 173.883 0.9914 
1 1 1 -3  46  9  o 6  2.23647e+01 4.88661e-01 4.48396e+02 305.356 2.48848e+01  -3.50731e+01 0.00000e+00 0.00000e+00 3.77321e+02 305.356 7.10744e+01 125.356 0.9883 
1 1 1 -3  46  10 f 0  7.40870e+00 6.48649e-01 1.41482e+02 205.852 -5.55950e+00 -2.69376e+00 0.00000e+00 0.00000e+00 1.11594e+02 205.852 2.98877e+01 25.852  0.9150 
1 1 1 -3  46  11 o 11 8.37170e+00 5.85286e-01 9.76140e+01 72.145  1.87153e+00  5.81012e+00  0.00000e+00 0.00000e+00 1.87800e+02 72.145  9.01865e+01 72.145  0.9139 
1 1 1 -3  46  12 o 1  3.73626e+00 9.46707e-01 4.48768e+01 122.656 -7.52789e-01 1.17459e+00  0.00000e+00 0.00000e+00 3.43773e+01 122.656 1.04995e+01 302.655 0.5691 
1 1 1 -3  46  13 o 8  7.84791e+00 6.54628e-01 1.55309e+02 286.174 3.75039e+00  -1.29309e+01 0.00000e+00 0.00000e+00 1.25868e+02 286.174 2.94417e+01 106.174 0.9621 
1 1 1 -3  46  14 o 7  5.59941e+00 6.61575e-01 7.69801e+01 303.077 3.21427e+00  -4.93492e+00 0.00000e+00 0.00000e+00 1.12717e+02 303.077 3.57369e+01 303.077 0.9106 
1 1 1 -3  46  15 o 13 7.79019e+00 1.65956e+00 9.97625e+01 313.958 5.06755e+00  -5.25535e+00 0.00000e+00 0.00000e+00 1.69140e+02 313.958 6.93777e+01 313.958 0.9287 
1 1 1 -3  46  16 o 14 5.08565e+00 1.52119e+00 1.25945e+02 143.946 -5.80562e+00 4.22642e+00  0.00000e+00 0.00000e+00 4.91798e+01 143.946 7.67652e+01 323.946 0.9275 
1 1 1 -3  46  17 o 2  6.27064e+00 1.97700e+00 1.32248e+02 266.070 -4.99682e-01 -7.27352e+00 0.00000e+00 0.00000e+00 8.37040e+01 266.070 4.85439e+01 86.070  0.9286 
1 1 1 -3  46  18 o 16 4.86011e+00 1.68529e+00 4.93797e+01 1.489   2.76107e+00  7.17842e-02  0.00000e+00 0.00000e+00 9.29684e+01 1.489   4.35887e+01 1.489   0.7907 
1 1 1 -3  47  1  o 10 3.07900e+01 4.90529e-01 6.56739e+02 335.475 2.42338e+01  -1.10567e+01 0.00000e+00 0.00000e+00 4.75407e+02 335.475 1.81332e+02 155.475 0.9810 
1 1 1 -3  47  2  o 3  2.06278e+01 3.82142e-01 3.34719e+02 279.189 1.49743e+00  -9.25648e+00 0.00000e+00 0.00000e+00 3.95794e+02 279.189 6.10747e+01 279.189 0.9451 
1 1 1 -3  47  3  o 3  2.37665e+01 4.78129e-01 5.98758e+02 41.484  1.64798e+01  1.45718e+01  0.00000e+00 0.00000e+00 2.71105e+02 41.484  3.27653e+02 221.484 0.9770 
1 1 1 -3  47  4  o 16 1.70183e+01 3.55641e-01 3.82524e+02 224.919 -8.09631e+00 -8.07343e+00 0.00000e+00 0.00000e+00 2.26262e+02 224.919 1.56262e+02 44.919  0.9552 
1 1 1 -3  47  5  o 12 2.46820e+01 4.24095e-01 3.48306e+02 165.490 -1.74481e+01 4.51567e+00  0.00000e+00 0.00000e+00 5.49649e+02 165.490 2.01343e+02 165.490 0.9718 
1 1 1 -3  47  6  o 4  1.80156e+01 3.71636e-01 3.43419e+02 4.680   1.49176e+01  1.22127e+00  0.00000e+00 0.00000e+00 3.07759e+02 4.680   3.56592e+01 184.680 0.9660 
1 1 1 -3  47  7  o 1  3.73156e+01 5.75317e-01 5.56467e+02 198.091 -5.50187e+01 -1.79735e+01 0.00000e+00 0.00000e+00 8.26963e+02 198.091 2.70495e+02 198.091 0.9913 
1 1 1 -3  47  8  o 1  2.35654e+01 4.41103e-01 4.16173e+02 143.548 -2.61292e+01 1.93009e+01  0.00000e+00 0.00000e+00 4.50954e+02 143.548 3.47815e+01 143.548 0.9845 
1 1 1 -3  47  9  o 8  2.23192e+01 4.41913e-01 4.03159e+02 187.701 -3.94800e+01 -5.33891e+00 0.00000e+00 0.00000e+00 4.19993e+02 187.701 1.68339e+01 187.701 0.9874 
1 1 1 -3  47  10 f 0  1.60347e+01 4.47955e-01 3.42876e+02 20.411  2.98002e+01  1.10893e+01  0.00000e+00 0.00000e+00 2.46156e+02 20.411  9.67196e+01 200.411 0.9841 
1 1 1 -3  47  11 o 2  1.67460e+01 4.61197e-01 3.20942e+02 99.578  -6.66000e+00 3.94691e+01  0.00000e+00 0.00000e+00 2.95799e+02 99.578  2.51425e+01 279.578 0.9874 
1 1 1 -3  47  12 o 14 9.80116e+00 5.27721e-01 1.91794e+02 286.698 4.96203e+00  -1.65416e+01 0.00000e+00 0.00000e+00 1.62730e+02 286.698 2.90640e+01 106.698 0.9706 
1 1 1 -3  47  13 o 8  8.43164e+00 6.03862e-01 1.26605e+02 293.490 4.45565e+00  -1.02522e+01 0.00000e+00 0.00000e+00 1.72952e+02 293.490 4.63479e+01 293.490 0.9542 
1 1 1 -3  47  14 o 8  4.41815e+00 7.63553e-01 8.83872e+01 163.867 -4.96781e+00 1.43699e+00  0.00000e+00 0.00000e+00 5.90709e+01 163.867 2.93163e+01 343.867 0.8972 
1 1 1 -3  47  15 o 12 5.06761e+00 1.25552e+00 4.44618e+01 327.039 2.24378e+00  -1.45495e+00 0.00000e+00 0.00000e+00 1.02935e+02 327.039 5.84733e+01 327.039 0.7827 
1 1 1 -3  47  16 o 14 5.76551e+00 1.61066e+00 5.78540e+01 43.774  2.46101e+00  2.35785e+00  0.00000e+00 0.00000e+00 1.21108e+02 43.774  6.32540e+01 43.774  0.8362 
1 1 1 -3  47  17 o 11 7.16631e+00 2.25101e+00 2.34743e+02 145.543 -1.03170e+01 7.07919e+00  0.00000e+00 0.00000e+00 2.01342e+01 145.543 2.14609e+02 325.543 0.9592 
1 1 1 -3  47  18 o 3  4.85174e+00 1.69620e+00 1.03479e+02 297.366 2.71820e+00  -5.25162e+00 0.00000e+00 0.00000e+00 6.02160e+01 297.366 4.32634e+01 117.366 0.9110 
1 1 1 -3  48  1  o 3  3.65137e+01 5.58556e-01 4.48319e+02 98.625  -3.31648e+00 2.18658e+01  0.00000e+00 0.00000e+00 8.88742e+02 98.625  4.40422e+02 98.625  0.9771 
1 1 1 -3  48  2  o 16 2.61016e+01 4.37999e-01 4.77289e+02 224.465 -1.40913e+01 -1.38306e+01 0.00000e+00 0.00000e+00 4.75576e+02 224.465 1.71295e+00 44.465  0.9743 
1 1 1 -3  48  3  o 6  4.05000e+01 7.05461e-01 7.29877e+02 351.288 5.46606e+01  -8.37626e+00 0.00000e+00 0.00000e+00 7.73359e+02 351.288 4.34827e+01 351.288 0.9909 
1 1 1 -3  48  4  o 14 1.09618e+01 3.29756e-01 2.96290e+02 51.181  3.47687e+00  4.32148e+00  0.00000e+00 0.00000e+00 7.50464e+01 51.181  2.21244e+02 231.181 0.9047 
1 1 1 -3  48  5  o 4  3.62039e+01 5.55414e-01 6.39673e+02 10.686  4.93556e+01  9.31351e+00  0.00000e+00 0.00000e+00 7.01874e+02 10.686  6.22007e+01 10.686  0.9900 
1 1 1 -3  48  6  o 9  9.26548e+00 3.59414e-01 1.94117e+02 88.059  1.64162e-01  4.84339e+00  0.00000e+00 0.00000e+00 1.14291e+02 88.059  7.98253e+01 268.059 0.8897 
1 1 1 -3  48  7  o 8  1.82938e+01 3.89984e-01 3.88521e+02 294.555 8.95134e+00  -1.95918e+01 0.00000e+00 0.00000e+00 2.79471e+02 294.555 1.09050e+02 114.555 0.9765 
1 1 1 -3  48  8  o 15 1.79225e+01 4.25692e-01 2.80627e+02 106.563 -5.12947e+00 1.72476e+01  0.00000e+00 0.00000e+00 3.70282e+02 106.563 8.96550e+01 106.563 0.9718 
1 1 1 -3  48  9  o 2  1.96779e+01 4.77811e-01 3.57652e+02 312.624 2.19869e+01  -2.38908e+01 0.00000e+00 0.00000e+00 3.65866e+02 312.624 8.21398e+00 312.624 0.9845 
1 1 1 -3  48  10 o 16 3.06987e+01 5.61339e-01 5.06689e+02 0.545   8.93963e+01  8.50651e-01  0.00000e+00 0.00000e+00 6.32611e+02 0.545   1.25921e+02 0.545   0.9944 
1 1 1 -3  48  11 o 9  1.11427e+01 5.75036e-01 1.86970e+02 17.866  1.53212e+01  4.93864e+00  0.00000e+00 0.00000e+00 2.15456e+02 17.866  2.84859e+01 17.866  0.9684 
1 1 1 -3  48  12 o 5  2.97740e+00 7.89913e-01 2.98386e+01 261.919 -1.14043e-01 -8.03214e-01 0.00000e+00 0.00000e+00 1.18271e+01 261.919 1.80114e+01 81.919  0.3756 
1 1 1 -3  48  13 o 8  4.31070e+00 9.26148e-01 7.85730e+01 250.350 -1.17210e+00 -3.28265e+00 0.00000e+00 0.00000e+00 5.62906e+01 250.350 2.22824e+01 70.350  0.8403 
1 1 1 -3  48  14 o 1  1.10472e+01 5.98953e-01 1.77448e+02 189.889 -2.81104e+01 -4.90042e+00 0.00000e+00 0.00000e+00 2.26180e+02 189.889 4.87320e+01 189.889 0.9823 
1 1 1 -3  48  15 o 4  3.30396e+00 1.05643e+00 7.35556e+01 257.773 -6.79664e-01 -3.13649e+00 0.00000e+00 0.00000e+00 2.76445e+01 257.773 4.59111e+01 77.773  0.8243 
1 1 1 -3  48  16 o 12 5.61121e+00 1.78227e+00 1.13635e+02 357.831 6.30282e+00  -2.38680e-01 0.00000e+00 0.00000e+00 7.73268e+01 357.831 3.63082e+01 177.831 0.9169 
1 1 1 -3  48  17 o 16 5.02099e+00 1.66484e+00 8.68826e+01 292.819 1.85789e+00  -4.41561e+00 0.00000e+00 0.00000e+00 7.84763e+01 292.819 8.40630e+00 112.819 0.8883 
1 1 1 -3  48  18 o 8  3.95029e+00 1.36098e+00 1.43621e+01 324.276 6.98540e-01  -5.02385e-01 0.00000e+00 0.00000e+00 4.33853e+01 324.276 2.90232e+01 324.276 0.3948 
1 1 1 -3  49  1  o 17 3.67351e+01 5.63202e-01 6.90069e+02 281.290 7.82512e+00  -3.91966e+01 0.00000e+00 0.00000e+00 6.69081e+02 281.290 2.09887e+01 101.290 0.9874 
1 1 1 -3  49  2  o 18 9.53110e+00 4.01714e-01 1.33588e+02 311.309 1.29666e+00  -1.47550e+00 0.00000e+00 0.00000e+00 1.13433e+02 311.309 2.01545e+01 131.309 0.6918 
1 1 1 -3  49  3  o 17 3.21123e+01 5.46382e-01 4.43207e+02 68.849  8.98160e+00  2.32153e+01  0.00000e+00 0.00000e+00 7.35057e+02 68.849  2.91850e+02 68.849  0.9797 
1 1 1 -3  49  4  o 9  1.11115e+01 3.84231e-01 6.69114e+01 145.515 -1.29140e+00 8.87049e-01  0.00000e+00 0.00000e+00 1.87770e+02 145.515 1.20858e+02 145.515 0.6122 
1 1 1 -3  49  5  o 6  1.43364e+01 4.05018e-01 1.94394e+02 52.213  3.80157e+00  4.90333e+00  0.00000e+00 0.00000e+00 2.96766e+02 52.213  1.02372e+02 52.213  0.9154 
1 1 1 -3  49  6  o 1  2.06618e+01 5.22295e-01 2.50426e+02 144.902 -1.10434e+01 7.76090e+00  0.00000e+00 0.00000e+00 4.93278e+02 144.902 2.42852e+02 144.902 0.9622 
1 1 1 -3  49  7  o 4  3.12680e+01 5.32338e-01 5.00955e+02 331.947 4.45344e+01  -2.37326e+01 0.00000e+00 0.00000e+00 6.56463e+02 331.947 1.55508e+02 331.947 0.9900 
1 1 1 -3  49  8  o 18 2.19590e+01 4.16877e-01 2.24841e+02 335.591 1.56096e+01  -7.08377e+00 0.00000e+00 0.00000e+00 5.71391e+02 335.591 3.46550e+02 335.591 0.9704 
1 1 1 -3  49  9  o 5  1.86578e+01 4.04947e-01 2.62903e+02 217.518 -1.90396e+01 -1.46192e+01 0.00000e+00 0.00000e+00 4.19163e+02 217.518 1.56261e+02 217.518 0.9789 
1 1 1 -3  49  10 o 17 2.79211e+01 5.69436e-01 4.85738e+02 262.865 -1.02920e+01 -8.22215e+01 0.00000e+00 0.00000e+00 5.49876e+02 262.865 6.41388e+01 262.865 0.9939 
1 1 1 -3  49  11 o 12 9.87708e+00 5.96844e-01 9.74573e+01 23.477  7.34984e+00  3.19224e+00  0.00000e+00 0.00000e+00 2.47029e+02 23.477  1.49572e+02 23.477  0.9353 
1 1 1 -3  49  12 o 12 1.53313e+01 4.87197e-01 2.65588e+02 179.305 -4.02544e+01 4.88121e-01  0.00000e+00 0.00000e+00 2.98479e+02 179.305 3.28908e+01 179.305 0.9875 
1 1 1 -3  49  13 o 3  9.88664e+00 6.52944e-01 1.52327e+02 327.584 1.58205e+01  -1.00460e+01 0.00000e+00 0.00000e+00 2.05740e+02 327.584 5.34129e+01 327.584 0.9729 
1 1 1 -3  49  14 o 8  6.13929e+00 7.91485e-01 9.73301e+01 117.244 -3.65242e+00 7.09350e+00  0.00000e+00 0.00000e+00 1.16158e+02 117.244 1.88278e+01 117.244 0.9351 
1 1 1 -3  49  15 o 1  8.55793e+00 1.11402e+00 1.21132e+02 225.444 -9.64795e+00 -9.79870e+00 0.00000e+00 0.00000e+00 1.85023e+02 225.444 6.38905e+01 225.444 0.9629 
1 1 1 -3  49  16 o 10 9.78536e+00 2.31856e+00 1.58237e+02 220.566 -8.09079e+00 -6.92644e+00 0.00000e+00 0.00000e+00 1.87427e+02 220.566 2.91896e+01 220.566 0.9518 
1 1 1 -3  49  17 o 2  5.78771e+00 1.90377e+00 1.45110e+02 118.422 -3.82546e+00 7.06855e+00  0.00000e+00 0.00000e+00 5.56143e+01 118.422 8.94957e+01 298.422 0.9355 
1 1 1 -3  49  18 o 14 4.82657e+00 1.57587e+00 2.47409e+01 285.460 4.25659e-01  -1.53904e+00 0.00000e+00 0.00000e+00 8.59110e+01 285.460 6.11702e+01 285.460 0.6192 
1 1 1 -3  50  1  o 19 2.80428e+01 4.64407e-01 5.65989e+02 76.455  7.04497e+00  2.92422e+01  0.00000e+00 0.00000e+00 4.67029e+02 76.455  9.89604e+01 256.455 0.9832 
1 1 1 -3  50  2  o 2  1.44074e+01 3.74925e-01 1.97479e+02 22.807  4.62935e+00  1.94669e+00  0.00000e+00 0.00000e+00 2.84922e+02 22.807  8.74433e+01 22.807  0.8939 
1 1 1 -3  50  3  o 2  3.22918e+01 5.11978e-01 3.28237e+02 50.121  1.15621e+01  1.38384e+01  0.00000e+00 0.00000e+00 8.46975e+02 50.121  5.18737e+02 50.121  0.9719 
1 1 1 -3  50  4  o 13 2.39592e+01 4.22428e-01 4.92823e+02 304.264 1.39217e+01  -2.04358e+01 0.00000e+00 0.00000e+00 3.85752e+02 304.264 1.07072e+02 124.264 0.9796 
1 1 1 -3  50  5  o 5  1.06923e+01 3.61667e-01 2.15812e+02 332.830 5.04311e+00  -2.58850e+00 0.00000e+00 0.00000e+00 1.47036e+02 332.830 6.87761e+01 152.830 0.9069 
1 1 1 -3  50  6  o 9  1.66782e+01 3.74122e-01 1.23574e+02 291.388 2.07278e+00  -5.29244e+00 0.00000e+00 0.00000e+00 4.42314e+02 291.388 3.18740e+02 291.388 0.9071 
1 1 1 -3  50  7  o 7  2.37355e+01 4.22531e-01 3.21639e+02 284.732 6.06380e+00  -2.30609e+01 0.00000e+00 0.00000e+00 5.46862e+02 284.732 2.25222e+02 284.732 0.9788 
1 1 1 -3  50  8  o 12 1.72379e+01 3.86604e-01 2.42786e+02 215.715 -1.34071e+01 -9.63941e+00 0.00000e+00 0.00000e+00 3.81433e+02 215.715 1.38647e+02 215.715 0.9692 
1 1 1 -3  50  9  o 5  4.16001e+01 6.26720e-01 7.16389e+02 231.015 -8.75731e+01 -1.08202e+02 0.00000e+00 0.00000e+00 8.31274e+02 231.015 1.14884e+02 231.015 0.9964 
1 1 1 -3  50  10 o 11 1.01647e+01 4.45898e-01 1.29245e+02 53.552  4.92873e+00  6.67342e+00  0.00000e+00 0.00000e+00 2.26366e+02 53.552  9.71207e+01 53.552  0.9376 
1 1 1 -3  50  11 o 8  1.10050e+01 4.92677e-01 1.86507e+02 277.432 2.11817e+00  -1.62371e+01 0.00000e+00 0.00000e+00 2.11062e+02 277.432 2.45544e+01 277.432 0.9690 
1 1 1 -3  50  12 o 5  7.81441e+00 5.95234e-01 1.72127e+02 260.172 -2.46840e+00 -1.42493e+01 0.00000e+00 0.00000e+00 1.08727e+02 260.172 6.34002e+01 80.172  0.9648 
1 1 1 -3  50  13 o 1  5.90445e+00 8.52880e-01 1.34177e+02 140.108 -7.36338e+00 6.15506e+00  0.00000e+00 0.00000e+00 7.37982e+01 140.108 6.03787e+01 320.108 0.9464 
1 1 1 -3  50  14 o 13 3.83404e+00 9.10726e-01 9.84581e+01 241.204 -2.43450e+00 -4.42900e+00 0.00000e+00 0.00000e+00 2.90842e+01 241.204 6.93740e+01 61.204  0.8946 
1 1 1 -3  50  15 o 3  3.95830e+00 1.21571e+00 7.75110e+01 222.317 -2.68609e+00 -2.44559e+00 0.00000e+00 0.00000e+00 4.71396e+01 222.317 3.03714e+01 42.317  0.8477 
1 1 1 -3  50  16 o 14 5.95900e+00 1.82373e+00 5.69669e+01 263.985 -3.35203e-01 -3.18119e+00 0.00000e+00 0.00000e+00 1.25165e+02 263.985 6.81980e+01 263.985 0.8237 
1 1 1 -3  50  17 o 16 4.66307e+00 1.49134e+00 5.90544e+01 22.314  3.22534e+00  1.32374e+00  0.00000e+00 0.00000e+00 8.61974e+01 22.314  2.71431e+01 22.314  0.8404 
1 1 1 -3  50  18 o 14 4.13574e+00 1.38770e+00 8.54602e+01 190.842 -5.47811e+00 -1.04915e+00 0.00000e+00 0.00000e+00 5.31434e+01 190.842 3.23168e+01 10.842  0.9053 
1 1 1 -3  51  1  o 10 2.66400e+01 4.50535e-01 2.52754e+02 250.424 -3.96802e+00 -1.11581e+01 0.00000e+00 0.00000e+00 7.02073e+02 250.424 4.49319e+02 250.424 0.9568 
1 1 1 -3  51  2  o 18 4.54526e+01 6.71287e-01 9.51473e+02 340.199 6.90770e+01  -2.48709e+01 0.00000e+00 0.00000e+00 7.39194e+02 340.199 2.12280e+02 160.199 0.9932 
1 1 1 -3  51  3  o 2  2.29002e+01 4.55651e-01 4.50403e+02 313.060 1.48148e+01  -1.58535e+01 0.00000e+00 0.00000e+00 3.87029e+02 313.060 6.33736e+01 133.060 0.9767 
1 1 1 -3  51  4  o 10 3.15892e+01 5.04985e-01 3.76762e+02 189.891 -2.54454e+01 -4.43701e+00 0.00000e+00 0.00000e+00 7.82483e+02 189.891 4.05720e+02 189.891 0.9804 
1 1 1 -3  51  5  o 16 2.59671e+01 4.48130e-01 3.30323e+02 29.118  1.80309e+01  1.00434e+01  0.00000e+00 0.00000e+00 6.17389e+02 29.118  2.87066e+02 29.118  0.9755 
1 1 1 -3  51  6  o 11 1.39031e+01 3.90346e-01 2.69095e+02 77.614  2.25866e+00  1.02847e+01  0.00000e+00 0.00000e+00 2.25506e+02 77.614  4.35884e+01 257.614 0.9513 
1 1 1 -3  51  7  o 18 3.56442e+01 5.46629e-01 6.59040e+02 251.055 -2.43414e+01 -7.09125e+01 0.00000e+00 0.00000e+00 6.64357e+02 251.055 5.31707e+00 251.055 0.9933 
1 1 1 -3  51  8  o 6  1.72888e+01 3.90477e-01 2.69331e+02 96.175  -2.16944e+00 2.00524e+01  0.00000e+00 0.00000e+00 3.60299e+02 96.175  9.09683e+01 96.175  0.9749 
1 1 1 -3  51  9  o 13 2.68788e+01 4.71257e-01 4.61896e+02 173.101 -6.75617e+01 8.17463e+00  0.00000e+00 0.00000e+00 5.34159e+02 173.101 7.22631e+01 173.101 0.9926 
1 1 1 -3  51  10 o 19 1.42524e+01 4.13186e-01 3.15225e+02 283.910 7.79363e+00  -3.14698e+01 0.00000e+00 0.00000e+00 2.08216e+02 283.910 1.07009e+02 103.910 0.9845 
1 1 1 -3  51  11 o 18 8.77090e+00 5.95063e-01 1.26753e+02 167.964 -9.29371e+00 1.98153e+00  0.00000e+00 0.00000e+00 1.82494e+02 167.964 5.57419e+01 167.964 0.9458 
1 1 1 -3  51  12 o 16 3.83899e+00 9.32257e-01 1.25923e+02 9.974   4.55945e+00  8.01785e-01  0.00000e+00 0.00000e+00 4.83447e-01 9.974   1.25440e+02 189.974 0.8840 
1 1 1 -3  51  13 o 4  6.77758e+00 8.02826e-01 1.49430e+02 297.528 5.76000e+00  -1.10515e+01 0.00000e+00 0.00000e+00 9.24523e+01 297.528 5.69776e+01 117.528 0.9590 
1 1 1 -3  51  14 o 8  1.60285e+01 6.55565e-01 2.59557e+02 143.359 -4.83711e+01 3.59769e+01  0.00000e+00 0.00000e+00 3.31404e+02 143.359 7.18475e+01 143.359 0.9917 
1 1 1 -3  51  15 o 6  6.78079e+00 8.39067e-01 8.35620e+01 120.001 -4.20352e+00 7.28029e+00  0.00000e+00 0.00000e+00 1.52797e+02 120.001 6.92350e+01 120.001 0.9385 
1 1 1 -3  51  16 o 18 7.05165e+00 2.04398e+00 1.86667e+02 262.804 -1.30493e+00 -1.03355e+01 0.00000e+00 0.00000e+00 6.20704e+01 262.804 1.24597e+02 82.804  0.9507 
1 1 1 -3  51  17 o 16 4.83779e+00 1.46131e+00 2.87448e+01 176.743 -1.82078e+00 1.03627e-01  0.00000e+00 0.00000e+00 9.07687e+01 176.743 6.20239e+01 176.743 0.6666 
1 1 1 -3  51  18 o 17 6.58303e+00 1.86291e+00 7.44411e+01 161.207 -5.13201e+00 1.74637e+00  0.00000e+00 0.00000e+00 1.45432e+02 161.207 7.09911e+01 161.207 0.9023 
1 1 1 -3  52  1  o 1  3.46472e+01 5.41844e-01 5.77455e+02 9.847   3.35756e+01  5.82770e+00  0.00000e+00 0.00000e+00 7.01067e+02 9.847   1.23612e+02 9.847   0.9852 
1 1 1 -3  52  2  o 13 3.86801e+01 5.88788e-01 6.92021e+02 289.882 1.55636e+01  -4.30350e+01 0.00000e+00 0.00000e+00 7.40515e+02 289.882 4.84944e+01 289.882 0.9890 
1 1 1 -3  52  3  f 0  1.34537e+01 3.51779e-01 2.34743e+02 10.126  6.52703e+00  1.16564e+00  0.00000e+00 0.00000e+00 2.29208e+02 10.126  5.53471e+00 190.125 0.9212 
1 1 1 -3  52  4  o 3  2.36152e+01 4.26169e-01 4.67827e+02 38.452  1.92153e+01  1.52585e+01  0.00000e+00 0.00000e+00 3.97750e+02 38.452  7.00769e+01 218.452 0.9794 
1 1 1 -3  52  5  o 16 3.05098e+01 4.97127e-01 5.26977e+02 327.060 3.60286e+01  -2.33434e+01 0.00000e+00 0.00000e+00 6.01001e+02 327.060 7.40240e+01 327.060 0.9883 
1 1 1 -3  52  6  o 13 2.83303e+01 4.63469e-01 5.63448e+02 306.650 2.87726e+01  -3.86718e+01 0.00000e+00 0.00000e+00 4.84838e+02 306.650 7.86092e+01 126.650 0.9896 
1 1 1 -3  52  7  f 0  1.26726e+01 3.78809e-01 1.87871e+02 87.924  2.86068e-01  7.89185e+00  0.00000e+00 0.00000e+00 2.54649e+02 87.924  6.67774e+01 87.924  0.9344 
1 1 1 -3  52  8  f 0  2.91877e+01 4.84719e-01 5.04903e+02 4.321   6.49386e+01  4.90676e+00  0.00000e+00 0.00000e+00 5.76889e+02 4.321   7.19861e+01 4.321   0.9923 
1 1 1 -3  52  9  o 14 1.60616e+01 4.04691e-01 2.77009e+02 146.284 -2.24457e+01 1.49784e+01  0.00000e+00 0.00000e+00 3.11310e+02 146.284 3.43008e+01 146.284 0.9813 
1 1 1 -3  52  10 o 3  1.75785e+01 4.25312e-01 3.03628e+02 295.385 1.73925e+01  -3.66529e+01 0.00000e+00 0.00000e+00 3.43937e+02 295.385 4.03094e+01 295.385 0.9876 
1 1 1 -3  52  11 o 13 1.66267e+01 5.45370e-01 3.04271e+02 193.335 -4.53309e+01 -1.07448e+01 0.00000e+00 0.00000e+00 3.08763e+02 193.335 4.49218e+00 193.335 0.9892 
1 1 1 -3  52  12 o 15 1.19030e+01 6.08531e-01 2.31997e+02 15.195  2.92901e+01  7.95508e+00  0.00000e+00 0.00000e+00 2.03931e+02 15.195  2.80661e+01 195.195 0.9834 
1 1 1 -3  52  13 o 1  4.84278e+00 9.54379e-01 1.13394e+02 20.877  5.63866e+00  2.15056e+00  0.00000e+00 0.00000e+00 5.11055e+01 20.877  6.22888e+01 200.877 0.9129 
1 1 1 -3  52  14 o 9  1.66748e+01 6.86451e-01 2.78820e+02 156.922 -6.01740e+01 2.56390e+01  0.00000e+00 0.00000e+00 3.36289e+02 156.922 5.74697e+01 156.922 0.9923 
1 1 1 -3  52  15 o 2  4.84168e+00 1.04241e+00 7.10616e+01 314.850 3.55259e+00  -3.57123e+00 0.00000e+00 0.00000e+00 8.97256e+01 314.850 1.86640e+01 314.850 0.8942 
1 1 1 -3  52  16 o 12 4.73189e+00 1.39735e+00 6.14926e+01 226.185 -2.52641e+00 -2.63312e+00 0.00000e+00 0.00000e+00 8.74567e+01 226.185 2.59641e+01 226.185 0.8485 
1 1 1 -3  52  17 o 3  4.88732e+00 1.52337e+00 5.02955e+01 64.357  1.33474e+00  2.78046e+00  0.00000e+00 0.00000e+00 9.74860e+01 64.357  4.71906e+01 64.357  0.8160 
1 1 1 -3  52  18 o 5  4.82303e+00 1.53392e+00 5.42623e+01 122.895 -1.93833e+00 2.99681e+00  0.00000e+00 0.00000e+00 9.65082e+01 122.895 4.22459e+01 122.895 0.8446 
1 1 1 -3  53  1  o 15 2.86440e+01 4.74354e-01 5.35033e+02 5.990   2.61391e+01  2.74258e+00  0.00000e+00 0.00000e+00 5.17058e+02 5.990   1.79748e+01 185.990 0.9808 
1 1 1 -3  53  2  o 9  2.03649e+01 3.95547e-01 3.13193e+02 226.331 -9.24407e+00 -9.68387e+00 0.00000e+00 0.00000e+00 4.20244e+02 226.331 1.07051e+02 226.331 0.9619 
1 1 1 -3  53  3  o 4  4.94487e+01 7.24031e-01 7.75400e+02 108.392 -2.59734e+01 7.81161e+01  0.00000e+00 0.00000e+00 1.06425e+03 108.392 2.88852e+02 108.392 0.9939 
1 1 1 -3  53  4  o 12 5.65429e+00 4.61987e-01 8.44977e+01 156.695 -1.07146e+00 4.61548e-01  0.00000e+00 0.00000e+00 2.17831e+01 156.695 6.27146e+01 336.695 0.5023 
1 1 1 -3  53  5  o 19 3.81480e+01 5.85446e-01 7.60202e+02 240.310 -3.92475e+01 -6.88369e+01 0.00000e+00 0.00000e+00 6.57651e+02 240.310 1.02552e+02 60.310  0.9937 
1 1 1 -3  53  6  o 18 1.62721e+01 3.69337e-01 2.79579e+02 358.071 1.47710e+01  -4.97462e-01 0.00000e+00 0.00000e+00 3.07826e+02 358.071 2.82472e+01 358.071 0.9656 
1 1 1 -3  53  7  o 5  4.32960e+01 6.38645e-01 6.22664e+02 171.674 -9.37770e+01 1.37243e+01  0.00000e+00 0.00000e+00 9.86640e+02 171.674 3.63976e+02 171.674 0.9947 
1 1 1 -3  53  8  o 9  1.62224e+01 3.90949e-01 2.08948e+02 4.717   1.57044e+01  1.29584e+00  0.00000e+00 0.00000e+00 3.77342e+02 4.717   1.68394e+02 4.717   0.9677 
1 1 1 -3  53  9  o 9  3.61071e+01 5.70454e-01 6.77235e+02 170.728 -1.37628e+02 2.24671e+01  0.00000e+00 0.00000e+00 6.65510e+02 170.728 1.17245e+01 350.729 0.9964 
1 1 1 -3  53  10 o 13 1.16614e+01 4.25494e-01 2.50375e+02 238.394 -1.16745e+01 -1.89725e+01 0.00000e+00 0.00000e+00 1.74668e+02 238.394 7.57070e+01 58.395  0.9773 
1 1 1 -3  53  11 o 2  1.41771e+01 5.06096e-01 2.54240e+02 20.166  3.12738e+01  1.14855e+01  0.00000e+00 0.00000e+00 2.66111e+02 20.166  1.18710e+01 20.166  0.9849 
1 1 1 -3  53  12 o 1  4.97909e+00 8.80721e-01 7.32379e+01 15.564  3.44263e+00  9.58850e-01  0.00000e+00 0.00000e+00 8.34029e+01 15.564  1.01650e+01 15.564  0.8449 
1 1 1 -3  53  13 o 8  8.92612e+00 7.55096e-01 1.42117e+02 239.397 -8.34377e+00 -1.41069e+01 0.00000e+00 0.00000e+00 1.79672e+02 239.397 3.75558e+01 239.397 0.9690 
1 1 1 -3  53  14 o 12 1.20961e+01 7.54969e-01 2.06315e+02 147.804 -3.29573e+01 2.07511e+01  0.00000e+00 0.00000e+00 2.37471e+02 147.804 3.11569e+01 147.804 0.9871 
1 1 1 -3  53  15 o 6  1.36698e+01 7.37971e-01 2.28461e+02 161.028 -4.74660e+01 1.63176e+01  0.00000e+00 0.00000e+00 2.74033e+02 161.028 4.55713e+01 161.028 0.9900 
1 1 1 -3  53  16 o 17 5.20610e+00 1.38133e+00 8.65266e+01 248.171 -2.18450e+00 -5.45356e+00 0.00000e+00 0.00000e+00 8.92674e+01 248.171 2.74085e+00 248.171 0.9104 
1 1 1 -3  53  17 o 11 3.50978e+00 1.18060e+00 4.64239e+01 119.967 -1.29210e+00 2.24094e+00  0.00000e+00 0.00000e+00 5.42389e+01 119.967 7.81501e+00 119.967 0.7741 
1 1 1 -3  53  18 o 18 5.34964e+00 1.69263e+00 9.02102e+01 71.936  1.88117e+00  5.76773e+00  0.00000e+00 0.00000e+00 9.06093e+01 71.936  3.99179e-01 71.936  0.9134 
1 1 1 -3  54  1  o 15 1.89020e+01 4.32057e-01 3.62786e+02 57.357  7.75519e+00  1.21065e+01  0.00000e+00 0.00000e+00 3.19903e+02 57.357  4.28838e+01 237.357 0.9646 
1 1 1 -3  54  2  o 12 2.44432e+01 4.35436e-01 3.11206e+02 222.151 -1.23038e+01 -1.11372e+01 0.00000e+00 0.00000e+00 5.75836e+02 222.151 2.64630e+02 222.151 0.9694 
1 1 1 -3  54  3  o 13 8.65027e+00 3.69271e-01 1.07760e+02 313.194 1.41953e+00  -1.51198e+00 0.00000e+00 0.00000e+00 1.21951e+02 313.194 1.41915e+01 313.194 0.7095 
1 1 1 -3  54  4  f 0  3.78292e+01 5.82958e-01 5.35953e+02 285.257 1.42221e+01  -5.21410e+01 0.00000e+00 0.00000e+00 8.66203e+02 285.257 3.30249e+02 285.257 0.9907 
1 1 1 -3  54  5  o 9  6.18058e+00 5.54474e-01 2.28703e+02 91.675  -1.15464e-01 3.94847e+00  0.00000e+00 0.00000e+00 2.95540e+01 271.675 2.58257e+02 271.675 0.8616 
1 1 1 -3  54  6  o 3  2.30434e+01 4.18176e-01 4.11534e+02 197.077 -2.82942e+01 -8.69219e+00 0.00000e+00 0.00000e+00 4.35181e+02 197.077 2.36474e+01 197.077 0.9830 
1 1 1 -3  54  7  o 11 2.93827e+01 4.82817e-01 5.05231e+02 101.699 -1.18305e+01 5.71308e+01  0.00000e+00 0.00000e+00 5.83117e+02 101.699 7.78865e+01 101.699 0.9914 
1 1 1 -3  54  8  o 1  2.53684e+01 4.54501e-01 4.22312e+02 29.706  4.53788e+01  2.58901e+01  0.00000e+00 0.00000e+00 5.15842e+02 29.706  9.35301e+01 29.706  0.9904 
1 1 1 -3  54  9  o 14 9.86424e+00 4.29275e-01 2.19262e+02 94.799  -1.05382e+00 1.25514e+01  0.00000e+00 0.00000e+00 1.33907e+02 94.799  8.53552e+01 274.799 0.9594 
1 1 1 -3  54  10 o 13 6.43374e+00 5.66093e-01 1.19872e+02 306.241 3.33661e+00  -4.55197e+00 0.00000e+00 0.00000e+00 9.75987e+01 306.241 2.22731e+01 126.242 0.9064 
1 1 1 -3  54  11 o 8  1.67252e+01 5.20119e-01 3.26071e+02 52.752  3.03711e+01  3.99424e+01  0.00000e+00 0.00000e+00 2.90898e+02 52.752  3.51737e+01 232.752 0.9900 
1 1 1 -3  54  12 o 15 2.05775e+01 6.44577e-01 3.65948e+02 235.401 -4.73236e+01 -6.86028e+01 0.00000e+00 0.00000e+00 3.95566e+02 235.401 2.96179e+01 235.401 0.9940 
1 1 1 -3  54  13 o 13 1.04352e+01 7.10233e-01 1.66899e+02 333.648 2.09892e+01  -1.03970e+01 0.00000e+00 0.00000e+00 2.12892e+02 333.648 4.59924e+01 333.648 0.9784 
1 1 1 -3  54  14 o 17 1.34434e+01 7.38620e-01 2.92141e+02 131.672 -4.02794e+01 4.52534e+01  0.00000e+00 0.00000e+00 2.03317e+02 131.672 8.88241e+01 311.672 0.9917 
1 1 1 -3  54  15 o 17 7.23741e+00 1.00221e+00 1.31949e+02 28.486  1.27333e+01  6.90966e+00  0.00000e+00 0.00000e+00 1.27299e+02 28.486  4.64971e+00 208.486 0.9648 
1 1 1 -3  54  16 f 0  1.07756e+01 1.24172e+00 1.69240e+02 253.664 -6.83454e+00 -2.33181e+01 0.00000e+00 0.00000e+00 2.22072e+02 253.664 5.28317e+01 253.664 0.9792 
1 1 1 -3  54  17 o 12 7.44114e+00 1.91182e+00 1.52156e+02 49.360  7.28314e+00  8.48551e+00  0.00000e+00 0.00000e+00 1.10866e+02 49.360  4.12903e+01 229.360 0.9542 
1 1 1 -3  54  18 o 4  3.38538e+00 1.19573e+00 8.61692e+01 160.337 -5.13701e+00 1.83552e+00  0.00000e+00 0.00000e+00 2.69359e+01 160.337 5.92333e+01 340.337 0.9030 
1 1 1 -3  55  1  o 1  2.18266e+01 4.14611e-01 4.58426e+02 349.672 2.14570e+01  -3.91015e+00 0.00000e+00 0.00000e+00 3.39766e+02 349.672 1.18660e+02 169.672 0.9768 
1 1 1 -3  55  2  o 17 3.32102e+01 5.31545e-01 6.18749e+02 234.370 -2.65270e+01 -3.70110e+01 0.00000e+00 0.00000e+00 6.10596e+02 234.370 8.15341e+00 54.370  0.9890 
1 1 1 -3  55  3  o 9  8.23938e+00 3.87676e-01 3.19377e+02 285.504 1.70095e+00  -6.13184e+00 0.00000e+00 0.00000e+00 3.64449e+01 105.504 3.55822e+02 105.504 0.9177 
1 1 1 -3  55  4  o 16 1.37259e+01 3.70363e-01 2.89470e+02 311.979 6.97506e+00  -7.75223e+00 0.00000e+00 0.00000e+00 1.98709e+02 311.979 9.07610e+01 131.979 0.9508 
1 1 1 -3  55  5  o 6  3.30508e+01 5.55228e-01 5.68729e+02 188.446 -5.58997e+01 -8.30053e+00 0.00000e+00 0.00000e+00 6.56150e+02 188.446 8.74204e+01 188.446 0.9911 
1 1 1 -3  55  6  o 11 1.10751e+01 3.74478e-01 2.06744e+02 80.365  1.23283e+00  7.26233e+00  0.00000e+00 0.00000e+00 1.77975e+02 80.365  2.87682e+01 260.365 0.9294 
1 1 1 -3  55  7  o 10 1.61792e+01 3.84205e-01 2.83247e+02 70.513  6.63819e+00  1.87597e+01  0.00000e+00 0.00000e+00 3.05763e+02 70.513  2.25163e+01 70.513  0.9745 
1 1 1 -3  55  8  f 0  2.22501e+01 4.32256e-01 4.23215e+02 60.075  2.23434e+01  3.88165e+01  0.00000e+00 0.00000e+00 3.98161e+02 60.075  2.50542e+01 240.074 0.9888 
1 1 1 -3  55  9  o 15 2.27949e+01 4.44580e-01 4.03400e+02 203.711 -5.33273e+01 -2.34207e+01 0.00000e+00 0.00000e+00 4.39765e+02 203.711 3.63652e+01 203.711 0.9914 
1 1 1 -3  55  10 o 5  2.85847e+01 5.80400e-01 4.67775e+02 79.518  2.03384e+01  1.09926e+02  0.00000e+00 0.00000e+00 5.93218e+02 79.518  1.25443e+02 79.518  0.9955 
1 1 1 -3  55  11 o 7  1.51329e+01 5.88672e-01 3.52408e+02 241.423 -2.44415e+01 -4.48713e+01 0.00000e+00 0.00000e+00 2.05845e+02 241.423 1.46564e+02 61.423  0.9902 
1 1 1 -3  55  12 o 16 1.26489e+01 8.35956e-01 2.45538e+02 30.742  2.83783e+01  1.68781e+01  0.00000e+00 0.00000e+00 2.18139e+02 30.742  2.73988e+01 210.742 0.9847 
1 1 1 -3  55  13 o 10 8.31820e+00 9.10229e-01 1.46460e+02 217.669 -1.20467e+01 -9.30043e+00 0.00000e+00 0.00000e+00 1.52573e+02 217.669 6.11284e+00 217.669 0.9666 
1 1 1 -3  55  14 o 19 6.09783e+00 1.01480e+00 1.02947e+02 91.260  -1.85418e-01 8.43323e+00  0.00000e+00 0.00000e+00 1.09745e+02 91.260  6.79775e+00 91.260  0.9387 
1 1 1 -3  55  15 o 13 1.07226e+01 7.51119e-01 2.11160e+02 279.954 6.90960e+00  -3.93692e+01 0.00000e+00 0.00000e+00 1.81853e+02 279.954 2.93073e+01 99.954  0.9874 
1 1 1 -3  55  16 o 6  6.55188e+00 9.62220e-01 9.39964e+01 201.809 -9.47389e+00 -3.79099e+00 0.00000e+00 0.00000e+00 1.36721e+02 201.809 4.27242e+01 201.809 0.9497 
1 1 1 -3  55  17 o 3  5.20938e+00 1.54710e+00 1.00847e+02 88.034  2.29905e-01  6.69795e+00  0.00000e+00 0.00000e+00 7.70595e+01 88.034  2.37879e+01 268.034 0.9220 
1 1 1 -3  55  18 o 15 3.64729e+00 1.27019e+00 8.87877e+01 196.903 -5.55162e+00 -1.68705e+00 0.00000e+00 0.00000e+00 3.38871e+01 196.903 5.49006e+01 16.903  0.9092 
1 1 1 -3  56  1  o 1  4.17928e+01 6.31615e-01 7.38655e+02 18.683  6.43968e+01  2.17762e+01  0.00000e+00 0.00000e+00 8.14211e+02 18.683  7.55551e+01 18.683  0.9926 
1 1 1 -3  56  2  o 15 1.74526e+01 4.08266e-01 1.77286e+02 50.644  4.81000e+00  5.86503e+00  0.00000e+00 0.00000e+00 4.31156e+02 50.644  2.53870e+02 50.644  0.9315 
1 1 1 -3  56  3  o 7  1.20932e+01 3.65951e-01 6.23583e+01 343.041 1.94177e+00  -5.92143e-01 0.00000e+00 0.00000e+00 2.55562e+02 343.041 1.93203e+02 343.041 0.7026 
1 1 1 -3  56  4  o 1  1.69966e+01 4.16807e-01 3.12929e+02 170.326 -1.44178e+01 2.45769e+00  0.00000e+00 0.00000e+00 3.00643e+02 170.326 1.22853e+01 350.326 0.9652 
1 1 1 -3  56  5  o 1  2.62274e+01 4.46932e-01 5.90008e+02 236.165 -2.78979e+01 -4.16190e+01 0.00000e+00 0.00000e+00 3.80723e+02 236.165 2.09285e+02 56.165  0.9900 
1 1 1 -3  56  6  o 18 2.52630e+01 4.40600e-01 5.13750e+02 76.587  1.07800e+01  4.52054e+01  0.00000e+00 0.00000e+00 4.20117e+02 76.587  9.36332e+01 256.587 0.9892 
1 1 1 -3  56  7  o 5  1.46793e+01 3.80964e-01 2.20918e+02 310.341 9.05398e+00  -1.06608e+01 0.00000e+00 0.00000e+00 3.07385e+02 310.341 8.64669e+01 310.341 0.9636 
1 1 1 -3  56  8  o 6  6.45862e+00 5.61217e-01 1.69323e+02 272.605 2.69784e-01  -5.92898e+00 0.00000e+00 0.00000e+00 5.03954e+01 272.605 1.18928e+02 92.605  0.9113 
1 1 1 -3  56  9  f 0  1.83015e+01 4.21426e-01 3.92014e+02 84.853  4.48497e+00  4.97932e+01  0.00000e+00 0.00000e+00 2.83865e+02 84.853  1.08149e+02 264.853 0.9899 
1 1 1 -3  56  10 o 11 2.79943e+01 5.76020e-01 4.47209e+02 344.955 9.52545e+01  -2.56027e+01 0.00000e+00 0.00000e+00 5.91086e+02 344.955 1.43878e+02 344.955 0.9949 
1 1 1 -3  56  11 o 12 2.15350e+01 5.64572e-01 4.40059e+02 268.862 -1.83653e+00 -9.24860e+01 0.00000e+00 0.00000e+00 3.57785e+02 268.862 8.22742e+01 88.862  0.9946 
1 1 1 -3  56  12 o 7  4.47627e+00 1.00278e+00 1.64499e+02 149.216 -6.61146e+00 3.93878e+00  0.00000e+00 0.00000e+00 9.12752e+00 329.216 1.73626e+02 329.216 0.9326 
1 1 1 -3  56  13 o 9  1.00924e+01 7.08120e-01 1.73082e+02 66.126  9.90878e+00  2.23881e+01  0.00000e+00 0.00000e+00 1.94477e+02 66.126  2.13952e+01 66.126  0.9794 
1 1 1 -3  56  14 o 5  5.52120e+00 1.14878e+00 1.42133e+02 282.678 2.16575e+00  -9.62723e+00 0.00000e+00 0.00000e+00 5.23014e+01 282.678 8.98312e+01 102.678 0.9479 
1 1 1 -3  56  15 f 0  7.87182e+00 9.15655e-01 1.86851e+02 171.543 -2.23095e+01 3.31698e+00  0.00000e+00 0.00000e+00 9.87560e+01 171.543 8.80946e+01 351.543 0.9776 
1 1 1 -3  56  16 o 2  4.69666e+00 1.11677e+00 1.49639e+02 98.885  -1.66140e+00 1.06279e+01  0.00000e+00 0.00000e+00 1.61870e+01 98.885  1.33452e+02 278.885 0.9523 
1 1 1 -3  56  17 o 5  4.24913e+00 1.34197e+00 8.38541e+01 348.173 5.11881e+00  -1.07187e+00 0.00000e+00 0.00000e+00 5.75249e+01 348.173 2.63292e+01 168.173 0.8985 
1 1 1 -3  56  18 o 19 3.93428e+00 1.34891e+00 8.70909e+01 28.462  5.00538e+00  2.71343e+00  0.00000e+00 0.00000e+00 4.49465e+01 28.462  4.21443e+01 208.462 0.9073 
1 1 1 -3  57  1  o 12 1.77798e+01 3.88545e-01 2.69327e+02 299.894 5.77306e+00  -1.00420e+01 0.00000e+00 0.00000e+00 3.66707e+02 299.894 9.73804e+01 299.894 0.9558 
1 1 1 -3  57  2  o 9  1.19759e+01 4.43906e-01 1.47534e+02 69.167  1.51103e+00  3.97097e+00  0.00000e+00 0.00000e+00 2.43433e+02 69.167  9.58992e+01 69.167  0.8724 
1 1 1 -3  57  3  o 2  4.30544e+01 6.47262e-01 7.03718e+02 271.346 1.84195e+00  -7.83783e+01 0.00000e+00 0.00000e+00 8.96586e+02 271.346 1.92867e+02 271.346 0.9936 
1 1 1 -3  57  4  o 7  9.72722e+00 4.13462e-01 1.45340e+02 12.289  4.19788e+00  9.14479e-01  0.00000e+00 0.00000e+00 1.72595e+02 12.289  2.72555e+01 12.289  0.8740 
1 1 1 -3  57  5  o 2  7.50372e+00 4.26250e-01 2.05235e+02 310.697 3.13356e+00  -3.64342e+00 0.00000e+00 0.00000e+00 4.40369e+01 310.697 1.61198e+02 130.697 0.8887 
1 1 1 -3  57  6  o 16 1.62834e+01 3.83776e-01 3.05140e+02 2.733   1.72706e+01  8.24315e-01  0.00000e+00 0.00000e+00 2.85414e+02 2.733   1.97264e+01 182.733 0.9706 
1 1 1 -3  57  7  o 2  8.42587e+00 4.51825e-01 1.96170e+02 182.469 -7.65229e+00 -3.29987e-01 0.00000e+00 0.00000e+00 9.71691e+01 182.469 9.90005e+01 2.469   0.9322 
1 1 1 -3  57  8  o 14 1.65405e+01 4.01611e-01 3.09353e+02 142.339 -2.45503e+01 1.89481e+01  0.00000e+00 0.00000e+00 2.97957e+02 142.339 1.13956e+01 322.339 0.9837 
1 1 1 -3  57  9  o 8  5.04247e+00 6.79642e-01 1.57878e+02 66.305  2.21646e+00  5.05037e+00  0.00000e+00 0.00000e+00 1.21672e+01 66.305  1.45711e+02 246.305 0.9041 
1 1 1 -3  57  10 o 5  1.10976e+01 4.95921e-01 2.12910e+02 6.864   2.04050e+01  2.45617e+00  0.00000e+00 0.00000e+00 1.90543e+02 6.864   2.23664e+01 186.864 0.9754 
1 1 1 -3  57  11 o 8  5.78041e+00 7.29596e-01 6.98940e+01 137.205 -3.07395e+00 2.84603e+00  0.00000e+00 0.00000e+00 1.17499e+02 137.205 4.76053e+01 137.205 0.8704 
1 1 1 -3  57  12 o 19 4.91174e+00 8.27420e-01 9.21085e+01 337.152 4.88735e+00  -2.05924e+00 0.00000e+00 0.00000e+00 7.23947e+01 337.152 1.97137e+01 157.152 0.9000 
1 1 1 -3  57  13 o 17 1.11533e+01 7.37563e-01 2.18750e+02 121.740 -1.74912e+01 2.82762e+01  0.00000e+00 0.00000e+00 1.89658e+02 121.740 2.90914e+01 301.740 0.9848 
1 1 1 -3  57  14 o 11 7.70742e+00 8.82173e-01 1.03993e+02 21.350  1.11901e+01  4.37410e+00  0.00000e+00 0.00000e+00 1.70121e+02 21.350  6.61280e+01 21.350  0.9574 
1 1 1 -3  57  15 o 6  8.53314e+00 9.06332e-01 1.49663e+02 171.970 -2.10761e+01 2.97343e+00  0.00000e+00 0.00000e+00 1.59461e+02 171.970 9.79798e+00 171.970 0.9762 
1 1 1 -3  57  16 o 11 9.29031e+00 9.37070e-01 1.27390e+02 213.820 -1.73102e+01 -1.15968e+01 0.00000e+00 0.00000e+00 2.08625e+02 213.820 8.12345e+01 213.820 0.9757 
1 1 1 -3  57  17 o 14 5.79136e+00 1.51763e+00 1.19037e+02 95.737  -8.95006e-01 8.90931e+00  0.00000e+00 0.00000e+00 8.30462e+01 95.737  3.59912e+01 275.737 0.9424 
1 1 1 -3  58  1  o 5  3.18590e+01 5.18438e-01 4.84360e+02 28.880  3.61341e+01  1.99309e+01  0.00000e+00 0.00000e+00 6.93301e+02 28.880  2.08942e+02 28.880  0.9878 
1 1 1 -3  58  2  o 4  1.57482e+01 4.68441e-01 2.89252e+02 14.503  1.15357e+01  2.98390e+00  0.00000e+00 0.00000e+00 2.74642e+02 14.503  1.46103e+01 194.503 0.9571 
1 1 1 -3  58  3  o 9  1.36472e+01 4.24564e-01 2.93273e+02 14.753  1.09072e+01  2.87228e+00  0.00000e+00 0.00000e+00 1.93987e+02 14.753  9.92865e+01 194.753 0.9546 
1 1 1 -3  58  4  o 5  3.89397e+01 6.01766e-01 5.44367e+02 46.757  4.14173e+01  4.40391e+01  0.00000e+00 0.00000e+00 8.99507e+02 46.757  3.55140e+02 46.757  0.9917 
1 1 1 -3  58  5  f 0  2.32472e+01 4.24428e-01 2.91498e+02 228.364 -1.44467e+01 -1.62514e+01 0.00000e+00 0.00000e+00 5.57156e+02 228.364 2.65658e+02 228.364 0.9767 
1 1 1 -3  58  6  o 12 2.14981e+01 4.15151e-01 3.66310e+02 321.242 2.41843e+01  -1.94155e+01 0.00000e+00 0.00000e+00 4.23769e+02 321.242 5.74592e+01 321.242 0.9837 
1 1 1 -3  58  7  o 16 2.35540e+01 4.34894e-01 3.96781e+02 63.194  2.05972e+01  4.07651e+01  0.00000e+00 0.00000e+00 4.73022e+02 63.194  7.62414e+01 63.194  0.9890 
1 1 1 -3  58  8  o 10 2.18443e+01 4.58793e-01 2.94708e+02 188.673 -3.66811e+01 -5.59552e+00 0.00000e+00 0.00000e+00 5.09405e+02 188.673 2.14697e+02 188.673 0.9864 
1 1 1 -3  58  9  o 2  1.31586e+01 4.74582e-01 2.26966e+02 5.413   2.25687e+01  2.13852e+00  0.00000e+00 0.00000e+00 2.52815e+02 5.413   2.58489e+01 5.413   0.9777 
1 1 1 -3  58  10 o 10 1.49454e+01 4.88657e-01 2.81171e+02 274.895 3.33403e+00  -3.89310e+01 0.00000e+00 0.00000e+00 2.68632e+02 274.895 1.25390e+01 94.895  0.9871 
1 1 1 -3  58  11 o 16 4.36743e+00 8.14015e-01 3.24479e+01 197.812 -1.33933e+00 -4.30328e-01 0.00000e+00 0.00000e+00 6.06182e+01 197.812 2.81702e+01 197.812 0.5722 
1 1 1 -3  58  12 o 19 3.16930e+00 7.68756e-01 1.13687e+02 211.134 -3.84294e+00 -2.32132e+00 0.00000e+00 0.00000e+00 9.91123e+00 31.134  1.23599e+02 31.134  0.8800 
1 1 1 -3  58  13 o 3  1.10201e+01 7.40637e-01 2.47194e+02 40.195  2.99363e+01  2.52937e+01  0.00000e+00 0.00000e+00 1.57221e+02 40.195  8.99733e+01 220.195 0.9872 
1 1 1 -3  58  14 o 7  1.01104e+01 8.35136e-01 2.14824e+02 196.966 -2.97198e+01 -9.06672e+00 0.00000e+00 0.00000e+00 1.54587e+02 196.966 6.02362e+01 16.966  0.9838 
1 1 1 -3  58  15 o 16 4.85767e+00 1.08095e+00 7.54884e+01 266.960 -2.88932e-01 -5.44046e+00 0.00000e+00 0.00000e+00 8.72325e+01 266.960 1.17441e+01 266.960 0.9028 
1 1 1 -3  58  16 o 7  5.84858e+00 1.14134e+00 7.74511e+01 301.736 3.73060e+00  -6.03197e+00 0.00000e+00 0.00000e+00 1.23395e+02 301.736 4.59439e+01 301.736 0.9266 
1 1 1 -3  58  17 o 9  4.42859e+00 1.35654e+00 1.04155e+02 144.643 -5.72041e+00 4.05888e+00  0.00000e+00 0.00000e+00 4.76146e+01 144.643 5.65401e+01 324.643 0.9257 
1 1 1 -3  59  1  o 16 2.58107e+01 4.57424e-01 6.53263e+02 307.198 2.66484e+01  -3.51108e+01 0.00000e+00 0.00000e+00 3.01426e+02 307.198 3.51837e+02 127.198 0.9886 
1 1 1 -3  59  2  o 1  1.74302e+01 4.44774e-01 3.76346e+02 290.193 6.22213e+00  -1.69175e+01 0.00000e+00 0.00000e+00 2.57312e+02 290.193 1.19033e+02 110.193 0.9719 
1 1 1 -3  59  3  o 16 1.51741e+01 3.81259e-01 1.90346e+02 214.870 -7.20211e+00 -5.01865e+00 0.00000e+00 0.00000e+00 3.43744e+02 214.870 1.53398e+02 214.870 0.9412 
1 1 1 -3  59  4  f 0  1.13112e+01 3.94979e-01 1.18214e+02 274.939 3.72204e-01  -4.30715e+00 0.00000e+00 0.00000e+00 2.51743e+02 274.939 1.33528e+02 274.939 0.8749 
1 1 1 -3  59  5  o 16 1.18205e+01 3.79372e-01 1.57519e+02 321.282 5.21658e+00  -4.18193e+00 0.00000e+00 0.00000e+00 2.49686e+02 321.282 9.21673e+01 321.282 0.9218 
1 1 1 -3  59  6  o 5  1.85390e+01 3.98372e-01 2.97853e+02 296.841 1.07726e+01  -2.12882e+01 0.00000e+00 0.00000e+00 3.79951e+02 296.841 8.20975e+01 296.841 0.9788 
1 1 1 -3  59  7  o 3  2.89066e+01 4.89560e-01 5.72628e+02 102.386 -1.68141e+01 7.65638e+01  0.00000e+00 0.00000e+00 4.99636e+02 102.386 7.29926e+01 282.386 0.9936 
1 1 1 -3  59  8  o 1  3.09481e+00 7.65876e-01 1.11412e+02 345.143 1.98012e+00  -5.25263e-01 0.00000e+00 0.00000e+00 2.99351e+01 165.143 1.41347e+02 165.143 0.7056 
1 1 1 -3  59  9  o 4  9.92489e+00 4.92964e-01 1.95772e+02 12.249  1.40592e+01  3.05230e+00  0.00000e+00 0.00000e+00 1.61200e+02 12.249  3.45715e+01 192.249 0.9646 
1 1 1 -3  59  10 o 2  9.55432e+00 5.29998e-01 1.67585e+02 80.639  2.39540e+00  1.45301e+01  0.00000e+00 0.00000e+00 1.76114e+02 80.639  8.52966e+00 80.639  0.9654 
1 1 1 -3  59  11 o 19 1.10376e+01 5.28548e-01 1.61865e+02 348.592 1.88956e+01  -3.81258e+00 0.00000e+00 0.00000e+00 2.38292e+02 348.592 7.64273e+01 348.592 0.9737 
1 1 1 -3  59  12 f 0  1.87228e+01 5.76115e-01 3.16346e+02 64.278  3.20395e+01  6.65080e+01  0.00000e+00 0.00000e+00 3.75452e+02 64.278  5.91060e+01 64.278  0.9932 
1 1 1 -3  59  13 f 0  8.32662e+00 7.37765e-01 1.33112e+02 4.552   1.55167e+01  1.23540e+00  0.00000e+00 0.00000e+00 1.66271e+02 4.552   3.31594e+01 4.552   0.9673 
1 1 1 -3  59  14 f 0  1.82415e+01 7.84751e-01 3.45073e+02 257.237 -2.28610e+01 -1.00923e+02 0.00000e+00 0.00000e+00 3.29030e+02 257.237 1.60430e+01 77.237  0.9952 
1 1 1 -3  59  15 o 9  1.12514e+01 8.46412e-01 1.75426e+02 128.429 -2.12510e+01 2.67846e+01  0.00000e+00 0.00000e+00 2.35816e+02 128.429 6.03903e+01 128.429 0.9853 
1 1 1 -3  59  16 f 0  6.22199e+00 1.20226e+00 6.31192e+01 169.638 -5.99054e+00 1.09537e+00  0.00000e+00 0.00000e+00 1.47561e+02 169.638 8.44416e+01 169.638 0.9137 
1 1 1 -3  59  17 o 15 4.85078e+00 1.30443e+00 1.08030e+02 57.156  4.71396e+00  7.30235e+00  0.00000e+00 0.00000e+00 6.08550e+01 57.156  4.71755e+01 237.156 0.9406 
1 1 1 -3  60  1  o 2  2.01899e+01 4.12873e-01 4.98640e+02 166.417 -2.75850e+01 6.66480e+00  0.00000e+00 0.00000e+00 2.43213e+02 166.417 2.55428e+02 346.417 0.9822 
1 1 1 -3  60  2  o 11 1.15715e+01 4.50588e-01 2.01952e+02 146.198 -5.89251e+00 3.94499e+00  0.00000e+00 0.00000e+00 1.99039e+02 146.198 2.91301e+00 326.198 0.9265 
1 1 1 -3  60  3  o 17 2.07260e+01 4.16669e-01 2.63379e+02 251.417 -5.00378e+00 -1.48829e+01 0.00000e+00 0.00000e+00 4.86483e+02 251.417 2.23104e+02 251.417 0.9676 
1 1 1 -3  60  4  o 4  1.33093e+01 4.16757e-01 1.12084e+02 187.235 -4.76122e+00 -6.04435e-01 0.00000e+00 0.00000e+00 3.29931e+02 187.235 2.17847e+02 187.235 0.8885 
1 1 1 -3  60  5  o 3  1.85023e+01 3.93220e-01 4.42821e+02 46.099  1.97470e+01  2.05192e+01  0.00000e+00 0.00000e+00 2.36239e+02 46.099  2.06582e+02 226.099 0.9823 
1 1 1 -3  60  6  o 18 4.23166e+01 6.31579e-01 6.48324e+02 196.659 -1.14411e+02 -3.42353e+01 0.00000e+00 0.00000e+00 9.25412e+02 196.659 2.77087e+02 196.659 0.9958 
1 1 1 -3  60  7  o 7  1.74824e+01 4.61368e-01 2.57651e+02 57.381  1.33135e+01  2.08030e+01  0.00000e+00 0.00000e+00 3.81562e+02 57.381  1.23911e+02 57.381  0.9795 
1 1 1 -3  60  8  o 2  3.98578e+00 7.21598e-01 6.91029e+01 109.652 -5.63883e-01 1.57901e+00  0.00000e+00 0.00000e+00 2.55940e+01 109.652 4.35089e+01 289.652 0.6369 
1 1 1 -3  60  9  o 4  8.24602e+00 5.30239e-01 2.61992e+02 211.792 -1.42583e+01 -8.83765e+00 0.00000e+00 0.00000e+00 3.61224e+01 211.792 2.25870e+02 31.792  0.9697 
1 1 1 -3  60  10 o 19 3.53531e+00 7.55087e-01 4.24218e+01 107.845 -4.01806e-01 1.24813e+00  0.00000e+00 0.00000e+00 2.94760e+01 107.845 1.29458e+01 287.845 0.5459 
1 1 1 -3  60  11 o 18 1.18231e+01 5.46394e-01 1.95240e+02 312.671 1.77591e+01  -1.92650e+01 0.00000e+00 0.00000e+00 2.36414e+02 312.671 4.11739e+01 312.671 0.9807 
1 1 1 -3  60  12 o 19 8.74907e+00 6.13785e-01 1.67805e+02 151.282 -1.67120e+01 9.15627e+00  0.00000e+00 0.00000e+00 1.48970e+02 151.282 1.88347e+01 331.282 0.9734 
1 1 1 -3  60  13 o 11 3.39941e+00 8.98252e-01 4.95950e+01 109.857 -8.36720e-01 2.31689e+00  0.00000e+00 0.00000e+00 4.65384e+01 109.857 3.05663e+00 289.857 0.7609 
1 1 1 -3  60  14 o 11 6.22135e+00 1.07290e+00 1.37925e+02 157.683 -1.14232e+01 4.68891e+00  0.00000e+00 0.00000e+00 8.35025e+01 157.683 5.44225e+01 337.683 0.9586 
1 1 1 -3  60  15 o 1  5.30549e+00 1.05650e+00 1.37863e+02 176.361 -1.04850e+01 6.66729e-01  0.00000e+00 0.00000e+00 4.93092e+01 176.361 8.85536e+01 356.361 0.9511 
1 1 1 -3  60  16 o 6  1.13788e+01 9.06335e-01 1.82457e+02 3.515   3.99537e+01  2.45389e+00  0.00000e+00 0.00000e+00 2.33843e+02 3.515   5.13859e+01 3.515   0.9874 
1 1 1 -3  60  17 o 9  4.42369e+00 1.36105e+00 4.83139e+01 138.506 -2.58158e+00 2.28347e+00  0.00000e+00 0.00000e+00 8.89252e+01 138.506 4.06113e+01 138.506 0.8383 
1 1 1 -3  61  1  o 10 2.01234e+01 4.15963e-01 2.74959e+02 299.824 8.34528e+00  -1.45574e+01 0.00000e+00 0.00000e+00 4.54924e+02 299.824 1.79964e+02 299.824 0.9697 
1 1 1 -3  61  2  o 16 2.91325e+01 5.51211e-01 6.27594e+02 155.391 -4.75538e+01 2.17813e+01  0.00000e+00 0.00000e+00 4.51343e+02 155.391 1.76251e+02 335.391 0.9904 
1 1 1 -3  61  3  o 15 2.96554e+01 5.00514e-01 4.91877e+02 351.560 4.48696e+01  -6.65809e+00 0.00000e+00 0.00000e+00 6.04486e+02 351.560 1.12609e+02 351.560 0.9889 
1 1 1 -3  61  4  o 17 3.07923e+01 6.08406e-01 5.98990e+02 167.428 -5.88552e+01 1.31251e+01  0.00000e+00 0.00000e+00 5.42195e+02 167.428 5.67954e+01 347.428 0.9917 
1 1 1 -3  61  5  o 2  1.92009e+01 4.01294e-01 2.24122e+02 92.243  -6.63244e-01 1.69312e+01  0.00000e+00 0.00000e+00 4.71669e+02 92.243  2.47547e+02 92.243  0.9700 
1 1 1 -3  61  6  o 18 1.87274e+01 4.03807e-01 4.22251e+02 312.944 2.49501e+01  -2.68084e+01 0.00000e+00 0.00000e+00 2.67420e+02 312.944 1.54831e+02 132.944 0.9863 
1 1 1 -3  61  7  o 16 1.43046e+01 4.49136e-01 1.86010e+02 52.558  9.75476e+00  1.27394e+01  0.00000e+00 0.00000e+00 3.30936e+02 52.558  1.44926e+02 52.558  0.9683 
1 1 1 -3  61  8  o 19 7.95002e+00 5.18388e-01 1.84321e+02 282.565 2.26976e+00  -1.01833e+01 0.00000e+00 0.00000e+00 9.76182e+01 282.565 8.67024e+01 102.565 0.9508 
1 1 1 -3  61  9  o 6  1.42816e+01 4.77307e-01 2.96490e+02 298.556 1.61961e+01  -2.97606e+01 0.00000e+00 0.00000e+00 2.27945e+02 298.556 6.85452e+01 118.556 0.9851 
1 1 1 -3  61  10 o 12 1.13948e+01 4.92431e-01 2.83262e+02 136.300 -2.30725e+01 2.20486e+01  0.00000e+00 0.00000e+00 1.34482e+02 136.300 1.48780e+02 316.300 0.9842 
1 1 1 -3  61  11 o 15 6.50465e+00 6.81964e-01 1.49976e+02 338.305 1.01089e+01  -4.02175e+00 0.00000e+00 0.00000e+00 8.07220e+01 338.305 6.92539e+01 158.305 0.9529 
1 1 1 -3  61  12 o 16 2.23427e+00 6.94291e-01 6.78218e+01 154.366 -1.84622e+00 8.85893e-01  0.00000e+00 0.00000e+00 9.20307e+00 334.366 7.70249e+01 334.366 0.7055 
1 1 1 -3  61  13 o 8  5.93112e+00 8.94345e-01 1.50292e+02 175.730 -1.26985e+01 9.48177e-01  0.00000e+00 0.00000e+00 6.12531e+01 175.730 8.90391e+01 355.730 0.9599 
1 1 1 -3  61  14 o 3  2.95800e+00 9.23424e-01 4.51002e+01 263.512 -2.21816e-01 -1.95051e+00 0.00000e+00 0.00000e+00 3.08444e+01 263.512 1.42558e+01 83.512  0.6916 
1 1 1 -3  61  15 o 16 1.14167e+01 8.95729e-01 2.27020e+02 32.323  3.69687e+01  2.33915e+01  0.00000e+00 0.00000e+00 1.91498e+02 32.323  3.55222e+01 212.323 0.9885 
1 1 1 -3  61  16 f 0  3.43148e+00 1.05576e+00 8.87876e+01 231.938 -3.42310e+00 -4.37161e+00 0.00000e+00 0.00000e+00 2.62290e+01 231.938 6.25586e+01 51.938  0.9048 
1 1 1 -3  61  17 o 19 4.50663e+00 1.19679e+00 8.67215e+01 220.224 -5.68501e+00 -4.80836e+00 0.00000e+00 0.00000e+00 6.83986e+01 220.224 1.83229e+01 40.224  0.9302 
1 1 1 -3  62  1  o 12 1.38000e+01 3.92243e-01 3.03943e+02 147.607 -1.15030e+01 7.29809e+00  0.00000e+00 0.00000e+00 1.92810e+02 147.607 1.11133e+02 327.607 0.9626 
1 1 1 -3  62  2  o 3  1.26252e+01 3.94133e-01 1.15987e+02 201.398 -4.26878e+00 -1.67274e+00 0.00000e+00 0.00000e+00 3.00714e+02 201.398 1.84727e+02 201.398 0.8828 
1 1 1 -3  62  3  o 3  2.79333e+00 7.01384e-01 2.08848e+02 224.745 -1.30534e+00 -1.29376e+00 0.00000e+00 0.00000e+00 1.38970e+02 44.745  3.47818e+02 44.745  0.6693 
1 1 1 -3  62  4  f 0  2.02856e+01 5.15398e-01 4.92285e+02 202.681 -3.18382e+01 -1.33056e+01 0.00000e+00 0.00000e+00 2.54635e+02 202.681 2.37650e+02 22.681  0.9854 
1 1 1 -3  62  5  o 4  2.66468e+01 4.62178e-01 4.52529e+02 8.021   5.12895e+01  7.22737e+00  0.00000e+00 0.00000e+00 5.33098e+02 8.021   8.05692e+01 8.021   0.9903 
1 1 1 -3  62  6  o 17 1.20228e+01 4.40911e-01 1.87471e+02 21.184  1.00134e+01  3.88071e+00  0.00000e+00 0.00000e+00 2.39949e+02 21.184  5.24782e+01 21.184  0.9522 
1 1 1 -3  62  7  o 3  8.58982e+00 4.84512e-01 1.75066e+02 46.053  6.05807e+00  6.28493e+00  0.00000e+00 0.00000e+00 1.26499e+02 46.053  4.85668e+01 226.053 0.9408 
1 1 1 -3  62  8  o 11 2.95553e+01 5.82585e-01 5.17432e+02 228.761 -7.48509e+01 -8.53837e+01 0.00000e+00 0.00000e+00 5.79906e+02 228.761 6.24736e+01 228.761 0.9956 
1 1 1 -3  62  9  o 18 1.28545e+01 4.69337e-01 2.79416e+02 143.357 -2.51643e+01 1.87182e+01  0.00000e+00 0.00000e+00 1.91959e+02 143.357 8.74576e+01 323.357 0.9839 
1 1 1 -3  62  10 o 1  1.00348e+01 5.08304e-01 1.91113e+02 320.121 1.44945e+01  -1.21104e+01 0.00000e+00 0.00000e+00 1.72580e+02 320.121 1.85337e+01 140.121 0.9732 
1 1 1 -3  62  11 o 12 6.43282e+00 6.95778e-01 1.20320e+02 147.351 -7.58110e+00 4.85753e+00  0.00000e+00 0.00000e+00 1.05360e+02 147.351 1.49601e+01 327.351 0.9427 
1 1 1 -3  62  12 o 3  9.44903e+00 5.65597e-01 1.45665e+02 24.332  1.77493e+01  8.02624e+00  0.00000e+00 0.00000e+00 1.96545e+02 24.332  5.08805e+01 24.332  0.9740 
1 1 1 -3  62  13 o 2  9.16139e+00 8.28895e-01 2.30056e+02 345.438 2.99869e+01  -7.78995e+00 0.00000e+00 0.00000e+00 1.04759e+02 345.438 1.25297e+02 165.438 0.9837 
1 1 1 -3  62  14 o 15 3.78392e+00 1.07589e+00 2.29880e+01 133.950 -8.75777e-01 9.08489e-01  0.00000e+00 0.00000e+00 5.16618e+01 133.950 2.86739e+01 133.950 0.5315 
1 1 1 -3  62  15 o 4  7.49323e+00 1.09920e+00 1.49887e+02 100.068 -3.07821e+00 1.73373e+01  0.00000e+00 0.00000e+00 1.19942e+02 100.068 2.99444e+01 280.068 0.9712 
1 1 1 -3  62  16 o 7  4.75480e+00 1.25302e+00 9.72973e+01 252.249 -2.12882e+00 -6.64987e+00 0.00000e+00 0.00000e+00 6.56656e+01 252.249 3.16317e+01 72.249  0.9253 
1 1 1 -3  62  17 o 8  4.64378e+00 1.17685e+00 2.80493e+01 101.514 -4.68768e-01 2.30117e+00  0.00000e+00 0.00000e+00 1.00368e+02 101.514 7.23187e+01 101.514 0.7475 
1 1 1 -3  63  1  o 10 1.71389e+01 4.02949e-01 3.17593e+02 88.032  5.83742e-01  1.69886e+01  0.00000e+00 0.00000e+00 3.04084e+02 88.032  1.35095e+01 268.032 0.9701 
1 1 1 -3  63  2  o 2  2.72941e+01 4.82498e-01 4.08719e+02 80.344  5.99416e+00  3.52296e+01  0.00000e+00 0.00000e+00 5.97208e+02 80.344  1.88489e+02 80.344  0.9859 
1 1 1 -3  63  3  o 12 2.85745e+01 4.92539e-01 4.05854e+02 196.671 -3.96172e+01 -1.18641e+01 0.00000e+00 0.00000e+00 6.49035e+02 196.671 2.43180e+02 196.671 0.9878 
1 1 1 -3  63  4  o 2  9.69572e+00 5.16031e-01 1.67419e+02 48.783  4.18413e+00  4.77655e+00  0.00000e+00 0.00000e+00 1.64913e+02 48.783  2.50588e+00 228.783 0.9175 
1 1 1 -3  63  5  o 17 2.14589e+01 4.21136e-01 3.23213e+02 41.679  2.29275e+01  2.04126e+01  0.00000e+00 0.00000e+00 4.64995e+02 41.679  1.41782e+02 41.679  0.9836 
1 1 1 -3  63  6  o 8  1.64536e+01 4.51542e-01 3.45827e+02 236.413 -1.60437e+01 -2.41599e+01 0.00000e+00 0.00000e+00 2.57661e+02 236.413 8.81665e+01 56.413  0.9826 
1 1 1 -3  63  7  f 0  1.81934e+01 4.69805e-01 2.61547e+02 55.083  1.68450e+01  2.41313e+01  0.00000e+00 0.00000e+00 4.05580e+02 55.083  1.44033e+02 55.083  0.9829 
1 1 1 -3  63  8  o 19 1.30340e+01 4.69974e-01 1.65214e+02 277.522 2.09736e+00  -1.58839e+01 0.00000e+00 0.00000e+00 3.05358e+02 277.522 1.40144e+02 277.522 0.9683 
1 1 1 -3  63  9  o 11 1.13584e+01 4.84048e-01 2.71719e+02 133.518 -1.97602e+01 2.08098e+01  0.00000e+00 0.00000e+00 1.44082e+02 133.518 1.27637e+02 313.518 0.9824 
1 1 1 -3  63  10 o 5  9.76317e+00 5.20734e-01 1.92898e+02 10.903  1.98199e+01  3.81765e+00  0.00000e+00 0.00000e+00 1.61524e+02 10.903  3.13743e+01 190.903 0.9749 
1 1 1 -3  63  11 o 10 1.36254e+01 5.24714e-01 1.91066e+02 113.073 -1.31297e+01 3.08221e+01  0.00000e+00 0.00000e+00 3.08283e+02 113.073 1.17218e+02 113.073 0.9850 
1 1 1 -3  63  12 o 4  9.87315e+00 5.83305e-01 1.33632e+02 51.294  1.14258e+01  1.42588e+01  0.00000e+00 0.00000e+00 2.23237e+02 51.294  8.96050e+01 51.294  0.9722 
1 1 1 -3  63  13 o 1  1.00975e+01 7.41927e-01 1.15096e+02 64.827  7.57880e+00  1.61251e+01  0.00000e+00 0.00000e+00 2.49290e+02 64.827  1.34194e+02 64.827  0.9715 
1 1 1 -3  63  14 o 7  3.94145e+00 1.05551e+00 4.66306e+01 231.269 -1.71881e+00 -2.14302e+00 0.00000e+00 0.00000e+00 6.88318e+01 231.269 2.22012e+01 231.269 0.7894 
1 1 1 -3  63  15 o 10 3.53490e+00 1.07648e+00 1.05322e+02 78.915  1.10743e+00  5.65243e+00  0.00000e+00 0.00000e+00 1.37285e+01 78.915  9.15931e+01 258.915 0.9085 
1 1 1 -3  63  16 o 5  5.02085e+00 1.29126e+00 8.36511e+01 249.491 -2.28304e+00 -6.10331e+00 0.00000e+00 0.00000e+00 8.73532e+01 249.491 3.70208e+00 249.491 0.9197 
1 1 1 -3  63  17 o 17 3.41054e+00 1.09567e+00 4.02025e+01 110.236 -9.64133e-01 2.61542e+00  0.00000e+00 0.00000e+00 5.98357e+01 110.236 1.96332e+01 110.236 0.7930 
1 1 1 -3  64  1  o 13 1.03191e+01 4.15162e-01 2.09743e+02 299.882 3.58097e+00  -6.23202e+00 0.00000e+00 0.00000e+00 1.48078e+02 299.882 6.16649e+01 119.882 0.9276 
1 1 1 -3  64  2  o 9  1.11181e+01 4.14665e-01 1.37978e+02 254.495 -1.35581e+00 -4.88737e+00 0.00000e+00 0.00000e+00 2.33943e+02 254.495 9.59650e+01 254.495 0.8950 
1 1 1 -3  64  3  o 15 3.46649e+01 5.60211e-01 5.60678e+02 129.436 -4.24480e+01 5.16100e+01  0.00000e+00 0.00000e+00 7.24856e+02 129.436 1.64178e+02 129.436 0.9925 
1 1 1 -3  64  4  o 2  1.40141e+01 4.17473e-01 3.07362e+02 277.245 2.34329e+00  -1.84331e+01 0.00000e+00 0.00000e+00 2.01817e+02 277.245 1.05545e+02 97.245  0.9727 
1 1 1 -3  64  5  o 8  1.99297e+01 4.73006e-01 3.16331e+02 120.561 -1.56175e+01 2.64489e+01  0.00000e+00 0.00000e+00 4.15587e+02 120.561 9.92563e+01 120.561 0.9836 
1 1 1 -3  64  6  o 11 1.47124e+01 4.50531e-01 3.06628e+02 354.698 2.71143e+01  -2.51635e+00 0.00000e+00 0.00000e+00 2.32271e+02 354.698 7.43569e+01 174.698 0.9815 
1 1 1 -3  64  7  o 13 1.41819e+01 4.57711e-01 2.93789e+02 240.089 -1.44359e+01 -2.50935e+01 0.00000e+00 0.00000e+00 2.25999e+02 240.089 6.77903e+01 60.089  0.9826 
1 1 1 -3  64  8  o 11 1.65772e+01 4.58533e-01 3.74994e+02 196.237 -4.68751e+01 -1.36517e+01 0.00000e+00 0.00000e+00 2.36642e+02 196.237 1.38352e+02 16.237  0.9897 
1 1 1 -3  64  9  o 15 3.61370e+00 7.50253e-01 1.49542e+02 264.134 -4.84138e-01 -4.71216e+00 0.00000e+00 0.00000e+00 3.01364e+01 84.134  1.79679e+02 84.134  0.8869 
1 1 1 -3  64  10 o 18 4.90639e+00 7.44871e-01 1.13372e+02 216.856 -4.70990e+00 -3.53070e+00 0.00000e+00 0.00000e+00 5.29540e+01 216.856 6.04184e+01 36.857  0.9106 
1 1 1 -3  64  11 o 11 5.63677e+00 7.06833e-01 1.18258e+02 291.118 3.05609e+00  -7.91254e+00 0.00000e+00 0.00000e+00 7.86599e+01 291.118 3.95978e+01 111.118 0.9391 
1 1 1 -3  64  12 o 18 9.22902e+00 5.89801e-01 1.65083e+02 83.427  2.49594e+00  2.16617e+01  0.00000e+00 0.00000e+00 1.70008e+02 83.427  4.92518e+00 83.427  0.9768 
1 1 1 -3  64  13 o 11 1.20038e+01 7.58400e-01 1.74779e+02 334.436 3.00637e+01  -1.43808e+01 0.00000e+00 0.00000e+00 2.64281e+02 334.436 8.95023e+01 334.436 0.9849 
1 1 1 -3  64  14 f 0  7.09180e+00 1.02250e+00 9.11910e+01 103.692 -2.38913e+00 9.80633e+00  0.00000e+00 0.00000e+00 1.58540e+02 103.692 6.73490e+01 103.692 0.9491 
1 1 1 -3  64  15 o 3  3.09947e+00 9.86505e-01 7.99105e+01 261.359 -6.17669e-01 -4.06448e+00 0.00000e+00 0.00000e+00 1.97701e+01 261.359 6.01404e+01 81.359  0.8677 
1 1 1 -3  64  16 o 4  5.49326e+00 1.34036e+00 7.74720e+01 97.441  -8.22318e-01 6.29630e+00  0.00000e+00 0.00000e+00 1.09136e+02 97.441  3.16644e+01 97.441  0.9175 
1 1 1 -3  64  17 f 0  3.67328e+00 1.11324e+00 6.25090e+01 43.129  3.42931e+00  3.21237e+00  0.00000e+00 0.00000e+00 5.78434e+01 43.129  4.66559e+00 223.129 0.8859 
1 1 1 -3  65  1  o 19 1.16372e+01 4.07381e-01 2.65308e+02 298.902 5.34051e+00  -9.67355e+00 0.00000e+00 0.00000e+00 1.49479e+02 298.902 1.15830e+02 118.902 0.9536 
1 1 1 -3  65  2  o 4  2.89562e+01 5.01165e-01 4.22424e+02 61.983  1.98504e+01  3.73072e+01  0.00000e+00 0.00000e+00 6.46758e+02 61.983  2.24333e+02 61.983  0.9881 
1 1 1 -3  65  3  o 5  1.67515e+01 4.08571e-01 2.31543e+02 7.984   1.66690e+01  2.33787e+00  0.00000e+00 0.00000e+00 3.75387e+02 7.984   1.43844e+02 7.984   0.9698 
1 1 1 -3  65  4  o 18 1.77201e+01 4.93702e-01 1.40420e+02 111.685 -4.05020e+00 1.01857e+01  0.00000e+00 0.00000e+00 4.90408e+02 111.685 3.49988e+02 111.685 0.9532 
1 1 1 -3  65  5  o 16 1.65558e+01 5.01399e-01 2.59318e+02 38.864  1.58059e+01  1.27372e+01  0.00000e+00 0.00000e+00 3.43312e+02 38.864  8.39948e+01 38.864  0.9750 
1 1 1 -3  65  6  o 2  6.32587e+00 5.65282e-01 2.78338e+02 269.058 -1.64963e-01 -1.00293e+01 0.00000e+00 0.00000e+00 5.43876e+01 89.058  3.32726e+02 89.058  0.9488 
1 1 1 -3  65  7  o 2  9.44471e+00 4.78603e-01 1.11516e+02 119.743 -3.73381e+00 6.53457e+00  0.00000e+00 0.00000e+00 2.16411e+02 119.743 1.04895e+02 119.743 0.9310 
1 1 1 -3  65  8  o 3  2.54388e+00 7.13305e-01 6.37856e+01 339.848 1.17093e+00  -4.29717e-01 0.00000e+00 0.00000e+00 1.37982e+01 159.848 7.75837e+01 159.848 0.5272 
1 1 1 -3  65  9  o 2  5.52222e+00 6.61368e-01 1.17494e+02 202.729 -5.64974e+00 -2.36676e+00 0.00000e+00 0.00000e+00 7.05710e+01 202.729 4.69226e+01 22.729  0.9143 
1 1 1 -3  65  10 o 9  5.29539e+00 7.39097e-01 1.46418e+02 236.489 -4.62058e+00 -6.97810e+00 0.00000e+00 0.00000e+00 3.85137e+01 236.489 1.07904e+02 56.489  0.9382 
1 1 1 -3  65  11 o 12 9.74587e+00 5.12491e-01 1.97048e+02 95.709  -2.41799e+00 2.41848e+01  0.00000e+00 0.00000e+00 1.57913e+02 95.709  3.91348e+01 275.709 0.9792 
1 1 1 -3  65  12 o 13 5.05185e+00 8.07858e-01 1.02795e+02 352.610 7.03781e+00  -9.12820e-01 0.00000e+00 0.00000e+00 7.11727e+01 352.610 3.16222e+01 172.610 0.9266 
1 1 1 -3  65  13 o 12 1.18186e+01 6.23065e-01 2.00439e+02 55.188  2.10656e+01  3.02960e+01  0.00000e+00 0.00000e+00 2.32416e+02 55.188  3.19772e+01 55.188  0.9864 
1 1 1 -3  65  14 o 2  8.39717e+00 9.50224e-01 1.37094e+02 233.648 -1.15736e+01 -1.57258e+01 0.00000e+00 0.00000e+00 1.66326e+02 233.648 2.92315e+01 233.648 0.9740 
1 1 1 -3  65  15 o 16 5.35644e+00 1.27826e+00 1.33563e+02 119.059 -4.90665e+00 8.83023e+00  0.00000e+00 0.00000e+00 5.48444e+01 119.059 7.87188e+01 299.059 0.9491 
1 1 1 -3  65  16 o 1  4.32238e+00 1.20659e+00 5.62566e+01 88.022  1.35760e-01  3.93140e+00  0.00000e+00 0.00000e+00 8.15022e+01 88.022  2.52456e+01 88.022  0.8609 
1 1 1 -3  65  17 o 2  5.15936e+00 1.21900e+00 1.12741e+02 233.250 -6.44480e+00 -8.63058e+00 0.00000e+00 0.00000e+00 6.89562e+01 233.250 4.37851e+01 53.250  0.9524 
1 1 1 -3  66  1  o 7  1.11454e+01 4.11410e-01 2.02803e+02 326.250 7.42400e+00  -4.96060e+00 0.00000e+00 0.00000e+00 1.89635e+02 326.250 1.31682e+01 146.250 0.9422 
1 1 1 -3  66  2  o 10 1.21336e+01 4.65961e-01 1.69577e+02 128.509 -5.54190e+00 6.96489e+00  0.00000e+00 0.00000e+00 2.57479e+02 128.509 8.79025e+01 128.509 0.9420 
1 1 1 -3  66  3  o 10 2.69954e+00 6.70506e-01 1.78233e+02 208.550 -1.77895e+00 -9.67913e-01 0.00000e+00 0.00000e+00 1.07461e+02 28.550  2.85695e+02 28.550  0.7019 
1 1 1 -3  66  4  o 14 1.76689e+01 4.61025e-01 3.67735e+02 25.063  2.87200e+01  1.34308e+01  0.00000e+00 0.00000e+00 2.81522e+02 25.063  8.62126e+01 205.063 0.9841 
1 1 1 -3  66  5  o 9  1.14472e+01 4.46152e-01 2.91310e+02 244.960 -7.74175e+00 -1.65720e+01 0.00000e+00 0.00000e+00 1.24106e+02 244.960 1.67204e+02 64.960  0.9723 
1 1 1 -3  66  6  o 6  1.75461e+01 4.62161e-01 2.44202e+02 73.760  7.42128e+00  2.54782e+01  0.00000e+00 0.00000e+00 3.97947e+02 73.760  1.53744e+02 73.760  0.9810 
1 1 1 -3  66  7  o 11 1.06512e+01 4.56929e-01 2.26284e+02 104.241 -4.50992e+00 1.77701e+01  0.00000e+00 0.00000e+00 1.59894e+02 104.241 6.63895e+01 284.241 0.9723 
1 1 1 -3  66  8  o 8  1.02610e+01 4.65887e-01 2.59552e+02 285.804 6.34035e+00  -2.23997e+01 0.00000e+00 0.00000e+00 1.14536e+02 285.804 1.45016e+02 105.804 0.9783 
1 1 1 -3  66  9  o 19 8.08035e+00 5.33284e-01 1.77942e+02 135.766 -1.00956e+01 9.82907e+00  0.00000e+00 0.00000e+00 1.12109e+02 135.766 6.58325e+01 315.766 0.9638 
1 1 1 -3  66  10 o 13 1.55655e+01 4.60655e-01 3.39749e+02 333.589 5.11018e+01  -2.53797e+01 0.00000e+00 0.00000e+00 2.34450e+02 333.589 1.05298e+02 153.589 0.9912 
1 1 1 -3  66  11 o 2  6.84198e+00 6.21807e-01 1.05852e+02 126.778 -5.60791e+00 7.50219e+00  0.00000e+00 0.00000e+00 1.34598e+02 126.778 2.87455e+01 126.778 0.9450 
1 1 1 -3  66  12 o 16 7.97959e+00 6.47992e-01 1.17758e+02 231.613 -8.31303e+00 -1.04932e+01 0.00000e+00 0.00000e+00 1.67447e+02 231.613 4.96883e+01 231.613 0.9619 
1 1 1 -3  66  13 o 19 4.11570e+00 9.36936e-01 5.77642e+01 219.405 -2.59998e+00 -2.13600e+00 0.00000e+00 0.00000e+00 6.96240e+01 219.405 1.18597e+01 219.405 0.8337 
1 1 1 -3  66  14 o 12 4.42371e+00 1.14293e+00 7.67908e+01 323.666 3.98736e+00  -2.93262e+00 0.00000e+00 0.00000e+00 6.95966e+01 323.666 7.19414e+00 143.666 0.8922 
1 1 1 -3  66  15 o 14 5.54381e+00 1.17023e+00 7.64575e+01 154.218 -5.85945e+00 2.83033e+00  0.00000e+00 0.00000e+00 1.12435e+02 154.218 3.59780e+01 154.218 0.9196 
1 1 1 -3  66  16 o 2  6.03838e+00 1.28402e+00 6.17236e+01 224.100 -4.30508e+00 -4.17192e+00 0.00000e+00 0.00000e+00 1.42169e+02 224.100 8.04451e+01 224.100 0.9123 
1 1 1 -3  66  17 o 2  3.96055e+00 1.22514e+00 7.90645e+01 9.978   5.80088e+00  1.02059e+00  0.00000e+00 0.00000e+00 5.42731e+01 9.978   2.47913e+01 189.978 0.9106 
1 1 1 -3  67  1  o 6  2.37012e+01 4.76853e-01 3.09454e+02 90.478  -2.63742e-01 3.16143e+01  0.00000e+00 0.00000e+00 5.61981e+02 90.478  2.52527e+02 90.478  0.9841 
1 1 1 -3  67  2  f 0  2.02296e+01 4.31484e-01 1.62506e+02 284.095 3.44354e+00  -1.37147e+01 0.00000e+00 0.00000e+00 5.65947e+02 284.095 4.03441e+02 284.095 0.9640 
1 1 1 -3  67  3  o 1  4.16055e+00 7.35023e-01 6.29865e+01 149.122 -1.01152e+00 6.04858e-01  0.00000e+00 0.00000e+00 1.56483e+01 149.122 4.73382e+01 329.122 0.5061 
1 1 1 -3  67  4  o 19 1.93513e+01 4.69535e-01 3.67973e+02 210.069 -2.92320e+01 -1.69244e+01 0.00000e+00 0.00000e+00 3.43686e+02 210.069 2.42873e+01 30.069  0.9851 
1 1 1 -3  67  5  f 0  1.09982e+01 4.60426e-01 1.14462e+02 66.992  2.84686e+00  6.70403e+00  0.00000e+00 0.00000e+00 2.66650e+02 66.992  1.52188e+02 66.992  0.9286 
1 1 1 -3  67  6  o 10 1.97322e+01 4.23060e-01 3.86538e+02 246.410 -2.12980e+01 -4.87732e+01 0.00000e+00 0.00000e+00 3.42541e+02 246.410 4.39963e+01 66.410  0.9906 
1 1 1 -3  67  7  o 17 7.59036e+00 5.08131e-01 6.74681e+01 354.058 3.75965e+00  -3.91286e-01 0.00000e+00 0.00000e+00 1.74336e+02 354.058 1.06868e+02 354.058 0.8545 
1 1 1 -3  67  8  o 11 9.26476e+00 4.90964e-01 1.87213e+02 188.232 -1.59462e+01 -2.30684e+00 0.00000e+00 0.00000e+00 1.47100e+02 188.232 4.01129e+01 8.232   0.9685 
1 1 1 -3  67  9  o 7  6.65881e+00 5.39205e-01 1.26590e+02 229.025 -6.01095e+00 -6.92102e+00 0.00000e+00 0.00000e+00 1.07415e+02 229.025 1.91747e+01 49.025  0.9438 
1 1 1 -3  67  10 o 4  7.28179e+00 5.69148e-01 1.21624e+02 307.738 6.53320e+00  -8.44126e+00 0.00000e+00 0.00000e+00 1.36309e+02 307.738 1.46852e+01 307.738 0.9519 
1 1 1 -3  67  11 o 18 8.62406e+00 5.42038e-01 8.88898e+01 204.516 -9.95264e+00 -4.53899e+00 0.00000e+00 0.00000e+00 2.16738e+02 204.516 1.27848e+02 204.516 0.9531 
1 1 1 -3  67  12 o 9  9.63028e+00 6.03113e-01 1.75417e+02 188.271 -2.70102e+01 -3.92639e+00 0.00000e+00 0.00000e+00 1.75741e+02 188.271 3.23968e-01 188.271 0.9815 
1 1 1 -3  67  13 o 2  5.86819e+00 8.46084e-01 1.37447e+02 26.062  1.17851e+01  5.76365e+00  0.00000e+00 0.00000e+00 7.18953e+01 26.062  6.55519e+01 206.062 0.9611 
1 1 1 -3  67  14 o 3  3.01702e+00 9.73412e-01 2.06365e+01 282.161 1.97338e-01  -9.15733e-01 0.00000e+00 0.00000e+00 2.67483e+01 282.161 6.11182e+00 282.161 0.4235 
1 1 1 -3  67  15 o 17 7.41592e+00 1.22124e+00 1.00622e+02 233.561 -6.77787e+00 -9.18024e+00 0.00000e+00 0.00000e+00 1.61777e+02 233.561 6.11553e+01 233.561 0.9551 
1 1 1 -3  67  16 o 12 3.45659e+00 1.12823e+00 9.24035e+01 119.789 -2.87068e+00 5.01471e+00  0.00000e+00 0.00000e+00 2.38416e+01 119.789 6.85619e+01 299.789 0.9088 
1 1 1 -3  67  17 o 2  4.54999e+00 1.30069e+00 4.91586e+01 292.813 1.62827e+00  -3.87107e+00 0.00000e+00 0.00000e+00 9.72957e+01 292.813 4.81371e+01 292.813 0.8708 
1 1 1 -3  68  1  o 4  1.13755e+01 4.18482e-01 1.54992e+02 155.653 -7.13034e+00 3.22650e+00  0.00000e+00 0.00000e+00 2.41796e+02 155.653 8.68039e+01 155.653 0.9337 
1 1 1 -3  68  2  o 5  6.13106e+00 6.55791e-01 3.41312e+01 57.843  5.05909e-01  8.04703e-01  0.00000e+00 0.00000e+00 6.40081e+01 57.843  2.98769e+01 57.843  0.4286 
1 1 1 -3  68  3  o 2  2.71143e+01 5.71837e-01 4.53882e+02 39.767  4.55771e+01  3.79295e+01  0.00000e+00 0.00000e+00 5.49941e+02 39.767  9.60590e+01 39.767  0.9915 
1 1 1 -3  68  4  o 13 5.15999e+00 6.45180e-01 2.38903e+02 341.764 6.28391e+00  -2.07038e+00 0.00000e+00 0.00000e+00 6.15226e+01 161.764 3.00426e+02 161.764 0.9210 
1 1 1 -3  68  5  o 6  8.18879e+00 5.12055e-01 1.85588e+02 57.419  4.72808e+00  7.39846e+00  0.00000e+00 0.00000e+00 1.01979e+02 57.419  8.36096e+01 237.419 0.9412 
1 1 1 -3  68  6  o 10 2.62998e+01 5.35925e-01 3.50805e+02 210.526 -5.63516e+01 -3.32285e+01 0.00000e+00 0.00000e+00 6.22490e+02 210.526 2.71685e+02 210.526 0.9923 
1 1 1 -3  68  7  o 5  8.63306e+00 4.94722e-01 2.63069e+02 298.834 9.27927e+00  -1.68552e+01 0.00000e+00 0.00000e+00 5.02474e+01 298.834 2.12822e+02 118.834 0.9737 
1 1 1 -3  68  8  o 17 5.70313e+00 6.09870e-01 1.33097e+02 352.754 6.81216e+00  -8.66096e-01 0.00000e+00 0.00000e+00 6.32179e+01 352.754 6.98791e+01 172.754 0.9240 
1 1 1 -3  68  9  f 0  1.09370e+01 4.50896e-01 9.64520e+01 203.930 -1.09814e+01 -4.87322e+00 0.00000e+00 0.00000e+00 2.93391e+02 203.930 1.96940e+02 203.930 0.9574 
1 1 1 -3  68  10 o 12 3.49434e+00 7.87991e-01 3.69893e+01 131.706 -1.02193e+00 1.14675e+00  0.00000e+00 0.00000e+00 4.16494e+01 131.706 4.66014e+00 131.706 0.6049 
1 1 1 -3  68  11 o 8  4.81024e+00 7.91113e-01 1.02365e+02 77.242  1.47606e+00  6.51915e+00  0.00000e+00 0.00000e+00 6.24755e+01 77.242  3.98892e+01 257.242 0.9218 
1 1 1 -3  68  12 o 12 1.09391e+01 5.75137e-01 2.16733e+02 108.923 -1.25183e+01 3.65158e+01  0.00000e+00 0.00000e+00 1.84291e+02 108.923 3.24413e+01 288.923 0.9870 
1 1 1 -3  68  13 o 5  9.52687e+00 6.70613e-01 1.23830e+02 356.192 2.11774e+01  -1.40966e+00 0.00000e+00 0.00000e+00 2.21292e+02 356.192 9.74618e+01 356.192 0.9762 
1 1 1 -3  68  14 o 3  7.28207e+00 1.09941e+00 9.43537e+01 49.883  6.62964e+00  7.86822e+00  0.00000e+00 0.00000e+00 1.62161e+02 49.883  6.78073e+01 49.883  0.9501 
1 1 1 -3  68  15 o 15 4.48554e+00 1.25842e+00 8.09215e+01 271.462 1.45926e-01  -5.71619e+00 0.00000e+00 0.00000e+00 6.98901e+01 271.462 1.10314e+01 91.462  0.9077 
1 1 1 -3  68  16 o 13 5.40712e+00 1.24499e+00 8.71341e+01 33.967  6.92756e+00  4.66695e+00  0.00000e+00 0.00000e+00 1.00537e+02 33.967  1.34033e+01 33.967  0.9381 
1 1 1 -3  68  17 o 18 3.16308e+00 1.05927e+00 1.70470e+01 83.961  1.27467e-01  1.20480e+00  0.00000e+00 0.00000e+00 4.33123e+01 83.961  2.62654e+01 83.961  0.5163 
1 1 1 -3  69  1  o 5  1.27725e+01 4.14674e-01 1.67814e+02 121.106 -5.12692e+00 8.49709e+00  0.00000e+00 0.00000e+00 2.84517e+02 121.106 1.16703e+02 121.106 0.9482 
1 1 1 -3  69  2  o 18 4.65458e+00 7.35578e-01 3.04888e+01 76.068  1.61587e-01  6.51359e-01  0.00000e+00 0.00000e+00 2.47782e+01 76.068  5.71057e+00 256.068 0.3180 
1 1 1 -3  69  3  o 7  7.69385e+00 5.97248e-01 2.20299e+02 240.165 -4.24311e+00 -7.39829e+00 0.00000e+00 0.00000e+00 4.95168e+01 240.165 1.70782e+02 60.165  0.9394 
1 1 1 -3  69  4  o 10 2.74412e+01 5.52954e-01 4.48583e+02 57.906  3.74618e+01  5.97337e+01  0.00000e+00 0.00000e+00 5.68197e+02 57.906  1.19615e+02 57.906  0.9929 
1 1 1 -3  69  5  o 18 3.03079e+01 5.17038e-01 5.98101e+02 247.324 -4.38716e+01 -1.05004e+02 0.00000e+00 0.00000e+00 5.27526e+02 247.324 7.05750e+01 67.324  0.9956 
1 1 1 -3  69  6  o 14 1.53802e+01 4.49651e-01 3.15744e+02 213.107 -3.09642e+01 -2.01904e+01 0.00000e+00 0.00000e+00 2.49925e+02 213.107 6.58183e+01 33.107  0.9864 
1 1 1 -3  69  7  f 0  4.96385e+00 6.34759e-01 6.07051e+01 93.776  -1.54378e-01 2.33914e+00  0.00000e+00 0.00000e+00 7.74711e+01 93.776  1.67660e+01 93.776  0.7469 
1 1 1 -3  69  8  o 8  9.77242e+00 4.49090e-01 1.96228e+02 183.207 -1.88489e+01 -1.05617e+00 0.00000e+00 0.00000e+00 1.57980e+02 183.207 3.82477e+01 3.207   0.9731 
1 1 1 -3  69  9  o 4  1.01155e+01 4.59332e-01 1.64869e+02 184.610 -1.81601e+01 -1.46446e+00 0.00000e+00 0.00000e+00 2.01168e+02 184.610 3.62995e+01 184.610 0.9722 
1 1 1 -3  69  10 f 0  6.93503e+00 5.82381e-01 8.67344e+01 48.984  5.21950e+00  6.00105e+00  0.00000e+00 0.00000e+00 1.54413e+02 48.984  6.76784e+01 48.984  0.9348 
1 1 1 -3  69  11 f 0  4.78727e+00 8.03172e-01 3.83038e+01 287.231 7.21342e-01  -2.32575e+00 0.00000e+00 0.00000e+00 9.65226e+01 287.231 5.82189e+01 287.231 0.7577 
1 1 1 -3  69  12 o 14 3.11922e+00 8.24568e-01 1.10360e+02 95.454  -4.83555e-01 5.06474e+00  0.00000e+00 0.00000e+00 6.64006e+00 275.454 1.17000e+02 275.454 0.8954 
1 1 1 -3  69  13 f 0  2.81865e+00 8.47467e-01 7.56349e+01 169.326 -3.44000e+00 6.48361e-01  0.00000e+00 0.00000e+00 1.23340e+01 169.326 6.33010e+01 349.326 0.8411 
1 1 1 -3  69  14 o 10 4.25577e+00 1.16632e+00 4.75472e+01 219.824 -2.33278e+00 -1.94524e+00 0.00000e+00 0.00000e+00 8.06645e+01 219.824 3.31173e+01 219.824 0.8127 
1 1 1 -3  69  15 o 12 3.69865e+00 1.15870e+00 7.89055e+01 139.212 -3.58401e+00 3.09235e+00  0.00000e+00 0.00000e+00 4.25600e+01 139.212 3.63455e+01 319.212 0.8868 
1 1 1 -3  69  16 o 2  3.76003e+00 1.17768e+00 4.34584e+01 132.568 -2.13993e+00 2.32975e+00  0.00000e+00 0.00000e+00 7.07884e+01 132.568 2.73300e+01 132.568 0.8214 
1 1 1 -3  69  17 o 5  4.05321e+00 1.27439e+00 8.77623e+01 215.311 -5.80558e+00 -4.11222e+00 0.00000e+00 0.00000e+00 5.10413e+01 215.311 3.67209e+01 35.311  0.9268 
1 1 1 -3  70  1  o 6  1.93267e+01 5.05879e-01 4.04200e+02 90.033  -2.13056e-02 3.70024e+01  0.00000e+00 0.00000e+00 3.07681e+02 90.033  9.65191e+01 270.033 0.9864 
1 1 1 -3  70  2  o 18 1.73341e+01 4.95222e-01 3.51601e+02 181.525 -3.09954e+01 -8.25167e-01 0.00000e+00 0.00000e+00 2.85032e+02 181.525 6.65690e+01 1.525   0.9837 
1 1 1 -3  70  3  o 2  1.76233e+01 4.92225e-01 3.49507e+02 352.553 3.67294e+01  -4.80106e+00 0.00000e+00 0.00000e+00 2.99328e+02 352.553 5.01793e+01 172.553 0.9864 
1 1 1 -3  70  4  o 18 9.09844e+00 5.44482e-01 1.59092e+02 269.895 -1.53305e-02 -8.33098e+00 0.00000e+00 0.00000e+00 1.59307e+02 269.895 2.14693e-01 269.895 0.9379 
1 1 1 -3  70  5  o 3  7.74082e+00 4.89087e-01 1.38603e+02 170.009 -7.28987e+00 1.28423e+00  0.00000e+00 0.00000e+00 1.29828e+02 170.009 8.77465e+00 350.009 0.9298 
1 1 1 -3  70  6  o 10 1.25244e+01 4.52584e-01 1.47580e+02 248.962 -4.93088e+00 -1.28202e+01 0.00000e+00 0.00000e+00 3.01996e+02 248.962 1.54415e+02 248.962 0.9629 
1 1 1 -3  70  7  o 3  1.59578e+01 4.57735e-01 2.48727e+02 206.819 -3.13824e+01 -1.58657e+01 0.00000e+00 0.00000e+00 3.37353e+02 206.819 8.86255e+01 206.819 0.9857 
1 1 1 -3  70  8  o 2  3.69505e+00 7.20714e-01 1.09047e+02 9.703   3.74010e+00  6.39516e-01  0.00000e+00 0.00000e+00 8.61741e+00 9.703   1.00430e+02 189.703 0.8551 
1 1 1 -3  70  9  o 15 1.83984e+01 4.55979e-01 2.65121e+02 25.425  4.76500e+01  2.26517e+01  0.00000e+00 0.00000e+00 4.13055e+02 25.425  1.47933e+02 25.425  0.9905 
1 1 1 -3  70  10 o 12 2.09636e+00 6.50401e-01 2.63538e+01 56.096  4.13245e-01  6.14885e-01  0.00000e+00 0.00000e+00 7.09335e-01 56.096  2.56444e+01 236.096 0.3471 
1 1 1 -3  70  11 f 0  5.54449e+00 7.14172e-01 2.79851e+01 272.787 1.09570e-01  -2.25051e+00 0.00000e+00 0.00000e+00 1.23506e+02 272.787 9.55211e+01 272.787 0.7353 
1 1 1 -3  70  12 o 14 3.57367e+00 8.97393e-01 2.37625e+01 76.998  2.84010e-01  1.23003e+00  0.00000e+00 0.00000e+00 4.67866e+01 76.998  2.30242e+01 76.998  0.5317 
1 1 1 -3  70  13 o 12 4.25011e+00 8.90546e-01 9.12984e+01 84.168  6.12200e-01  5.99318e+00  0.00000e+00 0.00000e+00 5.26099e+01 84.168  3.86886e+01 264.168 0.9127 
1 1 1 -3  70  14 o 3  6.82130e+00 1.12070e+00 1.15996e+02 70.575  3.95829e+00  1.12246e+01  0.00000e+00 0.00000e+00 1.25950e+02 70.575  9.95479e+00 70.575  0.9570 
1 1 1 -3  70  15 o 10 4.62239e+00 1.16020e+00 6.56406e+01 334.928 4.70079e+00  -2.19916e+00 0.00000e+00 0.00000e+00 8.79784e+01 334.928 2.23378e+01 334.928 0.8976 
1 1 1 -3  70  16 o 10 4.58483e+00 1.30772e+00 8.99145e+01 312.795 4.55367e+00  -4.91842e+00 0.00000e+00 0.00000e+00 6.64395e+01 312.795 2.34751e+01 132.795 0.9221 
1 1 1 -3  70  17 o 5  3.61531e+00 1.18251e+00 9.19665e+01 70.466  2.48635e+00  7.00814e+00  0.00000e+00 0.00000e+00 3.22602e+01 70.466  5.97064e+01 250.466 0.9301 
1 1 1 -3  71  1  o 9  8.79955e+00 5.37893e-01 1.31391e+02 131.148 -4.14062e+00 4.73843e+00  0.00000e+00 0.00000e+00 1.69767e+02 131.148 3.83751e+01 131.148 0.9167 
1 1 1 -3  71  2  o 9  2.05805e+01 5.15042e-01 3.69716e+02 350.183 4.49852e+01  -7.78409e+00 0.00000e+00 0.00000e+00 3.90032e+02 350.183 2.03157e+01 350.183 0.9890 
1 1 1 -3  71  3  o 14 1.17426e+01 5.13513e-01 2.65451e+02 132.686 -1.21127e+01 1.31330e+01  0.00000e+00 0.00000e+00 1.60298e+02 132.686 1.05153e+02 312.686 0.9716 
1 1 1 -3  71  4  o 11 1.51142e+01 4.78131e-01 3.21558e+02 329.768 2.64730e+01  -1.54272e+01 0.00000e+00 0.00000e+00 2.32988e+02 329.768 8.85702e+01 149.768 0.9835 
1 1 1 -3  71  5  o 7  9.35335e+00 4.63441e-01 2.26001e+02 219.296 -1.23591e+01 -1.01143e+01 0.00000e+00 0.00000e+00 1.11679e+02 219.296 1.14323e+02 39.296  0.9682 
1 1 1 -3  71  6  o 12 1.10224e+01 4.62754e-01 1.95848e+02 303.009 1.00023e+01  -1.53969e+01 0.00000e+00 0.00000e+00 2.03637e+02 303.009 7.78980e+00 303.009 0.9724 
1 1 1 -3  71  7  f 0  7.17201e+00 4.85189e-01 4.19033e+01 105.043 -7.23308e-01 2.69138e+00  0.00000e+00 0.00000e+00 1.69946e+02 105.043 1.28042e+02 105.043 0.7929 
1 1 1 -3  71  8  o 7  1.11912e+01 4.31599e-01 2.05612e+02 159.042 -2.38491e+01 9.13454e+00  0.00000e+00 0.00000e+00 2.02816e+02 159.042 2.79573e+00 339.042 0.9802 
1 1 1 -3  71  9  f 0  8.57663e+00 4.91389e-01 1.85362e+02 138.041 -1.37888e+01 1.23975e+01  0.00000e+00 0.00000e+00 1.25028e+02 138.041 6.03340e+01 318.041 0.9727 
1 1 1 -3  71  10 o 12 3.77247e+00 7.99794e-01 6.58505e+01 148.216 -2.57196e+00 1.59369e+00  0.00000e+00 0.00000e+00 4.80277e+01 148.216 1.78228e+01 328.216 0.8119 
1 1 1 -3  71  11 o 6  1.19843e+01 5.24054e-01 2.36106e+02 24.545  3.81578e+01  1.74260e+01  0.00000e+00 0.00000e+00 2.03811e+02 24.545  3.22951e+01 204.545 0.9880 
1 1 1 -3  71  12 o 16 4.60072e+00 8.38822e-01 4.66338e+01 126.401 -2.04072e+00 2.76791e+00  0.00000e+00 0.00000e+00 9.64634e+01 126.401 4.98296e+01 126.401 0.8378 
1 1 1 -3  71  13 o 8  2.79194e+00 8.45705e-01 6.39327e+01 199.453 -3.03510e+00 -1.07202e+00 0.00000e+00 0.00000e+00 2.14932e+01 199.453 4.24395e+01 19.453  0.8249 
1 1 1 -3  71  14 o 19 8.13687e+00 1.07569e+00 9.39236e+01 178.428 -1.21718e+01 3.33939e-01  0.00000e+00 0.00000e+00 1.94928e+02 178.428 1.01005e+02 178.428 0.9580 
1 1 1 -3  71  15 o 13 5.16819e+00 1.32844e+00 3.39269e+01 18.587  2.48952e+00  8.37189e-01  0.00000e+00 0.00000e+00 1.14932e+02 18.587  8.10052e+01 18.587  0.7781 
1 1 1 -3  71  16 o 5  4.51014e+00 1.30768e+00 7.04223e+01 98.137  -7.66513e-01 5.36083e+00  0.00000e+00 0.00000e+00 8.00436e+01 98.137  9.62130e+00 98.137  0.9022 
1 1 1 -3  71  17 o 1  3.18302e+00 1.07150e+00 6.65289e+01 298.395 2.33737e+00  -4.32376e+00 0.00000e+00 0.00000e+00 3.82696e+01 298.395 2.82593e+01 118.395 0.8914 
1 1 1 -3  72  1  o 16 1.12704e+01 5.34542e-01 2.36535e+02 319.850 1.21640e+01  -1.02611e+01 0.00000e+00 0.00000e+00 1.70725e+02 319.850 6.58102e+01 139.850 0.9681 
1 1 1 -3  72  2  o 6  2.34327e+01 5.42489e-01 3.91175e+02 181.644 -5.23557e+01 -1.50278e+00 0.00000e+00 0.00000e+00 4.74937e+02 181.644 8.37624e+01 181.644 0.9904 
1 1 1 -3  72  3  f 0  2.07071e+01 4.73693e-01 2.96429e+02 343.251 3.63407e+01  -1.09366e+01 0.00000e+00 0.00000e+00 4.65896e+02 343.251 1.69467e+02 343.251 0.9867 
1 1 1 -3  72  4  o 4  2.31669e+01 4.96899e-01 4.16939e+02 119.879 -3.43681e+01 5.98184e+01  0.00000e+00 0.00000e+00 4.40834e+02 119.879 2.38949e+01 119.879 0.9927 
1 1 1 -3  72  5  o 14 1.13655e+01 4.55400e-01 1.69796e+02 295.889 6.27535e+00  -1.29297e+01 0.00000e+00 0.00000e+00 2.38916e+02 295.889 6.91199e+01 295.889 0.9646 
1 1 1 -3  72  6  o 14 2.64189e+01 5.45794e-01 4.77447e+02 118.795 -5.24887e+01 9.54969e+01  0.00000e+00 0.00000e+00 5.02532e+02 118.795 2.50845e+01 118.795 0.9954 
1 1 1 -3  72  7  o 15 5.09687e+00 5.88102e-01 1.17184e+02 235.428 -3.07434e+00 -4.46113e+00 0.00000e+00 0.00000e+00 5.40973e+01 235.428 6.30863e+01 55.428  0.9022 
1 1 1 -3  72  8  o 17 6.98116e+00 5.21316e-01 1.18182e+02 78.438  1.85450e+00  9.06458e+00  0.00000e+00 0.00000e+00 1.27214e+02 78.438  9.03225e+00 78.438  0.9443 
1 1 1 -3  72  9  o 12 3.60687e+00 7.22265e-01 3.83242e+01 36.747  1.34661e+00  1.00546e+00  0.00000e+00 0.00000e+00 4.72416e+01 36.747  8.91745e+00 36.747  0.6377 
1 1 1 -3  72  10 o 12 4.73208e+00 7.57965e-01 9.73299e+01 283.767 1.45430e+00  -5.93571e+00 0.00000e+00 0.00000e+00 6.34638e+01 283.767 3.38661e+01 103.767 0.9141 
1 1 1 -3  72  11 o 13 4.57052e+00 8.35603e-01 7.60648e+01 331.607 4.49195e+00  -2.42810e+00 0.00000e+00 0.00000e+00 7.60195e+01 331.607 4.52603e-02 151.607 0.8958 
1 1 1 -3  72  12 o 17 8.46175e+00 6.98983e-01 1.23780e+02 94.692  -1.34885e+00 1.64328e+01  0.00000e+00 0.00000e+00 1.80605e+02 94.692  5.68248e+01 94.692  0.9692 
1 1 1 -3  72  13 o 1  3.67616e+00 9.53188e-01 8.73967e+01 60.507  2.52710e+00  4.46788e+00  0.00000e+00 0.00000e+00 3.47994e+01 60.507  5.25973e+01 240.507 0.8964 
1 1 1 -3  72  14 o 1  7.19732e+00 1.17911e+00 7.49745e+01 312.379 5.47886e+00  -6.00450e+00 0.00000e+00 0.00000e+00 1.74684e+02 312.379 9.97096e+01 312.379 0.9363 
1 1 1 -3  72  15 f 0  2.97446e+00 9.80563e-01 7.35076e+01 249.536 -1.45179e+00 -3.89050e+00 0.00000e+00 0.00000e+00 2.21724e+01 249.536 5.13352e+01 69.536  0.8691 
1 1 1 -3  72  16 o 9  4.01409e+00 1.21796e+00 6.79521e+01 305.597 2.89149e+00  -4.03918e+00 0.00000e+00 0.00000e+00 6.45169e+01 305.597 3.43520e+00 125.597 0.8926 
1 1 1 -3  72  17 o 11 5.61038e+00 1.49167e+00 5.54199e+01 185.507 -5.06082e+00 -4.87892e-01 0.00000e+00 0.00000e+00 1.30075e+02 185.507 7.46547e+01 185.507 0.8953 
1 1 1 -3  73  1  o 6  2.40518e+01 5.47773e-01 4.00481e+02 226.209 -3.83693e+01 -4.00238e+01 0.00000e+00 0.00000e+00 4.89007e+02 226.209 8.85268e+01 226.209 0.9909 
1 1 1 -3  73  2  o 8  1.49148e+01 5.12333e-01 2.29287e+02 278.174 2.99316e+00  -2.08391e+01 0.00000e+00 0.00000e+00 3.13838e+02 278.174 8.45505e+01 278.174 0.9760 
1 1 1 -3  73  3  o 3  1.81460e+01 5.36453e-01 3.70896e+02 238.091 -2.44517e+01 -3.92700e+01 0.00000e+00 0.00000e+00 2.98633e+02 238.091 7.22629e+01 58.091  0.9891 
1 1 1 -3  73  4  o 7  1.89957e+01 4.66190e-01 3.77623e+02 54.465  3.14636e+01  4.40539e+01  0.00000e+00 0.00000e+00 3.24145e+02 54.465  5.34782e+01 234.465 0.9907 
1 1 1 -3  73  5  o 12 1.95292e+01 4.71612e-01 3.28401e+02 32.548  4.23232e+01  2.70124e+01  0.00000e+00 0.00000e+00 3.92261e+02 32.548  6.38607e+01 32.548  0.9900 
1 1 1 -3  73  6  o 18 7.94615e+00 4.72317e-01 1.57135e+02 280.243 1.96026e+00  -1.08484e+01 0.00000e+00 0.00000e+00 1.25156e+02 280.243 3.19791e+01 100.243 0.9535 
1 1 1 -3  73  7  o 2  1.48930e+01 4.25660e-01 2.49023e+02 279.000 5.79606e+00  -3.65958e+01 0.00000e+00 0.00000e+00 2.98034e+02 279.000 4.90104e+01 279.000 0.9864 
1 1 1 -3  73  8  o 1  1.36388e+01 4.28893e-01 2.35041e+02 135.196 -2.64843e+01 2.63039e+01  0.00000e+00 0.00000e+00 2.65708e+02 135.196 3.06674e+01 135.196 0.9865 
1 1 1 -3  73  9  o 6  9.60901e+00 4.87737e-01 1.54245e+02 240.169 -1.00014e+01 -1.74412e+01 0.00000e+00 0.00000e+00 1.94140e+02 240.169 3.98945e+01 240.169 0.9748 
1 1 1 -3  73  10 o 13 1.01308e+01 5.17012e-01 1.87811e+02 71.933  8.32884e+00  2.55312e+01  0.00000e+00 0.00000e+00 1.81643e+02 71.933  6.16753e+00 251.933 0.9812 
1 1 1 -3  73  11 o 9  7.98803e+00 6.22163e-01 1.28711e+02 341.318 1.55948e+01  -5.27306e+00 0.00000e+00 0.00000e+00 1.58798e+02 341.318 3.00872e+01 341.318 0.9691 
1 1 1 -3  73  12 o 10 4.81272e+00 9.27102e-01 8.51282e+01 110.384 -2.09632e+00 5.64158e+00  0.00000e+00 0.00000e+00 7.78624e+01 110.384 7.26576e+00 290.384 0.9126 
1 1 1 -3  73  13 o 7  4.52796e+00 9.99747e-01 9.53674e+01 312.738 4.34622e+00  -4.70365e+00 0.00000e+00 0.00000e+00 5.87784e+01 312.738 3.65891e+01 132.738 0.9182 
1 1 1 -3  73  14 o 10 7.11053e+00 1.20088e+00 1.25006e+02 155.896 -1.26626e+01 5.66519e+00  0.00000e+00 0.00000e+00 1.28691e+02 155.896 3.68508e+00 155.896 0.9633 
1 1 1 -3  73  15 o 7  5.21439e+00 1.35312e+00 1.25237e+02 8.390   9.85635e+00  1.45365e+00  0.00000e+00 0.00000e+00 5.77560e+01 8.390   6.74807e+01 188.390 0.9484 
1 1 1 -3  73  16 o 7  3.67123e+00 1.17501e+00 3.43086e+01 264.745 -2.21317e-01 -2.40632e+00 0.00000e+00 0.00000e+00 6.82270e+01 264.745 3.39184e+01 264.745 0.7556 
1 1 1 -3  74  1  o 2  1.89430e+01 5.06614e-01 3.10914e+02 143.359 -2.97037e+01 2.20928e+01  0.00000e+00 0.00000e+00 3.86286e+02 143.359 7.53724e+01 143.359 0.9864 
1 1 1 -3  74  2  o 16 3.69174e+01 6.92020e-01 6.46745e+02 248.200 -5.94873e+01 -1.48731e+02 0.00000e+00 0.00000e+00 7.26144e+02 248.200 7.93988e+01 248.200 0.9969 
1 1 1 -3  74  3  o 15 1.48439e+01 5.19143e-01 2.96534e+02 119.708 -1.63899e+01 2.87253e+01  0.00000e+00 0.00000e+00 2.48629e+02 119.708 4.79047e+01 299.708 0.9848 
1 1 1 -3  74  4  o 10 8.48965e+00 4.74250e-01 1.30939e+02 22.484  7.62378e+00  3.15544e+00  0.00000e+00 0.00000e+00 1.65723e+02 22.484  3.47844e+01 22.484  0.9373 
1 1 1 -3  74  5  o 7  1.48498e+01 4.47740e-01 2.48267e+02 51.972  1.82193e+01  2.32964e+01  0.00000e+00 0.00000e+00 2.95706e+02 51.972  4.74390e+01 51.972  0.9829 
1 1 1 -3  74  6  o 3  1.11905e+01 4.17918e-01 2.70096e+02 216.992 -2.25967e+01 -1.70228e+01 0.00000e+00 0.00000e+00 1.39319e+02 216.992 1.30777e+02 36.992  0.9822 
1 1 1 -3  74  7  o 12 8.58363e+00 4.50383e-01 1.43023e+02 274.472 1.05981e+00  -1.35505e+01 0.00000e+00 0.00000e+00 1.64564e+02 274.472 2.15416e+01 274.472 0.9625 
1 1 1 -3  74  8  o 13 6.45000e+00 5.26519e-01 8.99194e+01 324.352 5.01779e+00  -3.59879e+00 0.00000e+00 0.00000e+00 1.29680e+02 324.352 3.97607e+01 324.352 0.9150 
1 1 1 -3  74  9  o 7  1.24401e+01 4.64344e-01 2.32906e+02 342.338 3.90520e+01  -1.24344e+01 0.00000e+00 0.00000e+00 2.24008e+02 342.338 8.89839e+00 162.338 0.9877 
1 1 1 -3  74  10 o 18 4.71561e+00 8.10411e-01 1.05837e+02 121.856 -3.68460e+00 5.92960e+00  0.00000e+00 0.00000e+00 5.63074e+01 121.856 4.95292e+01 301.856 0.9253 
1 1 1 -3  74  11 o 11 5.99817e+00 7.28520e-01 1.00848e+02 299.692 4.61721e+00  -8.09749e+00 0.00000e+00 0.00000e+00 1.09563e+02 299.692 8.71512e+00 299.692 0.9447 
1 1 1 -3  74  12 o 3  4.88540e+00 9.07887e-01 8.88546e+01 72.430  2.08751e+00  6.59261e+00  0.00000e+00 0.00000e+00 7.87256e+01 72.430  1.01290e+01 252.430 0.9246 
1 1 1 -3  74  13 o 7  6.05775e+00 9.54557e-01 1.23707e+02 63.884  5.38295e+00  1.09801e+01  0.00000e+00 0.00000e+00 9.14543e+01 63.884  3.22525e+01 243.884 0.9582 
1 1 1 -3  74  14 o 11 4.85552e+00 1.23686e+00 9.90353e+01 182.446 -7.39221e+00 -3.15739e-01 0.00000e+00 0.00000e+00 6.81437e+01 182.446 3.08916e+01 2.446   0.9297 
1 1 1 -3  74  15 o 9  3.23901e+00 1.06087e+00 3.60108e+01 102.523 -5.09657e-01 2.29452e+00  0.00000e+00 0.00000e+00 5.35855e+01 102.523 1.75747e+01 102.523 0.7477 
1 1 1 -3  74  16 f 0  4.37468e+00 1.28384e+00 5.37220e+01 167.776 -4.46557e+00 9.67428e-01  0.00000e+00 0.00000e+00 8.89250e+01 167.776 3.52030e+01 167.776 0.8823 
1 1 1 -3  75  1  o 3  1.33735e+01 4.67016e-01 1.80775e+02 294.235 7.11519e+00  -1.58065e+01 0.00000e+00 0.00000e+00 3.03511e+02 294.235 1.22736e+02 294.235 0.9707 
1 1 1 -3  75  2  f 0  1.77245e+01 4.84665e-01 2.89826e+02 30.422  3.34418e+01  1.96377e+01  0.00000e+00 0.00000e+00 3.62668e+02 30.422  7.28417e+01 30.422  0.9870 
1 1 1 -3  75  3  f 0  4.72952e+00 7.55819e-01 1.74036e+02 63.339  2.66739e+00  5.31253e+00  0.00000e+00 0.00000e+00 1.32955e+01 243.339 1.87332e+02 243.339 0.9115 
1 1 1 -3  75  4  o 16 1.13083e+01 4.49101e-01 2.27517e+02 333.463 1.96405e+01  -9.80813e+00 0.00000e+00 0.00000e+00 1.84281e+02 333.463 4.32353e+01 153.463 0.9770 
1 1 1 -3  75  5  o 17 6.03210e+00 5.11101e-01 5.39714e+01 119.355 -1.40253e+00 2.49365e+00  0.00000e+00 0.00000e+00 1.25643e+02 119.355 7.16720e+01 119.355 0.7992 
1 1 1 -3  75  6  o 3  7.15524e+00 4.73544e-01 1.45948e+02 174.012 -1.01811e+01 1.06789e+00  0.00000e+00 0.00000e+00 1.07162e+02 174.012 3.87867e+01 354.012 0.9498 
1 1 1 -3  75  7  o 13 6.61511e+00 6.01675e-01 9.67051e+01 222.258 -5.21445e+00 -4.73774e+00 0.00000e+00 0.00000e+00 1.31319e+02 222.258 3.46138e+01 222.258 0.9260 
1 1 1 -3  75  8  o 16 1.32030e+01 4.38664e-01 2.10425e+02 233.246 -2.06278e+01 -2.76204e+01 0.00000e+00 0.00000e+00 2.73576e+02 233.246 6.31513e+01 233.246 0.9854 
1 1 1 -3  75  9  o 6  8.34541e+00 5.11368e-01 1.37297e+02 29.116  1.33350e+01  7.42697e+00  0.00000e+00 0.00000e+00 1.62626e+02 29.116  2.53288e+01 29.116  0.9667 
1 1 1 -3  75  10 o 10 1.07411e+01 5.18951e-01 2.21353e+02 168.327 -3.52188e+01 7.27624e+00  0.00000e+00 0.00000e+00 1.72112e+02 168.327 4.92409e+01 348.327 0.9860 
1 1 1 -3  75  11 o 1  6.36614e+00 7.14478e-01 8.99262e+01 289.619 3.10962e+00  -8.72374e+00 0.00000e+00 0.00000e+00 1.33259e+02 289.619 4.33330e+01 289.619 0.9444 
1 1 1 -3  75  12 o 10 6.78546e+00 8.10099e-01 1.29350e+02 93.615  -9.46612e-01 1.49836e+01  0.00000e+00 0.00000e+00 1.13811e+02 93.615  1.55391e+01 273.615 0.9661 
1 1 1 -3  75  13 o 19 3.82057e+00 1.01843e+00 5.24165e+01 255.574 -7.59482e-01 -2.95240e+00 0.00000e+00 0.00000e+00 6.27695e+01 255.574 1.03530e+01 255.574 0.8135 
1 1 1 -3  75  14 o 15 3.38040e+00 1.06538e+00 5.68246e+01 37.296  2.64577e+00  2.01521e+00  0.00000e+00 0.00000e+00 4.72413e+01 37.296  9.58326e+00 217.296 0.8315 
1 1 1 -3  75  15 o 13 3.98508e+00 1.19758e+00 4.93828e+01 187.955 -3.58984e+00 -5.01626e-01 0.00000e+00 0.00000e+00 7.55184e+01 187.955 2.61356e+01 187.955 0.8474 
1 1 1 -3  75  16 o 2  4.57070e+00 1.29846e+00 8.49886e+01 292.376 2.69363e+00  -6.54293e+00 0.00000e+00 0.00000e+00 7.14569e+01 292.376 1.35317e+01 112.376 0.9264 
1 1 1 -3  76  1  o 1  4.98109e+00 7.31530e-01 5.52079e+01 31.438  1.69446e+00  1.03586e+00  0.00000e+00 0.00000e+00 7.39963e+01 31.438  1.87884e+01 31.438  0.6955 
1 1 1 -3  76  2  o 2  1.05414e+01 4.86678e-01 2.06803e+02 210.788 -1.41612e+01 -8.43773e+00 0.00000e+00 0.00000e+00 1.74166e+02 210.788 3.26364e+01 30.788  0.9692 
1 1 1 -3  76  3  o 12 9.62835e+00 5.59293e-01 1.93928e+02 302.781 7.82234e+00  -1.21465e+01 0.00000e+00 0.00000e+00 1.52356e+02 302.781 4.15719e+01 122.782 0.9647 
1 1 1 -3  76  4  o 15 1.71309e+01 4.06329e-01 3.60320e+02 217.044 -4.35240e+01 -3.28508e+01 0.00000e+00 0.00000e+00 2.72214e+02 217.044 8.81062e+01 37.045  0.9908 
1 1 1 -3  76  5  o 7  1.91852e+01 4.53018e-01 3.20648e+02 34.401  4.73141e+01  3.23984e+01  0.00000e+00 0.00000e+00 3.87782e+02 34.401  6.71339e+01 34.401  0.9912 
1 1 1 -3  76  6  o 13 1.16859e+01 4.19413e-01 1.40944e+02 160.231 -1.55224e+01 5.57888e+00  0.00000e+00 0.00000e+00 2.80777e+02 160.231 1.39833e+02 160.231 0.9692 
1 1 1 -3  76  7  o 12 5.80369e+00 5.59783e-01 9.29095e+01 268.158 -1.85258e-01 -5.76218e+00 0.00000e+00 0.00000e+00 1.03326e+02 268.158 1.04169e+01 268.158 0.9085 
1 1 1 -3  76  8  o 11 7.51758e+00 5.13408e-01 1.38656e+02 357.900 1.40801e+01  -5.16280e-01 0.00000e+00 0.00000e+00 1.30841e+02 357.900 7.81472e+00 177.900 0.9638 
1 1 1 -3  76  9  o 4  4.68844e+00 7.64213e-01 1.53036e+02 255.359 -2.40041e+00 -9.18861e+00 0.00000e+00 0.00000e+00 1.17877e+01 255.359 1.41248e+02 75.359  0.9458 
1 1 1 -3  76  10 o 17 2.20979e+00 6.89904e-01 2.29400e+01 74.354  2.19313e-01  7.83061e-01  0.00000e+00 0.00000e+00 7.94818e+00 74.354  1.49918e+01 254.354 0.3763 
1 1 1 -3  76  11 o 7  3.74968e+00 8.58140e-01 7.74097e+01 274.250 3.41274e-01  -4.59265e+00 0.00000e+00 0.00000e+00 4.55281e+01 274.250 3.18816e+01 94.250  0.8833 
1 1 1 -3  76  12 o 9  8.85544e+00 7.02014e-01 1.65806e+02 181.005 -2.72267e+01 -4.77449e-01 0.00000e+00 0.00000e+00 1.56514e+02 181.005 9.29142e+00 1.005   0.9815 
1 1 1 -3  76  13 f 0  2.79008e+00 8.74440e-01 9.23082e+01 43.641  3.24534e+00  3.09496e+00  0.00000e+00 0.00000e+00 1.34700e+00 223.641 9.36552e+01 223.641 0.8799 
1 1 1 -3  76  14 o 5  7.20315e+00 1.15238e+00 1.12647e+02 277.496 1.71146e+00  -1.30062e+01 0.00000e+00 0.00000e+00 1.43622e+02 277.496 3.09746e+01 277.496 0.9611 
1 1 1 -3  76  15 o 14 3.70536e+00 1.17348e+00 6.94292e+01 62.607  2.29783e+00  4.43420e+00  0.00000e+00 0.00000e+00 5.29687e+01 62.607  1.64605e+01 242.607 0.8932 
1 1 1 -3  76  16 o 17 4.56082e+00 1.28658e+00 5.96203e+01 259.258 -1.00233e+00 -5.28366e+00 0.00000e+00 0.00000e+00 9.22593e+01 259.258 3.26390e+01 259.258 0.9015 
1 1 1 -3  77  1  o 13 7.79068e+00 6.20023e-01 1.20467e+02 227.393 -4.61127e+00 -5.01355e+00 0.00000e+00 0.00000e+00 1.47782e+02 227.393 2.73150e+01 227.393 0.9234 
1 1 1 -3  77  2  o 16 1.78125e+01 4.92665e-01 3.37267e+02 295.495 2.02078e+01  -4.23757e+01 0.00000e+00 0.00000e+00 3.19699e+02 295.495 1.75683e+01 115.495 0.9893 
1 1 1 -3  77  3  o 1  1.03683e+01 5.47055e-01 1.43209e+02 308.523 7.32064e+00  -9.19558e+00 0.00000e+00 0.00000e+00 2.26408e+02 308.523 8.31986e+01 308.523 0.9565 
1 1 1 -3  77  4  o 15 9.18750e+00 4.22943e-01 2.04488e+02 22.619  1.54291e+01  6.42845e+00  0.00000e+00 0.00000e+00 1.27426e+02 22.619  7.70621e+01 202.619 0.9696 
1 1 1 -3  77  5  o 15 1.86447e+01 4.92870e-01 2.80766e+02 138.218 -3.81797e+01 3.41153e+01  0.00000e+00 0.00000e+00 4.06827e+02 138.218 1.26062e+02 138.218 0.9902 
1 1 1 -3  77  6  o 8  2.31863e+00 6.53270e-01 2.66174e+01 24.565  5.83674e-01  2.66794e-01  0.00000e+00 0.00000e+00 2.54848e-01 204.565 2.68723e+01 204.565 0.3054 
1 1 1 -3  77  7  o 18 1.08479e+01 4.44449e-01 1.90043e+02 41.581  1.66870e+01  1.48057e+01  0.00000e+00 0.00000e+00 2.04432e+02 41.581  1.43891e+01 41.581  0.9773 
1 1 1 -3  77  8  o 6  4.95175e+00 6.37098e-01 7.50894e+01 215.786 -3.69823e+00 -2.66590e+00 0.00000e+00 0.00000e+00 8.73268e+01 215.786 1.22374e+01 215.786 0.8820 
1 1 1 -3  77  9  f 0  4.45083e+00 7.34801e-01 1.68295e+02 268.998 -1.72552e-01 -9.86191e+00 0.00000e+00 0.00000e+00 1.15140e+01 88.998  1.79809e+02 88.998  0.9479 
1 1 1 -3  77  10 o 19 1.27408e+01 5.21984e-01 2.32113e+02 224.062 -3.55265e+01 -3.43817e+01 0.00000e+00 0.00000e+00 2.36228e+02 224.062 4.11490e+00 224.062 0.9898 
1 1 1 -3  77  11 o 10 5.28870e+00 8.53043e-01 9.65530e+01 314.323 5.78888e+00  -5.92722e+00 0.00000e+00 0.00000e+00 8.74454e+01 314.323 9.10756e+00 134.323 0.9376 
1 1 1 -3  77  12 o 10 3.78351e+00 9.69195e-01 4.95771e+01 47.222  2.01829e+00  2.18120e+00  0.00000e+00 0.00000e+00 6.37542e+01 47.222  1.41771e+01 47.222  0.8079 
1 1 1 -3  77  13 o 6  5.84466e+00 1.01692e+00 6.54622e+01 98.031  -8.82672e-01 6.25563e+00  0.00000e+00 0.00000e+00 1.33088e+02 98.031  6.76254e+01 98.031  0.9170 
1 1 1 -3  77  14 o 5  3.63747e+00 1.13694e+00 9.93152e+01 30.546  5.36410e+00  3.16551e+00  0.00000e+00 0.00000e+00 2.39676e+01 30.546  7.53475e+01 210.546 0.9158 
1 1 1 -3  77  15 o 16 2.89228e+00 9.83527e-01 5.26646e+01 196.824 -3.27954e+00 -9.91621e-01 0.00000e+00 0.00000e+00 3.68562e+01 196.824 1.58084e+01 16.824  0.8372 
1 1 1 -3  77  16 o 1  4.41322e+00 1.29309e+00 1.09921e+02 282.178 1.97327e+00  -9.14388e+00 0.00000e+00 0.00000e+00 4.40974e+01 282.178 6.58237e+01 102.178 0.9449 
1 1 1 -3  78  1  o 16 7.37812e+00 7.64548e-01 1.22241e+02 299.746 3.59592e+00  -6.29269e+00 0.00000e+00 0.00000e+00 1.33077e+02 299.746 1.08365e+01 299.746 0.9282 
1 1 1 -3  78  2  o 17 9.83879e+00 5.84223e-01 1.36760e+02 29.543  9.20597e+00  5.21761e+00  0.00000e+00 0.00000e+00 2.12184e+02 29.543  7.54244e+01 29.543  0.9515 
1 1 1 -3  78  3  o 15 7.55740e+00 4.83123e-01 1.21508e+02 351.432 8.02396e+00  -1.20893e+00 0.00000e+00 0.00000e+00 1.42137e+02 351.432 2.06290e+01 351.432 0.9362 
1 1 1 -3  78  4  o 6  1.19252e+01 4.02649e-01 1.83479e+02 120.875 -1.05330e+01 1.76169e+01  0.00000e+00 0.00000e+00 2.49787e+02 120.875 6.63083e+01 120.875 0.9753 
1 1 1 -3  78  5  o 9  1.33630e+01 4.89400e-01 2.95560e+02 245.729 -1.60366e+01 -3.55656e+01 0.00000e+00 0.00000e+00 1.95608e+02 245.729 9.99518e+01 65.729  0.9871 
1 1 1 -3  78  6  o 15 1.15654e+01 4.23852e-01 2.16902e+02 151.331 -2.51369e+01 1.37441e+01  0.00000e+00 0.00000e+00 2.05973e+02 151.331 1.09290e+01 331.331 0.9824 
1 1 1 -3  78  7  o 19 1.28752e+01 4.35060e-01 2.33210e+02 306.370 2.21114e+01  -3.00235e+01 0.00000e+00 0.00000e+00 2.39279e+02 306.370 6.06983e+00 306.370 0.9865 
1 1 1 -3  78  8  o 12 3.67850e+00 7.09430e-01 5.42622e+01 313.436 1.72791e+00  -1.82494e+00 0.00000e+00 0.00000e+00 5.05547e+01 313.436 3.70752e+00 133.436 0.7664 
1 1 1 -3  78  9  o 10 1.13226e+01 5.00288e-01 2.13113e+02 151.885 -3.32704e+01 1.77757e+01  0.00000e+00 0.00000e+00 2.01961e+02 151.885 1.11520e+01 331.885 0.9867 
1 1 1 -3  78  10 o 10 2.19617e+00 7.02625e-01 2.00660e+01 307.096 4.14414e-01  -5.48031e-01 0.00000e+00 0.00000e+00 6.41373e+00 307.096 1.36523e+01 127.096 0.3247 
1 1 1 -3  78  11 o 1  1.09384e+01 5.89816e-01 1.76664e+02 52.100  2.02402e+01  2.59998e+01  0.00000e+00 0.00000e+00 2.22949e+02 52.100  4.62851e+01 52.100  0.9847 
1 1 1 -3  78  12 o 11 8.85963e+00 7.43911e-01 1.26766e+02 167.844 -1.85717e+01 4.00034e+00  0.00000e+00 0.00000e+00 1.92894e+02 167.844 6.61280e+01 167.844 0.9733 
1 1 1 -3  78  13 o 17 5.11715e+00 1.05345e+00 4.97105e+01 313.573 2.90749e+00  -3.05600e+00 0.00000e+00 0.00000e+00 1.15443e+02 313.573 6.57329e+01 313.573 0.8714 
1 1 1 -3  78  14 o 16 5.27548e+00 1.31461e+00 8.33350e+01 214.042 -5.45081e+00 -3.68244e+00 0.00000e+00 0.00000e+00 9.63488e+01 214.042 1.30138e+01 214.042 0.9205 
1 1 1 -3  78  15 o 6  5.60701e+00 1.27967e+00 9.69227e+01 65.633  3.98893e+00  8.80687e+00  0.00000e+00 0.00000e+00 9.93082e+01 65.633  2.38551e+00 65.633  0.9468 
1 1 1 -3  78  16 o 1  3.57003e+00 1.16828e+00 5.86142e+01 133.902 -3.08117e+00 3.20155e+00  0.00000e+00 0.00000e+00 5.72121e+01 133.902 1.40214e+00 313.902 0.8786 
1 1 1 -3  79  1  o 6  4.31468e+00 8.02997e-01 1.35274e+02 322.190 3.77194e+00  -2.92683e+00 0.00000e+00 0.00000e+00 7.51668e+00 322.190 1.27757e+02 142.190 0.8879 
1 1 1 -3  79  2  o 6  1.11637e+01 5.05965e-01 2.27659e+02 123.832 -1.24529e+01 1.85791e+01  0.00000e+00 0.00000e+00 1.78953e+02 123.832 4.87067e+01 303.832 0.9774 
1 1 1 -3  79  3  o 16 8.00512e+00 4.86939e-01 1.45700e+02 327.083 9.08196e+00  -5.87918e+00 0.00000e+00 0.00000e+00 1.38398e+02 327.083 7.30142e+00 147.083 0.9526 
1 1 1 -3  79  4  o 11 1.21075e+01 4.05078e-01 2.33776e+02 124.742 -1.59832e+01 2.30465e+01  0.00000e+00 0.00000e+00 2.09030e+02 124.742 2.47455e+01 304.742 0.9820 
1 1 1 -3  79  5  o 16 1.05395e+01 4.83117e-01 1.78707e+02 123.094 -1.13022e+01 1.73415e+01  0.00000e+00 0.00000e+00 2.04061e+02 123.094 2.53538e+01 123.094 0.9755 
1 1 1 -3  79  6  o 12 1.18174e+01 4.21261e-01 1.84835e+02 125.745 -1.48540e+01 2.06369e+01  0.00000e+00 0.00000e+00 2.46171e+02 125.745 6.13359e+01 125.745 0.9801 
1 1 1 -3  79  7  o 6  6.65080e+00 5.19575e-01 1.05337e+02 71.525  2.99577e+00  8.96628e+00  0.00000e+00 0.00000e+00 1.28546e+02 71.525  2.32091e+01 71.525  0.9455 
1 1 1 -3  79  8  o 6  7.30706e+00 5.24595e-01 1.18774e+02 14.620  1.19540e+01  3.11829e+00  0.00000e+00 0.00000e+00 1.41597e+02 14.620  2.28238e+01 14.620  0.9586 
1 1 1 -3  79  9  o 14 1.33859e+01 4.87609e-01 2.28580e+02 218.969 -3.56573e+01 -2.88428e+01 0.00000e+00 0.00000e+00 2.63209e+02 218.969 3.46289e+01 218.969 0.9890 
1 1 1 -3  79  10 o 2  7.71189e+00 6.43716e-01 1.19620e+02 39.305  1.19004e+01  9.74221e+00  0.00000e+00 0.00000e+00 1.57181e+02 39.305  3.75611e+01 39.305  0.9669 
1 1 1 -3  79  11 o 19 1.71483e+01 5.56462e-01 2.98477e+02 195.622 -9.24660e+01 -2.58546e+01 0.00000e+00 0.00000e+00 3.34273e+02 195.622 3.57959e+01 195.622 0.9948 
1 1 1 -3  79  12 o 6  4.24378e+00 9.74316e-01 5.89173e+01 272.775 1.95295e-01  -4.02980e+00 0.00000e+00 0.00000e+00 7.71060e+01 272.775 1.81888e+01 272.775 0.8648 
1 1 1 -3  79  13 o 19 3.49180e+00 9.93449e-01 4.50030e+01 42.019  2.08257e+00  1.87637e+00  0.00000e+00 0.00000e+00 5.76999e+01 42.019  1.26969e+01 42.019  0.7943 
1 1 1 -3  79  14 o 11 9.09801e+00 1.09246e+00 1.14033e+02 53.554  1.14644e+01  1.55240e+01  0.00000e+00 0.00000e+00 2.13699e+02 53.554  9.96666e+01 53.554  0.9737 
1 1 1 -3  79  15 o 14 4.59102e+00 1.22741e+00 8.54697e+01 172.906 -7.15885e+00 8.90907e-01  0.00000e+00 0.00000e+00 7.19578e+01 172.906 1.35119e+01 352.906 0.9278 
1 1 1 -3  79  16 o 2  3.39908e+00 1.12524e+00 7.16888e+01 290.054 1.92251e+00  -5.26658e+00 0.00000e+00 0.00000e+00 4.19723e+01 290.054 2.97165e+01 110.054 0.9058 
1 1 1 -3  80  1  o 15 1.62011e+01 5.70946e-01 3.30429e+02 265.420 -3.91274e+00 -4.88497e+01 0.00000e+00 0.00000e+00 2.67122e+02 265.420 6.33068e+01 85.421  0.9897 
1 1 1 -3  80  2  o 10 2.12904e+01 5.23337e-01 4.14067e+02 181.419 -8.12010e+01 -2.01129e+00 0.00000e+00 0.00000e+00 3.74264e+02 181.419 3.98033e+01 1.419   0.9938 
1 1 1 -3  80  3  o 8  5.57522e+00 6.43369e-01 8.30060e+01 263.370 -4.79186e-01 -4.12261e+00 0.00000e+00 0.00000e+00 9.74657e+01 263.370 1.44597e+01 263.370 0.8691 
1 1 1 -3  80  4  o 2  8.80175e+00 4.32032e-01 1.41638e+02 237.889 -6.61939e+00 -1.05477e+01 0.00000e+00 0.00000e+00 1.72647e+02 237.889 3.10092e+01 237.889 0.9590 
1 1 1 -3  80  5  o 10 1.60457e+01 4.52438e-01 2.59051e+02 198.371 -4.48393e+01 -1.48907e+01 0.00000e+00 0.00000e+00 3.31818e+02 198.371 7.27669e+01 198.371 0.9894 
1 1 1 -3  80  6  f 0  4.26823e+00 6.46791e-01 1.00636e+02 48.394  3.20614e+00  3.61047e+00  0.00000e+00 0.00000e+00 4.05694e+01 48.394  6.00666e+01 228.394 0.8892 
1 1 1 -3  80  7  o 6  1.06468e+01 4.50924e-01 1.79060e+02 128.480 -1.52445e+01 1.91789e+01  0.00000e+00 0.00000e+00 2.08662e+02 128.480 2.96027e+01 128.480 0.9794 
1 1 1 -3  80  8  o 6  7.07691e+00 5.74256e-01 1.31681e+02 38.260  1.07306e+01  8.46246e+00  0.00000e+00 0.00000e+00 1.21501e+02 38.260  1.01803e+01 218.260 0.9627 
1 1 1 -3  80  9  o 11 2.72444e+00 7.55425e-01 3.33568e+01 186.092 -1.40904e+00 -1.50374e-01 0.00000e+00 0.00000e+00 2.48173e+01 186.092 8.53946e+00 6.092   0.5749 
1 1 1 -3  80  10 o 17 5.24458e+00 7.96980e-01 1.37181e+02 131.484 -6.92223e+00 7.82855e+00  0.00000e+00 0.00000e+00 4.78978e+01 131.484 8.92830e+01 311.484 0.9509 
1 1 1 -3  80  11 o 1  6.36687e+00 7.87163e-01 9.95518e+01 274.782 8.63296e-01  -1.03188e+01 0.00000e+00 0.00000e+00 1.24851e+02 274.782 2.52990e+01 274.782 0.9504 
1 1 1 -3  80  12 o 16 3.50846e+00 9.50879e-01 1.13303e+02 76.005  1.52054e+00  6.10094e+00  0.00000e+00 0.00000e+00 5.85692e+00 76.005  1.07446e+02 256.005 0.9166 
1 1 1 -3  80  13 o 18 3.27082e+00 9.85893e-01 7.87134e+01 207.560 -4.37330e+00 -2.28240e+00 0.00000e+00 0.00000e+00 2.92745e+01 207.560 4.94389e+01 27.560  0.8918 
1 1 1 -3  80  14 o 18 3.81753e+00 1.16141e+00 6.00509e+01 144.646 -3.47700e+00 2.46676e+00  0.00000e+00 0.00000e+00 6.32023e+01 144.646 3.15137e+00 144.646 0.8729 
1 1 1 -3  80  15 o 9  8.23138e+00 1.32762e+00 1.39201e+02 350.214 2.10983e+01  -3.63915e+00 0.00000e+00 0.00000e+00 1.57748e+02 350.214 1.85465e+01 350.214 0.9764 
1 1 1 -3  80  16 f 0  4.87718e+00 1.39119e+00 7.91789e+01 157.948 -6.76945e+00 2.74219e+00  0.00000e+00 0.00000e+00 8.80129e+01 157.948 8.83401e+00 157.948 0.9288 
1 1 1 -3  81  1  o 3  5.21444e+00 6.26861e-01 1.91581e+02 191.408 -8.83128e+00 -1.78199e+00 0.00000e+00 0.00000e+00 8.42726e+00 11.408  2.00008e+02 11.408  0.9428 
1 1 1 -3  81  2  o 10 6.21013e+00 6.23504e-01 7.40934e+01 237.831 -2.33399e+00 -3.71078e+00 0.00000e+00 0.00000e+00 1.28733e+02 237.831 5.46400e+01 237.831 0.8768 
1 1 1 -3  81  3  o 3  1.35936e+01 4.93301e-01 2.65624e+02 89.540  2.85972e-01  3.56475e+01  0.00000e+00 0.00000e+00 2.33438e+02 89.540  3.21865e+01 269.540 0.9859 
1 1 1 -3  81  4  o 2  1.83627e+01 4.27812e-01 3.61985e+02 333.973 6.51325e+01  -3.18054e+01 0.00000e+00 0.00000e+00 3.16864e+02 333.973 4.51206e+01 153.973 0.9931 
1 1 1 -3  81  5  o 12 6.96083e+00 4.83991e-01 1.37377e+02 161.662 -1.04433e+01 3.46141e+00  0.00000e+00 0.00000e+00 1.09580e+02 161.662 2.77970e+01 341.662 0.9534 
1 1 1 -3  81  6  o 13 8.77460e+00 4.71772e-01 1.74259e+02 38.332  1.56422e+01  1.23679e+01  0.00000e+00 0.00000e+00 1.43820e+02 38.332  3.04383e+01 218.332 0.9746 
1 1 1 -3  81  7  o 18 5.48706e+00 6.12385e-01 7.08474e+01 318.183 3.75912e+00  -3.36306e+00 0.00000e+00 0.00000e+00 1.11595e+02 318.183 4.07477e+01 318.183 0.8944 
1 1 1 -3  81  8  o 7  8.07638e+00 6.04944e-01 1.21679e+02 191.604 -1.37138e+01 -2.81608e+00 0.00000e+00 0.00000e+00 1.67468e+02 191.604 4.57894e+01 191.604 0.9636 
1 1 1 -3  81  9  f 0  6.60782e+00 6.27188e-01 1.56827e+02 106.833 -4.82966e+00 1.59633e+01  0.00000e+00 0.00000e+00 8.10509e+01 106.833 7.57758e+01 286.833 0.9695 
1 1 1 -3  81  10 o 10 5.34066e+00 8.13836e-01 1.07529e+02 275.424 8.12895e-01  -8.56173e+00 0.00000e+00 0.00000e+00 7.87284e+01 275.424 2.88003e+01 95.424  0.9399 
1 1 1 -3  81  11 o 13 2.40952e+00 7.68668e-01 8.59906e+01 47.554  2.62934e+00  2.87485e+00  0.00000e+00 0.00000e+00 9.21599e+00 227.554 9.52066e+01 227.554 0.8594 
1 1 1 -3  81  12 o 9  7.38944e+00 8.72788e-01 1.29025e+02 211.249 -1.44917e+01 -8.79346e+00 0.00000e+00 0.00000e+00 1.36520e+02 211.249 7.49505e+00 211.249 0.9700 
1 1 1 -3  81  13 o 3  2.76111e+00 8.59407e-01 4.18798e+01 122.562 -1.22345e+00 1.91582e+00  0.00000e+00 0.00000e+00 3.35307e+01 122.562 8.34911e+00 302.562 0.7379 
1 1 1 -3  81  14 o 3  4.04965e+00 1.17061e+00 3.77951e+01 276.339 3.28206e-01  -2.95461e+00 0.00000e+00 0.00000e+00 8.31932e+01 276.339 4.53981e+01 276.339 0.8080 
1 1 1 -3  81  15 o 14 5.87088e+00 1.29880e+00 1.20234e+02 189.455 -1.30849e+01 -2.17915e+00 0.00000e+00 0.00000e+00 8.82974e+01 189.455 3.19369e+01 9.455   0.9615 
1 1 1 -3  82  1  o 10 5.31570e+00 7.29051e-01 6.22961e+01 72.105  9.55633e-01  2.95965e+00  0.00000e+00 0.00000e+00 9.96329e+01 72.105  3.73368e+01 72.105  0.8178 
1 1 1 -3  82  2  o 15 6.96528e+00 5.72832e-01 1.60062e+02 99.326  -1.76059e+00 1.07202e+01  0.00000e+00 0.00000e+00 8.70887e+01 99.326  7.29735e+01 279.326 0.9528 
1 1 1 -3  82  3  o 2  4.47276e+00 7.04942e-01 9.20601e+01 37.486  3.40713e+00  2.61306e+00  0.00000e+00 0.00000e+00 5.34721e+01 37.486  3.85880e+01 217.486 0.8739 
1 1 1 -3  82  4  f 0  1.26409e+01 4.97821e-01 2.73600e+02 58.253  1.97508e+01  3.19204e+01  0.00000e+00 0.00000e+00 1.90564e+02 58.253  8.30364e+01 238.253 0.9866 
1 1 1 -3  82  5  o 14 1.29235e+01 4.24549e-01 2.35749e+02 245.960 -1.46886e+01 -3.29297e+01 0.00000e+00 0.00000e+00 2.38338e+02 245.960 2.58945e+00 245.960 0.9860 
1 1 1 -3  82  6  o 11 5.04837e+00 6.22653e-01 7.49012e+01 25.971  4.44225e+00  2.16382e+00  0.00000e+00 0.00000e+00 9.25559e+01 25.971  1.76547e+01 25.971  0.8920 
1 1 1 -3  82  7  o 5  1.63510e+01 4.48142e-01 2.48267e+02 126.310 -3.51545e+01 4.78390e+01  0.00000e+00 0.00000e+00 3.54318e+02 126.310 1.06051e+02 126.310 0.9915 
1 1 1 -3  82  8  o 3  7.93408e+00 5.28971e-01 1.13590e+02 27.555  1.20526e+01  6.28879e+00  0.00000e+00 0.00000e+00 1.70073e+02 27.555  5.64827e+01 27.555  0.9625 
1 1 1 -3  82  9  o 14 3.47490e+00 8.03360e-01 7.56854e+01 334.065 3.52787e+00  -1.71572e+00 0.00000e+00 0.00000e+00 3.53142e+01 334.065 4.03712e+01 154.065 0.8605 
1 1 1 -3  82  10 o 12 5.87442e+00 7.78488e-01 7.12748e+01 74.765  1.73484e+00  6.36975e+00  0.00000e+00 0.00000e+00 1.29383e+02 74.765  5.81083e+01 74.765  0.9208 
1 1 1 -3  82  11 o 17 4.51641e+00 8.38534e-01 4.57462e+01 339.724 3.37050e+00  -1.24515e+00 0.00000e+00 0.00000e+00 9.58560e+01 339.724 5.01098e+01 339.724 0.8458 
1 1 1 -3  82  12 f 0  5.20565e+00 9.87387e-01 1.78761e+02 22.189  1.44831e+01  5.90718e+00  0.00000e+00 0.00000e+00 7.77364e+00 22.189  1.70987e+02 202.189 0.9675 
1 1 1 -3  82  13 o 16 3.32562e+00 9.44478e-01 6.47896e+01 168.364 -4.17588e+00 8.59882e-01  0.00000e+00 0.00000e+00 4.26369e+01 168.364 2.21527e+01 348.365 0.8729 
1 1 1 -3  82  14 o 13 5.89559e+00 1.36326e+00 1.20794e+02 316.017 7.98368e+00  -7.70504e+00 0.00000e+00 0.00000e+00 8.70958e+01 316.017 3.36986e+01 136.017 0.9538 
1 1 1 -3  82  15 o 11 3.96493e+00 1.21266e+00 2.60694e+01 356.069 2.05720e+00  -1.41375e-01 0.00000e+00 0.00000e+00 7.75626e+01 356.069 5.14933e+01 356.069 0.7077 
1 1 1 -3  83  1  o 16 4.07784e+00 8.19926e-01 6.74533e+01 30.245  2.40156e+00  1.40027e+00  0.00000e+00 0.00000e+00 5.28668e+01 30.245  1.45865e+01 210.245 0.7923 
1 1 1 -3  83  2  o 5  2.76980e+00 7.25838e-01 6.16418e+01 347.036 1.72396e+00  -3.96867e-01 0.00000e+00 0.00000e+00 6.00523e+00 347.036 5.56366e+01 167.036 0.6560 
1 1 1 -3  83  3  o 7  6.66010e+00 5.95845e-01 5.58825e+01 222.565 -3.01928e+00 -2.77297e+00 0.00000e+00 0.00000e+00 1.59111e+02 222.565 1.03228e+02 222.565 0.8672 
1 1 1 -3  83  4  o 10 3.05462e+00 7.58541e-01 5.38927e+01 285.615 4.46366e-01  -1.59704e+00 0.00000e+00 0.00000e+00 1.80429e+01 285.615 3.58498e+01 105.615 0.6329 
1 1 1 -3  83  5  o 13 3.74053e+00 6.85738e-01 1.54232e+02 98.970  -1.10685e+00 7.01185e+00  0.00000e+00 0.00000e+00 2.53121e+01 278.970 1.79544e+02 278.970 0.9266 
1 1 1 -3  83  6  f 0  7.03111e+00 5.22177e-01 1.57264e+02 114.925 -6.48881e+00 1.39629e+01  0.00000e+00 0.00000e+00 9.55038e+01 114.925 6.17598e+01 294.925 0.9670 
1 1 1 -3  83  7  o 4  5.14676e+00 6.75966e-01 1.20310e+02 221.029 -6.28287e+00 -5.46719e+00 0.00000e+00 0.00000e+00 5.90597e+01 221.029 6.12505e+01 41.029  0.9379 
1 1 1 -3  83  8  o 4  6.19456e+00 6.24548e-01 1.10128e+02 18.934  1.06222e+01  3.64391e+00  0.00000e+00 0.00000e+00 1.09428e+02 18.934  7.00002e-01 198.934 0.9544 
1 1 1 -3  83  9  o 18 8.50206e+00 5.75669e-01 1.72239e+02 127.580 -1.52583e+01 1.98273e+01  0.00000e+00 0.00000e+00 1.36931e+02 127.580 3.53079e+01 307.580 0.9798 
1 1 1 -3  83  10 o 15 4.70046e+00 8.43161e-01 9.81674e+01 277.379 9.75496e-01  -7.53296e+00 0.00000e+00 0.00000e+00 6.42441e+01 277.379 3.39233e+01 97.379  0.9316 
1 1 1 -3  83  11 o 3  2.40130e+00 7.74692e-01 3.78673e+00 346.749 1.61990e-01  -3.81468e-02 0.00000e+00 0.00000e+00 3.59270e+00 346.749 1.94037e-01 166.749 0.0829 
1 1 1 -3  83  12 o 1  4.68799e+00 1.00951e+00 7.57190e+01 41.515  4.53081e+00  4.01071e+00  0.00000e+00 0.00000e+00 8.27946e+01 41.515  7.07559e+00 41.515  0.9131 
1 1 1 -3  83  13 f 0  3.03442e+00 9.34022e-01 7.48207e+01 128.722 -2.78729e+00 3.47638e+00  0.00000e+00 0.00000e+00 2.38595e+01 128.722 5.09612e+01 308.722 0.8790 
1 1 1 -3  83  14 o 5  3.06532e+00 1.00407e+00 7.61837e+01 74.773  1.34368e+00  4.93634e+00  0.00000e+00 0.00000e+00 2.53315e+01 74.773  5.08522e+01 254.773 0.8960 
1 1 1 -3  83  15 o 13 3.90771e+00 1.15724e+00 6.60164e+01 78.107  1.16320e+00  5.52334e+00  0.00000e+00 0.00000e+00 6.47742e+01 78.107  1.24222e+00 258.107 0.9065 
1 1 1 -3  84  1  o 13 9.97082e+00 5.70695e-01 1.21732e+02 55.244  7.31999e+00  1.05493e+01  0.00000e+00 0.00000e+00 2.34738e+02 55.244  1.13006e+02 55.244  0.9602 
1 1 1 -3  84  2  o 3  7.61460e+00 6.26170e-01 2.21027e+02 247.936 -6.90744e+00 -1.70413e+01 0.00000e+00 0.00000e+00 5.46011e+01 247.936 1.66426e+02 67.936  0.9724 
1 1 1 -3  84  3  o 11 6.59681e+00 6.23018e-01 1.19599e+02 278.492 1.29727e+00  -8.68830e+00 0.00000e+00 0.00000e+00 1.11467e+02 278.492 8.13219e+00 98.492  0.9412 
1 1 1 -3  84  4  o 10 6.19879e+00 6.35686e-01 1.20126e+02 55.130  5.04252e+00  7.23624e+00  0.00000e+00 0.00000e+00 9.69823e+01 55.130  2.31434e+01 235.130 0.9415 
1 1 1 -3  84  5  o 2  3.20413e+00 7.62771e-01 4.63144e+01 45.848  1.29003e+00  1.32879e+00  0.00000e+00 0.00000e+00 3.37438e+01 45.848  1.25706e+01 225.848 0.6719 
1 1 1 -3  84  6  o 8  6.21890e+00 5.37927e-01 7.41871e+01 281.374 1.29200e+00  -6.42260e+00 0.00000e+00 0.00000e+00 1.38510e+02 281.374 6.43232e+01 281.374 0.9202 
1 1 1 -3  84  7  o 3  1.01183e+01 4.78465e-01 1.74840e+02 26.702  2.48664e+01  1.25076e+01  0.00000e+00 0.00000e+00 1.94244e+02 26.702  1.94045e+01 26.702  0.9819 
1 1 1 -3  84  8  o 2  1.07316e+01 5.00068e-01 2.56708e+02 146.106 -3.84792e+01 2.58511e+01  0.00000e+00 0.00000e+00 1.37424e+02 146.106 1.19285e+02 326.106 0.9892 
1 1 1 -3  84  9  o 5  9.25519e+00 5.64602e-01 1.81238e+02 307.465 1.84380e+01  -2.40596e+01 0.00000e+00 0.00000e+00 1.56464e+02 307.465 2.47738e+01 127.465 0.9834 
1 1 1 -3  84  10 o 13 2.32082e+00 7.38963e-01 2.55655e+01 143.062 -7.92288e-01 5.95680e-01  0.00000e+00 0.00000e+00 1.25802e+01 143.062 1.29854e+01 323.062 0.4433 
1 1 1 -3  84  11 o 15 2.51575e+00 7.78136e-01 2.18323e+01 241.012 -5.06155e-01 -9.13580e-01 0.00000e+00 0.00000e+00 2.12226e+01 241.012 6.09766e-01 61.012  0.4619 
1 1 1 -3  84  12 o 16 4.79604e+00 1.01762e+00 8.73990e+01 17.682  7.00550e+00  2.23329e+00  0.00000e+00 0.00000e+00 7.75946e+01 17.682  9.80442e+00 197.682 0.9293 
1 1 1 -3  84  13 o 9  7.33859e+00 1.00855e+00 1.05245e+02 252.844 -4.51408e+00 -1.46223e+01 0.00000e+00 0.00000e+00 1.57168e+02 252.844 5.19235e+01 252.844 0.9668 
1 1 1 -3  84  14 o 9  9.49625e+00 1.15755e+00 2.09829e+02 126.055 -2.24437e+01 3.08290e+01  0.00000e+00 0.00000e+00 1.36451e+02 126.055 7.33777e+01 306.055 0.9868 
1 1 1 -3  84  15 o 17 6.87156e+00 1.29275e+00 1.54476e+02 281.273 3.93402e+00  -1.97356e+01 0.00000e+00 0.00000e+00 9.28058e+01 281.273 6.16702e+01 101.273 0.9748 
1 1 1 -3  85  1  o 6  8.26384e+00 6.07910e-01 1.00795e+02 322.742 7.01007e+00  -5.33203e+00 0.00000e+00 0.00000e+00 1.88784e+02 322.742 8.79895e+01 322.742 0.9414 
1 1 1 -3  85  2  o 19 9.35237e+00 5.81180e-01 1.86257e+02 237.099 -1.06392e+01 -1.64451e+01 0.00000e+00 0.00000e+00 1.52791e+02 237.099 3.34661e+01 57.099  0.9741 
1 1 1 -3  85  3  o 1  6.79539e+00 5.41920e-01 1.33038e+02 188.104 -1.03285e+01 -1.47067e+00 0.00000e+00 0.00000e+00 1.07346e+02 188.104 2.56923e+01 8.104   0.9508 
1 1 1 -3  85  4  o 3  6.05603e+00 6.49769e-01 9.51744e+01 329.846 6.48153e+00  -3.76544e+00 0.00000e+00 0.00000e+00 1.14454e+02 329.846 1.92793e+01 329.846 0.9307 
1 1 1 -3  85  5  o 5  8.31918e+00 5.78684e-01 1.64366e+02 37.250  1.49158e+01  1.13424e+01  0.00000e+00 0.00000e+00 1.36556e+02 37.250  2.78095e+01 217.250 0.9729 
1 1 1 -3  85  6  o 10 3.62485e+00 6.86907e-01 9.29267e+01 341.205 4.50510e+00  -1.53325e+00 0.00000e+00 0.00000e+00 2.66190e+01 341.205 6.63078e+01 161.205 0.8875 
1 1 1 -3  85  7  o 13 3.53055e+00 7.73220e-01 3.36650e+01 24.678  1.47132e+00  6.76053e-01  0.00000e+00 0.00000e+00 4.81937e+01 24.678  1.45287e+01 24.678  0.6243 
1 1 1 -3  85  8  o 15 1.27708e+01 4.89515e-01 2.10161e+02 160.011 -4.24102e+01 1.54267e+01  0.00000e+00 0.00000e+00 2.58612e+02 160.011 4.84513e+01 160.011 0.9889 
1 1 1 -3  85  9  o 3  6.90606e+00 6.67226e-01 1.10650e+02 204.266 -1.23353e+01 -5.56071e+00 0.00000e+00 0.00000e+00 1.35884e+02 204.266 2.52338e+01 204.266 0.9623 
1 1 1 -3  85  10 o 3  2.66184e+00 8.00234e-01 4.95535e+01 117.332 -1.11912e+00 2.16528e+00  0.00000e+00 0.00000e+00 2.52439e+01 117.332 2.43095e+01 297.332 0.7580 
1 1 1 -3  85  11 o 3  4.77185e+00 9.34430e-01 4.75983e+01 297.308 1.75495e+00  -3.39895e+00 0.00000e+00 0.00000e+00 1.03788e+02 297.308 5.61898e+01 297.308 0.8565 
1 1 1 -3  85  12 o 18 1.38232e+01 6.82544e-01 2.06334e+02 252.701 -1.97773e+01 -6.35036e+01 0.00000e+00 0.00000e+00 3.01425e+02 252.701 9.50913e+01 252.701 0.9925 
1 1 1 -3  85  13 o 9  7.64833e+00 9.78278e-01 1.16753e+02 105.598 -5.16210e+00 1.84912e+01  0.00000e+00 0.00000e+00 1.58608e+02 105.598 4.18552e+01 105.598 0.9736 
1 1 1 -3  85  14 o 19 4.34457e+00 1.22601e+00 1.14867e+01 325.234 7.71158e-01  -5.35291e-01 0.00000e+00 0.00000e+00 5.66096e+01 325.234 4.51229e+01 325.234 0.4243 
1 1 1 -3  85  15 o 19 5.72391e+00 1.25774e+00 1.15406e+02 281.695 2.71617e+00  -1.31214e+01 0.00000e+00 0.00000e+00 8.78030e+01 281.695 2.76035e+01 101.695 0.9619 
1 1 1 -3  86  1  o 8  1.49558e+01 5.47752e-01 2.44256e+02 346.516 4.10177e+01  -9.83522e+00 0.00000e+00 0.00000e+00 3.05680e+02 346.516 6.14239e+01 346.516 0.9881 
1 1 1 -3  86  2  f 0  1.22502e+01 5.57646e-01 1.92977e+02 181.705 -2.71473e+01 -8.08314e-01 0.00000e+00 0.00000e+00 2.54341e+02 181.705 6.13644e+01 181.705 0.9814 
1 1 1 -3  86  3  o 3  4.78398e+00 8.10490e-01 5.37611e+01 276.541 3.45576e-01  -3.01371e+00 0.00000e+00 0.00000e+00 9.08084e+01 276.541 3.70473e+01 276.541 0.8124 
1 1 1 -3  86  4  o 4  1.00924e+01 5.28592e-01 1.64384e+02 349.898 2.06213e+01  -3.67382e+00 0.00000e+00 0.00000e+00 2.01822e+02 349.898 3.74385e+01 349.898 0.9758 
1 1 1 -3  86  5  o 16 8.50489e+00 5.80266e-01 1.62555e+02 292.776 7.50537e+00  -1.78751e+01 0.00000e+00 0.00000e+00 1.45302e+02 292.776 1.72523e+01 112.776 0.9739 
1 1 1 -3  86  6  o 6  4.11153e+00 8.10099e-01 5.72316e+01 52.836  1.88177e+00  2.48240e+00  0.00000e+00 0.00000e+00 6.77421e+01 52.836  1.05105e+01 52.836  0.8181 
1 1 1 -3  86  7  o 19 5.05343e+00 6.86993e-01 9.46818e+01 154.410 -6.75602e+00 3.23546e+00  0.00000e+00 0.00000e+00 7.99516e+01 154.410 1.47303e+01 334.410 0.9306 
1 1 1 -3  86  8  o 7  1.88955e+00 6.20415e-01 3.13043e+01 320.369 7.65645e-01  -6.34096e-01 0.00000e+00 0.00000e+00 1.47712e-01 140.369 3.14520e+01 140.369 0.4443 
1 1 1 -3  86  9  o 11 4.00117e+00 8.35454e-01 1.14478e+02 202.971 -6.99944e+00 -2.96689e+00 0.00000e+00 0.00000e+00 2.37809e+01 202.971 9.06973e+01 22.971  0.9317 
1 1 1 -3  86  10 o 17 5.37514e+00 8.55735e-01 9.25093e+01 330.608 7.46056e+00  -4.20249e+00 0.00000e+00 0.00000e+00 9.46815e+01 330.608 2.17222e+00 330.608 0.9397 
1 1 1 -3  86  11 o 3  3.64574e+00 8.77726e-01 7.54389e+01 202.091 -4.58030e+00 -1.85903e+00 0.00000e+00 0.00000e+00 4.50008e+01 202.091 3.04381e+01 22.091  0.8920 
1 1 1 -3  86  12 o 11 1.36325e+01 6.87551e-01 2.00072e+02 30.789  5.09026e+01  3.03312e+01  0.00000e+00 0.00000e+00 3.00096e+02 30.789  1.00024e+02 30.789  0.9915 
1 1 1 -3  86  13 f 0  9.77761e+00 8.85319e-01 1.45924e+02 212.005 -2.97743e+01 -1.86087e+01 0.00000e+00 0.00000e+00 2.10373e+02 212.005 6.44489e+01 212.005 0.9857 
1 1 1 -3  86  14 o 17 1.26747e+01 1.08796e+00 2.04567e+02 50.780  3.73750e+01  4.57928e+01  0.00000e+00 0.00000e+00 2.59603e+02 50.780  5.50352e+01 50.780  0.9915 
1 1 1 -3  86  15 o 9  3.51690e+00 1.13953e+00 4.37207e+01 312.045 2.50347e+00  -2.77602e+00 0.00000e+00 0.00000e+00 6.69241e+01 312.045 2.32034e+01 312.045 0.8526 
1 1 1 -3  87  1  o 4  7.96578e+00 5.15333e-01 1.34043e+02 169.887 -1.35821e+01 2.42248e+00  0.00000e+00 0.00000e+00 1.51378e+02 169.887 1.73352e+01 169.887 0.9630 
1 1 1 -3  87  2  o 16 7.49294e+00 6.49200e-01 1.05124e+02 166.490 -9.96594e+00 2.39443e+00  0.00000e+00 0.00000e+00 1.59631e+02 166.490 5.45071e+01 166.490 0.9499 
1 1 1 -3  87  3  o 15 2.15541e+01 5.72117e-01 3.42270e+02 321.193 7.62033e+01  -6.12840e+01 0.00000e+00 0.00000e+00 4.55170e+02 321.193 1.12900e+02 321.193 0.9949 
1 1 1 -3  87  4  o 2  7.40036e+00 5.15125e-01 9.54032e+01 152.106 -8.31600e+00 4.40195e+00  0.00000e+00 0.00000e+00 1.64649e+02 152.106 6.92456e+01 152.106 0.9453 
1 1 1 -3  87  5  o 10 3.58621e+00 7.53880e-01 4.25702e+01 67.312  8.11236e-01  1.94045e+00  0.00000e+00 0.00000e+00 5.25832e+01 67.312  1.00130e+01 67.312  0.7140 
1 1 1 -3  87  6  o 17 1.13124e+01 5.69299e-01 1.82098e+02 174.895 -3.05803e+01 2.73194e+00  0.00000e+00 0.00000e+00 2.31185e+02 174.895 4.90874e+01 174.895 0.9836 
1 1 1 -3  87  7  o 6  2.59602e+00 7.11621e-01 6.40918e+01 70.746  8.48014e-01  2.42781e+00  0.00000e+00 0.00000e+00 1.03651e+01 70.746  5.37267e+01 250.746 0.7726 
1 1 1 -3  87  8  o 1  4.81360e+00 7.38119e-01 1.14730e+02 78.807  1.80115e+00  9.10267e+00  0.00000e+00 0.00000e+00 5.39514e+01 78.807  6.07781e+01 258.807 0.9445 
1 1 1 -3  87  9  o 7  5.63668e+00 7.44863e-01 6.21042e+01 69.797  2.13684e+00  5.80691e+00  0.00000e+00 0.00000e+00 1.29171e+02 69.797  6.70665e+01 69.797  0.9152 
1 1 1 -3  87  10 o 4  1.12336e+01 6.02249e-01 1.55574e+02 234.266 -2.02983e+01 -2.82124e+01 0.00000e+00 0.00000e+00 2.54632e+02 234.266 9.90581e+01 234.266 0.9855 
1 1 1 -3  87  11 o 12 4.69367e+00 9.90649e-01 1.05811e+02 108.627 -2.73877e+00 8.12551e+00  0.00000e+00 0.00000e+00 5.74989e+01 108.627 4.83125e+01 288.627 0.9397 
1 1 1 -3  87  12 o 13 4.69385e+00 1.07680e+00 1.03297e+02 224.211 -6.25514e+00 -6.08519e+00 0.00000e+00 0.00000e+00 6.00744e+01 224.211 4.32223e+01 44.211  0.9408 
1 1 1 -3  87  13 o 10 3.99823e+00 1.06625e+00 8.26754e+01 10.876  6.38382e+00  1.22660e+00  0.00000e+00 0.00000e+00 5.32085e+01 10.876  2.94669e+01 190.876 0.9195 
1 1 1 -3  87  14 o 4  3.30755e+00 1.08146e+00 5.64827e+01 332.113 3.70848e+00  -1.96246e+00 0.00000e+00 0.00000e+00 4.98552e+01 332.113 6.62752e+00 152.113 0.8706 
1 1 1 -3  87  15 o 8  2.66081e+00 9.20006e-01 6.22934e+01 141.579 -4.05452e+00 3.21596e+00  0.00000e+00 0.00000e+00 2.57810e+01 141.579 3.65123e+01 321.579 0.8973 
1 1 1 -3  88  1  o 7  4.00336e+00 6.81555e-01 7.80378e+01 336.163 3.66830e+00  -1.62072e+00 0.00000e+00 0.00000e+00 5.06105e+01 336.163 2.74273e+01 156.163 0.8639 
1 1 1 -3  88  2  o 16 3.15822e+00 7.96933e-01 9.65824e+01 181.021 -3.55467e+00 -6.33274e-02 0.00000e+00 0.00000e+00 2.53873e+00 181.021 9.40437e+01 1.021   0.8439 
1 1 1 -3  88  3  o 14 6.06110e+00 7.28410e-01 7.21536e+01 56.985  3.10746e+00  4.78236e+00  0.00000e+00 0.00000e+00 1.32343e+02 56.985  6.01899e+01 56.985  0.9075 
1 1 1 -3  88  4  f 0  5.51004e+00 7.68647e-01 1.13709e+02 133.564 -5.70824e+00 6.00171e+00  0.00000e+00 0.00000e+00 7.82864e+01 133.564 3.54229e+01 313.564 0.9375 
1 1 1 -3  88  5  o 18 4.88610e+00 7.76341e-01 7.68897e+01 25.390  4.55154e+00  2.16029e+00  0.00000e+00 0.00000e+00 8.54425e+01 25.390  8.55283e+00 25.390  0.8943 
1 1 1 -3  88  6  o 1  1.09450e+01 5.96137e-01 1.40266e+02 343.534 2.44961e+01  -7.24022e+00 0.00000e+00 0.00000e+00 2.58138e+02 343.534 1.17872e+02 343.534 0.9802 
1 1 1 -3  88  7  o 8  6.55684e+00 7.65842e-01 1.31100e+02 19.990  1.22662e+01  4.46202e+00  0.00000e+00 0.00000e+00 1.02743e+02 19.990  2.83578e+01 199.990 0.9609 
1 1 1 -3  88  8  o 4  7.48051e+00 5.98268e-01 1.24109e+02 19.000  1.60040e+01  5.51063e+00  0.00000e+00 0.00000e+00 1.45046e+02 19.000  2.09370e+01 19.000  0.9700 
1 1 1 -3  88  9  o 8  9.25325e+00 5.85035e-01 2.16598e+02 213.484 -3.26766e+01 -2.16153e+01 0.00000e+00 0.00000e+00 1.22015e+02 213.484 9.45828e+01 33.484  0.9872 
1 1 1 -3  88  10 o 5  5.25616e+00 8.94991e-01 9.06404e+01 62.178  3.95243e+00  7.48960e+00  0.00000e+00 0.00000e+00 9.21839e+01 62.178  1.54353e+00 62.178  0.9390 
1 1 1 -3  88  11 o 12 3.83084e+00 9.75920e-01 5.06913e+01 322.330 2.77284e+00  -2.14078e+00 0.00000e+00 0.00000e+00 6.86019e+01 322.330 1.79106e+01 322.330 0.8413 
1 1 1 -3  88  12 f 0  9.84140e+00 8.00040e-01 1.68892e+02 330.880 3.14506e+01  -1.75194e+01 0.00000e+00 0.00000e+00 1.90005e+02 330.880 2.11138e+01 330.880 0.9860 
1 1 1 -3  88  13 o 14 7.94464e+00 1.10470e+00 1.30755e+02 184.763 -2.08790e+01 -1.73957e+00 0.00000e+00 0.00000e+00 1.55727e+02 184.763 2.49719e+01 184.763 0.9758 
1 1 1 -3  88  14 o 14 8.26517e+00 1.24249e+00 1.32630e+02 76.499  5.17643e+00  2.15591e+01  0.00000e+00 0.00000e+00 1.65539e+02 76.499  3.29093e+01 76.499  0.9772 
1 1 1 -3  89  1  o 12 7.37110e+00 5.22863e-01 1.44853e+02 84.831  1.33987e+00  1.48127e+01  0.00000e+00 0.00000e+00 1.19881e+02 84.831  2.49718e+01 264.831 0.9658 
1 1 1 -3  89  2  o 4  7.25333e+00 5.29957e-01 9.22991e+01 304.885 5.08424e+00  -7.29217e+00 0.00000e+00 0.00000e+00 1.61725e+02 304.885 6.94258e+01 304.885 0.9420 
1 1 1 -3  89  3  o 9  1.05983e+01 5.79781e-01 1.94720e+02 96.274  -3.15914e+00 2.87358e+01  0.00000e+00 0.00000e+00 1.92342e+02 96.274  2.37803e+00 276.274 0.9825 
1 1 1 -3  89  4  o 18 9.24685e+00 6.72690e-01 1.42731e+02 277.132 2.20491e+00  -1.76220e+01 0.00000e+00 0.00000e+00 1.91038e+02 277.132 4.83070e+01 277.132 0.9714 
1 1 1 -3  89  5  o 18 3.62411e+00 7.63547e-01 5.50837e+01 58.387  1.45483e+00  2.36358e+00  0.00000e+00 0.00000e+00 5.15143e+01 58.387  3.56939e+00 238.387 0.7919 
1 1 1 -3  89  6  o 19 2.54587e+00 7.57639e-01 6.66935e+01 2.076   2.59251e+00  9.39883e-02  0.00000e+00 0.00000e+00 6.54469e+00 2.076   6.01488e+01 182.076 0.7749 
1 1 1 -3  89  7  o 19 7.98174e+00 6.93533e-01 1.16044e+02 39.180  1.08952e+01  8.87947e+00  0.00000e+00 0.00000e+00 1.69391e+02 39.180  5.33463e+01 39.180  0.9637 
1 1 1 -3  89  8  o 8  6.42614e+00 6.90043e-01 8.32635e+01 254.476 -2.55087e+00 -9.18330e+00 0.00000e+00 0.00000e+00 1.42178e+02 254.476 5.89141e+01 254.476 0.9460 
1 1 1 -3  89  9  o 7  3.18790e+00 8.57973e-01 8.27923e+01 230.998 -2.79597e+00 -3.45251e+00 0.00000e+00 0.00000e+00 2.10145e+01 230.998 6.17779e+01 50.998  0.8786 
1 1 1 -3  89  10 o 13 2.93768e+00 8.52154e-01 5.83816e+01 213.415 -2.52375e+00 -1.66508e+00 0.00000e+00 0.00000e+00 2.99305e+01 213.415 2.84511e+01 33.415  0.8117 
1 1 1 -3  89  11 o 9  3.19038e+00 9.38177e-01 7.94124e+00 265.798 -3.67410e-02 -5.00081e-01 0.00000e+00 0.00000e+00 2.07667e+01 265.798 1.28254e+01 265.798 0.2432 
1 1 1 -3  89  12 o 14 7.38318e+00 9.59180e-01 1.10706e+02 178.974 -1.67880e+01 3.00626e-01  0.00000e+00 0.00000e+00 1.54039e+02 178.974 4.33334e+01 178.974 0.9697 
1 1 1 -3  89  13 o 12 3.80394e+00 1.14029e+00 2.58969e+01 137.832 -1.41652e+00 1.28300e+00  0.00000e+00 0.00000e+00 7.00352e+01 137.832 4.41384e+01 137.832 0.6826 
1 1 1 -3  89  14 o 17 3.77767e+00 1.14325e+00 3.41182e+01 109.483 -9.34680e-01 2.64190e+00  0.00000e+00 0.00000e+00 7.66226e+01 109.483 4.25044e+01 109.483 0.7942 
1 1 1 -3  90  1  o 3  7.40457e+00 5.33048e-01 1.13581e+02 46.416  8.24654e+00  8.66448e+00  0.00000e+00 0.00000e+00 1.49940e+02 46.416  3.63584e+01 46.416  0.9572 
1 1 1 -3  90  2  o 14 7.53981e+00 5.53594e-01 1.26527e+02 292.101 5.10174e+00  -1.25634e+01 0.00000e+00 0.00000e+00 1.43192e+02 292.101 1.66652e+01 292.101 0.9624 
1 1 1 -3  90  3  o 6  5.68030e+00 7.60200e-01 1.05558e+02 27.290  6.95810e+00  3.58978e+00  0.00000e+00 0.00000e+00 9.15446e+01 27.290  1.40132e+01 207.290 0.9338 
1 1 1 -3  90  4  o 19 2.98526e+00 7.70952e-01 5.22041e+01 197.151 -2.11540e+00 -6.52857e-01 0.00000e+00 0.00000e+00 2.87445e+01 197.151 2.34597e+01 17.151  0.7299 
1 1 1 -3  90  5  o 7  2.73974e+00 7.51137e-01 7.20254e+01 73.594  8.70894e-01  2.95787e+00  0.00000e+00 0.00000e+00 1.09880e+01 73.594  6.10374e+01 253.594 0.8160 
1 1 1 -3  90  6  o 9  7.11357e+00 6.95192e-01 1.27013e+02 60.081  7.03927e+00  1.22323e+01  0.00000e+00 0.00000e+00 1.27484e+02 60.081  4.71195e-01 60.081  0.9639 
1 1 1 -3  90  7  o 7  3.24612e+00 8.47093e-01 8.20705e+01 109.165 -1.29119e+00 3.71511e+00  0.00000e+00 0.00000e+00 2.16010e+01 109.165 6.04695e+01 289.165 0.8609 
1 1 1 -3  90  8  o 7  2.99050e+00 8.66219e-01 6.92519e+01 202.694 -3.17340e+00 -1.32710e+00 0.00000e+00 0.00000e+00 2.36496e+01 202.694 4.56023e+01 22.694  0.8379 
1 1 1 -3  90  9  o 17 4.43224e+00 8.99621e-01 6.81704e+01 166.420 -5.02261e+00 1.21328e+00  0.00000e+00 0.00000e+00 7.91575e+01 166.420 1.09871e+01 166.420 0.8971 
1 1 1 -3  90  10 o 14 3.28561e+00 8.49031e-01 3.52519e+01 84.353  2.11507e-01  2.13888e+00  0.00000e+00 0.00000e+00 5.24395e+01 84.353  1.71876e+01 84.353  0.7208 
1 1 1 -3  90  11 o 6  4.07330e+00 9.64872e-01 9.33727e+01 143.206 -5.58905e+00 4.18017e+00  0.00000e+00 0.00000e+00 4.60733e+01 143.206 4.72995e+01 323.206 0.9253 
1 1 1 -3  90  12 o 8  4.06690e+00 1.00367e+00 8.81981e+01 251.160 -2.49909e+00 -7.32427e+00 0.00000e+00 0.00000e+00 5.20649e+01 251.160 3.61332e+01 71.160  0.9330 
1 1 1 -3  90  13 o 7  3.03826e+00 9.89078e-01 4.63143e+01 196.745 -3.09772e+00 -9.32032e-01 0.00000e+00 0.00000e+00 4.63721e+01 196.745 5.78503e-02 196.745 0.8260 
1 1 1 -3  90  14 o 6  8.87293e+00 1.25729e+00 2.00925e+02 17.605  3.45009e+01  1.09477e+01  0.00000e+00 0.00000e+00 1.21930e+02 17.605  7.89949e+01 197.605 0.9861 
1 1 1 -3  91  1  o 4  1.12700e+01 4.81040e-01 2.23309e+02 84.522  3.62258e+00  3.77760e+01  0.00000e+00 0.00000e+00 1.90035e+02 84.522  3.32738e+01 264.522 0.9867 
1 1 1 -3  91  2  o 5  1.21833e+01 4.67100e-01 1.73095e+02 233.875 -1.77696e+01 -2.43457e+01 0.00000e+00 0.00000e+00 2.72080e+02 233.875 9.89844e+01 233.875 0.9833 
1 1 1 -3  91  3  o 7  5.15612e+00 6.77925e-01 1.42556e+02 57.954  5.74813e+00  9.18246e+00  0.00000e+00 0.00000e+00 3.99334e+01 57.954  1.02623e+02 237.954 0.9527 
1 1 1 -3  91  4  o 15 5.95596e+00 8.90075e-01 2.06715e+02 97.666  -2.13054e+00 1.58286e+01  0.00000e+00 0.00000e+00 7.44201e+00 97.666  1.99273e+02 277.666 0.9682 
1 1 1 -3  91  5  o 2  9.73520e+00 5.74571e-01 1.49404e+02 301.587 1.24969e+01  -2.03237e+01 0.00000e+00 0.00000e+00 2.04351e+02 301.587 5.49479e+01 301.587 0.9788 
1 1 1 -3  91  6  o 12 5.07153e+00 8.24842e-01 7.17761e+01 287.405 1.67469e+00  -5.34222e+00 0.00000e+00 0.00000e+00 9.86555e+01 287.405 2.68795e+01 287.405 0.9056 
1 1 1 -3  91  7  f 0  2.19699e+00 7.04660e-01 9.17200e+01 155.497 -2.98791e+00 1.36189e+00  0.00000e+00 0.00000e+00 2.41755e+01 335.496 1.15896e+02 335.496 0.8290 
1 1 1 -3  91  8  o 7  4.31798e+00 9.54309e-01 4.97557e+01 252.258 -1.06092e+00 -3.31589e+00 0.00000e+00 0.00000e+00 8.47095e+01 252.258 3.49538e+01 252.258 0.8401 
1 1 1 -3  91  9  o 14 3.49267e+00 8.81188e-01 5.25775e+01 89.237  4.38575e-02  3.29420e+00  0.00000e+00 0.00000e+00 5.47552e+01 89.237  2.17770e+00 89.237  0.8296 
1 1 1 -3  91  10 o 13 8.47438e+00 7.22242e-01 1.27077e+02 169.460 -2.25292e+01 4.19173e+00  0.00000e+00 0.00000e+00 1.79695e+02 169.460 5.26178e+01 169.460 0.9779 
1 1 1 -3  91  11 o 7  2.87685e+00 8.69974e-01 4.78004e+01 333.830 2.56530e+00  -1.26064e+00 0.00000e+00 0.00000e+00 3.72155e+01 333.830 1.05849e+01 153.830 0.7989 
1 1 1 -3  91  12 o 12 4.45215e+00 1.08176e+00 8.92593e+01 324.154 6.75786e+00  -4.88220e+00 0.00000e+00 0.00000e+00 6.50752e+01 324.154 2.41842e+01 144.154 0.9380 
1 1 1 -3  91  13 o 15 3.28333e+00 1.01368e+00 3.89151e+01 103.943 -7.50638e-01 3.02352e+00  0.00000e+00 0.00000e+00 6.02777e+01 103.943 2.13626e+01 103.943 0.8182 
1 1 1 -3  91  14 o 19 4.40513e+00 1.25080e+00 9.90167e+01 300.937 4.87223e+00  -8.12906e+00 0.00000e+00 0.00000e+00 5.46625e+01 300.937 4.43542e+01 120.937 0.9457 
1 1 1 -3  92  1  o 5  2.06588e+01 4.89661e-01 3.86546e+02 239.719 -5.93604e+01 -1.01661e+02 0.00000e+00 0.00000e+00 3.77870e+02 239.719 8.67660e+00 59.719  0.9957 
1 1 1 -3  92  2  o 18 1.21666e+01 4.76152e-01 2.16020e+02 52.606  2.51071e+01  3.28455e+01  0.00000e+00 0.00000e+00 2.30497e+02 52.606  1.44766e+01 52.606  0.9878 
1 1 1 -3  92  3  o 9  7.52804e+00 5.67860e-01 9.06933e+01 332.906 8.89649e+00  -4.55135e+00 0.00000e+00 0.00000e+00 1.74531e+02 332.906 8.38381e+01 332.906 0.9486 
1 1 1 -3  92  4  f 0  5.38570e+00 9.30186e-01 1.09532e+02 113.176 -3.25823e+00 7.61080e+00  0.00000e+00 0.00000e+00 7.79394e+01 113.176 3.15929e+01 293.176 0.9375 
1 1 1 -3  92  5  o 17 1.38210e+01 5.35666e-01 2.21500e+02 330.938 4.44005e+01  -2.46745e+01 0.00000e+00 0.00000e+00 2.86392e+02 330.938 6.48922e+01 330.938 0.9901 
1 1 1 -3  92  6  o 7  3.90271e+00 8.74709e-01 5.18045e+01 223.350 -2.30977e+00 -2.18046e+00 0.00000e+00 0.00000e+00 6.72392e+01 223.350 1.54347e+01 223.350 0.8222 
1 1 1 -3  92  7  o 12 3.15097e+00 8.72430e-01 4.23894e+01 140.656 -1.67465e+00 1.37285e+00  0.00000e+00 0.00000e+00 4.20999e+01 140.656 2.89484e-01 320.656 0.7232 
1 1 1 -3  92  8  o 19 8.60121e+00 7.30403e-01 1.24848e+02 270.645 2.22450e-01  -1.97651e+01 0.00000e+00 0.00000e+00 1.85719e+02 270.645 6.08708e+01 270.645 0.9744 
1 1 1 -3  92  9  o 19 1.22683e+01 7.01816e-01 2.14167e+02 118.223 -2.37449e+01 4.42409e+01  0.00000e+00 0.00000e+00 2.35627e+02 118.223 2.14599e+01 118.223 0.9900 
1 1 1 -3  92  10 o 6  4.48493e+00 9.58945e-01 6.28909e+01 292.751 2.03138e+00  -4.84398e+00 0.00000e+00 0.00000e+00 8.63102e+01 292.751 2.34193e+01 292.751 0.8989 
1 1 1 -3  92  11 o 14 5.65669e+00 9.54651e-01 7.96161e+01 15.575  8.47423e+00  2.36200e+00  0.00000e+00 0.00000e+00 1.17290e+02 15.575  3.76744e+01 15.575  0.9413 
1 1 1 -3  92  12 o 17 4.43956e+00 1.05326e+00 5.64857e+01 351.239 5.26312e+00  -8.11102e-01 0.00000e+00 0.00000e+00 9.12160e+01 351.239 3.47304e+01 351.239 0.9004 
1 1 1 -3  92  13 f 0  3.15047e+00 1.00968e+00 6.64701e+01 151.904 -4.42041e+00 2.35991e+00  0.00000e+00 0.00000e+00 3.74629e+01 151.904 2.90072e+01 331.904 0.8936 
1 1 1 -3  92  14 o 5  2.86502e+00 9.65152e-01 3.45439e+01 333.352 2.63329e+00  -1.32144e+00 0.00000e+00 0.00000e+00 5.06156e+01 333.352 1.60717e+01 333.352 0.8059 
1 1 1 -3  93  1  o 2  3.99559e+00 7.21314e-01 7.78077e+01 354.692 4.37359e+00  -4.06332e-01 0.00000e+00 0.00000e+00 5.23855e+01 354.692 2.54222e+01 174.692 0.8771 
1 1 1 -3  93  2  o 2  5.65565e+00 6.59273e-01 1.09764e+02 61.862  4.15491e+00  7.76905e+00  0.00000e+00 0.00000e+00 8.79956e+01 61.862  2.17682e+01 241.862 0.9414 
1 1 1 -3  93  3  o 16 2.27165e+00 6.00252e-01 7.65184e+01 9.309   2.77354e+00  4.54637e-01  0.00000e+00 0.00000e+00 9.46315e+00 189.309 8.59815e+01 189.309 0.7949 
1 1 1 -3  93  4  o 14 3.73821e+00 7.70717e-01 5.40612e+01 62.784  1.39141e+00  2.70548e+00  0.00000e+00 0.00000e+00 5.87622e+01 62.784  4.70102e+00 62.784  0.8131 
1 1 1 -3  93  5  o 11 5.48630e+00 7.34818e-01 1.48550e+02 267.432 -5.45045e-01 -1.21549e+01 0.00000e+00 0.00000e+00 4.64685e+01 267.432 1.02081e+02 87.432  0.9580 
1 1 1 -3  93  6  f 0  3.68368e+00 9.44114e-01 1.53278e+01 139.216 -6.22840e-01 5.37323e-01  0.00000e+00 0.00000e+00 3.65914e+01 139.216 2.12637e+01 139.216 0.3800 
1 1 1 -3  93  7  f 0  4.88070e+00 8.40459e-01 1.62012e+02 111.969 -4.70583e+00 1.16653e+01  0.00000e+00 0.00000e+00 1.15644e+01 111.969 1.50448e+02 291.969 0.9594 
1 1 1 -3  93  8  o 11 6.44895e+00 8.88943e-01 1.07626e+02 274.040 8.40906e-01  -1.19048e+01 0.00000e+00 0.00000e+00 1.21054e+02 274.040 1.34280e+01 274.040 0.9571 
1 1 1 -3  93  9  o 5  9.34704e+00 7.91977e-01 1.45005e+02 87.788  9.86731e-01  2.55489e+01  0.00000e+00 0.00000e+00 1.94225e+02 87.788  4.92199e+01 87.788  0.9802 
1 1 1 -3  93  10 o 1  3.87972e+00 1.02744e+00 8.95474e+01 264.473 -5.93954e-01 -6.13791e+00 0.00000e+00 0.00000e+00 4.17757e+01 264.473 4.77717e+01 84.473  0.9149 
1 1 1 -3  93  11 o 4  7.58338e+00 8.51905e-01 1.03461e+02 37.815  1.37422e+01  1.06651e+01  0.00000e+00 0.00000e+00 1.68715e+02 37.815  6.52537e+01 37.815  0.9708 
1 1 1 -3  93  12 o 6  3.94594e+00 1.02247e+00 1.98343e+01 127.003 -1.03966e+00 1.37954e+00  0.00000e+00 0.00000e+00 7.45519e+01 127.003 5.47177e+01 127.003 0.6475 
1 1 1 -3  93  13 o 13 3.80802e+00 1.11392e+00 7.47812e+01 236.525 -3.57854e+00 -5.41166e+00 0.00000e+00 0.00000e+00 5.44234e+01 236.525 2.03578e+01 56.525  0.9193 
1 1 1 -3  93  14 o 6  3.24884e+00 1.07200e+00 9.11655e+01 245.874 -3.13158e+00 -6.99239e+00 0.00000e+00 0.00000e+00 2.05100e+01 245.874 7.06554e+01 65.875  0.9323 
1 1 1 -3  94  1  o 8  7.63681e+00 5.53795e-01 1.64760e+02 186.480 -2.05660e+01 -2.33580e+00 0.00000e+00 0.00000e+00 1.11941e+02 186.480 5.28195e+01 6.480   0.9755 
1 1 1 -3  94  2  o 19 1.35003e+01 4.76773e-01 2.23168e+02 7.349   5.02806e+01  6.48493e+00  0.00000e+00 0.00000e+00 2.73175e+02 7.349   5.00072e+01 7.349   0.9901 
1 1 1 -3  94  3  o 16 4.50666e+00 7.35936e-01 7.06103e+01 234.038 -2.85643e+00 -3.93704e+00 0.00000e+00 0.00000e+00 7.83100e+01 234.038 7.69969e+00 234.038 0.8901 
1 1 1 -3  94  4  o 19 5.80489e+00 6.97973e-01 9.24532e+01 254.380 -2.35520e+00 -8.42388e+00 0.00000e+00 0.00000e+00 1.10254e+02 254.380 1.78010e+01 254.380 0.9410 
1 1 1 -3  94  5  o 6  5.17706e+00 7.17584e-01 1.07791e+02 89.712  4.39145e-02  8.72201e+00  0.00000e+00 0.00000e+00 7.28875e+01 89.712  3.49036e+01 269.712 0.9408 
1 1 1 -3  94  6  o 16 2.57325e+00 7.92366e-01 5.00844e+01 242.481 -1.00641e+00 -1.93174e+00 0.00000e+00 0.00000e+00 1.90876e+01 242.481 3.09968e+01 62.481  0.7250 
1 1 1 -3  94  7  o 7  5.41801e+00 8.36643e-01 1.39880e+02 76.921  2.92437e+00  1.25879e+01  0.00000e+00 0.00000e+00 5.29784e+01 76.921  8.69015e+01 256.921 0.9605 
1 1 1 -3  94  8  o 17 3.45061e+00 9.23045e-01 1.08485e+01 171.522 -6.47547e-01 9.65271e-02  0.00000e+00 0.00000e+00 2.88962e+01 171.522 1.80477e+01 171.522 0.3110 
1 1 1 -3  94  9  o 5  2.43686e+00 8.02144e-01 3.42840e+01 84.771  1.47255e-01  1.60916e+00  0.00000e+00 0.00000e+00 2.19555e+01 84.771  1.23285e+01 264.771 0.6235 
1 1 1 -3  94  10 o 8  7.93899e+00 1.01887e+00 9.71690e+01 334.097 1.31389e+01  -6.38063e+00 0.00000e+00 0.00000e+00 1.86246e+02 334.097 8.90773e+01 334.097 0.9651 
1 1 1 -3  94  11 o 5  3.87956e+00 1.01923e+00 4.89962e+01 349.339 3.97866e+00  -7.48987e-01 0.00000e+00 0.00000e+00 7.50888e+01 349.339 2.60926e+01 349.339 0.8654 
1 1 1 -3  94  12 o 4  3.97822e+00 1.08016e+00 6.98241e+01 256.199 -1.37530e+00 -5.59888e+00 0.00000e+00 0.00000e+00 6.36566e+01 256.199 6.16744e+00 76.199  0.9086 
1 1 1 -3  94  13 o 14 4.95242e+00 1.14858e+00 6.58154e+01 353.998 7.53847e+00  -7.92539e-01 0.00000e+00 0.00000e+00 1.04397e+02 353.998 3.85815e+01 353.998 0.9315 
1 1 1 -3  95  1  f 0  1.03700e+01 4.92409e-01 1.19367e+02 313.162 1.41585e+01  -1.50974e+01 0.00000e+00 0.00000e+00 2.56267e+02 313.162 1.36900e+02 313.162 0.9755 
1 1 1 -3  95  2  o 10 5.27229e+00 7.10351e-01 6.86213e+01 3.753   5.61039e+00  3.68046e-01  0.00000e+00 0.00000e+00 1.08719e+02 3.753   4.00981e+01 3.753   0.9061 
1 1 1 -3  95  3  o 17 5.18799e+00 7.09170e-01 9.82394e+01 224.165 -5.67366e+00 -5.51063e+00 0.00000e+00 0.00000e+00 8.16860e+01 224.165 1.65534e+01 44.165  0.9345 
1 1 1 -3  95  4  o 4  3.00752e+00 7.91608e-01 9.50080e+01 248.975 -1.68006e+00 -4.37113e+00 0.00000e+00 0.00000e+00 3.79467e+00 248.975 9.12133e+01 68.976  0.8855 
1 1 1 -3  95  5  o 15 6.60893e+00 5.96593e-01 1.55059e+02 158.705 -1.62452e+01 6.33197e+00  0.00000e+00 0.00000e+00 8.29067e+01 158.705 7.21521e+01 338.705 0.9709 
1 1 1 -3  95  6  o 7  7.43002e+00 8.16630e-01 1.17436e+02 0.736   1.40515e+01  1.80623e-01  0.00000e+00 0.00000e+00 1.48003e+02 0.736   3.05669e+01 0.736   0.9637 
1 1 1 -3  95  7  o 4  1.04220e+01 6.29896e-01 1.62123e+02 48.228  2.00202e+01  2.24136e+01  0.00000e+00 0.00000e+00 2.17535e+02 48.228  5.54123e+01 48.228  0.9832 
1 1 1 -3  95  8  o 18 6.01065e+00 8.65583e-01 7.48074e+01 222.070 -5.84167e+00 -5.27279e+00 0.00000e+00 0.00000e+00 1.33096e+02 222.070 5.82885e+01 222.070 0.9341 
1 1 1 -3  95  9  o 17 6.60133e+00 9.85843e-01 1.39145e+02 190.273 -1.65433e+01 -2.99824e+00 0.00000e+00 0.00000e+00 9.77578e+01 190.273 4.13870e+01 10.273  0.9698 
1 1 1 -3  95  10 o 19 9.27109e+00 9.33940e-01 1.60352e+02 15.442  2.86554e+01  7.91583e+00  0.00000e+00 0.00000e+00 1.76669e+02 15.442  1.63176e+01 15.442  0.9830 
1 1 1 -3  95  11 o 11 5.71760e+00 1.15560e+00 1.35606e+02 203.223 -1.40415e+01 -6.02488e+00 0.00000e+00 0.00000e+00 6.86296e+01 203.223 6.69764e+01 23.223  0.9667 
1 1 1 -3  95  12 o 2  7.04664e+00 1.02475e+00 1.40934e+02 353.490 2.38310e+01  -2.71958e+00 0.00000e+00 0.00000e+00 1.13750e+02 353.490 2.71839e+01 173.490 0.9789 
1 1 1 -3  95  13 o 6  4.27528e+00 1.16091e+00 9.09950e+01 197.440 -8.32624e+00 -2.61575e+00 0.00000e+00 0.00000e+00 5.73802e+01 197.440 3.36148e+01 17.440  0.9408 
1 1 1 -3  96  1  o 1  7.67988e+00 6.09794e-01 1.57712e+02 75.177  5.00409e+00  1.89096e+01  0.00000e+00 0.00000e+00 1.19993e+02 75.177  3.77195e+01 255.177 0.9741 
1 1 1 -3  96  2  o 6  6.64531e+00 5.98366e-01 1.28463e+02 352.237 1.43385e+01  -1.95480e+00 0.00000e+00 0.00000e+00 1.09490e+02 352.237 1.89736e+01 172.237 0.9648 
1 1 1 -3  96  3  o 10 5.47649e+00 6.77048e-01 6.63051e+01 198.474 -5.95134e+00 -1.98824e+00 0.00000e+00 0.00000e+00 1.19911e+02 198.474 5.36063e+01 198.474 0.9164 
1 1 1 -3  96  4  o 19 9.28668e+00 5.40611e-01 2.02586e+02 95.270  -3.22163e+00 3.49272e+01  0.00000e+00 0.00000e+00 1.36923e+02 95.270  6.56636e+01 275.270 0.9856 
1 1 1 -3  96  5  o 2  5.76483e+00 6.54775e-01 9.96840e+01 340.641 9.76070e+00  -3.42933e+00 0.00000e+00 0.00000e+00 1.03448e+02 340.641 3.76428e+00 340.641 0.9504 
1 1 1 -3  96  6  o 14 4.49300e+00 8.85498e-01 7.77745e+01 48.321  4.09073e+00  4.59468e+00  0.00000e+00 0.00000e+00 7.45242e+01 48.321  3.25038e+00 228.321 0.9147 
1 1 1 -3  96  7  f 0  6.44812e+00 7.82501e-01 1.67370e+02 127.595 -1.18035e+01 1.53300e+01  0.00000e+00 0.00000e+00 6.52158e+01 127.595 1.02154e+02 307.595 0.9738 
1 1 1 -3  96  8  o 15 6.17788e+00 8.90925e-01 1.16367e+02 254.424 -3.49431e+00 -1.25354e+01 0.00000e+00 0.00000e+00 1.03362e+02 254.424 1.30045e+01 74.424  0.9608 
1 1 1 -3  96  9  o 4  3.29031e+00 9.39268e-01 3.09781e+01 345.440 1.85779e+00  -4.82523e-01 0.00000e+00 0.00000e+00 5.22935e+01 345.440 2.13154e+01 345.440 0.6841 
1 1 1 -3  96  10 o 10 1.16537e+01 8.46217e-01 2.13317e+02 235.422 -3.14064e+01 -4.55642e+01 0.00000e+00 0.00000e+00 2.13603e+02 235.422 2.85122e-01 235.422 0.9909 
1 1 1 -3  96  11 o 2  3.10002e+00 9.79038e-01 6.85292e+01 139.981 -3.66953e+00 3.08114e+00  0.00000e+00 0.00000e+00 3.31993e+01 139.981 3.53299e+01 319.981 0.8883 
1 1 1 -3  96  12 o 15 5.96130e+00 1.11273e+00 1.19723e+02 330.994 1.36258e+01  -7.55467e+00 0.00000e+00 0.00000e+00 9.31308e+01 330.994 2.65919e+01 150.994 0.9674 
1 1 1 -3  96  13 o 1  6.61613e+00 1.28832e+00 1.14050e+02 129.338 -9.70426e+00 1.18402e+01  0.00000e+00 0.00000e+00 1.21833e+02 129.338 7.78287e+00 129.338 0.9668 
1 1 1 -3  97  1  o 9  3.88029e+00 7.64935e-01 1.00420e+02 334.507 5.18024e+00  -2.47010e+00 0.00000e+00 0.00000e+00 3.03519e+01 334.507 7.00679e+01 154.507 0.9081 
1 1 1 -3  97  2  f 0  3.62889e+00 7.78031e-01 2.71793e+01 105.955 -4.46963e-01 1.56340e+00  0.00000e+00 0.00000e+00 5.70799e+01 105.955 2.99006e+01 105.955 0.6258 
1 1 1 -3  97  3  o 6  1.35641e+01 5.34296e-01 2.27736e+02 112.974 -2.25422e+01 5.31723e+01  0.00000e+00 0.00000e+00 2.71036e+02 112.974 4.32999e+01 112.974 0.9913 
1 1 1 -3  97  4  o 18 8.51721e+00 5.99313e-01 9.34284e+01 221.671 -1.10083e+01 -9.79816e+00 0.00000e+00 0.00000e+00 2.11492e+02 221.671 1.18063e+02 221.671 0.9655 
1 1 1 -3  97  5  o 14 6.17429e+00 6.86785e-01 1.38719e+02 237.018 -8.71965e+00 -1.34365e+01 0.00000e+00 0.00000e+00 8.28792e+01 237.018 5.58401e+01 57.018  0.9683 
1 1 1 -3  97  6  o 6  1.13342e+01 5.39650e-01 1.43716e+02 84.373  2.94457e+00  2.98870e+01  0.00000e+00 0.00000e+00 2.69162e+02 84.373  1.25446e+02 84.373  0.9832 
1 1 1 -3  97  7  o 11 5.64414e+00 8.85450e-01 1.41066e+02 262.297 -1.74611e+00 -1.29097e+01 0.00000e+00 0.00000e+00 5.97515e+01 262.297 8.13143e+01 82.297  0.9608 
1 1 1 -3  97  8  o 4  2.38252e+00 7.59857e-01 5.09891e+01 105.537 -6.77272e-01 2.43607e+00  0.00000e+00 0.00000e+00 1.67347e+01 105.537 3.42544e+01 285.537 0.7681 
1 1 1 -3  97  9  f 0  2.57324e+00 8.20316e-01 9.89630e+01 263.383 -6.37267e-01 -5.49375e+00 0.00000e+00 0.00000e+00 1.28899e+01 83.383  1.11853e+02 83.383  0.9044 
1 1 1 -3  97  10 o 12 4.11778e+00 1.08067e+00 5.75847e+01 268.356 -1.34888e-01 -4.69861e+00 0.00000e+00 0.00000e+00 7.72483e+01 268.356 1.96636e+01 268.356 0.8859 
1 1 1 -3  97  11 o 7  4.65316e+00 1.19541e+00 3.03850e+01 107.032 -7.68149e-01 2.50749e+00  0.00000e+00 0.00000e+00 1.03260e+02 107.032 7.28747e+01 107.032 0.7777 
1 1 1 -3  97  12 o 4  3.46544e+00 1.07523e+00 5.93963e+01 238.843 -2.51675e+00 -4.16265e+00 0.00000e+00 0.00000e+00 5.44334e+01 238.843 4.96296e+00 58.843  0.8901 
1 1 1 -3  97  13 o 14 5.03125e+00 1.26662e+00 9.17473e+01 49.707  6.07541e+00  7.16563e+00  0.00000e+00 0.00000e+00 8.35779e+01 49.707  8.16948e+00 229.707 0.9452 
1 1 1 -3  98  1  o 6  5.17206e+00 7.16453e-01 1.19681e+02 202.216 -9.93824e+00 -4.05903e+00 0.00000e+00 0.00000e+00 6.30444e+01 202.216 5.66367e+01 22.216  0.9522 
1 1 1 -3  98  2  o 2  4.16752e+00 7.59999e-01 6.75068e+01 201.751 -4.16063e+00 -1.66003e+00 0.00000e+00 0.00000e+00 6.84909e+01 201.751 9.84146e-01 201.751 0.8797 
1 1 1 -3  98  3  f 0  4.70551e+00 7.80783e-01 1.22617e+02 105.242 -2.58765e+00 9.49649e+00  0.00000e+00 0.00000e+00 4.27653e+01 105.242 7.98514e+01 285.242 0.9478 
1 1 1 -3  98  4  o 8  5.95226e+00 6.84969e-01 1.30247e+02 299.132 6.46536e+00  -1.16005e+01 0.00000e+00 0.00000e+00 8.19348e+01 299.132 4.83127e+01 119.132 0.9616 
1 1 1 -3  98  5  o 2  5.70912e+00 7.36980e-01 8.11447e+01 63.608  3.69151e+00  7.43919e+00  0.00000e+00 0.00000e+00 1.17239e+02 63.608  3.60940e+01 63.608  0.9377 
1 1 1 -3  98  6  o 1  6.10473e+00 7.17833e-01 1.24937e+02 114.707 -5.90701e+00 1.28385e+01  0.00000e+00 0.00000e+00 9.30290e+01 114.707 3.19083e+01 294.707 0.9639 
1 1 1 -3  98  7  f 0  5.61688e+00 8.22915e-01 7.71398e+01 35.444  6.55084e+00  4.66307e+00  0.00000e+00 0.00000e+00 1.17406e+02 35.444  4.02662e+01 35.444  0.9356 
1 1 1 -3  98  8  o 18 2.84133e+00 8.48015e-01 6.47539e+01 169.961 -3.62170e+00 6.41178e-01  0.00000e+00 0.00000e+00 2.45929e+01 169.961 4.01610e+01 349.960 0.8499 
1 1 1 -3  98  9  f 0  4.18736e+00 9.97014e-01 3.89516e+01 284.945 8.05090e-01  -3.01624e+00 0.00000e+00 0.00000e+00 8.77934e+01 284.945 4.88418e+01 284.945 0.8186 
1 1 1 -3  98  10 o 17 6.72853e+00 1.01956e+00 7.97709e+01 159.896 -1.10975e+01 4.06205e+00  0.00000e+00 0.00000e+00 1.58083e+02 159.896 7.83125e+01 159.896 0.9567 
1 1 1 -3  98  11 o 13 3.77318e+00 1.08905e+00 7.21279e+01 170.136 -5.66346e+00 9.84811e-01  0.00000e+00 0.00000e+00 5.44040e+01 170.136 1.77239e+01 350.135 0.9083 
1 1 1 -3  98  12 f 0  3.40870e+00 1.07293e+00 3.90608e+01 49.985  1.98340e+00  2.36250e+00  0.00000e+00 0.00000e+00 6.35592e+01 49.985  2.44984e+01 49.985  0.8161 
1 1 1 -3  99  1  o 12 3.56920e+00 8.07579e-01 7.27767e+01 14.701  4.23246e+00  1.11043e+00  0.00000e+00 0.00000e+00 4.32703e+01 14.701  2.95065e+01 194.701 0.8766 
1 1 1 -3  99  2  o 16 1.19768e+01 5.03261e-01 2.27851e+02 107.528 -1.57382e+01 4.98302e+01  0.00000e+00 0.00000e+00 2.12028e+02 107.528 1.58231e+01 287.528 0.9904 
1 1 1 -3  99  3  o 7  1.15311e+01 5.26994e-01 2.03278e+02 244.157 -1.86437e+01 -3.84933e+01 0.00000e+00 0.00000e+00 2.19197e+02 244.157 1.59186e+01 244.157 0.9882 
1 1 1 -3  99  4  o 5  3.17461e+00 8.11929e-01 6.48666e+01 143.675 -3.04629e+00 2.23977e+00  0.00000e+00 0.00000e+00 3.56756e+01 143.675 2.91910e+01 323.675 0.8545 
1 1 1 -3  99  5  o 5  9.70680e+00 6.06851e-01 1.77249e+02 175.910 -3.07703e+01 2.20036e+00  0.00000e+00 0.00000e+00 1.76480e+02 175.910 7.68986e-01 355.910 0.9837 
1 1 1 -3  99  6  o 14 4.83978e+00 7.53031e-01 1.08633e+02 164.589 -8.87834e+00 2.44738e+00  0.00000e+00 0.00000e+00 6.05550e+01 164.589 4.80779e+01 344.589 0.9440 
1 1 1 -3  99  7  o 16 7.23334e+00 6.76310e-01 1.18637e+02 341.125 1.68355e+01  -5.75591e+00 0.00000e+00 0.00000e+00 1.41439e+02 341.125 2.28016e+01 341.125 0.9715 
1 1 1 -3  99  8  o 18 3.93997e+00 9.57814e-01 4.63238e+01 249.721 -1.17507e+00 -3.18023e+00 0.00000e+00 0.00000e+00 7.53910e+01 249.721 2.90672e+01 249.721 0.8352 
1 1 1 -3  99  9  f 0  3.86860e+00 9.27905e-01 4.85341e+01 214.839 -3.23773e+00 -2.25353e+00 0.00000e+00 0.00000e+00 7.46460e+01 214.839 2.61119e+01 214.839 0.8614 
1 1 1 -3  99  10 o 3  3.79250e+00 1.03768e+00 7.22572e+01 318.395 4.41016e+00  -3.91622e+00 0.00000e+00 0.00000e+00 5.53328e+01 318.395 1.69244e+01 138.395 0.9107 
1 1 1 -3  99  11 o 16 6.65796e+00 1.25984e+00 9.74887e+01 159.093 -1.18055e+01 4.50966e+00  0.00000e+00 0.00000e+00 1.38334e+02 159.093 4.08458e+01 159.093 0.9596 
1 1 1 -3  99  12 o 3  2.83167e+00 9.47652e-01 2.12934e+01 179.862 -1.66200e+00 4.01375e-03  0.00000e+00 0.00000e+00 4.48878e+01 179.862 2.35944e+01 179.862 0.6337 
1 1 1 -3  100 1  o 17 8.77236e+00 5.77921e-01 1.24746e+02 203.094 -1.91828e+01 -8.17990e+00 0.00000e+00 0.00000e+00 1.92652e+02 203.094 6.79064e+01 203.094 0.9757 
1 1 1 -3  100 2  o 19 5.41494e+00 7.10233e-01 5.82279e+01 350.620 5.26404e+00  -8.69539e-01 0.00000e+00 0.00000e+00 1.22575e+02 350.620 6.43471e+01 350.620 0.9006 
1 1 1 -3  100 3  o 17 5.71822e+00 7.31837e-01 1.54523e+02 165.369 -1.63912e+01 4.27906e+00  0.00000e+00 0.00000e+00 5.10628e+01 165.369 1.03460e+02 345.369 0.9700 
1 1 1 -3  100 4  o 1  5.56069e+00 7.48999e-01 1.08324e+02 307.136 6.62017e+00  -8.74195e+00 0.00000e+00 0.00000e+00 8.80762e+01 307.136 2.02479e+01 127.136 0.9533 
1 1 1 -3  100 5  o 5  3.33701e+00 8.10118e-01 4.99040e+01 28.997  2.72190e+00  1.50858e+00  0.00000e+00 0.00000e+00 5.11868e+01 28.997  1.28280e+00 28.997  0.8179 
1 1 1 -3  100 6  o 18 7.27155e+00 6.66413e-01 1.14574e+02 185.913 -1.67192e+01 -1.73172e+00 0.00000e+00 0.00000e+00 1.46484e+02 185.913 3.19099e+01 185.913 0.9698 
1 1 1 -3  100 7  o 8  4.51158e+00 8.88625e-01 6.97819e+01 341.604 5.69438e+00  -1.89380e+00 0.00000e+00 0.00000e+00 8.25226e+01 341.604 1.27408e+01 341.604 0.9124 
1 1 1 -3  100 8  o 4  7.73994e+00 7.43513e-01 1.31411e+02 43.926  1.65409e+01  1.59321e+01  0.00000e+00 0.00000e+00 1.48504e+02 43.926  1.70934e+01 43.926  0.9780 
1 1 1 -3  100 9  o 17 4.61801e+00 1.06701e+00 1.04310e+02 120.467 -4.89410e+00 8.31956e+00  0.00000e+00 0.00000e+00 5.72530e+01 120.467 4.70571e+01 300.467 0.9467 
1 1 1 -3  100 10 o 14 7.90971e+00 9.30938e-01 1.15130e+02 252.575 -6.49489e+00 -2.06931e+01 0.00000e+00 0.00000e+00 1.70158e+02 252.575 5.50287e+01 252.575 0.9767 
1 1 1 -3  100 11 o 19 3.31662e+00 1.00565e+00 3.47410e+01 90.147  -7.65661e-03 2.97942e+00  0.00000e+00 0.00000e+00 6.42043e+01 90.147  2.94633e+01 90.147  0.8085 
1 1 1 -3  100 12 o 11 2.79224e+00 9.38616e-01 1.91583e+01 248.722 -5.55721e-01 -1.42695e+00 0.00000e+00 0.00000e+00 4.30035e+01 248.722 2.38452e+01 248.722 0.6038 
1 1 1 -3  101 1  o 10 4.89791e+00 7.48495e-01 9.25639e+01 359.811 8.62219e+00  -2.84433e-02 0.00000e+00 0.00000e+00 7.81311e+01 359.811 1.44328e+01 179.811 0.9401 
1 1 1 -3  101 2  o 11 4.72950e+00 8.04950e-01 1.34016e+02 122.482 -5.90127e+00 9.26955e+00  0.00000e+00 0.00000e+00 3.31006e+01 122.482 1.00915e+02 302.482 0.9534 
1 1 1 -3  101 3  o 8  1.33955e+01 5.19805e-01 2.24580e+02 304.880 3.47340e+01  -4.98266e+01 0.00000e+00 0.00000e+00 2.67671e+02 304.880 4.30911e+01 304.880 0.9917 
1 1 1 -3  101 4  o 10 1.09392e+01 5.53403e-01 1.64720e+02 171.102 -3.55455e+01 5.56504e+00  0.00000e+00 0.00000e+00 2.34811e+02 171.102 7.00912e+01 171.102 0.9860 
1 1 1 -3  101 5  o 18 2.94087e+00 8.05365e-01 3.78842e+01 36.356  1.62418e+00  1.19552e+00  0.00000e+00 0.00000e+00 3.83940e+01 36.356  5.09827e-01 36.356  0.7005 
1 1 1 -3  101 6  o 12 5.00947e+00 8.34895e-01 6.02753e+01 0.851   5.73241e+00  8.51976e-02  0.00000e+00 0.00000e+00 1.08067e+02 0.851   4.77917e+01 0.851   0.9080 
1 1 1 -3  101 7  o 6  2.99347e+00 8.19469e-01 3.72293e+01 148.215 -1.92529e+00 1.19304e+00  0.00000e+00 0.00000e+00 4.43594e+01 148.215 7.13019e+00 148.215 0.7368 
1 1 1 -3  101 8  f 0  2.72084e+00 8.24405e-01 5.64247e+01 235.563 -1.82915e+00 -2.66774e+00 0.00000e+00 0.00000e+00 2.66537e+01 235.563 2.97710e+01 55.563  0.8259 
1 1 1 -3  101 9  o 18 3.84393e+00 9.66652e-01 7.54661e+01 50.307  4.26055e+00  5.13322e+00  0.00000e+00 0.00000e+00 5.54246e+01 50.307  2.00415e+01 230.307 0.9217 
1 1 1 -3  101 10 o 17 7.93460e+00 9.29520e-01 1.23327e+02 289.778 7.77506e+00  -2.16215e+01 0.00000e+00 0.00000e+00 1.63167e+02 289.778 3.98402e+01 289.778 0.9780 
1 1 1 -3  101 11 o 18 2.61430e+00 8.80072e-01 5.00158e+01 106.623 -1.12579e+00 3.77079e+00  0.00000e+00 0.00000e+00 3.30223e+01 106.623 1.69935e+01 286.623 0.8610 
1 1 1 -3  102 1  o 9  3.38063e+00 7.69326e-01 4.64951e+01 291.013 1.01649e+00  -2.64618e+00 0.00000e+00 0.00000e+00 5.33593e+01 291.013 6.86420e+00 291.013 0.7970 
1 1 1 -3  102 2  o 7  5.62763e+00 7.64202e-01 9.63392e+01 339.411 8.49872e+00  -3.19263e+00 0.00000e+00 0.00000e+00 1.00341e+02 339.411 4.00149e+00 339.411 0.9432 
1 1 1 -3  102 3  o 9  6.69379e+00 6.46112e-01 1.14743e+02 46.260  1.01860e+01  1.06443e+01  0.00000e+00 0.00000e+00 1.24648e+02 46.260  9.90522e+00 46.260  0.9654 
1 1 1 -3  102 4  o 1  8.44406e+00 6.67442e-01 2.11126e+02 167.904 -3.17936e+01 6.81390e+00  0.00000e+00 0.00000e+00 9.67190e+01 167.904 1.14407e+02 347.903 0.9845 
1 1 1 -3  102 5  o 14 5.81969e+00 7.79453e-01 1.06773e+02 254.493 -3.15226e+00 -1.13616e+01 0.00000e+00 0.00000e+00 9.93027e+01 254.493 7.47008e+00 74.493  0.9566 
1 1 1 -3  102 6  o 3  7.41280e+00 7.57736e-01 1.51816e+02 188.248 -2.29721e+01 -3.33001e+00 0.00000e+00 0.00000e+00 1.16478e+02 188.248 3.53378e+01 8.248   0.9782 
1 1 1 -3  102 7  o 4  6.71308e+00 7.83873e-01 1.04726e+02 33.859  1.29813e+01  8.70955e+00  0.00000e+00 0.00000e+00 1.35449e+02 33.859  3.07224e+01 33.859  0.9675 
1 1 1 -3  102 8  o 18 5.45519e+00 9.25602e-01 1.19438e+02 299.653 6.78444e+00  -1.19172e+01 0.00000e+00 0.00000e+00 7.46831e+01 299.653 4.47549e+01 119.653 0.9628 
1 1 1 -3  102 9  o 13 2.28044e+00 7.48076e-01 2.70047e+01 93.261  -9.48656e-02 1.66512e+00  0.00000e+00 0.00000e+00 2.64775e+01 93.261  5.27225e-01 273.261 0.6350 
1 1 1 -3  102 10 o 7  5.33438e+00 1.07635e+00 3.65141e+01 314.581 3.14934e+00  -3.19573e+00 0.00000e+00 0.00000e+00 1.36736e+02 314.581 1.00222e+02 314.581 0.8799 
1 1 1 -3  102 11 o 4  4.15428e+00 1.16797e+00 6.34550e+01 215.751 -4.87651e+00 -3.51069e+00 0.00000e+00 0.00000e+00 7.63524e+01 215.751 1.28975e+01 215.751 0.9125 
1 1 1 -3  103 1  o 17 5.30458e+00 7.21007e-01 4.07582e+01 68.789  1.46976e+00  3.78717e+00  0.00000e+00 0.00000e+00 1.29421e+02 68.789  8.86630e+01 68.789  0.8659 
1 1 1 -3  103 2  o 10 6.31723e+00 6.99840e-01 8.81498e+01 33.284  8.69347e+00  5.70713e+00  0.00000e+00 0.00000e+00 1.34307e+02 33.284  4.61575e+01 33.284  0.9506 
1 1 1 -3  103 3  o 9  2.30297e+00 7.12562e-01 6.03865e+01 310.288 1.60661e+00  -1.89526e+00 0.00000e+00 0.00000e+00 4.71317e+00 310.288 5.56733e+01 130.288 0.7633 
1 1 1 -3  103 4  f 0  1.31420e+01 5.49311e-01 2.56347e+02 176.458 -7.16473e+01 4.43508e+00  0.00000e+00 0.00000e+00 2.26776e+02 176.458 2.95712e+01 356.458 0.9930 
1 1 1 -3  103 5  o 10 9.29293e+00 6.91749e-01 1.77972e+02 304.843 2.04431e+01  -2.93667e+01 0.00000e+00 0.00000e+00 1.61082e+02 304.843 1.68900e+01 124.843 0.9859 
1 1 1 -3  103 6  o 2  5.03973e+00 8.96564e-01 8.39486e+01 124.276 -4.61202e+00 6.76707e+00  0.00000e+00 0.00000e+00 9.06832e+01 124.276 6.73460e+00 124.276 0.9368 
1 1 1 -3  103 7  o 15 6.30049e+00 8.20714e-01 8.97157e+01 127.145 -7.21909e+00 9.52985e+00  0.00000e+00 0.00000e+00 1.33248e+02 127.145 4.35319e+01 127.145 0.9572 
1 1 1 -3  103 8  o 10 3.81318e+00 9.37760e-01 7.23284e+01 35.492  5.10216e+00  3.63821e+00  0.00000e+00 0.00000e+00 5.67717e+01 35.492  1.55568e+01 215.492 0.9163 
1 1 1 -3  103 9  o 10 1.00740e+01 7.21930e-01 1.64980e+02 321.621 3.65660e+01  -2.89601e+01 0.00000e+00 0.00000e+00 2.02989e+02 321.621 3.80088e+01 321.621 0.9892 
1 1 1 -3  103 10 o 3  2.84665e+00 8.60983e-01 3.68384e+01 14.889  2.76464e+00  7.35031e-01  0.00000e+00 0.00000e+00 4.71010e+01 14.889  1.02626e+01 14.889  0.7991 
1 1 1 -3  103 11 o 6  3.83718e+00 1.08489e+00 3.51998e+01 197.907 -3.30692e+00 -1.06854e+00 0.00000e+00 0.00000e+00 8.36152e+01 197.907 4.84154e+01 197.907 0.8398 
1 1 1 -3  104 1  o 6  2.45063e+00 7.11893e-01 2.31403e+01 18.201  9.63482e-01  3.16797e-01  0.00000e+00 0.00000e+00 1.78352e+01 18.201  5.30517e+00 198.201 0.4514 
1 1 1 -3  104 2  o 8  3.71721e+00 8.23736e-01 1.07124e+02 295.864 3.11445e+00  -6.42426e+00 0.00000e+00 0.00000e+00 2.04927e+01 295.864 8.66313e+01 115.864 0.9271 
1 1 1 -3  104 3  o 13 3.18319e+00 8.02092e-01 4.77421e+01 325.017 2.33832e+00  -1.63625e+00 0.00000e+00 0.00000e+00 4.63700e+01 325.017 1.37204e+00 145.017 0.7986 
1 1 1 -3  104 4  o 7  2.31254e+00 7.38415e-01 3.81859e+01 34.362  1.46180e+00  9.99482e-01  0.00000e+00 0.00000e+00 1.79862e+01 34.362  2.01997e+01 214.362 0.6563 
1 1 1 -3  104 5  o 3  6.56937e+00 9.12573e-01 5.94867e+01 63.840  3.30401e+00  6.72664e+00  0.00000e+00 0.00000e+00 1.66700e+02 63.840  1.07213e+02 63.840  0.9307 
1 1 1 -3  104 6  o 11 4.94391e+00 9.21461e-01 1.43310e+02 179.084 -1.43620e+01 2.29565e-01  0.00000e+00 0.00000e+00 3.30253e+01 179.084 1.10284e+02 359.084 0.9645 
1 1 1 -3  104 7  f 0  2.96371e+00 8.76227e-01 6.87262e+01 34.892  3.63947e+00  2.53814e+00  0.00000e+00 0.00000e+00 2.74967e+01 34.892  4.12295e+01 214.892 0.8785 
1 1 1 -3  104 8  o 19 3.33670e+00 9.24479e-01 4.44900e+01 220.070 -2.71225e+00 -2.28151e+00 0.00000e+00 0.00000e+00 5.94576e+01 220.070 1.49676e+01 220.070 0.8434 
1 1 1 -3  104 9  o 13 3.56612e+00 9.33669e-01 2.26229e+01 167.836 -1.89970e+00 4.09495e-01  0.00000e+00 0.00000e+00 6.79785e+01 167.836 4.53557e+01 167.836 0.6882 
1 1 1 -3  104 10 o 5  2.89648e+00 9.00801e-01 3.91019e+01 346.365 3.24829e+00  -7.87966e-01 0.00000e+00 0.00000e+00 4.98406e+01 346.365 1.07387e+01 346.365 0.8324 
1 1 1 -3  104 11 o 5  3.55213e+00 1.00280e+00 6.30137e+01 293.890 2.59274e+00  -5.85349e+00 0.00000e+00 0.00000e+00 5.72066e+01 293.890 5.80713e+00 113.890 0.9182 
1 1 1 -3  105 1  o 19 3.12810e+00 8.40279e-01 6.53120e+01 44.437  2.63640e+00  2.58510e+00  0.00000e+00 0.00000e+00 3.32102e+01 44.437  3.21018e+01 224.437 0.8506 
1 1 1 -3  105 2  o 9  1.49073e+01 5.31065e-01 1.96927e+02 20.525  5.89204e+01  2.20583e+01  0.00000e+00 0.00000e+00 3.50568e+02 20.525  1.53641e+02 20.525  0.9920 
1 1 1 -3  105 3  o 1  7.11837e+00 6.89377e-01 1.53349e+02 258.421 -4.51125e+00 -2.20171e+01 0.00000e+00 0.00000e+00 1.04185e+02 258.421 4.91646e+01 78.421  0.9775 
1 1 1 -3  105 4  o 2  3.94323e+00 7.86572e-01 6.39854e+01 317.423 3.86210e+00  -3.54857e+00 0.00000e+00 0.00000e+00 6.71425e+01 317.423 3.15709e+00 317.423 0.8988 
1 1 1 -3  105 5  o 12 6.60274e+00 8.96537e-01 1.42403e+02 93.288  -1.03535e+00 1.80197e+01  0.00000e+00 0.00000e+00 9.49338e+01 93.288  4.74694e+01 273.288 0.9719 
1 1 1 -3  105 6  o 11 1.62799e+01 5.89053e-01 2.35569e+02 302.632 5.01148e+01  -7.82654e+01 0.00000e+00 0.00000e+00 3.63017e+02 302.632 1.27448e+02 302.632 0.9946 
1 1 1 -3  105 7  o 11 8.79877e+00 7.37177e-01 1.00328e+02 118.786 -1.09148e+01 1.98651e+01  0.00000e+00 0.00000e+00 2.17521e+02 118.786 1.17193e+02 118.786 0.9777 
1 1 1 -3  105 8  o 3  7.88463e+00 8.41497e-01 9.88759e+01 335.640 1.76918e+01  -8.01061e+00 0.00000e+00 0.00000e+00 1.84684e+02 335.640 8.58085e+01 335.640 0.9739 
1 1 1 -3  105 9  o 17 4.62927e+00 1.09216e+00 4.34522e+01 222.967 -3.34007e+00 -3.11110e+00 0.00000e+00 0.00000e+00 1.07260e+02 222.967 6.38080e+01 222.967 0.8822 
1 1 1 -3  105 10 o 14 4.15510e+00 1.09044e+00 7.25011e+01 144.647 -6.04856e+00 4.29103e+00  0.00000e+00 0.00000e+00 6.99893e+01 144.647 2.51175e+00 324.647 0.9299 
1 1 1 -3  105 11 o 2  3.09017e+00 9.35086e-01 3.17766e+01 62.477  1.43029e+00  2.74490e+00  0.00000e+00 0.00000e+00 6.12321e+01 62.477  2.94555e+01 62.477  0.8168 
1 1 1 -3  106 1  o 18 1.23676e+01 5.54096e-01 2.24170e+02 13.212  5.94125e+01  1.39483e+01  0.00000e+00 0.00000e+00 2.29902e+02 13.212  5.73151e+00 13.212  0.9918 
1 1 1 -3  106 2  o 15 2.20517e+00 7.06800e-01 2.89609e+01 151.852 -1.20820e+00 6.46419e-01  0.00000e+00 0.00000e+00 1.69387e+01 151.852 1.20223e+01 331.852 0.5624 
1 1 1 -3  106 3  f 0  3.69099e+00 8.75607e-01 8.18331e+01 213.679 -4.94335e+00 -3.29426e+00 0.00000e+00 0.00000e+00 4.26407e+01 213.679 3.91924e+01 33.680  0.9114 
1 1 1 -3  106 4  o 18 3.59137e+00 8.81932e-01 5.88617e+01 164.033 -3.96908e+00 1.13562e+00  0.00000e+00 0.00000e+00 5.64812e+01 164.033 2.38052e+00 344.033 0.8683 
1 1 1 -3  106 5  o 5  3.86614e+00 9.85258e-01 2.45391e+01 1.527   1.82175e+00  4.85590e-02  0.00000e+00 0.00000e+00 7.07127e+01 1.527   4.61735e+01 1.527   0.6663 
1 1 1 -3  106 6  o 19 6.41518e+00 8.61142e-01 1.10093e+02 28.911  1.36047e+01  7.51347e+00  0.00000e+00 0.00000e+00 1.19235e+02 28.911  9.14116e+00 28.911  0.9673 
1 1 1 -3  106 7  o 5  3.09499e+00 8.79529e-01 5.24024e+01 201.496 -3.73996e+00 -1.47288e+00 0.00000e+00 0.00000e+00 4.64033e+01 201.496 5.99909e+00 21.496  0.8643 
1 1 1 -3  106 8  o 3  5.92824e+00 9.86880e-01 7.54419e+01 81.418  1.46441e+00  9.70353e+00  0.00000e+00 0.00000e+00 1.31939e+02 81.418  5.64973e+01 81.418  0.9476 
1 1 1 -3  106 9  o 7  3.45815e+00 9.86725e-01 3.64014e+01 91.176  -6.80293e-02 3.31428e+00  0.00000e+00 0.00000e+00 6.95963e+01 91.176  3.31949e+01 91.176  0.8308 
1 1 1 -3  106 10 o 15 2.61249e+00 8.41484e-01 9.65633e+01 228.776 -5.50387e+00 -6.28180e+00 0.00000e+00 0.00000e+00 6.21298e+00 48.776  1.02776e+02 48.776  0.9381 
1 1 1 -3  107 1  o 1  6.70149e+00 7.53662e-01 6.71541e+01 68.512  3.40871e+00  8.65863e+00  0.00000e+00 0.00000e+00 1.67126e+02 68.512  9.99715e+01 68.512  0.9446 
1 1 1 -3  107 2  o 14 5.81088e+00 7.80572e-01 1.02605e+02 224.663 -8.83194e+00 -8.72878e+00 0.00000e+00 0.00000e+00 1.03552e+02 224.663 9.46853e-01 224.663 0.9588 
1 1 1 -3  107 3  o 6  4.29889e+00 8.08678e-01 1.02901e+02 84.853  8.11202e-01  9.00615e+00  0.00000e+00 0.00000e+00 4.70479e+01 84.853  5.58528e+01 264.853 0.9430 
1 1 1 -3  107 4  o 2  1.03812e+01 6.19273e-01 1.84655e+02 130.830 -3.04687e+01 3.52608e+01  0.00000e+00 0.00000e+00 1.95081e+02 130.830 1.04258e+01 130.830 0.9892 
1 1 1 -3  107 5  o 5  6.80576e+00 9.55132e-01 1.14504e+02 289.127 4.98303e+00  -1.43680e+01 0.00000e+00 0.00000e+00 1.28643e+02 289.127 1.41390e+01 289.127 0.9665 
1 1 1 -3  107 6  o 9  4.92550e+00 8.83114e-01 5.58192e+01 245.336 -2.72173e+00 -5.92727e+00 0.00000e+00 0.00000e+00 1.11562e+02 245.336 5.57424e+01 245.336 0.9198 
1 1 1 -3  107 7  o 6  4.53837e+00 1.02129e+00 4.12217e+01 317.469 3.00339e+00  -2.75510e+00 0.00000e+00 0.00000e+00 1.03973e+02 317.469 6.27513e+01 317.469 0.8664 
1 1 1 -3  107 8  o 13 4.06557e+00 1.01996e+00 4.16549e+01 170.886 -4.15993e+00 6.67336e-01  0.00000e+00 0.00000e+00 8.90695e+01 170.886 4.74146e+01 170.886 0.8712 
1 1 1 -3  107 9  o 18 3.62195e+00 9.85526e-01 7.31121e+01 49.788  4.63836e+00  5.48634e+00  0.00000e+00 0.00000e+00 5.07932e+01 49.788  2.23190e+01 229.788 0.9275 
1 1 1 -3  107 10 o 5  3.44451e+00 9.77167e-01 2.89767e+01 146.286 -2.44072e+00 1.62860e+00  0.00000e+00 0.00000e+00 7.32198e+01 146.286 4.42431e+01 146.286 0.8050 
1 1 1 -3  108 1  o 5  5.31791e+00 8.34890e-01 9.82365e+01 261.088 -1.62851e+00 -1.03854e+01 0.00000e+00 0.00000e+00 8.89067e+01 261.088 9.32971e+00 81.088  0.9512 
1 1 1 -3  108 2  o 9  9.72754e+00 6.32233e-01 1.11668e+02 336.487 2.23166e+01  -9.70957e+00 0.00000e+00 0.00000e+00 2.40677e+02 336.487 1.29009e+02 336.487 0.9792 
1 1 1 -3  108 3  o 15 2.51700e+00 7.82506e-01 2.31590e+01 3.515   1.28234e+00  7.87693e-02  0.00000e+00 0.00000e+00 2.69401e+01 3.515   3.78117e+00 3.515   0.5383 
1 1 1 -3  108 4  o 6  6.42399e+00 7.89520e-01 9.85016e+01 201.139 -1.27160e+01 -4.91660e+00 0.00000e+00 0.00000e+00 1.30092e+02 201.139 3.15901e+01 201.139 0.9626 
1 1 1 -3  108 5  o 2  2.78987e+00 8.31243e-01 5.63674e+01 5.431   3.51609e+00  3.34272e-01  0.00000e+00 0.00000e+00 3.05142e+01 5.431   2.58531e+01 185.431 0.8428 
1 1 1 -3  108 6  o 3  3.74952e+00 9.01673e-01 5.02357e+01 27.682  4.05800e+00  2.12891e+00  0.00000e+00 0.00000e+00 7.20106e+01 27.682  2.17749e+01 27.682  0.8827 
1 1 1 -3  108 7  o 16 3.88926e+00 1.00956e+00 5.19820e+01 249.561 -1.52243e+00 -4.08519e+00 0.00000e+00 0.00000e+00 7.37998e+01 249.561 2.18178e+01 249.561 0.8761 
1 1 1 -3  108 8  o 1  7.73307e+00 8.03202e-01 1.17319e+02 111.364 -9.25016e+00 2.36472e+01  0.00000e+00 0.00000e+00 1.62317e+02 111.364 4.49976e+01 111.364 0.9801 
1 1 1 -3  108 9  o 9  2.81633e+00 8.79525e-01 5.06401e+01 0.675   4.15148e+00  4.88972e-02  0.00000e+00 0.00000e+00 3.96104e+01 0.675   1.10297e+01 180.675 0.8691 
1 1 1 -3  108 10 o 5  3.96785e+00 1.03298e+00 8.77026e+01 217.003 -7.88005e+00 -5.93872e+00 0.00000e+00 0.00000e+00 5.08763e+01 217.003 3.68264e+01 37.003  0.9479 
1 1 1 -3  109 1  o 12 6.19979e+00 7.79081e-01 1.35675e+02 327.941 1.58892e+01  -9.95138e+00 0.00000e+00 0.00000e+00 8.74312e+01 327.941 4.82437e+01 147.941 0.9730 
1 1 1 -3  109 2  o 4  5.55121e+00 8.20591e-01 1.09434e+02 117.067 -5.93463e+00 1.16138e+01  0.00000e+00 0.00000e+00 8.78079e+01 117.067 2.16259e+01 297.067 0.9609 
1 1 1 -3  109 3  o 3  4.73616e+00 8.69820e-01 1.01771e+02 243.196 -4.44611e+00 -8.80040e+00 0.00000e+00 0.00000e+00 6.41854e+01 243.196 3.75857e+01 63.196  0.9478 
1 1 1 -3  109 4  o 18 1.03488e+01 6.15192e-01 1.55928e+02 75.186  1.06656e+01  4.03266e+01  0.00000e+00 0.00000e+00 2.21909e+02 75.186  6.59816e+01 75.186  0.9879 
1 1 1 -3  109 5  o 18 2.81452e+00 8.38323e-01 3.60297e+01 129.666 -1.65261e+00 1.99298e+00  0.00000e+00 0.00000e+00 4.44808e+01 129.666 8.45103e+00 129.666 0.7743 
1 1 1 -3  109 6  o 13 4.02485e+00 9.41648e-01 8.66033e+01 238.820 -4.15482e+00 -6.86590e+00 0.00000e+00 0.00000e+00 5.24186e+01 238.820 3.41848e+01 58.820  0.9354 
1 1 1 -3  109 7  o 4  3.81051e+00 1.01290e+00 8.20209e+01 52.415  4.77621e+00  6.20535e+00  0.00000e+00 0.00000e+00 4.92945e+01 52.415  3.27264e+01 232.415 0.9338 
1 1 1 -3  109 8  o 16 3.04793e+00 8.94773e-01 5.80411e+01 100.836 -9.30332e-01 4.86029e+00  0.00000e+00 0.00000e+00 4.22573e+01 100.836 1.57838e+01 280.836 0.8922 
1 1 1 -3  109 9  o 4  5.57138e+00 1.02837e+00 8.20677e+01 304.963 7.14292e+00  -1.02153e+01 0.00000e+00 0.00000e+00 1.14877e+02 304.963 3.28095e+01 304.963 0.9590 
1 1 1 -3  109 10 o 9  2.62530e+00 8.50757e-01 5.84964e+01 156.446 -5.16236e+00 2.25048e+00  0.00000e+00 0.00000e+00 2.91372e+01 156.446 2.93592e+01 336.446 0.9062 
1 1 1 -3  110 1  o 3  5.23782e+00 8.65288e-01 9.10178e+01 217.401 -7.77242e+00 -5.94278e+00 0.00000e+00 0.00000e+00 9.24706e+01 217.401 1.45280e+00 217.401 0.9474 
1 1 1 -3  110 2  o 7  2.27876e+00 7.23544e-01 4.24464e+01 200.890 -2.04962e+00 -7.82269e-01 0.00000e+00 0.00000e+00 1.88102e+01 200.890 2.36361e+01 20.890  0.7272 
1 1 1 -3  110 3  o 12 2.45824e+00 7.75886e-01 9.72848e+00 233.799 -3.29817e-01 -4.50617e-01 0.00000e+00 0.00000e+00 1.46978e+01 233.799 4.96935e+00 233.799 0.2689 
1 1 1 -3  110 4  o 15 3.88962e+00 9.01949e-01 5.94240e+01 301.909 2.85345e+00  -4.58257e+00 0.00000e+00 0.00000e+00 7.01759e+01 301.909 1.07519e+01 301.909 0.9019 
1 1 1 -3  110 5  o 12 8.09305e+00 7.07070e-01 1.15122e+02 188.473 -2.35251e+01 -3.50438e+00 0.00000e+00 0.00000e+00 1.77405e+02 188.473 6.22838e+01 188.473 0.9787 
1 1 1 -3  110 6  o 15 6.00220e+00 8.68711e-01 9.05075e+01 7.560   1.29671e+01  1.72098e+00  0.00000e+00 0.00000e+00 1.22409e+02 7.560   3.19018e+01 7.560   0.9610 
1 1 1 -3  110 7  o 1  5.97228e+00 1.06359e+00 1.20730e+02 91.300  -3.66085e-01 1.61354e+01  0.00000e+00 0.00000e+00 9.26740e+01 91.300  2.80560e+01 271.300 0.9685 
1 1 1 -3  110 8  o 16 3.19587e+00 9.33620e-01 3.02205e+01 232.586 -1.68893e+00 -2.20794e+00 0.00000e+00 0.00000e+00 6.31442e+01 232.586 3.29236e+01 232.586 0.7923 
1 1 1 -3  110 9  o 19 8.03109e+00 9.05024e-01 1.48579e+02 324.681 2.81201e+01  -1.99237e+01 0.00000e+00 0.00000e+00 1.43035e+02 324.681 5.54382e+00 144.682 0.9854 
1 1 1 -3  111 1  o 15 3.58846e+00 7.99172e-01 9.07804e+01 242.201 -3.49314e+00 -6.62562e+00 0.00000e+00 0.00000e+00 3.26621e+01 242.201 5.81184e+01 62.201  0.9306 
1 1 1 -3  111 2  o 7  7.81915e+00 6.79046e-01 1.39715e+02 59.020  1.50516e+01  2.50694e+01  0.00000e+00 0.00000e+00 1.44266e+02 59.020  4.55133e+00 59.020  0.9827 
1 1 1 -3  111 3  o 11 2.77944e+00 8.28667e-01 3.56803e+01 226.048 -1.70017e+00 -1.76351e+00 0.00000e+00 0.00000e+00 4.23023e+01 226.048 6.62206e+00 226.048 0.7594 
1 1 1 -3  111 4  o 15 7.22312e+00 7.46617e-01 1.21687e+02 181.317 -2.18734e+01 -5.02771e-01 0.00000e+00 0.00000e+00 1.38920e+02 181.317 1.72328e+01 181.317 0.9769 
1 1 1 -3  111 5  o 2  2.37265e+00 7.61418e-01 2.72239e+01 318.783 1.32386e+00  -1.15965e+00 0.00000e+00 0.00000e+00 3.00765e+01 318.783 2.85257e+00 318.783 0.6541 
1 1 1 -3  111 6  o 5  3.33785e+00 8.81358e-01 3.33896e+01 84.553  2.99345e-01  3.13942e+00  0.00000e+00 0.00000e+00 6.77035e+01 84.553  3.43138e+01 84.553  0.8207 
1 1 1 -3  111 7  o 12 6.24496e+00 9.98783e-01 1.26517e+02 288.310 6.30552e+00  -1.90548e+01 0.00000e+00 0.00000e+00 9.80032e+01 288.310 2.85139e+01 108.310 0.9748 
1 1 1 -3  111 8  f 0  3.21513e+00 9.24311e-01 5.57982e+01 279.264 8.13500e-01  -4.98758e+00 0.00000e+00 0.00000e+00 5.02266e+01 279.264 5.57165e+00 99.264  0.8946 
1 1 1 -3  111 9  o 14 4.10818e+00 1.04796e+00 8.41355e+01 58.959  4.96818e+00  8.25512e+00  0.00000e+00 0.00000e+00 5.91191e+01 58.959  2.50165e+01 238.959 0.9466 
1 1 1 -3  112 1  o 5  2.72563e+00 8.15170e-01 6.52798e+01 351.907 4.39647e+00  -6.25188e-01 0.00000e+00 0.00000e+00 2.32085e+01 351.907 4.20713e+01 171.907 0.8786 
1 1 1 -3  112 2  o 16 4.12291e+00 9.22631e-01 5.31159e+01 261.089 -8.08808e-01 -5.15838e+00 0.00000e+00 0.00000e+00 8.37099e+01 261.089 3.05940e+01 261.089 0.8983 
1 1 1 -3  112 3  f 0  5.70477e+00 8.40013e-01 5.11262e+01 271.098 1.30200e-01  -6.79344e+00 0.00000e+00 0.00000e+00 1.43389e+02 271.098 9.22624e+01 271.098 0.9232 
1 1 1 -3  112 4  o 11 4.20062e+00 9.50219e-01 1.21907e+02 111.272 -4.24241e+00 1.08970e+01  0.00000e+00 0.00000e+00 2.64030e+01 111.272 9.55036e+01 291.272 0.9562 
1 1 1 -3  112 5  o 4  6.70340e+00 8.11968e-01 1.03303e+02 302.861 9.99351e+00  -1.54706e+01 0.00000e+00 0.00000e+00 1.37292e+02 302.861 3.39885e+01 302.861 0.9725 
1 1 1 -3  112 6  o 3  2.69020e+00 8.34249e-01 5.71114e+01 196.050 -4.12507e+00 -1.18673e+00 0.00000e+00 0.00000e+00 2.96173e+01 196.050 2.74941e+01 16.050  0.8739 
1 1 1 -3  112 7  o 14 3.68181e+00 9.83994e-01 7.59128e+01 42.477  5.18148e+00  4.74412e+00  0.00000e+00 0.00000e+00 4.97711e+01 42.477  2.61417e+01 222.477 0.9258 
1 1 1 -3  112 8  o 13 4.18577e+00 9.94904e-01 2.97031e+01 98.556  -5.33851e-01 3.54833e+00  0.00000e+00 0.00000e+00 1.00726e+02 98.556  7.10232e+01 98.556  0.8456 
1 1 1 -3  112 9  o 19 3.04590e+00 9.21813e-01 3.94823e+01 29.364  3.44923e+00  1.94066e+00  0.00000e+00 0.00000e+00 5.71952e+01 29.364  1.77129e+01 29.364  0.8619 
1 1 1 -3  113 1  o 17 3.24376e+00 8.79208e-01 5.74259e+01 256.040 -1.01752e+00 -4.09324e+00 0.00000e+00 0.00000e+00 4.69935e+01 256.040 1.04324e+01 76.040  0.8714 
1 1 1 -3  113 2  o 5  3.33631e+00 9.20682e-01 7.12098e+01 19.276  5.30719e+00  1.85603e+00  0.00000e+00 0.00000e+00 4.04365e+01 19.276  3.07733e+01 199.276 0.9061 
1 1 1 -3  113 3  o 18 1.92395e+00 6.56159e-01 4.07306e+01 100.481 -4.20366e-01 2.27235e+00  0.00000e+00 0.00000e+00 1.20346e+01 100.481 2.86960e+01 280.481 0.7428 
1 1 1 -3  113 4  o 8  3.33360e+00 9.04132e-01 6.32886e+01 140.660 -3.91168e+00 3.20626e+00  0.00000e+00 0.00000e+00 4.68020e+01 140.660 1.64867e+01 320.660 0.8947 
1 1 1 -3  113 5  o 19 7.13607e+00 7.96217e-01 1.12165e+02 259.268 -4.41330e+00 -2.32853e+01 0.00000e+00 0.00000e+00 1.45514e+02 259.268 3.33493e+01 259.268 0.9787 
1 1 1 -3  113 6  o 11 6.04734e+00 9.10371e-01 9.07659e+01 152.292 -1.33917e+01 7.03310e+00  0.00000e+00 0.00000e+00 1.24754e+02 152.292 3.39886e+01 152.292 0.9664 
1 1 1 -3  113 7  o 4  2.58161e+00 8.03242e-01 1.62087e+01 297.694 6.14736e-01  -1.17122e+00 0.00000e+00 0.00000e+00 3.60495e+01 297.694 1.98407e+01 297.694 0.5492 
1 1 1 -3  113 8  o 13 2.51808e+00 7.92534e-01 3.03706e+01 188.899 -2.78021e+00 -4.35316e-01 0.00000e+00 0.00000e+00 4.33993e+01 188.899 1.30287e+01 188.899 0.7952 
1 1 1 -3  113 9  o 15 3.55538e+00 1.00736e+00 1.04615e+02 19.589  1.09483e+01  3.89610e+00  0.00000e+00 0.00000e+00 2.05128e+01 19.589  8.41027e+01 199.589 0.9560 
1 1 1 -3  114 1  o 7  6.81748e+00 7.61131e-01 7.30541e+01 166.110 -1.31904e+01 3.26195e+00  0.00000e+00 0.00000e+00 1.69265e+02 166.110 9.62110e+01 166.110 0.9625 
1 1 1 -3  114 2  o 12 5.78313e+00 8.44763e-01 8.17535e+01 195.391 -1.12001e+01 -3.08323e+00 0.00000e+00 0.00000e+00 1.22363e+02 195.391 4.06099e+01 195.391 0.9559 
1 1 1 -3  114 3  o 3  3.80219e+00 9.46788e-01 1.07447e+02 93.951  -6.51729e-01 9.43692e+00  0.00000e+00 0.00000e+00 2.52593e+01 93.951  8.21878e+01 273.951 0.9456 
1 1 1 -3  114 4  o 3  2.83764e+00 7.69763e-01 5.35528e+01 34.314  3.80649e+00  2.59797e+00  0.00000e+00 0.00000e+00 3.89498e+01 34.314  1.46030e+01 214.314 0.8834 
1 1 1 -3  114 5  o 19 3.78685e+00 9.09360e-01 4.91620e+01 344.868 5.09248e+00  -1.37713e+00 0.00000e+00 0.00000e+00 7.64643e+01 344.868 2.73023e+01 344.868 0.8994 
1 1 1 -3  114 6  o 7  5.02473e+00 8.83102e-01 8.05969e+01 272.809 6.00119e-01  -1.22303e+01 0.00000e+00 0.00000e+00 9.69219e+01 272.809 1.63249e+01 272.809 0.9583 
1 1 1 -3  114 7  o 17 2.51131e+00 7.97511e-01 4.01312e+01 291.478 1.31205e+00  -3.33462e+00 0.00000e+00 0.00000e+00 3.80967e+01 291.478 2.03447e+00 111.478 0.8453 
1 1 1 -3  114 8  o 2  2.78209e+00 8.61412e-01 3.39196e+01 108.139 -1.06426e+00 3.24859e+00  0.00000e+00 0.00000e+00 5.18100e+01 108.139 1.78905e+01 108.139 0.8367 
1 1 1 -3  115 1  o 6  3.86551e+00 9.34557e-01 9.56319e+01 298.273 4.09470e+00  -7.61322e+00 0.00000e+00 0.00000e+00 3.85488e+01 298.273 5.70831e+01 118.273 0.9402 
1 1 1 -3  115 2  o 10 5.09826e+00 8.61622e-01 6.19482e+01 39.545  6.21554e+00  5.13187e+00  0.00000e+00 0.00000e+00 1.14138e+02 39.545  5.21900e+01 39.545  0.9357 
1 1 1 -3  115 3  o 8  4.43356e+00 8.37305e-01 5.07262e+01 64.449  2.77219e+00  5.79862e+00  0.00000e+00 0.00000e+00 9.95443e+01 64.449  4.88182e+01 64.449  0.9185 
1 1 1 -3  115 4  o 19 2.21144e+00 7.21090e-01 1.40741e+01 173.523 -1.04471e+00 1.18596e-01  0.00000e+00 0.00000e+00 2.38025e+01 173.523 9.72838e+00 173.523 0.4643 
1 1 1 -3  115 5  o 4  6.22269e+00 8.86027e-01 1.25220e+02 201.922 -1.98788e+01 -7.99993e+00 0.00000e+00 0.00000e+00 9.88117e+01 201.922 2.64085e+01 21.922  0.9764 
1 1 1 -3  115 6  o 13 3.84578e+00 9.27860e-01 5.03431e+01 235.321 -3.33515e+00 -4.82036e+00 0.00000e+00 0.00000e+00 7.86639e+01 235.321 2.83208e+01 235.321 0.9102 
1 1 1 -3  115 7  o 9  2.96222e+00 8.62242e-01 4.94478e+01 114.221 -1.92703e+00 4.28368e+00  0.00000e+00 0.00000e+00 4.72167e+01 114.221 2.23103e+00 294.221 0.8859 
1 1 1 -3  115 8  o 19 2.56353e+00 8.19437e-01 5.39219e+01 201.724 -4.80056e+00 -1.91275e+00 0.00000e+00 0.00000e+00 3.07484e+01 201.724 2.31735e+01 21.724  0.8971 
1 1 1 -3  116 1  o 17 4.95174e+00 9.09916e-01 3.57101e+01 136.337 -3.42635e+00 3.27011e+00  0.00000e+00 0.00000e+00 1.26370e+02 136.337 9.06601e+01 136.337 0.8869 
1 1 1 -3  116 2  o 13 3.44010e+00 8.75823e-01 7.71955e+01 126.071 -4.11997e+00 5.65590e+00  0.00000e+00 0.00000e+00 4.02834e+01 126.071 3.69121e+01 306.071 0.9255 
1 1 1 -3  116 3  o 19 2.91727e+00 8.49317e-01 7.24919e+01 251.919 -1.96924e+00 -6.03185e+00 0.00000e+00 0.00000e+00 2.62343e+01 251.919 4.62575e+01 71.919  0.9174 
1 1 1 -3  116 4  o 3  4.78287e+00 9.12373e-01 4.60591e+01 129.994 -4.12712e+00 4.91956e+00  0.00000e+00 0.00000e+00 1.15932e+02 129.994 6.98725e+01 129.994 0.9184 
1 1 1 -3  116 5  o 15 3.67099e+00 9.52373e-01 5.35022e+01 294.811 2.23596e+00  -4.83672e+00 0.00000e+00 0.00000e+00 6.83500e+01 294.811 1.48478e+01 294.811 0.9005 
1 1 1 -3  116 6  o 6  3.27719e+00 8.91584e-01 4.21036e+01 164.587 -4.27913e+00 1.17971e+00  0.00000e+00 0.00000e+00 6.39736e+01 164.587 2.18700e+01 164.587 0.8785 
1 1 1 -3  116 7  o 18 3.04790e+00 8.86856e-01 4.30528e+01 74.466  1.23641e+00  4.44807e+00  0.00000e+00 0.00000e+00 5.61305e+01 74.466  1.30777e+01 74.466  0.8837 
1 1 1 -3  116 8  o 14 2.73880e+00 8.67505e-01 8.75694e+01 0.148   8.95998e+00  2.32115e-02  0.00000e+00 0.00000e+00 7.42706e+00 0.148   8.01424e+01 180.148 0.9424 
1 1 1 -3  117 1  o 7  9.15334e+00 6.93518e-01 1.50902e+02 267.210 -2.32642e+00 -4.77427e+01 0.00000e+00 0.00000e+00 1.83257e+02 267.210 3.23543e+01 267.210 0.9895 
1 1 1 -3  117 2  o 1  2.23745e+00 7.26742e-01 9.68782e+01 222.597 -5.19567e+00 -4.77708e+00 0.00000e+00 0.00000e+00 2.04385e+01 42.597  1.17317e+02 42.597  0.9262 
1 1 1 -3  117 3  o 10 8.71756e+00 7.30118e-01 1.45400e+02 93.027  -2.11104e+00 3.99253e+01  0.00000e+00 0.00000e+00 1.72030e+02 93.027  2.66305e+01 93.027  0.9874 
1 1 1 -3  117 4  o 15 2.31474e+00 7.36160e-01 5.05314e+01 329.840 3.35961e+00  -1.95221e+00 0.00000e+00 0.00000e+00 2.27663e+01 329.840 2.77651e+01 149.840 0.8590 
1 1 1 -3  117 5  o 8  8.60242e+00 7.38667e-01 1.14974e+02 82.291  4.61333e+00  3.40805e+01  0.00000e+00 0.00000e+00 1.97381e+02 82.291  8.24079e+01 82.291  0.9854 
1 1 1 -3  117 6  o 1  3.77167e+00 9.50799e-01 1.03446e+02 189.778 -1.19087e+01 -2.05237e+00 0.00000e+00 0.00000e+00 2.95980e+01 189.778 7.38478e+01 9.778   0.9577 
1 1 1 -3  117 7  o 10 2.65605e+00 8.16388e-01 4.95434e+01 1.717   4.93393e+00  1.47944e-01  0.00000e+00 0.00000e+00 3.76647e+01 1.717   1.18787e+01 181.717 0.8919 
1 1 1 -3  118 1  o 11 4.13947e+00 8.74180e-01 6.10886e+01 229.760 -4.54145e+00 -5.36655e+00 0.00000e+00 0.00000e+00 8.02689e+01 229.760 1.91804e+01 229.760 0.9259 
1 1 1 -3  118 2  o 6  2.36887e+00 7.58435e-01 3.67488e+01 119.068 -1.44460e+00 2.59887e+00  0.00000e+00 0.00000e+00 3.38315e+01 119.068 2.91737e+00 299.068 0.8080 
1 1 1 -3  118 3  o 10 3.71538e+00 8.51276e-01 4.77254e+01 131.563 -3.51287e+00 3.96174e+00  0.00000e+00 0.00000e+00 7.55178e+01 131.563 2.77924e+01 131.563 0.8998 
1 1 1 -3  118 4  o 15 8.29465e+00 7.51885e-01 1.26686e+02 216.085 -2.91875e+01 -2.12722e+01 0.00000e+00 0.00000e+00 1.74732e+02 216.085 4.80458e+01 216.085 0.9861 
1 1 1 -3  118 5  o 6  4.02323e+00 9.73126e-01 6.73299e+01 84.139  7.92410e-01  7.71913e+00  0.00000e+00 0.00000e+00 7.09694e+01 84.139  3.63955e+00 84.139  0.9331 
1 1 1 -3  118 6  o 4  3.96559e+00 1.00338e+00 1.00233e+02 251.637 -3.76350e+00 -1.13379e+01 0.00000e+00 0.00000e+00 3.95332e+01 251.637 6.06997e+01 71.637  0.9572 
1 1 1 -3  118 7  o 14 5.26771e+00 9.50163e-01 5.76808e+01 334.819 9.31020e+00  -4.37735e+00 0.00000e+00 0.00000e+00 1.26505e+02 334.819 6.88240e+01 334.819 0.9501 
1 1 1 -3  119 1  o 9  2.35298e+00 7.52451e-01 1.87742e+01 156.580 -1.32590e+00 5.74332e-01  0.00000e+00 0.00000e+00 3.17378e+01 156.580 1.29636e+01 156.580 0.5822 
1 1 1 -3  119 2  o 7  4.01288e+00 8.36258e-01 6.04041e+01 160.579 -7.00089e+00 2.46831e+00  0.00000e+00 0.00000e+00 7.71645e+01 160.579 1.67604e+01 160.579 0.9300 
1 1 1 -3  119 3  o 3  1.92981e+00 6.54445e-01 5.32211e+01 35.918  3.12821e+00  2.26596e+00  0.00000e+00 0.00000e+00 7.80093e+00 35.918  4.54202e+01 215.918 0.8580 
1 1 1 -3  119 4  o 16 2.72059e+00 8.22722e-01 3.81327e+01 101.199 -6.73629e-01 3.40233e+00  0.00000e+00 0.00000e+00 4.60023e+01 101.199 7.86963e+00 101.199 0.8394 
1 1 1 -3  119 5  o 3  2.87682e+00 7.76172e-01 3.87363e+01 37.775  3.52045e+00  2.72829e+00  0.00000e+00 0.00000e+00 5.43823e+01 37.775  1.56460e+01 37.775  0.8790 
1 1 1 -3  119 6  o 16 3.55670e+00 9.56952e-01 4.83612e+01 38.661  4.44961e+00  3.55984e+00  0.00000e+00 0.00000e+00 7.04353e+01 38.661  2.20741e+01 38.661  0.9074 
1 1 1 -3  120 1  o 7  2.58956e+00 8.03875e-01 2.83442e+01 169.119 -2.35462e+00 4.52617e-01  0.00000e+00 0.00000e+00 4.35663e+01 169.119 1.52222e+01 169.119 0.7534 
1 1 1 -3  120 2  o 9  4.50420e+00 9.38544e-01 6.81609e+01 149.885 -8.13177e+00 4.71663e+00  0.00000e+00 0.00000e+00 8.87296e+01 149.885 2.05686e+01 149.885 0.9452 
1 1 1 -3  120 3  o 13 2.03253e+00 6.80812e-01 7.61335e+00 157.913 -5.51494e-01 2.23788e-01  0.00000e+00 0.00000e+00 1.37381e+01 157.913 6.12479e+00 157.913 0.2851 
1 1 1 -3  120 4  o 16 3.73804e+00 9.05479e-01 4.49175e+01 206.652 -4.96134e+00 -2.49005e+00 0.00000e+00 0.00000e+00 7.96390e+01 206.652 3.47215e+01 206.652 0.9048 
1 1 1 -3  120 5  o 4  3.90488e+00 9.65360e-01 5.17502e+01 153.000 -5.71016e+00 2.90942e+00  0.00000e+00 0.00000e+00 8.02557e+01 153.000 2.85055e+01 153.000 0.9183 
1 1 1 -3  120 6  o 5  2.14592e+00 7.37076e-01 5.77173e+01 161.703 -4.84043e+00 1.60052e+00  0.00000e+00 0.00000e+00 1.30035e+01 161.703 4.47138e+01 341.703 0.8956 
1 1 1 -3  121 1  o 15 7.08841e+00 8.24397e-01 1.07877e+02 31.563  2.17265e+01  1.33472e+01  0.00000e+00 0.00000e+00 1.48133e+02 31.563  4.02552e+01 31.563  0.9802 
1 1 1 -3  121 2  o 15 3.41568e+00 8.95335e-01 7.08758e+01 217.195 -6.34447e+00 -4.81480e+00 0.00000e+00 0.00000e+00 4.67668e+01 217.195 2.41090e+01 37.195  0.9349 
1 1 1 -3  121 3  o 3  2.93319e+00 8.42159e-01 6.00989e+01 84.812  5.90715e-01  6.50561e+00  0.00000e+00 0.00000e+00 3.92750e+01 84.812  2.08240e+01 264.812 0.9199 
1 1 1 -3  121 4  o 15 2.71887e+00 8.24179e-01 3.61050e+01 182.222 -3.47590e+00 -1.34854e-01 0.00000e+00 0.00000e+00 4.79756e+01 182.222 1.18706e+01 182.222 0.8400 
1 1 1 -3  121 5  o 15 4.33093e+00 9.99665e-01 9.51031e+01 19.151  1.23347e+01  4.28358e+00  0.00000e+00 0.00000e+00 5.80527e+01 19.151  3.70504e+01 199.151 0.9609 
1 1 1 -3  122 1  o 18 2.09744e+00 6.91327e-01 4.81307e+01 309.995 2.85419e+00  -3.40209e+00 0.00000e+00 0.00000e+00 1.97454e+01 309.995 2.83853e+01 129.995 0.8786 
1 1 1 -3  122 2  o 17 3.11452e+00 8.54988e-01 5.35643e+01 316.376 4.28332e+00  -4.08231e+00 0.00000e+00 0.00000e+00 5.09306e+01 316.376 2.63367e+00 136.376 0.9111 
1 1 1 -3  122 3  o 3  2.30788e+00 7.21855e-01 2.82963e+01 144.400 -2.21515e+00 1.58591e+00  0.00000e+00 0.00000e+00 3.86026e+01 144.400 1.03063e+01 144.400 0.7873 
1 1 1 -3  122 4  o 8  2.38125e+00 7.73355e-01 4.28603e+01 55.720  2.38052e+00  3.49230e+00  0.00000e+00 0.00000e+00 3.35352e+01 55.720  9.32510e+00 235.720 0.8717 
1 1 1 -3  122 5  o 19 2.33250e+00 7.60025e-01 7.65534e+01 188.904 -7.49233e+00 -1.17380e+00 0.00000e+00 0.00000e+00 3.38205e+00 188.904 7.31713e+01 8.904   0.9315 
1 1 1 -3  123 1  o 17 6.40991e+00 8.68240e-01 9.11277e+01 261.347 -3.10919e+00 -2.04312e+01 0.00000e+00 0.00000e+00 1.39115e+02 261.347 4.79873e+01 261.347 0.9755 
1 1 1 -3  123 2  o 6  2.07651e+00 6.91071e-01 3.98604e+01 59.322  1.90895e+00  3.21785e+00  0.00000e+00 0.00000e+00 2.53311e+01 59.322  1.45294e+01 239.322 0.8528 
1 1 1 -3  123 3  o 14 6.66080e+00 8.49992e-01 9.92443e+01 38.105  1.98454e+01  1.55636e+01  0.00000e+00 0.00000e+00 1.40990e+02 38.105  4.17455e+01 38.105  0.9800 
1 1 1 -3  123 4  o 8  2.79056e+00 8.39526e-01 5.59978e+01 152.145 -5.33960e+00 2.82176e+00  0.00000e+00 0.00000e+00 3.77361e+01 152.145 1.82617e+01 332.145 0.9130 
1 1 1 -3  124 1  o 9  3.69474e+00 8.93434e-01 7.32048e+01 314.894 6.91317e+00  -6.93882e+00 0.00000e+00 0.00000e+00 5.56551e+01 314.894 1.75497e+01 134.894 0.9475 
1 1 1 -3  124 2  o 14 2.64468e+00 7.80943e-01 6.18799e+01 161.662 -6.08572e+00 2.01712e+00  0.00000e+00 0.00000e+00 2.74982e+01 161.662 3.43817e+01 341.662 0.9183 
1 1 1 -3  124 3  o 9  2.19975e+00 7.22764e-01 4.01752e+01 317.178 2.87677e+00  -2.66593e+00 0.00000e+00 0.00000e+00 2.94638e+01 317.178 1.07115e+01 137.178 0.8605 
1 1 1 -3  125 1  o 15 2.06593e+00 6.89373e-01 2.10900e+01 128.106 -1.34676e+00 1.71722e+00  0.00000e+00 0.00000e+00 3.40667e+01 128.106 1.29766e+01 128.106 0.7256 
1 1 1 -3  125 2  o 10 2.40199e+00 7.60773e-01 3.95625e+01 149.641 -3.52482e+00 2.06464e+00  0.00000e+00 0.00000e+00 3.70264e+01 149.641 2.53608e+00 329.641 0.8667 
1 1 1 -3  126 1  o 1  2.08979e+00 6.92672e-01 3.74815e+01 57.314  2.07817e+00  3.23887e+00  0.00000e+00 0.00000e+00 2.84300e+01 57.314  9.05151e+00 237.314 0.8574 
1 1 1 -3  127 1  o 7  2.64974e+00 8.19102e-01 2.84635e+01 278.925 4.41858e-01  -2.81359e+00 0.00000e+00 0.00000e+00 4.92987e+01 278.925 2.08352e+01 278.925 0.7981 
1 1 1 -2  0   1  o 16 2.61086e+01 7.25012e-01 5.99723e+02 180.000 -1.47114e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.83147e+02 180.000 3.16576e+02 0.000   0.8998 
1 1 1 -2  0   2  o 9  2.06241e+01 5.84610e-01 6.34638e+02 0.000   1.84259e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.02363e+02 0.000   5.32275e+02 180.000 0.9510 
1 1 1 -2  0   3  o 4  6.57368e+00 2.85045e-01 2.13032e+02 180.000 -2.40413e-01 -0.00000e+00 0.00000e+00 0.00000e+00 1.54781e+02 0.000   3.67814e+02 0.000   0.2359 
1 1 1 -2  0   4  o 19 1.29315e+01 3.32851e-01 8.15352e+01 0.000   2.73385e-01  0.00000e+00  0.00000e+00 0.00000e+00 4.80192e+01 0.000   3.35160e+01 180.000 0.2668 
1 1 1 -2  0   5  f 0  3.05694e+01 5.96006e-01 8.29327e+02 0.000   7.28985e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.18287e+02 0.000   5.11040e+02 180.000 1.0000 
1 1 1 -2  0   6  o 15 8.80650e+00 3.58978e-01 1.59545e+02 180.000 -6.06190e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.93851e+01 180.000 1.40160e+02 0.000   0.5414 
1 1 1 -2  0   7  o 19 5.44031e+01 1.09514e+00 1.12508e+03 180.000 -2.76130e+01 -0.00000e+00 0.00000e+00 0.00000e+00 9.15460e+02 180.000 2.09621e+02 0.000   1.0000 
1 1 1 -2  0   8  o 7  1.39163e+01 4.97868e-01 4.99176e+02 180.000 -4.54898e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.23953e+01 180.000 4.76781e+02 0.000   0.9998 
1 1 1 -2  0   9  o 2  3.35520e+01 7.11402e-01 7.26694e+02 0.000   1.64786e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.30333e+02 0.000   1.96361e+02 180.000 1.0000 
1 1 1 -2  0   10 o 1  2.98226e+01 7.85793e-01 6.89599e+02 0.000   2.14322e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.26968e+02 0.000   2.62631e+02 180.000 1.0000 
1 1 1 -2  0   11 o 10 1.63859e+01 4.96116e-01 2.89035e+02 0.000   6.53289e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.24014e+02 0.000   3.49795e+01 0.000   1.0000 
1 1 1 -2  0   12 o 14 3.39723e+01 7.72421e-01 4.96324e+02 0.000   2.90769e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.73698e+02 0.000   2.77374e+02 0.000   1.0000 
1 1 1 -2  0   13 o 11 1.54862e+01 5.94285e-01 2.75584e+02 0.000   1.17369e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.02865e+02 0.000   2.72809e+01 0.000   1.0000 
1 1 1 -2  0   14 o 17 1.39118e+00 9.58660e-01 2.95053e+01 180.000 -1.47635e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.18958e+01 0.000   5.14010e+01 0.000   0.1466 
1 1 1 -2  0   15 o 18 3.65304e+00 1.48461e+00 1.76239e+02 180.000 -2.75057e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.11519e+01 0.000   2.17391e+02 0.000   0.9919 
1 1 1 -2  0   16 o 14 9.94747e+00 9.07664e-01 8.28201e+01 0.000   5.35435e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.87650e+02 0.000   2.04830e+02 0.000   1.0000 
1 1 1 -2  0   17 o 17 1.90850e+00 1.29579e+00 1.01619e+02 0.000   1.37298e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.91807e+01 180.000 1.40800e+02 180.000 0.8794 
1 1 1 -2  0   18 o 3  2.97726e+00 1.79663e+00 7.86882e+01 0.000   1.53911e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.22104e+01 0.000   5.64778e+01 180.000 0.9120 
1 1 1 -2  0   19 o 18 3.03242e+00 1.91451e+00 2.93430e+01 0.000   5.90435e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.03327e+01 0.000   9.89649e-01 0.000   0.5302 
1 1 1 -2  0   20 o 17 3.59512e+00 2.22845e+00 9.73442e+01 180.000 -2.25375e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.30160e+01 180.000 6.43282e+01 0.000   0.9782 
1 1 1 -2  1   1  o 9  1.74884e+01 3.62811e-01 3.29183e+02 235.604 -6.07633e-01 -8.87573e-01 0.00000e+00 0.00000e+00 1.86089e+01 55.604  3.47792e+02 55.604  0.4726 
1 1 1 -2  1   2  o 13 7.65609e+00 2.16599e-01 2.91267e+02 83.675  6.89513e-02  6.22099e-01  0.00000e+00 0.00000e+00 2.05377e+02 263.675 4.96644e+02 263.675 0.2986 
1 1 1 -2  1   3  o 17 3.44004e+01 6.59772e-01 9.54554e+02 161.035 -1.06128e+01 3.64700e+00  0.00000e+00 0.00000e+00 2.78728e+02 161.035 6.75826e+02 341.035 0.9543 
1 1 1 -2  1   4  o 11 1.89498e+01 2.94901e-01 1.91791e+02 88.686  4.31551e-02  1.88131e+00  0.00000e+00 0.00000e+00 2.90267e+02 88.686  9.84760e+01 88.686  0.6774 
1 1 1 -2  1   5  o 11 7.83196e+00 1.75759e-01 8.87842e+01 296.721 1.79969e-01  -3.57497e-01 0.00000e+00 0.00000e+00 3.10919e+01 116.721 1.19876e+02 116.721 0.1962 
1 1 1 -2  1   6  o 16 7.97865e+00 1.78286e-01 2.53466e+02 296.029 7.65868e-01  -1.56822e+00 0.00000e+00 0.00000e+00 5.85007e+01 116.029 3.11967e+02 116.029 0.6512 
1 1 1 -2  1   7  o 18 2.68719e+01 4.02782e-01 4.95064e+02 40.714  9.16381e+00  7.88611e+00  0.00000e+00 0.00000e+00 4.70213e+02 40.714  2.48517e+01 220.714 0.9577 
1 1 1 -2  1   8  o 14 1.40372e+01 2.65808e-01 3.22955e+02 262.462 -7.79796e-01 -5.89291e+00 0.00000e+00 0.00000e+00 1.56686e+02 262.462 1.66269e+02 82.462  0.9115 
1 1 1 -2  1   9  o 16 4.13047e+01 9.61404e-01 7.27069e+02 56.546  2.20022e+01  3.32994e+01  0.00000e+00 0.00000e+00 8.00903e+02 56.546  7.38342e+01 56.546  0.9874 
1 1 1 -2  1   10 o 4  2.81141e+01 5.91583e-01 3.26883e+02 252.742 -5.67320e+00 -1.82615e+01 0.00000e+00 0.00000e+00 6.97814e+02 252.742 3.70931e+02 252.742 0.9735 
1 1 1 -2  1   11 o 15 2.69871e+01 4.65801e-01 4.36166e+02 74.644  8.55766e+00  3.11613e+01  0.00000e+00 0.00000e+00 5.57760e+02 74.644  1.21594e+02 74.644  0.9844 
1 1 1 -2  1   12 o 7  1.20333e+01 4.77671e-01 1.53612e+02 266.752 -3.62856e-01 -6.39364e+00 0.00000e+00 0.00000e+00 2.59448e+02 266.752 1.05836e+02 266.752 0.9182 
1 1 1 -2  1   13 o 9  6.72925e+00 5.87108e-01 1.78654e+02 134.720 -4.57361e+00 4.61847e+00  0.00000e+00 0.00000e+00 5.24626e+01 134.720 1.26191e+02 314.720 0.9195 
1 1 1 -2  1   14 o 7  1.52148e+01 4.63958e-01 1.98015e+02 182.886 -2.23771e+01 -1.12804e+00 0.00000e+00 0.00000e+00 3.56961e+02 182.886 1.58946e+02 182.886 0.9774 
1 1 1 -2  1   15 o 17 9.91084e+00 6.04878e-01 2.08122e+02 230.446 -1.27141e+01 -1.53936e+01 0.00000e+00 0.00000e+00 1.52003e+02 230.446 5.61187e+01 50.446  0.9746 
1 1 1 -2  1   16 o 11 1.60305e+01 5.60231e-01 2.45971e+02 27.204  4.66909e+01  2.40001e+01  0.00000e+00 0.00000e+00 3.45358e+02 27.204  9.93872e+01 27.204  0.9904 
1 1 1 -2  1   17 o 3  9.41961e+00 7.64776e-01 1.52887e+02 89.106  3.41074e-01  2.18535e+01  0.00000e+00 0.00000e+00 1.89444e+02 89.106  3.65569e+01 89.106  0.9768 
1 1 1 -2  1   18 o 14 1.40193e+01 8.03243e-01 2.63719e+02 244.923 -2.69661e+01 -5.76281e+01 0.00000e+00 0.00000e+00 2.53142e+02 244.923 1.05773e+01 64.924  0.9921 
1 1 1 -2  1   19 o 1  1.17594e+01 1.02802e+00 1.19062e+02 31.462  1.95927e+01  1.19883e+01  0.00000e+00 0.00000e+00 3.07791e+02 31.462  1.88729e+02 31.462  0.9780 
1 1 1 -2  1   20 f 0  3.65570e+00 1.20593e+00 1.60993e+01 229.100 -6.57871e-01 -7.59455e-01 0.00000e+00 0.00000e+00 4.46209e+01 229.100 2.85216e+01 229.100 0.4481 
1 1 1 -2  2   1  o 12 3.09441e+01 5.99847e-01 1.45356e+02 90.297  -4.27763e-03 8.24601e-01  0.00000e+00 0.00000e+00 2.97498e+02 90.297  1.52142e+02 90.297  0.3808 
1 1 1 -2  2   2  o 15 2.47929e+01 4.86541e-01 5.13985e+02 95.042  -3.10559e-01 3.51991e+00  0.00000e+00 0.00000e+00 2.71185e+02 95.042  2.42800e+02 275.042 0.8428 
1 1 1 -2  2   3  o 14 1.52238e+01 4.49639e-01 1.37779e+02 276.710 8.33517e-02  -7.08453e-01 0.00000e+00 0.00000e+00 5.42350e+01 276.710 8.35438e+01 96.710  0.3358 
1 1 1 -2  2   4  o 7  1.33618e+01 2.46606e-01 2.63241e+02 288.354 5.71519e-01  -1.72265e+00 0.00000e+00 0.00000e+00 7.04182e+01 288.354 1.92822e+02 108.354 0.6649 
1 1 1 -2  2   5  o 3  2.75318e+01 3.82724e-01 4.75082e+02 331.485 6.59309e+00  -3.58201e+00 0.00000e+00 0.00000e+00 4.86925e+02 331.485 1.18428e+01 331.485 0.9308 
1 1 1 -2  2   6  o 1  1.49295e+01 2.55039e-01 3.93719e+02 53.658  3.00079e+00  4.07883e+00  0.00000e+00 0.00000e+00 1.07605e+02 53.658  2.86114e+02 233.658 0.8948 
1 1 1 -2  2   7  o 11 3.19959e+01 4.70279e-01 6.96414e+02 93.001  -1.05850e+00 2.01881e+01  0.00000e+00 0.00000e+00 4.73607e+02 93.001  2.22807e+02 273.001 0.9749 
1 1 1 -2  2   8  o 12 4.02141e+01 6.66560e-01 8.40229e+02 87.221  2.12753e+00  4.38324e+01  0.00000e+00 0.00000e+00 6.50015e+02 87.221  1.90214e+02 267.221 0.9885 
1 1 1 -2  2   9  o 1  4.07372e+01 7.49884e-01 8.98146e+02 215.386 -3.99935e+01 -2.84071e+01 0.00000e+00 0.00000e+00 6.12431e+02 215.386 2.85714e+02 35.386  0.9898 
1 1 1 -2  2   10 o 14 1.77231e+01 3.36364e-01 2.62788e+02 142.413 -7.76205e+00 5.97481e+00  0.00000e+00 0.00000e+00 3.65926e+02 142.413 1.03138e+02 142.413 0.9475 
1 1 1 -2  2   11 o 5  3.06831e+01 4.90903e-01 5.08139e+02 49.557  2.77286e+01  3.25314e+01  0.00000e+00 0.00000e+00 6.26304e+02 49.557  1.18166e+02 49.557  0.9882 
1 1 1 -2  2   12 o 9  2.95748e+01 4.97754e-01 4.35901e+02 304.030 2.49593e+01  -3.69624e+01 0.00000e+00 0.00000e+00 6.57251e+02 304.030 2.21350e+02 304.030 0.9887 
1 1 1 -2  2   13 o 19 1.43821e+01 5.19528e-01 2.46945e+02 43.700  1.39860e+01  1.33655e+01  0.00000e+00 0.00000e+00 2.76185e+02 43.700  2.92401e+01 43.700  0.9738 
1 1 1 -2  2   14 o 7  8.32629e+00 5.23987e-01 1.67339e+02 338.398 9.55408e+00  -3.78314e+00 0.00000e+00 0.00000e+00 1.27856e+02 338.398 3.94824e+01 158.398 0.9500 
1 1 1 -2  2   15 o 3  1.42533e+01 5.16697e-01 2.24717e+02 212.150 -2.67225e+01 -1.67957e+01 0.00000e+00 0.00000e+00 2.98193e+02 212.150 7.34757e+01 212.150 0.9840 
1 1 1 -2  2   16 o 3  6.81401e+00 7.67738e-01 6.69251e+01 119.529 -2.80090e+00 4.94483e+00  0.00000e+00 0.00000e+00 1.63289e+02 119.529 9.63639e+01 119.529 0.9071 
1 1 1 -2  2   17 o 14 4.79272e+00 1.04266e+00 4.64007e+01 137.154 -2.16709e+00 2.01001e+00  0.00000e+00 0.00000e+00 9.74317e+01 137.154 5.10310e+01 137.154 0.8067 
1 1 1 -2  2   18 f 0  1.63145e+01 7.64081e-01 2.41519e+02 344.886 6.67692e+01  -1.80332e+01 0.00000e+00 0.00000e+00 3.60342e+02 344.886 1.18823e+02 344.886 0.9927 
1 1 1 -2  2   19 o 4  1.07803e+01 1.16211e+00 1.68638e+02 150.356 -2.37921e+01 1.35402e+01  0.00000e+00 0.00000e+00 2.24105e+02 150.356 5.54663e+01 150.356 0.9816 
1 1 1 -2  2   20 o 16 3.71159e+00 1.21307e+00 6.67907e+01 263.336 -4.88440e-01 -4.18050e+00 0.00000e+00 0.00000e+00 5.30586e+01 263.336 1.37322e+01 83.336  0.8711 
1 1 1 -2  3   1  o 15 9.45064e+00 2.40509e-01 2.85686e+02 244.877 -2.04255e-01 -4.35581e-01 0.00000e+00 0.00000e+00 2.02633e+02 64.877  4.88319e+02 64.877  0.2338 
1 1 1 -2  3   2  o 8  4.75260e+01 9.04508e-01 3.67876e+02 59.202  2.43014e+00  4.07700e+00  0.00000e+00 0.00000e+00 1.21634e+03 59.202  8.48468e+02 59.202  0.8871 
1 1 1 -2  3   3  o 9  3.72570e+01 6.46039e-01 7.02979e+02 153.838 -7.90051e+00 3.88110e+00  0.00000e+00 0.00000e+00 6.14516e+02 153.838 8.84632e+01 333.837 0.9414 
1 1 1 -2  3   4  o 12 2.30781e+01 3.78125e-01 3.49195e+02 277.131 5.12710e-01  -4.09793e+00 0.00000e+00 0.00000e+00 4.03376e+02 277.131 5.41814e+01 277.131 0.8683 
1 1 1 -2  3   5  o 11 8.59782e+00 1.79609e-01 2.41305e+02 119.131 -5.78056e-01 1.03723e+00  0.00000e+00 0.00000e+00 7.70568e+01 299.131 3.18362e+02 299.131 0.5089 
1 1 1 -2  3   6  f 0  1.35796e+01 2.48527e-01 4.25799e+02 49.229  3.24650e+00  3.76499e+00  0.00000e+00 0.00000e+00 2.91093e+01 49.229  3.96690e+02 229.229 0.8927 
1 1 1 -2  3   7  o 4  2.10656e+01 4.15110e-01 4.70079e+02 138.535 -6.73029e+00 5.94713e+00  0.00000e+00 0.00000e+00 2.74658e+02 138.535 1.95421e+02 318.535 0.9426 
1 1 1 -2  3   8  o 14 2.58191e+01 4.53877e-01 6.30632e+02 297.508 9.81766e+00  -1.88528e+01 0.00000e+00 0.00000e+00 3.14201e+02 297.508 3.16431e+02 117.508 0.9762 
1 1 1 -2  3   9  o 6  4.00048e+01 6.67476e-01 6.37989e+02 259.094 -7.64655e+00 -3.96848e+01 0.00000e+00 0.00000e+00 8.42116e+02 259.094 2.04128e+02 259.094 0.9875 
1 1 1 -2  3   10 o 17 7.08090e+01 1.01563e+00 1.15389e+03 5.142   1.65125e+02  1.48598e+01  0.00000e+00 0.00000e+00 1.48919e+03 5.142   3.35299e+02 5.142   0.9970 
1 1 1 -2  3   11 o 8  4.16161e+01 6.28433e-01 6.67427e+02 58.227  3.97747e+01  6.42183e+01  0.00000e+00 0.00000e+00 8.79208e+02 58.227  2.11780e+02 58.227  0.9934 
1 1 1 -2  3   12 o 1  8.37710e+00 4.19503e-01 2.02067e+02 65.447  2.44426e+00  5.35029e+00  0.00000e+00 0.00000e+00 8.30669e+01 65.447  1.19000e+02 245.447 0.9105 
1 1 1 -2  3   13 o 9  1.69696e+01 4.78723e-01 3.87819e+02 281.746 7.32622e+00  -3.52336e+01 0.00000e+00 0.00000e+00 2.37160e+02 281.746 1.50659e+02 101.746 0.9860 
1 1 1 -2  3   14 o 7  1.04892e+01 4.86668e-01 1.49099e+02 300.926 5.95718e+00  -9.94357e+00 0.00000e+00 0.00000e+00 2.25052e+02 300.926 7.59536e+01 300.926 0.9558 
1 1 1 -2  3   15 o 1  1.71190e+01 5.19061e-01 2.73183e+02 77.316  1.01126e+01  4.49312e+01  0.00000e+00 0.00000e+00 3.58084e+02 77.316  8.49014e+01 77.316  0.9891 
1 1 1 -2  3   16 o 9  8.83555e+00 6.72672e-01 1.80851e+02 160.207 -1.93497e+01 6.96363e+00  0.00000e+00 0.00000e+00 1.40116e+02 160.207 4.07354e+01 340.207 0.9754 
1 1 1 -2  3   17 o 5  1.00546e+01 7.42157e-01 1.39268e+02 152.713 -1.90670e+01 9.83593e+00  0.00000e+00 0.00000e+00 2.25974e+02 152.713 8.67063e+01 152.713 0.9764 
1 1 1 -2  3   18 o 2  6.79376e+00 1.14104e+00 1.10879e+02 192.295 -1.04664e+01 -2.28100e+00 0.00000e+00 0.00000e+00 1.29491e+02 192.295 1.86121e+01 192.295 0.9521 
1 1 1 -2  3   19 o 9  1.20736e+01 1.04571e+00 1.77772e+02 337.124 3.20775e+01  -1.35340e+01 0.00000e+00 0.00000e+00 2.63863e+02 337.124 8.60913e+01 337.124 0.9855 
1 1 1 -2  3   20 o 18 6.38302e+00 1.57975e+00 1.50168e+02 305.171 7.08907e+00  -1.00603e+01 0.00000e+00 0.00000e+00 7.66141e+01 305.171 7.35538e+01 125.171 0.9585 
1 1 1 -2  4   1  o 4  1.74437e+01 5.21114e-01 5.05734e+02 63.842  6.65595e-01  1.35515e+00  0.00000e+00 0.00000e+00 1.13367e+02 243.841 6.19101e+02 243.841 0.5985 
1 1 1 -2  4   2  o 3  1.71600e+01 3.52835e-01 2.43418e+02 239.058 -5.70747e-01 -9.52056e-01 0.00000e+00 0.00000e+00 6.86605e+01 239.058 1.74758e+02 59.058  0.4840 
1 1 1 -2  4   3  o 10 1.92580e+01 4.26937e-01 4.60660e+02 131.013 -1.93144e+00 2.22085e+00  0.00000e+00 0.00000e+00 1.22203e+02 131.013 3.38457e+02 311.013 0.8057 
1 1 1 -2  4   4  o 17 3.61841e+01 5.70296e-01 7.02740e+02 149.841 -1.11536e+01 6.48074e+00  0.00000e+00 0.00000e+00 6.02333e+02 149.841 1.00407e+02 329.841 0.9604 
1 1 1 -2  4   5  o 1  2.07860e+01 3.47038e-01 5.62677e+02 298.835 3.20968e+00  -5.82993e+00 0.00000e+00 0.00000e+00 1.56359e+02 298.835 4.06318e+02 118.835 0.9215 
1 1 1 -2  4   6  o 15 1.97776e+01 3.00111e-01 2.54467e+02 31.216  3.68858e+00  2.23525e+00  0.00000e+00 0.00000e+00 3.94593e+02 31.216  1.40126e+02 31.216  0.8746 
1 1 1 -2  4   7  o 4  3.11347e+01 4.79032e-01 5.89368e+02 56.336  9.20208e+00  1.38167e+01  0.00000e+00 0.00000e+00 5.42663e+02 56.336  4.67051e+01 236.336 0.9694 
1 1 1 -2  4   8  o 13 2.55598e+01 4.49565e-01 6.11254e+02 338.263 1.89298e+01  -7.54704e+00 0.00000e+00 0.00000e+00 3.23088e+02 338.263 2.88166e+02 158.263 0.9751 
1 1 1 -2  4   9  o 5  2.09098e+01 3.48893e-01 3.98105e+02 102.946 -2.97944e+00 1.29610e+01  0.00000e+00 0.00000e+00 3.55211e+02 102.946 4.28939e+01 282.946 0.9616 
1 1 1 -2  4   10 o 16 1.46885e+01 3.14143e-01 1.31246e+02 86.065  2.78160e-01  4.04415e+00  0.00000e+00 0.00000e+00 3.44751e+02 86.065  2.13506e+02 86.065  0.8656 
1 1 1 -2  4   11 o 14 3.90037e+01 7.94942e-01 7.36201e+02 250.317 -2.59822e+01 -7.26319e+01 0.00000e+00 0.00000e+00 7.13536e+02 250.317 2.26651e+01 70.317  0.9935 
1 1 1 -2  4   12 o 3  3.65479e+01 5.97836e-01 6.80694e+02 249.864 -2.94039e+01 -8.01956e+01 0.00000e+00 0.00000e+00 6.77562e+02 249.864 3.13285e+00 69.864  0.9941 
1 1 1 -2  4   13 o 1  7.20912e+00 5.22485e-01 8.02219e+01 260.573 -5.15498e-01 -3.10475e+00 0.00000e+00 0.00000e+00 1.40664e+02 260.573 6.04426e+01 260.573 0.8203 
1 1 1 -2  4   14 o 5  4.23439e+00 8.31078e-01 1.49667e+02 33.034  3.70413e+00  2.40865e+00  0.00000e+00 0.00000e+00 1.09452e+01 213.034 1.60612e+02 213.034 0.8779 
1 1 1 -2  4   15 o 11 1.08401e+01 5.41922e-01 2.41362e+02 153.420 -2.29350e+01 1.14749e+01  0.00000e+00 0.00000e+00 1.54819e+02 153.420 8.65433e+01 333.420 0.9803 
1 1 1 -2  4   16 o 17 2.66970e+00 8.32348e-01 2.80395e+01 304.598 4.89859e-01  -7.10145e-01 0.00000e+00 0.00000e+00 1.12984e+01 304.598 1.67410e+01 124.598 0.3956 
1 1 1 -2  4   17 o 18 2.52728e+00 8.21480e-01 6.58718e+01 7.038   2.44469e+00  3.01831e-01  0.00000e+00 0.00000e+00 5.67326e+00 7.038   6.01986e+01 187.038 0.7609 
1 1 1 -2  4   18 o 8  6.76905e+00 1.13075e+00 5.11826e+01 105.052 -1.28722e+00 4.78674e+00  0.00000e+00 0.00000e+00 1.73284e+02 105.052 1.22101e+02 105.052 0.8924 
1 1 1 -2  4   19 o 13 4.20970e+00 1.17059e+00 6.62927e+01 232.628 -2.57124e+00 -3.36644e+00 0.00000e+00 0.00000e+00 6.99555e+01 232.628 3.66283e+00 232.628 0.8720 
1 1 1 -2  4   20 o 9  6.43717e+00 1.55264e+00 7.42363e+01 273.640 3.97500e-01  -6.24893e+00 0.00000e+00 0.00000e+00 1.44391e+02 273.640 7.01546e+01 273.640 0.9162 
1 1 1 -2  5   1  o 2  2.97330e+01 5.77621e-01 5.88953e+02 303.775 3.59222e+00  -5.37107e+00 0.00000e+00 0.00000e+00 4.37879e+02 303.775 1.51074e+02 123.775 0.9190 
1 1 1 -2  5   2  o 11 3.44203e+01 6.61517e-01 8.97268e+02 12.348  1.04076e+01  2.27839e+00  0.00000e+00 0.00000e+00 3.33736e+02 12.348  5.63532e+02 192.348 0.9518 
1 1 1 -2  5   3  o 16 4.42902e+01 8.68418e-01 1.07512e+03 71.763  4.83824e+00  1.46840e+01  0.00000e+00 0.00000e+00 5.33879e+02 71.763  5.41241e+02 251.763 0.9671 
1 1 1 -2  5   4  o 3  2.83472e+01 5.01110e-01 7.27534e+02 297.398 4.76704e+00  -9.19738e+00 0.00000e+00 0.00000e+00 2.84238e+02 297.398 4.43296e+02 117.398 0.9504 
1 1 1 -2  5   5  o 17 2.62818e+01 4.25467e-01 3.69342e+02 226.908 -3.74778e+00 -4.00606e+00 0.00000e+00 0.00000e+00 5.22118e+02 226.908 1.52776e+02 226.908 0.9036 
1 1 1 -2  5   6  o 13 1.13042e+01 3.57816e-01 1.46171e+02 287.563 4.25510e-01  -1.34442e+00 0.00000e+00 0.00000e+00 9.69388e+01 287.563 4.92326e+01 107.563 0.5731 
1 1 1 -2  5   7  o 7  2.73014e+01 3.97629e-01 5.52115e+02 169.237 -1.33861e+01 2.54452e+00  0.00000e+00 0.00000e+00 4.33542e+02 169.237 1.18573e+02 349.237 0.9626 
1 1 1 -2  5   8  o 3  1.65902e+01 4.10421e-01 2.60055e+02 276.052 5.93099e-01  -5.59405e+00 0.00000e+00 0.00000e+00 3.03462e+02 276.052 4.34076e+01 276.052 0.9061 
1 1 1 -2  5   9  o 19 1.60994e+01 2.98896e-01 2.22223e+02 270.902 8.99450e-02  -5.71500e+00 0.00000e+00 0.00000e+00 3.25254e+02 270.902 1.03031e+02 270.902 0.9077 
1 1 1 -2  5   10 o 5  5.62994e+00 5.49425e-01 1.58752e+02 268.502 -4.87168e-02 -1.86277e+00 0.00000e+00 0.00000e+00 1.66827e+01 88.502  1.75435e+02 88.502  0.6740 
1 1 1 -2  5   11 o 2  1.39349e+01 3.76093e-01 2.67736e+02 246.972 -4.12263e+00 -9.69935e+00 0.00000e+00 0.00000e+00 2.28212e+02 246.972 3.95246e+01 66.972  0.9513 
1 1 1 -2  5   12 o 17 1.66687e+01 3.87487e-01 3.61758e+02 58.486  1.09634e+01  1.78806e+01  0.00000e+00 0.00000e+00 2.46323e+02 58.486  1.15435e+02 238.486 0.9759 
1 1 1 -2  5   13 o 2  2.20586e+01 5.00272e-01 4.19900e+02 225.477 -3.54098e+01 -3.60049e+01 0.00000e+00 0.00000e+00 3.95815e+02 225.477 2.40850e+01 45.477  0.9900 
1 1 1 -2  5   14 o 14 1.59568e+01 4.53637e-01 3.14109e+02 263.308 -4.34451e+00 -3.70264e+01 0.00000e+00 0.00000e+00 2.73314e+02 263.308 4.07943e+01 83.308  0.9865 
1 1 1 -2  5   15 o 1  1.76608e+01 5.15760e-01 3.42884e+02 11.917  5.83527e+01  1.23146e+01  0.00000e+00 0.00000e+00 3.09990e+02 11.917  3.28945e+01 191.917 0.9916 
1 1 1 -2  5   16 o 10 5.86477e+00 8.40950e-01 1.25282e+02 166.759 -8.21555e+00 1.93311e+00  0.00000e+00 0.00000e+00 7.97598e+01 166.759 4.55219e+01 346.759 0.9387 
1 1 1 -2  5   17 f 0  4.00012e+00 9.93950e-01 6.90415e+01 176.650 -3.75515e+00 2.19832e-01  0.00000e+00 0.00000e+00 5.79991e+01 176.650 1.10424e+01 356.650 0.8537 
1 1 1 -2  5   18 o 1  6.63174e+00 1.14339e+00 8.58600e+01 123.547 -4.46706e+00 6.73704e+00  0.00000e+00 0.00000e+00 1.44785e+02 123.547 5.89249e+01 123.547 0.9359 
1 1 1 -2  5   19 o 10 3.78901e+00 1.17719e+00 8.93098e+01 260.763 -8.20737e-01 -5.04690e+00 0.00000e+00 0.00000e+00 3.66851e+01 260.763 5.26247e+01 80.763  0.8959 
1 1 1 -2  5   20 o 3  4.06794e+00 1.28539e+00 7.94586e+01 319.757 3.96216e+00  -3.35333e+00 0.00000e+00 0.00000e+00 5.58931e+01 319.757 2.35655e+01 139.757 0.8976 
1 1 1 -2  6   1  o 18 2.25912e+01 5.60004e-01 5.28460e+02 48.011  2.78814e+00  3.09769e+00  0.00000e+00 0.00000e+00 2.09856e+02 48.011  3.18604e+02 228.011 0.8697 
1 1 1 -2  6   2  o 9  2.77738e+01 5.40552e-01 5.86010e+02 51.643  3.36381e+00  4.25064e+00  0.00000e+00 0.00000e+00 3.55576e+02 51.643  2.30434e+02 231.643 0.9023 
1 1 1 -2  6   3  o 6  2.34270e+01 4.27912e-01 6.72437e+02 234.186 -2.93962e+00 -4.07380e+00 0.00000e+00 0.00000e+00 1.14231e+02 234.186 5.58206e+02 54.186  0.8939 
1 1 1 -2  6   4  o 5  1.46184e+01 2.96533e-01 2.31408e+02 83.108  2.01627e-01  1.66822e+00  0.00000e+00 0.00000e+00 1.18643e+02 83.108  1.12765e+02 263.108 0.6377 
1 1 1 -2  6   5  o 15 2.18842e+01 3.62991e-01 1.60406e+02 235.802 -1.10737e+00 -1.62955e+00 0.00000e+00 0.00000e+00 4.08763e+02 235.802 2.48357e+02 235.802 0.6928 
1 1 1 -2  6   6  o 19 1.90106e+01 3.42775e-01 3.34057e+02 301.786 2.84316e+00  -4.58803e+00 0.00000e+00 0.00000e+00 3.09283e+02 301.786 2.47736e+01 121.786 0.9019 
1 1 1 -2  6   7  o 2  1.51299e+01 2.52211e-01 4.53212e+02 116.606 -2.77376e+00 5.53764e+00  0.00000e+00 0.00000e+00 6.61669e+01 116.606 3.87045e+02 296.606 0.9153 
1 1 1 -2  6   8  o 3  5.90587e+01 9.60850e-01 1.16883e+03 112.292 -3.06987e+01 7.48818e+01  0.00000e+00 0.00000e+00 1.03131e+03 112.292 1.37522e+02 292.292 0.9938 
1 1 1 -2  6   9  o 9  2.21330e+01 4.54658e-01 3.23233e+02 303.893 6.34386e+00  -9.44303e+00 0.00000e+00 0.00000e+00 4.68615e+02 303.893 1.45381e+02 303.893 0.9550 
1 1 1 -2  6   10 o 6  2.83083e+01 4.48360e-01 5.46531e+02 355.641 3.22681e+01  -2.45935e+00 0.00000e+00 0.00000e+00 4.96785e+02 355.641 4.97459e+01 175.642 0.9844 
1 1 1 -2  6   11 o 8  2.00052e+01 4.23974e-01 4.13446e+02 169.912 -2.29441e+01 4.08212e+00  0.00000e+00 0.00000e+00 3.18739e+02 169.912 9.47063e+01 349.912 0.9783 
1 1 1 -2  6   12 o 3  1.50296e+01 3.84139e-01 3.31411e+02 36.585  1.39070e+01  1.03227e+01  0.00000e+00 0.00000e+00 2.13959e+02 36.585  1.17452e+02 216.585 0.9707 
1 1 1 -2  6   13 o 15 1.32670e+01 4.86031e-01 2.40927e+02 14.628  1.68770e+01  4.40491e+00  0.00000e+00 0.00000e+00 2.40181e+02 14.628  7.46020e-01 194.628 0.9709 
1 1 1 -2  6   14 o 12 8.69520e+00 5.66280e-01 2.87779e+02 158.100 -1.69890e+01 6.82947e+00  0.00000e+00 0.00000e+00 2.77095e+01 158.100 2.60069e+02 338.100 0.9723 
1 1 1 -2  6   15 o 16 5.52063e+00 7.65892e-01 4.86188e+01 265.011 -2.17008e-01 -2.48605e+00 0.00000e+00 0.00000e+00 1.08727e+02 265.011 6.01080e+01 265.011 0.7645 
1 1 1 -2  6   16 o 4  3.25194e+00 8.37497e-01 1.64288e+02 212.038 -5.20731e+00 -3.25869e+00 0.00000e+00 0.00000e+00 5.35300e+01 32.038  2.17818e+02 32.038  0.9145 
1 1 1 -2  6   17 o 7  1.14960e+01 7.02069e-01 2.58984e+02 35.059  3.79457e+01  2.66280e+01  0.00000e+00 0.00000e+00 1.64053e+02 35.059  9.49310e+01 215.059 0.9892 
1 1 1 -2  6   18 o 6  4.83466e+00 1.14374e+00 7.09272e+01 291.811 1.80796e+00  -4.51779e+00 0.00000e+00 0.00000e+00 8.89960e+01 291.811 1.80688e+01 291.811 0.8902 
1 1 1 -2  6   19 o 2  5.04949e+00 1.32704e+00 5.45579e+01 157.281 -3.47337e+00 1.45432e+00  0.00000e+00 0.00000e+00 1.05462e+02 157.281 5.09042e+01 157.281 0.8539 
1 1 1 -2  6   20 o 5  4.85620e+00 1.42265e+00 8.08944e+01 298.364 2.69800e+00  -4.99729e+00 0.00000e+00 0.00000e+00 8.23818e+01 298.364 1.48741e+00 298.364 0.9071 
1 1 1 -2  7   1  o 5  2.91342e+01 5.61407e-01 7.66990e+02 156.045 -6.70507e+00 2.97891e+00  0.00000e+00 0.00000e+00 2.50222e+02 156.045 5.16768e+02 336.045 0.9291 
1 1 1 -2  7   2  o 16 3.16481e+01 5.23343e-01 4.60330e+02 42.618  3.42891e+00  3.15499e+00  0.00000e+00 0.00000e+00 5.91818e+02 42.618  1.31488e+02 42.618  0.8848 
1 1 1 -2  7   3  o 1  3.26813e+01 5.77076e-01 4.60478e+02 175.295 -7.23590e+00 5.95526e-01  0.00000e+00 0.00000e+00 6.79154e+02 175.295 2.18676e+02 175.295 0.9283 
1 1 1 -2  7   4  o 5  2.64442e+01 4.72842e-01 4.42277e+02 149.026 -4.90275e+00 2.94282e+00  0.00000e+00 0.00000e+00 4.59146e+02 149.026 1.68691e+01 149.026 0.9077 
1 1 1 -2  7   5  o 19 1.62079e+01 3.23101e-01 3.89116e+02 131.314 -2.31754e+00 2.63667e+00  0.00000e+00 0.00000e+00 1.22962e+02 131.314 2.66154e+02 311.314 0.8416 
1 1 1 -2  7   6  o 10 1.49642e+01 3.46730e-01 2.96474e+02 43.353  2.72812e+00  2.57560e+00  0.00000e+00 0.00000e+00 1.82631e+02 43.353  1.13843e+02 223.353 0.8533 
1 1 1 -2  7   7  o 4  3.78591e+01 6.28396e-01 8.05898e+02 65.158  1.14809e+01  2.47993e+01  0.00000e+00 0.00000e+00 5.87792e+02 65.158  2.18107e+02 245.158 0.9815 
1 1 1 -2  7   8  o 19 2.61091e+01 4.00574e-01 5.48638e+02 44.942  1.20679e+01  1.20434e+01  0.00000e+00 0.00000e+00 4.00912e+02 44.942  1.47726e+02 224.942 0.9702 
1 1 1 -2  7   9  o 13 3.33042e+01 5.68528e-01 6.64560e+02 348.288 3.42949e+01  -7.10975e+00 0.00000e+00 0.00000e+00 5.65161e+02 348.288 9.93994e+01 168.288 0.9856 
1 1 1 -2  7   10 o 11 1.69311e+01 4.69955e-01 3.31546e+02 238.695 -6.09136e+00 -1.00164e+01 0.00000e+00 0.00000e+00 2.74649e+02 238.695 5.68969e+01 58.694  0.9563 
1 1 1 -2  7   11 o 15 2.22620e+01 4.09933e-01 3.67872e+02 53.287  1.37938e+01  1.84972e+01  0.00000e+00 0.00000e+00 4.46716e+02 53.287  7.88439e+01 53.287  0.9781 
1 1 1 -2  7   12 o 2  1.78245e+01 3.99561e-01 1.79526e+02 157.873 -1.02930e+01 4.18531e+00  0.00000e+00 0.00000e+00 4.56053e+02 157.873 2.76527e+02 157.873 0.9539 
1 1 1 -2  7   13 o 8  4.16852e+00 8.39628e-01 1.21025e+02 334.884 2.61396e+00  -1.22534e+00 0.00000e+00 0.00000e+00 3.72715e+00 334.884 1.17298e+02 154.884 0.8013 
1 1 1 -2  7   14 o 11 8.18339e+00 5.32513e-01 2.22777e+02 185.854 -1.41233e+01 -1.44815e+00 0.00000e+00 0.00000e+00 7.16367e+01 185.854 1.51140e+02 5.854   0.9641 
1 1 1 -2  7   15 o 13 7.77174e+00 6.26211e-01 1.51275e+02 278.154 1.60368e+00  -1.11924e+01 0.00000e+00 0.00000e+00 1.25331e+02 278.154 2.59430e+01 98.154  0.9547 
1 1 1 -2  7   16 o 7  1.27204e+01 5.80252e-01 2.31802e+02 29.656  3.19472e+01  1.81896e+01  0.00000e+00 0.00000e+00 2.35441e+02 29.656  3.63833e+00 29.656  0.9863 
1 1 1 -2  7   17 o 8  1.25923e+01 6.92763e-01 1.59878e+02 110.788 -1.11642e+01 2.94081e+01  0.00000e+00 0.00000e+00 3.01063e+02 110.788 1.41185e+02 110.788 0.9840 
1 1 1 -2  7   18 f 0  4.52073e+00 1.15652e+00 1.26923e+02 180.778 -8.07723e+00 -1.09753e-01 0.00000e+00 0.00000e+00 3.02907e+01 180.778 9.66319e+01 0.778   0.9359 
1 1 1 -2  7   19 o 4  5.76240e+00 1.26752e+00 1.49771e+02 43.547  8.89644e+00  8.45626e+00  0.00000e+00 0.00000e+00 5.51860e+01 43.547  9.45851e+01 223.547 0.9584 
1 1 1 -2  7   20 o 2  4.41352e+00 1.35319e+00 1.16393e+02 227.770 -5.26204e+00 -5.79708e+00 0.00000e+00 0.00000e+00 3.63645e+01 227.770 8.00281e+01 47.770  0.9338 
1 1 1 -2  8   1  o 11 2.55608e+01 5.63987e-01 3.05573e+02 278.368 3.49579e-01  -2.37640e+00 0.00000e+00 0.00000e+00 4.18561e+02 278.368 1.12988e+02 278.368 0.7539 
1 1 1 -2  8   2  o 5  1.50006e+01 2.80268e-01 2.20249e+02 192.707 -9.87249e-01 -2.22608e-01 0.00000e+00 0.00000e+00 3.37275e+01 192.707 1.86521e+02 12.707  0.4506 
1 1 1 -2  8   3  o 8  2.72228e+01 5.49917e-01 5.82666e+02 63.800  3.28885e+00  6.68383e+00  0.00000e+00 0.00000e+00 3.68548e+02 63.800  2.14118e+02 243.800 0.9302 
1 1 1 -2  8   4  o 3  4.52730e+01 7.85672e-01 1.00059e+03 204.047 -1.98267e+01 -8.84676e+00 0.00000e+00 0.00000e+00 6.59847e+02 204.047 3.40746e+02 24.047  0.9767 
1 1 1 -2  8   5  o 14 3.33997e+01 5.86362e-01 8.06884e+02 300.148 1.09944e+01  -1.89299e+01 0.00000e+00 0.00000e+00 4.17897e+02 300.148 3.88987e+02 120.148 0.9769 
1 1 1 -2  8   6  o 6  1.05952e+01 3.03894e-01 2.28669e+02 14.746  1.82839e+00  4.81238e-01  0.00000e+00 0.00000e+00 4.12643e+01 14.746  1.87405e+02 194.746 0.6790 
1 1 1 -2  8   7  o 3  1.44199e+01 3.43681e-01 4.42808e+02 57.983  3.03667e+00  4.85652e+00  0.00000e+00 0.00000e+00 4.82001e+01 57.983  3.94608e+02 237.983 0.9079 
1 1 1 -2  8   8  o 12 2.58913e+01 4.15422e-01 5.39763e+02 335.124 1.50552e+01  -6.98072e+00 0.00000e+00 0.00000e+00 4.01041e+02 335.124 1.38722e+02 155.124 0.9694 
1 1 1 -2  8   9  o 3  3.09412e+01 5.88097e-01 5.34899e+02 271.290 5.88548e-01  -2.61253e+01 0.00000e+00 0.00000e+00 6.01816e+02 271.290 6.69166e+01 271.290 0.9807 
1 1 1 -2  8   10 o 5  3.98702e+01 6.19159e-01 7.20357e+02 256.214 -1.41897e+01 -5.78330e+01 0.00000e+00 0.00000e+00 7.59681e+02 256.214 3.93237e+01 256.214 0.9916 
1 1 1 -2  8   11 o 12 4.10338e+01 7.02560e-01 7.22924e+02 12.346  8.02110e+01  1.75561e+01  0.00000e+00 0.00000e+00 8.02774e+02 12.346  7.98499e+01 12.346  0.9939 
1 1 1 -2  8   12 o 4  1.26530e+01 3.79122e-01 2.47190e+02 170.996 -1.22331e+01 1.93835e+00  0.00000e+00 0.00000e+00 2.06273e+02 170.996 4.09167e+01 350.996 0.9587 
1 1 1 -2  8   13 o 8  1.49365e+01 4.54137e-01 2.58179e+02 25.539  2.10169e+01  1.00421e+01  0.00000e+00 0.00000e+00 2.87577e+02 25.539  2.93982e+01 25.539  0.9783 
1 1 1 -2  8   14 f 0  8.12664e+00 5.19532e-01 1.06113e+02 129.016 -4.23367e+00 5.22523e+00  0.00000e+00 0.00000e+00 1.73582e+02 129.016 6.74688e+01 129.016 0.9223 
1 1 1 -2  8   15 o 6  1.06036e+01 5.29080e-01 1.82079e+02 108.822 -6.80237e+00 1.99571e+01  0.00000e+00 0.00000e+00 2.03726e+02 108.822 2.16476e+01 108.822 0.9760 
1 1 1 -2  8   16 f 0  3.11985e+00 8.80810e-01 6.04290e+01 269.565 -1.61701e-02 -2.13225e+00 0.00000e+00 0.00000e+00 2.30334e+01 269.565 3.73956e+01 89.565  0.7183 
1 1 1 -2  8   17 o 17 4.42732e+00 1.05581e+00 1.12601e+02 314.669 4.62186e+00  -4.67548e+00 0.00000e+00 0.00000e+00 3.89950e+01 314.669 7.36063e+01 134.670 0.9204 
1 1 1 -2  8   18 o 18 9.46490e+00 9.52497e-01 1.28487e+02 67.421  7.40520e+00  1.78085e+01  0.00000e+00 0.00000e+00 2.13965e+02 67.421  8.54786e+01 67.421  0.9737 
1 1 1 -2  8   19 o 2  4.53586e+00 1.26789e+00 5.95082e+01 223.302 -2.79211e+00 -2.63137e+00 0.00000e+00 0.00000e+00 8.47468e+01 223.302 2.52387e+01 223.302 0.8569 
1 1 1 -2  8   20 o 11 4.64463e+00 1.38551e+00 2.31020e+01 45.499  1.16909e+00  1.18964e+00  0.00000e+00 0.00000e+00 8.62154e+01 45.499  6.31134e+01 45.499  0.6350 
1 1 1 -2  9   1  o 17 1.19062e+01 3.10269e-01 3.41567e+02 235.115 -6.68809e-01 -9.59244e-01 0.00000e+00 0.00000e+00 1.16439e+02 55.115  4.58006e+02 55.115  0.5032 
1 1 1 -2  9   2  o 8  2.88589e+01 4.54546e-01 4.51597e+02 221.455 -2.85177e+00 -2.51908e+00 0.00000e+00 0.00000e+00 4.76060e+02 221.455 2.44628e+01 221.455 0.8556 
1 1 1 -2  9   3  o 4  1.97624e+01 4.28063e-01 2.52321e+02 213.481 -1.89834e+00 -1.25558e+00 0.00000e+00 0.00000e+00 2.95703e+02 213.481 4.33819e+01 213.481 0.7383 
1 1 1 -2  9   4  o 9  1.60758e+01 3.26869e-01 2.79042e+02 94.137  -2.15058e-01 2.97312e+00  0.00000e+00 0.00000e+00 2.09049e+02 94.137  6.99926e+01 274.137 0.8086 
1 1 1 -2  9   5  o 1  2.11166e+01 4.53740e-01 2.01029e+02 244.983 -1.44573e+00 -3.09795e+00 0.00000e+00 0.00000e+00 4.62219e+02 244.983 2.61189e+02 244.983 0.8367 
1 1 1 -2  9   6  o 4  1.53438e+01 3.75023e-01 2.02317e+02 241.853 -1.13493e+00 -2.12138e+00 0.00000e+00 0.00000e+00 2.31985e+02 241.853 2.96687e+01 241.853 0.7544 
1 1 1 -2  9   7  o 5  1.97410e+01 4.48833e-01 2.26178e+02 198.521 -4.51584e+00 -1.51278e+00 0.00000e+00 0.00000e+00 4.30940e+02 198.521 2.04762e+02 198.521 0.8876 
1 1 1 -2  9   8  o 11 1.96762e+01 4.14844e-01 4.97882e+02 1.968   1.15995e+01  3.98482e-01  0.00000e+00 0.00000e+00 2.07122e+02 1.968   2.90760e+02 181.967 0.9559 
1 1 1 -2  9   9  o 6  3.44656e+01 5.38334e-01 5.83848e+02 126.185 -1.87563e+01 2.56413e+01  0.00000e+00 0.00000e+00 6.86779e+02 126.185 1.02931e+02 126.185 0.9841 
1 1 1 -2  9   10 o 1  4.02553e+01 6.84278e-01 7.84102e+02 182.689 -6.50910e+01 -3.05726e+00 0.00000e+00 0.00000e+00 7.11293e+02 182.689 7.28085e+01 2.689   0.9923 
1 1 1 -2  9   11 o 4  1.74565e+01 4.06365e-01 2.90183e+02 298.340 6.76552e+00  -1.25439e+01 0.00000e+00 0.00000e+00 3.39505e+02 298.340 4.93214e+01 298.340 0.9643 
1 1 1 -2  9   12 o 18 7.15089e+00 5.35882e-01 1.15312e+02 135.294 -2.29448e+00 2.27108e+00  0.00000e+00 0.00000e+00 1.05356e+02 135.294 9.95615e+00 315.294 0.8255 
1 1 1 -2  9   13 o 2  1.83852e+01 4.71521e-01 3.16282e+02 239.514 -1.77723e+01 -3.01882e+01 0.00000e+00 0.00000e+00 3.60503e+02 239.514 4.42209e+01 239.514 0.9856 
1 1 1 -2  9   14 o 7  7.75018e+00 5.38723e-01 8.01678e+01 299.085 2.34690e+00  -4.21922e+00 0.00000e+00 0.00000e+00 1.76994e+02 299.085 9.68260e+01 299.085 0.8892 
1 1 1 -2  9   15 o 4  1.56021e+01 5.04161e-01 2.62841e+02 175.867 -4.48760e+01 3.24264e+00  0.00000e+00 0.00000e+00 3.12280e+02 175.867 4.94391e+01 175.867 0.9888 
1 1 1 -2  9   16 o 14 4.91253e+00 8.47203e-01 1.17640e+02 21.445  6.15659e+00  2.41828e+00  0.00000e+00 0.00000e+00 5.08433e+01 21.445  6.67966e+01 201.445 0.9210 
1 1 1 -2  9   17 o 6  9.59777e+00 7.75781e-01 1.97827e+02 43.598  2.08919e+01  1.98936e+01  0.00000e+00 0.00000e+00 1.52963e+02 43.598  4.48636e+01 223.598 0.9825 
1 1 1 -2  9   18 o 19 6.33098e+00 1.16056e+00 5.53980e+01 11.078  4.61599e+00  9.03780e-01  0.00000e+00 0.00000e+00 1.53030e+02 11.078  9.76317e+01 11.078  0.8860 
1 1 1 -2  9   19 o 5  5.28658e+00 1.31190e+00 8.54576e+01 170.468 -6.14671e+00 1.03214e+00  0.00000e+00 0.00000e+00 9.42240e+01 170.468 8.76638e+00 170.468 0.9158 
1 1 1 -2  9   20 o 9  5.16126e+00 1.41256e+00 6.78814e+01 66.082  2.16035e+00  4.87103e+00  0.00000e+00 0.00000e+00 1.04382e+02 66.082  3.65004e+01 66.082  0.9005 
1 1 1 -2  10  1  o 16 3.55477e+01 6.77194e-01 6.33853e+02 168.433 -5.90640e+00 1.20888e+00  0.00000e+00 0.00000e+00 5.85412e+02 168.433 4.84417e+01 348.433 0.9128 
1 1 1 -2  10  2  o 1  1.33060e+01 2.32836e-01 3.19869e+02 283.695 2.80231e-01  -1.14997e+00 0.00000e+00 0.00000e+00 6.60801e+01 103.695 3.85949e+02 103.695 0.5077 
1 1 1 -2  10  3  o 7  7.79213e+00 2.72182e-01 8.91289e+01 256.762 -7.04045e-02 -2.99282e-01 0.00000e+00 0.00000e+00 4.46603e+01 76.762  1.33789e+02 76.762  0.1519 
1 1 1 -2  10  4  o 15 1.68003e+01 3.32349e-01 2.53658e+02 82.526  3.61300e-01  2.75385e+00  0.00000e+00 0.00000e+00 2.46025e+02 82.526  7.63293e+00 262.526 0.7921 
1 1 1 -2  10  5  o 13 1.95536e+01 4.31643e-01 3.86067e+02 318.860 4.52698e+00  -3.95466e+00 0.00000e+00 0.00000e+00 2.83701e+02 318.860 1.02366e+02 138.860 0.9125 
1 1 1 -2  10  6  o 18 1.43918e+01 3.66425e-01 1.39130e+02 87.309  7.23867e-02  1.53994e+00  0.00000e+00 0.00000e+00 1.88244e+02 87.309  4.91143e+01 87.309  0.6063 
1 1 1 -2  10  7  f 0  1.75398e+01 3.62116e-01 4.77311e+02 39.522  6.87152e+00  5.66889e+00  0.00000e+00 0.00000e+00 1.42376e+02 39.522  3.34935e+02 219.522 0.9421 
1 1 1 -2  10  8  o 15 2.72890e+01 5.30475e-01 4.74396e+02 158.986 -1.42473e+01 5.47306e+00  0.00000e+00 0.00000e+00 5.14364e+02 158.986 3.99680e+01 158.986 0.9667 
1 1 1 -2  10  9  o 5  3.73359e+01 5.76909e-01 6.06728e+02 108.605 -1.11613e+01 3.31553e+01  0.00000e+00 0.00000e+00 7.71737e+02 108.605 1.65009e+02 108.605 0.9856 
1 1 1 -2  10  10 o 14 3.12884e+01 5.04620e-01 5.95528e+02 23.525  3.71529e+01  1.61735e+01  0.00000e+00 0.00000e+00 5.61215e+02 23.525  3.43123e+01 203.525 0.9876 
1 1 1 -2  10  11 o 2  1.83507e+01 3.76136e-01 4.18057e+02 342.598 2.06029e+01  -6.45722e+00 0.00000e+00 0.00000e+00 2.52318e+02 342.598 1.65739e+02 162.598 0.9766 
1 1 1 -2  10  12 o 3  2.04286e+01 4.46918e-01 3.12612e+02 283.121 5.70700e+00  -2.44845e+01 0.00000e+00 0.00000e+00 4.35642e+02 283.121 1.23030e+02 283.121 0.9799 
1 1 1 -2  10  13 f 0  2.69517e+01 5.04973e-01 4.46626e+02 350.139 7.11199e+01  -1.23630e+01 0.00000e+00 0.00000e+00 5.52953e+02 350.139 1.06328e+02 350.139 0.9930 
1 1 1 -2  10  14 o 17 1.14922e+01 4.56426e-01 1.08944e+02 80.399  1.64099e+00  9.70079e+00  0.00000e+00 0.00000e+00 2.97456e+02 80.399  1.88512e+02 80.399  0.9477 
1 1 1 -2  10  15 o 19 7.66867e+00 5.89219e-01 1.44460e+02 164.508 -1.14866e+01 3.18388e+00  0.00000e+00 0.00000e+00 1.29142e+02 164.508 1.53178e+01 344.507 0.9571 
1 1 1 -2  10  16 o 5  8.76934e+00 6.56415e-01 1.20060e+02 181.306 -1.41086e+01 -3.21684e-01 0.00000e+00 0.00000e+00 1.94711e+02 181.306 7.46507e+01 181.306 0.9639 
1 1 1 -2  10  17 o 15 3.24781e+00 9.35536e-01 5.40068e+01 89.746  1.09578e-02  2.47285e+00  0.00000e+00 0.00000e+00 3.80552e+01 89.746  1.59516e+01 269.746 0.7620 
1 1 1 -2  10  18 o 4  5.11222e+00 1.13239e+00 6.25830e+01 74.571  1.15970e+00  4.20192e+00  0.00000e+00 0.00000e+00 1.03819e+02 74.571  4.12362e+01 74.571  0.8760 
1 1 1 -2  10  19 o 11 4.01356e+00 1.19584e+00 1.22676e+01 102.226 -1.57625e-01 7.27442e-01  0.00000e+00 0.00000e+00 3.96495e+01 102.226 2.73819e+01 102.226 0.3486 
1 1 1 -2  10  20 o 11 5.33950e+00 1.46237e+00 1.04737e+02 252.126 -2.50867e+00 -7.77914e+00 0.00000e+00 0.00000e+00 8.06314e+01 252.126 2.41053e+01 72.126  0.9367 
1 1 1 -2  11  1  o 2  1.38720e+01 3.47491e-01 3.34235e+02 270.945 2.56094e-02  -1.55274e+00 0.00000e+00 0.00000e+00 1.68261e+01 90.945  3.51061e+02 90.945  0.6090 
1 1 1 -2  11  2  o 3  1.58049e+01 2.62008e-01 2.31559e+02 206.504 -1.19952e+00 -5.98158e-01 0.00000e+00 0.00000e+00 9.74624e+01 206.504 1.34097e+02 26.504  0.5541 
1 1 1 -2  11  3  o 11 2.17277e+01 3.31410e-01 2.94695e+02 208.885 -2.76165e+00 -1.52355e+00 0.00000e+00 0.00000e+00 3.75111e+02 208.885 8.04161e+01 208.885 0.8208 
1 1 1 -2  11  4  o 19 1.93164e+01 4.25503e-01 3.18435e+02 327.882 3.32350e+00  -2.08629e+00 0.00000e+00 0.00000e+00 3.05716e+02 327.882 1.27190e+01 147.882 0.8605 
1 1 1 -2  11  5  o 17 1.99938e+01 4.42076e-01 5.31338e+02 145.571 -6.89040e+00 4.72307e+00  0.00000e+00 0.00000e+00 1.72668e+02 145.571 3.58669e+02 325.571 0.9381 
1 1 1 -2  11  6  o 13 9.46441e+00 3.18274e-01 1.80102e+02 174.562 -1.29775e+00 1.23545e-01  0.00000e+00 0.00000e+00 1.29688e+01 174.562 1.67133e+02 354.562 0.5437 
1 1 1 -2  11  7  o 3  1.55066e+01 3.96500e-01 4.53515e+02 304.776 4.24824e+00  -6.11792e+00 0.00000e+00 0.00000e+00 8.74293e+01 304.776 3.66086e+02 124.776 0.9302 
1 1 1 -2  11  8  o 3  1.24508e+01 3.75695e-01 2.85747e+02 126.899 -2.63537e+00 3.51010e+00  0.00000e+00 0.00000e+00 1.23520e+02 126.899 1.62228e+02 306.899 0.8770 
1 1 1 -2  11  9  o 6  5.62613e+01 9.24265e-01 1.29868e+03 41.045  8.36827e+01  7.28593e+01  0.00000e+00 0.00000e+00 7.99284e+02 41.045  4.99399e+02 221.045 0.9955 
1 1 1 -2  11  10 o 3  1.49352e+01 3.80325e-01 3.68974e+02 219.727 -9.24593e+00 -7.68359e+00 0.00000e+00 0.00000e+00 1.66330e+02 219.727 2.02643e+02 39.727  0.9575 
1 1 1 -2  11  11 o 2  3.13870e+01 5.19218e-01 6.27025e+02 291.446 2.17517e+01  -5.53721e+01 0.00000e+00 0.00000e+00 5.37163e+02 291.446 8.98625e+01 111.446 0.9916 
1 1 1 -2  11  12 o 19 2.45922e+01 5.67036e-01 3.93159e+02 242.294 -1.75215e+01 -3.33656e+01 0.00000e+00 0.00000e+00 5.13767e+02 242.294 1.20609e+02 242.294 0.9866 
1 1 1 -2  11  13 o 19 2.30340e+01 5.52986e-01 4.10568e+02 195.371 -5.43207e+01 -1.49326e+01 0.00000e+00 0.00000e+00 4.41997e+02 195.371 3.14287e+01 195.371 0.9911 
1 1 1 -2  11  14 o 4  2.38412e+01 5.01209e-01 3.56866e+02 324.339 5.39388e+01  -3.87035e+01 0.00000e+00 0.00000e+00 5.25983e+02 324.339 1.69117e+02 324.339 0.9924 
1 1 1 -2  11  15 o 9  1.35178e+01 4.99276e-01 1.88868e+02 131.206 -1.84451e+01 2.10649e+01  0.00000e+00 0.00000e+00 3.05945e+02 131.206 1.17077e+02 131.206 0.9820 
1 1 1 -2  11  16 o 12 1.75328e+01 5.57869e-01 2.44764e+02 38.555  4.63408e+01  3.69334e+01  0.00000e+00 0.00000e+00 4.02592e+02 38.555  1.57828e+02 38.555  0.9915 
1 1 1 -2  11  17 o 10 1.17303e+01 6.82871e-01 2.02731e+02 56.363  2.07907e+01  3.12491e+01  0.00000e+00 0.00000e+00 2.27757e+02 56.363  2.50265e+01 56.363  0.9866 
1 1 1 -2  11  18 o 9  4.76061e+00 1.14912e+00 3.98035e+01 249.282 -9.04167e-01 -2.39049e+00 0.00000e+00 0.00000e+00 9.65583e+01 249.282 5.67547e+01 249.282 0.7709 
1 1 1 -2  11  19 o 4  8.15291e+00 1.25239e+00 1.02687e+02 34.535  1.00321e+01  6.90395e+00  0.00000e+00 0.00000e+00 1.87165e+02 34.535  8.44776e+01 34.535  0.9580 
1 1 1 -2  11  20 o 15 4.69259e+00 1.39618e+00 1.21542e+02 235.334 -4.99599e+00 -7.22439e+00 0.00000e+00 0.00000e+00 4.21567e+01 235.334 7.93849e+01 55.334  0.9412 
1 1 1 -2  12  1  o 16 1.87899e+01 3.84209e-01 2.44746e+02 260.958 -2.25469e-01 -1.41685e+00 0.00000e+00 0.00000e+00 1.64428e+02 260.958 8.03180e+01 80.958  0.5796 
1 1 1 -2  12  2  o 15 3.03680e+00 1.91881e-01 5.69441e+01 167.060 -5.86090e-02 1.34665e-02  0.00000e+00 0.00000e+00 5.35153e+01 347.060 1.10459e+02 347.060 0.0301 
1 1 1 -2  12  3  o 15 2.91711e+01 4.90222e-01 8.10266e+02 102.474 -2.42728e+00 1.09723e+01  0.00000e+00 0.00000e+00 2.35408e+02 102.474 5.74858e+02 282.474 0.9544 
1 1 1 -2  12  4  o 12 1.75003e+01 3.24494e-01 4.32200e+02 254.034 -1.30013e+00 -4.54429e+00 0.00000e+00 0.00000e+00 1.50395e+02 254.034 2.81804e+02 74.034  0.8866 
1 1 1 -2  12  5  o 6  9.72795e+00 3.10335e-01 2.61768e+02 47.314  1.32299e+00  1.43440e+00  0.00000e+00 0.00000e+00 9.96694e+00 227.314 2.71735e+02 227.314 0.6896 
1 1 1 -2  12  6  o 8  1.10283e+01 3.36418e-01 1.52663e+02 294.333 5.99473e-01  -1.32563e+00 0.00000e+00 0.00000e+00 8.92959e+01 294.333 6.33668e+01 114.333 0.5848 
1 1 1 -2  12  7  o 6  2.65638e+01 5.64174e-01 4.91768e+02 243.009 -6.23199e+00 -1.22360e+01 0.00000e+00 0.00000e+00 4.67397e+02 243.009 2.43709e+01 63.010  0.9629 
1 1 1 -2  12  8  o 5  1.91758e+01 3.94207e-01 5.43949e+02 3.729   1.28024e+01  8.34374e-01  0.00000e+00 0.00000e+00 1.46157e+02 3.729   3.97793e+02 183.729 0.9602 
1 1 1 -2  12  9  o 10 1.30430e+01 6.07677e-01 7.53374e+01 131.553 -1.00162e+00 1.13003e+00  0.00000e+00 0.00000e+00 2.17118e+02 131.553 1.41780e+02 131.553 0.5986 
1 1 1 -2  12  10 o 1  9.30142e+00 3.14932e-01 2.30504e+02 37.302  3.72211e+00  2.83574e+00  0.00000e+00 0.00000e+00 7.77643e+01 37.302  1.52740e+02 217.302 0.8854 
1 1 1 -2  12  11 o 14 1.92585e+01 4.28746e-01 3.51410e+02 216.153 -1.65753e+01 -1.21104e+01 0.00000e+00 0.00000e+00 3.51202e+02 216.153 2.07727e-01 36.153  0.9753 
1 1 1 -2  12  12 o 7  2.18014e+01 4.31777e-01 3.54509e+02 54.707  1.75584e+01  2.48052e+01  0.00000e+00 0.00000e+00 4.46832e+02 54.707  9.23229e+01 54.707  0.9834 
1 1 1 -2  12  13 o 18 1.16635e+01 4.23254e-01 2.17937e+02 232.544 -8.97410e+00 -1.17138e+01 0.00000e+00 0.00000e+00 2.02609e+02 232.544 1.53279e+01 52.544  0.9655 
1 1 1 -2  12  14 o 7  7.16035e+00 5.51888e-01 1.26491e+02 284.469 1.90152e+00  -7.36900e+00 0.00000e+00 0.00000e+00 1.22443e+02 284.469 4.04803e+00 104.469 0.9318 
1 1 1 -2  12  15 o 14 1.75186e+01 4.96990e-01 3.52941e+02 113.998 -2.71232e+01 6.09255e+01  0.00000e+00 0.00000e+00 2.95155e+02 113.998 5.77855e+01 293.998 0.9925 
1 1 1 -2  12  16 o 18 1.60006e+01 5.41119e-01 2.37627e+02 81.649  7.65644e+00  5.21603e+01  0.00000e+00 0.00000e+00 3.52509e+02 81.649  1.14882e+02 81.649  0.9905 
1 1 1 -2  12  17 o 2  7.10487e+00 8.80883e-01 1.62869e+02 203.001 -1.54026e+01 -6.53823e+00 0.00000e+00 0.00000e+00 9.33837e+01 203.001 6.94856e+01 23.001  0.9696 
1 1 1 -2  12  18 o 14 8.88774e+00 9.35966e-01 1.08021e+02 36.456  1.17133e+01  8.65342e+00  0.00000e+00 0.00000e+00 2.10644e+02 36.456  1.02623e+02 36.456  0.9650 
1 1 1 -2  12  19 o 3  3.44183e+00 1.10365e+00 3.22856e+01 21.118  1.66456e+00  6.42891e-01  0.00000e+00 0.00000e+00 5.18824e+01 21.118  1.95968e+01 21.118  0.6590 
1 1 1 -2  12  20 o 15 5.33783e+00 1.43616e+00 4.96375e+01 31.766  3.41985e+00  2.11760e+00  0.00000e+00 0.00000e+00 1.21361e+02 31.766  7.17231e+01 31.766  0.8644 
1 1 1 -2  13  1  o 6  1.33019e+01 4.97497e-01 3.74103e+02 293.134 5.68296e-01  -1.33014e+00 0.00000e+00 0.00000e+00 8.29220e+01 113.134 4.57025e+02 113.134 0.5826 
1 1 1 -2  13  2  o 3  3.13550e+01 4.61214e-01 6.28257e+02 80.897  1.02731e+00  6.41138e+00  0.00000e+00 0.00000e+00 4.54680e+02 80.897  1.73576e+02 260.897 0.9194 
1 1 1 -2  13  3  o 5  1.66811e+01 3.60995e-01 3.73249e+02 34.255  2.36452e+00  1.61022e+00  0.00000e+00 0.00000e+00 1.27404e+02 34.255  2.45845e+02 214.255 0.7991 
1 1 1 -2  13  4  o 8  3.42905e+01 6.84263e-01 7.44513e+02 244.116 -9.06206e+00 -1.86757e+01 0.00000e+00 0.00000e+00 5.11552e+02 244.116 2.32961e+02 64.116  0.9756 
1 1 1 -2  13  5  o 12 5.50942e+00 3.13271e-01 1.84650e+02 12.352  7.51197e-01  1.64505e-01  0.00000e+00 0.00000e+00 1.10494e+02 192.352 2.95144e+02 192.352 0.3586 
1 1 1 -2  13  6  o 18 1.31483e+01 3.60747e-01 2.69538e+02 125.690 -1.77199e+00 2.46687e+00  0.00000e+00 0.00000e+00 1.31360e+02 125.690 1.38178e+02 305.690 0.8127 
1 1 1 -2  13  7  o 9  1.25445e+01 3.73561e-01 3.87884e+02 347.078 4.96971e+00  -1.14019e+00 0.00000e+00 0.00000e+00 3.34256e+01 347.078 3.54458e+02 167.078 0.8956 
1 1 1 -2  13  8  o 15 3.13383e+01 6.54607e-01 4.83711e+02 143.845 -1.49181e+01 1.09003e+01  0.00000e+00 0.00000e+00 6.58574e+02 143.845 1.74863e+02 143.845 0.9726 
1 1 1 -2  13  9  o 12 1.56022e+01 3.94681e-01 4.15154e+02 204.133 -9.12041e+00 -4.08602e+00 0.00000e+00 0.00000e+00 1.39189e+02 204.133 2.75965e+02 24.133  0.9486 
1 1 1 -2  13  10 o 17 1.96183e+01 4.04967e-01 3.83691e+02 294.907 6.88996e+00  -1.48383e+01 0.00000e+00 0.00000e+00 3.27845e+02 294.907 5.58459e+01 114.907 0.9689 
1 1 1 -2  13  11 o 13 3.28289e+01 5.40498e-01 4.43980e+02 232.037 -2.69897e+01 -3.45909e+01 0.00000e+00 0.00000e+00 7.69897e+02 232.037 3.25916e+02 232.037 0.9885 
1 1 1 -2  13  12 f 0  2.82930e+01 4.99843e-01 4.48065e+02 113.958 -2.21972e+01 4.99543e+01  0.00000e+00 0.00000e+00 5.99679e+02 113.958 1.51614e+02 113.958 0.9908 
1 1 1 -2  13  13 o 11 8.88896e+00 4.50150e-01 2.43111e+02 246.471 -4.98846e+00 -1.14570e+01 0.00000e+00 0.00000e+00 7.52637e+01 246.471 1.67848e+02 66.471  0.9591 
1 1 1 -2  13  14 o 10 9.08964e+00 4.76280e-01 1.59248e+02 143.849 -9.92975e+00 7.25433e+00  0.00000e+00 0.00000e+00 1.65791e+02 143.849 6.54308e+00 143.849 0.9584 
1 1 1 -2  13  15 o 16 9.62010e+00 5.36339e-01 1.90290e+02 53.580  1.16177e+01  1.57462e+01  0.00000e+00 0.00000e+00 1.59004e+02 53.580  3.12859e+01 233.580 0.9741 
1 1 1 -2  13  16 o 16 1.19444e+01 5.78211e-01 1.51682e+02 309.614 1.58368e+01  -1.91338e+01 0.00000e+00 0.00000e+00 2.84027e+02 309.614 1.32345e+02 309.614 0.9797 
1 1 1 -2  13  17 o 14 3.72523e+00 9.74582e-01 5.20415e+01 166.716 -2.58974e+00 6.11415e-01  0.00000e+00 0.00000e+00 5.62330e+01 166.716 4.19152e+00 166.716 0.7814 
1 1 1 -2  13  18 o 18 1.36842e+01 7.60026e-01 1.98397e+02 2.957   4.89835e+01  2.53008e+00  0.00000e+00 0.00000e+00 3.04796e+02 2.957   1.06400e+02 2.957   0.9898 
1 1 1 -2  13  19 o 12 8.69962e+00 1.21025e+00 1.45795e+02 285.926 5.20374e+00  -1.82358e+01 0.00000e+00 0.00000e+00 1.68395e+02 285.926 2.26003e+01 285.926 0.9733 
1 1 1 -2  13  20 o 12 3.85276e+00 1.23479e+00 4.88688e+01 180.419 -3.36639e+00 -2.46023e-02 0.00000e+00 0.00000e+00 7.01866e+01 180.419 2.13178e+01 180.419 0.8338 
1 1 1 -2  14  1  o 8  2.89457e+01 6.37972e-01 3.96518e+02 21.160  4.01929e+00  1.55572e+00  0.00000e+00 0.00000e+00 5.54474e+02 21.160  1.57955e+02 21.160  0.8745 
1 1 1 -2  14  2  o 12 2.91903e+01 4.34547e-01 3.22840e+02 20.395  4.29008e+00  1.59506e+00  0.00000e+00 0.00000e+00 6.44894e+02 20.395  3.22054e+02 20.395  0.8826 
1 1 1 -2  14  3  o 8  4.85706e+01 6.92659e-01 7.37897e+02 163.479 -1.51893e+01 4.50540e+00  0.00000e+00 0.00000e+00 1.02767e+03 163.479 2.89769e+02 163.479 0.9679 
1 1 1 -2  14  4  o 14 3.02609e+01 4.91532e-01 5.60233e+02 217.587 -1.07125e+01 -8.24575e+00 0.00000e+00 0.00000e+00 5.33037e+02 217.587 2.71958e+01 37.587  0.9623 
1 1 1 -2  14  5  f 0  1.19770e+01 3.44183e-01 6.01750e+02 142.126 -4.23901e+00 3.29688e+00  0.00000e+00 0.00000e+00 1.96599e+02 322.126 7.98350e+02 322.126 0.9013 
1 1 1 -2  14  6  o 6  5.95589e+00 3.83895e-01 1.12510e+02 149.095 -4.88570e-01 2.92456e-01  0.00000e+00 0.00000e+00 5.13416e+01 329.095 1.63851e+02 329.095 0.2738 
1 1 1 -2  14  7  o 9  1.76102e+01 4.35624e-01 3.69281e+02 204.162 -6.18019e+00 -2.77253e+00 0.00000e+00 0.00000e+00 2.40156e+02 204.162 1.29125e+02 24.162  0.9229 
1 1 1 -2  14  8  o 16 1.39314e+01 4.06776e-01 1.39562e+02 23.569  2.17877e+00  9.50489e-01  0.00000e+00 0.00000e+00 2.52513e+02 23.569  1.12951e+02 23.569  0.7509 
1 1 1 -2  14  9  o 15 3.01745e+01 5.91063e-01 5.30191e+02 88.352  8.67039e-01  3.01308e+01  0.00000e+00 0.00000e+00 5.81089e+02 88.352  5.08972e+01 88.352  0.9833 
1 1 1 -2  14  10 o 8  2.81433e+01 5.79526e-01 5.21646e+02 173.668 -3.22696e+01 3.58071e+00  0.00000e+00 0.00000e+00 5.15415e+02 173.668 6.23047e+00 353.668 0.9845 
1 1 1 -2  14  11 o 13 1.60709e+01 4.14797e-01 4.18889e+02 152.533 -1.72565e+01 8.97036e+00  0.00000e+00 0.00000e+00 1.66551e+02 152.533 2.52337e+02 332.533 0.9739 
1 1 1 -2  14  12 o 13 2.53312e+01 4.67564e-01 5.08774e+02 338.607 5.17973e+01  -2.02920e+01 0.00000e+00 0.00000e+00 4.29407e+02 338.607 7.93667e+01 158.607 0.9910 
1 1 1 -2  14  13 o 17 2.32038e+01 4.67123e-01 2.86375e+02 158.545 -3.56486e+01 1.40097e+01  0.00000e+00 0.00000e+00 5.68725e+02 158.545 2.82350e+02 158.545 0.9869 
1 1 1 -2  14  14 o 16 2.10502e+01 4.76923e-01 3.34153e+02 62.062  2.79563e+01  5.27165e+01  0.00000e+00 0.00000e+00 4.44593e+02 62.062  1.10440e+02 62.062  0.9916 
1 1 1 -2  14  15 o 16 1.42382e+01 4.83233e-01 2.27543e+02 50.672  2.21670e+01  2.70555e+01  0.00000e+00 0.00000e+00 2.95509e+02 50.672  6.79653e+01 50.672  0.9856 
1 1 1 -2  14  16 f 0  5.24559e+00 8.55327e-01 6.22765e+01 13.940  3.79247e+00  9.41329e-01  0.00000e+00 0.00000e+00 1.05670e+02 13.940  4.33933e+01 13.940  0.8599 
1 1 1 -2  14  17 o 9  9.17007e+00 7.11609e-01 1.49047e+02 209.264 -1.84437e+01 -1.03349e+01 0.00000e+00 0.00000e+00 1.83856e+02 209.264 3.48088e+01 209.264 0.9761 
1 1 1 -2  14  18 o 2  3.13145e+00 9.65473e-01 7.83970e+01 23.997  3.61874e+00  1.61095e+00  0.00000e+00 0.00000e+00 2.18862e+01 23.997  5.65109e+01 203.997 0.8620 
1 1 1 -2  14  19 o 2  1.07027e+01 1.06231e+00 1.39395e+02 326.371 2.13478e+01  -1.41992e+01 0.00000e+00 0.00000e+00 2.49918e+02 326.371 1.10523e+02 326.371 0.9803 
1 1 1 -2  14  20 o 19 4.45550e+00 1.34116e+00 5.44106e+01 32.168  3.36241e+00  2.11484e+00  0.00000e+00 0.00000e+00 8.79926e+01 32.168  3.35820e+01 32.168  0.8624 
1 1 1 -2  15  1  o 3  3.60965e+01 5.67716e-01 5.92054e+02 213.206 -6.28114e+00 -4.11126e+00 0.00000e+00 0.00000e+00 6.70218e+02 213.206 7.81646e+01 213.206 0.9308 
1 1 1 -2  15  2  o 7  1.35591e+01 2.46420e-01 3.09372e+02 351.035 1.91247e+00  -3.01705e-01 0.00000e+00 0.00000e+00 4.05314e+01 351.035 2.68841e+02 171.035 0.6870 
1 1 1 -2  15  3  o 10 2.23527e+01 4.48407e-01 2.31144e+02 246.524 -1.05084e+00 -2.41949e+00 0.00000e+00 0.00000e+00 4.22940e+02 246.524 1.91796e+02 246.524 0.7792 
1 1 1 -2  15  4  o 4  1.09266e+01 2.26657e-01 2.51624e+02 37.190  1.71086e+00  1.29815e+00  0.00000e+00 0.00000e+00 4.39724e+01 37.190  2.07652e+02 217.190 0.7206 
1 1 1 -2  15  5  o 15 2.03494e+01 4.07525e-01 3.53197e+02 206.146 -4.95915e+00 -2.43444e+00 0.00000e+00 0.00000e+00 3.37406e+02 206.146 1.57904e+01 26.146  0.9043 
1 1 1 -2  15  6  o 3  3.09984e+01 6.39701e-01 6.77614e+02 328.429 1.59529e+01  -9.80320e+00 0.00000e+00 0.00000e+00 4.53774e+02 328.429 2.23840e+02 148.429 0.9729 
1 1 1 -2  15  7  o 2  9.05334e+00 3.58659e-01 1.44829e+02 85.073  1.16829e-01  1.35524e+00  0.00000e+00 0.00000e+00 4.51507e+01 85.073  9.96785e+01 265.073 0.5596 
1 1 1 -2  15  8  o 19 1.87149e+01 4.66233e-01 3.39456e+02 299.168 4.03343e+00  -7.22654e+00 0.00000e+00 0.00000e+00 3.18055e+02 299.168 2.14010e+01 119.168 0.9375 
1 1 1 -2  15  9  o 6  1.21301e+01 4.65240e-01 1.83694e+02 105.341 -1.11302e+00 4.05724e+00  0.00000e+00 0.00000e+00 2.12033e+02 105.341 2.83387e+01 105.341 0.8710 
1 1 1 -2  15  10 o 16 1.73940e+01 4.46425e-01 2.57578e+02 130.876 -6.51078e+00 7.52273e+00  0.00000e+00 0.00000e+00 3.59819e+02 130.876 1.02242e+02 130.876 0.9483 
1 1 1 -2  15  11 o 1  2.34155e+01 4.25491e-01 5.14474e+02 113.185 -1.36711e+01 3.19205e+01  0.00000e+00 0.00000e+00 3.48605e+02 113.185 1.65869e+02 293.185 0.9855 
1 1 1 -2  15  12 f 0  2.26775e+01 4.38981e-01 3.89356e+02 225.844 -2.65634e+01 -2.73574e+01 0.00000e+00 0.00000e+00 4.46973e+02 225.844 5.76171e+01 225.844 0.9868 
1 1 1 -2  15  13 o 11 2.21257e+00 6.70714e-01 5.46351e+01 16.275  6.58513e-01  1.92253e-01  0.00000e+00 0.00000e+00 2.78425e+01 196.275 8.24776e+01 196.275 0.3243 
1 1 1 -2  15  14 o 11 1.69843e+01 4.53853e-01 2.80845e+02 97.802  -5.20480e+00 3.79873e+01  0.00000e+00 0.00000e+00 3.44473e+02 97.802  6.36278e+01 97.802  0.9869 
1 1 1 -2  15  15 o 10 1.56929e+01 4.82796e-01 3.23238e+02 192.770 -5.33589e+01 -1.20937e+01 0.00000e+00 0.00000e+00 2.56282e+02 192.770 6.69558e+01 12.770  0.9908 
1 1 1 -2  15  16 o 10 7.77579e+00 7.35546e-01 1.16011e+02 32.731  9.47183e+00  6.08809e+00  0.00000e+00 0.00000e+00 1.60332e+02 32.731  4.43209e+01 32.731  0.9545 
1 1 1 -2  15  17 o 15 5.35109e+00 9.32277e-01 6.30708e+01 342.821 4.51381e+00  -1.39547e+00 0.00000e+00 0.00000e+00 1.13376e+02 342.821 5.03048e+01 342.821 0.8866 
1 1 1 -2  15  18 o 11 5.21903e+00 1.13874e+00 1.11449e+02 262.338 -1.12729e+00 -8.37979e+00 0.00000e+00 0.00000e+00 7.05807e+01 262.338 4.08684e+01 82.338  0.9389 
1 1 1 -2  15  19 o 2  8.30140e+00 1.21786e+00 1.14371e+02 216.595 -1.17624e+01 -8.73404e+00 0.00000e+00 0.00000e+00 1.82944e+02 216.595 6.85731e+01 216.595 0.9652 
1 1 1 -2  15  20 o 11 6.70670e+00 1.46329e+00 1.21516e+02 181.073 -1.23917e+01 -2.32184e-01 0.00000e+00 0.00000e+00 1.16769e+02 181.073 4.74691e+00 1.073   0.9588 
1 1 1 -2  16  1  o 19 3.89644e+01 5.67546e-01 7.97259e+02 297.408 4.70499e+00  -9.07364e+00 0.00000e+00 0.00000e+00 5.92982e+02 297.408 2.04277e+02 117.408 0.9497 
1 1 1 -2  16  2  o 17 7.25522e+00 1.95668e-01 4.52908e+02 327.950 1.22128e+00  -7.64625e-01 0.00000e+00 0.00000e+00 2.94527e+02 147.950 7.47435e+02 147.950 0.5812 
1 1 1 -2  16  3  o 15 3.55518e+01 5.19388e-01 6.46541e+02 88.815  2.33933e-01  1.13106e+01  0.00000e+00 0.00000e+00 6.28077e+02 88.815  1.84647e+01 268.815 0.9547 
1 1 1 -2  16  4  o 12 3.24945e+01 4.64546e-01 5.46293e+02 135.475 -7.38560e+00 7.26426e+00  0.00000e+00 0.00000e+00 6.13136e+02 135.475 6.68430e+01 135.475 0.9504 
1 1 1 -2  16  5  o 4  6.69621e+00 2.13021e-01 7.45548e+01 288.398 1.19556e-01  -3.59439e-01 0.00000e+00 0.00000e+00 2.77929e+01 108.398 1.02348e+02 108.398 0.1861 
1 1 1 -2  16  6  o 15 4.30444e+01 8.56758e-01 7.56603e+02 71.082  9.28058e+00  2.70783e+01  0.00000e+00 0.00000e+00 8.29642e+02 71.082  7.30395e+01 71.082  0.9824 
1 1 1 -2  16  7  o 2  1.63553e+01 4.29384e-01 3.04159e+02 113.129 -2.35383e+00 5.51062e+00  0.00000e+00 0.00000e+00 2.55259e+02 113.129 4.88997e+01 293.129 0.9122 
1 1 1 -2  16  8  o 7  2.96905e+01 6.34781e-01 6.03882e+02 254.600 -6.15573e+00 -2.23489e+01 0.00000e+00 0.00000e+00 4.84485e+02 254.600 1.19397e+02 74.600  0.9782 
1 1 1 -2  16  9  o 2  1.44843e+01 4.84576e-01 3.32030e+02 4.598   9.02081e+00  7.25485e-01  0.00000e+00 0.00000e+00 1.79525e+02 4.598   1.52505e+02 184.598 0.9430 
1 1 1 -2  16  10 o 1  4.46672e+00 6.27439e-01 3.63292e+01 294.137 1.45929e-01  -3.25662e-01 0.00000e+00 0.00000e+00 6.96461e+00 114.137 4.32938e+01 114.137 0.1756 
1 1 1 -2  16  11 o 8  2.18531e+01 4.57548e-01 4.08155e+02 191.893 -2.50733e+01 -5.28057e+00 0.00000e+00 0.00000e+00 3.93043e+02 191.893 1.51123e+01 11.893  0.9803 
1 1 1 -2  16  12 o 1  1.82787e+01 3.98907e-01 3.35445e+02 77.273  5.83428e+00  2.58317e+01  0.00000e+00 0.00000e+00 3.34622e+02 77.273  8.22660e-01 257.273 0.9809 
1 1 1 -2  16  13 o 4  2.32545e+01 4.76815e-01 3.65696e+02 58.208  2.60075e+01  4.19585e+01  0.00000e+00 0.00000e+00 4.93771e+02 58.208  1.28074e+02 58.208  0.9898 
1 1 1 -2  16  14 o 19 1.58463e+01 4.38871e-01 2.10600e+02 302.829 1.45518e+01  -2.25545e+01 0.00000e+00 0.00000e+00 3.69436e+02 302.829 1.58836e+02 302.829 0.9812 
1 1 1 -2  16  15 o 11 2.43328e+00 7.14794e-01 5.98312e+01 113.669 -6.24947e-01 1.42579e+00  0.00000e+00 0.00000e+00 4.52558e+00 293.668 6.43568e+01 293.668 0.6098 
1 1 1 -2  16  16 o 15 4.60172e+00 8.37471e-01 9.82180e+01 140.964 -4.22126e+00 3.42267e+00  0.00000e+00 0.00000e+00 5.64172e+01 140.964 4.18008e+01 320.964 0.9026 
1 1 1 -2  16  17 o 8  1.91993e+01 5.99238e-01 3.57467e+02 193.947 -1.08223e+02 -2.68764e+01 0.00000e+00 0.00000e+00 3.53360e+02 193.947 4.10695e+00 13.947  0.9955 
1 1 1 -2  16  18 o 1  1.15275e+01 8.01885e-01 2.54025e+02 324.323 4.40063e+01  -3.15946e+01 0.00000e+00 0.00000e+00 1.70226e+02 324.323 8.37990e+01 144.323 0.9907 
1 1 1 -2  16  19 o 10 9.02723e+00 1.14354e+00 1.26975e+02 228.519 -1.23273e+01 -1.39429e+01 0.00000e+00 0.00000e+00 1.98836e+02 228.519 7.18606e+01 228.519 0.9728 
1 1 1 -2  16  20 o 7  3.82593e+00 1.22397e+00 1.57590e+01 169.438 -1.10032e+00 2.05166e-01  0.00000e+00 0.00000e+00 5.32934e+01 169.438 3.75344e+01 169.438 0.4871 
1 1 1 -2  17  1  o 6  1.77841e+01 4.15150e-01 2.85746e+02 240.397 -1.20468e+00 -2.12034e+00 0.00000e+00 0.00000e+00 2.20762e+02 240.397 6.49835e+01 60.397  0.7582 
1 1 1 -2  17  2  o 12 1.36867e+01 2.51553e-01 1.75134e+02 305.011 6.59565e-01  -9.41567e-01 0.00000e+00 0.00000e+00 8.03015e+01 305.011 9.48328e+01 125.011 0.4969 
1 1 1 -2  17  3  o 4  4.79328e+01 6.69095e-01 1.04152e+03 106.347 -6.66194e+00 2.27121e+01  0.00000e+00 0.00000e+00 7.19961e+02 106.347 3.21554e+02 286.348 0.9786 
1 1 1 -2  17  4  o 2  1.31406e+01 2.47865e-01 3.03095e+02 281.296 4.45354e-01  -2.22965e+00 0.00000e+00 0.00000e+00 6.09442e+01 281.296 2.42151e+02 101.296 0.7380 
1 1 1 -2  17  5  o 5  1.56005e+01 2.56903e-01 1.33824e+02 286.231 4.36117e-01  -1.49813e+00 0.00000e+00 0.00000e+00 2.23696e+02 286.231 8.98723e+01 286.231 0.6107 
1 1 1 -2  17  6  o 15 9.34527e+00 2.98922e-01 2.93121e+02 284.697 6.11920e-01  -2.33303e+00 0.00000e+00 0.00000e+00 2.84320e+01 104.697 3.21553e+02 104.697 0.7551 
1 1 1 -2  17  7  o 5  2.58796e+01 5.66667e-01 5.87498e+02 257.547 -3.91522e+00 -1.77300e+01 0.00000e+00 0.00000e+00 3.55694e+02 257.547 2.31804e+02 77.548  0.9721 
1 1 1 -2  17  8  o 3  3.29804e+01 6.92486e-01 6.73348e+02 239.714 -1.42645e+01 -2.44246e+01 0.00000e+00 0.00000e+00 5.40471e+02 239.714 1.32877e+02 59.714  0.9822 
1 1 1 -2  17  9  o 1  3.27211e+01 7.39526e-01 5.04809e+02 346.683 2.79449e+01  -6.61463e+00 0.00000e+00 0.00000e+00 6.99076e+02 346.683 1.94267e+02 346.683 0.9824 
1 1 1 -2  17  10 o 9  4.95178e+01 9.20340e-01 9.69814e+02 133.322 -7.84317e+01 8.31656e+01  0.00000e+00 0.00000e+00 8.75290e+02 133.322 9.45234e+01 313.322 0.9956 
1 1 1 -2  17  11 o 10 2.50538e+01 5.64607e-01 4.44983e+02 159.490 -3.35612e+01 1.25545e+01  0.00000e+00 0.00000e+00 4.78822e+02 159.490 3.38397e+01 159.490 0.9859 
1 1 1 -2  17  12 o 9  2.07856e+01 4.13308e-01 5.16574e+02 290.290 1.60384e+01  -4.33797e+01 0.00000e+00 0.00000e+00 2.51725e+02 290.290 2.64849e+02 110.290 0.9891 
1 1 1 -2  17  13 o 10 1.09270e+01 3.88270e-01 3.08787e+02 182.326 -1.97082e+01 -8.00599e-01 0.00000e+00 0.00000e+00 8.87219e+01 182.326 2.20065e+02 2.326   0.9743 
1 1 1 -2  17  14 o 12 2.07773e+01 4.67428e-01 3.56534e+02 21.467  5.51503e+01  2.16873e+01  0.00000e+00 0.00000e+00 4.11971e+02 21.467  5.54370e+01 21.467  0.9915 
1 1 1 -2  17  15 o 5  9.66045e+00 4.83976e-01 2.13110e+02 241.162 -1.12268e+01 -2.03896e+01 0.00000e+00 0.00000e+00 1.39093e+02 241.162 7.40164e+01 61.162  0.9783 
1 1 1 -2  17  16 o 9  6.39792e+00 7.22314e-01 9.54004e+01 24.233  7.45696e+00  3.35646e+00  0.00000e+00 0.00000e+00 1.27713e+02 24.233  3.23129e+01 24.233  0.9367 
1 1 1 -2  17  17 o 15 1.25900e+01 6.30286e-01 1.86058e+02 308.480 2.33922e+01  -2.94292e+01 0.00000e+00 0.00000e+00 2.75883e+02 308.480 8.98254e+01 308.480 0.9866 
1 1 1 -2  17  18 o 13 6.70504e+00 1.01673e+00 8.53537e+01 329.015 7.99779e+00  -4.80272e+00 0.00000e+00 0.00000e+00 1.49960e+02 329.015 6.46062e+01 329.015 0.9448 
1 1 1 -2  17  19 o 15 4.57297e+00 1.18240e+00 3.95350e+01 163.466 -2.72391e+00 8.08634e-01  0.00000e+00 0.00000e+00 9.57783e+01 163.466 5.62432e+01 163.466 0.7975 
1 1 1 -2  17  20 o 1  3.77911e+00 1.20313e+00 1.12556e+02 131.397 -5.31128e+00 6.02500e+00  0.00000e+00 0.00000e+00 1.84437e+01 131.397 9.41126e+01 311.397 0.9355 
1 1 1 -2  18  1  o 13 3.67835e+01 5.40032e-01 7.37898e+02 262.518 -1.59365e+00 -1.21350e+01 0.00000e+00 0.00000e+00 5.86138e+02 262.518 1.51760e+02 82.518  0.9582 
1 1 1 -2  18  2  o 2  1.70005e+01 2.90589e-01 3.95958e+02 10.797  3.01835e+00  5.75639e-01  0.00000e+00 0.00000e+00 1.24564e+02 10.797  2.71393e+02 190.797 0.8152 
1 1 1 -2  18  3  o 11 3.31291e+01 4.76062e-01 7.06252e+02 87.770  5.86281e-01  1.50569e+01  0.00000e+00 0.00000e+00 4.95701e+02 87.770  2.10551e+02 267.770 0.9662 
1 1 1 -2  18  4  o 18 1.53142e+01 2.76698e-01 3.62974e+02 12.252  3.02796e+00  6.57522e-01  0.00000e+00 0.00000e+00 1.06699e+02 12.252  2.56275e+02 192.252 0.8170 
1 1 1 -2  18  5  o 16 1.09280e+01 2.13356e-01 1.40942e+02 194.665 -1.29475e+00 -3.38825e-01 0.00000e+00 0.00000e+00 8.60543e+01 194.665 5.48880e+01 14.665  0.5536 
1 1 1 -2  18  6  o 8  1.21106e+01 3.74191e-01 2.08093e+02 8.705   2.39043e+00  3.65996e-01  0.00000e+00 0.00000e+00 1.35238e+02 8.705   7.28550e+01 188.705 0.7558 
1 1 1 -2  18  7  o 15 1.41212e+01 4.08792e-01 3.53568e+02 305.047 3.41644e+00  -4.87074e+00 0.00000e+00 0.00000e+00 1.29032e+02 305.047 2.24536e+02 125.047 0.9116 
1 1 1 -2  18  8  o 13 2.55265e+01 5.74308e-01 4.90025e+02 70.243  5.38487e+00  1.49926e+01  0.00000e+00 0.00000e+00 4.35953e+02 70.243  5.40723e+01 250.243 0.9681 
1 1 1 -2  18  9  f 0  3.58424e+01 7.96515e-01 5.62084e+02 176.289 -3.47527e+01 2.25433e+00  0.00000e+00 0.00000e+00 7.60744e+02 176.289 1.98660e+02 176.289 0.9855 
1 1 1 -2  18  10 o 14 1.76870e+01 5.70880e-01 2.68300e+02 160.050 -1.08473e+01 3.93737e+00  0.00000e+00 0.00000e+00 3.64251e+02 160.050 9.59505e+01 160.050 0.9556 
1 1 1 -2  18  11 o 8  1.27948e+01 4.54532e-01 3.20515e+02 3.626   1.32174e+01  8.37653e-01  0.00000e+00 0.00000e+00 1.39534e+02 3.626   1.80981e+02 183.626 0.9615 
1 1 1 -2  18  12 o 8  1.13011e+01 4.46969e-01 1.75823e+02 153.752 -7.90196e+00 3.89650e+00  0.00000e+00 0.00000e+00 2.21728e+02 153.752 4.59043e+01 153.752 0.9414 
1 1 1 -2  18  13 o 18 1.44455e+01 3.83911e-01 2.83031e+02 74.760  6.71452e+00  2.46450e+01  0.00000e+00 0.00000e+00 2.45641e+02 74.760  3.73904e+01 254.760 0.9802 
1 1 1 -2  18  14 o 2  1.58420e+01 4.26652e-01 2.79125e+02 256.259 -9.25010e+00 -3.78275e+01 0.00000e+00 0.00000e+00 3.04178e+02 256.259 2.50530e+01 256.259 0.9871 
1 1 1 -2  18  15 o 18 1.76188e+01 4.71006e-01 3.15766e+02 40.916  4.59320e+01  3.98103e+01  0.00000e+00 0.00000e+00 3.35394e+02 40.916  1.96287e+01 40.916  0.9917 
1 1 1 -2  18  16 o 6  4.72243e+00 7.96388e-01 1.09172e+02 181.874 -6.70903e+00 -2.19484e-01 0.00000e+00 0.00000e+00 5.29514e+01 181.874 5.62206e+01 1.874   0.9222 
1 1 1 -2  18  17 f 0  1.31356e+01 5.99882e-01 1.07492e+02 2.996   2.28636e+01  1.19646e+00  0.00000e+00 0.00000e+00 3.70194e+02 2.996   2.62702e+02 2.996   0.9779 
1 1 1 -2  18  18 f 0  7.99323e+00 9.58698e-01 6.94197e+01 149.274 -8.04981e+00 4.78455e+00  0.00000e+00 0.00000e+00 2.11153e+02 149.274 1.41734e+02 149.274 0.9450 
1 1 1 -2  18  19 o 11 5.57382e+00 1.28667e+00 7.10502e+01 176.537 -5.77504e+00 3.49434e-01  0.00000e+00 0.00000e+00 1.16896e+02 176.537 4.58462e+01 176.537 0.9089 
1 1 1 -2  18  20 o 8  3.97033e+00 1.23903e+00 6.64520e+01 254.406 -1.30358e+00 -4.67070e+00 0.00000e+00 0.00000e+00 6.44414e+01 254.406 2.01060e+00 74.406  0.8898 
1 1 1 -2  19  1  o 16 2.92749e+01 4.43679e-01 5.37779e+02 343.153 7.37484e+00  -2.23324e+00 0.00000e+00 0.00000e+00 4.87800e+02 343.153 4.99793e+01 163.153 0.9327 
1 1 1 -2  19  2  o 11 2.93331e+01 4.43497e-01 5.37606e+02 230.034 -5.26017e+00 -6.27632e+00 0.00000e+00 0.00000e+00 4.94393e+02 230.034 4.32129e+01 50.034  0.9368 
1 1 1 -2  19  3  o 10 2.96738e+01 4.32380e-01 5.56568e+02 13.391  9.99714e+00  2.38004e+00  0.00000e+00 0.00000e+00 5.01917e+02 13.391  5.46516e+01 193.391 0.9500 
1 1 1 -2  19  4  o 10 7.88392e+00 2.17863e-01 1.60250e+02 198.288 -9.66450e-01 -3.19398e-01 0.00000e+00 0.00000e+00 2.62870e+01 18.288  1.86537e+02 18.288  0.4527 
1 1 1 -2  19  5  o 4  2.83486e+01 4.35451e-01 4.49107e+02 152.114 -9.60991e+00 5.08511e+00  0.00000e+00 0.00000e+00 5.64445e+02 152.114 1.15339e+02 152.114 0.9528 
1 1 1 -2  19  6  o 19 1.88913e+01 3.62838e-01 5.10071e+02 60.877  4.45984e+00  8.00511e+00  0.00000e+00 0.00000e+00 1.58630e+02 60.877  3.51442e+02 240.877 0.9437 
1 1 1 -2  19  7  o 16 2.30477e+01 4.20030e-01 3.29502e+02 181.317 -8.39253e+00 -1.92904e-01 0.00000e+00 0.00000e+00 4.81314e+02 181.317 1.51812e+02 181.317 0.9384 
1 1 1 -2  19  8  o 4  1.67233e+01 4.56665e-01 1.34407e+02 57.483  1.53749e+00  2.41176e+00  0.00000e+00 0.00000e+00 3.66308e+02 57.483  2.31901e+02 57.483  0.7991 
1 1 1 -2  19  9  o 7  4.06687e+01 8.84012e-01 6.37614e+02 297.598 2.01940e+01  -3.86310e+01 0.00000e+00 0.00000e+00 8.67719e+02 297.598 2.30104e+02 297.598 0.9885 
1 1 1 -2  19  10 o 1  2.31609e+01 6.16332e-01 3.44482e+02 310.404 1.23690e+01  -1.45315e+01 0.00000e+00 0.00000e+00 4.99219e+02 310.404 1.54737e+02 310.404 0.9734 
1 1 1 -2  19  11 o 18 1.65258e+01 4.61756e-01 3.00654e+02 242.837 -7.07905e+00 -1.37965e+01 0.00000e+00 0.00000e+00 2.97056e+02 242.837 3.59806e+00 62.837  0.9672 
1 1 1 -2  19  12 o 5  2.67205e+01 5.30535e-01 4.36978e+02 239.570 -2.60019e+01 -4.42654e+01 0.00000e+00 0.00000e+00 5.51676e+02 239.570 1.14698e+02 239.570 0.9902 
1 1 1 -2  19  13 o 10 1.84740e+01 4.02574e-01 3.20589e+02 109.961 -1.25872e+01 3.46559e+01  0.00000e+00 0.00000e+00 3.59701e+02 109.961 3.91122e+01 109.961 0.9863 
1 1 1 -2  19  14 o 3  2.36567e+01 4.80859e-01 3.35420e+02 160.459 -6.52243e+01 2.31494e+01  0.00000e+00 0.00000e+00 5.40581e+02 160.459 2.05161e+02 160.459 0.9927 
1 1 1 -2  19  15 o 16 1.35078e+01 4.48583e-01 2.39499e+02 149.317 -3.04893e+01 1.80907e+01  0.00000e+00 0.00000e+00 2.56706e+02 149.317 1.72066e+01 149.317 0.9858 
1 1 1 -2  19  16 o 8  1.48888e+01 6.04603e-01 2.01355e+02 8.556   4.15524e+01  6.25146e+00  0.00000e+00 0.00000e+00 3.46259e+02 8.556   1.44904e+02 8.556   0.9880 
1 1 1 -2  19  17 o 17 3.26106e+00 9.15761e-01 1.13635e+02 91.905  -1.74711e-01 5.25391e+00  0.00000e+00 0.00000e+00 4.61686e+00 271.905 1.18252e+02 271.905 0.8990 
1 1 1 -2  19  18 o 6  7.66991e+00 9.14160e-01 9.57355e+01 272.108 4.41945e-01  -1.20047e+01 0.00000e+00 0.00000e+00 1.77017e+02 272.108 8.12814e+01 272.108 0.9574 
1 1 1 -2  19  19 o 13 5.06837e+00 1.06670e+00 9.10985e+01 231.191 -5.01677e+00 -6.23759e+00 0.00000e+00 0.00000e+00 8.47563e+01 231.191 6.34226e+00 51.191  0.9353 
1 1 1 -2  19  20 o 12 6.21803e+00 1.32378e+00 8.04248e+01 79.140  1.61165e+00  8.40046e+00  0.00000e+00 0.00000e+00 1.36038e+02 79.140  5.56137e+01 79.140  0.9396 
1 1 1 -2  20  1  o 18 1.61761e+01 2.90020e-01 3.40317e+02 286.470 7.22700e-01  -2.44441e+00 0.00000e+00 0.00000e+00 1.27655e+02 286.470 2.12662e+02 106.471 0.7702 
1 1 1 -2  20  2  o 16 1.68283e+01 2.83026e-01 3.15257e+02 128.686 -1.64589e+00 2.05544e+00  0.00000e+00 0.00000e+00 1.76883e+02 128.686 1.38373e+02 308.686 0.7787 
1 1 1 -2  20  3  o 10 1.43775e+01 2.69423e-01 2.96145e+02 297.366 1.57695e+00  -3.04666e+00 0.00000e+00 0.00000e+00 1.55884e+02 297.366 1.40261e+02 117.366 0.8374 
1 1 1 -2  20  4  o 18 5.37927e+00 2.31335e-01 1.43180e+02 7.261   6.01271e-01  7.66035e-02  0.00000e+00 0.00000e+00 8.46372e+01 187.260 2.27817e+02 187.260 0.2899 
1 1 1 -2  20  5  o 3  1.60746e+01 2.71449e-01 3.70811e+02 66.006  1.89490e+00  4.25714e+00  0.00000e+00 0.00000e+00 1.62866e+02 66.006  2.07946e+02 246.006 0.8848 
1 1 1 -2  20  6  o 18 1.76905e+01 2.90892e-01 4.34530e+02 160.579 -6.60386e+00 2.32827e+00  0.00000e+00 0.00000e+00 1.79563e+02 160.579 2.54968e+02 340.579 0.9256 
1 1 1 -2  20  7  o 1  2.08256e+01 3.77717e-01 4.34518e+02 54.120  5.83407e+00  8.06548e+00  0.00000e+00 0.00000e+00 3.05859e+02 54.120  1.28659e+02 234.120 0.9484 
1 1 1 -2  20  8  o 9  3.00007e+01 5.63509e-01 6.21060e+02 295.217 1.04608e+01  -2.22130e+01 0.00000e+00 0.00000e+00 4.79844e+02 295.217 1.41216e+02 115.217 0.9794 
1 1 1 -2  20  9  o 13 1.32647e+01 5.41988e-01 2.84274e+02 141.000 -4.98632e+00 4.03786e+00  0.00000e+00 0.00000e+00 1.71873e+02 141.000 1.12401e+02 321.000 0.9184 
1 1 1 -2  20  10 o 14 2.78963e+01 8.34435e-01 5.88970e+02 157.681 -3.57837e+01 1.46897e+01  0.00000e+00 0.00000e+00 4.41322e+02 157.681 1.47648e+02 337.681 0.9870 
1 1 1 -2  20  11 o 8  1.31207e+01 4.42110e-01 3.26900e+02 14.782  1.29302e+01  3.41198e+00  0.00000e+00 0.00000e+00 1.45003e+02 14.782  1.81897e+02 194.782 0.9619 
1 1 1 -2  20  12 o 5  1.18306e+01 4.97260e-01 2.22002e+02 302.224 6.16373e+00  -9.77878e+00 0.00000e+00 0.00000e+00 2.00454e+02 302.224 2.15477e+01 122.224 0.9557 
1 1 1 -2  20  13 o 8  1.37395e+01 4.53028e-01 2.75152e+02 145.420 -1.96973e+01 1.35781e+01  0.00000e+00 0.00000e+00 2.26934e+02 145.420 4.82178e+01 325.420 0.9789 
1 1 1 -2  20  14 o 18 1.79023e+01 4.24623e-01 3.25764e+02 67.479  1.99255e+01  4.80538e+01  0.00000e+00 0.00000e+00 3.35511e+02 67.479  9.74723e+00 67.479  0.9903 
1 1 1 -2  20  15 o 16 3.01135e+00 7.20750e-01 6.03566e+01 298.822 9.52217e-01  -1.73049e+00 0.00000e+00 0.00000e+00 1.74779e+01 298.822 4.28786e+01 118.822 0.6937 
1 1 1 -2  20  16 o 5  6.64701e+00 1.15283e+00 9.24849e+01 63.348  3.08690e+00  6.15036e+00  0.00000e+00 0.00000e+00 1.36184e+02 63.348  4.36988e+01 63.348  0.9242 
1 1 1 -2  20  17 o 18 3.84843e+00 8.47493e-01 1.10178e+02 258.055 -1.28418e+00 -6.07040e+00 0.00000e+00 0.00000e+00 2.08180e+01 258.055 8.93596e+01 78.055  0.9154 
1 1 1 -2  20  18 o 8  2.75619e+00 8.84508e-01 1.35318e+01 328.687 5.29416e-01  -3.22051e-01 0.00000e+00 0.00000e+00 1.67542e+01 328.687 3.22232e+00 328.687 0.2959 
1 1 1 -2  20  19 o 7  1.08481e+01 8.95444e-01 1.77357e+02 238.863 -1.93193e+01 -3.19793e+01 0.00000e+00 0.00000e+00 2.19636e+02 238.863 4.22793e+01 238.863 0.9865 
1 1 1 -2  20  20 o 5  3.44670e+00 1.11890e+00 6.41673e+01 104.332 -1.03379e+00 4.04633e+00  0.00000e+00 0.00000e+00 4.69240e+01 104.332 1.72433e+01 284.332 0.8700 
1 1 1 -2  21  1  o 8  2.10873e+01 3.45654e-01 4.31701e+02 161.066 -3.77618e+00 1.29537e+00  0.00000e+00 0.00000e+00 2.51972e+02 161.066 1.79729e+02 341.066 0.8632 
1 1 1 -2  21  2  o 18 2.03615e+01 3.24632e-01 2.64195e+02 277.769 4.84873e-01  -3.55394e+00 0.00000e+00 0.00000e+00 3.82295e+02 277.769 1.18100e+02 277.769 0.8455 
1 1 1 -2  21  3  o 11 1.74390e+01 2.88957e-01 1.82754e+02 357.555 2.48085e+00  -1.05928e-01 0.00000e+00 0.00000e+00 3.16887e+02 357.555 1.34133e+02 357.555 0.7631 
1 1 1 -2  21  4  o 3  2.47189e+01 3.73483e-01 3.35493e+02 36.838  5.02699e+00  3.76584e+00  0.00000e+00 0.00000e+00 5.14805e+02 36.838  1.79312e+02 36.838  0.9165 
1 1 1 -2  21  5  o 14 1.89906e+01 3.07354e-01 2.94393e+02 3.597   4.29710e+00  2.70126e-01  0.00000e+00 0.00000e+00 3.28566e+02 3.597   3.41731e+01 3.597   0.8743 
1 1 1 -2  21  6  o 16 7.47496e+00 2.08706e-01 1.92026e+02 350.494 1.27867e+00  -2.14116e-01 0.00000e+00 0.00000e+00 4.01840e+01 170.494 2.32210e+02 170.494 0.5416 
1 1 1 -2  21  7  o 7  2.44872e+01 4.29426e-01 2.96272e+02 3.083   9.50731e+00  5.12002e-01  0.00000e+00 0.00000e+00 5.72004e+02 3.083   2.75732e+02 3.083   0.9459 
1 1 1 -2  21  8  o 9  3.32100e+01 5.54008e-01 5.93823e+02 281.185 5.02219e+00  -2.53987e+01 0.00000e+00 0.00000e+00 6.26116e+02 281.185 3.22934e+01 281.185 0.9805 
1 1 1 -2  21  9  f 0  1.62821e+01 5.72626e-01 2.16564e+02 71.454  1.92076e+00  5.72534e+00  0.00000e+00 0.00000e+00 3.40015e+02 71.454  1.23451e+02 71.454  0.9130 
1 1 1 -2  21  10 o 12 1.77167e+01 5.67154e-01 3.62561e+02 222.515 -1.26368e+01 -1.15856e+01 0.00000e+00 0.00000e+00 2.80724e+02 222.515 8.18365e+01 42.515  0.9704 
1 1 1 -2  21  11 o 1  2.09351e+01 5.07460e-01 3.28136e+02 167.922 -2.08244e+01 4.45594e+00  0.00000e+00 0.00000e+00 4.36039e+02 167.922 1.07903e+02 167.922 0.9762 
1 1 1 -2  21  12 o 12 2.88998e+01 6.33169e-01 4.85712e+02 253.833 -1.77836e+01 -6.13417e+01 0.00000e+00 0.00000e+00 5.85539e+02 253.833 9.98261e+01 253.833 0.9921 
1 1 1 -2  21  13 o 9  1.71365e+01 4.41679e-01 2.69870e+02 198.236 -2.77772e+01 -9.15220e+00 0.00000e+00 0.00000e+00 3.58800e+02 198.236 8.89303e+01 198.236 0.9828 
1 1 1 -2  21  14 o 2  1.03259e+01 4.49418e-01 2.38706e+02 41.596  1.63565e+01  1.45199e+01  0.00000e+00 0.00000e+00 1.37501e+02 41.596  1.01205e+02 221.596 0.9769 
1 1 1 -2  21  15 o 3  4.02146e+00 6.81316e-01 4.96873e+01 337.096 2.02039e+00  -8.53597e-01 0.00000e+00 0.00000e+00 5.92607e+01 337.096 9.57345e+00 337.096 0.7271 
1 1 1 -2  21  16 o 8  3.20918e+00 7.96778e-01 9.02654e+01 153.203 -3.50848e+00 1.77206e+00  0.00000e+00 0.00000e+00 1.25585e+01 153.203 7.77068e+01 333.203 0.8608 
1 1 1 -2  21  17 o 8  7.24727e+00 7.32040e-01 1.29141e+02 216.651 -1.20727e+01 -8.98274e+00 0.00000e+00 0.00000e+00 1.31208e+02 216.651 2.06753e+00 216.651 0.9662 
1 1 1 -2  21  18 o 2  1.39628e+01 6.51173e-01 2.05891e+02 259.969 -9.58561e+00 -5.41908e+01 0.00000e+00 0.00000e+00 3.07934e+02 259.969 1.02044e+02 259.969 0.9909 
1 1 1 -2  21  19 o 16 2.91257e+00 9.64679e-01 9.23127e+01 98.061  -7.34011e-01 5.18274e+00  0.00000e+00 0.00000e+00 4.76454e+00 98.061  8.75481e+01 278.061 0.8986 
1 1 1 -2  21  20 o 12 4.31195e+00 1.22892e+00 7.92092e+01 38.232  4.64264e+00  3.65755e+00  0.00000e+00 0.00000e+00 6.63069e+01 38.232  1.29023e+01 218.232 0.9109 
1 1 1 -2  22  1  o 13 1.89678e+01 3.23486e-01 5.99542e+02 124.780 -3.22804e+00 4.64794e+00  0.00000e+00 0.00000e+00 4.63582e+01 124.780 5.53184e+02 304.780 0.9067 
1 1 1 -2  22  2  o 2  4.32534e+01 6.11849e-01 7.39176e+02 306.040 1.19755e+01  -1.64585e+01 0.00000e+00 0.00000e+00 8.44558e+02 306.040 1.05382e+02 306.040 0.9751 
1 1 1 -2  22  3  o 3  1.35658e+01 2.51792e-01 1.28187e+02 75.534  2.51226e-01  9.73807e-01  0.00000e+00 0.00000e+00 1.00172e+02 75.534  2.80146e+01 255.534 0.4484 
1 1 1 -2  22  4  o 17 2.03941e+01 3.24597e-01 4.16304e+02 316.136 4.53600e+00  -4.35963e+00 0.00000e+00 0.00000e+00 2.85297e+02 316.136 1.31007e+02 136.136 0.9167 
1 1 1 -2  22  5  o 11 1.81403e+01 2.99747e-01 4.38201e+02 37.289  5.46731e+00  4.16334e+00  0.00000e+00 0.00000e+00 1.90688e+02 37.289  2.47513e+02 217.289 0.9241 
1 1 1 -2  22  6  o 4  1.73743e+01 2.84813e-01 3.27634e+02 330.356 5.29016e+00  -3.01059e+00 0.00000e+00 0.00000e+00 2.67680e+02 330.356 5.99537e+01 150.356 0.9137 
1 1 1 -2  22  7  o 2  8.70631e+00 2.31778e-01 1.06294e+02 44.743  8.60311e-01  8.52623e-01  0.00000e+00 0.00000e+00 6.21777e+01 44.743  4.41163e+01 224.743 0.5162 
1 1 1 -2  22  8  o 1  4.65087e+01 7.46512e-01 9.72872e+02 185.812 -6.06109e+01 -6.16909e+00 0.00000e+00 0.00000e+00 7.55111e+02 185.812 2.17761e+02 5.812   0.9918 
1 1 1 -2  22  9  o 9  3.05370e+01 5.81809e-01 5.27057e+02 120.218 -1.38443e+01 2.37697e+01  0.00000e+00 0.00000e+00 5.95277e+02 120.218 6.82200e+01 120.218 0.9817 
1 1 1 -2  22  10 o 19 1.68562e+01 5.55554e-01 4.20455e+02 253.103 -5.48999e+00 -1.80727e+01 0.00000e+00 0.00000e+00 1.93298e+02 253.103 2.27157e+02 73.103  0.9732 
1 1 1 -2  22  11 o 13 2.37592e+01 7.84486e-01 5.28429e+02 122.499 -2.11318e+01 3.31710e+01  0.00000e+00 0.00000e+00 3.48526e+02 122.499 1.79903e+02 302.499 0.9872 
1 1 1 -2  22  12 o 7  2.32664e+01 5.63760e-01 4.18317e+02 290.198 1.53612e+01  -4.17555e+01 0.00000e+00 0.00000e+00 4.41074e+02 290.198 2.27569e+01 290.198 0.9887 
1 1 1 -2  22  13 o 5  2.75236e+01 6.44753e-01 3.72105e+02 46.381  4.78134e+01  5.01764e+01  0.00000e+00 0.00000e+00 6.47847e+02 46.381  2.75741e+02 46.381  0.9928 
1 1 1 -2  22  14 o 5  7.75146e+00 4.52455e-01 1.71065e+02 293.513 4.94803e+00  -1.13728e+01 0.00000e+00 0.00000e+00 1.06107e+02 293.513 6.49579e+01 113.513 0.9588 
1 1 1 -2  22  15 o 7  1.58449e+01 5.32438e-01 2.30878e+02 13.604  3.79482e+01  9.18314e+00  0.00000e+00 0.00000e+00 3.51861e+02 13.604  1.20984e+02 13.604  0.9871 
1 1 1 -2  22  16 o 4  1.43454e+01 5.48399e-01 1.91428e+02 357.398 4.06170e+01  -1.84593e+00 0.00000e+00 0.00000e+00 3.35894e+02 357.398 1.44466e+02 357.398 0.9876 
1 1 1 -2  22  17 f 0  6.31847e+00 7.66541e-01 1.10564e+02 263.195 -1.30926e+00 -1.09724e+01 0.00000e+00 0.00000e+00 1.13456e+02 263.195 2.89196e+00 263.195 0.9536 
1 1 1 -2  22  18 o 14 3.20017e+00 9.41895e-01 2.10366e+01 290.549 3.88027e-01  -1.03511e+00 0.00000e+00 0.00000e+00 3.63060e+01 290.549 1.52694e+01 290.549 0.4825 
1 1 1 -2  22  19 o 18 3.09154e+00 1.02318e+00 2.96737e+01 168.272 -1.67660e+00 3.48055e-01  0.00000e+00 0.00000e+00 4.42211e+01 168.272 1.45474e+01 168.272 0.6444 
1 1 1 -2  22  20 o 2  3.94638e+00 1.24090e+00 5.57453e+01 352.084 3.96034e+00  -5.50658e-01 0.00000e+00 0.00000e+00 7.04849e+01 352.084 1.47396e+01 352.084 0.8635 
1 1 1 -2  23  1  o 2  1.72631e+01 3.14124e-01 2.74140e+02 17.690  3.00173e+00  9.57408e-01  0.00000e+00 0.00000e+00 2.57810e+02 17.690  1.63298e+01 197.690 0.8205 
1 1 1 -2  23  2  o 2  1.28736e+01 2.74243e-01 1.76600e+02 303.386 1.02628e+00  -1.55726e+00 0.00000e+00 0.00000e+00 1.49342e+02 303.386 2.72577e+01 123.386 0.6743 
1 1 1 -2  23  3  o 6  3.43480e+01 4.96946e-01 5.64037e+02 51.150  6.79951e+00  8.44166e+00  0.00000e+00 0.00000e+00 6.64339e+02 51.150  1.00302e+02 51.150  0.9527 
1 1 1 -2  23  4  o 13 1.26073e+01 3.30749e-01 2.56267e+02 223.691 -1.77404e+00 -1.69477e+00 0.00000e+00 0.00000e+00 1.03226e+02 223.691 1.53041e+02 43.691  0.7598 
1 1 1 -2  23  5  o 11 1.54998e+01 2.65114e-01 4.46361e+02 291.532 2.16499e+00  -5.48720e+00 0.00000e+00 0.00000e+00 8.32095e+01 291.532 3.63151e+02 111.532 0.9108 
1 1 1 -2  23  6  o 4  1.54735e+01 3.27471e-01 4.51173e+02 336.633 6.78818e+00  -2.93293e+00 0.00000e+00 0.00000e+00 8.82647e+01 336.633 3.62909e+02 156.633 0.9297 
1 1 1 -2  23  7  o 6  1.50828e+01 2.87794e-01 3.82079e+02 183.207 -6.84741e+00 -3.83728e-01 0.00000e+00 0.00000e+00 1.40219e+02 183.207 2.41861e+02 3.207   0.9239 
1 1 1 -2  23  8  o 15 8.90172e+00 4.40085e-01 2.64986e+02 238.113 -1.68682e+00 -2.71137e+00 0.00000e+00 0.00000e+00 9.55902e+00 238.113 2.55426e+02 58.113  0.8233 
1 1 1 -2  23  9  o 14 2.16842e+01 4.04778e-01 4.46866e+02 59.676  1.02991e+01  1.76081e+01  0.00000e+00 0.00000e+00 3.44790e+02 59.676  1.02076e+02 239.676 0.9752 
1 1 1 -2  23  10 o 17 1.30373e+01 3.89288e-01 1.81086e+02 324.307 5.03394e+00  -3.61635e+00 0.00000e+00 0.00000e+00 2.65385e+02 324.307 8.42984e+01 324.307 0.9153 
1 1 1 -2  23  11 o 12 1.60348e+01 4.48292e-01 3.06487e+02 171.755 -1.55721e+01 2.25646e+00  0.00000e+00 0.00000e+00 2.73621e+02 171.755 3.28663e+01 351.755 0.9677 
1 1 1 -2  23  12 o 5  2.38210e+01 5.69465e-01 4.20609e+02 69.678  1.68013e+01  4.53665e+01  0.00000e+00 0.00000e+00 4.60023e+02 69.678  3.94142e+01 69.678  0.9896 
1 1 1 -2  23  13 o 5  1.21013e+01 5.04310e-01 1.39933e+02 82.915  1.43994e+00  1.15845e+01  0.00000e+00 0.00000e+00 2.91951e+02 82.915  1.52018e+02 82.915  0.9562 
1 1 1 -2  23  14 o 15 6.48435e+00 5.66445e-01 2.10775e+02 253.478 -3.55615e+00 -1.19884e+01 0.00000e+00 0.00000e+00 2.11566e+01 253.478 1.89619e+02 73.478  0.9591 
1 1 1 -2  23  15 o 1  9.43614e+00 4.84547e-01 1.87471e+02 110.234 -6.58227e+00 1.78577e+01  0.00000e+00 0.00000e+00 1.54713e+02 110.234 3.27576e+01 290.234 0.9734 
1 1 1 -2  23  16 o 3  3.86393e+00 7.66180e-01 1.34938e+02 127.286 -4.11916e+00 5.40991e+00  0.00000e+00 0.00000e+00 2.17427e+00 307.286 1.37113e+02 307.286 0.9232 
1 1 1 -2  23  17 o 11 7.39654e+00 7.36885e-01 1.60483e+02 170.523 -1.74821e+01 2.91838e+00  0.00000e+00 0.00000e+00 1.06623e+02 170.523 5.38604e+01 350.523 0.9714 
1 1 1 -2  23  18 f 0  3.02584e+00 9.47303e-01 6.05945e+01 9.868   2.76067e+00  4.80219e-01  0.00000e+00 0.00000e+00 2.86455e+01 9.868   3.19490e+01 189.868 0.7942 
1 1 1 -2  23  19 o 6  3.23110e+00 1.01547e+00 1.39650e+02 97.083  -9.97163e-01 8.02462e+00  0.00000e+00 0.00000e+00 2.74869e+01 277.083 1.67137e+02 277.083 0.9360 
1 1 1 -2  23  20 o 15 5.73874e+00 1.22373e+00 1.20903e+02 14.252  1.23903e+01  3.14722e+00  0.00000e+00 0.00000e+00 8.31796e+01 14.252  3.77234e+01 194.252 0.9601 
1 1 1 -2  24  1  o 10 2.26346e+01 3.56470e-01 5.66618e+02 171.621 -8.05903e+00 1.18701e+00  0.00000e+00 0.00000e+00 2.29321e+02 171.621 3.37297e+02 351.621 0.9364 
1 1 1 -2  24  2  o 16 3.87362e+00 2.64691e-01 2.00267e+02 329.149 5.25182e-01  -3.13703e-01 0.00000e+00 0.00000e+00 1.57742e+02 149.149 3.58008e+02 149.149 0.2924 
1 1 1 -2  24  3  o 12 1.44697e+01 2.65113e-01 2.24473e+02 5.795   2.59987e+00  2.63847e-01  0.00000e+00 0.00000e+00 1.97419e+02 5.795   2.70542e+01 185.795 0.7768 
1 1 1 -2  24  4  o 7  1.82596e+01 3.04196e-01 2.39143e+02 21.237  3.02730e+00  1.17649e+00  0.00000e+00 0.00000e+00 3.27349e+02 21.237  8.82063e+01 21.237  0.8268 
1 1 1 -2  24  5  o 3  8.16318e+00 2.32141e-01 3.57733e+02 14.628  2.52588e+00  6.59276e-01  0.00000e+00 0.00000e+00 1.19957e+02 194.628 4.77690e+02 194.628 0.7765 
1 1 1 -2  24  6  o 13 1.62653e+01 2.78391e-01 3.62359e+02 137.226 -4.53592e+00 4.19642e+00  0.00000e+00 0.00000e+00 1.95722e+02 137.226 1.66637e+02 317.226 0.9151 
1 1 1 -2  24  7  o 15 1.60498e+01 3.19540e-01 3.23266e+02 35.499  4.99345e+00  3.56167e+00  0.00000e+00 0.00000e+00 2.26751e+02 35.499  9.65155e+01 215.499 0.9144 
1 1 1 -2  24  8  o 18 2.56830e+01 4.20235e-01 4.91691e+02 127.243 -1.21501e+01 1.59819e+01  0.00000e+00 0.00000e+00 4.46066e+02 127.243 4.56253e+01 307.243 0.9748 
1 1 1 -2  24  9  o 19 1.00179e+01 3.41879e-01 1.83486e+02 31.173  3.30625e+00  2.00021e+00  0.00000e+00 0.00000e+00 1.38318e+02 31.173  4.51681e+01 211.173 0.8581 
1 1 1 -2  24  10 o 10 1.89260e+01 4.59856e-01 1.52870e+02 251.390 -2.41293e+00 -7.16596e+00 0.00000e+00 0.00000e+00 5.06532e+02 251.390 3.53661e+02 251.390 0.9313 
1 1 1 -2  24  11 o 15 1.14175e+01 4.12225e-01 1.12568e+02 97.072  -5.24360e-01 4.22659e+00  0.00000e+00 0.00000e+00 2.59963e+02 97.072  1.47394e+02 97.072  0.8728 
1 1 1 -2  24  12 o 2  1.19315e+01 4.59162e-01 2.37191e+02 54.162  7.89971e+00  1.09380e+01  0.00000e+00 0.00000e+00 1.91655e+02 54.162  4.55360e+01 234.162 0.9622 
1 1 1 -2  24  13 o 19 2.52157e+01 6.14794e-01 3.53363e+02 305.155 3.60029e+01  -5.11217e+01 0.00000e+00 0.00000e+00 5.80206e+02 305.155 2.26842e+02 305.155 0.9920 
1 1 1 -2  24  14 o 16 1.19227e+01 5.42563e-01 1.89020e+02 317.831 1.53420e+01  -1.38961e+01 0.00000e+00 0.00000e+00 2.44693e+02 317.831 5.56729e+01 317.831 0.9755 
1 1 1 -2  24  15 o 17 3.37993e+00 1.01252e+00 4.95872e+01 122.795 -9.07245e-01 1.40803e+00  0.00000e+00 0.00000e+00 3.05582e+01 122.795 1.90290e+01 302.795 0.6365 
1 1 1 -2  24  16 o 2  3.73479e+00 8.11298e-01 1.00855e+02 281.475 9.59440e-01  -4.72648e+00 0.00000e+00 0.00000e+00 2.27214e+01 281.475 7.81339e+01 101.475 0.8891 
1 1 1 -2  24  17 f 0  8.43344e+00 7.50514e-01 2.31022e+02 73.000  8.44809e+00  2.76317e+01  0.00000e+00 0.00000e+00 7.70119e+01 73.000  1.54011e+02 253.000 0.9825 
1 1 1 -2  24  18 o 7  5.78448e+00 1.54465e+00 1.04784e+02 140.325 -5.00793e+00 4.15391e+00  0.00000e+00 0.00000e+00 9.27284e+01 140.325 1.20559e+01 320.325 0.9196 
1 1 1 -2  24  19 o 6  5.27868e+00 1.61958e+00 7.93706e+01 288.450 1.55300e+00  -4.65485e+00 0.00000e+00 0.00000e+00 9.50953e+01 288.450 1.57247e+01 288.450 0.8912 
1 1 1 -2  24  20 o 12 5.75830e+00 1.74034e+00 1.22301e+02 194.697 -8.20127e+00 -2.15108e+00 0.00000e+00 0.00000e+00 7.79806e+01 194.697 4.43202e+01 14.697  0.9390 
1 1 1 -2  25  1  o 14 2.03541e+01 3.33129e-01 3.23079e+02 20.257  5.01629e+00  1.85130e+00  0.00000e+00 0.00000e+00 3.65418e+02 20.257  4.23396e+01 20.257  0.9009 
1 1 1 -2  25  2  o 8  2.24969e+01 4.16494e-01 3.99129e+02 308.053 3.21777e+00  -4.11076e+00 0.00000e+00 0.00000e+00 3.59525e+02 308.053 3.96037e+01 128.053 0.8983 
1 1 1 -2  25  3  o 13 2.40422e+01 3.72094e-01 6.02235e+02 148.054 -9.59252e+00 5.98142e+00  0.00000e+00 0.00000e+00 2.59268e+02 148.054 3.42967e+02 328.054 0.9547 
1 1 1 -2  25  4  o 4  2.31308e+01 3.52713e-01 3.67586e+02 55.583  4.12922e+00  6.02672e+00  0.00000e+00 0.00000e+00 4.38540e+02 55.583  7.09545e+01 55.583  0.9288 
1 1 1 -2  25  5  o 4  1.97770e+01 3.14734e-01 4.07481e+02 122.169 -3.78132e+00 6.01192e+00  0.00000e+00 0.00000e+00 2.79929e+02 122.169 1.27552e+02 302.169 0.9267 
1 1 1 -2  25  6  o 9  2.93738e+01 4.29143e-01 5.78229e+02 359.626 1.76113e+01  -1.14893e-01 0.00000e+00 0.00000e+00 4.91361e+02 359.626 8.68674e+01 179.626 0.9712 
1 1 1 -2  25  7  o 8  1.65799e+01 3.09983e-01 3.41766e+02 278.635 1.04613e+00  -6.88847e+00 0.00000e+00 0.00000e+00 2.33079e+02 278.635 1.08687e+02 98.635  0.9252 
1 1 1 -2  25  8  o 19 1.55563e+01 3.07904e-01 3.18411e+02 135.515 -5.49745e+00 5.39950e+00  0.00000e+00 0.00000e+00 2.25018e+02 135.515 9.33926e+01 315.515 0.9327 
1 1 1 -2  25  9  o 12 1.26699e+01 2.84981e-01 2.20188e+02 246.230 -2.36351e+00 -5.36642e+00 0.00000e+00 0.00000e+00 2.11489e+02 246.230 8.69946e+00 66.230  0.9102 
1 1 1 -2  25  10 f 0  2.14264e+01 4.31087e-01 2.58180e+02 356.538 1.52023e+01  -9.19818e-01 0.00000e+00 0.00000e+00 5.16566e+02 356.538 2.58386e+02 356.538 0.9666 
1 1 1 -2  25  11 o 8  1.06949e+01 4.04078e-01 2.45956e+02 289.350 3.12654e+00  -8.90327e+00 0.00000e+00 0.00000e+00 1.32014e+02 289.350 1.13942e+02 109.350 0.9454 
1 1 1 -2  25  12 o 9  1.70818e+01 5.02231e-01 4.32450e+02 82.253  4.71654e+00  3.46699e+01  0.00000e+00 0.00000e+00 1.96405e+02 82.253  2.36045e+02 262.253 0.9856 
1 1 1 -2  25  13 o 5  1.31838e+01 4.65737e-01 2.11371e+02 297.838 9.31030e+00  -1.76305e+01 0.00000e+00 0.00000e+00 2.68152e+02 297.838 5.67813e+01 297.838 0.9746 
1 1 1 -2  25  14 o 5  6.44083e+00 5.68342e-01 6.00388e+01 34.365  2.91295e+00  1.99191e+00  0.00000e+00 0.00000e+00 1.42317e+02 34.365  8.22783e+01 34.365  0.8426 
1 1 1 -2  25  15 o 10 2.08168e+01 6.21567e-01 3.43930e+02 139.375 -6.15430e+01 5.27961e+01  0.00000e+00 0.00000e+00 4.26711e+02 139.375 8.27818e+01 139.375 0.9938 
1 1 1 -2  25  16 o 5  3.22905e+00 1.03819e+00 8.30012e+01 267.553 -1.37375e-01 -3.21524e+00 0.00000e+00 0.00000e+00 1.61198e+01 267.553 6.68814e+01 87.553  0.8249 
1 1 1 -2  25  17 o 1  4.42420e+00 1.33028e+00 8.16263e+01 182.453 -4.38940e+00 -1.88007e-01 0.00000e+00 0.00000e+00 6.26202e+01 182.453 1.90061e+01 2.453   0.8771 
1 1 1 -2  25  18 o 15 4.68485e+00 1.43556e+00 1.14467e+02 317.744 4.85804e+00  -4.41371e+00 0.00000e+00 0.00000e+00 4.56162e+01 317.744 6.88510e+01 137.744 0.9203 
1 1 1 -2  25  19 o 17 7.81555e+00 1.88342e+00 9.86876e+01 245.819 -3.07017e+00 -6.83756e+00 0.00000e+00 0.00000e+00 1.71054e+02 245.819 7.23667e+01 245.819 0.9307 
1 1 1 -2  25  20 o 1  4.93073e+00 1.66464e+00 1.51826e+02 35.688  7.76168e+00  5.57492e+00  0.00000e+00 0.00000e+00 2.09574e+01 35.688  1.30868e+02 215.688 0.9461 
1 1 1 -2  26  1  o 13 1.44304e+01 2.74701e-01 4.60253e+02 210.170 -4.47907e+00 -2.60378e+00 0.00000e+00 0.00000e+00 2.59711e+01 210.170 4.34282e+02 30.170  0.8974 
1 1 1 -2  26  2  o 1  2.64271e+01 4.66903e-01 6.16180e+02 81.152  1.40453e+00  9.02269e+00  0.00000e+00 0.00000e+00 3.19878e+02 81.152  2.96302e+02 261.152 0.9435 
1 1 1 -2  26  3  o 12 2.08411e+01 3.37502e-01 2.08655e+02 345.712 3.15657e+00  -8.03898e-01 0.00000e+00 0.00000e+00 4.38485e+02 345.712 2.29829e+02 345.712 0.8273 
1 1 1 -2  26  4  o 4  8.42009e+00 2.19240e-01 1.51882e+02 339.000 9.33976e-01  -3.58512e-01 0.00000e+00 0.00000e+00 1.08107e+01 159.000 1.62693e+02 159.000 0.4465 
1 1 1 -2  26  5  o 17 2.09819e+01 3.29608e-01 4.88537e+02 127.760 -6.00861e+00 7.75736e+00  0.00000e+00 0.00000e+00 2.57174e+02 127.760 2.31362e+02 307.760 0.9476 
1 1 1 -2  26  6  o 1  2.64197e+01 3.94927e-01 4.90704e+02 57.840  8.29404e+00  1.31910e+01  0.00000e+00 0.00000e+00 4.67464e+02 57.840  2.32403e+01 237.840 0.9674 
1 1 1 -2  26  7  o 14 3.17750e+00 3.46327e-01 1.08878e+02 83.094  5.44081e-02  4.49182e-01  0.00000e+00 0.00000e+00 8.26074e+01 263.093 1.91486e+02 263.093 0.2206 
1 1 1 -2  26  8  o 11 3.05958e+01 5.88888e-01 5.27438e+02 217.165 -1.97702e+01 -1.49874e+01 0.00000e+00 0.00000e+00 5.95127e+02 217.165 6.76892e+01 217.165 0.9796 
1 1 1 -2  26  9  o 5  2.71588e+01 4.44215e-01 5.52180e+02 94.926  -2.68632e+00 3.11652e+01  0.00000e+00 0.00000e+00 4.47999e+02 94.926  1.04181e+02 274.926 0.9839 
1 1 1 -2  26  10 o 13 1.49062e+01 3.61558e-01 2.17825e+02 5.946   8.89738e+00  9.26672e-01  0.00000e+00 0.00000e+00 3.07594e+02 5.946   8.97694e+01 5.946   0.9423 
1 1 1 -2  26  11 o 6  1.46730e+01 4.52088e-01 3.21339e+02 209.311 -1.46643e+01 -8.23291e+00 0.00000e+00 0.00000e+00 2.10553e+02 209.311 1.10786e+02 29.311  0.9698 
1 1 1 -2  26  12 o 16 1.25290e+01 4.84306e-01 3.11311e+02 19.161  1.87931e+01  6.53021e+00  0.00000e+00 0.00000e+00 1.44724e+02 19.161  1.66587e+02 199.161 0.9745 
1 1 1 -2  26  13 o 1  1.42373e+01 7.60965e-01 1.76744e+02 307.838 1.11014e+01  -1.42925e+01 0.00000e+00 0.00000e+00 3.39667e+02 307.838 1.62923e+02 307.838 0.9720 
1 1 1 -2  26  14 f 0  8.86962e+00 9.50460e-01 1.98511e+02 191.422 -1.43306e+01 -2.89537e+00 0.00000e+00 0.00000e+00 1.20667e+02 191.422 7.78437e+01 11.422  0.9652 
1 1 1 -2  26  15 o 13 1.12644e+01 9.82330e-01 2.02660e+02 68.285  8.90774e+00  2.23670e+01  0.00000e+00 0.00000e+00 2.08108e+02 68.285  5.44809e+00 68.285  0.9790 
1 1 1 -2  26  16 o 5  6.57743e+00 1.33390e+00 1.56968e+02 0.612   1.07063e+01  1.14372e-01  0.00000e+00 0.00000e+00 7.60512e+01 0.612   8.09167e+01 180.612 0.9521 
1 1 1 -2  26  17 o 8  9.46654e+00 1.93087e+00 1.41528e+02 354.514 1.07931e+01  -1.03657e+00 0.00000e+00 0.00000e+00 1.93696e+02 354.514 5.21682e+01 354.514 0.9527 
1 1 1 -2  26  18 o 14 1.10103e+01 1.57669e+00 1.25971e+02 336.951 1.41123e+01  -6.00446e+00 0.00000e+00 0.00000e+00 2.69244e+02 336.951 1.43274e+02 336.951 0.9668 
1 1 1 -2  26  19 o 4  5.14558e+00 1.61814e+00 1.00618e+02 141.326 -4.71381e+00 3.77303e+00  0.00000e+00 0.00000e+00 7.35776e+01 141.326 2.70401e+01 321.326 0.9129 
1 1 1 -2  26  20 o 4  7.34760e+00 2.05030e+00 1.73673e+02 135.482 -8.77038e+00 8.62405e+00  0.00000e+00 0.00000e+00 8.71345e+01 135.482 8.65383e+01 315.482 0.9584 
1 1 1 -2  27  1  o 8  3.48177e+01 5.09257e-01 5.04484e+02 121.788 -5.30719e+00 8.56357e+00  0.00000e+00 0.00000e+00 7.36019e+02 121.788 2.31535e+02 121.788 0.9490 
1 1 1 -2  27  2  o 2  2.78873e+01 4.89121e-01 5.85286e+02 2.277   1.30634e+01  5.19322e-01  0.00000e+00 0.00000e+00 4.20652e+02 2.277   1.64634e+02 182.277 0.9610 
1 1 1 -2  27  3  o 7  9.93995e+00 2.60357e-01 8.33635e+01 144.888 -5.18285e-01 3.64425e-01  0.00000e+00 0.00000e+00 2.92500e+01 144.888 5.41135e+01 324.887 0.3019 
1 1 1 -2  27  4  o 10 1.68506e+01 3.33870e-01 4.00133e+02 141.355 -4.03896e+00 3.22941e+00  0.00000e+00 0.00000e+00 1.67072e+02 141.355 2.33061e+02 321.355 0.8972 
1 1 1 -2  27  5  o 15 1.65355e+01 2.85929e-01 3.35823e+02 62.002  2.46494e+00  4.63627e+00  0.00000e+00 0.00000e+00 2.21620e+02 62.002  1.14203e+02 242.002 0.8989 
1 1 1 -2  27  6  o 2  1.43612e+01 2.67918e-01 3.87363e+02 82.978  8.11897e-01  6.59143e+00  0.00000e+00 0.00000e+00 1.08639e+02 82.978  2.78724e+02 262.978 0.9213 
1 1 1 -2  27  7  o 18 1.69117e+01 3.55566e-01 4.40232e+02 357.087 9.67174e+00  -4.92060e-01 0.00000e+00 0.00000e+00 1.59786e+02 357.087 2.80446e+02 177.087 0.9469 
1 1 1 -2  27  8  f 0  1.58692e+01 3.18182e-01 1.03999e+02 159.686 -2.94096e+00 1.08868e+00  0.00000e+00 0.00000e+00 3.83066e+02 159.686 2.79067e+02 159.686 0.8196 
1 1 1 -2  27  9  o 4  2.71424e+01 4.43907e-01 4.41491e+02 187.664 -2.58267e+01 -3.47557e+00 0.00000e+00 0.00000e+00 5.54699e+02 187.664 1.13208e+02 187.664 0.9806 
1 1 1 -2  27  10 o 15 2.24972e+01 4.56907e-01 3.14293e+02 95.179  -1.79210e+00 1.97727e+01  0.00000e+00 0.00000e+00 5.05695e+02 95.179  1.91402e+02 95.179  0.9745 
1 1 1 -2  27  11 o 18 1.73570e+01 3.98651e-01 3.46506e+02 317.912 1.55246e+01  -1.40218e+01 0.00000e+00 0.00000e+00 2.86529e+02 317.912 5.99771e+01 137.912 0.9758 
1 1 1 -2  27  12 o 17 2.69305e+01 6.18161e-01 4.21218e+02 16.247  5.46057e+01  1.59131e+01  0.00000e+00 0.00000e+00 5.75663e+02 16.247  1.54445e+02 16.247  0.9912 
1 1 1 -2  27  13 o 16 1.77380e+01 5.17075e-01 3.21914e+02 129.708 -2.75395e+01 3.31625e+01  0.00000e+00 0.00000e+00 3.32257e+02 129.708 1.03432e+01 129.708 0.9883 
1 1 1 -2  27  14 o 1  7.83975e+00 1.03269e+00 2.31686e+02 128.070 -9.52931e+00 1.21664e+01  0.00000e+00 0.00000e+00 5.09706e+01 128.070 1.80715e+02 308.070 0.9671 
1 1 1 -2  27  15 o 8  1.34873e+01 9.02700e-01 3.16510e+02 348.644 4.54094e+01  -9.11954e+00 0.00000e+00 0.00000e+00 1.80376e+02 348.644 1.36135e+02 168.644 0.9891 
1 1 1 -2  27  16 o 10 4.19643e+00 1.20195e+00 9.40586e+01 318.999 3.45845e+00  -3.00646e+00 0.00000e+00 0.00000e+00 4.37645e+01 318.999 5.02941e+01 138.999 0.8827 
1 1 1 -2  27  17 o 19 9.43154e+00 1.45835e+00 1.65901e+02 228.475 -1.10474e+01 -1.24759e+01 0.00000e+00 0.00000e+00 1.73951e+02 228.475 8.04919e+00 228.475 0.9695 
1 1 1 -2  27  18 f 0  6.83993e+00 1.72153e+00 6.11145e+01 357.565 4.20293e+00  -1.78749e-01 0.00000e+00 0.00000e+00 1.60060e+02 357.565 9.89459e+01 357.565 0.8710 
1 1 1 -2  27  19 o 11 7.07026e+00 1.95827e+00 1.86473e+02 164.409 -1.21396e+01 3.38728e+00  0.00000e+00 0.00000e+00 6.50592e+01 164.409 1.21414e+02 344.409 0.9595 
1 1 1 -2  27  20 o 14 5.45027e+00 1.74984e+00 7.45968e+01 59.671  2.44037e+00  4.17142e+00  0.00000e+00 0.00000e+00 1.04905e+02 59.671  3.03081e+01 59.671  0.8894 
1 1 1 -2  28  1  o 13 1.92263e+01 3.26251e-01 3.98196e+02 197.362 -5.98208e+00 -1.87035e+00 0.00000e+00 0.00000e+00 2.63181e+02 197.362 1.35015e+02 17.362  0.9163 
1 1 1 -2  28  2  o 4  3.37899e+01 5.76555e-01 5.08051e+02 41.484  9.82183e+00  8.68477e+00  0.00000e+00 0.00000e+00 7.10853e+02 41.484  2.02802e+02 41.484  0.9611 
1 1 1 -2  28  3  o 2  2.20098e+01 3.69591e-01 3.85310e+02 45.667  4.41550e+00  4.51954e+00  0.00000e+00 0.00000e+00 3.72098e+02 45.667  1.32113e+01 225.667 0.9170 
1 1 1 -2  28  4  o 19 2.55690e+01 3.84085e-01 4.47775e+02 203.070 -9.03036e+00 -3.84626e+00 0.00000e+00 0.00000e+00 4.61171e+02 203.070 1.33966e+01 203.070 0.9476 
1 1 1 -2  28  5  o 4  2.49999e+01 3.78296e-01 4.22462e+02 123.085 -5.19525e+00 7.97410e+00  0.00000e+00 0.00000e+00 4.64345e+02 123.085 4.18831e+01 123.085 0.9459 
1 1 1 -2  28  6  o 17 6.98314e+00 2.80973e-01 1.75238e+02 38.647  1.05557e+00  8.44068e-01  0.00000e+00 0.00000e+00 2.93723e+01 218.647 2.04610e+02 218.647 0.5572 
1 1 1 -2  28  7  o 15 4.69907e+01 6.99385e-01 8.67179e+02 243.874 -2.27805e+01 -4.64470e+01 0.00000e+00 0.00000e+00 8.76344e+02 243.874 9.16483e+00 243.874 0.9903 
1 1 1 -2  28  8  o 19 2.29029e+01 3.94223e-01 3.54192e+02 337.887 1.41834e+01  -5.76292e+00 0.00000e+00 0.00000e+00 4.74957e+02 337.887 1.20765e+02 337.887 0.9668 
1 1 1 -2  28  9  o 19 1.86747e+01 3.88406e-01 2.33492e+02 224.897 -6.88510e+00 -6.86043e+00 0.00000e+00 0.00000e+00 4.28414e+02 224.897 1.94922e+02 224.897 0.9471 
1 1 1 -2  28  10 o 5  1.24630e+01 3.17635e-01 2.20379e+02 217.664 -6.63227e+00 -5.11928e+00 0.00000e+00 0.00000e+00 2.16966e+02 217.664 3.41260e+00 37.664  0.9383 
1 1 1 -2  28  11 o 17 8.27561e+00 3.39518e-01 2.21520e+02 268.316 -2.13752e-01 -7.27061e+00 0.00000e+00 0.00000e+00 6.56417e+01 268.316 1.55878e+02 88.316  0.9285 
1 1 1 -2  28  12 o 7  8.05889e+00 4.70161e-01 2.43330e+02 90.894  -1.67523e-01 1.07334e+01  0.00000e+00 0.00000e+00 4.32398e+01 90.894  2.00090e+02 270.894 0.9522 
1 1 1 -2  28  13 o 19 8.60678e+00 4.38988e-01 1.97618e+02 175.822 -1.29166e+01 9.43502e-01  0.00000e+00 0.00000e+00 1.10863e+02 175.822 8.67552e+01 355.822 0.9606 
1 1 1 -2  28  14 o 7  1.59866e+01 8.60628e-01 2.64481e+02 20.846  3.53852e+01  1.34745e+01  0.00000e+00 0.00000e+00 3.23553e+02 20.846  5.90724e+01 20.846  0.9867 
1 1 1 -2  28  15 o 17 1.65276e+01 9.05059e-01 2.72652e+02 2.839   5.13118e+01  2.54458e+00  0.00000e+00 0.00000e+00 3.36858e+02 2.839   6.42057e+01 2.839   0.9902 
1 1 1 -2  28  16 f 0  1.04119e+01 1.25031e+00 5.83735e+01 243.367 -3.02646e+00 -6.03512e+00 0.00000e+00 0.00000e+00 2.99030e+02 243.367 2.40656e+02 243.367 0.9226 
1 1 1 -2  28  17 o 6  5.00809e+00 1.42079e+00 3.91219e+01 352.294 2.26820e+00  -3.06901e-01 0.00000e+00 0.00000e+00 9.85961e+01 352.294 5.94742e+01 352.294 0.7399 
1 1 1 -2  28  18 o 17 4.06102e+00 1.31409e+00 7.78937e+01 359.908 4.31316e+00  -6.93403e-03 0.00000e+00 0.00000e+00 5.39472e+01 359.908 2.39464e+01 179.908 0.8746 
1 1 1 -2  28  19 o 15 6.57577e+00 1.80701e+00 1.03937e+02 132.741 -4.90878e+00 5.31193e+00  0.00000e+00 0.00000e+00 1.22324e+02 132.741 1.83877e+01 132.741 0.9280 
1 1 1 -2  28  20 o 8  8.59003e+00 2.24983e+00 1.27212e+02 31.415  7.69399e+00  4.69921e+00  0.00000e+00 0.00000e+00 1.72671e+02 31.415  4.54589e+01 31.415  0.9428 
1 1 1 -2  29  1  o 15 2.67311e+01 4.13156e-01 4.86174e+02 3.532   1.02427e+01  6.32160e-01  0.00000e+00 0.00000e+00 4.67032e+02 3.532   1.91426e+01 183.532 0.9500 
1 1 1 -2  29  2  o 13 3.59532e+01 5.64175e-01 6.49184e+02 121.736 -9.09937e+00 1.47126e+01  0.00000e+00 0.00000e+00 6.60584e+02 121.736 1.13999e+01 121.736 0.9707 
1 1 1 -2  29  3  o 8  2.24060e+01 3.50246e-01 3.38482e+02 29.952  5.64023e+00  3.25005e+00  0.00000e+00 0.00000e+00 4.34665e+02 29.952  9.61828e+01 29.952  0.9196 
1 1 1 -2  29  4  o 5  2.30460e+01 3.57443e-01 3.03378e+02 222.890 -4.58902e+00 -4.26285e+00 0.00000e+00 0.00000e+00 4.88725e+02 222.890 1.85347e+02 222.890 0.9163 
1 1 1 -2  29  5  o 10 1.14389e+01 2.97045e-01 2.59743e+02 119.445 -1.55618e+00 2.75675e+00  0.00000e+00 0.00000e+00 9.26374e+01 119.445 1.67105e+02 299.445 0.8215 
1 1 1 -2  29  6  o 17 7.06324e+00 2.69956e-01 7.83403e+01 250.904 -2.38333e-01 -6.88424e-01 0.00000e+00 0.00000e+00 1.22165e+01 250.904 6.61239e+01 70.904  0.3420 
1 1 1 -2  29  7  o 14 2.67522e+01 4.08645e-01 3.30774e+02 308.287 7.27065e+00  -9.21051e+00 0.00000e+00 0.00000e+00 6.27780e+02 308.287 2.97006e+02 308.287 0.9564 
1 1 1 -2  29  8  o 7  1.09026e+01 2.94265e-01 1.88041e+02 75.866  8.81878e-01  3.50222e+00  0.00000e+00 0.00000e+00 1.57627e+02 75.866  3.04149e+01 255.866 0.8467 
1 1 1 -2  29  9  o 19 4.03854e+01 6.19667e-01 6.65506e+02 155.683 -5.39017e+01 2.43573e+01  0.00000e+00 0.00000e+00 8.32963e+02 155.683 1.67457e+02 155.683 0.9915 
1 1 1 -2  29  10 o 6  1.65116e+01 4.31923e-01 3.17379e+02 123.019 -8.63828e+00 1.32919e+01  0.00000e+00 0.00000e+00 2.80303e+02 123.019 3.70759e+01 303.019 0.9679 
1 1 1 -2  29  11 o 1  3.39620e+01 6.17561e-01 6.27979e+02 52.691  5.01605e+01  6.58232e+01  0.00000e+00 0.00000e+00 6.33495e+02 52.691  5.51594e+00 52.691  0.9939 
1 1 1 -2  29  12 o 11 8.47244e+00 4.34692e-01 2.18610e+02 170.835 -1.10678e+01 1.78566e+00  0.00000e+00 0.00000e+00 8.33009e+01 170.835 1.35309e+02 350.835 0.9543 
1 1 1 -2  29  13 o 11 3.35891e+00 7.20037e-01 1.27572e+02 335.435 2.78169e+00  -1.27150e+00 0.00000e+00 0.00000e+00 2.55346e+01 155.435 1.53106e+02 155.435 0.8142 
1 1 1 -2  29  14 o 1  1.02276e+01 9.34627e-01 2.01733e+02 278.708 2.76762e+00  -1.80689e+01 0.00000e+00 0.00000e+00 1.68928e+02 278.708 3.28052e+01 98.708  0.9723 
1 1 1 -2  29  15 o 1  5.91813e+00 1.13411e+00 1.23938e+02 132.464 -5.32916e+00 5.82316e+00  0.00000e+00 0.00000e+00 8.19772e+01 132.464 4.19605e+01 312.464 0.9343 
1 1 1 -2  29  16 o 5  5.96497e+00 1.36735e+00 1.13845e+02 27.334  6.29694e+00  3.25478e+00  0.00000e+00 0.00000e+00 9.17515e+01 27.334  2.20936e+01 207.334 0.9265 
1 1 1 -2  29  17 o 10 4.63427e+00 1.35602e+00 8.91909e+01 135.141 -3.40054e+00 3.38378e+00  0.00000e+00 0.00000e+00 6.38136e+01 135.141 2.53773e+01 315.142 0.8885 
1 1 1 -2  29  18 o 16 7.04495e+00 1.76594e+00 1.61965e+02 164.325 -1.05374e+01 2.95694e+00  0.00000e+00 0.00000e+00 8.72822e+01 164.325 7.46824e+01 344.325 0.9532 
1 1 1 -2  29  19 o 11 4.55768e+00 1.48836e+00 6.31138e+01 303.763 2.12897e+00  -3.18465e+00 0.00000e+00 0.00000e+00 8.16382e+01 303.763 1.85244e+01 303.763 0.8567 
1 1 1 -2  29  20 o 2  5.49165e+00 1.76343e+00 8.33158e+01 5.419   5.41683e+00  5.13843e-01  0.00000e+00 0.00000e+00 1.00234e+02 5.419   1.69182e+01 5.419   0.9027 
1 1 1 -2  30  1  o 2  1.62451e+01 3.00709e-01 3.08122e+02 62.691  1.73199e+00  3.35439e+00  0.00000e+00 0.00000e+00 2.12781e+02 62.691  9.53413e+01 242.691 0.8543 
1 1 1 -2  30  2  o 3  2.14244e+01 3.51943e-01 5.90027e+02 355.966 9.53967e+00  -6.72836e-01 0.00000e+00 0.00000e+00 1.70717e+02 355.966 4.19310e+02 175.966 0.9462 
1 1 1 -2  30  3  o 15 9.85693e+00 2.85576e-01 1.18503e+02 126.777 -5.44662e-01 7.28683e-01  0.00000e+00 0.00000e+00 3.44187e+01 126.777 8.40848e+01 306.777 0.4135 
1 1 1 -2  30  4  o 3  1.59384e+01 3.09383e-01 4.24222e+02 258.542 -1.18435e+00 -5.84311e+00 0.00000e+00 0.00000e+00 1.20853e+02 258.542 3.03369e+02 78.542  0.9118 
1 1 1 -2  30  5  o 13 2.02992e+01 3.29212e-01 4.00710e+02 169.841 -8.43148e+00 1.51081e+00  0.00000e+00 0.00000e+00 3.14497e+02 169.841 8.62135e+01 349.841 0.9397 
1 1 1 -2  30  6  o 1  2.77465e+01 4.16009e-01 4.88089e+02 92.360  -6.65428e-01 1.61429e+01  0.00000e+00 0.00000e+00 5.19118e+02 92.360  3.10296e+01 92.360  0.9685 
1 1 1 -2  30  7  o 2  1.26807e+01 3.67538e-01 2.44653e+02 356.309 4.08457e+00  -2.63484e-01 0.00000e+00 0.00000e+00 1.67210e+02 356.309 7.74435e+01 176.309 0.8670 
1 1 1 -2  30  8  o 9  1.90599e+01 3.60157e-01 2.65234e+02 314.741 6.10199e+00  -6.15738e+00 0.00000e+00 0.00000e+00 4.05878e+02 314.741 1.40644e+02 314.741 0.9404 
1 1 1 -2  30  9  o 17 4.45642e+01 6.75839e-01 7.50039e+02 185.564 -8.04965e+01 -7.84105e+00 0.00000e+00 0.00000e+00 9.07162e+02 185.564 1.57124e+02 185.564 0.9938 
1 1 1 -2  30  10 o 5  1.21490e+01 3.38817e-01 2.61281e+02 37.756  7.25126e+00  5.61564e+00  0.00000e+00 0.00000e+00 1.67490e+02 37.756  9.37911e+01 217.756 0.9438 
1 1 1 -2  30  11 o 14 2.98063e+01 5.10626e-01 5.19989e+02 264.355 -6.56323e+00 -6.64000e+01 0.00000e+00 0.00000e+00 5.85410e+02 264.355 6.54215e+01 264.355 0.9925 
1 1 1 -2  30  12 o 15 1.69510e+01 3.95916e-01 2.86554e+02 150.471 -2.56026e+01 1.45025e+01  0.00000e+00 0.00000e+00 3.35512e+02 150.471 4.89583e+01 150.471 0.9829 
1 1 1 -2  30  13 o 10 2.02767e+01 5.50785e-01 3.51071e+02 295.060 2.34056e+01  -5.00568e+01 0.00000e+00 0.00000e+00 3.98505e+02 295.060 4.74338e+01 295.060 0.9909 
1 1 1 -2  30  14 o 7  1.58847e+01 1.12328e+00 1.72712e+02 29.776  1.98457e+01  1.13549e+01  0.00000e+00 0.00000e+00 4.06255e+02 29.776  2.33543e+02 29.776  0.9779 
1 1 1 -2  30  15 o 4  9.41189e+00 1.09017e+00 2.01204e+02 188.655 -2.05240e+01 -3.12421e+00 0.00000e+00 0.00000e+00 1.40715e+02 188.655 6.04892e+01 8.655   0.9756 
1 1 1 -2  30  16 o 18 1.28621e+01 1.18578e+00 2.33257e+02 153.400 -3.03433e+01 1.51947e+01  0.00000e+00 0.00000e+00 2.38090e+02 153.400 4.83272e+00 153.400 0.9852 
1 1 1 -2  30  17 o 16 5.90858e+00 1.47020e+00 3.19283e+01 114.247 -8.39853e-01 1.86466e+00  0.00000e+00 0.00000e+00 1.22863e+02 114.247 9.09349e+01 114.247 0.7050 
1 1 1 -2  30  18 o 2  4.63357e+00 1.44938e+00 1.46769e+02 239.158 -4.07942e+00 -6.83193e+00 0.00000e+00 0.00000e+00 1.40061e+01 239.158 1.32763e+02 59.158  0.9349 
1 1 1 -2  30  19 o 4  4.78714e+00 1.56600e+00 9.70969e+01 103.768 -1.39669e+00 5.70011e+00  0.00000e+00 0.00000e+00 6.44400e+01 103.768 3.26569e+01 283.768 0.9103 
1 1 1 -2  30  20 o 5  4.76138e+00 1.61428e+00 9.96951e+01 322.194 5.09719e+00  -3.95459e+00 0.00000e+00 0.00000e+00 6.22802e+01 322.194 3.74150e+01 142.194 0.9188 
1 1 1 -2  31  1  o 15 1.58941e+01 2.99661e-01 7.16354e+01 260.875 -1.38307e-01 -8.61109e-01 0.00000e+00 0.00000e+00 1.66535e+02 260.875 9.48994e+01 260.875 0.3993 
1 1 1 -2  31  2  o 9  1.55770e+01 2.94515e-01 3.15752e+02 316.981 3.12661e+00  -2.91754e+00 0.00000e+00 0.00000e+00 1.94757e+02 316.981 1.20995e+02 136.981 0.8734 
1 1 1 -2  31  3  o 5  1.58438e+01 2.87349e-01 4.74203e+02 4.865   5.70813e+00  4.85839e-01  0.00000e+00 0.00000e+00 6.54709e+01 4.865   4.08732e+02 184.865 0.9079 
1 1 1 -2  31  4  o 17 8.38883e+00 2.57782e-01 5.07171e+01 36.343  3.27621e-01  2.41040e-01  0.00000e+00 0.00000e+00 1.19802e+01 36.343  3.87369e+01 216.343 0.1993 
1 1 1 -2  31  5  o 6  1.22748e+01 2.77791e-01 3.72980e+02 112.893 -1.85193e+00 4.38554e+00  0.00000e+00 0.00000e+00 3.54606e+01 112.893 3.37519e+02 292.893 0.8875 
1 1 1 -2  31  6  o 4  1.70459e+01 3.04161e-01 4.08778e+02 187.491 -8.18813e+00 -1.07664e+00 0.00000e+00 0.00000e+00 1.90012e+02 187.491 2.18766e+02 7.491   0.9373 
1 1 1 -2  31  7  o 16 2.59478e+01 4.01346e-01 4.94712e+02 161.670 -1.65572e+01 5.48525e+00  0.00000e+00 0.00000e+00 4.48963e+02 161.670 4.57490e+01 341.670 0.9709 
1 1 1 -2  31  8  o 17 3.10358e+01 4.96126e-01 5.56576e+02 199.845 -2.79088e+01 -1.00727e+01 0.00000e+00 0.00000e+00 5.85599e+02 199.845 2.90231e+01 199.845 0.9830 
1 1 1 -2  31  9  o 1  9.14997e+00 4.05065e-01 1.96753e+02 354.281 4.32442e+00  -4.33094e-01 0.00000e+00 0.00000e+00 1.03019e+02 354.281 9.37338e+01 174.281 0.8756 
1 1 1 -2  31  10 o 2  2.02827e+01 3.96725e-01 4.44842e+02 83.936  3.09050e+00  2.90908e+01  0.00000e+00 0.00000e+00 3.00474e+02 83.936  1.44368e+02 263.936 0.9828 
1 1 1 -2  31  11 o 3  5.79846e+00 6.94569e-01 1.58656e+02 178.363 -3.87330e+00 1.10669e-01  0.00000e+00 0.00000e+00 2.73479e+01 178.363 1.31309e+02 358.363 0.8585 
1 1 1 -2  31  12 o 18 1.44299e+01 5.01714e-01 2.73176e+02 318.032 1.68478e+01  -1.51527e+01 0.00000e+00 0.00000e+00 2.53537e+02 318.032 1.96399e+01 138.032 0.9777 
1 1 1 -2  31  13 o 15 2.64671e+00 6.85473e-01 5.96034e+01 134.093 -8.30155e-01 8.56853e-01  0.00000e+00 0.00000e+00 9.18903e+00 314.093 6.87924e+01 314.093 0.5106 
1 1 1 -2  31  14 o 7  4.42948e+00 1.15551e+00 1.63312e+02 205.714 -5.36065e+00 -2.58155e+00 0.00000e+00 0.00000e+00 1.28256e+01 25.714  1.76138e+02 25.714  0.9116 
1 1 1 -2  31  15 o 15 5.25939e+00 1.15943e+00 1.04005e+02 10.139  5.71083e+00  1.02129e+00  0.00000e+00 0.00000e+00 7.40312e+01 10.139  2.99741e+01 190.139 0.9092 
1 1 1 -2  31  16 o 14 3.65546e+00 1.11593e+00 1.03868e+02 15.542  4.77823e+00  1.32889e+00  0.00000e+00 0.00000e+00 1.74735e+01 15.542  8.63941e+01 195.542 0.8924 
1 1 1 -2  31  17 o 8  7.45979e+00 1.41126e+00 1.15732e+02 127.501 -6.24271e+00 8.13530e+00  0.00000e+00 0.00000e+00 1.47552e+02 127.501 3.18204e+01 127.501 0.9499 
1 1 1 -2  31  18 o 14 8.06055e+00 1.57476e+00 1.13946e+02 128.039 -6.34853e+00 8.11442e+00  0.00000e+00 0.00000e+00 1.70287e+02 128.039 5.63416e+01 128.039 0.9502 
1 1 1 -2  31  19 o 17 7.02450e+00 1.79342e+00 1.43161e+02 281.340 2.09527e+00  -1.04481e+01 0.00000e+00 0.00000e+00 1.04681e+02 281.340 3.84795e+01 101.340 0.9519 
1 1 1 -2  31  20 o 2  4.27636e+00 1.46617e+00 5.35790e+01 317.520 2.59216e+00  -2.37358e+00 0.00000e+00 0.00000e+00 7.96980e+01 317.520 2.61190e+01 317.520 0.8419 
1 1 1 -2  32  1  o 5  1.33478e+01 3.05371e-01 4.39098e+02 292.497 1.66934e+00  -4.03070e+00 0.00000e+00 0.00000e+00 2.16311e-01 112.497 4.39314e+02 112.497 0.8762 
1 1 1 -2  32  2  o 18 1.58460e+01 2.92788e-01 3.52984e+02 281.773 9.67579e-01  -4.64235e+00 0.00000e+00 0.00000e+00 1.74422e+02 281.773 1.78562e+02 101.773 0.8870 
1 1 1 -2  32  3  o 16 1.38109e+01 2.70249e-01 2.29894e+02 59.439  1.37435e+00  2.32749e+00  0.00000e+00 0.00000e+00 1.77004e+02 59.439  5.28899e+01 239.439 0.7854 
1 1 1 -2  32  4  o 12 6.92989e+00 2.42541e-01 1.94342e+02 76.799  2.79818e-01  1.19292e+00  0.00000e+00 0.00000e+00 5.90600e+01 256.799 2.53402e+02 256.799 0.5205 
1 1 1 -2  32  5  o 5  2.39951e+01 3.74003e-01 5.52106e+02 162.879 -1.52021e+01 4.68298e+00  0.00000e+00 0.00000e+00 3.18687e+02 162.879 2.33419e+02 342.879 0.9680 
1 1 1 -2  32  6  o 9  1.40767e+01 3.08984e-01 1.09093e+02 347.460 1.84409e+00  -4.10166e-01 0.00000e+00 0.00000e+00 2.48922e+02 347.460 1.39830e+02 347.460 0.6787 
1 1 1 -2  32  7  o 10 3.41960e+01 5.00459e-01 4.83644e+02 129.372 -1.66748e+01 2.03207e+01  0.00000e+00 0.00000e+00 7.72568e+02 129.372 2.88924e+02 129.372 0.9808 
1 1 1 -2  32  8  o 14 1.66753e+01 3.38529e-01 2.31841e+02 231.579 -4.13371e+00 -5.21145e+00 0.00000e+00 0.00000e+00 3.43350e+02 231.579 1.11509e+02 231.579 0.9214 
1 1 1 -2  32  9  o 1  8.24745e+00 3.36758e-01 1.24234e+02 121.991 -1.46460e+00 2.34471e+00  0.00000e+00 0.00000e+00 1.19821e+02 121.991 4.41316e+00 301.991 0.7910 
1 1 1 -2  32  10 o 6  2.25110e+01 4.56373e-01 3.85726e+02 292.370 1.03121e+01  -2.50559e+01 0.00000e+00 0.00000e+00 4.40231e+02 292.370 5.45052e+01 292.370 0.9814 
1 1 1 -2  32  11 o 2  2.25291e+01 4.82525e-01 3.51853e+02 96.965  -4.11629e+00 3.36923e+01  0.00000e+00 0.00000e+00 4.77358e+02 96.965  1.25505e+02 96.965  0.9852 
1 1 1 -2  32  12 o 4  2.55442e+01 4.70701e-01 4.36914e+02 332.129 5.73312e+01  -3.03183e+01 0.00000e+00 0.00000e+00 5.09309e+02 332.129 7.23950e+01 332.129 0.9923 
1 1 1 -2  32  13 o 14 4.75426e+00 6.01802e-01 1.04050e+02 265.088 -3.52110e-01 -4.09687e+00 0.00000e+00 0.00000e+00 4.98220e+01 265.088 5.42277e+01 85.088  0.8677 
1 1 1 -2  32  14 o 19 1.05541e+01 9.19161e-01 2.20538e+02 215.289 -1.85758e+01 -1.31469e+01 0.00000e+00 0.00000e+00 1.64032e+02 215.289 5.65058e+01 35.289  0.9778 
1 1 1 -2  32  15 o 15 6.09312e+00 1.20033e+00 4.70821e+01 44.294  2.03745e+00  1.98784e+00  0.00000e+00 0.00000e+00 1.33935e+02 44.294  8.68531e+01 44.294  0.7980 
1 1 1 -2  32  16 o 15 8.72263e+00 1.33006e+00 1.43263e+02 47.997  9.68378e+00  1.07537e+01  0.00000e+00 0.00000e+00 1.69732e+02 47.997  2.64690e+01 47.997  0.9648 
1 1 1 -2  32  17 o 2  4.41546e+00 1.34253e+00 6.38743e+01 139.021 -2.63207e+00 2.28630e+00  0.00000e+00 0.00000e+00 7.39843e+01 139.021 1.01101e+01 139.021 0.8404 
1 1 1 -2  32  18 o 9  7.28491e+00 1.72368e+00 1.52178e+02 26.749  1.01835e+01  5.13279e+00  0.00000e+00 0.00000e+00 1.06017e+02 26.749  4.61613e+01 206.749 0.9551 
1 1 1 -2  32  19 o 8  4.72899e+00 1.53756e+00 8.67602e+01 249.391 -1.83611e+00 -4.88245e+00 0.00000e+00 0.00000e+00 7.06663e+01 249.391 1.60939e+01 69.391  0.8982 
1 1 1 -2  32  20 o 5  5.40017e+00 1.83767e+00 1.35065e+02 59.579  4.42593e+00  7.53755e+00  0.00000e+00 0.00000e+00 5.30242e+01 59.579  8.20407e+01 239.579 0.9409 
1 1 1 -2  33  1  o 14 1.69259e+01 3.14214e-01 1.90892e+02 111.637 -1.01828e+00 2.56709e+00  0.00000e+00 0.00000e+00 3.11314e+02 111.637 1.20422e+02 111.637 0.7907 
1 1 1 -2  33  2  o 7  7.99303e+00 2.44018e-01 1.81633e+02 335.949 1.01873e+00  -4.54650e-01 0.00000e+00 0.00000e+00 3.59349e+01 155.949 2.17568e+02 155.949 0.4858 
1 1 1 -2  33  3  f 0  8.63560e+00 2.61909e-01 3.48315e+02 330.232 2.31852e+00  -1.32611e+00 0.00000e+00 0.00000e+00 9.48868e+01 150.232 4.43202e+02 150.232 0.7824 
1 1 1 -2  33  4  o 12 2.82278e+01 4.22523e-01 5.99010e+02 266.837 -8.35137e-01 -1.51138e+01 0.00000e+00 0.00000e+00 4.23911e+02 266.837 1.75099e+02 86.837  0.9664 
1 1 1 -2  33  5  o 16 2.73140e+01 4.12013e-01 3.58014e+02 15.035  1.04645e+01  2.81090e+00  0.00000e+00 0.00000e+00 6.17405e+02 15.035  2.59392e+02 15.035  0.9527 
1 1 1 -2  33  6  o 15 2.03916e+01 3.41081e-01 4.49342e+02 177.749 -1.19631e+01 4.70270e-01  0.00000e+00 0.00000e+00 2.82084e+02 177.749 1.67258e+02 357.749 0.9573 
1 1 1 -2  33  7  o 14 1.72434e+01 3.61891e-01 2.09945e+02 138.571 -4.21889e+00 3.72327e+00  0.00000e+00 0.00000e+00 3.75239e+02 138.571 1.65294e+02 138.571 0.9061 
1 1 1 -2  33  8  o 17 1.64243e+01 3.40536e-01 1.93574e+02 2.233   6.68608e+00  2.60728e-01  0.00000e+00 0.00000e+00 3.73206e+02 2.233   1.79632e+02 2.233   0.9219 
1 1 1 -2  33  9  o 19 1.47086e+01 3.49964e-01 2.06973e+02 318.401 6.11988e+00  -5.43329e+00 0.00000e+00 0.00000e+00 3.08461e+02 318.401 1.01488e+02 318.401 0.9367 
1 1 1 -2  33  10 o 19 2.46442e+01 4.44403e-01 3.62963e+02 97.787  -3.77147e+00 2.75785e+01  0.00000e+00 0.00000e+00 5.41643e+02 97.787  1.78680e+02 97.787  0.9819 
1 1 1 -2  33  11 o 5  2.29568e+01 4.50635e-01 4.08409e+02 280.532 7.58003e+00  -4.07695e+01 0.00000e+00 0.00000e+00 4.38793e+02 280.532 3.03836e+01 280.532 0.9879 
1 1 1 -2  33  12 o 15 7.86241e+00 3.74368e-01 1.61778e+02 112.890 -3.09590e+00 7.33248e+00  0.00000e+00 0.00000e+00 1.12603e+02 112.890 4.91756e+01 292.890 0.9349 
1 1 1 -2  33  13 o 1  1.57014e+01 4.19514e-01 2.80118e+02 112.746 -1.37180e+01 3.27199e+01  0.00000e+00 0.00000e+00 2.97179e+02 112.746 1.70612e+01 112.746 0.9858 
1 1 1 -2  33  14 o 13 2.31606e+00 6.88192e-01 7.57599e+01 115.941 -7.90772e-01 1.62556e+00  0.00000e+00 0.00000e+00 1.84953e+01 295.941 9.42552e+01 295.941 0.6635 
1 1 1 -2  33  15 o 1  4.83338e+00 1.24242e+00 8.56183e+01 359.928 4.33949e+00  -5.45273e-03 0.00000e+00 0.00000e+00 7.18970e+01 359.928 1.37213e+01 179.928 0.8754 
1 1 1 -2  33  16 o 5  3.30433e+00 1.06617e+00 9.50922e+01 155.568 -3.75277e+00 1.70484e+00  0.00000e+00 0.00000e+00 1.15770e+01 155.568 8.35153e+01 335.568 0.8680 
1 1 1 -2  33  17 o 1  4.42898e+00 1.31845e+00 4.73413e+01 235.820 -1.47603e+00 -2.17352e+00 0.00000e+00 0.00000e+00 8.06894e+01 235.820 3.33482e+01 235.820 0.7782 
1 1 1 -2  33  18 o 6  5.40831e+00 1.52617e+00 1.03870e+02 338.388 6.11566e+00  -2.42281e+00 0.00000e+00 0.00000e+00 8.08535e+01 338.388 2.30166e+01 158.388 0.9205 
1 1 1 -2  33  19 o 16 5.33321e+00 1.68092e+00 9.78855e+01 223.768 -4.34782e+00 -4.16478e+00 0.00000e+00 0.00000e+00 8.25078e+01 223.768 1.53777e+01 43.768  0.9127 
1 1 1 -2  33  20 o 1  3.53032e+00 1.27447e+00 3.78274e+01 292.722 9.91375e-01  -2.36741e+00 0.00000e+00 0.00000e+00 6.30562e+01 292.722 2.52288e+01 292.722 0.7721 
1 1 1 -2  34  1  f 0  1.91225e+01 3.36749e-01 2.69399e+02 177.755 -3.97939e+00 1.56016e-01  0.00000e+00 0.00000e+00 3.49695e+02 177.755 8.02962e+01 177.755 0.8628 
1 1 1 -2  34  2  o 12 2.83574e+01 4.27384e-01 6.12676e+02 288.490 4.70814e+00  -1.40797e+01 0.00000e+00 0.00000e+00 4.14676e+02 288.490 1.98001e+02 108.490 0.9657 
1 1 1 -2  34  3  o 18 6.07754e+00 2.46946e-01 5.58063e+01 213.024 -2.73140e-01 -1.77541e-01 0.00000e+00 0.00000e+00 1.91613e+01 33.024  7.49676e+01 33.024  0.1608 
1 1 1 -2  34  4  f 0  7.90909e+00 2.47798e-01 8.28069e+01 107.470 -2.08039e-01 6.61021e-01  0.00000e+00 0.00000e+00 1.42344e+01 107.470 6.85725e+01 287.470 0.3272 
1 1 1 -2  34  5  f 0  2.35259e+01 3.71296e-01 5.80200e+02 219.522 -1.38902e+01 -1.14591e+01 0.00000e+00 0.00000e+00 2.76751e+02 219.522 3.03449e+02 39.522  0.9718 
1 1 1 -2  34  6  o 8  2.25989e+01 3.66888e-01 5.40553e+02 123.828 -8.73588e+00 1.30357e+01  0.00000e+00 0.00000e+00 2.78704e+02 123.828 2.61850e+02 303.828 0.9676 
1 1 1 -2  34  7  o 18 2.31636e+01 4.28828e-01 1.28970e+02 7.247   4.57198e+00  5.81379e-01  0.00000e+00 0.00000e+00 6.37362e+02 7.247   5.08392e+02 7.247   0.8834 
1 1 1 -2  34  8  o 9  2.30553e+01 4.10359e-01 2.98045e+02 294.624 5.99654e+00  -1.30831e+01 0.00000e+00 0.00000e+00 5.34332e+02 294.624 2.36287e+02 294.624 0.9646 
1 1 1 -2  34  9  o 1  2.85220e+01 4.82279e-01 4.28307e+02 176.747 -3.18526e+01 1.81026e+00  0.00000e+00 0.00000e+00 6.21724e+02 176.747 1.93417e+02 176.747 0.9842 
1 1 1 -2  34  10 o 11 2.04225e+01 4.41716e-01 2.07987e+02 256.821 -3.10698e+00 -1.32686e+01 0.00000e+00 0.00000e+00 5.26861e+02 256.821 3.18875e+02 256.821 0.9626 
1 1 1 -2  34  11 o 11 2.21932e+01 4.45395e-01 4.18810e+02 70.561  1.43230e+01  4.05842e+01  0.00000e+00 0.00000e+00 4.00508e+02 70.561  1.83019e+01 250.561 0.9883 
1 1 1 -2  34  12 o 15 7.54553e+00 4.38969e-01 1.92053e+02 160.304 -8.45752e+00 3.02750e+00  0.00000e+00 0.00000e+00 7.34102e+01 160.304 1.18643e+02 340.304 0.9426 
1 1 1 -2  34  13 o 4  3.70940e+00 7.75391e-01 1.13622e+02 101.521 -6.93881e-01 3.40409e+00  0.00000e+00 0.00000e+00 2.54438e+00 101.521 1.11077e+02 281.521 0.8397 
1 1 1 -2  34  14 o 17 4.15446e+00 7.16476e-01 9.50820e+01 216.233 -3.40572e+00 -2.49561e+00 0.00000e+00 0.00000e+00 3.98286e+01 216.233 5.52534e+01 36.233  0.8716 
1 1 1 -2  34  15 o 13 5.03919e+00 1.24465e+00 1.04106e+02 289.109 1.79647e+00  -5.18538e+00 0.00000e+00 0.00000e+00 6.53851e+01 289.109 3.87213e+01 109.109 0.9036 
1 1 1 -2  34  16 o 10 5.84725e+00 1.40835e+00 1.25802e+02 353.348 7.97849e+00  -9.30518e-01 0.00000e+00 0.00000e+00 7.76068e+01 353.348 4.81956e+01 173.348 0.9355 
1 1 1 -2  34  17 o 18 1.09685e+01 1.49081e+00 1.96648e+02 237.930 -1.30913e+01 -2.08937e+01 0.00000e+00 0.00000e+00 2.02426e+02 237.930 5.77728e+00 237.930 0.9795 
1 1 1 -2  34  18 o 18 5.23190e+00 1.43992e+00 7.54197e+01 175.666 -4.93026e+00 3.73642e-01  0.00000e+00 0.00000e+00 9.77457e+01 175.666 2.23260e+01 175.666 0.8921 
1 1 1 -2  34  19 o 9  7.77038e+00 2.12541e+00 1.09712e+02 80.585  1.20906e+00  7.29166e+00  0.00000e+00 0.00000e+00 1.57982e+02 80.585  4.82693e+01 80.585  0.9297 
1 1 1 -2  35  1  o 9  9.59370e+00 2.64026e-01 1.84559e+02 41.215  1.14651e+00  1.00422e+00  0.00000e+00 0.00000e+00 3.21362e+01 41.215  1.52423e+02 221.215 0.6020 
1 1 1 -2  35  2  o 12 4.43429e+00 3.04117e-01 1.05615e+02 218.427 -3.26933e-01 -2.59374e-01 0.00000e+00 0.00000e+00 7.16414e+01 38.427  1.77257e+02 38.427  0.2042 
1 1 1 -2  35  3  o 4  1.53952e+01 2.89510e-01 3.02927e+02 236.887 -2.32352e+00 -3.56251e+00 0.00000e+00 0.00000e+00 2.00878e+02 236.887 1.02049e+02 56.887  0.8726 
1 1 1 -2  35  4  o 6  1.54348e+01 2.92028e-01 2.46099e+02 253.524 -1.12255e+00 -3.79557e+00 0.00000e+00 0.00000e+00 2.52659e+02 253.524 6.55969e+00 253.524 0.8619 
1 1 1 -2  35  5  o 10 1.47866e+01 2.88891e-01 3.51255e+02 1.338   6.79300e+00  1.58660e-01  0.00000e+00 0.00000e+00 1.60342e+02 1.338   1.90912e+02 181.338 0.9232 
1 1 1 -2  35  6  o 19 8.94859e+00 2.92923e-01 1.22785e+02 165.228 -1.35659e+00 3.57710e-01  0.00000e+00 0.00000e+00 6.87067e+01 165.228 5.40787e+01 345.228 0.5712 
1 1 1 -2  35  7  o 11 1.97774e+01 3.68964e-01 2.89886e+02 291.111 3.90839e+00  -1.01229e+01 0.00000e+00 0.00000e+00 4.15681e+02 291.111 1.25795e+02 291.111 0.9527 
1 1 1 -2  35  8  f 0  1.53507e+01 3.41241e-01 9.86241e+01 131.461 -2.19156e+00 2.48053e+00  0.00000e+00 0.00000e+00 3.78509e+02 131.461 2.79885e+02 131.461 0.8305 
1 1 1 -2  35  9  o 3  1.52013e+01 3.59110e-01 2.65793e+02 269.287 -1.38791e-01 -1.11512e+01 0.00000e+00 0.00000e+00 2.76647e+02 269.287 1.08538e+01 269.287 0.9541 
1 1 1 -2  35  10 o 3  3.51831e+00 6.29626e-01 6.43824e+01 172.481 -7.34077e-01 9.68943e-02  0.00000e+00 0.00000e+00 1.87540e+01 352.481 8.31364e+01 352.481 0.3470 
1 1 1 -2  35  11 o 3  1.64523e+01 4.09049e-01 3.32223e+02 111.961 -1.00195e+01 2.48484e+01  0.00000e+00 0.00000e+00 2.70700e+02 111.961 6.15230e+01 291.961 0.9812 
1 1 1 -2  35  12 o 16 9.82663e+00 3.87838e-01 2.45868e+02 24.410  1.39843e+01  6.34643e+00  0.00000e+00 0.00000e+00 1.08725e+02 24.410  1.37143e+02 204.410 0.9669 
1 1 1 -2  35  13 o 17 7.12306e+00 3.94660e-01 1.08835e+02 271.565 1.89814e-01  -6.94573e+00 0.00000e+00 0.00000e+00 1.36847e+02 271.565 2.80119e+01 271.565 0.9250 
1 1 1 -2  35  14 o 12 4.98466e+00 6.09343e-01 9.56170e+01 62.674  2.32005e+00  4.48997e+00  0.00000e+00 0.00000e+00 7.05216e+01 62.674  2.50954e+01 242.674 0.8946 
1 1 1 -2  35  15 f 0  1.12781e+01 1.02781e+00 3.06202e+02 301.850 2.02979e+01  -3.26737e+01 0.00000e+00 0.00000e+00 1.08077e+02 301.850 1.98125e+02 121.850 0.9869 
1 1 1 -2  35  16 o 7  6.39548e+00 1.36589e+00 1.04940e+02 88.747  1.63189e-01  7.46200e+00  0.00000e+00 0.00000e+00 1.16298e+02 88.747  1.13585e+01 88.747  0.9304 
1 1 1 -2  35  17 o 11 3.32312e+00 1.11347e+00 5.31860e+01 215.237 -1.98686e+00 -1.40352e+00 0.00000e+00 0.00000e+00 4.03035e+01 215.237 1.28825e+01 35.237  0.7575 
1 1 1 -2  35  18 o 12 4.34331e+00 1.38936e+00 7.95397e+01 135.416 -3.22316e+00 3.17666e+00  0.00000e+00 0.00000e+00 6.24286e+01 135.416 1.71112e+01 315.416 0.8811 
1 1 1 -2  35  19 o 13 4.65349e+00 1.57400e+00 7.86041e+01 121.417 -2.45934e+00 4.02640e+00  0.00000e+00 0.00000e+00 7.42381e+01 121.417 4.36601e+00 301.417 0.8864 
1 1 1 -2  36  1  o 7  7.96663e+00 3.19232e-01 3.74333e+01 20.932  2.49268e-01  9.53445e-02  0.00000e+00 0.00000e+00 2.09604e+00 20.932  3.53373e+01 200.932 0.1323 
1 1 1 -2  36  2  o 1  1.40927e+01 2.84361e-01 1.87248e+02 182.144 -2.53842e+00 -9.50435e-02 0.00000e+00 0.00000e+00 2.19394e+02 182.144 3.21465e+01 182.144 0.7693 
1 1 1 -2  36  3  o 8  9.59043e+00 2.56094e-01 1.51120e+02 96.911  -1.56616e-01 1.29216e+00  0.00000e+00 0.00000e+00 4.42081e+01 96.911  1.06912e+02 276.911 0.5431 
1 1 1 -2  36  4  o 1  1.83777e+01 3.20332e-01 6.47040e+02 290.633 5.03937e+00  -1.33839e+01 0.00000e+00 0.00000e+00 1.73609e+01 290.633 6.29680e+02 110.633 0.9644 
1 1 1 -2  36  5  o 13 1.60593e+01 3.02139e-01 3.88777e+02 131.628 -4.91903e+00 5.53500e+00  0.00000e+00 0.00000e+00 1.70791e+02 131.628 2.17985e+02 311.628 0.9298 
1 1 1 -2  36  6  o 5  1.95884e+01 3.40748e-01 2.30343e+02 212.863 -5.00596e+00 -3.23391e+00 0.00000e+00 0.00000e+00 4.38648e+02 212.863 2.08305e+02 212.863 0.9117 
1 1 1 -2  36  7  o 16 1.36624e+01 2.99771e-01 1.65410e+02 117.072 -1.81327e+00 3.54774e+00  0.00000e+00 0.00000e+00 2.76001e+02 117.072 1.10591e+02 117.072 0.8629 
1 1 1 -2  36  8  o 4  1.95763e+01 3.78844e-01 2.03704e+02 295.497 3.73235e+00  -7.82617e+00 0.00000e+00 0.00000e+00 4.85222e+02 295.497 2.81519e+02 295.497 0.9404 
1 1 1 -2  36  9  o 1  2.47676e+01 4.41353e-01 4.45326e+02 229.702 -2.00689e+01 -2.36658e+01 0.00000e+00 0.00000e+00 4.65898e+02 229.702 2.05720e+01 229.702 0.9838 
1 1 1 -2  36  10 f 0  1.44418e+01 4.04979e-01 1.65936e+02 49.532  5.57378e+00  6.53342e+00  0.00000e+00 0.00000e+00 3.41335e+02 49.532  1.75399e+02 49.532  0.9398 
1 1 1 -2  36  11 o 19 3.02560e+01 5.41664e-01 5.63151e+02 53.663  4.77750e+01  6.49510e+01  0.00000e+00 0.00000e+00 5.59786e+02 53.663  3.36523e+00 233.663 0.9938 
1 1 1 -2  36  12 o 4  2.53549e+01 4.88427e-01 5.47903e+02 333.675 8.60628e+01  -4.25809e+01 0.00000e+00 0.00000e+00 3.93343e+02 333.675 1.54560e+02 153.675 0.9948 
1 1 1 -2  36  13 o 7  3.16616e+00 6.87759e-01 7.76386e+01 95.566  -2.02391e-01 2.07672e+00  0.00000e+00 0.00000e+00 6.35523e+00 95.566  7.12834e+01 275.566 0.7115 
1 1 1 -2  36  14 o 11 1.39282e+01 4.20996e-01 2.29757e+02 260.467 -5.83055e+00 -3.47192e+01 0.00000e+00 0.00000e+00 2.81677e+02 260.467 5.19204e+01 260.467 0.9857 
1 1 1 -2  36  15 o 18 1.07343e+01 5.20007e-01 2.16378e+02 163.227 -3.17490e+01 9.56923e+00  0.00000e+00 0.00000e+00 1.77042e+02 163.227 3.93358e+01 343.227 0.9848 
1 1 1 -2  36  16 o 17 6.72894e+00 1.16980e+00 1.36477e+02 19.931  1.07476e+01  3.89714e+00  0.00000e+00 0.00000e+00 1.02487e+02 19.931  3.39904e+01 199.931 0.9552 
1 1 1 -2  36  17 o 19 5.71261e+00 1.48510e+00 1.45179e+02 249.266 -3.42891e+00 -9.05817e+00 0.00000e+00 0.00000e+00 5.57034e+01 249.266 8.94760e+01 69.266  0.9469 
1 1 1 -2  36  18 o 10 6.58198e+00 1.86366e+00 1.37249e+02 97.868  -1.18807e+00 8.59692e+00  0.00000e+00 0.00000e+00 9.23797e+01 97.868  4.48691e+01 277.868 0.9405 
1 1 1 -2  36  19 o 17 5.70905e+00 1.84218e+00 1.20845e+02 191.411 -7.37988e+00 -1.48953e+00 0.00000e+00 0.00000e+00 7.60815e+01 191.411 4.47631e+01 11.411  0.9310 
1 1 1 -2  37  1  o 8  1.58621e+01 3.81103e-01 3.53789e+02 221.206 -3.70129e+00 -3.24091e+00 0.00000e+00 0.00000e+00 1.76640e+02 221.206 1.77149e+02 41.206  0.8915 
1 1 1 -2  37  2  o 12 1.14550e+01 2.69489e-01 2.93297e+02 262.674 -4.05187e-01 -3.15149e+00 0.00000e+00 0.00000e+00 5.99657e+01 262.674 2.33332e+02 82.674  0.8223 
1 1 1 -2  37  3  o 10 1.50835e+01 2.91935e-01 3.24705e+02 294.381 2.13840e+00  -4.71821e+00 0.00000e+00 0.00000e+00 1.82828e+02 294.381 1.41877e+02 114.381 0.8974 
1 1 1 -2  37  4  o 16 3.98872e+01 5.68244e-01 7.39675e+02 135.367 -2.31789e+01 2.28835e+01  0.00000e+00 0.00000e+00 7.32336e+02 135.367 7.33894e+00 315.367 0.9845 
1 1 1 -2  37  5  o 18 1.90207e+01 3.32658e-01 4.15059e+02 48.688  6.40543e+00  7.28806e+00  0.00000e+00 0.00000e+00 2.59871e+02 48.688  1.55188e+02 228.688 0.9470 
1 1 1 -2  37  6  o 19 3.96182e+01 5.67505e-01 5.70397e+02 298.357 1.45182e+01  -2.68991e+01 0.00000e+00 0.00000e+00 8.89037e+02 298.357 3.18639e+02 298.357 0.9835 
1 1 1 -2  37  7  o 15 1.02556e+01 3.07958e-01 1.45798e+02 206.036 -2.30580e+00 -1.12642e+00 0.00000e+00 0.00000e+00 1.50612e+02 206.036 4.81355e+00 206.036 0.7720 
1 1 1 -2  37  8  o 17 2.63046e+01 4.51822e-01 6.09226e+02 282.609 7.75631e+00  -3.46752e+01 0.00000e+00 0.00000e+00 3.61070e+02 282.609 2.48157e+02 102.609 0.9858 
1 1 1 -2  37  9  o 15 1.62906e+01 3.76209e-01 3.83004e+02 99.078  -2.99712e+00 1.87586e+01  0.00000e+00 0.00000e+00 2.09924e+02 99.078  1.73080e+02 279.078 0.9733 
1 1 1 -2  37  10 o 10 2.44112e+01 4.57800e-01 3.39321e+02 87.823  1.09146e+00  2.87141e+01  0.00000e+00 0.00000e+00 5.56913e+02 87.823  2.17592e+02 87.823  0.9824 
1 1 1 -2  37  11 o 2  1.91200e+01 4.44643e-01 1.71243e+02 342.584 1.48463e+01  -4.65699e+00 0.00000e+00 0.00000e+00 5.19418e+02 342.584 3.48175e+02 342.584 0.9673 
1 1 1 -2  37  12 o 18 1.08676e+01 4.37546e-01 2.52760e+02 141.406 -1.54346e+01 1.23185e+01  0.00000e+00 0.00000e+00 1.42348e+02 141.406 1.10413e+02 321.406 0.9743 
1 1 1 -2  37  13 o 18 1.17342e+01 4.25695e-01 2.34657e+02 25.533  2.32899e+01  1.11254e+01  0.00000e+00 0.00000e+00 1.94262e+02 25.533  4.03952e+01 205.533 0.9804 
1 1 1 -2  37  14 o 19 7.16490e+00 5.86953e-01 1.64363e+02 193.575 -1.28710e+01 -3.10787e+00 0.00000e+00 0.00000e+00 9.22352e+01 193.575 7.21278e+01 13.575  0.9615 
1 1 1 -2  37  15 o 2  8.55133e+00 5.67452e-01 1.43494e+02 106.018 -4.79612e+00 1.67058e+01  0.00000e+00 0.00000e+00 1.65429e+02 106.018 2.19347e+01 106.018 0.9708 
1 1 1 -2  37  16 o 19 4.23073e+00 1.27208e+00 1.03397e+02 236.509 -2.84201e+00 -4.29532e+00 0.00000e+00 0.00000e+00 3.76408e+01 236.509 6.57558e+01 56.509  0.8968 
1 1 1 -2  37  17 o 16 6.86793e+00 1.71448e+00 1.43659e+02 336.524 9.35724e+00  -4.06398e+00 0.00000e+00 0.00000e+00 9.85326e+01 336.524 4.51266e+01 156.524 0.9496 
1 1 1 -2  37  18 o 11 5.61783e+00 1.72856e+00 4.33691e+01 137.568 -1.94008e+00 1.77354e+00  0.00000e+00 0.00000e+00 1.18805e+02 137.568 7.54355e+01 137.568 0.7783 
1 1 1 -2  37  19 o 10 4.92184e+00 1.64244e+00 1.02029e+02 109.691 -2.17972e+00 6.09085e+00  0.00000e+00 0.00000e+00 6.55531e+01 109.691 3.64759e+01 289.691 0.9191 
1 1 1 -2  38  1  o 5  7.54223e+00 2.94024e-01 2.02016e+02 211.126 -1.23658e+00 -7.46710e-01 0.00000e+00 0.00000e+00 3.73431e+01 31.126  2.39359e+02 31.126  0.5821 
1 1 1 -2  38  2  o 15 2.17386e+01 3.60222e-01 6.13401e+02 30.243  1.03390e+01  6.02773e+00  0.00000e+00 0.00000e+00 1.66963e+02 30.243  4.46437e+02 210.243 0.9573 
1 1 1 -2  38  3  o 13 2.30894e+01 3.71546e-01 3.78919e+02 312.240 6.11597e+00  -6.73555e+00 0.00000e+00 0.00000e+00 4.37679e+02 312.240 5.87599e+01 312.240 0.9433 
1 1 1 -2  38  4  o 16 1.42229e+01 3.17733e-01 1.92969e+02 77.103  8.07518e-01  3.52671e+00  0.00000e+00 0.00000e+00 2.58568e+02 77.103  6.55994e+01 77.103  0.8470 
1 1 1 -2  38  5  o 10 3.19333e+01 4.74134e-01 6.68218e+02 55.785  1.56122e+01  2.29597e+01  0.00000e+00 0.00000e+00 5.06484e+02 55.785  1.61734e+02 235.785 0.9818 
1 1 1 -2  38  6  o 14 1.45771e+01 3.04743e-01 3.58571e+02 205.348 -7.52945e+00 -3.56695e+00 0.00000e+00 0.00000e+00 1.53468e+02 205.348 2.05103e+02 25.348  0.9379 
1 1 1 -2  38  7  o 12 2.61552e+01 4.19772e-01 4.67303e+02 171.536 -2.07965e+01 3.09471e+00  0.00000e+00 0.00000e+00 4.88204e+02 171.536 2.09017e+01 171.536 0.9759 
1 1 1 -2  38  8  o 3  2.85138e+01 4.77307e-01 3.91929e+02 171.658 -2.70094e+01 3.96051e+00  0.00000e+00 0.00000e+00 6.55144e+02 171.658 2.63215e+02 171.658 0.9815 
1 1 1 -2  38  9  o 19 2.52056e+01 4.53319e-01 4.94432e+02 12.662  3.50621e+01  7.87745e+00  0.00000e+00 0.00000e+00 4.34824e+02 12.662  5.96083e+01 192.662 0.9860 
1 1 1 -2  38  10 o 8  7.48945e+00 4.47292e-01 1.62896e+02 38.936  3.74071e+00  3.02223e+00  0.00000e+00 0.00000e+00 8.58256e+01 38.936  7.70702e+01 218.936 0.8888 
1 1 1 -2  38  11 o 11 6.76211e+00 5.13676e-01 2.48356e+01 182.590 -8.50769e-01 -3.84779e-02 0.00000e+00 0.00000e+00 7.39807e+01 182.590 4.91451e+01 182.590 0.3914 
1 1 1 -2  38  12 o 7  1.85741e+01 4.44577e-01 2.39635e+02 281.900 6.96096e+00  -3.30308e+01 0.00000e+00 0.00000e+00 4.43021e+02 281.900 2.03386e+02 281.900 0.9851 
1 1 1 -2  38  13 o 11 1.85145e+01 4.47627e-01 3.05379e+02 241.407 -2.52374e+01 -4.63022e+01 0.00000e+00 0.00000e+00 3.78237e+02 241.407 7.28578e+01 241.407 0.9905 
1 1 1 -2  38  14 o 6  1.68988e+01 4.13816e-01 2.24596e+02 228.496 -2.73977e+01 -3.09626e+01 0.00000e+00 0.00000e+00 3.97139e+02 228.496 1.72543e+02 228.496 0.9878 
1 1 1 -2  38  15 o 18 3.40624e+00 8.37894e-01 4.07846e+01 133.529 -1.27566e+00 1.34291e+00  0.00000e+00 0.00000e+00 4.43798e+01 133.529 3.59526e+00 133.529 0.6720 
1 1 1 -2  38  16 o 14 5.07963e+00 1.30893e+00 6.57711e+01 222.894 -2.81801e+00 -2.61814e+00 0.00000e+00 0.00000e+00 9.61079e+01 222.894 3.03368e+01 222.894 0.8574 
1 1 1 -2  38  17 o 5  8.36740e+00 1.59933e+00 1.41194e+02 147.186 -1.06669e+01 6.87801e+00  0.00000e+00 0.00000e+00 1.56987e+02 147.186 1.57935e+01 147.186 0.9598 
1 1 1 -2  38  18 o 19 1.01924e+01 2.18705e+00 1.78190e+02 33.730  1.19506e+01  7.97908e+00  0.00000e+00 0.00000e+00 1.86423e+02 33.730  8.23298e+00 33.730  0.9646 
1 1 1 -2  38  19 o 17 5.16909e+00 1.71003e+00 7.86799e+01 116.127 -2.18696e+00 4.45884e+00  0.00000e+00 0.00000e+00 9.22312e+01 116.127 1.35513e+01 116.127 0.8926 
1 1 1 -2  39  1  o 7  1.21063e+01 3.16899e-01 2.88210e+02 111.788 -1.16530e+00 2.91521e+00  0.00000e+00 0.00000e+00 8.39907e+01 111.788 2.04219e+02 291.788 0.8198 
1 1 1 -2  39  2  o 1  8.52409e+00 2.67690e-01 2.46046e+02 324.214 1.79932e+00  -1.29702e+00 0.00000e+00 0.00000e+00 1.25552e+01 144.214 2.58601e+02 144.214 0.7305 
1 1 1 -2  39  3  o 10 1.26210e+01 3.37770e-01 1.24824e+02 302.237 1.00846e+00  -1.59910e+00 0.00000e+00 0.00000e+00 1.96409e+02 302.237 7.15853e+01 302.237 0.6790 
1 1 1 -2  39  4  f 0  4.58242e+01 6.44462e-01 8.19687e+02 31.421  3.80102e+01  2.32210e+01  0.00000e+00 0.00000e+00 8.78254e+02 31.421  5.85678e+01 31.421  0.9887 
1 1 1 -2  39  5  o 19 3.32387e+01 4.91217e-01 6.51938e+02 358.990 2.76860e+01  -4.88055e-01 0.00000e+00 0.00000e+00 5.70591e+02 358.990 8.13464e+01 178.990 0.9818 
1 1 1 -2  39  6  o 3  4.27995e+01 6.09052e-01 6.07442e+02 227.206 -2.71912e+01 -2.93700e+01 0.00000e+00 0.00000e+00 9.75142e+02 227.206 3.67700e+02 227.206 0.9874 
1 1 1 -2  39  7  o 1  2.71976e+01 4.31110e-01 5.31964e+02 308.852 1.90933e+01  -2.37036e+01 0.00000e+00 0.00000e+00 4.69168e+02 308.852 6.27959e+01 128.852 0.9834 
1 1 1 -2  39  8  o 9  2.13948e+01 4.04196e-01 5.72286e+02 356.673 2.94661e+01  -1.71272e+00 0.00000e+00 0.00000e+00 2.14405e+02 356.673 3.57881e+02 176.673 0.9829 
1 1 1 -2  39  9  o 2  1.39010e+01 3.73792e-01 1.32295e+02 218.520 -4.14429e+00 -3.29887e+00 0.00000e+00 0.00000e+00 3.35368e+02 218.520 2.03073e+02 218.520 0.8998 
1 1 1 -2  39  10 o 10 1.29037e+01 3.95669e-01 2.66312e+02 9.884   1.33373e+01  2.32392e+00  0.00000e+00 0.00000e+00 1.97639e+02 9.884   6.86734e+01 189.884 0.9623 
1 1 1 -2  39  11 o 3  1.10865e+01 4.88423e-01 1.25285e+02 182.391 -7.57577e+00 -3.16369e-01 0.00000e+00 0.00000e+00 2.60286e+02 182.391 1.35001e+02 182.391 0.9315 
1 1 1 -2  39  12 o 7  9.11600e+00 4.45529e-01 1.45216e+02 291.442 3.68719e+00  -9.38841e+00 0.00000e+00 0.00000e+00 1.77541e+02 291.442 3.23250e+01 291.442 0.9491 
1 1 1 -2  39  13 o 16 2.33524e+01 4.94041e-01 4.03118e+02 211.928 -7.38710e+01 -4.60303e+01 0.00000e+00 0.00000e+00 4.62317e+02 211.928 5.91994e+01 211.928 0.9942 
1 1 1 -2  39  14 o 13 9.62789e+00 4.07003e-01 1.64003e+02 78.264  3.81592e+00  1.83689e+01  0.00000e+00 0.00000e+00 1.84857e+02 78.264  2.08545e+01 78.264  0.9730 
1 1 1 -2  39  15 o 3  7.68814e+00 6.04973e-01 1.49033e+02 194.620 -1.52669e+01 -3.98242e+00 0.00000e+00 0.00000e+00 1.27785e+02 194.620 2.12478e+01 14.620  0.9678 
1 1 1 -2  39  16 o 11 8.62303e+00 1.45125e+00 1.52708e+02 44.562  1.02592e+01  1.01036e+01  0.00000e+00 0.00000e+00 1.56444e+02 44.562  3.73602e+00 44.562  0.9646 
1 1 1 -2  39  17 o 17 5.57397e+00 1.63071e+00 5.76286e+01 75.594  8.52782e-01  3.31990e+00  0.00000e+00 0.00000e+00 1.15629e+02 75.594  5.80008e+01 75.594  0.8372 
1 1 1 -2  39  18 o 17 5.58997e+00 1.72050e+00 1.28361e+02 301.946 4.15068e+00  -6.65651e+00 0.00000e+00 0.00000e+00 6.52329e+01 301.946 6.31277e+01 121.946 0.9339 
1 1 1 -2  39  19 f 0  4.87023e+00 1.66755e+00 9.38623e+01 190.512 -5.78812e+00 -1.07405e+00 0.00000e+00 0.00000e+00 7.03917e+01 190.512 2.34706e+01 10.512  0.9106 
1 1 1 -2  40  1  o 16 1.23390e+01 3.18484e-01 2.10547e+02 56.258  1.52744e+00  2.28666e+00  0.00000e+00 0.00000e+00 1.54819e+02 56.258  5.57279e+01 236.258 0.7896 
1 1 1 -2  40  2  f 0  2.88165e+01 4.38963e-01 4.52833e+02 305.905 7.94076e+00  -1.09678e+01 0.00000e+00 0.00000e+00 5.86868e+02 305.905 1.34036e+02 305.905 0.9623 
1 1 1 -2  40  3  o 10 1.01645e+01 3.06992e-01 2.52787e+02 62.371  1.31830e+00  2.51854e+00  0.00000e+00 0.00000e+00 5.11162e+01 62.371  2.01671e+02 242.371 0.7976 
1 1 1 -2  40  4  o 11 2.60608e+01 4.08538e-01 6.48830e+02 182.782 -1.99261e+01 -9.68372e-01 0.00000e+00 0.00000e+00 3.02931e+02 182.782 3.45900e+02 2.782   0.9746 
1 1 1 -2  40  5  o 17 1.69950e+01 3.22138e-01 1.74020e+02 203.820 -3.58745e+00 -1.58373e+00 0.00000e+00 0.00000e+00 3.73747e+02 203.820 1.99728e+02 203.820 0.8604 
1 1 1 -2  40  6  o 9  1.58240e+01 3.18886e-01 3.04376e+02 99.963  -1.58314e+00 9.01223e+00  0.00000e+00 0.00000e+00 2.54750e+02 99.963  4.96259e+01 279.963 0.9437 
1 1 1 -2  40  7  f 0  1.89158e+01 3.54275e-01 5.39938e+02 147.240 -1.80436e+01 1.16104e+01  0.00000e+00 0.00000e+00 1.51299e+02 147.240 3.88639e+02 327.240 0.9764 
1 1 1 -2  40  8  o 14 2.80274e+01 4.51638e-01 4.83697e+02 224.285 -2.60042e+01 -2.53635e+01 0.00000e+00 0.00000e+00 5.50148e+02 224.285 6.64503e+01 224.285 0.9861 
1 1 1 -2  40  9  o 3  4.13818e+01 6.47461e-01 6.68219e+02 279.133 1.39717e+01  -8.69074e+01 0.00000e+00 0.00000e+00 8.69942e+02 279.133 2.01724e+02 279.133 0.9943 
1 1 1 -2  40  10 f 0  7.05907e+00 4.73136e-01 1.31799e+02 312.770 2.72115e+00  -2.94162e+00 0.00000e+00 0.00000e+00 9.59974e+01 312.770 3.58019e+01 132.770 0.8638 
1 1 1 -2  40  11 o 19 2.02275e+01 4.58360e-01 3.74922e+02 54.644  2.64455e+01  3.72732e+01  0.00000e+00 0.00000e+00 3.71891e+02 54.644  3.03097e+00 234.644 0.9890 
1 1 1 -2  40  12 o 10 2.18731e+01 4.79190e-01 4.42819e+02 234.878 -4.14071e+01 -5.88687e+01 0.00000e+00 0.00000e+00 3.67404e+02 234.878 7.54148e+01 54.878  0.9930 
1 1 1 -2  40  13 o 7  7.25190e+00 4.78332e-01 1.24574e+02 134.561 -6.21276e+00 6.30879e+00  0.00000e+00 0.00000e+00 1.29955e+02 134.561 5.38101e+00 134.561 0.9417 
1 1 1 -2  40  14 f 0  4.16674e+00 7.21577e-01 1.53239e+02 181.309 -7.37128e+00 -1.68373e-01 0.00000e+00 0.00000e+00 9.02447e+00 1.309   1.62263e+02 1.309   0.9295 
1 1 1 -2  40  15 o 11 6.05750e+00 7.38644e-01 1.10115e+02 321.684 7.13063e+00  -5.63458e+00 0.00000e+00 0.00000e+00 1.02444e+02 321.684 7.67072e+00 141.684 0.9433 
1 1 1 -2  40  16 o 18 5.27281e+00 1.41943e+00 6.81899e+01 168.759 -3.73610e+00 7.42533e-01  0.00000e+00 0.00000e+00 9.94980e+01 168.759 3.13080e+01 168.759 0.8558 
1 1 1 -2  40  17 o 13 6.80283e+00 1.80671e+00 8.61539e+01 50.154  3.43514e+00  4.11633e+00  0.00000e+00 0.00000e+00 1.41416e+02 50.154  5.52624e+01 50.154  0.9011 
1 1 1 -2  40  18 o 9  7.10266e+00 1.98831e+00 1.85479e+02 283.589 2.88192e+00  -1.19223e+01 0.00000e+00 0.00000e+00 6.69088e+01 283.589 1.18571e+02 103.589 0.9583 
1 1 1 -2  40  19 o 12 5.22800e+00 1.85823e+00 8.42438e+01 25.009  4.43670e+00  2.06974e+00  0.00000e+00 0.00000e+00 8.82511e+01 25.009  4.00739e+00 25.009  0.8909 
1 1 1 -2  41  1  o 12 2.25779e+01 4.39486e-01 2.86453e+02 263.818 -7.23376e-01 -6.67886e+00 0.00000e+00 0.00000e+00 4.94268e+02 263.818 2.07815e+02 263.818 0.9222 
1 1 1 -2  41  2  o 4  2.38273e+01 3.84419e-01 5.37821e+02 201.560 -1.42680e+01 -5.63754e+00 0.00000e+00 0.00000e+00 3.25794e+02 201.560 2.12028e+02 21.560  0.9668 
1 1 1 -2  41  3  o 7  1.96459e+01 3.92208e-01 4.43804e+02 179.391 -1.14394e+01 1.21688e-01  0.00000e+00 0.00000e+00 2.59553e+02 179.391 1.84252e+02 359.391 0.9552 
1 1 1 -2  41  4  o 13 2.01696e+01 3.49409e-01 3.22477e+02 301.415 4.14928e+00  -6.79363e+00 0.00000e+00 0.00000e+00 3.84046e+02 301.415 6.15696e+01 301.415 0.9349 
1 1 1 -2  41  5  o 16 3.45773e+01 5.09568e-01 7.23202e+02 290.694 1.20009e+01  -3.17689e+01 0.00000e+00 0.00000e+00 5.52674e+02 290.694 1.70528e+02 110.694 0.9852 
1 1 1 -2  41  6  o 11 2.13421e+01 3.97203e-01 4.19223e+02 93.257  -8.95559e-01 1.57370e+01  0.00000e+00 0.00000e+00 3.54033e+02 93.257  6.51896e+01 273.257 0.9677 
1 1 1 -2  41  7  f 0  1.60408e+01 3.56407e-01 8.85790e+01 158.910 -2.89893e+00 1.11803e+00  0.00000e+00 0.00000e+00 4.02201e+02 158.910 3.13621e+02 158.910 0.8176 
1 1 1 -2  41  8  o 1  1.76271e+01 3.66004e-01 2.75364e+02 327.181 1.07054e+01  -6.90426e+00 0.00000e+00 0.00000e+00 3.57480e+02 327.181 8.21164e+01 327.181 0.9599 
1 1 1 -2  41  9  o 4  2.03995e+01 4.13763e-01 4.09702e+02 334.709 2.35502e+01  -1.11275e+01 0.00000e+00 0.00000e+00 3.38025e+02 334.709 7.16763e+01 154.709 0.9806 
1 1 1 -2  41  10 o 10 3.91306e+00 6.77921e-01 1.25688e+02 0.907   2.06792e+00  3.27376e-02  0.00000e+00 0.00000e+00 2.21042e+01 180.907 1.47792e+02 180.907 0.7087 
1 1 1 -2  41  11 o 4  1.73256e+01 4.47171e-01 1.61027e+02 64.766  6.87427e+00  1.45859e+01  0.00000e+00 0.00000e+00 4.65303e+02 64.766  3.04276e+02 64.766  0.9685 
1 1 1 -2  41  12 o 9  2.13432e+01 4.82405e-01 4.10809e+02 206.802 -6.13731e+01 -3.10046e+01 0.00000e+00 0.00000e+00 3.79436e+02 206.802 3.13730e+01 26.802  0.9927 
1 1 1 -2  41  13 o 12 1.74542e+01 6.55499e-01 3.31920e+02 69.279  1.95967e+01  5.18027e+01  0.00000e+00 0.00000e+00 3.12638e+02 69.279  1.92820e+01 249.279 0.9909 
1 1 1 -2  41  14 o 15 8.85241e+00 4.46615e-01 1.82438e+02 36.955  1.69438e+01  1.27473e+01  0.00000e+00 0.00000e+00 1.39293e+02 36.955  4.31446e+01 216.955 0.9761 
1 1 1 -2  41  15 o 12 8.67486e+00 6.18620e-01 6.50614e+01 2.310   8.49805e+00  3.42772e-01  0.00000e+00 0.00000e+00 2.38005e+02 2.310   1.72944e+02 2.310   0.9392 
1 1 1 -2  41  16 o 2  7.09143e+00 6.43747e-01 1.12409e+02 121.438 -7.28826e+00 1.19222e+01  0.00000e+00 0.00000e+00 1.41487e+02 121.438 2.90775e+01 121.438 0.9635 
1 1 1 -2  41  17 o 19 8.71007e+00 1.86436e+00 1.86543e+02 296.987 6.50232e+00  -1.27689e+01 0.00000e+00 0.00000e+00 1.25265e+02 296.987 6.12785e+01 116.987 0.9644 
1 1 1 -2  41  18 o 9  5.21836e+00 1.65381e+00 4.60732e+01 87.140  1.41270e-01  2.82787e+00  0.00000e+00 0.00000e+00 1.08067e+02 87.140  6.19942e+01 87.140  0.7967 
1 1 1 -2  41  19 o 5  4.48117e+00 1.60681e+00 1.12924e+01 332.271 5.76898e-01  -3.03250e-01 0.00000e+00 0.00000e+00 4.01013e+01 332.271 2.88089e+01 332.271 0.3097 
1 1 1 -2  42  1  o 5  1.26108e+01 2.88362e-01 3.06843e+02 174.389 -4.61976e+00 4.53848e-01  0.00000e+00 0.00000e+00 1.11265e+02 174.389 1.95577e+02 354.389 0.8844 
1 1 1 -2  42  2  o 12 4.90194e+01 6.87059e-01 9.38404e+02 249.870 -1.73434e+01 -4.73171e+01 0.00000e+00 0.00000e+00 8.80706e+02 249.870 5.76978e+01 69.870  0.9900 
1 1 1 -2  42  3  o 16 3.20661e+01 5.50420e-01 2.93007e+02 25.778  1.00169e+01  4.83767e+00  0.00000e+00 0.00000e+00 8.53315e+02 25.778  5.60308e+02 25.778  0.9539 
1 1 1 -2  42  4  f 0  3.17718e+01 4.76410e-01 4.85259e+02 72.813  5.90256e+00  1.90838e+01  0.00000e+00 0.00000e+00 6.74854e+02 72.813  1.89595e+02 72.813  0.9746 
1 1 1 -2  42  5  o 15 4.28522e+01 6.10951e-01 7.35153e+02 119.232 -2.43706e+01 4.35482e+01  0.00000e+00 0.00000e+00 8.53527e+02 119.232 1.18373e+02 119.232 0.9899 
1 1 1 -2  42  6  o 7  1.70204e+01 3.34494e-01 4.00659e+02 46.085  8.11876e+00  8.43220e+00  0.00000e+00 0.00000e+00 2.08644e+02 46.085  1.92014e+02 226.085 0.9563 
1 1 1 -2  42  7  o 8  1.29368e+01 3.19690e-01 2.54821e+02 312.662 4.86486e+00  -5.27899e+00 0.00000e+00 0.00000e+00 1.94133e+02 312.662 6.06882e+01 132.662 0.9275 
1 1 1 -2  42  8  o 17 1.62841e+01 3.64348e-01 3.90564e+02 236.808 -9.60370e+00 -1.46803e+01 0.00000e+00 0.00000e+00 2.00794e+02 236.808 1.89770e+02 56.808  0.9711 
1 1 1 -2  42  9  f 0  1.82507e+01 4.02320e-01 2.97324e+02 270.919 2.79366e-01  -1.74244e+01 0.00000e+00 0.00000e+00 3.64916e+02 270.919 6.75920e+01 270.919 0.9709 
1 1 1 -2  42  10 o 14 5.25878e+00 5.87506e-01 1.77440e+02 268.047 -1.38887e-01 -4.07290e+00 0.00000e+00 0.00000e+00 7.27512e+00 88.047  1.84715e+02 88.047  0.8664 
1 1 1 -2  42  11 o 12 2.74012e+01 5.29407e-01 4.04702e+02 73.998  1.76351e+01  6.14940e+01  0.00000e+00 0.00000e+00 6.09967e+02 73.998  2.05265e+02 73.998  0.9922 
1 1 1 -2  42  12 o 4  1.79069e+01 4.54103e-01 2.52342e+02 152.687 -3.42697e+01 1.76980e+01  0.00000e+00 0.00000e+00 4.06758e+02 152.687 1.54416e+02 152.687 0.9870 
1 1 1 -2  42  13 o 19 1.00376e+01 4.50352e-01 2.27835e+02 218.109 -1.79341e+01 -1.40667e+01 0.00000e+00 0.00000e+00 1.37889e+02 218.109 8.99466e+01 38.109  0.9778 
1 1 1 -2  42  14 o 13 6.14685e+00 5.52591e-01 4.82546e+01 221.745 -2.96269e+00 -2.64386e+00 0.00000e+00 0.00000e+00 1.49093e+02 221.745 1.00839e+02 221.745 0.8624 
1 1 1 -2  42  15 o 19 3.35877e+00 7.17735e-01 3.03173e+01 273.932 9.89922e-02  -1.44000e+00 0.00000e+00 0.00000e+00 4.23652e+01 273.932 1.20479e+01 273.932 0.5818 
1 1 1 -2  42  16 o 6  8.10486e+00 6.28531e-01 1.60912e+02 204.100 -1.92871e+01 -8.62736e+00 0.00000e+00 0.00000e+00 1.33004e+02 204.100 2.79087e+01 24.100  0.9760 
1 1 1 -2  42  17 o 12 8.26342e+00 1.85696e+00 1.29247e+02 111.880 -3.70228e+00 9.21910e+00  0.00000e+00 0.00000e+00 1.61570e+02 111.880 3.23229e+01 111.880 0.9483 
1 1 1 -2  42  18 o 3  4.74753e+00 1.67411e+00 1.25847e+02 308.446 4.18648e+00  -5.27338e+00 0.00000e+00 0.00000e+00 3.64969e+01 308.446 8.93501e+01 128.446 0.9224 
1 1 1 -2  42  19 o 17 4.78976e+00 1.70159e+00 3.91548e+01 219.088 -1.81595e+00 -1.47517e+00 0.00000e+00 0.00000e+00 9.32110e+01 219.088 5.40563e+01 219.088 0.7464 
1 1 1 -2  43  1  o 16 9.65516e+00 3.02908e-01 1.51579e+02 155.364 -1.46926e+00 6.73797e-01  0.00000e+00 0.00000e+00 7.41277e+01 155.364 7.74512e+01 335.364 0.6236 
1 1 1 -2  43  2  o 17 2.20477e+01 3.68714e-01 4.87885e+02 247.744 -5.33467e+00 -1.30357e+01 0.00000e+00 0.00000e+00 3.08553e+02 247.744 1.79333e+02 67.744  0.9638 
1 1 1 -2  43  3  o 18 4.45047e+01 7.33681e-01 7.86822e+02 19.941  4.01079e+01  1.45511e+01  0.00000e+00 0.00000e+00 8.61139e+02 19.941  7.43165e+01 19.941  0.9882 
1 1 1 -2  43  4  o 2  6.75037e+00 3.02274e-01 2.66989e+02 201.560 -2.13832e+00 -8.44879e-01 0.00000e+00 0.00000e+00 7.95463e+01 21.560  3.46535e+02 21.560  0.7413 
1 1 1 -2  43  5  o 8  5.40567e+01 7.52905e-01 1.15280e+03 179.070 -9.54849e+01 1.54931e+00  0.00000e+00 0.00000e+00 8.60796e+02 179.070 2.92005e+02 359.070 0.9948 
1 1 1 -2  43  6  o 4  2.54187e+01 4.13061e-01 4.36211e+02 74.282  5.16753e+00  1.83616e+01  0.00000e+00 0.00000e+00 4.89941e+02 74.282  5.37299e+01 74.282  0.9734 
1 1 1 -2  43  7  o 18 1.47915e+01 3.33373e-01 4.33410e+02 271.525 4.20743e-01  -1.57981e+01 0.00000e+00 0.00000e+00 1.02177e+02 271.525 3.31233e+02 91.526  0.9678 
1 1 1 -2  43  8  o 17 6.30036e+00 4.38106e-01 1.77558e+02 186.051 -3.12626e+00 -3.31405e-01 0.00000e+00 0.00000e+00 1.56415e+01 186.051 1.61917e+02 6.051   0.8201 
1 1 1 -2  43  9  o 13 2.20949e+01 4.37361e-01 4.14018e+02 294.557 1.25632e+01  -2.74950e+01 0.00000e+00 0.00000e+00 3.97897e+02 294.557 1.61211e+01 114.557 0.9833 
1 1 1 -2  43  10 o 4  2.50819e+01 4.76640e-01 4.66532e+02 185.865 -5.36479e+01 -5.51094e+00 0.00000e+00 0.00000e+00 4.61440e+02 185.865 5.09184e+00 5.865   0.9907 
1 1 1 -2  43  11 o 1  1.16816e+01 4.54449e-01 1.60840e+02 77.746  2.47088e+00  1.13768e+01  0.00000e+00 0.00000e+00 2.55936e+02 77.746  9.50967e+01 77.746  0.9560 
1 1 1 -2  43  12 o 11 1.64450e+01 4.59405e-01 3.50239e+02 229.246 -3.01990e+01 -3.50425e+01 0.00000e+00 0.00000e+00 2.56321e+02 229.246 9.39178e+01 49.246  0.9891 
1 1 1 -2  43  13 o 17 4.62400e+00 6.59633e-01 9.39981e+01 216.889 -3.67525e+00 -2.75833e+00 0.00000e+00 0.00000e+00 5.81362e+01 216.889 3.58618e+01 36.889  0.8831 
1 1 1 -2  43  14 o 8  1.43093e+01 4.64824e-01 2.44631e+02 51.430  2.97882e+01  3.73549e+01  0.00000e+00 0.00000e+00 2.82415e+02 51.430  3.77844e+01 51.430  0.9895 
1 1 1 -2  43  15 o 10 8.02803e+00 5.73851e-01 1.13208e+02 340.293 1.25162e+01  -4.48304e+00 0.00000e+00 0.00000e+00 1.73883e+02 340.293 6.06746e+01 340.293 0.9616 
1 1 1 -2  43  16 o 17 6.48882e+00 7.66711e-01 1.08618e+02 316.866 8.70844e+00  -8.15890e+00 0.00000e+00 0.00000e+00 1.22109e+02 316.866 1.34903e+01 316.866 0.9571 
1 1 1 -2  43  17 o 8  3.78903e+00 1.27392e+00 9.21993e+01 243.808 -2.06946e+00 -4.20718e+00 0.00000e+00 0.00000e+00 3.23273e+01 243.808 5.98720e+01 63.808  0.8856 
1 1 1 -2  43  18 o 3  5.21004e+00 1.77589e+00 9.43561e+01 78.566  1.01860e+00  5.03615e+00  0.00000e+00 0.00000e+00 7.87742e+01 78.566  1.55819e+01 258.566 0.8965 
1 1 1 -2  43  19 o 6  4.30489e+00 1.56088e+00 8.02451e+01 284.717 1.21677e+00  -4.63232e+00 0.00000e+00 0.00000e+00 6.13220e+01 284.717 1.89230e+01 104.717 0.8883 
1 1 1 -2  44  1  o 2  2.57967e+01 4.10641e-01 4.30376e+02 166.623 -1.41313e+01 3.36057e+00  0.00000e+00 0.00000e+00 5.02619e+02 166.623 7.22426e+01 166.623 0.9649 
1 1 1 -2  44  2  o 9  1.91092e+01 3.44274e-01 3.80858e+02 220.795 -6.53081e+00 -5.63624e+00 0.00000e+00 0.00000e+00 2.92376e+02 220.795 8.84821e+01 40.795  0.9401 
1 1 1 -2  44  3  o 16 1.54618e+01 4.01839e-01 3.49608e+02 254.407 -1.89318e+00 -6.78376e+00 0.00000e+00 0.00000e+00 1.86825e+02 254.407 1.62783e+02 74.407  0.9260 
1 1 1 -2  44  4  o 13 2.41563e+01 3.95766e-01 3.01052e+02 197.979 -9.10656e+00 -2.95529e+00 0.00000e+00 0.00000e+00 5.55084e+02 197.979 2.54032e+02 197.979 0.9462 
1 1 1 -2  44  5  o 14 1.80644e+01 3.41361e-01 3.40559e+02 18.189  1.11014e+01  3.64767e+00  0.00000e+00 0.00000e+00 3.06184e+02 18.189  3.43752e+01 198.189 0.9562 
1 1 1 -2  44  6  o 18 2.00313e+01 3.63239e-01 6.82263e+02 233.287 -1.72090e+01 -2.30770e+01 0.00000e+00 0.00000e+00 5.42946e+01 233.287 6.27968e+02 53.287  0.9825 
1 1 1 -2  44  7  o 3  2.34870e+01 4.04475e-01 4.99870e+02 209.334 -2.47295e+01 -1.38967e+01 0.00000e+00 0.00000e+00 3.63111e+02 209.334 1.36759e+02 29.334  0.9822 
1 1 1 -2  44  8  o 11 3.63333e+01 5.51225e-01 8.06659e+02 63.231  3.97287e+01  7.87558e+01  0.00000e+00 0.00000e+00 5.44053e+02 63.231  2.62606e+02 243.231 0.9943 
1 1 1 -2  44  9  o 8  1.19131e+01 3.93095e-01 2.11296e+02 307.873 5.52576e+00  -7.10513e+00 0.00000e+00 0.00000e+00 2.08338e+02 307.873 2.95857e+00 127.873 0.9427 
1 1 1 -2  44  10 o 6  3.23534e+01 5.53148e-01 5.59841e+02 169.174 -8.59134e+01 1.64289e+01  0.00000e+00 0.00000e+00 6.41342e+02 169.174 8.15011e+01 169.174 0.9943 
1 1 1 -2  44  11 o 11 1.86752e+01 4.70734e-01 2.66055e+02 38.277  2.45917e+01  1.94050e+01  0.00000e+00 0.00000e+00 4.19577e+02 38.277  1.53522e+02 38.277  0.9839 
1 1 1 -2  44  12 o 16 1.03960e+01 4.67195e-01 1.13761e+02 143.789 -8.35729e+00 6.11903e+00  0.00000e+00 0.00000e+00 2.54639e+02 143.789 1.40878e+02 143.789 0.9504 
1 1 1 -2  44  13 o 8  7.87940e+00 5.30195e-01 1.40970e+02 140.742 -9.19897e+00 7.51788e+00  0.00000e+00 0.00000e+00 1.39925e+02 140.742 1.04569e+00 320.742 0.9569 
1 1 1 -2  44  14 o 16 2.70979e+00 6.52463e-01 1.27564e+02 342.462 4.02423e+00  -1.27175e+00 0.00000e+00 0.00000e+00 3.96676e+01 162.462 1.67232e+02 162.462 0.8715 
1 1 1 -2  44  15 o 13 1.37609e+01 5.13743e-01 2.25537e+02 196.506 -5.10235e+01 -1.51201e+01 0.00000e+00 0.00000e+00 2.81314e+02 196.506 5.57776e+01 196.506 0.9906 
1 1 1 -2  44  16 o 13 1.05814e+01 6.99582e-01 1.25226e+02 78.655  4.25973e+00  2.12312e+01  0.00000e+00 0.00000e+00 2.58638e+02 78.655  1.33412e+02 78.655  0.9766 
1 1 1 -2  44  17 o 1  5.58373e+00 1.73356e+00 7.43409e+01 235.716 -2.40751e+00 -3.53138e+00 0.00000e+00 0.00000e+00 1.06591e+02 235.716 3.22501e+01 235.716 0.8733 
1 1 1 -2  44  18 o 3  4.85558e+00 1.68845e+00 6.43628e+01 266.382 -2.28264e-01 -3.60981e+00 0.00000e+00 0.00000e+00 8.80612e+01 266.382 2.36985e+01 266.382 0.8470 
1 1 1 -2  44  19 o 14 4.66531e+00 1.64212e+00 1.07967e+02 51.188  4.16179e+00  5.17401e+00  0.00000e+00 0.00000e+00 5.11365e+01 51.188  5.68307e+01 231.188 0.9213 
1 1 1 -2  45  1  o 10 3.40232e+01 5.05038e-01 8.72478e+02 280.973 6.67539e+00  -3.44278e+01 0.00000e+00 0.00000e+00 3.84288e+02 280.973 4.88189e+02 100.973 0.9856 
1 1 1 -2  45  2  o 17 2.39216e+01 3.92004e-01 4.88772e+02 237.644 -7.66934e+00 -1.21053e+01 0.00000e+00 0.00000e+00 3.75714e+02 237.644 1.13057e+02 57.644  0.9645 
1 1 1 -2  45  3  f 0  2.29732e+01 4.11014e-01 5.04584e+02 305.288 8.55923e+00  -1.20942e+01 0.00000e+00 0.00000e+00 3.26459e+02 305.288 1.78125e+02 125.288 0.9656 
1 1 1 -2  45  4  o 14 4.56350e+01 6.46852e-01 8.70497e+02 94.306  -4.72622e+00 6.27725e+01  0.00000e+00 0.00000e+00 8.24931e+02 94.306  4.55659e+01 274.306 0.9920 
1 1 1 -2  45  5  o 17 2.27037e+01 3.84834e-01 4.66930e+02 272.202 7.17553e-01  -1.86617e+01 0.00000e+00 0.00000e+00 3.59954e+02 272.202 1.06975e+02 92.202  0.9728 
1 1 1 -2  45  6  o 13 5.86933e+00 3.72427e-01 1.94123e+02 240.859 -1.16336e+00 -2.08659e+00 0.00000e+00 0.00000e+00 2.88746e+01 60.859  2.22998e+02 60.859  0.7524 
1 1 1 -2  45  7  o 5  4.77959e+01 6.81921e-01 9.01118e+02 159.483 -1.06899e+02 4.00047e+01  0.00000e+00 0.00000e+00 8.78781e+02 159.483 2.23372e+01 339.483 0.9956 
1 1 1 -2  45  8  o 18 3.95478e+01 5.89621e-01 6.29500e+02 128.428 -4.41387e+01 5.56333e+01  0.00000e+00 0.00000e+00 8.38494e+02 128.428 2.08994e+02 128.428 0.9929 
1 1 1 -2  45  9  o 17 2.21532e+01 4.42554e-01 2.69330e+02 4.755   2.05843e+01  1.71238e+00  0.00000e+00 0.00000e+00 5.38048e+02 4.755   2.68718e+02 4.755   0.9755 
1 1 1 -2  45  10 o 12 3.70503e+01 6.13232e-01 6.36321e+02 60.660  5.40385e+01  9.61385e+01  0.00000e+00 0.00000e+00 7.40723e+02 60.660  1.04402e+02 60.660  0.9955 
1 1 1 -2  45  11 f 0  4.11773e+00 6.99245e-01 3.51685e+01 95.534  -9.34645e-02 9.64593e-01  0.00000e+00 0.00000e+00 3.17126e+01 95.534  3.45596e+00 275.534 0.4353 
1 1 1 -2  45  12 o 19 1.40690e+01 4.67684e-01 2.19380e+02 144.528 -2.22759e+01 1.58725e+01  0.00000e+00 0.00000e+00 2.95438e+02 144.528 7.60571e+01 144.528 0.9815 
1 1 1 -2  45  13 o 15 1.51039e+01 4.73509e-01 2.25081e+02 228.731 -2.54108e+01 -2.89562e+01 0.00000e+00 0.00000e+00 3.30173e+02 228.731 1.05092e+02 228.731 0.9869 
1 1 1 -2  45  14 o 13 3.35133e+00 7.38453e-01 9.01657e+01 194.016 -3.81519e+00 -9.52365e-01 0.00000e+00 0.00000e+00 1.72017e+01 194.016 7.29641e+01 14.016  0.8609 
1 1 1 -2  45  15 o 3  4.40572e+00 7.91862e-01 2.88932e+01 163.889 -1.83304e+00 5.29472e-01  0.00000e+00 0.00000e+00 8.28304e+01 163.889 5.39372e+01 163.889 0.6821 
1 1 1 -2  45  16 o 11 4.00689e+00 7.28329e-01 4.82754e+01 344.639 3.26710e+00  -8.97494e-01 0.00000e+00 0.00000e+00 7.59950e+01 344.639 2.77196e+01 344.639 0.8350 
1 1 1 -2  45  17 o 2  6.00373e+00 1.95267e+00 8.90753e+01 206.241 -4.21434e+00 -2.07745e+00 0.00000e+00 0.00000e+00 1.08249e+02 206.241 1.91736e+01 206.241 0.8859 
1 1 1 -2  45  18 o 3  5.24582e+00 1.81586e+00 1.19656e+02 324.114 5.36423e+00  -3.88100e+00 0.00000e+00 0.00000e+00 5.93939e+01 324.114 6.02617e+01 144.114 0.9210 
1 1 1 -2  45  19 o 4  4.42401e+00 1.49255e+00 6.39716e+01 233.858 -2.42812e+00 -3.32460e+00 0.00000e+00 0.00000e+00 7.81391e+01 233.858 1.41675e+01 233.858 0.8679 
1 1 1 -2  46  1  o 11 3.08300e+01 4.69727e-01 5.38281e+02 175.624 -2.02400e+01 1.54869e+00  0.00000e+00 0.00000e+00 5.88161e+02 175.624 4.98799e+01 175.624 0.9750 
1 1 1 -2  46  2  o 19 2.31933e+01 3.87009e-01 3.70819e+02 39.125  8.67031e+00  7.05242e+00  0.00000e+00 0.00000e+00 4.58297e+02 39.125  8.74786e+01 39.125  0.9542 
1 1 1 -2  46  3  o 2  4.66047e+01 6.59823e-01 8.40511e+02 123.317 -2.82227e+01 4.29377e+01  0.00000e+00 0.00000e+00 8.88085e+02 123.317 4.75737e+01 123.317 0.9902 
1 1 1 -2  46  4  f 0  3.77324e+01 5.51399e-01 6.37201e+02 56.806  2.03427e+01  3.10936e+01  0.00000e+00 0.00000e+00 7.56578e+02 56.806  1.19378e+02 56.806  0.9865 
1 1 1 -2  46  5  o 4  2.31689e+01 3.91591e-01 5.57753e+02 311.273 1.45969e+01  -1.66310e+01 0.00000e+00 0.00000e+00 2.89689e+02 311.273 2.68064e+02 131.273 0.9771 
1 1 1 -2  46  6  o 11 6.87719e+00 3.89937e-01 2.29704e+02 112.766 -1.33262e+00 3.17550e+00  0.00000e+00 0.00000e+00 1.40380e+01 292.766 2.43742e+02 292.766 0.8381 
1 1 1 -2  46  7  o 12 2.83295e+01 4.56545e-01 5.17391e+02 149.483 -3.30522e+01 1.94825e+01  0.00000e+00 0.00000e+00 5.28208e+02 149.483 1.08168e+01 149.483 0.9869 
1 1 1 -2  46  8  o 8  5.42257e+01 7.70398e-01 8.75288e+02 45.474  1.04932e+02  1.06682e+02  0.00000e+00 0.00000e+00 1.14483e+03 45.474  2.69539e+02 45.474  0.9967 
1 1 1 -2  46  9  f 0  2.12302e+01 4.39638e-01 3.43523e+02 312.853 1.94848e+01  -2.10026e+01 0.00000e+00 0.00000e+00 4.35596e+02 312.853 9.20726e+01 312.853 0.9824 
1 1 1 -2  46  10 o 18 9.46901e+00 4.58360e-01 1.72437e+02 262.571 -1.07495e+00 -8.24387e+00 0.00000e+00 0.00000e+00 1.59062e+02 262.571 1.33754e+01 82.571  0.9378 
1 1 1 -2  46  11 o 5  1.18773e+01 4.66937e-01 1.76199e+02 86.612  8.84784e-01  1.49473e+01  0.00000e+00 0.00000e+00 2.51823e+02 86.612  7.56238e+01 86.612  0.9660 
1 1 1 -2  46  12 o 4  1.09431e+01 4.75394e-01 1.65465e+02 269.112 -2.61457e-01 -1.68644e+01 0.00000e+00 0.00000e+00 2.30165e+02 269.112 6.46993e+01 269.112 0.9699 
1 1 1 -2  46  13 o 16 7.72058e+00 5.57104e-01 1.00250e+02 274.461 6.45065e-01  -8.26908e+00 0.00000e+00 0.00000e+00 1.69361e+02 274.461 6.91112e+01 274.461 0.9376 
1 1 1 -2  46  14 o 13 1.28591e+01 5.28362e-01 2.25725e+02 73.846  1.07259e+01  3.70307e+01  0.00000e+00 0.00000e+00 2.46520e+02 73.846  2.07957e+01 73.846  0.9869 
1 1 1 -2  46  15 o 16 7.76114e+00 5.90818e-01 1.73387e+02 74.248  5.97116e+00  2.11692e+01  0.00000e+00 0.00000e+00 1.08493e+02 74.248  6.48934e+01 254.248 0.9770 
1 1 1 -2  46  16 o 2  5.60450e+00 8.97301e-01 9.14996e+01 227.484 -5.54795e+00 -6.05109e+00 0.00000e+00 0.00000e+00 1.03509e+02 227.484 1.20099e+01 227.484 0.9370 
1 1 1 -2  46  17 o 11 5.94876e+00 1.99992e+00 4.41209e+01 17.191  2.15648e+00  6.67185e-01  0.00000e+00 0.00000e+00 1.18255e+02 17.191  7.41343e+01 17.191  0.7358 
1 1 1 -2  46  18 o 15 5.46361e+00 1.87699e+00 1.30986e+02 304.008 4.00150e+00  -5.93062e+00 0.00000e+00 0.00000e+00 5.67237e+01 304.008 7.42627e+01 124.008 0.9272 
1 1 1 -2  46  19 o 3  5.04230e+00 1.63527e+00 6.21135e+01 13.428  4.00519e+00  9.56213e-01  0.00000e+00 0.00000e+00 9.98437e+01 13.428  3.77302e+01 13.428  0.8679 
1 1 1 -2  47  1  o 19 1.63285e+01 3.26816e-01 3.19531e+02 277.005 8.27272e-01  -6.73268e+00 0.00000e+00 0.00000e+00 2.45164e+02 277.005 7.43672e+01 97.005  0.9230 
1 1 1 -2  47  2  o 8  3.21843e+01 4.86330e-01 5.53180e+02 128.751 -1.41723e+01 1.76578e+01  0.00000e+00 0.00000e+00 6.25539e+02 128.751 7.23596e+01 128.751 0.9777 
1 1 1 -2  47  3  o 3  8.81430e+00 3.09566e-01 1.07269e+02 175.906 -1.28187e+00 9.17523e-02  0.00000e+00 0.00000e+00 7.04528e+01 175.906 3.68163e+01 355.906 0.5384 
1 1 1 -2  47  4  o 16 1.41544e+01 3.17465e-01 1.80578e+02 132.127 -3.25945e+00 3.60384e+00  0.00000e+00 0.00000e+00 2.91089e+02 132.127 1.10511e+02 132.127 0.8900 
1 1 1 -2  47  5  o 1  2.93503e+01 4.59906e-01 3.99978e+02 315.476 1.43677e+01  -1.41307e+01 0.00000e+00 0.00000e+00 6.70927e+02 315.476 2.70949e+02 315.476 0.9749 
1 1 1 -2  47  6  o 3  3.94283e+01 5.77609e-01 8.06931e+02 132.611 -4.75755e+01 5.17172e+01  0.00000e+00 0.00000e+00 6.57635e+02 132.611 1.49297e+02 312.611 0.9929 
1 1 1 -2  47  7  o 18 1.78030e+01 3.70948e-01 3.59226e+02 180.498 -1.76499e+01 -1.53398e-01 0.00000e+00 0.00000e+00 2.87363e+02 180.498 7.18629e+01 0.498   0.9712 
1 1 1 -2  47  8  o 6  8.44784e+00 4.09757e-01 5.60932e+01 79.395  2.71837e-01  1.45187e+00  0.00000e+00 0.00000e+00 1.30321e+02 79.395  7.42278e+01 79.395  0.5904 
1 1 1 -2  47  9  o 17 2.29612e+01 4.53376e-01 5.13197e+02 299.299 2.48265e+01  -4.42419e+01 0.00000e+00 0.00000e+00 3.35949e+02 299.299 1.77248e+02 119.299 0.9901 
1 1 1 -2  47  10 o 11 2.13672e+01 4.51666e-01 2.99209e+02 349.002 3.79278e+01  -7.37103e+00 0.00000e+00 0.00000e+00 4.87977e+02 349.002 1.88768e+02 349.002 0.9870 
1 1 1 -2  47  11 o 4  4.90719e+00 6.74580e-01 8.07356e+01 155.339 -2.62906e+00 1.20706e+00  0.00000e+00 0.00000e+00 6.60150e+01 155.339 1.47206e+01 335.339 0.8017 
1 1 1 -2  47  12 o 17 1.89871e+01 5.12933e-01 3.27489e+02 93.966  -3.96969e+00 5.72570e+01  0.00000e+00 0.00000e+00 3.73986e+02 93.966  4.64971e+01 93.966  0.9912 
1 1 1 -2  47  13 o 8  1.28182e+01 5.08930e-01 1.99664e+02 174.091 -2.91456e+01 3.01629e+00  0.00000e+00 0.00000e+00 2.69460e+02 174.091 6.97964e+01 174.091 0.9828 
1 1 1 -2  47  14 o 8  3.92223e+00 7.89358e-01 6.39225e+01 265.210 -2.73221e-01 -3.26058e+00 0.00000e+00 0.00000e+00 5.69426e+01 265.210 6.97993e+00 85.210  0.8282 
1 1 1 -2  47  15 o 13 8.75410e+00 5.70925e-01 1.41185e+02 240.552 -9.90879e+00 -1.75506e+01 0.00000e+00 0.00000e+00 1.76025e+02 240.552 3.48396e+01 240.552 0.9749 
1 1 1 -2  47  16 f 0  3.58643e+00 7.25627e-01 1.32347e+02 211.020 -7.26223e+00 -4.36698e+00 0.00000e+00 0.00000e+00 7.30042e+00 31.020  1.39647e+02 31.020  0.9390 
1 1 1 -2  47  17 o 17 1.12516e+01 8.73999e-01 2.24496e+02 352.098 4.51261e+01  -6.26357e+00 0.00000e+00 0.00000e+00 1.88234e+02 352.098 3.62616e+01 172.098 0.9890 
1 1 1 -2  47  18 o 3  5.77362e+00 1.79932e+00 1.40064e+02 168.589 -8.40858e+00 1.69720e+00  0.00000e+00 0.00000e+00 6.09565e+01 168.589 7.91071e+01 348.589 0.9398 
1 1 1 -2  48  1  o 19 2.39872e+01 3.98781e-01 4.97131e+02 345.157 1.52993e+01  -4.05460e+00 0.00000e+00 0.00000e+00 3.72621e+02 345.157 1.24511e+02 165.157 0.9679 
1 1 1 -2  48  2  o 10 2.44349e+01 4.03089e-01 5.39546e+02 82.129  2.46161e+00  1.78068e+01  0.00000e+00 0.00000e+00 3.49855e+02 82.129  1.89690e+02 262.129 0.9718 
1 1 1 -2  48  3  o 16 2.52400e+01 4.12896e-01 5.55957e+02 341.634 2.11117e+01  -7.00917e+00 0.00000e+00 0.00000e+00 3.67717e+02 341.634 1.88240e+02 161.634 0.9773 
1 1 1 -2  48  4  o 19 3.60065e+01 5.33868e-01 4.97314e+02 17.049  3.00173e+01  9.20503e+00  0.00000e+00 0.00000e+00 8.28990e+02 17.049  3.31676e+02 17.049  0.9839 
1 1 1 -2  48  5  f 0  2.81438e+01 4.46482e-01 5.96703e+02 206.463 -3.15215e+01 -1.56904e+01 0.00000e+00 0.00000e+00 4.41455e+02 206.463 1.55249e+02 26.463  0.9857 
1 1 1 -2  48  6  o 15 1.84125e+01 3.64655e-01 3.24816e+02 180.172 -1.46799e+01 -4.41612e-02 0.00000e+00 0.00000e+00 3.40056e+02 180.172 1.52400e+01 180.172 0.9653 
1 1 1 -2  48  7  o 3  1.73949e+01 3.69399e-01 2.76729e+02 118.773 -6.53361e+00 1.18981e+01  0.00000e+00 0.00000e+00 3.49220e+02 118.773 7.24915e+01 118.773 0.9624 
1 1 1 -2  48  8  o 15 2.27312e+01 4.21603e-01 3.92746e+02 256.936 -6.46989e+00 -2.78827e+01 0.00000e+00 0.00000e+00 4.41731e+02 256.936 4.89853e+01 256.936 0.9824 
1 1 1 -2  48  9  o 13 2.90441e+01 5.17131e-01 4.02590e+02 76.244  1.22492e+01  5.00366e+01  0.00000e+00 0.00000e+00 6.71539e+02 76.244  2.68949e+02 76.244  0.9902 
1 1 1 -2  48  10 o 17 1.56339e+01 4.27586e-01 1.82358e+02 148.830 -1.41496e+01 8.55914e+00  0.00000e+00 0.00000e+00 3.83206e+02 148.830 2.00849e+02 148.830 0.9693 
1 1 1 -2  48  11 o 13 7.49139e+00 5.12907e-01 2.38889e+02 317.776 9.98195e+00  -9.05880e+00 0.00000e+00 0.00000e+00 2.99326e+01 317.776 2.08956e+02 137.776 0.9622 
1 1 1 -2  48  12 o 14 7.44764e+00 5.43934e-01 1.59133e+02 258.253 -2.21093e+00 -1.06318e+01 0.00000e+00 0.00000e+00 1.05306e+02 258.253 5.38278e+01 78.252  0.9528 
1 1 1 -2  48  13 o 14 8.15500e+00 5.90251e-01 6.57130e+01 35.966  4.55773e+00  3.30724e+00  0.00000e+00 0.00000e+00 2.09459e+02 35.966  1.43746e+02 35.966  0.9062 
1 1 1 -2  48  14 o 11 1.24133e+01 5.49518e-01 2.00745e+02 83.302  4.13545e+00  3.52161e+01  0.00000e+00 0.00000e+00 2.54481e+02 83.302  5.37364e+01 83.302  0.9858 
1 1 1 -2  48  15 o 1  2.75364e+00 7.74226e-01 8.03919e+01 146.003 -2.77655e+00 1.87259e+00  0.00000e+00 0.00000e+00 4.83697e+00 146.003 7.55549e+01 326.003 0.8328 
1 1 1 -2  48  16 o 12 8.30015e+00 6.49264e-01 1.81614e+02 3.022   2.86898e+01  1.51437e+00  0.00000e+00 0.00000e+00 1.21132e+02 3.022   6.04825e+01 183.021 0.9824 
1 1 1 -2  48  17 o 2  3.29869e+00 1.07749e+00 7.30180e+01 265.117 -3.30454e-01 -3.86825e+00 0.00000e+00 0.00000e+00 3.20496e+01 265.117 4.09685e+01 85.117  0.8588 
1 1 1 -2  48  18 o 15 7.66985e+00 1.95834e+00 1.26944e+02 202.876 -8.73770e+00 -3.68660e+00 0.00000e+00 0.00000e+00 1.41751e+02 202.876 1.48077e+01 202.876 0.9457 
1 1 1 -2  49  1  o 4  2.56599e+01 4.16124e-01 4.78876e+02 255.227 -4.26737e+00 -1.61818e+01 0.00000e+00 0.00000e+00 4.53104e+02 255.227 2.57718e+01 75.227  0.9696 
1 1 1 -2  49  2  o 8  2.75629e+01 4.38688e-01 6.53353e+02 79.776  5.09257e+00  2.82346e+01  0.00000e+00 0.00000e+00 3.60752e+02 79.776  2.92601e+02 259.776 0.9824 
1 1 1 -2  49  3  o 18 2.49491e+01 4.10964e-01 5.36339e+02 161.935 -1.96135e+01 6.39733e+00  0.00000e+00 0.00000e+00 3.74882e+02 161.935 1.61457e+02 341.935 0.9755 
1 1 1 -2  49  4  o 3  3.44229e+01 5.16577e-01 6.54775e+02 102.038 -8.01474e+00 3.75829e+01  0.00000e+00 0.00000e+00 6.16839e+02 102.038 3.79364e+01 282.038 0.9869 
1 1 1 -2  49  5  o 13 2.02799e+01 3.72033e-01 4.55559e+02 199.709 -1.81957e+01 -6.51835e+00 0.00000e+00 0.00000e+00 2.83375e+02 199.709 1.72184e+02 19.709  0.9738 
1 1 1 -2  49  6  o 5  2.10123e+01 3.84594e-01 4.06271e+02 74.560  5.47923e+00  1.98386e+01  0.00000e+00 0.00000e+00 3.60301e+02 74.560  4.59699e+01 254.560 0.9754 
1 1 1 -2  49  7  o 15 1.94207e+01 3.86670e-01 4.11736e+02 336.969 2.23425e+01  -9.49793e+00 0.00000e+00 0.00000e+00 2.99182e+02 336.969 1.12555e+02 156.969 0.9792 
1 1 1 -2  49  8  o 3  5.64341e+01 8.02427e-01 8.60500e+02 159.240 -1.57800e+02 5.98159e+01  0.00000e+00 0.00000e+00 1.24187e+03 159.240 3.81368e+02 159.240 0.9970 
1 1 1 -2  49  9  o 13 2.12886e+01 4.41167e-01 4.56778e+02 309.360 2.85658e+01  -3.48265e+01 0.00000e+00 0.00000e+00 3.29306e+02 309.360 1.27473e+02 129.360 0.9888 
1 1 1 -2  49  10 o 2  1.40346e+01 4.30280e-01 1.98122e+02 126.665 -9.68379e+00 1.30083e+01  0.00000e+00 0.00000e+00 3.09198e+02 126.665 1.11076e+02 126.665 0.9687 
1 1 1 -2  49  11 o 6  7.72828e+00 5.05040e-01 1.69653e+02 160.349 -9.65026e+00 3.44593e+00  0.00000e+00 0.00000e+00 1.04092e+02 160.349 6.55610e+01 340.349 0.9499 
1 1 1 -2  49  12 o 18 3.72621e+00 8.00835e-01 1.14257e+02 329.159 3.32922e+00  -1.98786e+00 0.00000e+00 0.00000e+00 4.95899e+00 329.159 1.09298e+02 149.159 0.8586 
1 1 1 -2  49  13 o 11 1.42880e+01 5.46118e-01 2.70774e+02 129.705 -2.84932e+01 3.43144e+01  0.00000e+00 0.00000e+00 2.55165e+02 129.705 1.56084e+01 309.705 0.9887 
1 1 1 -2  49  14 o 9  1.37478e+01 5.97701e-01 2.87673e+02 83.460  6.55937e+00  5.72197e+01  0.00000e+00 0.00000e+00 2.19232e+02 83.460  6.84407e+01 263.460 0.9913 
1 1 1 -2  49  15 o 3  1.19372e+01 6.32945e-01 1.98651e+02 310.137 2.44827e+01  -2.90362e+01 0.00000e+00 0.00000e+00 2.39057e+02 310.137 4.04056e+01 310.137 0.9867 
1 1 1 -2  49  16 o 11 6.12026e+00 9.29501e-01 1.45130e+02 245.796 -6.25923e+00 -1.39247e+01 0.00000e+00 0.00000e+00 7.44937e+01 245.796 7.06363e+01 65.796  0.9667 
1 1 1 -2  49  17 o 17 7.67719e+00 9.65744e-01 7.48337e+01 156.931 -9.27610e+00 3.95058e+00  0.00000e+00 0.00000e+00 1.95338e+02 156.931 1.20504e+02 156.931 0.9490 
1 1 1 -2  49  18 o 13 3.90632e+00 1.34429e+00 8.45291e+01 255.075 -1.30593e+00 -4.89957e+00 0.00000e+00 0.00000e+00 4.49639e+01 255.075 3.95652e+01 75.075  0.8950 
1 1 1 -2  50  1  o 17 2.92372e+01 4.56202e-01 6.12092e+02 101.078 -5.46849e+00 2.79303e+01  0.00000e+00 0.00000e+00 4.63499e+02 101.078 1.48593e+02 281.078 0.9823 
1 1 1 -2  50  2  o 2  3.59734e+01 5.34280e-01 7.26246e+02 281.689 8.16941e+00  -3.94866e+01 0.00000e+00 0.00000e+00 6.04001e+02 281.689 1.22246e+02 101.689 0.9875 
1 1 1 -2  50  3  o 2  2.69289e+01 4.33643e-01 4.91698e+02 292.459 8.91058e+00  -2.15558e+01 0.00000e+00 0.00000e+00 4.94590e+02 292.459 2.89135e+00 292.459 0.9783 
1 1 1 -2  50  4  o 14 1.50133e+01 3.30112e-01 6.93844e+01 212.069 -1.51943e+00 -9.51980e-01 0.00000e+00 0.00000e+00 3.01846e+02 212.069 2.32462e+02 212.069 0.6607 
1 1 1 -2  50  5  o 13 1.64438e+01 3.46992e-01 2.53004e+02 152.794 -8.05434e+00 4.14052e+00  0.00000e+00 0.00000e+00 3.27173e+02 152.794 7.41699e+01 152.794 0.9431 
1 1 1 -2  50  6  o 7  2.42125e+01 4.15974e-01 5.70057e+02 159.312 -3.45977e+01 1.30648e+01  0.00000e+00 0.00000e+00 3.23097e+02 159.312 2.46961e+02 339.312 0.9864 
1 1 1 -2  50  7  o 3  6.12011e+01 8.58533e-01 1.07847e+03 345.851 1.78756e+02  -4.50634e+01 0.00000e+00 0.00000e+00 1.20298e+03 345.851 1.24513e+02 345.851 0.9973 
1 1 1 -2  50  8  o 13 1.69801e+01 3.91768e-01 2.62667e+02 163.556 -1.48853e+01 4.39329e+00  0.00000e+00 0.00000e+00 3.50909e+02 163.556 8.82411e+01 163.556 0.9672 
1 1 1 -2  50  9  o 4  3.70741e+00 7.40482e-01 1.55395e+02 309.901 1.74831e+00  -2.09088e+00 0.00000e+00 0.00000e+00 4.63936e+01 129.901 2.01788e+02 129.901 0.7875 
1 1 1 -2  50  10 o 9  2.12953e+01 4.58131e-01 4.31373e+02 46.782  3.89686e+01  4.14710e+01  0.00000e+00 0.00000e+00 3.56188e+02 46.782  7.51849e+01 226.782 0.9912 
1 1 1 -2  50  11 o 18 1.64620e+01 4.52755e-01 3.01481e+02 116.468 -1.88665e+01 3.78936e+01  0.00000e+00 0.00000e+00 3.05015e+02 116.468 3.53369e+00 116.468 0.9881 
1 1 1 -2  50  12 o 8  1.02242e+01 5.45567e-01 2.07042e+02 56.908  1.13032e+01  1.73444e+01  0.00000e+00 0.00000e+00 1.64555e+02 56.908  4.24868e+01 236.908 0.9755 
1 1 1 -2  50  13 f 0  6.74388e+00 6.68981e-01 5.72658e+01 76.661  1.10339e+00  4.65365e+00  0.00000e+00 0.00000e+00 1.65678e+02 76.661  1.08412e+02 76.661  0.8881 
1 1 1 -2  50  14 o 3  1.70922e+01 6.13578e-01 3.14665e+02 130.160 -4.93801e+01 5.85160e+01  0.00000e+00 0.00000e+00 3.16844e+02 130.160 2.17887e+00 130.160 0.9934 
1 1 1 -2  50  15 o 14 1.58458e+01 6.25606e-01 2.30764e+02 263.168 -7.29833e+00 -6.09121e+01 0.00000e+00 0.00000e+00 3.53170e+02 263.168 1.22406e+02 263.168 0.9918 
1 1 1 -2  50  16 o 7  4.36597e+00 9.68145e-01 5.84065e+01 65.285  1.69151e+00  3.67512e+00  0.00000e+00 0.00000e+00 8.18092e+01 65.285  2.34026e+01 65.285  0.8653 
1 1 1 -2  50  17 o 2  4.03971e+00 1.11235e+00 5.45362e+01 201.759 -3.39522e+00 -1.35516e+00 0.00000e+00 0.00000e+00 7.26013e+01 201.759 1.80651e+01 201.759 0.8488 
1 1 1 -2  50  18 f 0  4.44553e+00 1.47859e+00 1.35170e+02 111.483 -3.17558e+00 8.06858e+00  0.00000e+00 0.00000e+00 1.96583e+01 111.483 1.15512e+02 291.483 0.9404 
1 1 1 -2  51  1  o 15 1.72531e+01 3.42134e-01 3.68723e+02 257.940 -2.05888e+00 -9.63698e+00 0.00000e+00 0.00000e+00 2.43645e+02 257.940 1.25078e+02 77.940  0.9478 
1 1 1 -2  51  2  o 18 1.54119e+01 3.31947e-01 4.38381e+02 270.735 1.64239e-01  -1.28060e+01 0.00000e+00 0.00000e+00 1.15644e+02 270.735 3.22737e+02 90.735  0.9601 
1 1 1 -2  51  3  o 18 3.61617e+01 5.38459e-01 7.65064e+02 59.682  2.38205e+01  4.07346e+01  0.00000e+00 0.00000e+00 5.74119e+02 59.682  1.90945e+02 239.682 0.9893 
1 1 1 -2  51  4  o 15 2.45311e+01 4.11672e-01 4.28267e+02 40.695  1.66974e+01  1.43595e+01  0.00000e+00 0.00000e+00 4.68623e+02 40.695  4.03555e+01 40.695  0.9770 
1 1 1 -2  51  5  o 12 2.51488e+01 4.21260e-01 2.85507e+02 142.568 -1.40037e+01 1.07189e+01  0.00000e+00 0.00000e+00 6.28178e+02 142.568 3.42671e+02 142.568 0.9712 
1 1 1 -2  51  6  o 15 2.31402e+01 4.09313e-01 1.93213e+02 20.565  1.15404e+01  4.32970e+00  0.00000e+00 0.00000e+00 6.36168e+02 20.565  4.42955e+02 20.565  0.9585 
1 1 1 -2  51  7  o 6  1.16101e+01 4.12153e-01 2.19471e+02 184.291 -8.20696e+00 -6.15805e-01 0.00000e+00 0.00000e+00 1.87162e+02 184.291 3.23087e+01 4.291   0.9371 
1 1 1 -2  51  8  o 19 1.07428e+01 3.97350e-01 2.08824e+02 156.394 -8.11317e+00 3.54552e+00  0.00000e+00 0.00000e+00 1.69073e+02 156.394 3.97508e+01 336.394 0.9417 
1 1 1 -2  51  9  o 4  2.79871e+01 5.09460e-01 3.42521e+02 206.675 -4.05182e+01 -2.03568e+01 0.00000e+00 0.00000e+00 6.90699e+02 206.675 3.48178e+02 206.675 0.9889 
1 1 1 -2  51  10 o 4  6.89333e+00 5.26130e-01 1.23713e+02 32.723  4.49186e+00  2.88627e+00  0.00000e+00 0.00000e+00 1.07919e+02 32.723  1.57939e+01 212.723 0.9007 
1 1 1 -2  51  11 o 15 1.69276e+01 4.55532e-01 2.31421e+02 134.931 -2.21973e+01 2.22505e+01  0.00000e+00 0.00000e+00 3.89520e+02 134.931 1.58098e+02 134.931 0.9840 
1 1 1 -2  51  12 o 1  4.71896e+00 7.79251e-01 1.26019e+02 274.325 4.14920e-01  -5.48633e+00 0.00000e+00 0.00000e+00 3.28659e+01 274.325 9.31529e+01 94.325  0.9039 
1 1 1 -2  51  13 o 17 7.71102e+00 6.68589e-01 1.40304e+02 61.692  6.63451e+00  1.23177e+01  0.00000e+00 0.00000e+00 1.36241e+02 61.692  4.06336e+00 241.692 0.9636 
1 1 1 -2  51  14 o 11 8.83060e+00 6.52218e-01 1.26593e+02 249.083 -5.94057e+00 -1.55434e+01 0.00000e+00 0.00000e+00 1.91754e+02 249.083 6.51613e+01 249.083 0.9695 
1 1 1 -2  51  15 o 2  3.77347e+00 9.24121e-01 6.19006e+01 159.312 -3.35398e+00 1.26654e+00  0.00000e+00 0.00000e+00 5.66150e+01 159.312 5.28551e+00 339.312 0.8454 
1 1 1 -2  51  16 o 3  4.34397e+00 1.04808e+00 1.36327e+02 332.178 8.08165e+00  -4.26488e+00 0.00000e+00 0.00000e+00 1.57902e+01 332.178 1.20537e+02 152.178 0.9436 
1 1 1 -2  51  17 o 18 6.27439e+00 1.06445e+00 1.06256e+02 148.180 -9.63707e+00 5.97978e+00  0.00000e+00 0.00000e+00 1.15840e+02 148.180 9.58442e+00 148.180 0.9548 
1 1 1 -2  51  18 o 17 5.11840e+00 1.63075e+00 9.15066e+01 21.412  5.66500e+00  2.22140e+00  0.00000e+00 0.00000e+00 8.16570e+01 21.412  9.84959e+00 201.411 0.9137 
1 1 1 -2  52  1  f 0  3.12640e+01 4.81559e-01 6.32809e+02 227.509 -2.51872e+01 -2.74959e+01 0.00000e+00 0.00000e+00 5.21970e+02 227.509 1.10839e+02 47.509  0.9865 
1 1 1 -2  52  2  o 9  2.58295e+01 4.84367e-01 5.41873e+02 350.675 2.41833e+01  -3.97079e+00 0.00000e+00 0.00000e+00 4.05126e+02 350.675 1.36747e+02 170.675 0.9794 
1 1 1 -2  52  3  o 13 1.93230e+01 3.66352e-01 3.01334e+02 126.530 -5.96323e+00 8.04990e+00  0.00000e+00 0.00000e+00 3.84760e+02 126.530 8.34261e+01 126.530 0.9487 
1 1 1 -2  52  4  f 0  2.45658e+01 4.17096e-01 4.48895e+02 200.563 -2.25278e+01 -8.45120e+00 0.00000e+00 0.00000e+00 4.50945e+02 200.563 2.05004e+00 200.563 0.9790 
1 1 1 -2  52  5  o 7  1.27598e+01 4.29867e-01 1.70154e+02 156.994 -4.81804e+00 2.04569e+00  0.00000e+00 0.00000e+00 2.58676e+02 156.994 8.85217e+01 156.994 0.8985 
1 1 1 -2  52  6  o 6  1.90024e+01 3.80411e-01 2.63098e+02 90.241  -5.94019e-02 1.40933e+01  0.00000e+00 0.00000e+00 4.21653e+02 90.241  1.58555e+02 90.241  0.9638 
1 1 1 -2  52  7  o 16 1.33694e+01 3.95065e-01 2.82767e+02 21.829  1.13118e+01  4.53104e+00  0.00000e+00 0.00000e+00 1.95876e+02 21.829  8.68910e+01 201.829 0.9580 
1 1 1 -2  52  8  o 16 2.89674e+01 4.85643e-01 4.11205e+02 224.785 -3.64098e+01 -3.61374e+01 0.00000e+00 0.00000e+00 6.60096e+02 224.785 2.48892e+02 224.785 0.9902 
1 1 1 -2  52  9  o 16 3.55496e+00 7.66327e-01 5.57707e+01 26.328  8.73655e-01  4.32315e-01  0.00000e+00 0.00000e+00 2.26662e+00 26.328  5.35041e+01 206.328 0.4374 
1 1 1 -2  52  10 o 9  1.42962e+01 4.29467e-01 2.36260e+02 303.220 1.28577e+01  -1.96334e+01 0.00000e+00 0.00000e+00 2.85527e+02 303.220 4.92669e+01 303.220 0.9785 
1 1 1 -2  52  11 o 9  9.89315e+00 4.76665e-01 2.09499e+02 344.578 1.74351e+01  -4.80949e+00 0.00000e+00 0.00000e+00 1.48922e+02 344.578 6.05772e+01 164.578 0.9719 
1 1 1 -2  52  12 o 19 5.77438e+00 7.13804e-01 7.98254e+01 331.533 4.14679e+00  -2.24839e+00 0.00000e+00 0.00000e+00 1.10809e+02 331.533 3.09835e+01 331.533 0.8864 
1 1 1 -2  52  13 o 19 1.49630e+01 5.84919e-01 2.49747e+02 118.342 -2.34544e+01 4.34829e+01  0.00000e+00 0.00000e+00 3.01425e+02 118.342 5.16775e+01 118.342 0.9898 
1 1 1 -2  52  14 o 10 9.25255e+00 6.81863e-01 1.51860e+02 97.632  -2.67860e+00 1.99890e+01  0.00000e+00 0.00000e+00 1.83514e+02 97.632  3.16547e+01 97.632  0.9749 
1 1 1 -2  52  15 o 10 3.04455e+00 8.89963e-01 9.69975e+01 359.087 4.27640e+00  -6.81377e-02 0.00000e+00 0.00000e+00 1.77258e+00 359.087 9.52250e+01 179.087 0.8734 
1 1 1 -2  52  16 o 9  3.01654e+00 9.39034e-01 4.19829e+01 56.242  1.07886e+00  1.61413e+00  0.00000e+00 0.00000e+00 3.50187e+01 56.242  6.96422e+00 236.242 0.6879 
1 1 1 -2  52  17 o 7  8.69865e+00 7.00048e-01 1.16100e+02 309.955 1.50100e+01  -1.79169e+01 0.00000e+00 0.00000e+00 1.99350e+02 309.955 8.32506e+01 309.955 0.9784 
1 1 1 -2  52  18 o 10 5.12659e+00 1.65588e+00 4.72939e+01 194.512 -3.05894e+00 -7.91792e-01 0.00000e+00 0.00000e+00 1.08561e+02 194.512 6.12670e+01 194.512 0.8211 
1 1 1 -2  53  1  o 4  4.37480e+01 6.29578e-01 8.11399e+02 147.903 -5.23003e+01 3.28041e+01  0.00000e+00 0.00000e+00 8.13054e+02 147.903 1.65467e+00 147.903 0.9919 
1 1 1 -2  53  2  o 1  3.51224e+01 6.05755e-01 7.79847e+02 343.885 4.45544e+01  -1.28723e+01 0.00000e+00 0.00000e+00 5.20536e+02 343.885 2.59311e+02 163.885 0.9892 
1 1 1 -2  53  3  o 9  1.58073e+01 3.42797e-01 2.66933e+02 280.536 1.62123e+00  -8.71676e+00 0.00000e+00 0.00000e+00 2.90166e+02 280.536 2.32331e+01 280.536 0.9418 
1 1 1 -2  53  4  o 19 4.35745e+01 6.30984e-01 7.54682e+02 359.874 7.25019e+01  -1.59349e-01 0.00000e+00 0.00000e+00 8.64173e+02 359.874 1.09491e+02 359.874 0.9931 
1 1 1 -2  53  5  o 16 2.35211e+01 4.13723e-01 4.61316e+02 62.705  1.33529e+01  2.58767e+01  0.00000e+00 0.00000e+00 4.03063e+02 62.705  5.82533e+01 242.705 0.9827 
1 1 1 -2  53  6  o 9  2.79155e+01 4.58629e-01 5.36217e+02 257.680 -9.66069e+00 -4.42332e+01 0.00000e+00 0.00000e+00 4.95716e+02 257.680 4.05009e+01 77.680  0.9889 
1 1 1 -2  53  7  o 3  1.56539e+01 3.79571e-01 2.75843e+02 106.230 -4.00694e+00 1.37652e+01  0.00000e+00 0.00000e+00 2.88259e+02 106.230 1.24168e+01 106.230 0.9645 
1 1 1 -2  53  8  o 15 1.38566e+01 3.93033e-01 3.04445e+02 77.735  3.85930e+00  1.77524e+01  0.00000e+00 0.00000e+00 1.98558e+02 77.735  1.05887e+02 257.735 0.9721 
1 1 1 -2  53  9  o 5  2.12223e+01 4.37581e-01 3.54301e+02 265.990 -3.18098e+00 -4.53748e+01 0.00000e+00 0.00000e+00 4.28983e+02 265.990 7.46821e+01 265.990 0.9889 
1 1 1 -2  53  10 o 1  1.36214e+01 4.28972e-01 1.87331e+02 2.754   1.93723e+01  9.31761e-01  0.00000e+00 0.00000e+00 3.07421e+02 2.754   1.20089e+02 2.754   0.9739 
1 1 1 -2  53  11 o 9  1.40560e+01 5.07613e-01 2.48570e+02 171.815 -3.03696e+01 4.36822e+00  0.00000e+00 0.00000e+00 2.66680e+02 171.815 1.81100e+01 171.815 0.9836 
1 1 1 -2  53  12 o 14 1.28111e+01 5.42276e-01 1.80543e+02 278.046 3.61475e+00  -2.55709e+01 0.00000e+00 0.00000e+00 2.87217e+02 278.046 1.06674e+02 278.046 0.9804 
1 1 1 -2  53  13 o 15 1.74250e+01 5.58548e-01 3.26729e+02 112.291 -2.70413e+01 6.59638e+01  0.00000e+00 0.00000e+00 3.17069e+02 112.291 9.66008e+00 292.291 0.9930 
1 1 1 -2  53  14 o 6  5.36231e+00 9.19170e-01 9.98070e+01 166.082 -6.65718e+00 1.64966e+00  0.00000e+00 0.00000e+00 8.43710e+01 166.082 1.54359e+01 346.082 0.9239 
1 1 1 -2  53  15 o 8  1.42137e+01 6.80561e-01 1.91316e+02 311.409 3.17014e+01  -3.59463e+01 0.00000e+00 0.00000e+00 3.31035e+02 311.409 1.39719e+02 311.409 0.9895 
1 1 1 -2  53  16 o 6  2.72632e+00 8.44898e-01 7.90689e+01 303.044 2.04240e+00  -3.13977e+00 0.00000e+00 0.00000e+00 7.20898e+00 303.044 7.18599e+01 123.044 0.8530 
1 1 1 -2  53  17 o 3  5.62748e+00 9.74593e-01 1.47652e+02 80.240  2.59303e+00  1.50742e+01  0.00000e+00 0.00000e+00 5.39695e+01 80.240  9.36823e+01 260.240 0.9667 
1 1 1 -2  53  18 o 9  5.07199e+00 1.63706e+00 1.09945e+02 220.059 -5.37470e+00 -4.51931e+00 0.00000e+00 0.00000e+00 6.38748e+01 220.059 4.60705e+01 40.059  0.9258 
1 1 1 -2  54  1  o 6  2.78978e+01 4.47466e-01 4.85986e+02 256.721 -5.35237e+00 -2.26789e+01 0.00000e+00 0.00000e+00 5.35598e+02 256.721 4.96115e+01 256.721 0.9783 
1 1 1 -2  54  2  o 10 2.28176e+01 5.02528e-01 5.95341e+02 96.793  -3.36845e+00 2.82777e+01  0.00000e+00 0.00000e+00 2.43468e+02 96.793  3.51873e+02 276.793 0.9823 
1 1 1 -2  54  3  o 12 4.02771e+01 5.90202e-01 7.12015e+02 67.595  2.36828e+01  5.74450e+01  0.00000e+00 0.00000e+00 7.82808e+02 67.595  7.07931e+01 67.595  0.9919 
1 1 1 -2  54  4  o 4  2.20129e+01 4.21344e-01 4.82883e+02 85.070  2.23815e+00  2.59480e+01  0.00000e+00 0.00000e+00 3.24540e+02 85.070  1.58344e+02 265.070 0.9806 
1 1 1 -2  54  5  o 14 2.83272e+01 4.60487e-01 4.39953e+02 251.215 -1.04814e+01 -3.08151e+01 0.00000e+00 0.00000e+00 6.02842e+02 251.215 1.62889e+02 251.215 0.9845 
1 1 1 -2  54  6  o 4  2.34334e+01 4.21695e-01 5.20683e+02 242.751 -1.60593e+01 -3.11824e+01 0.00000e+00 0.00000e+00 3.42585e+02 242.751 1.78098e+02 62.751  0.9856 
1 1 1 -2  54  7  o 14 2.13581e+01 4.08776e-01 3.56379e+02 7.335   2.69940e+01  3.47498e+00  0.00000e+00 0.00000e+00 4.26719e+02 7.335   7.03396e+01 7.335   0.9815 
1 1 1 -2  54  8  o 8  3.03924e+01 5.01387e-01 5.78518e+02 114.776 -3.39893e+01 7.36420e+01  0.00000e+00 0.00000e+00 5.49255e+02 114.776 2.92627e+01 294.776 0.9938 
1 1 1 -2  54  9  o 15 8.55606e+00 4.67194e-01 1.10477e+02 6.122   5.42462e+00  5.81808e-01  0.00000e+00 0.00000e+00 1.77821e+02 6.122   6.73446e+01 6.122   0.9030 
1 1 1 -2  54  10 o 16 1.18251e+01 4.36697e-01 2.05170e+02 205.964 -1.66228e+01 -8.09463e+00 0.00000e+00 0.00000e+00 2.23703e+02 205.964 1.85326e+01 205.964 0.9726 
1 1 1 -2  54  11 o 8  2.04043e+01 5.52825e-01 3.84303e+02 211.377 -6.13622e+01 -3.74212e+01 0.00000e+00 0.00000e+00 3.70736e+02 211.377 1.35666e+01 31.377  0.9930 
1 1 1 -2  54  12 o 2  1.07447e+01 5.64654e-01 2.15855e+02 48.059  1.65721e+01  1.84435e+01  0.00000e+00 0.00000e+00 1.76070e+02 48.059  3.97850e+01 228.059 0.9796 
1 1 1 -2  54  13 o 12 1.05605e+01 6.44092e-01 2.07482e+02 164.573 -2.83444e+01 7.82179e+00  0.00000e+00 0.00000e+00 1.78666e+02 164.573 2.88166e+01 344.573 0.9828 
1 1 1 -2  54  14 o 14 9.67655e+00 7.18525e-01 1.90208e+02 75.606  7.25258e+00  2.82591e+01  0.00000e+00 0.00000e+00 1.63248e+02 75.606  2.69604e+01 255.606 0.9827 
1 1 1 -2  54  15 o 1  9.32093e+00 7.21411e-01 1.27694e+02 171.621 -1.90572e+01 2.80705e+00  0.00000e+00 0.00000e+00 2.09320e+02 171.621 8.16253e+01 171.621 0.9737 
1 1 1 -2  54  16 o 3  4.85890e+00 9.78916e-01 8.45520e+01 105.747 -1.88712e+00 6.69266e+00  0.00000e+00 0.00000e+00 8.21757e+01 105.747 2.37628e+00 285.747 0.9250 
1 1 1 -2  54  17 o 13 4.91092e+00 1.05901e+00 5.68023e+01 334.297 4.33582e+00  -2.08699e+00 0.00000e+00 0.00000e+00 1.04943e+02 334.297 4.81408e+01 334.297 0.8888 
1 1 1 -2  54  18 o 10 6.11567e+00 1.56580e+00 1.06959e+02 237.296 -4.91364e+00 -7.65268e+00 0.00000e+00 0.00000e+00 1.06565e+02 237.296 3.93617e-01 57.296  0.9433 
1 1 1 -2  55  1  o 18 3.61140e+01 5.40856e-01 6.35717e+02 95.739  -4.79764e+00 4.77411e+01  0.00000e+00 0.00000e+00 7.01706e+02 95.739  6.59887e+01 95.739  0.9895 
1 1 1 -2  55  2  o 13 1.94189e+01 4.23271e-01 3.95089e+02 157.167 -1.47840e+01 6.22455e+00  0.00000e+00 0.00000e+00 3.08519e+02 157.167 8.65691e+01 337.167 0.9683 
1 1 1 -2  55  3  o 17 4.44822e+01 6.41279e-01 6.56653e+02 334.519 5.80947e+01  -2.76859e+01 0.00000e+00 0.00000e+00 9.94457e+02 334.519 3.37804e+02 334.519 0.9922 
1 1 1 -2  55  4  o 19 1.87586e+01 3.96547e-01 3.77262e+02 241.003 -8.26443e+00 -1.49112e+01 0.00000e+00 0.00000e+00 3.03400e+02 241.003 7.38620e+01 61.003  0.9702 
1 1 1 -2  55  5  o 2  3.10318e+01 4.92315e-01 5.95591e+02 323.717 4.18215e+01  -3.07021e+01 0.00000e+00 0.00000e+00 5.53326e+02 323.717 4.22654e+01 143.717 0.9903 
1 1 1 -2  55  6  o 12 2.95290e+01 4.80805e-01 5.15239e+02 127.966 -2.91466e+01 3.73520e+01  0.00000e+00 0.00000e+00 5.76562e+02 127.966 6.13230e+01 127.966 0.9894 
1 1 1 -2  55  7  o 15 1.24721e+01 3.81212e-01 2.73172e+02 274.169 8.59912e-01  -1.17984e+01 0.00000e+00 0.00000e+00 1.72546e+02 274.169 1.00625e+02 94.169  0.9568 
1 1 1 -2  55  8  o 10 1.11310e+01 4.26776e-01 1.12466e+02 145.442 -5.04092e+00 3.47207e+00  0.00000e+00 0.00000e+00 2.67427e+02 145.442 1.54961e+02 145.442 0.9142 
1 1 1 -2  55  9  o 12 1.49679e+01 4.18406e-01 2.99382e+02 321.295 2.03906e+01  -1.63386e+01 0.00000e+00 0.00000e+00 2.48276e+02 321.295 5.11065e+01 141.295 0.9807 
1 1 1 -2  55  10 o 6  1.23253e+01 4.97667e-01 2.67668e+02 312.616 1.65141e+01  -1.79488e+01 0.00000e+00 0.00000e+00 1.82363e+02 312.616 8.53041e+01 132.616 0.9793 
1 1 1 -2  55  11 o 19 7.72161e+00 6.15998e-01 1.79635e+02 268.848 -2.51859e-01 -1.25257e+01 0.00000e+00 0.00000e+00 9.63275e+01 268.848 8.33079e+01 88.848  0.9592 
1 1 1 -2  55  12 o 6  5.38727e+00 7.88653e-01 6.37180e+01 187.196 -3.61504e+00 -4.56401e-01 0.00000e+00 0.00000e+00 1.06415e+02 187.196 4.26969e+01 187.196 0.8483 
1 1 1 -2  55  13 o 18 6.37757e+00 8.24237e-01 9.06868e+01 97.990  -1.03566e+00 7.37877e+00  0.00000e+00 0.00000e+00 1.29998e+02 97.990  3.93108e+01 97.990  0.9302 
1 1 1 -2  55  14 o 15 1.08619e+01 7.13750e-01 1.94331e+02 247.259 -1.27156e+01 -3.03366e+01 0.00000e+00 0.00000e+00 2.03158e+02 247.259 8.82733e+00 247.259 0.9847 
1 1 1 -2  55  15 o 5  6.99889e+00 8.38373e-01 9.32159e+01 250.972 -3.51730e+00 -1.01986e+01 0.00000e+00 0.00000e+00 1.54287e+02 250.972 6.10713e+01 250.972 0.9525 
1 1 1 -2  55  16 o 4  4.04126e+00 1.00440e+00 1.23299e+02 15.860  7.35194e+00  2.08864e+00  0.00000e+00 0.00000e+00 1.64102e+01 15.860  1.06889e+02 195.859 0.9321 
1 1 1 -2  55  17 o 1  4.71855e+00 1.05586e+00 3.83595e+01 163.363 -3.19839e+00 9.55747e-01  0.00000e+00 0.00000e+00 1.07123e+02 163.363 6.87637e+01 163.363 0.8322 
1 1 1 -2  55  18 f 0  4.04379e+00 1.34806e+00 6.62267e+01 67.289  1.70411e+00  4.07155e+00  0.00000e+00 0.00000e+00 6.51267e+01 67.289  1.10001e+00 247.289 0.8777 
1 1 1 -2  56  1  o 14 3.08767e+01 4.83377e-01 5.75601e+02 290.003 1.26655e+01  -3.47931e+01 0.00000e+00 0.00000e+00 5.64085e+02 290.003 1.15165e+01 110.003 0.9864 
1 1 1 -2  56  2  o 8  1.70292e+01 4.14822e-01 2.18273e+02 75.834  1.97658e+00  7.83072e+00  0.00000e+00 0.00000e+00 3.77990e+02 75.834  1.59717e+02 75.834  0.9359 
1 1 1 -2  56  3  o 15 2.87852e+01 4.60693e-01 6.17758e+02 288.730 1.39625e+01  -4.11797e+01 0.00000e+00 0.00000e+00 4.46487e+02 288.730 1.71271e+02 108.730 0.9884 
1 1 1 -2  56  4  o 14 1.38373e+01 4.71886e-01 6.49152e+01 328.440 2.00184e+00  -1.22962e+00 0.00000e+00 0.00000e+00 3.21895e+02 328.440 2.56979e+02 328.440 0.7476 
1 1 1 -2  56  5  o 9  2.64960e+01 4.47286e-01 5.24862e+02 61.442  2.01357e+01  3.69953e+01  0.00000e+00 0.00000e+00 4.53735e+02 61.442  7.11269e+01 241.441 0.9881 
1 1 1 -2  56  6  o 15 4.15478e+01 6.17020e-01 7.36287e+02 50.720  6.14838e+01  7.51731e+01  0.00000e+00 0.00000e+00 8.08120e+02 50.720  7.18335e+01 50.720  0.9948 
1 1 1 -2  56  7  o 4  1.33042e+01 3.85509e-01 2.83806e+02 251.373 -5.24020e+00 -1.55469e+01 0.00000e+00 0.00000e+00 1.97673e+02 251.373 8.61330e+01 71.373  0.9690 
1 1 1 -2  56  8  o 4  7.75910e+00 4.59349e-01 8.03102e+01 163.620 -2.83904e+00 8.34476e-01  0.00000e+00 0.00000e+00 1.53391e+02 163.620 7.30808e+01 163.620 0.8069 
1 1 1 -2  56  9  o 17 1.75232e+01 4.24982e-01 3.69949e+02 355.542 4.10297e+01  -3.19895e+00 0.00000e+00 0.00000e+00 2.75751e+02 355.542 9.41979e+01 175.542 0.9878 
1 1 1 -2  56  10 o 7  1.02921e+01 5.25749e-01 2.51939e+02 190.018 -2.15541e+01 -3.80757e+00 0.00000e+00 0.00000e+00 1.22878e+02 190.018 1.29061e+02 10.018  0.9769 
1 1 1 -2  56  11 o 7  8.06777e+00 6.02487e-01 1.39421e+02 115.718 -4.66261e+00 9.68047e+00  0.00000e+00 0.00000e+00 1.46778e+02 115.718 7.35744e+00 115.718 0.9523 
1 1 1 -2  56  12 o 5  5.43230e+00 8.32900e-01 9.42090e+01 204.929 -4.93806e+00 -2.29525e+00 0.00000e+00 0.00000e+00 8.83420e+01 204.929 5.86702e+00 24.929  0.9028 
1 1 1 -2  56  13 o 14 4.90993e+00 9.16205e-01 1.66792e+02 48.186  6.80254e+00  7.60442e+00  0.00000e+00 0.00000e+00 6.62439e+00 48.186  1.60168e+02 228.186 0.9497 
1 1 1 -2  56  14 o 19 3.66134e+00 8.97420e-01 1.01673e+02 264.410 -5.16072e-01 -5.27265e+00 0.00000e+00 0.00000e+00 2.07527e+01 264.410 8.09203e+01 84.410  0.8999 
1 1 1 -2  56  15 o 18 2.88344e+00 8.39193e-01 3.77373e+01 206.977 -1.63632e+00 -8.32930e-01 0.00000e+00 0.00000e+00 3.38664e+01 206.977 3.87092e+00 26.977  0.6689 
1 1 1 -2  56  16 o 4  2.94302e+00 8.99117e-01 9.00468e+01 180.947 -4.55249e+00 -7.52150e-02 0.00000e+00 0.00000e+00 6.20104e+00 180.947 8.38457e+01 0.947   0.8819 
1 1 1 -2  56  17 o 5  3.95206e+00 1.02981e+00 4.62057e+01 306.001 2.01103e+00  -2.76782e+00 0.00000e+00 0.00000e+00 7.63145e+01 306.001 3.01088e+01 306.001 0.8369 
1 1 1 -2  56  18 o 2  3.49913e+00 1.16980e+00 6.90387e+01 231.425 -2.85366e+00 -3.57788e+00 0.00000e+00 0.00000e+00 4.52260e+01 231.425 2.38127e+01 51.425  0.8825 
1 1 1 -2  57  1  o 1  1.30799e+01 3.56919e-01 2.23158e+02 53.160  3.90452e+00  5.21161e+00  0.00000e+00 0.00000e+00 2.26888e+02 53.160  3.73062e+00 53.160  0.9196 
1 1 1 -2  57  2  o 17 3.42409e+01 5.61532e-01 5.48630e+02 282.919 1.02456e+01  -4.46663e+01 0.00000e+00 0.00000e+00 7.18184e+02 282.919 1.69554e+02 282.919 0.9890 
1 1 1 -2  57  3  o 9  2.23425e+01 4.00361e-01 4.77980e+02 323.155 2.05753e+01  -1.54175e+01 0.00000e+00 0.00000e+00 3.41187e+02 323.155 1.36794e+02 143.155 0.9804 
1 1 1 -2  57  4  o 16 2.26309e+01 4.68830e-01 5.12069e+02 219.699 -2.44812e+01 -2.03237e+01 0.00000e+00 0.00000e+00 3.20646e+02 219.699 1.91423e+02 39.699  0.9842 
1 1 1 -2  57  5  o 2  2.46973e+01 4.34003e-01 4.76527e+02 109.004 -1.10151e+01 3.19821e+01  0.00000e+00 0.00000e+00 4.32773e+02 109.004 4.37535e+01 289.004 0.9851 
1 1 1 -2  57  6  o 16 1.85502e+01 4.00245e-01 3.05746e+02 7.506   1.86136e+01  2.45255e+00  0.00000e+00 0.00000e+00 3.68551e+02 7.506   6.28048e+01 7.506   0.9730 
1 1 1 -2  57  7  o 11 8.36247e+00 4.66452e-01 8.10720e+01 269.476 -2.66202e-02 -2.90868e+00 0.00000e+00 0.00000e+00 1.69678e+02 269.476 8.86064e+01 269.476 0.8030 
1 1 1 -2  57  8  o 18 6.05148e+00 5.05035e-01 8.13242e+01 270.400 1.87823e-02  -2.68810e+00 0.00000e+00 0.00000e+00 9.57405e+01 270.400 1.44163e+01 270.400 0.7840 
1 1 1 -2  57  9  o 1  1.88388e+01 4.92852e-01 3.42896e+02 177.769 -4.46091e+01 1.73784e+00  0.00000e+00 0.00000e+00 3.51849e+02 177.769 8.95271e+00 177.769 0.9887 
1 1 1 -2  57  10 o 9  5.80724e+00 7.08736e-01 7.47552e+01 103.543 -7.81374e-01 3.24400e+00  0.00000e+00 0.00000e+00 1.05360e+02 103.543 3.06048e+01 103.543 0.8321 
1 1 1 -2  57  11 o 18 8.30999e+00 6.06779e-01 1.48533e+02 170.324 -1.17696e+01 2.00669e+00  0.00000e+00 0.00000e+00 1.47729e+02 170.324 8.04706e-01 350.324 0.9572 
1 1 1 -2  57  12 o 13 1.31064e+01 6.13258e-01 2.12300e+02 337.374 3.05809e+01  -1.27457e+01 0.00000e+00 0.00000e+00 2.68072e+02 337.374 5.57712e+01 337.374 0.9848 
1 1 1 -2  57  13 o 17 3.45013e+00 8.28935e-01 2.42713e+01 225.844 -7.79710e-01 -8.03013e-01 0.00000e+00 0.00000e+00 3.82173e+01 225.844 1.39460e+01 225.844 0.4871 
1 1 1 -2  57  14 o 8  1.69859e+01 5.92776e-01 2.59000e+02 211.165 -6.11512e+01 -3.69831e+01 0.00000e+00 0.00000e+00 3.67643e+02 211.165 1.08642e+02 211.165 0.9930 
1 1 1 -2  57  15 f 0  8.32454e+00 8.23326e-01 2.08763e+02 350.904 2.75607e+01  -4.41260e+00 0.00000e+00 0.00000e+00 9.46309e+01 350.904 1.14132e+02 170.904 0.9819 
1 1 1 -2  57  16 o 5  1.07314e+01 7.67746e-01 2.17400e+02 140.210 -3.43286e+01 2.85909e+01  0.00000e+00 0.00000e+00 1.76027e+02 140.210 4.13728e+01 320.210 0.9887 
1 1 1 -2  57  17 o 14 3.45809e+00 9.72932e-01 2.02286e+01 257.083 -2.98731e-01 -1.30257e+00 0.00000e+00 0.00000e+00 5.06020e+01 257.083 3.03734e+01 257.083 0.5530 
1 1 1 -2  57  18 o 15 4.43557e+00 1.43196e+00 6.92666e+01 173.937 -4.73784e+00 5.03261e-01  0.00000e+00 0.00000e+00 7.63892e+01 173.937 7.12256e+00 173.937 0.8876 
1 1 1 -2  58  1  o 17 1.67664e+01 3.89765e-01 2.68395e+02 327.408 9.30213e+00  -5.94703e+00 0.00000e+00 0.00000e+00 3.29687e+02 327.408 6.12927e+01 327.408 0.9536 
1 1 1 -2  58  2  o 9  9.82629e+00 4.08916e-01 1.33712e+02 308.479 1.97078e+00  -2.47945e+00 0.00000e+00 0.00000e+00 1.68252e+02 308.479 3.45404e+01 308.479 0.8216 
1 1 1 -2  58  3  o 4  1.71433e+01 3.66743e-01 3.33278e+02 289.258 4.94746e+00  -1.41609e+01 0.00000e+00 0.00000e+00 2.86009e+02 289.258 4.72693e+01 109.258 0.9661 
1 1 1 -2  58  4  o 18 7.22582e+00 4.67332e-01 3.40167e+01 44.217  4.93608e-01  4.80304e-01  0.00000e+00 0.00000e+00 5.38884e+01 44.217  1.98717e+01 44.217  0.3254 
1 1 1 -2  58  5  o 5  3.30851e+01 5.18655e-01 7.22914e+02 237.107 -4.03596e+01 -6.24041e+01 0.00000e+00 0.00000e+00 5.05083e+02 237.107 2.17832e+02 57.107  0.9932 
1 1 1 -2  58  6  o 15 4.76214e+01 6.92950e-01 8.10416e+02 351.885 1.30204e+02  -1.85648e+01 0.00000e+00 0.00000e+00 9.61608e+02 351.885 1.51192e+02 351.885 0.9962 
1 1 1 -2  58  7  o 3  1.39647e+01 4.05410e-01 3.03389e+02 180.263 -1.87661e+01 -8.60707e-02 0.00000e+00 0.00000e+00 2.03896e+02 180.263 9.94931e+01 0.263   0.9730 
1 1 1 -2  58  8  o 11 7.43020e+00 4.86603e-01 7.97803e+01 256.528 -8.30084e-01 -3.46514e+00 0.00000e+00 0.00000e+00 1.54319e+02 256.528 7.45387e+01 256.528 0.8443 
1 1 1 -2  58  9  o 8  1.12010e+01 4.98349e-01 1.30835e+02 37.406  8.29404e+00  6.34268e+00  0.00000e+00 0.00000e+00 2.66343e+02 37.406  1.35508e+02 37.406  0.9508 
1 1 1 -2  58  10 o 19 1.14757e+01 5.19816e-01 3.08812e+02 9.298   3.02983e+01  4.96037e+00  0.00000e+00 0.00000e+00 1.11840e+02 9.298   1.96972e+02 189.298 0.9836 
1 1 1 -2  58  11 o 5  2.93255e+00 7.80835e-01 4.42318e+01 198.383 -1.25729e+00 -4.17827e-01 0.00000e+00 0.00000e+00 1.58098e+01 198.383 2.84220e+01 18.383  0.5498 
1 1 1 -2  58  12 o 9  9.56476e+00 6.70104e-01 2.29041e+02 70.062  9.65929e+00  2.66287e+01  0.00000e+00 0.00000e+00 1.20542e+02 70.062  1.08498e+02 250.062 0.9822 
1 1 1 -2  58  13 o 18 8.61632e+00 8.29491e-01 1.39929e+02 249.936 -5.43663e+00 -1.48855e+01 0.00000e+00 0.00000e+00 1.70152e+02 249.936 3.02234e+01 249.936 0.9679 
1 1 1 -2  58  14 o 12 4.80706e+00 9.25007e-01 1.04009e+02 170.751 -7.23873e+00 1.17878e+00  0.00000e+00 0.00000e+00 6.18952e+01 170.751 4.21136e+01 350.751 0.9291 
1 1 1 -2  58  15 o 13 8.19170e+00 8.26971e-01 1.68502e+02 57.071  1.36839e+01  2.11283e+01  0.00000e+00 0.00000e+00 1.29399e+02 57.071  3.91029e+01 237.070 0.9799 
1 1 1 -2  58  16 o 8  9.86598e+00 8.13196e-01 1.97047e+02 260.267 -6.22278e+00 -3.62783e+01 0.00000e+00 0.00000e+00 1.63710e+02 260.267 3.33375e+01 80.267  0.9863 
1 1 1 -2  58  17 o 10 3.61595e+00 1.05202e+00 1.15205e+02 54.668  4.38974e+00  6.19254e+00  0.00000e+00 0.00000e+00 9.54135e+00 54.668  1.05664e+02 234.668 0.9316 
1 1 1 -2  58  18 o 2  3.83427e+00 1.14588e+00 7.72448e+01 246.834 -2.34368e+00 -5.47732e+00 0.00000e+00 0.00000e+00 5.20606e+01 246.834 2.51842e+01 66.834  0.9117 
1 1 1 -2  59  1  o 6  7.83355e+00 3.75373e-01 2.51444e+02 157.858 -4.39742e+00 1.78939e+00  0.00000e+00 0.00000e+00 8.49139e+00 157.858 2.42953e+02 337.858 0.8872 
1 1 1 -2  59  2  o 5  2.26867e+01 4.09927e-01 4.63416e+02 225.456 -1.97630e+01 -2.00803e+01 0.00000e+00 0.00000e+00 3.69772e+02 225.456 9.36449e+01 45.456  0.9821 
1 1 1 -2  59  3  o 1  1.97594e+01 3.87066e-01 4.42900e+02 320.535 1.86023e+01  -1.53153e+01 0.00000e+00 0.00000e+00 2.80346e+02 320.535 1.62554e+02 140.535 0.9790 
1 1 1 -2  59  4  o 10 2.62021e+01 5.09794e-01 3.90104e+02 144.607 -2.39216e+01 1.69957e+01  0.00000e+00 0.00000e+00 5.72386e+02 144.607 1.82283e+02 144.607 0.9828 
1 1 1 -2  59  5  f 0  2.20328e+01 4.17481e-01 3.75843e+02 299.796 1.32205e+01  -2.30880e+01 0.00000e+00 0.00000e+00 4.31736e+02 299.796 5.58925e+01 299.796 0.9810 
1 1 1 -2  59  6  o 7  1.16723e+01 3.86460e-01 2.92358e+02 6.274   1.33879e+01  1.47194e+00  0.00000e+00 0.00000e+00 1.27059e+02 6.274   1.65300e+02 186.274 0.9621 
1 1 1 -2  59  7  o 17 1.72453e+01 4.25891e-01 2.41080e+02 289.438 6.76778e+00  -1.91775e+01 0.00000e+00 0.00000e+00 3.86642e+02 289.438 1.45563e+02 289.438 0.9751 
1 1 1 -2  59  8  o 9  1.94042e+01 4.80319e-01 2.43367e+02 268.196 -8.55102e-01 -2.71515e+01 0.00000e+00 0.00000e+00 4.67132e+02 268.196 2.23765e+02 268.196 0.9814 
1 1 1 -2  59  9  o 15 1.58237e+01 4.91845e-01 1.90913e+02 52.918  1.37929e+01  1.82496e+01  0.00000e+00 0.00000e+00 3.86055e+02 52.918  1.95142e+02 52.918  0.9779 
1 1 1 -2  59  10 o 15 5.83524e+00 7.02479e-01 4.20915e+01 314.185 1.52422e+00  -1.56823e+00 0.00000e+00 0.00000e+00 1.15808e+02 314.185 7.37168e+01 314.185 0.7262 
1 1 1 -2  59  11 o 4  6.00431e+00 7.12240e-01 6.78959e+01 252.647 -1.24235e+00 -3.97580e+00 0.00000e+00 0.00000e+00 1.26520e+02 252.647 5.86242e+01 252.647 0.8696 
1 1 1 -2  59  12 o 8  2.76511e+00 8.12308e-01 7.15973e+01 145.431 -1.99897e+00 1.37738e+00  0.00000e+00 0.00000e+00 6.26952e+00 145.431 6.53277e+01 325.431 0.7569 
1 1 1 -2  59  13 o 9  2.64184e+00 8.09398e-01 1.29942e+02 323.488 3.85839e+00  -2.85632e+00 0.00000e+00 0.00000e+00 4.26788e+01 143.488 1.72621e+02 143.488 0.8885 
1 1 1 -2  59  14 o 16 1.17708e+01 6.49472e-01 2.02029e+02 80.551  6.02393e+00  3.61937e+01  0.00000e+00 0.00000e+00 2.29150e+02 80.551  2.71213e+01 80.551  0.9863 
1 1 1 -2  59  15 o 15 1.82624e+01 7.06426e-01 2.43437e+02 247.287 -3.12575e+01 -7.46778e+01 0.00000e+00 0.00000e+00 4.29992e+02 247.287 1.86554e+02 247.287 0.9938 
1 1 1 -2  59  16 o 10 5.29770e+00 1.14533e+00 1.02962e+02 115.816 -3.70741e+00 7.66373e+00  0.00000e+00 0.00000e+00 8.14859e+01 115.816 2.14762e+01 295.816 0.9393 
1 1 1 -2  59  17 o 13 7.72566e+00 1.04972e+00 8.33615e+01 110.467 -4.32742e+00 1.15947e+01  0.00000e+00 0.00000e+00 1.90881e+02 110.467 1.07520e+02 110.467 0.9587 
1 1 1 -2  59  18 o 19 3.17400e+00 1.07068e+00 5.42715e+01 279.822 6.80432e-01  -3.93035e+00 0.00000e+00 0.00000e+00 4.70445e+01 279.822 7.22702e+00 99.822  0.8631 
1 1 1 -2  60  1  o 1  3.07193e+00 6.00869e-01 2.14989e+02 231.950 -1.05703e+00 -1.35050e+00 0.00000e+00 0.00000e+00 1.40897e+02 51.950  3.55886e+02 51.950  0.6450 
1 1 1 -2  60  2  o 14 2.51453e+01 4.32393e-01 5.09388e+02 69.045  1.26052e+01  3.29156e+01  0.00000e+00 0.00000e+00 4.17347e+02 69.045  9.20417e+01 249.045 0.9857 
1 1 1 -2  60  3  o 11 1.84886e+01 3.80081e-01 3.99306e+02 181.823 -2.24552e+01 -7.14569e-01 0.00000e+00 0.00000e+00 2.76253e+02 181.823 1.23053e+02 1.823   0.9775 
1 1 1 -2  60  4  o 16 3.14414e+01 5.37122e-01 5.03344e+02 236.275 -2.82089e+01 -4.22568e+01 0.00000e+00 0.00000e+00 6.59994e+02 236.275 1.56649e+02 236.275 0.9901 
1 1 1 -2  60  5  o 16 3.77106e+01 5.74187e-01 6.35569e+02 257.007 -1.76423e+01 -7.64591e+01 0.00000e+00 0.00000e+00 7.64162e+02 257.007 1.28593e+02 257.007 0.9936 
1 1 1 -2  60  6  o 18 2.51965e+01 4.47821e-01 3.82872e+02 88.991  7.32529e-01  4.15939e+01  0.00000e+00 0.00000e+00 5.46611e+02 88.991  1.63740e+02 88.991  0.9879 
1 1 1 -2  60  7  o 2  1.91466e+01 4.10719e-01 2.78064e+02 206.090 -2.27938e+01 -1.11618e+01 0.00000e+00 0.00000e+00 4.22322e+02 206.090 1.44258e+02 206.090 0.9801 
1 1 1 -2  60  8  o 2  1.48538e+01 4.65652e-01 2.50664e+02 196.068 -2.21674e+01 -6.38494e+00 0.00000e+00 0.00000e+00 2.91282e+02 196.068 4.06185e+01 196.068 0.9781 
1 1 1 -2  60  9  o 18 8.38938e+00 5.35400e-01 1.71552e+02 319.812 8.09116e+00  -6.83465e+00 0.00000e+00 0.00000e+00 1.26057e+02 319.812 4.54952e+01 139.812 0.9516 
1 1 1 -2  60  10 o 18 9.07424e+00 5.21667e-01 1.62046e+02 190.456 -1.33165e+01 -2.45749e+00 0.00000e+00 0.00000e+00 1.63290e+02 190.456 1.24412e+00 190.456 0.9623 
1 1 1 -2  60  11 o 16 1.32501e+01 5.47182e-01 2.79996e+02 63.680  1.76714e+01  3.57239e+01  0.00000e+00 0.00000e+00 2.07066e+02 63.680  7.29293e+01 243.680 0.9874 
1 1 1 -2  60  12 o 1  7.98123e+00 7.31717e-01 1.51630e+02 250.914 -4.70850e+00 -1.36079e+01 0.00000e+00 0.00000e+00 1.34768e+02 250.914 1.68616e+01 70.914  0.9646 
1 1 1 -2  60  13 o 6  7.56446e+00 7.46381e-01 1.47827e+02 147.589 -1.30014e+01 8.25444e+00  0.00000e+00 0.00000e+00 1.24045e+02 147.589 2.37821e+01 327.589 0.9670 
1 1 1 -2  60  14 o 11 2.52013e+00 8.01771e-01 7.95913e+01 299.602 1.49534e+00  -2.63201e+00 0.00000e+00 0.00000e+00 3.60343e+00 119.603 8.31947e+01 119.603 0.8120 
1 1 1 -2  60  15 o 18 3.04851e+00 9.15309e-01 1.22130e+02 260.178 -1.05834e+00 -6.11308e+00 0.00000e+00 0.00000e+00 1.85998e+01 80.178  1.40730e+02 80.178  0.9154 
1 1 1 -2  60  16 o 5  9.38152e+00 9.15278e-01 8.94043e+01 24.083  1.43761e+01  6.42576e+00  0.00000e+00 0.00000e+00 2.47055e+02 24.083  1.57651e+02 24.083  0.9677 
1 1 1 -2  60  17 f 0  4.83126e+00 1.13190e+00 7.70124e+01 238.157 -3.73599e+00 -6.01557e+00 0.00000e+00 0.00000e+00 8.86847e+01 238.157 1.16724e+01 238.157 0.9264 
1 1 1 -2  60  18 o 16 2.80017e+00 9.22308e-01 2.64158e+01 31.013  1.60568e+00  9.65296e-01  0.00000e+00 0.00000e+00 4.35665e+01 31.013  1.71508e+01 31.013  0.6759 
1 1 1 -2  61  1  o 18 1.92312e+01 3.84299e-01 2.66479e+02 172.794 -1.39991e+01 1.77006e+00  0.00000e+00 0.00000e+00 4.26604e+02 172.794 1.60126e+02 172.794 0.9639 
1 1 1 -2  61  2  o 15 1.94039e+01 3.86998e-01 2.44014e+02 230.218 -8.52252e+00 -1.02356e+01 0.00000e+00 0.00000e+00 4.53582e+02 230.218 2.09568e+02 230.218 0.9617 
1 1 1 -2  61  3  o 16 2.99307e+01 4.83764e-01 5.07762e+02 214.935 -3.57600e+01 -2.49793e+01 0.00000e+00 0.00000e+00 5.97987e+02 214.935 9.02258e+01 214.935 0.9885 
1 1 1 -2  61  4  o 15 3.13322e+01 5.01524e-01 5.37494e+02 304.003 3.01864e+01  -4.47484e+01 0.00000e+00 0.00000e+00 6.22293e+02 304.003 8.47998e+01 304.003 0.9907 
1 1 1 -2  61  5  o 12 2.00102e+01 4.10848e-01 3.08638e+02 303.939 1.19787e+01  -1.77997e+01 0.00000e+00 0.00000e+00 4.21119e+02 303.939 1.12480e+02 303.939 0.9764 
1 1 1 -2  61  6  o 17 1.66447e+01 3.93729e-01 2.58677e+02 54.270  1.11690e+01  1.55265e+01  0.00000e+00 0.00000e+00 3.46278e+02 54.270  8.76010e+01 54.270  0.9735 
1 1 1 -2  61  7  o 17 6.83492e+00 5.85969e-01 1.48625e+02 115.314 -2.35061e+00 4.96961e+00  0.00000e+00 0.00000e+00 8.18883e+01 115.314 6.67370e+01 295.314 0.9038 
1 1 1 -2  61  8  o 11 4.67917e+00 7.21809e-01 1.39379e+02 227.708 -2.67133e+00 -2.93661e+00 0.00000e+00 0.00000e+00 1.11167e+01 227.708 1.28263e+02 47.708  0.8624 
1 1 1 -2  61  9  o 13 8.98623e+00 5.25972e-01 1.13274e+02 294.108 3.22985e+00  -7.21775e+00 0.00000e+00 0.00000e+00 1.99724e+02 294.108 8.64503e+01 294.108 0.9344 
1 1 1 -2  61  10 o 19 1.86792e+01 5.36316e-01 3.36965e+02 265.548 -4.47681e+00 -5.74940e+01 0.00000e+00 0.00000e+00 3.52771e+02 265.548 1.58066e+01 265.548 0.9913 
1 1 1 -2  61  11 o 9  1.20044e+01 5.47431e-01 2.36764e+02 98.102  -4.54406e+00 3.19197e+01  0.00000e+00 0.00000e+00 2.03089e+02 98.102  3.36753e+01 278.102 0.9844 
1 1 1 -2  61  12 o 15 8.66994e+00 6.38549e-01 1.83428e+02 261.657 -2.97143e+00 -2.02630e+01 0.00000e+00 0.00000e+00 1.31065e+02 261.657 5.23633e+01 81.657  0.9753 
1 1 1 -2  61  13 o 9  3.47805e+00 7.68614e-01 8.06511e+01 12.255  4.25366e+00  9.23949e-01  0.00000e+00 0.00000e+00 3.25532e+01 12.255  4.80979e+01 192.255 0.8758 
1 1 1 -2  61  14 o 4  2.44569e+00 7.83519e-01 8.96624e+01 137.697 -2.72359e+00 2.47854e+00  0.00000e+00 0.00000e+00 1.24690e+01 317.697 1.02131e+02 317.697 0.8501 
1 1 1 -2  61  15 o 5  4.35122e+00 1.06020e+00 2.16352e+01 186.100 -1.45565e+00 -1.55574e-01 0.00000e+00 0.00000e+00 7.31209e+01 186.100 5.14857e+01 186.100 0.5871 
1 1 1 -2  61  16 o 11 3.68734e+00 1.04546e+00 8.75470e+01 218.280 -4.45098e+00 -3.51271e+00 0.00000e+00 0.00000e+00 3.63670e+01 218.280 5.11800e+01 38.280  0.9069 
1 1 1 -2  61  17 o 13 1.35161e+01 9.29682e-01 1.88189e+02 16.487  5.79219e+01  1.71433e+01  0.00000e+00 0.00000e+00 3.07941e+02 16.487  1.19752e+02 16.487  0.9917 
1 1 1 -2  61  18 o 3  7.31252e+00 1.18053e+00 1.00471e+02 147.341 -1.35253e+01 8.66955e+00  0.00000e+00 0.00000e+00 1.61332e+02 147.341 6.08602e+01 147.341 0.9684 
1 1 1 -2  62  1  o 16 1.52216e+01 3.68932e-01 3.20523e+02 302.182 7.90843e+00  -1.25670e+01 0.00000e+00 0.00000e+00 2.29002e+02 302.182 9.15207e+01 122.182 0.9657 
1 1 1 -2  62  2  o 2  2.37182e+01 4.23568e-01 1.93173e+02 184.912 -1.31625e+01 -1.13113e+00 0.00000e+00 0.00000e+00 6.59098e+02 184.912 4.65925e+02 184.912 0.9614 
1 1 1 -2  62  3  o 3  1.84268e+01 4.17063e-01 2.68975e+02 304.229 8.99678e+00  -1.32240e+01 0.00000e+00 0.00000e+00 3.97718e+02 304.229 1.28743e+02 304.229 0.9682 
1 1 1 -2  62  4  o 14 2.25478e+01 4.19240e-01 3.97904e+02 324.904 2.43026e+01  -1.70778e+01 0.00000e+00 0.00000e+00 4.30117e+02 324.904 3.22132e+01 324.904 0.9830 
1 1 1 -2  62  5  o 7  1.95457e+01 4.07448e-01 4.53129e+02 158.081 -3.23519e+01 1.30177e+01  0.00000e+00 0.00000e+00 2.66240e+02 158.081 1.86889e+02 338.081 0.9856 
1 1 1 -2  62  6  o 1  2.40712e+01 4.40395e-01 5.09086e+02 247.756 -2.14323e+01 -5.24040e+01 0.00000e+00 0.00000e+00 3.81483e+02 247.756 1.27603e+02 67.756  0.9911 
1 1 1 -2  62  7  o 15 2.74917e+01 5.48922e-01 4.03781e+02 110.431 -2.31089e+01 6.20347e+01  0.00000e+00 0.00000e+00 6.14172e+02 110.431 2.10391e+02 110.431 0.9924 
1 1 1 -2  62  8  o 9  1.12299e+01 4.79916e-01 2.50524e+02 1.082   2.01270e+01  3.80205e-01  0.00000e+00 0.00000e+00 1.57707e+02 1.082   9.28171e+01 181.082 0.9748 
1 1 1 -2  62  9  o 11 1.65802e+01 4.38522e-01 3.81960e+02 245.345 -2.12453e+01 -4.62867e+01 0.00000e+00 0.00000e+00 2.29855e+02 245.345 1.52105e+02 65.345  0.9901 
1 1 1 -2  62  10 o 6  7.45854e+00 6.23370e-01 1.54788e+02 288.839 3.58834e+00  -1.05173e+01 0.00000e+00 0.00000e+00 1.10184e+02 288.839 4.46040e+01 108.839 0.9539 
1 1 1 -2  62  11 o 19 7.18799e+00 6.79261e-01 1.03735e+02 276.146 8.90541e-01  -8.27071e+00 0.00000e+00 0.00000e+00 1.47142e+02 276.146 4.34065e+01 276.146 0.9378 
1 1 1 -2  62  12 o 6  4.91057e+00 8.15520e-01 1.30343e+02 192.868 -8.05791e+00 -1.84082e+00 0.00000e+00 0.00000e+00 4.08370e+01 192.868 8.95058e+01 12.868  0.9374 
1 1 1 -2  62  13 o 3  5.82495e+00 8.35795e-01 8.07375e+01 135.575 -4.92858e+00 4.83063e+00  0.00000e+00 0.00000e+00 1.19335e+02 135.575 3.85971e+01 135.575 0.9244 
1 1 1 -2  62  14 o 11 4.59205e+00 9.30879e-01 7.15470e+01 80.072  8.29957e-01  4.74170e+00  0.00000e+00 0.00000e+00 7.99781e+01 80.072  8.43110e+00 80.072  0.8889 
1 1 1 -2  62  15 o 2  2.74458e+00 8.81277e-01 2.97447e+01 2.574   1.38689e+00  6.23493e-02  0.00000e+00 0.00000e+00 2.79972e+01 2.574   1.74748e+00 182.574 0.5673 
1 1 1 -2  62  16 o 4  6.47333e+00 1.14225e+00 1.48736e+02 94.957  -1.36625e+00 1.57508e+01  0.00000e+00 0.00000e+00 8.33774e+01 94.957  6.53589e+01 274.957 0.9678 
1 1 1 -2  62  17 o 13 5.72880e+00 1.14354e+00 1.22414e+02 248.308 -5.16183e+00 -1.29764e+01 0.00000e+00 0.00000e+00 8.18602e+01 248.308 4.05541e+01 68.308  0.9635 
1 1 1 -2  62  18 o 18 3.50109e+00 1.09175e+00 2.39877e+01 260.664 -3.17066e-01 -1.92864e+00 0.00000e+00 0.00000e+00 6.53334e+01 260.664 4.13457e+01 260.664 0.6902 
1 1 1 -2  63  1  o 18 1.27030e+01 3.71106e-01 2.93655e+02 50.048  6.90668e+00  8.24500e+00  0.00000e+00 0.00000e+00 1.58504e+02 50.048  1.35152e+02 230.048 0.9523 
1 1 1 -2  63  2  o 7  6.82732e+00 4.41370e-01 1.39908e+02 235.738 -1.73565e+00 -2.54797e+00 0.00000e+00 0.00000e+00 6.82711e+01 235.738 7.16365e+01 55.738  0.8159 
1 1 1 -2  63  3  o 2  4.34324e+01 6.39201e-01 8.17545e+02 51.320  7.03162e+01  8.78331e+01  0.00000e+00 0.00000e+00 7.97944e+02 51.320  1.96006e+01 231.320 0.9955 
1 1 1 -2  63  4  o 8  1.16046e+01 3.91948e-01 2.50822e+02 224.817 -7.37450e+00 -7.32765e+00 0.00000e+00 0.00000e+00 1.61212e+02 224.817 8.96100e+01 44.817  0.9506 
1 1 1 -2  63  5  o 9  2.82139e+01 4.80574e-01 4.95260e+02 232.432 -3.65558e+01 -4.75244e+01 0.00000e+00 0.00000e+00 5.49355e+02 232.432 5.40949e+01 232.432 0.9916 
1 1 1 -2  63  6  f 0  1.26445e+01 4.57355e-01 2.39219e+02 356.506 1.43690e+01  -8.77320e-01 0.00000e+00 0.00000e+00 2.16000e+02 356.506 2.32191e+01 176.506 0.9646 
1 1 1 -2  63  7  o 10 1.09797e+01 4.73645e-01 1.83101e+02 307.482 7.10864e+00  -9.27023e+00 0.00000e+00 0.00000e+00 2.08545e+02 307.482 2.54440e+01 307.482 0.9562 
1 1 1 -2  63  8  o 10 9.95628e+00 4.89650e-01 2.39709e+02 210.269 -1.55149e+01 -9.05493e+00 0.00000e+00 0.00000e+00 1.21017e+02 210.269 1.18692e+02 30.269  0.9718 
1 1 1 -2  63  9  o 2  1.43641e+01 4.92650e-01 3.24662e+02 239.352 -2.06748e+01 -3.48919e+01 0.00000e+00 0.00000e+00 2.03928e+02 239.352 1.20734e+02 59.352  0.9876 
1 1 1 -2  63  10 o 16 1.42611e+01 5.26227e-01 2.21450e+02 254.147 -8.46401e+00 -2.98055e+01 0.00000e+00 0.00000e+00 3.00949e+02 254.147 7.94982e+01 254.147 0.9837 
1 1 1 -2  63  11 f 0  3.17125e+00 8.25393e-01 8.54651e+01 142.262 -2.39015e+00 1.84985e+00  0.00000e+00 0.00000e+00 1.03089e+01 142.262 7.51562e+01 322.262 0.8116 
1 1 1 -2  63  12 o 12 8.41254e+00 6.16591e-01 1.45091e+02 15.490  1.70397e+01  4.72230e+00  0.00000e+00 0.00000e+00 1.58718e+02 15.490  1.36266e+01 15.490  0.9713 
1 1 1 -2  63  13 o 13 7.83472e+00 7.22382e-01 1.40455e+02 34.462  1.39609e+01  9.58141e+00  0.00000e+00 0.00000e+00 1.41872e+02 34.462  1.41704e+00 34.462  0.9700 
1 1 1 -2  63  14 o 17 3.42320e+00 9.35614e-01 4.51360e+01 71.533  7.67899e-01  2.29937e+00  0.00000e+00 0.00000e+00 5.09810e+01 71.533  5.84506e+00 71.533  0.7565 
1 1 1 -2  63  15 o 15 5.12987e+00 1.11030e+00 6.13856e+01 150.855 -3.96848e+00 2.21289e+00  0.00000e+00 0.00000e+00 1.06310e+02 150.855 4.49245e+01 150.855 0.8816 
1 1 1 -2  63  16 o 3  8.97990e+00 1.30979e+00 1.87263e+02 289.476 8.12572e+00  -2.29772e+01 0.00000e+00 0.00000e+00 1.38474e+02 289.476 4.87884e+01 109.476 0.9793 
1 1 1 -2  63  17 o 17 1.05156e+01 1.03272e+00 1.59429e+02 308.351 2.09651e+01  -2.64980e+01 0.00000e+00 0.00000e+00 2.23867e+02 308.351 6.44384e+01 308.351 0.9851 
1 1 1 -2  63  18 o 6  3.88431e+00 1.13105e+00 4.35663e+01 52.558  2.26294e+00  2.95530e+00  0.00000e+00 0.00000e+00 7.87365e+01 52.558  3.51702e+01 52.558  0.8519 
1 1 1 -2  64  1  o 18 1.81979e+01 3.87723e-01 3.15794e+02 315.205 1.27566e+01  -1.26656e+01 0.00000e+00 0.00000e+00 3.45076e+02 315.205 2.92816e+01 315.205 0.9718 
1 1 1 -2  64  2  o 18 4.25188e+00 6.18827e-01 1.35884e+02 347.739 1.79423e+00  -3.89923e-01 0.00000e+00 0.00000e+00 2.96111e+01 167.739 1.65495e+02 167.739 0.6689 
1 1 1 -2  64  3  o 9  5.88077e+00 5.37385e-01 1.46141e+02 90.690  -3.39593e-02 2.81960e+00  0.00000e+00 0.00000e+00 2.86626e+01 90.690  1.17479e+02 270.690 0.7957 
1 1 1 -2  64  4  o 17 1.60334e+01 3.86017e-01 2.68774e+02 214.939 -1.39436e+01 -9.74125e+00 0.00000e+00 0.00000e+00 3.12104e+02 214.939 4.33296e+01 214.939 0.9701 
1 1 1 -2  64  5  o 6  3.43879e+00 7.20659e-01 1.71095e+02 131.650 -1.68330e+00 1.89259e+00  0.00000e+00 0.00000e+00 7.24366e+01 311.650 2.43532e+02 311.650 0.7685 
1 1 1 -2  64  6  o 17 1.13021e+01 4.59152e-01 1.35752e+02 67.575  2.98146e+00  7.22450e+00  0.00000e+00 0.00000e+00 2.58005e+02 67.575  1.22253e+02 67.575  0.9336 
1 1 1 -2  64  7  o 7  2.89496e+01 5.69166e-01 5.02990e+02 315.018 6.29403e+01  -6.29001e+01 0.00000e+00 0.00000e+00 5.70678e+02 315.018 6.76881e+01 315.018 0.9944 
1 1 1 -2  64  8  o 13 7.95073e+00 4.72257e-01 1.85344e+02 221.967 -8.14702e+00 -7.32705e+00 0.00000e+00 0.00000e+00 9.71739e+01 221.967 8.81697e+01 41.967  0.9532 
1 1 1 -2  64  9  o 14 3.85629e+00 7.86631e-01 7.28042e+01 191.337 -2.39869e+00 -4.80925e-01 0.00000e+00 0.00000e+00 3.62449e+01 191.337 3.65593e+01 11.337  0.7590 
1 1 1 -2  64  10 o 7  1.24901e+01 5.42776e-01 2.69029e+02 143.675 -2.88651e+01 2.12226e+01  0.00000e+00 0.00000e+00 1.89448e+02 143.675 7.95810e+01 323.675 0.9859 
1 1 1 -2  64  11 o 19 2.80210e+00 7.19352e-01 7.43115e+01 119.739 -1.31339e+00 2.29898e+00  0.00000e+00 0.00000e+00 7.01810e+00 119.739 6.72934e+01 299.739 0.7802 
1 1 1 -2  64  12 o 13 2.13515e+00 6.81732e-01 5.12953e+01 169.595 -1.44465e+00 2.65275e-01  0.00000e+00 0.00000e+00 4.59799e+00 349.595 5.58933e+01 349.595 0.5883 
1 1 1 -2  64  13 o 5  6.92303e+00 8.32200e-01 1.22852e+02 128.474 -7.79237e+00 9.80534e+00  0.00000e+00 0.00000e+00 1.23802e+02 128.474 9.50664e-01 128.474 0.9592 
1 1 1 -2  64  14 o 16 2.70224e+00 8.04796e-01 8.60042e+01 120.171 -2.00406e+00 3.44733e+00  0.00000e+00 0.00000e+00 5.40719e-01 120.171 8.54635e+01 300.171 0.8630 
1 1 1 -2  64  15 o 7  3.63611e+00 1.02912e+00 2.46694e+01 127.172 -8.62527e-01 1.13748e+00  0.00000e+00 0.00000e+00 5.32068e+01 127.172 2.85374e+01 127.172 0.5777 
1 1 1 -2  64  16 o 19 3.93577e+00 1.10934e+00 7.08647e+01 171.266 -4.85370e+00 7.45628e-01  0.00000e+00 0.00000e+00 5.90500e+01 171.266 1.18148e+01 351.266 0.8913 
1 1 1 -2  64  17 f 0  3.07500e+00 9.93862e-01 6.59153e+01 49.183  2.92486e+00  3.38644e+00  0.00000e+00 0.00000e+00 3.41465e+01 49.183  3.17687e+01 229.183 0.8796 
1 1 1 -2  64  18 o 13 4.76738e+00 1.33450e+00 4.46408e+01 186.262 -4.10311e+00 -4.50202e-01 0.00000e+00 0.00000e+00 1.08319e+02 186.262 6.36781e+01 186.262 0.8683 
1 1 1 -2  65  1  o 18 3.27889e+01 5.18885e-01 5.38699e+02 108.309 -1.77083e+01 5.35174e+01  0.00000e+00 0.00000e+00 6.75505e+02 108.309 1.36806e+02 108.309 0.9911 
1 1 1 -2  65  2  o 10 2.62046e+01 4.51982e-01 3.64465e+02 135.757 -2.25911e+01 2.20019e+01  0.00000e+00 0.00000e+00 5.98824e+02 135.757 2.34359e+02 135.757 0.9840 
1 1 1 -2  65  3  o 4  1.91736e+01 3.99462e-01 3.53458e+02 241.471 -1.12439e+01 -2.06834e+01 0.00000e+00 0.00000e+00 3.47273e+02 241.471 6.18518e+00 61.471  0.9785 
1 1 1 -2  65  4  o 2  2.72815e+01 4.68246e-01 4.69126e+02 129.004 -3.46333e+01 4.27623e+01  0.00000e+00 0.00000e+00 5.40204e+02 129.004 7.10782e+01 129.004 0.9909 
1 1 1 -2  65  5  o 12 1.71196e+01 4.55703e-01 2.94984e+02 339.548 2.30872e+01  -8.60977e+00 0.00000e+00 0.00000e+00 3.30893e+02 339.548 3.59088e+01 339.548 0.9795 
1 1 1 -2  65  6  o 4  2.26249e+01 5.00354e-01 2.95885e+02 284.722 1.02137e+01  -3.88710e+01 0.00000e+00 0.00000e+00 5.37655e+02 284.722 2.41769e+02 284.722 0.9875 
1 1 1 -2  65  7  o 15 1.21990e+01 4.75552e-01 1.82460e+02 338.866 1.43906e+01  -5.56255e+00 0.00000e+00 0.00000e+00 2.57457e+02 338.866 7.49968e+01 338.866 0.9670 
1 1 1 -2  65  8  o 19 7.24328e+00 5.75074e-01 1.45409e+02 168.706 -7.96828e+00 1.59131e+00  0.00000e+00 0.00000e+00 1.07353e+02 168.706 3.80561e+01 348.706 0.9363 
1 1 1 -2  65  9  o 1  6.60430e+00 6.16130e-01 1.23758e+02 202.184 -6.83574e+00 -2.78740e+00 0.00000e+00 0.00000e+00 1.04917e+02 202.184 1.88413e+01 22.184  0.9296 
1 1 1 -2  65  10 f 0  5.25390e+00 7.57867e-01 1.05555e+02 183.655 -5.83155e+00 -3.72472e-01 0.00000e+00 0.00000e+00 7.23864e+01 183.655 3.31688e+01 3.655   0.9099 
1 1 1 -2  65  11 o 14 7.33081e+00 5.95373e-01 9.58175e+01 57.285  5.00039e+00  7.78442e+00  0.00000e+00 0.00000e+00 1.61680e+02 57.285  6.58628e+01 57.285  0.9443 
1 1 1 -2  65  12 o 5  2.23781e+00 7.15856e-01 5.05253e+01 200.729 -1.53673e+00 -5.81581e-01 0.00000e+00 0.00000e+00 1.83893e+00 200.729 4.86864e+01 20.729  0.6296 
1 1 1 -2  65  13 o 17 7.90832e+00 7.96915e-01 1.70681e+02 265.436 -1.67537e+00 -2.09896e+01 0.00000e+00 0.00000e+00 1.15947e+02 265.436 5.47342e+01 85.436  0.9760 
1 1 1 -2  65  14 o 8  7.95853e+00 9.04906e-01 1.33435e+02 85.856  1.28077e+00  1.76782e+01  0.00000e+00 0.00000e+00 1.53396e+02 85.856  1.99612e+01 85.856  0.9714 
1 1 1 -2  65  15 o 10 8.45229e+00 9.56963e-01 1.36193e+02 235.951 -1.10589e+01 -1.63655e+01 0.00000e+00 0.00000e+00 1.69073e+02 235.951 3.28797e+01 235.951 0.9743 
1 1 1 -2  65  16 o 9  4.80895e+00 1.18594e+00 8.73377e+01 357.920 7.01299e+00  -2.54717e-01 0.00000e+00 0.00000e+00 7.75078e+01 357.920 9.82985e+00 177.920 0.9257 
1 1 1 -2  65  17 o 9  4.26912e+00 1.20945e+00 8.22648e+01 150.605 -5.61252e+00 3.16186e+00  0.00000e+00 0.00000e+00 6.28099e+01 150.605 1.94549e+01 330.605 0.9187 
1 1 1 -2  65  18 o 6  3.48321e+00 1.09395e+00 8.96228e+01 244.303 -3.24042e+00 -6.73386e+00 0.00000e+00 0.00000e+00 3.01201e+01 244.303 5.95027e+01 64.303  0.9305 
1 1 1 -2  66  1  o 4  1.18764e+01 4.14156e-01 1.25116e+02 198.027 -5.05962e+00 -1.64665e+00 0.00000e+00 0.00000e+00 2.74330e+02 198.027 1.49214e+02 198.027 0.9003 
1 1 1 -2  66  2  o 10 3.03011e+01 4.94159e-01 4.95772e+02 334.575 4.69147e+01  -2.23013e+01 0.00000e+00 0.00000e+00 6.25048e+02 334.575 1.29276e+02 334.575 0.9903 
1 1 1 -2  66  3  o 10 2.29069e+01 4.27468e-01 4.91045e+02 12.248  4.76614e+01  1.03467e+01  0.00000e+00 0.00000e+00 3.55530e+02 12.248  1.35515e+02 192.248 0.9897 
1 1 1 -2  66  4  o 16 2.75290e+01 5.43918e-01 4.19691e+02 355.652 5.05400e+01  -3.84226e+00 0.00000e+00 0.00000e+00 5.97807e+02 355.652 1.78116e+02 355.652 0.9901 
1 1 1 -2  66  5  o 19 2.25511e+01 4.99179e-01 3.47953e+02 162.085 -3.53106e+01 1.14155e+01  0.00000e+00 0.00000e+00 4.82187e+02 162.085 1.34234e+02 162.085 0.9864 
1 1 1 -2  66  6  o 4  1.58657e+01 4.58154e-01 4.57688e+02 227.908 -2.80521e+01 -3.10546e+01 0.00000e+00 0.00000e+00 1.27023e+02 227.908 3.30665e+02 47.908  0.9880 
1 1 1 -2  66  7  o 3  4.20579e+00 6.33014e-01 1.02396e+02 312.186 2.01969e+00  -2.22850e+00 0.00000e+00 0.00000e+00 2.47051e+01 312.186 7.76910e+01 132.186 0.8105 
1 1 1 -2  66  8  o 6  8.70400e+00 5.13544e-01 1.43846e+02 212.155 -8.44029e+00 -5.30585e+00 0.00000e+00 0.00000e+00 1.63778e+02 212.155 1.99316e+01 212.155 0.9484 
1 1 1 -2  66  9  o 12 9.42261e+00 5.23302e-01 1.37255e+02 217.951 -9.90745e+00 -7.72681e+00 0.00000e+00 0.00000e+00 1.99394e+02 217.951 6.21392e+01 217.951 0.9593 
1 1 1 -2  66  10 o 11 5.58211e+00 6.17542e-01 9.40960e+01 304.706 3.33684e+00  -4.81788e+00 0.00000e+00 0.00000e+00 9.49859e+01 304.706 8.89834e-01 304.706 0.9101 
1 1 1 -2  66  11 o 3  3.34675e+00 8.09264e-01 1.09703e+02 95.568  -4.51644e-01 4.63267e+00  0.00000e+00 0.00000e+00 4.14158e-01 95.568  1.09288e+02 275.568 0.8847 
1 1 1 -2  66  12 o 13 7.71765e+00 7.12217e-01 1.37706e+02 337.246 1.38994e+01  -5.82957e+00 0.00000e+00 0.00000e+00 1.39409e+02 337.246 1.70281e+00 337.246 0.9662 
1 1 1 -2  66  13 o 13 1.53716e+01 6.42527e-01 2.40979e+02 122.997 -3.11778e+01 4.80148e+01  0.00000e+00 0.00000e+00 3.24762e+02 122.997 8.37838e+01 122.997 0.9912 
1 1 1 -2  66  14 o 7  5.16133e+00 1.08275e+00 9.00420e+01 301.899 3.64543e+00  -5.85681e+00 0.00000e+00 0.00000e+00 8.69463e+01 301.899 3.09571e+00 121.899 0.9244 
1 1 1 -2  66  15 o 8  5.22998e+00 1.16645e+00 1.30201e+02 58.686  5.37783e+00  8.84010e+00  0.00000e+00 0.00000e+00 5.40059e+01 58.686  7.61956e+01 238.686 0.9504 
1 1 1 -2  66  16 o 6  5.05773e+00 1.16941e+00 1.10056e+02 115.023 -3.94729e+00 8.45629e+00  0.00000e+00 0.00000e+00 6.68573e+01 115.023 4.31984e+01 295.023 0.9448 
1 1 1 -2  66  17 o 7  7.67986e+00 1.23126e+00 1.07748e+02 307.756 9.27951e+00  -1.19818e+01 0.00000e+00 0.00000e+00 1.66733e+02 307.756 5.89852e+01 307.756 0.9664 
1 1 1 -2  67  1  o 2  2.94951e+01 4.86936e-01 6.14813e+02 53.313  3.74027e+01  5.02038e+01  0.00000e+00 0.00000e+00 4.78004e+02 53.313  1.36809e+02 233.313 0.9920 
1 1 1 -2  67  2  o 11 1.45791e+01 3.85820e-01 1.99125e+02 144.252 -9.28655e+00 6.68486e+00  0.00000e+00 0.00000e+00 3.20952e+02 144.252 1.21826e+02 144.252 0.9553 
1 1 1 -2  67  3  f 0  8.78838e+00 4.27053e-01 1.95318e+02 259.326 -1.36738e+00 -7.25449e+00 0.00000e+00 0.00000e+00 1.09688e+02 259.326 8.56305e+01 79.326  0.9296 
1 1 1 -2  67  4  o 5  2.63728e+01 5.34501e-01 4.78924e+02 193.118 -5.96255e+01 -1.38946e+01 0.00000e+00 0.00000e+00 4.97346e+02 193.118 1.84224e+01 193.118 0.9918 
1 1 1 -2  67  5  o 18 5.98776e+00 6.03556e-01 3.53415e+01 265.521 -8.91343e-02 -1.13783e+00 0.00000e+00 0.00000e+00 7.50729e+01 265.521 3.97314e+01 265.521 0.4942 
1 1 1 -2  67  6  o 15 1.18568e+01 4.59223e-01 2.49432e+02 22.103  1.69708e+01  6.89228e+00  0.00000e+00 0.00000e+00 1.80527e+02 22.103  6.89058e+01 202.103 0.9723 
1 1 1 -2  67  7  o 8  1.32005e+01 4.60018e-01 2.84050e+02 238.714 -1.47999e+01 -2.43547e+01 0.00000e+00 0.00000e+00 1.99321e+02 238.714 8.47288e+01 58.714  0.9823 
1 1 1 -2  67  8  o 7  9.52084e+00 4.81787e-01 1.23204e+02 169.943 -1.00653e+01 1.78508e+00  0.00000e+00 0.00000e+00 2.13694e+02 169.943 9.04895e+01 169.943 0.9498 
1 1 1 -2  67  9  o 4  7.95005e+00 5.59745e-01 1.35682e+02 147.679 -8.88163e+00 5.61928e+00  0.00000e+00 0.00000e+00 1.45884e+02 147.679 1.02020e+01 147.679 0.9512 
1 1 1 -2  67  10 o 15 6.21908e+00 6.21682e-01 1.82372e+02 96.361  -1.42431e+00 1.27769e+01  0.00000e+00 0.00000e+00 3.98523e+01 96.361  1.42520e+02 276.361 0.9603 
1 1 1 -2  67  11 o 17 7.75803e+00 5.87450e-01 1.00159e+02 321.536 7.94270e+00  -6.30965e+00 0.00000e+00 0.00000e+00 1.73702e+02 321.536 7.35424e+01 321.536 0.9494 
1 1 1 -2  67  12 o 7  8.23647e+00 6.90982e-01 1.83422e+02 56.391  1.34159e+01  2.01854e+01  0.00000e+00 0.00000e+00 1.16219e+02 56.391  6.72029e+01 236.391 0.9791 
1 1 1 -2  67  13 f 0  1.00079e+01 7.05158e-01 1.16001e+02 151.135 -1.59746e+01 8.80587e+00  0.00000e+00 0.00000e+00 2.45194e+02 151.135 1.29192e+02 151.135 0.9722 
1 1 1 -2  67  14 o 3  6.97654e+00 9.77407e-01 1.03268e+02 235.541 -6.55707e+00 -9.55524e+00 0.00000e+00 0.00000e+00 1.44060e+02 235.541 4.07920e+01 235.541 0.9558 
1 1 1 -2  67  15 o 16 3.98526e+00 1.07793e+00 4.43377e+01 33.265  2.51064e+00  1.64701e+00  0.00000e+00 0.00000e+00 7.53010e+01 33.265  3.09633e+01 33.265  0.8102 
1 1 1 -2  67  16 o 14 4.26425e+00 1.14473e+00 7.11366e+01 341.453 5.13940e+00  -1.72432e+00 0.00000e+00 0.00000e+00 7.12874e+01 341.453 1.50814e-01 341.453 0.9023 
1 1 1 -2  67  17 o 17 3.99638e+00 1.15193e+00 5.63014e+01 219.096 -3.83972e+00 -3.12006e+00 0.00000e+00 0.00000e+00 7.55300e+01 219.096 1.92286e+01 219.096 0.8922 
1 1 1 -2  68  1  f 0  1.31754e+01 3.83729e-01 3.21792e+02 87.110  9.28098e-01  1.83817e+01  0.00000e+00 0.00000e+00 1.56664e+02 87.110  1.65127e+02 267.109 0.9724 
1 1 1 -2  68  2  o 14 2.82110e+01 4.77949e-01 4.38185e+02 211.742 -4.50822e+01 -2.78885e+01 0.00000e+00 0.00000e+00 6.05148e+02 211.742 1.66962e+02 211.742 0.9905 
1 1 1 -2  68  3  o 5  1.67101e+01 4.72993e-01 3.29514e+02 1.828   2.54319e+01  8.11774e-01  0.00000e+00 0.00000e+00 2.81862e+02 1.828   4.76515e+01 181.828 0.9801 
1 1 1 -2  68  4  o 15 1.23792e+01 4.53992e-01 1.24013e+02 19.007  6.89412e+00  2.37472e+00  0.00000e+00 0.00000e+00 3.04986e+02 19.007  1.80974e+02 19.007  0.9287 
1 1 1 -2  68  5  o 1  1.73811e+01 4.67492e-01 2.60745e+02 359.495 2.61962e+01  -2.30754e-01 0.00000e+00 0.00000e+00 3.75140e+02 359.495 1.14395e+02 359.495 0.9807 
1 1 1 -2  68  6  o 4  1.12000e+01 4.17814e-01 1.74759e+02 154.726 -1.23525e+01 5.83215e+00  0.00000e+00 0.00000e+00 2.27282e+02 154.726 5.25230e+01 154.726 0.9627 
1 1 1 -2  68  7  o 11 7.83765e+00 5.16644e-01 1.47044e+02 20.677  7.94487e+00  2.99844e+00  0.00000e+00 0.00000e+00 1.27290e+02 20.677  1.97540e+01 200.677 0.9391 
1 1 1 -2  68  8  o 15 7.19049e+00 5.58488e-01 1.62108e+02 85.219  8.90964e-01  1.06524e+01  0.00000e+00 0.00000e+00 9.28878e+01 85.219  6.92203e+01 265.219 0.9520 
1 1 1 -2  68  9  f 0  1.52013e+01 4.49640e-01 1.38621e+02 7.412   2.31230e+01  3.00800e+00  0.00000e+00 0.00000e+00 4.15026e+02 7.412   2.76405e+02 7.412   0.9783 
1 1 1 -2  68  10 o 4  2.76335e+00 7.34583e-01 9.38084e+01 198.351 -2.82664e+00 -9.37610e-01 0.00000e+00 0.00000e+00 1.07043e+01 18.351  1.04513e+02 18.351  0.8084 
1 1 1 -2  68  11 o 5  7.20012e+00 6.34851e-01 1.06142e+02 66.439  4.23400e+00  9.70945e+00  0.00000e+00 0.00000e+00 1.48568e+02 66.439  4.24262e+01 66.439  0.9516 
1 1 1 -2  68  12 o 5  1.08652e+01 6.09770e-01 1.74335e+02 22.270  2.82351e+01  1.15625e+01  0.00000e+00 0.00000e+00 2.22610e+02 22.270  4.82754e+01 22.270  0.9835 
1 1 1 -2  68  13 o 19 4.43987e+00 9.76873e-01 8.48379e+01 116.299 -2.39149e+00 4.83909e+00  0.00000e+00 0.00000e+00 6.37807e+01 116.299 2.10572e+01 296.299 0.9019 
1 1 1 -2  68  14 o 5  4.53685e+00 1.01537e+00 1.03314e+02 318.383 5.59996e+00  -4.97487e+00 0.00000e+00 0.00000e+00 5.32549e+01 318.383 5.00590e+01 138.383 0.9306 
1 1 1 -2  68  15 o 18 5.09099e+00 9.43920e-01 7.63341e+01 12.303  6.98958e+00  1.52430e+00  0.00000e+00 0.00000e+00 9.85430e+01 12.303  2.22089e+01 12.303  0.9272 
1 1 1 -2  68  16 o 6  3.48143e+00 1.06206e+00 6.15416e+01 252.007 -1.33180e+00 -4.10050e+00 0.00000e+00 0.00000e+00 5.11337e+01 252.007 1.04078e+01 72.007  0.8745 
1 1 1 -2  68  17 o 15 3.65576e+00 1.13683e+00 3.75362e+01 24.131  2.72745e+00  1.22185e+00  0.00000e+00 0.00000e+00 7.18176e+01 24.131  3.42814e+01 24.131  0.8091 
1 1 1 -2  69  1  o 10 2.17282e+01 4.19882e-01 3.46904e+02 195.513 -3.22473e+01 -8.95087e+00 0.00000e+00 0.00000e+00 4.52134e+02 195.513 1.05231e+02 195.513 0.9849 
1 1 1 -2  69  2  o 3  1.12126e+01 3.95302e-01 1.36927e+02 89.201  9.95647e-02  7.14106e+00  0.00000e+00 0.00000e+00 2.51117e+02 89.201  1.14190e+02 89.201  0.9271 
1 1 1 -2  69  3  o 18 1.25734e+01 4.67400e-01 1.53740e+02 24.010  8.59112e+00  3.82683e+00  0.00000e+00 0.00000e+00 2.89820e+02 24.010  1.36080e+02 24.010  0.9452 
1 1 1 -2  69  4  o 4  1.27836e+01 4.52985e-01 3.27791e+02 216.664 -1.84275e+01 -1.37173e+01 0.00000e+00 0.00000e+00 1.38670e+02 216.664 1.89121e+02 36.664  0.9780 
1 1 1 -2  69  5  o 7  8.64670e+00 4.98895e-01 1.94285e+02 7.887   9.62456e+00  1.33331e+00  0.00000e+00 0.00000e+00 1.11136e+02 7.887   8.31488e+01 187.887 0.9471 
1 1 1 -2  69  6  o 17 6.36405e+00 5.50594e-01 1.84969e+02 279.807 1.41808e+00  -8.20390e+00 0.00000e+00 0.00000e+00 3.75506e+01 279.807 1.47418e+02 99.807  0.9379 
1 1 1 -2  69  7  o 2  1.97473e+01 4.86708e-01 3.19082e+02 109.412 -1.77526e+01 5.03771e+01  0.00000e+00 0.00000e+00 4.09856e+02 109.412 9.07737e+01 109.412 0.9906 
1 1 1 -2  69  8  o 16 1.12998e+01 4.85324e-01 1.98487e+02 202.441 -1.91830e+01 -7.92288e+00 0.00000e+00 0.00000e+00 2.12092e+02 202.441 1.36054e+01 202.441 0.9756 
1 1 1 -2  69  9  o 6  1.45984e+01 4.43108e-01 2.30081e+02 42.787  2.80964e+01  2.60058e+01  0.00000e+00 0.00000e+00 3.06144e+02 42.787  7.60622e+01 42.787  0.9869 
1 1 1 -2  69  10 o 8  4.44469e+00 7.18902e-01 3.51142e+01 336.436 1.81872e+00  -7.93224e-01 0.00000e+00 0.00000e+00 7.98147e+01 336.436 4.47005e+01 336.436 0.6952 
1 1 1 -2  69  11 o 14 1.02101e+01 5.37320e-01 1.97027e+02 79.185  5.59679e+00  2.92985e+01  0.00000e+00 0.00000e+00 1.76064e+02 79.185  2.09633e+01 259.185 0.9831 
1 1 1 -2  69  12 o 19 1.13326e+01 6.02619e-01 1.70928e+02 353.970 3.10385e+01  -3.27873e+00 0.00000e+00 0.00000e+00 2.43175e+02 353.970 7.22467e+01 353.970 0.9838 
1 1 1 -2  69  13 o 13 3.22094e+00 9.22912e-01 1.12064e+02 207.535 -5.07339e+00 -2.64495e+00 0.00000e+00 0.00000e+00 3.55704e+00 27.535  1.15621e+02 27.535  0.9078 
1 1 1 -2  69  14 o 4  1.00926e+01 8.24542e-01 1.70683e+02 124.560 -1.71363e+01 2.48772e+01  0.00000e+00 0.00000e+00 1.97260e+02 124.560 2.65768e+01 124.560 0.9833 
1 1 1 -2  69  15 o 1  2.77462e+00 9.07640e-01 6.31138e+01 323.152 2.83333e+00  -2.12331e+00 0.00000e+00 0.00000e+00 2.35433e+01 323.152 3.95705e+01 143.152 0.8432 
1 1 1 -2  69  16 o 12 5.45822e+00 1.18004e+00 5.47269e+01 27.915  5.08730e+00  2.69527e+00  0.00000e+00 0.00000e+00 1.28740e+02 27.915  7.40134e+01 27.915  0.9084 
1 1 1 -2  69  17 o 9  3.07996e+00 1.00715e+00 4.86999e+01 137.328 -2.64662e+00 2.43987e+00  0.00000e+00 0.00000e+00 4.76256e+01 137.328 1.07435e+00 317.328 0.8461 
1 1 1 -2  70  1  o 16 5.39269e+00 5.50303e-01 4.09257e+01 105.359 -2.67730e-01 9.74700e-01  0.00000e+00 0.00000e+00 4.97029e+01 105.359 8.77716e+00 105.359 0.4502 
1 1 1 -2  70  2  o 13 1.11591e+01 4.60123e-01 9.47621e+01 139.098 -3.89287e+00 3.37238e+00  0.00000e+00 0.00000e+00 2.78729e+02 139.098 1.83967e+02 139.098 0.8968 
1 1 1 -2  70  3  o 18 8.52682e+00 5.64401e-01 1.76077e+02 114.282 -3.11797e+00 6.91130e+00  0.00000e+00 0.00000e+00 1.20302e+02 114.282 5.57742e+01 294.282 0.9315 
1 1 1 -2  70  4  o 9  1.89842e+01 4.68507e-01 3.45456e+02 311.083 2.58902e+01  -2.96959e+01 0.00000e+00 0.00000e+00 3.53668e+02 311.083 8.21214e+00 311.083 0.9872 
1 1 1 -2  70  5  o 12 1.73974e+01 4.89430e-01 2.99546e+02 136.977 -2.39866e+01 2.23857e+01  0.00000e+00 0.00000e+00 3.39235e+02 136.977 3.96894e+01 136.977 0.9846 
1 1 1 -2  70  6  o 16 7.42873e+00 5.22755e-01 6.67033e+01 123.535 -2.06191e+00 3.11113e+00  0.00000e+00 0.00000e+00 1.69322e+02 123.535 1.02618e+02 123.535 0.8524 
1 1 1 -2  70  7  o 2  7.48112e+00 5.13750e-01 8.84454e+01 148.778 -4.91696e+00 2.98039e+00  0.00000e+00 0.00000e+00 1.64713e+02 148.778 7.62676e+01 148.778 0.9083 
1 1 1 -2  70  8  o 17 9.58674e+00 4.46820e-01 1.86018e+02 351.237 1.73448e+01  -2.67357e+00 0.00000e+00 0.00000e+00 1.60634e+02 351.237 2.53847e+01 171.237 0.9711 
1 1 1 -2  70  9  o 14 5.55471e+00 6.49849e-01 8.33445e+01 140.410 -3.73417e+00 3.08808e+00  0.00000e+00 0.00000e+00 1.00564e+02 140.410 1.72193e+01 140.410 0.8897 
1 1 1 -2  70  10 o 9  3.07984e+00 7.91368e-01 7.89020e+01 272.106 1.10212e-01  -2.99758e+00 0.00000e+00 0.00000e+00 1.38686e+01 272.106 6.50334e+01 92.106  0.8100 
1 1 1 -2  70  11 o 7  8.40275e+00 5.89477e-01 2.29392e+02 123.587 -1.52697e+01 2.29939e+01  0.00000e+00 0.00000e+00 7.71671e+01 123.587 1.52225e+02 303.587 0.9817 
1 1 1 -2  70  12 o 16 6.66292e+00 8.09892e-01 1.01884e+02 337.138 9.31948e+00  -3.92948e+00 0.00000e+00 0.00000e+00 1.32965e+02 337.138 3.10807e+01 337.138 0.9492 
1 1 1 -2  70  13 o 16 1.30831e+01 6.70201e-01 1.88774e+02 313.692 3.12729e+01  -3.27337e+01 0.00000e+00 0.00000e+00 2.91249e+02 313.692 1.02475e+02 313.692 0.9889 
1 1 1 -2  70  14 o 7  8.17366e+00 9.17687e-01 4.33303e+01 160.474 -5.37484e+00 1.90611e+00  0.00000e+00 0.00000e+00 2.31624e+02 160.474 1.88294e+02 160.474 0.9075 
1 1 1 -2  70  15 o 11 6.51820e+00 1.15642e+00 1.12395e+02 336.750 1.08676e+01  -4.66915e+00 0.00000e+00 0.00000e+00 1.18552e+02 336.750 6.15789e+00 336.750 0.9567 
1 1 1 -2  70  16 o 2  3.69651e+00 1.12860e+00 1.01718e+02 131.631 -5.03563e+00 5.66558e+00  0.00000e+00 0.00000e+00 2.56647e+01 131.631 7.60534e+01 311.631 0.9315 
1 1 1 -2  70  17 o 14 5.12760e+00 1.29510e+00 1.06298e+02 318.717 8.02854e+00  -7.04909e+00 0.00000e+00 0.00000e+00 7.40918e+01 318.717 3.22061e+01 138.717 0.9520 
1 1 1 -2  71  1  o 13 8.65122e+00 4.91790e-01 1.30987e+02 281.088 1.03390e+00  -5.27557e+00 0.00000e+00 0.00000e+00 1.60068e+02 281.088 2.90813e+01 281.088 0.9014 
1 1 1 -2  71  2  o 1  1.40732e+01 4.50365e-01 3.31459e+02 213.773 -1.98089e+01 -1.32474e+01 0.00000e+00 0.00000e+00 1.82551e+02 213.773 1.48909e+02 33.773  0.9788 
1 1 1 -2  71  3  o 9  2.95007e+01 6.14079e-01 4.76393e+02 293.232 3.28368e+01  -7.64944e+01 0.00000e+00 0.00000e+00 6.17556e+02 293.232 1.41163e+02 293.232 0.9940 
1 1 1 -2  71  4  o 10 1.57135e+01 4.60140e-01 2.79958e+02 44.111  1.83394e+01  1.77790e+01  0.00000e+00 0.00000e+00 2.94503e+02 44.111  1.45450e+01 44.111  0.9802 
1 1 1 -2  71  5  o 1  6.15518e+00 6.00775e-01 8.70340e+01 184.188 -3.62750e+00 -2.65647e-01 0.00000e+00 0.00000e+00 1.07558e+02 184.188 2.05238e+01 184.188 0.8480 
1 1 1 -2  71  6  o 12 1.24234e+01 4.60129e-01 2.25442e+02 177.214 -2.07550e+01 1.00986e+00  0.00000e+00 0.00000e+00 2.26260e+02 177.214 8.18483e-01 177.214 0.9756 
1 1 1 -2  71  7  o 2  4.49728e+00 6.94315e-01 7.89891e+01 103.374 -6.96154e-01 2.92805e+00  0.00000e+00 0.00000e+00 5.68197e+01 103.374 2.21694e+01 283.374 0.8107 
1 1 1 -2  71  8  o 19 1.78887e+01 4.34095e-01 2.44296e+02 53.695  2.58460e+01  3.51786e+01  0.00000e+00 0.00000e+00 4.14014e+02 53.695  1.69718e+02 53.695  0.9885 
1 1 1 -2  71  9  o 12 1.08813e+01 4.76361e-01 1.81889e+02 139.743 -1.62594e+01 1.37681e+01  0.00000e+00 0.00000e+00 2.13352e+02 139.743 3.14635e+01 139.743 0.9762 
1 1 1 -2  71  10 o 13 5.61303e+00 6.78342e-01 1.70419e+02 337.489 1.17323e+01  -4.86223e+00 0.00000e+00 0.00000e+00 2.98935e+01 337.489 1.40525e+02 157.489 0.9598 
1 1 1 -2  71  11 o 1  4.86170e+00 7.92537e-01 1.17648e+02 26.847  7.01817e+00  3.55231e+00  0.00000e+00 0.00000e+00 5.10847e+01 26.847  6.65629e+01 206.847 0.9341 
1 1 1 -2  71  12 o 17 6.39051e+00 8.29302e-01 7.59097e+01 330.797 6.50080e+00  -3.63367e+00 0.00000e+00 0.00000e+00 1.44790e+02 330.797 6.88799e+01 330.797 0.9302 
1 1 1 -2  71  13 o 13 4.38556e+00 1.01347e+00 1.08357e+02 67.901  2.80491e+00  6.90811e+00  0.00000e+00 0.00000e+00 4.29860e+01 67.901  6.53713e+01 247.901 0.9303 
1 1 1 -2  71  14 o 11 4.72309e+00 1.08164e+00 7.74103e+01 110.374 -1.99491e+00 5.37168e+00  0.00000e+00 0.00000e+00 8.15219e+01 110.374 4.11161e+00 110.374 0.9080 
1 1 1 -2  71  15 o 10 4.37173e+00 1.15920e+00 6.60152e+01 307.834 3.02750e+00  -3.89827e+00 0.00000e+00 0.00000e+00 7.83492e+01 307.834 1.23341e+01 307.834 0.8919 
1 1 1 -2  71  16 o 15 4.00136e+00 1.16151e+00 5.24960e+01 311.158 2.68390e+00  -3.07035e+00 0.00000e+00 0.00000e+00 7.57404e+01 311.158 2.32444e+01 311.158 0.8665 
1 1 1 -2  71  17 o 8  3.88038e+00 1.16390e+00 8.32789e+01 86.838  4.05592e-01  7.34295e+00  0.00000e+00 0.00000e+00 4.99529e+01 86.838  3.33260e+01 266.838 0.9293 
1 1 1 -2  72  1  o 10 1.05759e+01 4.69466e-01 1.19806e+02 187.398 -6.88750e+00 -8.94235e-01 0.00000e+00 0.00000e+00 2.45200e+02 187.398 1.25394e+02 187.398 0.9249 
1 1 1 -2  72  2  o 17 5.81310e+00 5.96740e-01 1.91892e+02 21.052  6.18278e+00  2.37975e+00  0.00000e+00 0.00000e+00 7.87098e+00 21.052  1.84021e+02 201.052 0.9211 
1 1 1 -2  72  3  o 6  1.76852e+01 4.70004e-01 3.97498e+02 8.996   3.99702e+01  6.32793e+00  0.00000e+00 0.00000e+00 2.53951e+02 8.996   1.43547e+02 188.996 0.9876 
1 1 1 -2  72  4  o 10 1.80317e+01 4.54330e-01 3.30381e+02 269.154 -5.55804e-01 -3.76357e+01 0.00000e+00 0.00000e+00 3.33005e+02 269.154 2.62342e+00 269.154 0.9866 
1 1 1 -2  72  5  o 1  2.21066e+01 5.37715e-01 3.80728e+02 154.603 -5.68138e+01 2.69732e+01  0.00000e+00 0.00000e+00 4.36726e+02 154.603 5.59975e+01 154.603 0.9920 
1 1 1 -2  72  6  o 6  1.00305e+01 4.70050e-01 1.93792e+02 61.222  7.94432e+00  1.44640e+01  0.00000e+00 0.00000e+00 1.68436e+02 61.222  2.53554e+01 241.222 0.9692 
1 1 1 -2  72  7  o 11 1.03870e+01 4.25521e-01 2.33118e+02 17.156  2.16427e+01  6.68115e+00  0.00000e+00 0.00000e+00 1.45078e+02 17.156  8.80397e+01 197.156 0.9777 
1 1 1 -2  72  8  o 14 8.83356e+00 4.75476e-01 7.22438e+01 99.261  -1.12962e+00 6.92744e+00  0.00000e+00 0.00000e+00 2.32143e+02 99.261  1.59899e+02 99.261  0.9257 
1 1 1 -2  72  9  o 11 1.06573e+01 4.75115e-01 1.72887e+02 143.367 -1.82261e+01 1.35521e+01  0.00000e+00 0.00000e+00 2.14732e+02 143.367 4.18444e+01 143.367 0.9777 
1 1 1 -2  72  10 o 11 3.32326e+00 7.76736e-01 5.86171e+01 266.680 -1.48002e-01 -2.55109e+00 0.00000e+00 0.00000e+00 3.66206e+01 266.680 2.19965e+01 86.680  0.7709 
1 1 1 -2  72  11 f 0  6.16434e+00 7.02206e-01 9.27842e+01 87.406  3.61759e-01  7.98389e+00  0.00000e+00 0.00000e+00 1.21364e+02 87.406  2.85800e+01 87.406  0.9352 
1 1 1 -2  72  12 o 5  1.07520e+01 6.43435e-01 2.04154e+02 61.846  1.81508e+01  3.39158e+01  0.00000e+00 0.00000e+00 1.89730e+02 61.846  1.44240e+01 241.845 0.9869 
1 1 1 -2  72  13 o 14 1.05494e+01 7.39787e-01 1.38687e+02 194.677 -2.70188e+01 -7.07685e+00 0.00000e+00 0.00000e+00 2.45499e+02 194.677 1.06812e+02 194.677 0.9819 
1 1 1 -2  72  14 o 7  7.92468e+00 1.00156e+00 1.35421e+02 233.607 -1.06154e+01 -1.44021e+01 0.00000e+00 0.00000e+00 1.49894e+02 233.607 1.44724e+01 233.607 0.9716 
1 1 1 -2  72  15 o 6  4.37254e+00 1.13511e+00 2.94142e+01 274.878 1.89701e-01  -2.22295e+00 0.00000e+00 0.00000e+00 8.91177e+01 274.878 5.97036e+01 274.878 0.7323 
1 1 1 -2  72  16 f 0  5.35910e+00 1.25406e+00 1.01363e+02 203.560 -9.05461e+00 -3.94830e+00 0.00000e+00 0.00000e+00 8.65020e+01 203.560 1.48614e+01 23.560  0.9479 
1 1 1 -2  72  17 o 9  7.09839e+00 1.41188e+00 8.85487e+01 19.470  1.06834e+01  3.77681e+00  0.00000e+00 0.00000e+00 1.61815e+02 19.470  7.32663e+01 19.470  0.9548 
1 1 1 -2  73  1  o 12 1.80600e+01 4.69450e-01 3.92982e+02 95.123  -3.81114e+00 4.25064e+01  0.00000e+00 0.00000e+00 2.72847e+02 95.123  1.20134e+02 275.123 0.9882 
1 1 1 -2  73  2  o 2  9.25715e+00 4.71626e-01 1.51199e+02 191.068 -7.90859e+00 -1.54697e+00 0.00000e+00 0.00000e+00 1.71907e+02 191.068 2.07071e+01 191.068 0.9357 
1 1 1 -2  73  3  o 8  5.60313e+00 5.23286e-01 1.38067e+02 220.613 -3.60898e+00 -3.09474e+00 0.00000e+00 0.00000e+00 4.73482e+01 220.613 9.07183e+01 40.613  0.8874 
1 1 1 -2  73  4  o 3  3.73179e+00 7.05011e-01 7.40980e+01 121.698 -1.00381e+00 1.62542e+00  0.00000e+00 0.00000e+00 2.08549e+01 121.698 5.32431e+01 301.698 0.6825 
1 1 1 -2  73  5  o 18 9.51513e+00 4.95529e-01 1.71970e+02 171.566 -1.19828e+01 1.77674e+00  0.00000e+00 0.00000e+00 1.67672e+02 171.566 4.29828e+00 351.566 0.9578 
1 1 1 -2  73  6  o 4  1.15065e+01 4.71228e-01 1.96588e+02 26.824  1.76410e+01  8.92035e+00  0.00000e+00 0.00000e+00 2.21072e+02 26.824  2.44843e+01 26.824  0.9744 
1 1 1 -2  73  7  o 10 1.41619e+01 4.21997e-01 2.10200e+02 244.942 -1.24732e+01 -2.66789e+01 0.00000e+00 0.00000e+00 3.08082e+02 244.942 9.78817e+01 244.942 0.9829 
1 1 1 -2  73  8  o 13 2.32438e+00 6.81983e-01 3.80757e+01 289.099 3.11917e-01  -9.00805e-01 0.00000e+00 0.00000e+00 9.15762e-01 109.099 3.89914e+01 109.099 0.4296 
1 1 1 -2  73  9  o 3  6.77591e+00 5.85407e-01 1.19729e+02 146.470 -8.56241e+00 5.67372e+00  0.00000e+00 0.00000e+00 1.19682e+02 146.470 4.76455e-02 326.470 0.9500 
1 1 1 -2  73  10 o 5  3.65824e+00 7.81733e-01 1.01594e+02 290.366 1.69973e+00  -4.57886e+00 0.00000e+00 0.00000e+00 1.95034e+01 290.366 8.20901e+01 110.366 0.8906 
1 1 1 -2  73  11 o 16 1.13854e+01 5.88603e-01 1.92649e+02 73.998  9.81584e+00  3.42275e+01  0.00000e+00 0.00000e+00 2.24236e+02 73.998  3.15874e+01 73.998  0.9859 
1 1 1 -2  73  12 o 10 4.62651e+00 9.37806e-01 1.30105e+02 193.749 -9.07059e+00 -2.21943e+00 0.00000e+00 0.00000e+00 3.21210e+01 193.749 9.79843e+01 13.749  0.9448 
1 1 1 -2  73  13 o 8  4.89960e+00 1.00660e+00 6.56104e+01 51.204  3.18500e+00  3.96190e+00  0.00000e+00 0.00000e+00 9.70438e+01 51.204  3.14334e+01 51.204  0.8953 
1 1 1 -2  73  14 o 18 6.48102e+00 1.11881e+00 1.07870e+02 21.940  1.03067e+01  4.15158e+00  0.00000e+00 0.00000e+00 1.21159e+02 21.940  1.32893e+01 21.940  0.9539 
1 1 1 -2  73  15 o 1  4.82049e+00 1.20452e+00 8.27018e+01 215.799 -5.28441e+00 -3.81106e+00 0.00000e+00 0.00000e+00 8.13813e+01 215.799 1.32053e+00 35.799  0.9197 
1 1 1 -2  73  16 o 11 4.43043e+00 1.23874e+00 9.51104e+01 92.629  -3.45682e-01 7.52852e+00  0.00000e+00 0.00000e+00 5.74058e+01 92.629  3.77046e+01 272.629 0.9311 
1 1 1 -2  73  17 o 6  3.50406e+00 1.11136e+00 7.41577e+01 332.383 5.41965e+00  -2.83539e+00 0.00000e+00 0.00000e+00 4.41448e+01 332.383 3.00128e+01 152.383 0.9141 
1 1 1 -2  74  1  f 0  8.83043e+00 4.87093e-01 1.14531e+02 84.622  5.49246e-01  5.83406e+00  0.00000e+00 0.00000e+00 1.85240e+02 84.622  7.07094e+01 84.622  0.9101 
1 1 1 -2  74  2  o 10 9.30138e+00 4.79158e-01 1.98182e+02 332.457 1.00973e+01  -5.26597e+00 0.00000e+00 0.00000e+00 1.33100e+02 332.457 6.50820e+01 152.457 0.9550 
1 1 1 -2  74  3  o 16 1.22542e+01 4.41818e-01 2.24509e+02 125.189 -1.10233e+01 1.56329e+01  0.00000e+00 0.00000e+00 2.20277e+02 125.189 4.23229e+00 305.189 0.9735 
1 1 1 -2  74  4  o 13 1.00479e+01 4.57798e-01 1.72865e+02 41.958  9.75267e+00  8.76846e+00  0.00000e+00 0.00000e+00 1.87084e+02 41.958  1.42195e+01 41.958  0.9611 
1 1 1 -2  74  5  o 10 8.10961e+00 5.25614e-01 1.38714e+02 31.880  8.05816e+00  5.01178e+00  0.00000e+00 0.00000e+00 1.47059e+02 31.880  8.34472e+00 31.880  0.9457 
1 1 1 -2  74  6  o 18 5.46809e+00 5.66805e-01 9.58145e+01 29.405  4.18191e+00  2.35683e+00  0.00000e+00 0.00000e+00 8.51436e+01 29.405  1.06708e+01 209.405 0.8885 
1 1 1 -2  74  7  o 3  6.45742e+00 5.29290e-01 9.09249e+01 124.126 -3.22911e+00 4.76463e+00  0.00000e+00 0.00000e+00 1.27444e+02 124.126 3.65191e+01 124.126 0.9084 
1 1 1 -2  74  8  o 3  4.28753e+00 6.64154e-01 1.39047e+02 13.774  6.38082e+00  1.56423e+00  0.00000e+00 0.00000e+00 7.77979e+00 13.774  1.31267e+02 193.774 0.9204 
1 1 1 -2  74  9  o 5  5.98422e+00 6.20012e-01 7.58729e+01 75.760  1.46001e+00  5.75305e+00  0.00000e+00 0.00000e+00 1.26921e+02 75.760  5.10481e+01 75.760  0.9113 
1 1 1 -2  74  10 o 4  6.68498e+00 6.81504e-01 1.06481e+02 282.492 2.06436e+00  -9.31785e+00 0.00000e+00 0.00000e+00 1.28535e+02 282.492 2.20540e+01 282.492 0.9461 
1 1 1 -2  74  11 o 6  3.28752e+00 8.48251e-01 9.87259e+01 3.864   4.71488e+00  3.18463e-01  0.00000e+00 0.00000e+00 9.50799e+00 3.864   8.92179e+01 183.864 0.8866 
1 1 1 -2  74  12 o 17 1.23842e+01 6.42543e-01 2.15181e+02 85.090  3.81058e+00  4.43610e+01  0.00000e+00 0.00000e+00 2.39137e+02 85.090  2.39562e+01 85.090  0.9887 
1 1 1 -2  74  13 o 19 4.46853e+00 1.05521e+00 7.95302e+01 200.555 -5.18996e+00 -1.94611e+00 0.00000e+00 0.00000e+00 7.03297e+01 200.555 9.20051e+00 20.555  0.9046 
1 1 1 -2  74  14 f 0  8.22391e+00 1.00424e+00 7.03561e+01 294.453 4.24463e+00  -9.33431e+00 0.00000e+00 0.00000e+00 2.18995e+02 294.453 1.48639e+02 294.453 0.9499 
1 1 1 -2  74  15 f 0  4.37500e+00 1.18838e+00 1.00661e+02 209.413 -6.64103e+00 -3.74399e+00 0.00000e+00 0.00000e+00 5.02048e+01 209.413 5.04562e+01 29.413  0.9319 
1 1 1 -2  74  16 o 16 3.82610e+00 1.18604e+00 2.31083e+01 117.271 -7.87871e-01 1.52840e+00  0.00000e+00 0.00000e+00 6.82447e+01 117.271 4.51364e+01 117.271 0.6459 
1 1 1 -2  74  17 o 1  3.77645e+00 1.21226e+00 7.05186e+01 325.939 4.98071e+00  -3.36721e+00 0.00000e+00 0.00000e+00 5.67332e+01 325.939 1.37854e+01 145.939 0.9125 
1 1 1 -2  75  1  o 15 7.29106e+00 5.27447e-01 5.50387e+01 288.253 7.87824e-01  -2.38880e+00 0.00000e+00 0.00000e+00 1.53415e+02 288.253 9.83764e+01 288.253 0.7667 
1 1 1 -2  75  2  o 4  1.22162e+01 4.37702e-01 2.68892e+02 98.449  -3.35759e+00 2.26031e+01  0.00000e+00 0.00000e+00 1.76517e+02 98.449  9.23749e+01 278.449 0.9779 
1 1 1 -2  75  3  f 0  1.25620e+01 4.43428e-01 2.17977e+02 354.273 2.06709e+01  -2.07312e+00 0.00000e+00 0.00000e+00 2.38886e+02 354.273 2.09086e+01 354.273 0.9756 
1 1 1 -2  75  4  o 10 1.04647e+01 4.48391e-01 1.38737e+02 84.708  9.96465e-01  1.07581e+01  0.00000e+00 0.00000e+00 2.32731e+02 84.708  9.39938e+01 84.708  0.9525 
1 1 1 -2  75  5  o 7  1.02466e+01 4.74444e-01 2.08571e+02 81.163  2.62180e+00  1.68641e+01  0.00000e+00 0.00000e+00 1.61785e+02 81.163  4.67861e+01 261.163 0.9702 
1 1 1 -2  75  6  o 15 1.08483e+01 4.21395e-01 2.03166e+02 133.544 -1.41932e+01 1.49334e+01  0.00000e+00 0.00000e+00 1.90868e+02 133.544 1.22982e+01 313.544 0.9754 
1 1 1 -2  75  7  o 7  1.52081e+01 4.32454e-01 2.28699e+02 304.034 2.16012e+01  -3.19841e+01 0.00000e+00 0.00000e+00 3.29956e+02 304.034 1.01258e+02 304.034 0.9870 
1 1 1 -2  75  8  o 2  1.25539e+01 4.43571e-01 1.92364e+02 280.405 5.14665e+00  -2.80280e+01 0.00000e+00 0.00000e+00 2.66368e+02 280.405 7.40034e+01 280.405 0.9823 
1 1 1 -2  75  9  o 14 7.02252e+00 5.69790e-01 1.74314e+02 35.946  1.36145e+01  9.87197e+00  0.00000e+00 0.00000e+00 7.88782e+01 35.946  9.54360e+01 215.946 0.9698 
1 1 1 -2  75  10 o 7  3.04340e+00 7.95584e-01 8.40608e+01 329.676 3.10591e+00  -1.81668e+00 0.00000e+00 0.00000e+00 1.16049e+01 329.676 7.24560e+01 149.676 0.8461 
1 1 1 -2  75  11 o 17 2.08307e+01 5.52691e-01 3.24561e+02 84.709  1.02831e+01  1.11033e+02  0.00000e+00 0.00000e+00 4.45319e+02 84.709  1.20758e+02 84.709  0.9955 
1 1 1 -2  75  12 f 0  3.63635e+00 9.10360e-01 1.56660e+02 267.786 -3.49713e-01 -9.04669e+00 0.00000e+00 0.00000e+00 2.94475e+01 87.786  1.86108e+02 87.786  0.9430 
1 1 1 -2  75  13 o 9  1.41874e+01 7.41083e-01 2.20853e+02 16.372  5.50268e+01  1.61663e+01  0.00000e+00 0.00000e+00 3.00402e+02 16.372  7.95491e+01 16.372  0.9912 
1 1 1 -2  75  14 o 3  9.79336e+00 9.44998e-01 1.60124e+02 345.669 2.99750e+01  -7.65787e+00 0.00000e+00 0.00000e+00 1.96632e+02 345.669 3.65079e+01 345.669 0.9837 
1 1 1 -2  75  15 o 5  4.17025e+00 1.15762e+00 3.70706e+01 281.369 5.68069e-01  -2.82523e+00 0.00000e+00 0.00000e+00 8.64869e+01 281.369 4.94164e+01 281.369 0.8008 
1 1 1 -2  75  16 o 5  4.32070e+00 1.23888e+00 1.04768e+02 112.696 -3.46780e+00 8.29148e+00  0.00000e+00 0.00000e+00 4.57519e+01 112.696 5.90160e+01 292.696 0.9426 
1 1 1 -2  75  17 o 7  3.62527e+00 1.15978e+00 3.01593e+01 108.161 -8.26776e-01 2.52036e+00  0.00000e+00 0.00000e+00 7.43160e+01 108.161 4.41567e+01 108.161 0.7806 
1 1 1 -2  76  1  o 12 3.65514e+01 6.19665e-01 5.90032e+02 292.635 5.82014e+01  -1.39577e+02 0.00000e+00 0.00000e+00 7.68255e+02 292.635 1.78222e+02 292.635 0.9967 
1 1 1 -2  76  2  o 10 1.49699e+01 4.41883e-01 2.16376e+02 45.066  1.73599e+01  1.73999e+01  0.00000e+00 0.00000e+00 3.30201e+02 45.066  1.13825e+02 45.066  0.9794 
1 1 1 -2  76  3  o 2  7.41671e+00 4.94024e-01 4.92753e+01 216.426 -2.22030e+00 -1.63849e+00 0.00000e+00 0.00000e+00 1.69231e+02 216.426 1.19955e+02 216.426 0.7905 
1 1 1 -2  76  4  o 7  5.46071e+00 6.47576e-01 9.19056e+01 36.315  3.33251e+00  2.44932e+00  0.00000e+00 0.00000e+00 8.48067e+01 36.315  7.09895e+00 216.315 0.8685 
1 1 1 -2  76  5  f 0  1.07809e+01 4.44692e-01 2.14386e+02 218.501 -1.60484e+01 -1.27660e+01 0.00000e+00 0.00000e+00 1.77233e+02 218.501 3.71531e+01 38.501  0.9753 
1 1 1 -2  76  6  o 13 2.60500e+01 4.84032e-01 3.75641e+02 279.977 1.65722e+01  -9.42118e+01 0.00000e+00 0.00000e+00 5.89109e+02 279.977 2.13468e+02 279.977 0.9948 
1 1 1 -2  76  7  o 14 2.98349e+00 6.84610e-01 5.10598e+01 294.027 6.67930e-01  -1.49832e+00 0.00000e+00 0.00000e+00 1.87708e+01 294.027 3.22889e+01 114.027 0.6290 
1 1 1 -2  76  8  o 13 7.76984e+00 5.00666e-01 1.13542e+02 250.281 -3.64049e+00 -1.01569e+01 0.00000e+00 0.00000e+00 1.61697e+02 250.281 4.81552e+01 250.281 0.9525 
1 1 1 -2  76  9  o 10 4.91503e+00 7.06931e-01 9.17262e+01 84.952  5.33870e-01  6.04340e+00  0.00000e+00 0.00000e+00 7.51396e+01 84.952  1.65866e+01 264.952 0.9134 
1 1 1 -2  76  10 o 17 4.17166e+00 8.10936e-01 1.39151e+02 326.047 6.46077e+00  -4.35016e+00 0.00000e+00 0.00000e+00 5.48519e+00 326.047 1.33666e+02 146.047 0.9334 
1 1 1 -2  76  11 o 7  8.97155e+00 6.10933e-01 1.66588e+02 239.351 -1.28420e+01 -2.16721e+01 0.00000e+00 0.00000e+00 1.59741e+02 239.351 6.84775e+00 59.351  0.9799 
1 1 1 -2  76  12 o 6  3.21220e+00 9.33511e-01 2.41765e+01 120.284 -5.94704e-01 1.01838e+00  0.00000e+00 0.00000e+00 3.61459e+01 120.284 1.19694e+01 120.284 0.5063 
1 1 1 -2  76  13 o 12 7.61896e+00 9.30656e-01 1.05952e+02 128.292 -7.99037e+00 1.01203e+01  0.00000e+00 0.00000e+00 1.65210e+02 128.292 5.92581e+01 128.292 0.9604 
1 1 1 -2  76  14 o 11 1.06430e+01 9.04411e-01 1.45995e+02 89.028  5.07493e-01  2.99025e+01  0.00000e+00 0.00000e+00 2.41410e+02 89.028  9.54154e+01 89.028  0.9831 
1 1 1 -2  76  15 o 4  3.65563e+00 1.08264e+00 4.77219e+01 288.557 1.16043e+00  -3.45666e+00 0.00000e+00 0.00000e+00 6.69943e+01 288.557 1.92724e+01 288.557 0.8484 
1 1 1 -2  76  16 o 1  3.48951e+00 1.16022e+00 7.58823e+01 148.930 -4.74649e+00 2.85984e+00  0.00000e+00 0.00000e+00 4.07545e+01 148.930 3.51278e+01 328.930 0.9046 
1 1 1 -2  77  1  o 5  2.06823e+01 5.93340e-01 3.26047e+02 77.349  1.09313e+01  4.87004e+01  0.00000e+00 0.00000e+00 4.37158e+02 77.349  1.11111e+02 77.349  0.9899 
1 1 1 -2  77  2  o 19 1.15519e+01 4.46054e-01 1.72933e+02 111.938 -5.67079e+00 1.40797e+01  0.00000e+00 0.00000e+00 2.43176e+02 111.938 7.02433e+01 111.938 0.9665 
1 1 1 -2  77  3  o 16 1.47539e+01 4.50482e-01 2.22280e+02 302.691 1.39165e+01  -2.16842e+01 0.00000e+00 0.00000e+00 3.16695e+02 302.691 9.44157e+01 302.691 0.9804 
1 1 1 -2  77  4  o 16 4.78531e+00 5.82893e-01 8.48490e+01 51.020  2.19148e+00  2.70823e+00  0.00000e+00 0.00000e+00 6.49311e+01 51.020  1.99179e+01 231.020 0.8403 
1 1 1 -2  77  5  o 12 2.21399e+00 6.10413e-01 4.14968e+01 33.777  6.91186e-01  4.62308e-01  0.00000e+00 0.00000e+00 9.87685e+00 213.777 5.13737e+01 213.777 0.3835 
1 1 1 -2  77  6  o 13 1.02846e+01 4.28077e-01 1.34852e+02 146.386 -1.15391e+01 7.67057e+00  0.00000e+00 0.00000e+00 2.33876e+02 146.386 9.90245e+01 146.386 0.9632 
1 1 1 -2  77  7  o 5  1.03590e+01 4.48738e-01 1.39487e+02 90.430  -1.25644e-01 1.67519e+01  0.00000e+00 0.00000e+00 2.34226e+02 90.430  9.47389e+01 90.430  0.9697 
1 1 1 -2  77  8  o 18 1.30190e+01 4.52977e-01 2.03832e+02 320.249 2.79611e+01  -2.32561e+01 0.00000e+00 0.00000e+00 2.73563e+02 320.249 6.97310e+01 320.249 0.9862 
1 1 1 -2  77  9  o 10 4.52587e+00 7.37611e-01 7.23690e+01 125.111 -2.61332e+00 3.71678e+00  0.00000e+00 0.00000e+00 7.59059e+01 125.111 3.53690e+00 125.111 0.8816 
1 1 1 -2  77  10 o 10 6.62602e+00 6.72055e-01 9.65062e+01 221.666 -7.52427e+00 -6.69579e+00 0.00000e+00 0.00000e+00 1.37010e+02 221.666 4.05042e+01 221.666 0.9490 
1 1 1 -2  77  11 o 14 3.80567e+00 8.89479e-01 4.09570e+01 43.932  1.75112e+00  1.68703e+00  0.00000e+00 0.00000e+00 6.60021e+01 43.932  2.50451e+01 43.932  0.7573 
1 1 1 -2  77  12 o 1  4.03217e+00 9.90218e-01 8.59749e+01 47.323  3.89191e+00  4.22099e+00  0.00000e+00 0.00000e+00 4.98089e+01 47.323  3.61659e+01 227.323 0.9081 
1 1 1 -2  77  13 o 7  4.78573e+00 1.10530e+00 1.21870e+02 23.322  8.26144e+00  3.56170e+00  0.00000e+00 0.00000e+00 4.52753e+01 23.322  7.65945e+01 203.322 0.9427 
1 1 1 -2  77  14 o 16 2.60096e+00 8.73258e-01 3.02663e+01 253.323 -4.73689e-01 -1.58119e+00 0.00000e+00 0.00000e+00 3.05065e+01 253.323 2.40204e-01 253.323 0.6312 
1 1 1 -2  77  15 o 16 4.84917e+00 1.25435e+00 5.24831e+01 275.678 4.27256e-01  -4.29709e+00 0.00000e+00 0.00000e+00 1.04379e+02 275.678 5.18961e+01 275.678 0.8747 
1 1 1 -2  77  16 o 14 2.66781e+00 8.90249e-01 4.13956e+01 180.554 -3.18568e+00 -3.07879e-02 0.00000e+00 0.00000e+00 3.96998e+01 180.554 1.69577e+00 0.554   0.8228 
1 1 1 -2  78  1  o 12 1.27565e+01 5.54585e-01 2.64618e+02 201.792 -2.29770e+01 -9.18646e+00 0.00000e+00 0.00000e+00 2.01094e+02 201.792 6.35236e+01 21.792  0.9796 
1 1 1 -2  78  2  f 0  1.39288e+01 4.54200e-01 1.64811e+02 270.252 7.92799e-02  -1.80237e+01 0.00000e+00 0.00000e+00 3.39597e+02 270.252 1.74786e+02 270.252 0.9719 
1 1 1 -2  78  3  o 17 8.30324e+00 4.71912e-01 1.64399e+02 232.237 -6.68743e+00 -8.63289e+00 0.00000e+00 0.00000e+00 1.30404e+02 232.237 3.39955e+01 52.237  0.9531 
1 1 1 -2  78  4  o 7  6.18438e+00 4.85235e-01 1.33157e+02 227.877 -4.86403e+00 -5.37876e+00 0.00000e+00 0.00000e+00 8.06384e+01 227.877 5.25185e+01 47.877  0.9282 
1 1 1 -2  78  5  o 16 2.43430e+00 6.61720e-01 8.34205e+01 230.346 -1.22291e+00 -1.47540e+00 0.00000e+00 0.00000e+00 2.14726e+01 50.346  1.04893e+02 50.346  0.6835 
1 1 1 -2  78  6  o 16 1.51103e+01 4.20248e-01 2.84142e+02 277.628 6.22158e+00  -4.64537e+01 0.00000e+00 0.00000e+00 2.72139e+02 277.628 1.20033e+01 97.628  0.9893 
1 1 1 -2  78  7  o 15 9.60026e+00 4.66093e-01 2.01114e+02 77.362  4.96345e+00  2.21354e+01  0.00000e+00 0.00000e+00 1.48017e+02 77.362  5.30966e+01 257.361 0.9777 
1 1 1 -2  78  8  o 13 3.62219e+00 7.43361e-01 1.27100e+02 268.338 -1.58312e-01 -5.45469e+00 0.00000e+00 0.00000e+00 5.50282e+00 88.338  1.32603e+02 88.338  0.9030 
1 1 1 -2  78  9  o 19 6.59533e+00 6.13853e-01 7.49689e+01 62.895  3.08622e+00  6.02976e+00  0.00000e+00 0.00000e+00 1.51183e+02 62.895  7.62145e+01 62.895  0.9229 
1 1 1 -2  78  10 o 11 5.32213e+00 7.72769e-01 7.63939e+01 216.310 -4.97048e+00 -3.65254e+00 0.00000e+00 0.00000e+00 1.04396e+02 216.310 2.80018e+01 216.310 0.9149 
1 1 1 -2  78  11 o 2  8.18240e+00 6.51217e-01 1.81806e+02 257.763 -5.62387e+00 -2.59309e+01 0.00000e+00 0.00000e+00 1.16004e+02 257.763 6.58025e+01 77.763  0.9810 
1 1 1 -2  78  12 o 10 9.84733e+00 7.38022e-01 1.55175e+02 114.300 -1.15342e+01 2.55453e+01  0.00000e+00 0.00000e+00 2.03326e+02 114.300 4.81517e+01 114.300 0.9820 
1 1 1 -2  78  13 o 7  2.79373e+00 8.99342e-01 7.79977e+01 264.030 -4.07960e-01 -3.90131e+00 0.00000e+00 0.00000e+00 1.10493e+01 264.030 6.69484e+01 84.030  0.8605 
1 1 1 -2  78  14 o 19 6.47038e+00 1.16844e+00 1.38795e+02 297.765 7.08395e+00  -1.34558e+01 0.00000e+00 0.00000e+00 9.26522e+01 297.765 4.61423e+01 117.765 0.9665 
1 1 1 -2  78  15 o 8  4.55760e+00 1.22543e+00 5.21960e+01 328.147 3.68888e+00  -2.29195e+00 0.00000e+00 0.00000e+00 9.53362e+01 328.147 4.31402e+01 328.147 0.8755 
1 1 1 -2  78  16 o 3  2.95973e+00 9.76619e-01 2.87764e+01 294.886 9.80892e-01  -2.11450e+00 0.00000e+00 0.00000e+00 5.26962e+01 294.886 2.39198e+01 294.886 0.7453 
1 1 1 -2  79  1  o 16 1.05590e+01 5.68382e-01 1.87528e+02 172.473 -1.64084e+01 2.16809e+00  0.00000e+00 0.00000e+00 1.93830e+02 172.473 6.30194e+00 172.473 0.9693 
1 1 1 -2  79  2  o 13 4.76892e+00 7.82470e-01 1.60314e+02 35.587  4.69958e+00  3.36293e+00  0.00000e+00 0.00000e+00 1.14176e+00 35.587  1.59173e+02 215.587 0.9088 
1 1 1 -2  79  3  o 6  2.59153e+00 6.52152e-01 3.47814e+01 223.490 -5.59717e-01 -5.30966e-01 0.00000e+00 0.00000e+00 6.86426e-02 43.490  3.48501e+01 43.490  0.3596 
1 1 1 -2  79  4  o 4  1.04792e+01 4.12712e-01 1.56077e+02 172.438 -1.51743e+01 2.01451e+00  0.00000e+00 0.00000e+00 2.21142e+02 172.438 6.50648e+01 172.438 0.9668 
1 1 1 -2  79  5  o 7  7.93248e+00 4.49145e-01 1.38815e+02 84.131  1.12215e+00  1.09168e+01  0.00000e+00 0.00000e+00 1.42651e+02 84.131  3.83659e+00 84.131  0.9533 
1 1 1 -2  79  6  o 16 1.50411e+01 4.24624e-01 2.66983e+02 26.159  3.96582e+01  1.94792e+01  0.00000e+00 0.00000e+00 2.86265e+02 26.159  1.92826e+01 26.159  0.9886 
1 1 1 -2  79  7  o 17 1.26291e+01 4.47071e-01 2.28107e+02 288.802 1.14879e+01  -3.37422e+01 0.00000e+00 0.00000e+00 2.34909e+02 288.802 6.80142e+00 288.802 0.9859 
1 1 1 -2  79  8  o 8  5.55653e+00 6.40477e-01 9.78198e+01 61.276  3.35866e+00  6.12853e+00  0.00000e+00 0.00000e+00 9.32997e+01 61.276  4.52014e+00 241.276 0.9254 
1 1 1 -2  79  9  f 0  2.98852e+00 7.75232e-01 5.40020e+01 260.199 -3.89449e-01 -2.25437e+00 0.00000e+00 0.00000e+00 2.81240e+01 260.199 2.58780e+01 80.199  0.7398 
1 1 1 -2  79  10 o 18 1.34585e+01 5.17894e-01 2.08291e+02 281.374 9.21027e+00  -4.57832e+01 0.00000e+00 0.00000e+00 2.85927e+02 281.374 7.76358e+01 281.374 0.9892 
1 1 1 -2  79  11 o 13 8.77058e+00 6.49611e-01 1.79950e+02 348.970 2.81161e+01  -5.48043e+00 0.00000e+00 0.00000e+00 1.39659e+02 348.970 4.02908e+01 168.970 0.9824 
1 1 1 -2  79  12 o 5  2.99263e+00 8.89797e-01 2.61595e+01 100.758 -2.29647e-01 1.20869e+00  0.00000e+00 0.00000e+00 3.17502e+01 100.758 5.59070e+00 100.758 0.5221 
1 1 1 -2  79  13 o 4  6.06851e+00 1.04200e+00 9.14043e+01 267.737 -3.81360e-01 -9.64996e+00 0.00000e+00 0.00000e+00 1.21363e+02 267.737 2.99585e+01 267.737 0.9467 
1 1 1 -2  79  14 o 16 9.50100e+00 9.87765e-01 1.75354e+02 81.591  4.64949e+00  3.14526e+01  0.00000e+00 0.00000e+00 1.70615e+02 81.591  4.73866e+00 261.591 0.9841 
1 1 1 -2  79  15 o 11 5.95034e+00 1.27667e+00 1.14290e+02 295.658 5.11150e+00  -1.06407e+01 0.00000e+00 0.00000e+00 9.61303e+01 295.658 1.81596e+01 115.658 0.9567 
1 1 1 -2  79  16 o 19 3.33690e+00 1.06167e+00 8.68290e+01 130.584 -4.77427e+00 5.57343e+00  0.00000e+00 0.00000e+00 2.76596e+01 130.584 5.91694e+01 310.584 0.9291 
1 1 1 -2  80  1  o 2  2.44032e+01 6.43574e-01 4.41859e+02 41.865  6.80363e+01  6.09701e+01  0.00000e+00 0.00000e+00 4.62235e+02 41.865  2.03756e+01 41.865  0.9945 
1 1 1 -2  80  2  o 7  1.19128e+01 5.12469e-01 2.69739e+02 144.817 -2.30696e+01 1.62635e+01  0.00000e+00 0.00000e+00 1.66034e+02 144.817 1.03705e+02 324.817 0.9821 
1 1 1 -2  80  3  o 10 1.67314e+01 4.85585e-01 2.69418e+02 237.923 -2.21917e+01 -3.54084e+01 0.00000e+00 0.00000e+00 3.46118e+02 237.923 7.67004e+01 237.923 0.9880 
1 1 1 -2  80  4  f 0  6.72251e+00 4.80862e-01 2.15476e+02 167.393 -1.38221e+01 3.09146e+00  0.00000e+00 0.00000e+00 2.57766e+01 167.393 1.89700e+02 347.393 0.9640 
1 1 1 -2  80  5  o 1  1.00871e+01 4.24838e-01 1.20729e+02 231.770 -8.36338e+00 -1.06165e+01 0.00000e+00 0.00000e+00 2.40480e+02 231.770 1.19751e+02 231.770 0.9623 
1 1 1 -2  80  6  o 9  4.08563e+00 6.97806e-01 2.75323e+01 50.067  7.39756e-01  8.83693e-01  0.00000e+00 0.00000e+00 4.81225e+01 50.067  2.05902e+01 50.067  0.4978 
1 1 1 -2  80  7  o 2  9.20823e+00 4.67333e-01 1.38374e+02 187.961 -1.72328e+01 -2.41004e+00 0.00000e+00 0.00000e+00 1.94000e+02 187.961 5.56255e+01 187.961 0.9708 
1 1 1 -2  80  8  o 17 5.20250e+00 6.67854e-01 7.20197e+01 213.142 -4.29969e+00 -2.80746e+00 0.00000e+00 0.00000e+00 1.01281e+02 213.142 2.92616e+01 213.142 0.8964 
1 1 1 -2  80  9  o 19 1.37060e+01 4.90226e-01 2.25551e+02 241.392 -2.21478e+01 -4.06080e+01 0.00000e+00 0.00000e+00 2.77925e+02 241.392 5.23737e+01 241.392 0.9891 
1 1 1 -2  80  10 o 13 7.02397e+00 6.53770e-01 1.55326e+02 77.112  4.03593e+00  1.76393e+01  0.00000e+00 0.00000e+00 9.80471e+01 77.112  5.72787e+01 257.112 0.9720 
1 1 1 -2  80  11 o 11 1.09310e+01 6.16831e-01 1.93673e+02 235.384 -2.25674e+01 -3.26943e+01 0.00000e+00 0.00000e+00 2.06583e+02 235.384 1.29098e+01 235.384 0.9873 
1 1 1 -2  80  12 o 8  9.07648e+00 7.85977e-01 1.29015e+02 209.259 -1.82760e+01 -1.02388e+01 0.00000e+00 0.00000e+00 1.99206e+02 209.259 7.01918e+01 209.259 0.9758 
1 1 1 -2  80  13 o 12 6.01337e+00 1.10693e+00 8.16495e+01 131.109 -5.44127e+00 6.23539e+00  0.00000e+00 0.00000e+00 1.27081e+02 131.109 4.54317e+01 131.109 0.9375 
1 1 1 -2  80  14 o 6  5.57955e+00 1.17921e+00 8.24374e+01 3.125   8.00406e+00  4.37023e-01  0.00000e+00 0.00000e+00 1.10624e+02 3.125   2.81869e+01 3.125   0.9354 
1 1 1 -2  80  15 o 10 4.08123e+00 1.16088e+00 8.58778e+01 184.597 -6.78106e+00 -5.45183e-01 0.00000e+00 0.00000e+00 5.33771e+01 184.597 3.25007e+01 4.597   0.9233 
1 1 1 -2  80  16 o 2  3.76725e+00 1.15198e+00 6.72980e+01 349.051 5.63114e+00  -1.08938e+00 0.00000e+00 0.00000e+00 5.89949e+01 349.051 8.30308e+00 169.051 0.9080 
1 1 1 -2  81  1  o 17 8.05789e+00 6.14873e-01 1.59672e+02 164.886 -1.12624e+01 3.04175e+00  0.00000e+00 0.00000e+00 1.27273e+02 164.886 3.23987e+01 344.886 0.9561 
1 1 1 -2  81  2  o 10 7.65875e+00 6.53053e-01 1.19443e+02 226.494 -5.65018e+00 -5.95284e+00 0.00000e+00 0.00000e+00 1.47768e+02 226.494 2.83243e+01 226.494 0.9369 
1 1 1 -2  81  3  o 10 1.74862e+01 4.92078e-01 2.13783e+02 254.414 -9.82026e+00 -3.52062e+01 0.00000e+00 0.00000e+00 4.28247e+02 254.414 2.14464e+02 254.414 0.9862 
1 1 1 -2  81  4  o 3  1.47416e+01 4.12183e-01 3.35212e+02 150.441 -4.30237e+01 2.44006e+01  0.00000e+00 0.00000e+00 2.07871e+02 150.441 1.27341e+02 330.440 0.9898 
1 1 1 -2  81  5  o 13 2.02636e+01 4.44457e-01 3.25553e+02 101.979 -1.55711e+01 7.33872e+01  0.00000e+00 0.00000e+00 4.23312e+02 101.979 9.77593e+01 101.979 0.9933 
1 1 1 -2  81  6  o 15 1.28510e+01 4.28291e-01 2.44307e+02 309.902 2.37805e+01  -2.84392e+01 0.00000e+00 0.00000e+00 2.27127e+02 309.902 1.71796e+01 129.902 0.9864 
1 1 1 -2  81  7  o 4  1.91112e+00 5.96261e-01 3.54632e+01 271.661 2.43313e-02  -8.39169e-01 0.00000e+00 0.00000e+00 7.99542e+00 91.661  4.34587e+01 91.661  0.3867 
1 1 1 -2  81  8  o 16 1.04957e+01 4.84540e-01 1.67885e+02 320.357 1.93142e+01  -1.60025e+01 0.00000e+00 0.00000e+00 2.14196e+02 320.357 4.63111e+01 320.357 0.9799 
1 1 1 -2  81  9  o 6  5.74788e+00 6.72407e-01 1.61958e+02 82.297  1.96330e+00  1.45159e+01  0.00000e+00 0.00000e+00 4.40387e+01 82.297  1.17920e+02 262.297 0.9652 
1 1 1 -2  81  10 o 16 1.12814e+01 5.44787e-01 2.29148e+02 233.091 -2.82770e+01 -3.76490e+01 0.00000e+00 0.00000e+00 1.84978e+02 233.091 4.41699e+01 53.091  0.9893 
1 1 1 -2  81  11 o 4  3.71391e+00 9.34829e-01 5.60159e+01 240.302 -1.69161e+00 -2.96597e+00 0.00000e+00 0.00000e+00 5.91753e+01 240.302 3.15942e+00 240.302 0.8365 
1 1 1 -2  81  12 o 5  3.16037e+00 9.02023e-01 3.74934e+01 259.893 -3.37351e-01 -1.89251e+00 0.00000e+00 0.00000e+00 4.26657e+01 259.893 5.17234e+00 259.893 0.6846 
1 1 1 -2  81  13 o 6  1.00282e+01 8.61519e-01 1.55182e+02 90.399  -2.14457e-01 3.08296e+01  0.00000e+00 0.00000e+00 2.09968e+02 90.399  5.47855e+01 90.399  0.9836 
1 1 1 -2  81  14 o 8  5.14443e+00 1.19385e+00 1.15206e+02 207.411 -9.73221e+00 -5.04718e+00 0.00000e+00 0.00000e+00 6.61606e+01 207.411 4.90456e+01 27.412  0.9532 
1 1 1 -2  81  15 f 0  3.37031e+00 1.03906e+00 6.17769e+01 299.947 2.53866e+00  -4.40656e+00 0.00000e+00 0.00000e+00 4.97168e+01 299.947 1.20601e+01 119.947 0.8953 
1 1 1 -2  81  16 o 10 3.08414e+00 1.02068e+00 6.49803e+01 89.536  4.28166e-02  5.29059e+00  0.00000e+00 0.00000e+00 3.74411e+01 89.536  2.75392e+01 269.536 0.8997 
1 1 1 -2  82  1  o 18 1.08476e+01 4.92181e-01 1.93599e+02 245.894 -7.93057e+00 -1.77238e+01 0.00000e+00 0.00000e+00 1.99781e+02 245.894 6.18222e+00 245.894 0.9739 
1 1 1 -2  82  2  o 19 1.19390e+01 4.85622e-01 1.92447e+02 145.382 -1.85001e+01 1.27712e+01  0.00000e+00 0.00000e+00 2.42035e+02 145.382 4.95881e+01 145.382 0.9775 
1 1 1 -2  82  3  o 15 2.51318e+01 5.55811e-01 3.98102e+02 326.642 8.16807e+01  -5.37720e+01 0.00000e+00 0.00000e+00 5.32531e+02 326.642 1.34429e+02 326.642 0.9949 
1 1 1 -2  82  4  o 5  1.56665e+01 5.03123e-01 2.87522e+02 141.573 -3.78992e+01 3.00674e+01  0.00000e+00 0.00000e+00 2.89370e+02 141.573 1.84857e+00 141.573 0.9896 
1 1 1 -2  82  5  o 6  1.09333e+01 4.30572e-01 2.24625e+02 53.318  1.70380e+01  2.28730e+01  0.00000e+00 0.00000e+00 1.74866e+02 53.318  4.97589e+01 233.318 0.9823 
1 1 1 -2  82  6  o 3  7.09638e+00 4.94519e-01 1.12938e+02 35.149  8.49232e+00  5.97938e+00  0.00000e+00 0.00000e+00 1.37872e+02 35.149  2.49338e+01 35.149  0.9506 
1 1 1 -2  82  7  o 3  6.26725e+00 5.75125e-01 7.97257e+01 200.921 -6.11371e+00 -2.33715e+00 0.00000e+00 0.00000e+00 1.34571e+02 200.921 5.48457e+01 200.921 0.9201 
1 1 1 -2  82  8  o 14 5.13653e+00 6.86525e-01 4.20270e+01 139.001 -2.39328e+00 2.08035e+00  0.00000e+00 0.00000e+00 1.14778e+02 139.001 7.27507e+01 139.001 0.8219 
1 1 1 -2  82  9  o 10 9.00246e+00 5.50995e-01 1.97326e+02 207.630 -2.58131e+01 -1.35120e+01 0.00000e+00 0.00000e+00 1.31071e+02 207.630 6.62551e+01 27.630  0.9827 
1 1 1 -2  82  10 o 10 2.86936e+00 7.44677e-01 7.19857e+01 321.545 2.76652e+00  -2.19705e+00 0.00000e+00 0.00000e+00 1.77247e+01 321.545 5.42610e+01 141.545 0.8428 
1 1 1 -2  82  11 o 14 3.35340e+00 9.12288e-01 3.04026e+01 76.054  4.02164e-01  1.61946e+00  0.00000e+00 0.00000e+00 4.85522e+01 76.054  1.81497e+01 76.054  0.6351 
1 1 1 -2  82  12 o 4  3.32964e+00 9.78827e-01 8.74372e+01 40.444  3.69473e+00  3.14935e+00  0.00000e+00 0.00000e+00 2.23170e+01 40.444  6.51202e+01 220.444 0.8899 
1 1 1 -2  82  13 f 0  1.17568e+01 8.06613e-01 2.30051e+02 197.584 -5.22721e+01 -1.65655e+01 0.00000e+00 0.00000e+00 2.01076e+02 197.584 2.89755e+01 17.584  0.9908 
1 1 1 -2  82  14 o 17 5.99981e+00 1.20747e+00 8.52240e+01 323.534 7.73479e+00  -5.71635e+00 0.00000e+00 0.00000e+00 1.24755e+02 323.534 3.95307e+01 323.534 0.9465 
1 1 1 -2  82  15 o 15 3.14149e+00 1.02954e+00 6.75562e+01 228.396 -3.24964e+00 -3.65971e+00 0.00000e+00 0.00000e+00 3.58273e+01 228.396 3.17289e+01 48.396  0.8909 
1 1 1 -2  82  16 o 4  3.53883e+00 1.13597e+00 4.84573e+01 101.328 -7.77709e-01 3.88213e+00  0.00000e+00 0.00000e+00 6.41041e+01 101.328 1.56468e+01 101.328 0.8619 
1 1 1 -2  83  1  o 10 1.07202e+01 4.92958e-01 2.38326e+02 114.461 -1.04561e+01 2.29854e+01  0.00000e+00 0.00000e+00 1.52777e+02 114.461 8.55492e+01 294.461 0.9800 
1 1 1 -2  83  2  o 18 6.32955e+00 5.99947e-01 8.43555e+01 354.380 5.14332e+00  -5.06108e-01 0.00000e+00 0.00000e+00 1.27005e+02 354.380 4.26496e+01 354.380 0.8971 
1 1 1 -2  83  3  o 5  2.68794e+00 7.29663e-01 1.14639e+01 223.359 -2.31798e-01 -2.18885e-01 0.00000e+00 0.00000e+00 4.28142e+00 223.359 7.18249e+00 43.359  0.1574 
1 1 1 -2  83  4  o 1  1.00989e+01 5.42962e-01 2.04104e+02 127.509 -1.34790e+01 1.75602e+01  0.00000e+00 0.00000e+00 1.63003e+02 127.509 4.11013e+01 307.509 0.9771 
1 1 1 -2  83  5  o 16 1.20881e+01 4.27554e-01 1.87150e+02 357.562 2.67016e+01  -1.13700e+00 0.00000e+00 0.00000e+00 2.53893e+02 357.562 6.67430e+01 357.562 0.9811 
1 1 1 -2  83  6  o 6  8.56590e+00 4.69933e-01 1.12029e+02 263.038 -1.58265e+00 -1.29611e+01 0.00000e+00 0.00000e+00 1.93943e+02 263.038 8.19144e+01 263.038 0.9609 
1 1 1 -2  83  7  f 0  8.32150e+00 5.14954e-01 1.00869e+02 281.764 2.45725e+00  -1.17997e+01 0.00000e+00 0.00000e+00 1.95199e+02 281.764 9.43296e+01 281.764 0.9576 
1 1 1 -2  83  8  o 7  2.96918e+00 7.38411e-01 5.26138e+01 228.090 -1.44051e+00 -1.60490e+00 0.00000e+00 0.00000e+00 2.69810e+01 228.090 2.56328e+01 48.090  0.7219 
1 1 1 -2  83  9  o 4  6.75033e+00 6.70646e-01 1.71524e+02 10.909  1.79466e+01  3.45888e+00  0.00000e+00 0.00000e+00 7.20461e+01 10.909  9.94783e+01 190.909 0.9722 
1 1 1 -2  83  10 o 3  9.09036e+00 6.03628e-01 1.98688e+02 90.813  -4.74347e-01 3.34294e+01  0.00000e+00 0.00000e+00 1.33377e+02 90.813  6.53106e+01 270.813 0.9849 
1 1 1 -2  83  11 o 4  9.29268e+00 6.95890e-01 1.66176e+02 227.361 -1.80963e+01 -1.96527e+01 0.00000e+00 0.00000e+00 1.71716e+02 227.361 5.54073e+00 227.361 0.9811 
1 1 1 -2  83  12 o 14 8.04734e+00 8.74270e-01 1.77173e+02 192.647 -2.54031e+01 -5.70013e+00 0.00000e+00 0.00000e+00 1.15059e+02 192.647 6.21143e+01 12.647  0.9806 
1 1 1 -2  83  13 o 6  6.28304e+00 1.15863e+00 1.14093e+02 1.653   1.21575e+01  3.50829e-01  0.00000e+00 0.00000e+00 1.08614e+02 1.653   5.47901e+00 181.653 0.9580 
1 1 1 -2  83  14 f 0  4.00605e+00 1.13651e+00 7.02872e+01 212.052 -4.43734e+00 -2.77840e+00 0.00000e+00 0.00000e+00 6.27863e+01 212.052 7.50092e+00 32.052  0.8986 
1 1 1 -2  83  15 o 4  4.59265e+00 1.25660e+00 4.81618e+01 224.295 -3.21912e+00 -3.14084e+00 0.00000e+00 0.00000e+00 1.01144e+02 224.295 5.29819e+01 224.295 0.8803 
1 1 1 -2  84  1  o 13 1.14445e+01 4.87487e-01 1.94792e+02 116.141 -1.08010e+01 2.20075e+01  0.00000e+00 0.00000e+00 2.22381e+02 116.141 2.75890e+01 116.141 0.9794 
1 1 1 -2  84  2  o 5  8.64805e+00 5.30568e-01 1.69989e+02 212.830 -1.32064e+01 -8.52079e+00 0.00000e+00 0.00000e+00 1.41415e+02 212.830 2.85735e+01 32.830  0.9676 
1 1 1 -2  84  3  o 3  1.48327e+01 5.51526e-01 1.88541e+02 343.374 2.97966e+01  -8.89757e+00 0.00000e+00 0.00000e+00 3.54348e+02 343.374 1.65807e+02 343.374 0.9838 
1 1 1 -2  84  4  o 13 1.57428e+01 6.33623e-01 2.87152e+02 350.170 4.63206e+01  -8.02591e+00 0.00000e+00 0.00000e+00 2.92107e+02 350.170 4.95555e+00 350.170 0.9893 
1 1 1 -2  84  5  o 4  1.55832e+01 5.13011e-01 2.66601e+02 118.424 -2.55168e+01 4.71445e+01  0.00000e+00 0.00000e+00 3.07350e+02 118.424 4.07485e+01 118.424 0.9906 
1 1 1 -2  84  6  o 5  5.96785e+00 5.56429e-01 1.57299e+02 120.693 -6.60111e+00 1.11207e+01  0.00000e+00 0.00000e+00 5.57362e+01 120.693 1.01563e+02 300.693 0.9605 
1 1 1 -2  84  7  o 18 2.84617e+00 7.07301e-01 1.08517e+02 67.118  1.59601e+00  3.78155e+00  0.00000e+00 0.00000e+00 1.68079e+01 247.118 1.25325e+02 247.118 0.8674 
1 1 1 -2  84  8  o 1  6.84157e+00 5.97360e-01 1.14053e+02 296.188 5.57736e+00  -1.13406e+01 0.00000e+00 0.00000e+00 1.29685e+02 296.188 1.56326e+01 296.188 0.9596 
1 1 1 -2  84  9  o 13 1.71347e+01 5.04746e-01 3.36986e+02 124.368 -5.28191e+01 7.72326e+01  0.00000e+00 0.00000e+00 2.95376e+02 124.368 4.16100e+01 304.368 0.9946 
1 1 1 -2  84  10 o 6  1.25292e+01 5.59751e-01 1.56675e+02 211.157 -3.22737e+01 -1.95127e+01 0.00000e+00 0.00000e+00 3.01705e+02 211.157 1.45030e+02 211.157 0.9867 
1 1 1 -2  84  11 f 0  7.74015e+00 7.72129e-01 1.44955e+02 351.463 2.00202e+01  -3.00522e+00 0.00000e+00 0.00000e+00 1.34665e+02 351.463 1.02894e+01 171.463 0.9750 
1 1 1 -2  84  12 o 13 4.93996e+00 1.05996e+00 7.52899e+01 310.642 4.16401e+00  -4.85099e+00 0.00000e+00 0.00000e+00 9.26212e+01 310.642 1.73313e+01 310.642 0.9181 
1 1 1 -2  84  13 o 13 4.94576e+00 1.12459e+00 7.06132e+01 132.405 -4.04017e+00 4.42375e+00  0.00000e+00 0.00000e+00 9.62839e+01 132.405 2.56708e+01 132.405 0.9122 
1 1 1 -2  84  14 o 8  3.44167e+00 1.04198e+00 7.10895e+01 278.310 7.49902e-01  -5.13435e+00 0.00000e+00 0.00000e+00 4.30846e+01 278.310 2.80049e+01 98.310  0.8976 
1 1 1 -2  84  15 o 17 4.05575e+00 1.16423e+00 6.73561e+01 169.816 -6.11737e+00 1.09889e+00  0.00000e+00 0.00000e+00 6.97545e+01 169.816 2.39835e+00 169.816 0.9156 
1 1 1 -2  85  1  o 6  7.09339e+00 5.67087e-01 1.41625e+02 339.235 1.04285e+01  -3.95400e+00 0.00000e+00 0.00000e+00 1.10197e+02 339.235 3.14284e+01 159.236 0.9541 
1 1 1 -2  85  2  o 13 5.32204e+00 6.65315e-01 1.26082e+02 216.840 -5.60676e+00 -4.20053e+00 0.00000e+00 0.00000e+00 5.71873e+01 216.840 6.88949e+01 36.840  0.9256 
1 1 1 -2  85  3  o 19 4.23365e+00 6.95774e-01 9.41332e+01 120.152 -2.18308e+00 3.75818e+00  0.00000e+00 0.00000e+00 4.37543e+01 120.152 5.03789e+01 300.152 0.8756 
1 1 1 -2  85  4  o 5  1.02801e+01 6.30363e-01 2.21621e+02 129.755 -1.72623e+01 2.07519e+01  0.00000e+00 0.00000e+00 1.53491e+02 129.755 6.81305e+01 309.755 0.9813 
1 1 1 -2  85  5  o 7  1.58183e+01 5.18659e-01 2.77622e+02 185.399 -5.87756e+01 -5.55509e+00 0.00000e+00 0.00000e+00 3.05360e+02 185.399 2.77375e+01 185.399 0.9915 
1 1 1 -2  85  6  o 14 5.47255e+00 6.19994e-01 1.28540e+02 1.519   9.72871e+00  2.57954e-01  0.00000e+00 0.00000e+00 6.40478e+01 1.519   6.44926e+01 181.519 0.9471 
1 1 1 -2  85  7  o 18 7.10297e+00 5.42702e-01 1.57212e+02 54.989  9.88012e+00  1.41044e+01  0.00000e+00 0.00000e+00 9.88007e+01 54.989  5.84108e+01 234.989 0.9705 
1 1 1 -2  85  8  o 4  5.49417e+00 6.81831e-01 8.23225e+01 108.420 -2.23554e+00 6.71248e+00  0.00000e+00 0.00000e+00 1.06592e+02 108.420 2.42696e+01 108.420 0.9264 
1 1 1 -2  85  9  o 16 1.24936e+01 5.17993e-01 1.81692e+02 227.690 -2.57267e+01 -2.82639e+01 0.00000e+00 0.00000e+00 2.75661e+02 227.690 9.39690e+01 227.690 0.9868 
1 1 1 -2  85  10 o 19 4.28601e+00 8.95400e-01 1.18453e+02 318.209 6.35051e+00  -5.67622e+00 0.00000e+00 0.00000e+00 3.07930e+01 318.209 8.76604e+01 138.209 0.9393 
1 1 1 -2  85  11 o 9  6.97113e+00 8.74780e-01 1.71487e+02 67.602  7.51034e+00  1.82232e+01  0.00000e+00 0.00000e+00 8.01157e+01 67.602  9.13712e+01 247.602 0.9743 
1 1 1 -2  85  12 o 3  4.15724e+00 1.06866e+00 9.53619e+01 150.644 -5.97396e+00 3.36016e+00  0.00000e+00 0.00000e+00 4.68044e+01 150.644 4.85575e+01 330.644 0.9239 
1 1 1 -2  85  13 o 3  3.07344e+00 9.68375e-01 1.37889e+01 297.508 3.98858e-01  -7.65945e-01 0.00000e+00 0.00000e+00 3.12204e+01 297.508 1.74315e+01 297.508 0.3960 
1 1 1 -2  85  14 o 18 5.53869e+00 1.24889e+00 7.24308e+01 279.141 1.13028e+00  -7.02409e+00 0.00000e+00 0.00000e+00 1.17244e+02 279.141 4.48133e+01 279.141 0.9268 
1 1 1 -2  85  15 o 2  4.40707e+00 1.22237e+00 7.66295e+01 125.986 -4.28955e+00 5.90699e+00  0.00000e+00 0.00000e+00 7.44644e+01 125.986 2.16514e+00 305.986 0.9287 
1 1 1 -2  86  1  f 0  1.16658e+01 4.92487e-01 1.46598e+02 116.545 -8.78329e+00 1.75820e+01  0.00000e+00 0.00000e+00 2.76200e+02 116.545 1.29603e+02 116.545 0.9742 
1 1 1 -2  86  2  o 3  4.09857e+00 7.57909e-01 1.38501e+02 48.347  3.79968e+00  4.27165e+00  0.00000e+00 0.00000e+00 1.20867e-01 228.346 1.38622e+02 228.346 0.9077 
1 1 1 -2  86  3  f 0  1.62431e+01 5.51504e-01 2.84021e+02 348.739 5.20347e+01  -1.03610e+01 0.00000e+00 0.00000e+00 3.14286e+02 348.739 3.02648e+01 348.739 0.9905 
1 1 1 -2  86  4  o 12 7.75059e+00 7.44639e-01 1.03244e+02 71.824  3.14232e+00  9.57120e+00  0.00000e+00 0.00000e+00 1.70191e+02 71.824  6.69473e+01 71.824  0.9490 
1 1 1 -2  86  5  f 0  8.62401e+00 5.75207e-01 1.02022e+02 39.402  9.31501e+00  7.65191e+00  0.00000e+00 0.00000e+00 2.04873e+02 39.402  1.02851e+02 39.402  0.9576 
1 1 1 -2  86  6  o 2  6.96786e+00 6.53264e-01 1.29524e+02 342.959 1.23241e+01  -3.77752e+00 0.00000e+00 0.00000e+00 1.19059e+02 342.959 1.04645e+01 162.959 0.9604 
1 1 1 -2  86  7  o 3  9.52940e+00 4.90706e-01 1.69309e+02 47.780  1.62173e+01  1.78729e+01  0.00000e+00 0.00000e+00 1.77101e+02 47.780  7.79126e+00 47.780  0.9791 
1 1 1 -2  86  8  f 0  1.10936e+01 5.08403e-01 1.28019e+02 234.851 -1.36823e+01 -1.94324e+01 0.00000e+00 0.00000e+00 2.74900e+02 234.851 1.46881e+02 234.851 0.9787 
1 1 1 -2  86  9  o 15 4.51124e+00 8.36939e-01 5.44368e+01 331.377 3.31002e+00  -1.80642e+00 0.00000e+00 0.00000e+00 8.84602e+01 331.377 3.40234e+01 331.377 0.8541 
1 1 1 -2  86  10 o 9  5.83628e+00 8.19606e-01 1.38106e+02 73.418  3.95581e+00  1.32851e+01  0.00000e+00 0.00000e+00 7.02460e+01 73.418  6.78605e+01 253.418 0.9632 
1 1 1 -2  86  11 o 1  2.26825e+00 7.50870e-01 4.30646e+01 167.375 -1.81225e+00 4.05929e-01  0.00000e+00 0.00000e+00 1.34603e+01 167.375 2.96043e+01 347.374 0.6729 
1 1 1 -2  86  12 o 19 8.46272e+00 8.92032e-01 1.59058e+02 242.225 -1.21708e+01 -2.31087e+01 0.00000e+00 0.00000e+00 1.48064e+02 242.225 1.09938e+01 62.225  0.9807 
1 1 1 -2  86  13 o 2  5.00375e+00 1.16482e+00 1.16705e+02 129.750 -6.91915e+00 8.31943e+00  0.00000e+00 0.00000e+00 5.95423e+01 129.750 5.71630e+01 309.750 0.9526 
1 1 1 -2  86  14 o 1  3.49882e+00 1.07923e+00 8.05713e+01 126.515 -3.57047e+00 4.82249e+00  0.00000e+00 0.00000e+00 3.73549e+01 126.515 4.32165e+01 306.515 0.9124 
1 1 1 -2  86  15 o 18 3.16351e+00 1.03661e+00 2.83553e+01 204.321 -2.06641e+00 -9.33918e-01 0.00000e+00 0.00000e+00 5.77128e+01 204.321 2.93575e+01 204.321 0.7372 
1 1 1 -2  87  1  o 9  3.84262e+00 6.85974e-01 1.16146e+02 65.444  2.06389e+00  4.51712e+00  0.00000e+00 0.00000e+00 1.14227e+01 65.444  1.04723e+02 245.444 0.8926 
1 1 1 -2  87  2  o 5  9.50128e+00 5.20249e-01 2.27154e+02 149.428 -2.26633e+01 1.33883e+01  0.00000e+00 0.00000e+00 1.19387e+02 149.428 1.07767e+02 329.428 0.9808 
1 1 1 -2  87  3  o 16 3.64921e+00 7.39489e-01 5.74463e+01 214.702 -2.17575e+00 -1.50665e+00 0.00000e+00 0.00000e+00 4.83808e+01 214.702 9.06546e+00 34.702  0.7800 
1 1 1 -2  87  4  o 19 1.00618e+01 5.20617e-01 1.62636e+02 30.849  1.77514e+01  1.06027e+01  0.00000e+00 0.00000e+00 2.02173e+02 30.849  3.95364e+01 30.849  0.9755 
1 1 1 -2  87  5  o 13 1.36828e+01 5.30622e-01 2.36265e+02 177.928 -4.59025e+01 1.66079e+00  0.00000e+00 0.00000e+00 2.66536e+02 177.928 3.02710e+01 177.928 0.9891 
1 1 1 -2  87  6  o 13 1.09511e+01 6.25149e-01 2.06291e+02 29.873  2.77065e+01  1.59147e+01  0.00000e+00 0.00000e+00 1.93997e+02 29.873  1.22934e+01 209.873 0.9842 
1 1 1 -2  87  7  o 12 1.06410e+01 5.61686e-01 2.17735e+02 123.659 -2.10380e+01 3.15937e+01  0.00000e+00 0.00000e+00 1.72024e+02 123.659 4.57110e+01 303.659 0.9867 
1 1 1 -2  87  8  o 2  9.27964e+00 5.28341e-01 1.67004e+02 188.286 -2.46789e+01 -3.59426e+00 0.00000e+00 0.00000e+00 1.70300e+02 188.286 3.29580e+00 188.286 0.9797 
1 1 1 -2  87  9  o 9  4.10564e+00 8.28239e-01 2.24081e+01 273.261 8.68740e-02  -1.52452e+00 0.00000e+00 0.00000e+00 6.93461e+01 273.261 4.69380e+01 273.261 0.6027 
1 1 1 -2  87  10 o 2  5.42717e+00 8.93408e-01 6.50769e+01 81.217  8.47069e-01  5.48222e+00  0.00000e+00 0.00000e+00 1.16855e+02 81.217  5.17776e+01 81.217  0.9047 
1 1 1 -2  87  11 o 6  1.69899e+01 6.21899e-01 2.53058e+02 253.736 -2.52332e+01 -8.64950e+01 0.00000e+00 0.00000e+00 3.72526e+02 253.736 1.19468e+02 253.736 0.9944 
1 1 1 -2  87  12 o 17 7.74790e+00 9.42892e-01 1.48510e+02 73.369  6.57980e+00  2.20285e+01  0.00000e+00 0.00000e+00 1.31841e+02 73.369  1.66686e+01 253.369 0.9780 
1 1 1 -2  87  13 o 18 7.20155e+00 1.11265e+00 5.94886e+01 26.410  7.81537e+00  3.88136e+00  0.00000e+00 0.00000e+00 1.90976e+02 26.410  1.31487e+02 26.410  0.9408 
1 1 1 -2  87  14 f 0  6.23303e+00 1.19041e+00 8.86788e+01 256.949 -2.58800e+00 -1.11641e+01 0.00000e+00 0.00000e+00 1.31242e+02 256.949 4.25631e+01 256.949 0.9553 
1 1 1 -2  87  15 o 10 3.33366e+00 1.06611e+00 4.74471e+01 78.632  7.86264e-01  3.91088e+00  0.00000e+00 0.00000e+00 5.87179e+01 78.632  1.12708e+01 78.632  0.8631 
1 1 1 -2  88  1  o 13 1.10893e+01 4.38244e-01 1.91847e+02 195.009 -2.70018e+01 -7.23962e+00 0.00000e+00 0.00000e+00 2.13053e+02 195.009 2.12063e+01 195.009 0.9819 
1 1 1 -2  88  2  o 1  6.83965e+00 5.81138e-01 1.16642e+02 268.320 -3.10356e-01 -1.05800e+01 0.00000e+00 0.00000e+00 1.25312e+02 268.320 8.67063e+00 268.320 0.9515 
1 1 1 -2  88  3  o 16 6.68192e+00 5.97070e-01 1.06179e+02 60.021  4.39568e+00  7.62001e+00  0.00000e+00 0.00000e+00 1.27607e+02 60.021  2.14282e+01 60.021  0.9413 
1 1 1 -2  88  4  o 9  2.51437e+00 7.13214e-01 8.53239e+01 153.365 -2.40756e+00 1.20743e+00  0.00000e+00 0.00000e+00 1.20300e+01 333.365 9.73538e+01 333.365 0.7845 
1 1 1 -2  88  5  o 8  4.54892e+00 7.94259e-01 5.38058e+01 57.549  1.77907e+00  2.79790e+00  0.00000e+00 0.00000e+00 8.65833e+01 57.549  3.27775e+01 57.549  0.8309 
1 1 1 -2  88  6  o 17 6.65936e+00 8.61952e-01 1.23355e+02 167.507 -1.07006e+01 2.37097e+00  0.00000e+00 0.00000e+00 1.12337e+02 167.507 1.10184e+01 347.507 0.9532 
1 1 1 -2  88  7  o 11 8.04544e+00 6.58986e-01 1.10158e+02 23.076  1.28529e+01  5.47579e+00  0.00000e+00 0.00000e+00 1.77528e+02 23.076  6.73702e+01 23.076  0.9635 
1 1 1 -2  88  8  o 7  8.07478e+00 5.90279e-01 1.85054e+02 172.532 -2.43426e+01 3.19090e+00  0.00000e+00 0.00000e+00 1.08287e+02 172.532 7.67669e+01 352.532 0.9794 
1 1 1 -2  88  9  o 8  5.96242e+00 7.79598e-01 9.49325e+01 18.325  8.81226e+00  2.91863e+00  0.00000e+00 0.00000e+00 1.13823e+02 18.325  1.88902e+01 18.325  0.9445 
1 1 1 -2  88  10 o 6  3.01817e+00 8.58068e-01 6.75003e+01 148.049 -2.97726e+00 1.85684e+00  0.00000e+00 0.00000e+00 2.65928e+01 148.049 4.09075e+01 328.049 0.8416 
1 1 1 -2  88  11 o 19 7.29232e+00 8.43140e-01 1.10043e+02 334.132 1.42978e+01  -6.93281e+00 0.00000e+00 0.00000e+00 1.51267e+02 334.132 4.12243e+01 334.132 0.9680 
1 1 1 -2  88  12 f 0  7.52331e+00 9.89701e-01 1.16180e+02 131.795 -1.12107e+01 1.25405e+01  0.00000e+00 0.00000e+00 1.53698e+02 131.795 3.75182e+01 131.795 0.9698 
1 1 1 -2  88  13 o 18 1.06077e+01 8.93774e-01 1.80517e+02 23.064  4.26434e+01  1.81575e+01  0.00000e+00 0.00000e+00 2.07267e+02 23.064  2.67500e+01 23.064  0.9892 
1 1 1 -2  88  14 o 12 3.16907e+00 1.01988e+00 5.10895e+01 88.504  1.07838e-01  4.12928e+00  0.00000e+00 0.00000e+00 5.05233e+01 88.504  5.66174e-01 268.504 0.8684 
1 1 1 -2  88  15 o 8  4.38343e+00 1.25705e+00 9.15075e+01 322.900 6.57070e+00  -4.96941e+00 0.00000e+00 0.00000e+00 6.00340e+01 322.900 3.14735e+01 142.900 0.9372 
1 1 1 -2  89  1  o 4  1.06313e+01 4.37224e-01 1.71123e+02 202.233 -2.31042e+01 -9.44439e+00 0.00000e+00 0.00000e+00 2.16094e+02 202.233 4.49704e+01 202.233 0.9798 
1 1 1 -2  89  2  o 9  3.22891e+00 6.55655e-01 7.01678e+01 94.907  -2.36160e-01 2.75055e+00  0.00000e+00 0.00000e+00 2.47160e+01 94.907  4.54518e+01 274.907 0.7906 
1 1 1 -2  89  3  o 4  1.03872e+01 5.24651e-01 1.92234e+02 104.842 -6.79808e+00 2.56539e+01  0.00000e+00 0.00000e+00 1.86411e+02 104.842 5.82289e+00 284.842 0.9810 
1 1 1 -2  89  4  o 12 5.54555e+00 6.61114e-01 1.22192e+02 332.238 8.22983e+00  -4.33206e+00 0.00000e+00 0.00000e+00 7.24066e+01 332.238 4.97856e+01 152.238 0.9446 
1 1 1 -2  89  5  o 17 3.23074e+00 7.41495e-01 8.22601e+01 154.099 -3.24461e+00 1.57553e+00  0.00000e+00 0.00000e+00 1.92991e+01 154.099 6.29610e+01 334.099 0.8465 
1 1 1 -2  89  6  o 19 7.72163e+00 8.34720e-01 1.27073e+02 113.945 -5.98906e+00 1.34865e+01  0.00000e+00 0.00000e+00 1.49667e+02 113.945 2.25943e+01 113.945 0.9655 
1 1 1 -2  89  7  o 12 9.21738e+00 6.61321e-01 1.84275e+02 34.450  2.21614e+01  1.52026e+01  0.00000e+00 0.00000e+00 1.51289e+02 34.450  3.29853e+01 214.450 0.9812 
1 1 1 -2  89  8  o 1  5.01106e+00 9.19350e-01 1.12475e+02 173.425 -8.25771e+00 9.51835e-01  0.00000e+00 0.00000e+00 6.17833e+01 173.425 5.06916e+01 353.425 0.9378 
1 1 1 -2  89  9  o 13 3.39134e+00 8.70179e-01 4.27428e+01 133.333 -1.76764e+00 1.87358e+00  0.00000e+00 0.00000e+00 5.44110e+01 133.333 1.16682e+01 133.333 0.7730 
1 1 1 -2  89  10 o 6  7.83381e+00 7.08982e-01 9.48314e+01 204.403 -1.21109e+01 -5.49443e+00 0.00000e+00 0.00000e+00 1.84169e+02 204.403 8.93379e+01 204.403 0.9616 
1 1 1 -2  89  11 o 17 3.36001e+00 9.21693e-01 1.01074e+02 155.497 -5.89744e+00 2.68800e+00  0.00000e+00 0.00000e+00 1.32341e+01 155.497 8.78401e+01 335.497 0.9192 
1 1 1 -2  89  12 o 14 2.34778e+00 7.94711e-01 4.34490e+01 20.410  2.07324e+00  7.71436e-01  0.00000e+00 0.00000e+00 1.99049e+01 20.410  2.35442e+01 200.410 0.7297 
1 1 1 -2  89  13 o 7  4.46885e+00 1.14555e+00 6.33398e+01 285.955 1.55047e+00  -5.42328e+00 0.00000e+00 0.00000e+00 8.63217e+01 285.955 2.29819e+01 285.955 0.9064 
1 1 1 -2  89  14 o 1  3.61398e+00 1.10353e+00 5.55143e+01 185.558 -4.82543e+00 -4.69594e-01 0.00000e+00 0.00000e+00 6.31873e+01 185.558 7.67299e+00 185.558 0.8897 
1 1 1 -2  90  1  o 16 2.84847e+00 6.98216e-01 8.86573e+01 161.097 -3.14994e+00 1.07863e+00  0.00000e+00 0.00000e+00 6.11212e-01 341.097 8.92685e+01 341.097 0.8317 
1 1 1 -2  90  2  o 5  8.15391e+00 4.67245e-01 1.70361e+02 142.293 -1.48031e+01 1.14439e+01  0.00000e+00 0.00000e+00 1.24422e+02 142.293 4.59390e+01 322.293 0.9729 
1 1 1 -2  90  3  o 14 5.73416e+00 6.45685e-01 1.53077e+02 248.686 -4.40451e+00 -1.12889e+01 0.00000e+00 0.00000e+00 5.09634e+01 248.686 1.02113e+02 68.686  0.9578 
1 1 1 -2  90  4  o 2  1.13474e+01 5.09910e-01 2.37809e+02 56.536  2.10045e+01  3.17773e+01  0.00000e+00 0.00000e+00 1.78064e+02 56.536  5.97451e+01 236.536 0.9868 
1 1 1 -2  90  5  o 2  5.09894e+00 7.55004e-01 7.23493e+01 296.368 2.24718e+00  -4.53327e+00 0.00000e+00 0.00000e+00 9.70322e+01 296.368 2.46829e+01 296.368 0.8947 
1 1 1 -2  90  6  o 8  1.39118e+01 7.47555e-01 2.20614e+02 69.920  1.60422e+01  4.38842e+01  0.00000e+00 0.00000e+00 2.90114e+02 69.920  6.95006e+01 69.920  0.9892 
1 1 1 -2  90  7  o 8  6.77664e+00 7.62598e-01 1.28587e+02 291.836 4.77612e+00  -1.19191e+01 0.00000e+00 0.00000e+00 1.12785e+02 291.836 1.58019e+01 111.836 0.9602 
1 1 1 -2  90  8  o 4  8.24888e+00 7.31141e-01 2.09984e+02 106.016 -8.31930e+00 2.89814e+01  0.00000e+00 0.00000e+00 9.07159e+01 106.016 1.19268e+02 286.016 0.9833 
1 1 1 -2  90  9  o 19 7.72898e+00 6.83313e-01 5.60818e+01 45.708  5.69434e+00  5.83689e+00  0.00000e+00 0.00000e+00 2.12105e+02 45.708  1.56023e+02 45.708  0.9365 
1 1 1 -2  90  10 o 9  7.17350e+00 7.75618e-01 1.62580e+02 288.212 6.82933e+00  -2.07566e+01 0.00000e+00 0.00000e+00 9.68804e+01 288.212 6.56994e+01 108.212 0.9768 
1 1 1 -2  90  11 f 0  6.07375e+00 9.74538e-01 1.08988e+02 288.746 3.91281e+00  -1.15295e+01 0.00000e+00 0.00000e+00 1.06304e+02 288.746 2.68390e+00 108.746 0.9580 
1 1 1 -2  90  12 o 3  3.91699e+00 1.03205e+00 3.78840e+01 145.399 -2.37423e+00 1.63793e+00  0.00000e+00 0.00000e+00 7.81218e+01 145.399 4.02377e+01 145.399 0.8011 
1 1 1 -2  90  13 o 3  4.95008e+00 1.17746e+00 5.14388e+01 40.888  3.68913e+00  3.19427e+00  0.00000e+00 0.00000e+00 1.11397e+02 40.888  5.99585e+01 40.888  0.8905 
1 1 1 -2  90  14 f 0  3.13891e+00 9.94844e-01 3.90232e+01 141.716 -2.60377e+00 2.05513e+00  0.00000e+00 0.00000e+00 5.72386e+01 141.716 1.82154e+01 141.716 0.8309 
1 1 1 -2  91  1  o 18 1.21163e+01 4.33039e-01 1.68021e+02 304.135 1.66524e+01  -2.45633e+01 0.00000e+00 0.00000e+00 2.74528e+02 304.135 1.06507e+02 304.135 0.9830 
1 1 1 -2  91  2  o 1  5.62488e+00 5.63108e-01 9.67971e+01 24.069  7.03904e+00  3.14420e+00  0.00000e+00 0.00000e+00 9.81024e+01 24.069  1.30533e+00 24.069  0.9327 
1 1 1 -2  91  3  o 5  6.44288e+00 5.43921e-01 1.03652e+02 10.681  9.18596e+00  1.73248e+00  0.00000e+00 0.00000e+00 1.22460e+02 10.681  1.88075e+01 10.681  0.9449 
1 1 1 -2  91  4  o 12 4.35859e+00 7.82886e-01 1.10539e+02 338.239 6.31888e+00  -2.52242e+00 0.00000e+00 0.00000e+00 3.88811e+01 338.239 7.16575e+01 158.239 0.9233 
1 1 1 -2  91  5  o 4  1.14438e+01 5.29068e-01 2.11830e+02 157.518 -3.71190e+01 1.53614e+01  0.00000e+00 0.00000e+00 2.07615e+02 157.518 4.21544e+00 337.518 0.9875 
1 1 1 -2  91  6  o 9  2.70594e+00 8.06898e-01 6.05602e+01 318.734 1.83629e+00  -1.61127e+00 0.00000e+00 0.00000e+00 1.56049e+01 318.734 4.49553e+01 138.734 0.7586 
1 1 1 -2  91  7  o 9  4.28088e+00 8.35877e-01 8.83988e+01 169.675 -6.09265e+00 1.10992e+00  0.00000e+00 0.00000e+00 5.69010e+01 169.675 3.14978e+01 349.675 0.9153 
1 1 1 -2  91  8  o 2  3.56084e+00 8.31958e-01 5.09697e+01 6.849   2.88070e+00  3.46000e-01  0.00000e+00 0.00000e+00 5.49340e+01 6.849   3.96430e+00 6.849   0.8024 
1 1 1 -2  91  9  o 6  3.23518e+00 9.41594e-01 6.83385e+01 124.465 -2.08523e+00 3.03798e+00  0.00000e+00 0.00000e+00 3.35478e+01 124.465 3.47907e+01 304.465 0.8502 
1 1 1 -2  91  10 o 3  4.59522e+00 8.58037e-01 6.18790e+01 56.743  2.87315e+00  4.38105e+00  0.00000e+00 0.00000e+00 9.09843e+01 56.743  2.91053e+01 56.743  0.8986 
1 1 1 -2  91  11 o 10 6.62961e+00 9.61612e-01 1.13826e+02 157.844 -1.37845e+01 5.61293e+00  0.00000e+00 0.00000e+00 1.23021e+02 157.844 9.19481e+00 157.844 0.9658 
1 1 1 -2  91  12 o 10 4.34163e+00 1.12027e+00 5.27114e+01 108.597 -1.47904e+00 4.39562e+00  0.00000e+00 0.00000e+00 8.91872e+01 108.597 3.64759e+01 108.597 0.8842 
1 1 1 -2  91  13 o 6  3.08968e+00 9.73439e-01 3.20051e+01 331.184 2.25159e+00  -1.23866e+00 0.00000e+00 0.00000e+00 5.61266e+01 331.184 2.41216e+01 331.184 0.7724 
1 1 1 -2  91  14 o 17 2.76627e+00 9.27663e-01 4.80212e+01 146.813 -3.12367e+00 2.04307e+00  0.00000e+00 0.00000e+00 3.89796e+01 146.813 9.04158e+00 326.813 0.8524 
1 1 1 -2  92  1  f 0  7.45989e+00 5.08220e-01 1.44451e+02 354.569 1.60380e+01  -1.52477e+00 0.00000e+00 0.00000e+00 1.23921e+02 354.569 2.05297e+01 174.569 0.9684 
1 1 1 -2  92  2  o 14 1.42739e+00 4.88644e-01 9.62244e+01 180.667 -1.94952e+00 -2.26998e-02 0.00000e+00 0.00000e+00 5.96800e+01 0.667   1.55904e+02 0.667   0.6893 
1 1 1 -2  92  3  o 18 8.37125e+00 4.93510e-01 1.83045e+02 148.848 -2.05178e+01 1.24025e+01  0.00000e+00 0.00000e+00 1.21245e+02 148.848 6.18006e+01 328.848 0.9789 
1 1 1 -2  92  4  o 4  6.29022e+00 6.36008e-01 1.23953e+02 281.665 2.58426e+00  -1.25169e+01 0.00000e+00 0.00000e+00 1.00219e+02 281.665 2.37338e+01 101.665 0.9600 
1 1 1 -2  92  5  o 5  9.13322e+00 5.75979e-01 1.37608e+02 79.190  3.83243e+00  2.00706e+01  0.00000e+00 0.00000e+00 1.92908e+02 79.190  5.53006e+01 79.190  0.9752 
1 1 1 -2  92  6  o 15 9.75179e+00 6.77281e-01 1.83699e+02 17.280  2.61068e+01  8.12154e+00  0.00000e+00 0.00000e+00 1.71342e+02 17.280  1.23567e+01 197.280 0.9815 
1 1 1 -2  92  7  o 16 4.54825e+00 8.44749e-01 9.56604e+01 109.621 -2.41531e+00 6.77498e+00  0.00000e+00 0.00000e+00 6.07611e+01 109.621 3.48993e+01 289.621 0.9276 
1 1 1 -2  92  8  o 5  4.25440e+00 9.81062e-01 1.04016e+02 6.587   7.31506e+00  8.44742e-01  0.00000e+00 0.00000e+00 4.24980e+01 6.587   6.15178e+01 186.587 0.9294 
1 1 1 -2  92  9  o 17 7.16433e+00 9.17954e-01 1.60400e+02 81.263  3.05990e+00  1.99096e+01  0.00000e+00 0.00000e+00 9.82427e+01 81.263  6.21574e+01 261.263 0.9749 
1 1 1 -2  92  10 f 0  4.72808e+00 9.85810e-01 4.69439e+01 267.577 -1.69310e-01 -4.00183e+00 0.00000e+00 0.00000e+00 1.04190e+02 267.577 5.72457e+01 267.577 0.8637 
1 1 1 -2  92  11 o 15 4.78829e+00 9.59239e-01 8.65683e+01 230.767 -5.15410e+00 -6.31211e+00 0.00000e+00 0.00000e+00 7.92597e+01 230.767 7.30857e+00 50.767  0.9365 
1 1 1 -2  92  12 o 15 5.01227e+00 1.05815e+00 8.10775e+01 79.290  1.49419e+00  7.90030e+00  0.00000e+00 0.00000e+00 9.22057e+01 79.290  1.11282e+01 79.290  0.9356 
1 1 1 -2  92  13 o 15 4.62639e+00 1.07964e+00 1.03687e+02 304.066 5.93162e+00  -8.77207e+00 0.00000e+00 0.00000e+00 5.88483e+01 304.066 4.48388e+01 124.066 0.9515 
1 1 1 -2  92  14 o 14 2.44038e+00 8.39901e-01 3.50767e+01 129.332 -1.71223e+00 2.08958e+00  0.00000e+00 0.00000e+00 3.56115e+01 129.332 5.34738e-01 129.332 0.7852 
1 1 1 -2  93  1  o 16 1.10718e+01 4.57468e-01 1.54691e+02 325.066 2.08455e+01  -1.45604e+01 0.00000e+00 0.00000e+00 2.48324e+02 325.066 9.36326e+01 325.066 0.9801 
1 1 1 -2  93  2  o 17 1.14504e+01 4.51376e-01 2.25161e+02 145.112 -3.34510e+01 2.33249e+01  0.00000e+00 0.00000e+00 1.94764e+02 145.112 3.03975e+01 325.112 0.9877 
1 1 1 -2  93  3  o 2  2.07106e+00 6.24329e-01 1.21384e+02 307.251 2.18460e+00  -2.87277e+00 0.00000e+00 0.00000e+00 5.62937e+01 127.251 1.77677e+02 127.251 0.8466 
1 1 1 -2  93  4  o 11 3.03750e+00 7.34281e-01 4.31864e+01 62.227  9.43506e-01  1.79156e+00  0.00000e+00 0.00000e+00 3.59266e+01 62.227  7.25985e+00 242.227 0.7018 
1 1 1 -2  93  5  o 4  4.01825e+00 7.77542e-01 6.93583e+01 12.534  4.10490e+00  9.12614e-01  0.00000e+00 0.00000e+00 6.04790e+01 12.534  8.87930e+00 192.534 0.8710 
1 1 1 -2  93  6  o 3  6.57027e+00 6.98593e-01 5.87932e+01 35.975  4.92118e+00  3.57211e+00  0.00000e+00 0.00000e+00 1.63802e+02 35.975  1.05009e+02 35.975  0.9136 
1 1 1 -2  93  7  o 14 2.63417e+00 7.81045e-01 4.94576e+01 118.877 -1.09294e+00 1.98174e+00  0.00000e+00 0.00000e+00 2.24603e+01 118.877 2.69973e+01 298.877 0.7366 
1 1 1 -2  93  8  o 13 3.92683e+00 9.73022e-01 6.95307e+01 107.812 -1.34552e+00 4.18766e+00  0.00000e+00 0.00000e+00 5.80872e+01 107.812 1.14435e+01 287.812 0.8773 
1 1 1 -2  93  9  o 17 4.71721e+00 1.03278e+00 8.32344e+01 221.057 -4.78159e+00 -4.16497e+00 0.00000e+00 0.00000e+00 7.69784e+01 221.057 6.25591e+00 41.057  0.9174 
1 1 1 -2  93  10 o 7  5.55740e+00 1.08433e+00 6.35739e+01 196.776 -6.04599e+00 -1.82265e+00 0.00000e+00 0.00000e+00 1.24975e+02 196.776 6.14007e+01 196.776 0.9170 
1 1 1 -2  93  11 o 7  8.82465e+00 8.08580e-01 1.58493e+02 356.425 2.99944e+01  -1.87409e+00 0.00000e+00 0.00000e+00 1.62298e+02 356.425 3.80545e+00 356.425 0.9832 
1 1 1 -2  93  12 o 5  7.76151e+00 1.15840e+00 8.29984e+01 127.690 -7.59653e+00 9.83236e+00  0.00000e+00 0.00000e+00 1.91944e+02 127.690 1.08946e+02 127.690 0.9589 
1 1 1 -2  93  13 o 12 3.43709e+00 1.05124e+00 6.16097e+01 232.772 -3.16881e+00 -4.17047e+00 0.00000e+00 0.00000e+00 5.23979e+01 232.772 9.21182e+00 52.772  0.8986 
1 1 1 -2  93  14 o 9  4.76793e+00 1.24668e+00 5.31992e+01 142.448 -4.17183e+00 3.20722e+00  0.00000e+00 0.00000e+00 1.04898e+02 142.448 5.16992e+01 142.448 0.8991 
1 1 1 -2  94  1  o 1  1.40698e+01 4.48296e-01 2.63133e+02 0.225   5.60340e+01  2.19791e-01  0.00000e+00 0.00000e+00 2.54572e+02 0.225   8.56150e+00 180.225 0.9910 
1 1 1 -2  94  2  o 7  3.35136e+00 7.20789e-01 9.51001e+01 100.883 -9.52950e-01 4.95650e+00  0.00000e+00 0.00000e+00 1.61799e+01 100.883 7.89202e+01 280.883 0.8945 
1 1 1 -2  94  3  o 19 6.31174e+00 5.72334e-01 9.05174e+01 339.973 8.75444e+00  -3.19109e+00 0.00000e+00 0.00000e+00 1.30781e+02 339.973 4.02631e+01 339.973 0.9447 
1 1 1 -2  94  4  o 18 8.06346e+00 5.08189e-01 1.19892e+02 45.923  1.12382e+01  1.16062e+01  0.00000e+00 0.00000e+00 1.69869e+02 45.923  4.99762e+01 45.923  0.9685 
1 1 1 -2  94  5  o 16 1.35874e+01 5.06772e-01 2.47580e+02 290.147 1.87383e+01  -5.10753e+01 0.00000e+00 0.00000e+00 2.51711e+02 290.147 4.13054e+00 290.147 0.9908 
1 1 1 -2  94  6  o 7  4.11953e+00 7.62018e-01 6.13276e+01 27.124  3.57046e+00  1.82897e+00  0.00000e+00 0.00000e+00 7.06230e+01 27.124  9.29534e+00 27.124  0.8640 
1 1 1 -2  94  7  o 6  8.71013e+00 6.50876e-01 1.78622e+02 242.464 -1.36639e+01 -2.62078e+01 0.00000e+00 0.00000e+00 1.38633e+02 242.464 3.99895e+01 62.464  0.9829 
1 1 1 -2  94  8  o 18 9.18683e+00 6.86936e-01 1.40722e+02 68.239  9.02072e+00  2.25979e+01  0.00000e+00 0.00000e+00 1.92455e+02 68.239  5.17332e+01 68.239  0.9792 
1 1 1 -2  94  9  o 6  9.39868e+00 8.10540e-01 1.43182e+02 261.113 -3.94096e+00 -2.52036e+01 0.00000e+00 0.00000e+00 1.97811e+02 261.113 5.46285e+01 261.113 0.9802 
1 1 1 -2  94  10 o 18 6.05903e+00 1.14755e+00 1.03568e+02 43.132  7.43530e+00  6.96551e+00  0.00000e+00 0.00000e+00 1.09251e+02 43.132  5.68359e+00 43.132  0.9496 
1 1 1 -2  94  11 o 1  2.82671e+00 9.16397e-01 2.42759e+01 1.681   1.54648e+00  4.53841e-02  0.00000e+00 0.00000e+00 3.92050e+01 1.681   1.49291e+01 1.681   0.6076 
1 1 1 -2  94  12 o 5  3.61671e+00 1.06084e+00 8.08801e+01 174.198 -6.01980e+00 6.11632e-01  0.00000e+00 0.00000e+00 4.10958e+01 174.198 3.97843e+01 354.198 0.9131 
1 1 1 -2  94  13 o 18 5.36511e+00 1.23039e+00 7.63434e+01 100.530 -1.59649e+00 8.58885e+00  0.00000e+00 0.00000e+00 1.09941e+02 100.530 3.35971e+01 100.530 0.9409 
1 1 1 -2  95  1  o 8  7.29605e+00 5.26260e-01 9.34449e+01 309.594 7.20506e+00  -8.71120e+00 0.00000e+00 0.00000e+00 1.65105e+02 309.594 7.16597e+01 309.594 0.9547 
1 1 1 -2  95  2  o 6  2.30453e+00 6.50258e-01 3.54001e+01 220.929 -9.83878e-01 -8.53137e-01 0.00000e+00 0.00000e+00 1.10678e+01 220.929 2.43323e+01 40.929  0.5433 
1 1 1 -2  95  3  o 10 4.59982e+00 6.76654e-01 1.37644e+02 154.763 -9.01849e+00 4.25095e+00  0.00000e+00 0.00000e+00 2.42266e+01 154.763 1.13417e+02 334.763 0.9484 
1 1 1 -2  95  4  o 16 5.00102e+00 6.80154e-01 6.93529e+01 206.437 -5.09232e+00 -2.53191e+00 0.00000e+00 0.00000e+00 9.89348e+01 206.437 2.95819e+01 206.437 0.9072 
1 1 1 -2  95  5  o 6  5.76860e+00 6.58430e-01 8.94449e+01 256.450 -1.93164e+00 -8.01524e+00 0.00000e+00 0.00000e+00 1.11027e+02 256.450 2.15818e+01 256.450 0.9372 
1 1 1 -2  95  6  o 19 4.67210e+00 7.60479e-01 1.02562e+02 150.308 -7.30968e+00 4.16798e+00  0.00000e+00 0.00000e+00 5.99635e+01 150.308 4.25989e+01 330.308 0.9385 
1 1 1 -2  95  7  o 17 4.66725e+00 8.86684e-01 9.44778e+01 106.218 -2.04130e+00 7.01803e+00  0.00000e+00 0.00000e+00 6.61210e+01 106.218 2.83568e+01 286.218 0.9288 
1 1 1 -2  95  8  o 12 5.34433e+00 9.06582e-01 1.35449e+02 153.402 -1.04830e+01 5.24898e+00  0.00000e+00 0.00000e+00 5.37953e+01 153.402 8.16537e+01 333.402 0.9564 
1 1 1 -2  95  9  o 11 7.39599e+00 9.40914e-01 1.14245e+02 109.352 -5.20673e+00 1.48253e+01  0.00000e+00 0.00000e+00 1.50580e+02 109.352 3.63352e+01 109.352 0.9676 
1 1 1 -2  95  10 o 7  5.57500e+00 1.12368e+00 1.20419e+02 187.149 -1.15968e+01 -1.45446e+00 0.00000e+00 0.00000e+00 7.67157e+01 187.149 4.37036e+01 7.149   0.9562 
1 1 1 -2  95  11 o 14 3.73371e+00 1.09814e+00 4.10181e+01 8.796   3.12320e+00  4.83288e-01  0.00000e+00 0.00000e+00 7.22812e+01 8.796   3.12631e+01 8.796   0.8212 
1 1 1 -2  95  12 o 2  7.15806e+00 1.13646e+00 1.22896e+02 96.957  -2.16030e+00 1.77051e+01  0.00000e+00 0.00000e+00 1.33889e+02 96.957  1.09929e+01 96.957  0.9716 
1 1 1 -2  95  13 o 2  2.96977e+00 9.52795e-01 2.05709e+01 346.840 1.61547e+00  -3.77701e-01 0.00000e+00 0.00000e+00 4.87894e+01 346.840 2.82185e+01 346.840 0.6331 
1 1 1 -2  96  1  o 12 3.79595e+00 7.50960e-01 1.20191e+02 290.008 2.37062e+00  -6.51039e+00 0.00000e+00 0.00000e+00 1.00693e+01 290.008 1.10122e+02 110.008 0.9247 
1 1 1 -2  96  2  o 14 1.53741e+01 4.58885e-01 2.50635e+02 118.375 -3.10478e+01 5.74817e+01  0.00000e+00 0.00000e+00 3.15401e+02 118.375 6.47655e+01 118.375 0.9923 
1 1 1 -2  96  3  o 6  3.57359e+00 7.26860e-01 7.78256e+01 80.867  7.10014e-01  4.41655e+00  0.00000e+00 0.00000e+00 3.87647e+01 80.867  3.90609e+01 260.867 0.8795 
1 1 1 -2  96  4  o 17 5.44677e+00 6.59308e-01 1.02656e+02 326.157 8.07110e+00  -5.41180e+00 0.00000e+00 0.00000e+00 8.86336e+01 326.157 1.40221e+01 146.157 0.9471 
1 1 1 -2  96  5  o 16 2.61852e+00 7.38133e-01 3.88108e+01 155.444 -1.61101e+00 7.36079e-01  0.00000e+00 0.00000e+00 2.49037e+01 155.444 1.39070e+01 335.444 0.6564 
1 1 1 -2  96  6  f 0  5.65845e+00 7.09367e-01 6.78925e+01 282.884 1.58397e+00  -6.92468e+00 0.00000e+00 0.00000e+00 1.26403e+02 282.884 5.85105e+01 282.884 0.9267 
1 1 1 -2  96  7  o 1  4.97502e+00 8.93238e-01 8.67890e+01 246.776 -2.92187e+00 -6.80922e+00 0.00000e+00 0.00000e+00 8.45419e+01 246.776 2.24707e+00 66.776  0.9298 
1 1 1 -2  96  8  o 6  5.61267e+00 8.59680e-01 1.14029e+02 35.620  9.30488e+00  6.66655e+00  0.00000e+00 0.00000e+00 8.44400e+01 35.620  2.95888e+01 215.620 0.9553 
1 1 1 -2  96  9  o 8  4.90639e+00 9.67055e-01 8.70186e+01 265.033 -6.83920e-01 -7.87024e+00 0.00000e+00 0.00000e+00 8.25805e+01 265.033 4.43811e+00 85.033  0.9344 
1 1 1 -2  96  10 o 16 2.89249e+00 9.24681e-01 6.93420e+01 319.375 3.00122e+00  -2.57459e+00 0.00000e+00 0.00000e+00 2.28086e+01 319.375 4.65334e+01 139.375 0.8617 
1 1 1 -2  96  11 o 13 4.82923e+00 1.20090e+00 3.66881e+01 152.405 -2.77732e+00 1.45166e+00  0.00000e+00 0.00000e+00 1.09502e+02 152.405 7.28136e+01 152.405 0.8194 
1 1 1 -2  96  12 o 7  4.28173e+00 1.23248e+00 5.02579e+01 296.342 1.84350e+00  -3.72309e+00 0.00000e+00 0.00000e+00 8.71274e+01 296.342 3.68695e+01 296.342 0.8692 
1 1 1 -2  96  13 o 3  2.56458e+00 8.56175e-01 5.92434e+01 37.038  3.95296e+00  2.98292e+00  0.00000e+00 0.00000e+00 2.51558e+01 37.038  3.40876e+01 217.038 0.8923 
1 1 1 -2  97  1  o 4  2.05706e+00 6.23854e-01 5.75840e+01 252.377 -5.75192e-01 -1.81070e+00 0.00000e+00 0.00000e+00 5.64198e+00 72.377  6.32260e+01 72.377  0.6806 
1 1 1 -2  97  2  f 0  7.05511e+00 5.52347e-01 1.07917e+02 173.342 -1.30172e+01 1.51944e+00  0.00000e+00 0.00000e+00 1.43586e+02 173.342 3.56687e+01 173.342 0.9611 
1 1 1 -2  97  3  f 0  2.87626e+00 6.88990e-01 4.21274e+01 306.983 1.25128e+00  -1.66155e+00 0.00000e+00 0.00000e+00 3.36556e+01 306.983 8.47183e+00 126.983 0.7105 
1 1 1 -2  97  4  o 16 4.30175e+00 7.46450e-01 8.38805e+01 350.895 5.70286e+00  -9.13985e-01 0.00000e+00 0.00000e+00 6.10427e+01 350.895 2.28378e+01 170.895 0.9087 
1 1 1 -2  97  5  o 8  4.38288e+00 7.64112e-01 1.16734e+02 113.011 -3.50234e+00 8.24658e+00  0.00000e+00 0.00000e+00 3.63427e+01 113.011 8.03917e+01 293.011 0.9424 
1 1 1 -2  97  6  o 4  9.79964e+00 5.38689e-01 1.69310e+02 50.848  2.04926e+01  2.51695e+01  0.00000e+00 0.00000e+00 1.88077e+02 50.848  1.87675e+01 50.848  0.9845 
1 1 1 -2  97  7  o 6  5.14410e+00 8.28574e-01 2.16292e+01 306.343 1.21884e+00  -1.65661e+00 0.00000e+00 0.00000e+00 1.13008e+02 306.343 9.13784e+01 306.343 0.7069 
1 1 1 -2  97  8  o 1  5.73284e+00 9.00981e-01 5.62479e+01 179.165 -5.79031e+00 8.44138e-02  0.00000e+00 0.00000e+00 1.36597e+02 179.165 8.03493e+01 179.165 0.9090 
1 1 1 -2  97  9  o 10 5.19474e+00 9.56052e-01 8.83747e+01 46.495  5.84008e+00  6.15301e+00  0.00000e+00 0.00000e+00 9.20445e+01 46.495  3.66988e+00 46.495  0.9391 
1 1 1 -2  97  10 o 8  5.28362e+00 1.04859e+00 6.96958e+01 137.901 -5.25392e+00 4.74708e+00  0.00000e+00 0.00000e+00 1.11220e+02 137.901 4.15243e+01 137.901 0.9264 
1 1 1 -2  97  11 o 8  4.99524e+00 1.25259e+00 8.91879e+01 343.077 7.60011e+00  -2.31235e+00 0.00000e+00 0.00000e+00 8.32680e+01 343.077 5.91992e+00 163.077 0.9348 
1 1 1 -2  97  12 o 1  3.19705e+00 1.05401e+00 2.87072e+01 195.865 -2.17864e+00 -6.19152e-01 0.00000e+00 0.00000e+00 5.82272e+01 195.865 2.95200e+01 195.865 0.7368 
1 1 1 -2  97  13 o 14 4.11523e+00 1.14953e+00 5.14215e+01 199.776 -4.88315e+00 -1.75576e+00 0.00000e+00 0.00000e+00 8.47822e+01 199.776 3.33607e+01 199.776 0.8976 
1 1 1 -2  98  1  o 4  3.23943e+00 7.76056e-01 7.52827e+01 85.367  3.25277e-01  4.01374e+00  0.00000e+00 0.00000e+00 2.85911e+01 85.367  4.66916e+01 265.367 0.8645 
1 1 1 -2  98  2  o 18 6.03197e+00 5.90064e-01 1.08747e+02 73.092  3.13337e+00  1.03078e+01  0.00000e+00 0.00000e+00 1.04287e+02 73.092  4.46065e+00 253.092 0.9524 
1 1 1 -2  98  3  o 2  2.42088e+00 6.96296e-01 9.27552e+01 243.575 -1.63537e+00 -3.29086e+00 0.00000e+00 0.00000e+00 1.64894e+01 63.575  1.09245e+02 63.575  0.8497 
1 1 1 -2  98  4  o 8  5.60341e+00 6.48925e-01 1.16179e+02 2.285   1.17461e+01  4.68682e-01  0.00000e+00 0.00000e+00 8.24616e+01 2.285   3.37179e+01 182.285 0.9565 
1 1 1 -2  98  5  o 16 3.24973e+00 8.09000e-01 5.50755e+01 135.658 -2.24734e+00 2.19634e+00  0.00000e+00 0.00000e+00 4.36528e+01 135.658 1.14226e+01 315.657 0.8200 
1 1 1 -2  98  6  o 15 1.66478e+01 5.26234e-01 3.08580e+02 264.124 -9.71958e+00 -9.44492e+01 0.00000e+00 0.00000e+00 3.04709e+02 264.124 3.87062e+00 84.124  0.9947 
1 1 1 -2  98  7  o 1  1.06363e+01 5.54264e-01 1.67289e+02 94.010  -2.54205e+00 3.62635e+01  0.00000e+00 0.00000e+00 2.20980e+02 94.010  5.36912e+01 94.010  0.9861 
1 1 1 -2  98  8  o 3  1.03655e+01 6.64605e-01 1.92017e+02 314.736 3.04850e+01  -3.07674e+01 0.00000e+00 0.00000e+00 1.87022e+02 314.736 4.99464e+00 134.736 0.9884 
1 1 1 -2  98  9  o 13 3.85056e+00 9.80988e-01 8.42254e+01 225.860 -4.35412e+00 -4.48676e+00 0.00000e+00 0.00000e+00 4.62045e+01 225.860 3.80209e+01 45.860  0.9161 
1 1 1 -2  98  10 o 19 2.73199e+00 8.64536e-01 3.04844e+01 8.642   1.98075e+00  3.01053e-01  0.00000e+00 0.00000e+00 4.00126e+01 8.642   9.52823e+00 8.642   0.6983 
1 1 1 -2  98  11 o 14 3.40021e+00 1.06699e+00 6.28229e+00 243.844 -1.97823e-01 -4.02805e-01 0.00000e+00 0.00000e+00 2.12021e+01 243.844 1.49198e+01 243.844 0.2189 
1 1 1 -2  98  12 o 9  3.30253e+00 1.08516e+00 6.89417e+01 85.858  4.04341e-01  5.58373e+00  0.00000e+00 0.00000e+00 4.14058e+01 85.858  2.75358e+01 265.858 0.9056 
1 1 1 -2  99  1  o 14 1.13548e+01 4.66146e-01 1.68333e+02 152.185 -3.23537e+01 1.70692e+01  0.00000e+00 0.00000e+00 2.46900e+02 152.185 7.85666e+01 152.185 0.9862 
1 1 1 -2  99  2  o 15 2.19847e+00 6.63065e-01 5.29320e+01 91.683  -5.66460e-02 1.92771e+00  0.00000e+00 0.00000e+00 2.95347e+00 91.683  4.99786e+01 271.683 0.6857 
1 1 1 -2  99  3  o 16 3.54997e+00 7.86977e-01 3.30689e+01 292.776 7.69933e-01  -1.83374e+00 0.00000e+00 0.00000e+00 5.84994e+01 292.776 2.54305e+01 292.776 0.6959 
1 1 1 -2  99  4  o 6  4.17739e+00 7.24550e-01 8.11320e+01 177.719 -5.68957e+00 2.26608e-01  0.00000e+00 0.00000e+00 5.93095e+01 177.719 2.18225e+01 357.719 0.9073 
1 1 1 -2  99  5  o 1  7.06031e+00 6.77534e-01 1.29743e+02 64.180  7.53267e+00  1.55681e+01  0.00000e+00 0.00000e+00 1.24094e+02 64.180  5.64931e+00 244.180 0.9706 
1 1 1 -2  99  6  o 14 6.12607e+00 6.96120e-01 6.53708e+01 103.686 -1.88188e+00 7.72828e+00  0.00000e+00 0.00000e+00 1.46667e+02 103.686 8.12963e+01 103.686 0.9348 
1 1 1 -2  99  7  o 3  7.94955e+00 6.61421e-01 1.55973e+02 323.517 2.01130e+01  -1.48738e+01 0.00000e+00 0.00000e+00 1.32274e+02 323.517 2.36992e+01 143.517 0.9798 
1 1 1 -2  99  8  o 18 6.77220e+00 7.99527e-01 1.32162e+02 170.876 -1.91844e+01 3.08107e+00  0.00000e+00 0.00000e+00 1.11788e+02 170.876 2.03745e+01 350.876 0.9739 
1 1 1 -2  99  9  o 2  1.09035e+01 7.10557e-01 1.54462e+02 18.401  3.61204e+01  1.20165e+01  0.00000e+00 0.00000e+00 2.43255e+02 18.401  8.87922e+01 18.401  0.9868 
1 1 1 -2  99  10 o 9  4.22004e+00 9.23306e-01 8.15889e+01 249.780 -2.84488e+00 -7.72369e+00 0.00000e+00 0.00000e+00 6.44995e+01 249.780 1.70895e+01 69.780  0.9371 
1 1 1 -2  99  11 f 0  3.13285e+00 9.72427e-01 2.85619e+01 288.525 7.39339e-01  -2.20639e+00 0.00000e+00 0.00000e+00 5.75695e+01 288.525 2.90076e+01 288.525 0.7448 
1 1 1 -2  99  12 o 2  3.38839e+00 1.11321e+00 6.54136e+01 67.777  1.95270e+00  4.77943e+00  0.00000e+00 0.00000e+00 4.66974e+01 67.777  1.87161e+01 247.777 0.8970 
1 1 1 -2  100 1  o 7  4.46215e+00 7.41801e-01 1.02297e+02 69.258  2.80912e+00  7.41752e+00  0.00000e+00 0.00000e+00 5.23020e+01 69.258  4.99951e+01 249.258 0.9347 
1 1 1 -2  100 2  o 19 1.03626e+01 4.91716e-01 1.55397e+02 329.938 2.67474e+01  -1.54811e+01 0.00000e+00 0.00000e+00 2.22403e+02 329.938 6.70056e+01 329.938 0.9837 
1 1 1 -2  100 3  o 19 3.75029e+00 7.91414e-01 1.16758e+02 151.152 -6.24911e+00 3.44234e+00  0.00000e+00 0.00000e+00 1.20622e+01 151.152 1.04696e+02 331.152 0.9270 
1 1 1 -2  100 4  o 18 1.11824e+01 5.02584e-01 2.21265e+02 123.342 -2.69880e+01 4.10198e+01  0.00000e+00 0.00000e+00 1.88726e+02 123.342 3.25396e+01 303.342 0.9898 
1 1 1 -2  100 5  o 12 4.15655e+00 8.67759e-01 9.32158e+01 210.342 -5.81506e+00 -3.40377e+00 0.00000e+00 0.00000e+00 4.87703e+01 210.342 4.44456e+01 30.342  0.9225 
1 1 1 -2  100 6  o 3  2.21822e+00 6.89681e-01 4.81017e+01 172.092 -2.03026e+00 2.82015e-01  0.00000e+00 0.00000e+00 9.84740e+00 172.092 3.82543e+01 352.092 0.7058 
1 1 1 -2  100 7  o 6  6.09026e+00 7.75990e-01 8.29315e+01 319.905 7.96448e+00  -6.70543e+00 0.00000e+00 0.00000e+00 1.31279e+02 319.905 4.83470e+01 319.905 0.9507 
1 1 1 -2  100 8  o 13 2.86242e+00 8.42363e-01 5.42773e+01 263.925 -3.26122e-01 -3.06407e+00 0.00000e+00 0.00000e+00 3.20726e+01 263.925 2.22048e+01 83.925  0.8158 
1 1 1 -2  100 9  o 15 2.32851e+00 7.79943e-01 5.15071e+01 322.416 2.21407e+00  -1.70405e+00 0.00000e+00 0.00000e+00 1.67743e+01 322.416 3.47328e+01 142.416 0.7935 
1 1 1 -2  100 10 o 17 3.15400e+00 9.40543e-01 3.93906e+01 65.532  1.18637e+00  2.60708e+00  0.00000e+00 0.00000e+00 5.37259e+01 65.532  1.43352e+01 65.532  0.7994 
1 1 1 -2  100 11 o 9  4.03639e+00 1.05812e+00 4.42060e+01 333.229 3.58186e+00  -1.80701e+00 0.00000e+00 0.00000e+00 8.44901e+01 333.229 4.02841e+01 333.229 0.8640 
1 1 1 -2  100 12 o 5  4.05310e+00 1.17884e+00 1.09921e+02 316.655 7.57229e+00  -7.14693e+00 0.00000e+00 0.00000e+00 3.21672e+01 316.655 7.77538e+01 136.655 0.9507 
1 1 1 -2  101 1  o 16 4.92181e+00 7.09407e-01 4.87655e+01 274.066 2.88293e-01  -4.05575e+00 0.00000e+00 0.00000e+00 1.09192e+02 274.066 6.04268e+01 274.066 0.8660 
1 1 1 -2  101 2  o 6  6.38197e+00 6.29521e-01 9.07324e+01 22.394  1.02743e+01  4.23346e+00  0.00000e+00 0.00000e+00 1.34831e+02 22.394  4.40984e+01 22.394  0.9539 
1 1 1 -2  101 3  o 11 5.94157e+00 6.64156e-01 1.51656e+02 220.925 -1.26392e+01 -1.09581e+01 0.00000e+00 0.00000e+00 6.17595e+01 220.925 8.98962e+01 40.925  0.9696 
1 1 1 -2  101 4  o 1  3.30300e+00 7.95356e-01 1.12156e+02 256.435 -1.43250e+00 -5.93704e+00 0.00000e+00 0.00000e+00 3.55824e-01 76.435  1.12512e+02 76.435  0.9140 
1 1 1 -2  101 5  o 15 4.66269e+00 8.56036e-01 1.00233e+02 140.903 -6.59239e+00 5.35689e+00  0.00000e+00 0.00000e+00 6.18753e+01 140.903 3.83578e+01 320.903 0.9392 
1 1 1 -2  101 6  o 7  4.20367e+00 8.33722e-01 7.80992e+01 348.981 5.93143e+00  -1.15493e+00 0.00000e+00 0.00000e+00 6.39247e+01 348.981 1.41744e+01 168.981 0.9130 
1 1 1 -2  101 7  o 19 3.30888e+00 7.75727e-01 4.68282e+01 326.638 2.70364e+00  -1.78017e+00 0.00000e+00 0.00000e+00 5.42727e+01 326.638 7.44451e+00 326.638 0.8261 
1 1 1 -2  101 8  o 11 4.24908e+00 8.33683e-01 1.00958e+02 274.565 7.31805e-01  -9.16577e+00 0.00000e+00 0.00000e+00 4.73118e+01 274.565 5.36465e+01 94.565  0.9439 
1 1 1 -2  101 9  f 0  3.71401e+00 9.75487e-01 7.15249e+01 331.026 5.12508e+00  -2.83785e+00 0.00000e+00 0.00000e+00 5.33521e+01 331.026 1.81728e+01 151.026 0.9101 
1 1 1 -2  101 10 o 11 4.13481e+00 1.08450e+00 9.23778e+01 120.685 -3.95627e+00 6.66708e+00  0.00000e+00 0.00000e+00 5.00641e+01 120.685 4.23137e+01 300.685 0.9331 
1 1 1 -2  101 11 o 16 4.11298e+00 1.05220e+00 8.16459e+01 252.274 -2.47047e+00 -7.72893e+00 0.00000e+00 0.00000e+00 6.04128e+01 252.274 2.12331e+01 72.274  0.9362 
1 1 1 -2  101 12 o 6  3.40563e+00 1.05543e+00 6.45158e+01 245.856 -2.43183e+00 -5.42514e+00 0.00000e+00 0.00000e+00 4.99205e+01 245.856 1.45953e+01 65.856  0.9115 
1 1 1 -2  102 1  o 19 9.92489e+00 5.12317e-01 1.71824e+02 323.291 2.90047e+01  -2.16265e+01 0.00000e+00 0.00000e+00 1.90761e+02 323.291 1.89368e+01 323.291 0.9861 
1 1 1 -2  102 2  o 2  5.30301e+00 6.80424e-01 5.60350e+01 31.271  4.67387e+00  2.83851e+00  0.00000e+00 0.00000e+00 1.21389e+02 31.271  6.53536e+01 31.271  0.9032 
1 1 1 -2  102 3  o 7  1.48574e+01 4.83038e-01 2.23385e+02 54.806  3.59264e+01  5.09408e+01  0.00000e+00 0.00000e+00 3.22406e+02 54.806  9.90204e+01 54.806  0.9919 
1 1 1 -2  102 4  o 2  2.27819e+00 7.07045e-01 9.34095e+01 352.920 4.17226e+00  -5.18237e-01 0.00000e+00 0.00000e+00 1.99502e+01 172.920 1.13360e+02 172.920 0.8709 
1 1 1 -2  102 5  o 14 8.81466e+00 6.20473e-01 1.32303e+02 117.875 -1.10526e+01 2.08970e+01  0.00000e+00 0.00000e+00 1.86947e+02 117.875 5.46437e+01 117.875 0.9786 
1 1 1 -2  102 6  o 3  5.29631e+00 7.78704e-01 3.33800e+01 136.525 -2.64019e+00 2.50323e+00  0.00000e+00 0.00000e+00 1.32772e+02 136.525 9.93925e+01 136.525 0.8480 
1 1 1 -2  102 7  o 17 5.45298e+00 8.19779e-01 9.81758e+01 78.085  2.22649e+00  1.05517e+01  0.00000e+00 0.00000e+00 9.38666e+01 78.085  4.30921e+00 258.085 0.9524 
1 1 1 -2  102 8  f 0  4.18592e+00 9.15079e-01 9.24325e+01 249.047 -2.77260e+00 -7.24079e+00 0.00000e+00 0.00000e+00 5.19132e+01 249.047 4.05192e+01 69.047  0.9331 
1 1 1 -2  102 9  o 15 2.65665e+00 8.18066e-01 5.54855e+01 298.387 1.82233e+00  -3.37219e+00 0.00000e+00 0.00000e+00 2.85833e+01 298.387 2.69022e+01 118.387 0.8568 
1 1 1 -2  102 10 o 16 7.00846e+00 9.86756e-01 1.59987e+02 357.618 2.57803e+01  -1.07241e+00 0.00000e+00 0.00000e+00 9.36315e+01 357.618 6.63552e+01 177.618 0.9804 
1 1 1 -2  102 11 o 19 2.59441e+00 8.57287e-01 7.76958e+01 193.321 -5.53081e+00 -1.30956e+00 0.00000e+00 0.00000e+00 9.10920e+00 193.321 6.85866e+01 13.321  0.9071 
1 1 1 -2  103 1  o 7  4.06444e+00 8.19986e-01 1.05821e+02 91.355  -1.65846e-01 7.01312e+00  0.00000e+00 0.00000e+00 3.35327e+01 91.355  7.22887e+01 271.355 0.9257 
1 1 1 -2  103 2  f 0  3.91564e+00 7.77086e-01 1.13768e+02 298.779 3.92097e+00  -7.13855e+00 0.00000e+00 0.00000e+00 2.20173e+01 298.779 9.17508e+01 118.778 0.9364 
1 1 1 -2  103 3  o 10 2.94177e+00 7.79384e-01 7.48845e+01 170.427 -3.89691e+00 6.57189e-01  0.00000e+00 0.00000e+00 1.89607e+01 170.427 5.59238e+01 350.427 0.8616 
1 1 1 -2  103 4  o 6  1.14917e+01 5.38577e-01 1.71954e+02 216.219 -3.27949e+01 -2.40194e+01 0.00000e+00 0.00000e+00 2.48114e+02 216.219 7.61604e+01 216.219 0.9876 
1 1 1 -2  103 5  o 13 7.79894e+00 6.84386e-01 2.05044e+02 99.161  -5.16190e+00 3.20096e+01  0.00000e+00 0.00000e+00 7.90243e+01 99.161  1.26020e+02 279.161 0.9845 
1 1 1 -2  103 6  o 18 4.66134e+00 8.86802e-01 9.93921e+01 328.173 7.67497e+00  -4.76369e+00 0.00000e+00 0.00000e+00 6.31590e+01 328.173 3.62331e+01 148.173 0.9429 
1 1 1 -2  103 7  o 6  1.17008e+01 6.38638e-01 1.87290e+02 219.374 -4.06873e+01 -3.33896e+01 0.00000e+00 0.00000e+00 2.41113e+02 219.374 5.38230e+01 219.374 0.9905 
1 1 1 -2  103 8  o 5  5.19164e+00 8.90399e-01 3.26021e+01 62.660  1.78775e+00  3.45771e+00  0.00000e+00 0.00000e+00 1.32213e+02 62.660  9.96109e+01 62.660  0.8593 
1 1 1 -2  103 9  o 9  5.54533e+00 9.58301e-01 9.32754e+01 215.180 -9.60521e+00 -6.77071e+00 0.00000e+00 0.00000e+00 1.02564e+02 215.180 9.28906e+00 215.180 0.9565 
1 1 1 -2  103 10 o 14 2.48493e+00 7.87346e-01 5.37854e+01 259.223 -7.09591e-01 -3.72801e+00 0.00000e+00 0.00000e+00 2.46254e+01 259.223 2.91600e+01 79.223  0.8551 
1 1 1 -2  103 11 o 18 3.55213e+00 1.02325e+00 5.46269e+01 140.879 -3.85878e+00 3.13829e+00  0.00000e+00 0.00000e+00 6.23062e+01 140.879 7.67933e+00 140.879 0.8928 
1 1 1 -2  104 1  o 7  6.35850e+00 6.48710e-01 1.19196e+02 123.800 -8.06974e+00 1.20544e+01  0.00000e+00 0.00000e+00 1.07979e+02 123.800 1.12170e+01 303.800 0.9649 
1 1 1 -2  104 2  o 18 5.46182e+00 6.74226e-01 1.11629e+02 59.606  6.18968e+00  1.05525e+01  0.00000e+00 0.00000e+00 8.21257e+01 59.606  2.95033e+01 239.606 0.9582 
1 1 1 -2  104 3  o 8  5.36367e+00 7.29208e-01 7.91624e+01 131.830 -5.33560e+00 5.96115e+00  0.00000e+00 0.00000e+00 1.06504e+02 131.830 2.73418e+01 131.830 0.9352 
1 1 1 -2  104 4  o 2  3.65363e+00 8.13182e-01 5.71967e+01 350.027 3.83258e+00  -6.73896e-01 0.00000e+00 0.00000e+00 5.89607e+01 350.027 1.76404e+00 350.027 0.8592 
1 1 1 -2  104 5  o 5  3.99561e+00 8.52456e-01 6.92987e+01 191.104 -5.30352e+00 -1.04087e+00 0.00000e+00 0.00000e+00 6.40086e+01 191.104 5.29009e+00 11.104  0.9020 
1 1 1 -2  104 6  o 10 5.14511e+00 8.16891e-01 9.76066e+01 31.493  8.63904e+00  5.29257e+00  0.00000e+00 0.00000e+00 8.29770e+01 31.493  1.46296e+01 211.493 0.9493 
1 1 1 -2  104 7  o 13 7.10512e+00 9.04861e-01 1.63805e+02 328.335 1.97838e+01  -1.22018e+01 0.00000e+00 0.00000e+00 9.30569e+01 328.335 7.07478e+01 148.335 0.9782 
1 1 1 -2  104 8  o 18 8.04113e+00 7.49002e-01 1.08566e+02 214.972 -1.95674e+01 -1.36868e+01 0.00000e+00 0.00000e+00 1.82151e+02 214.972 7.35855e+01 214.972 0.9788 
1 1 1 -2  104 9  o 6  3.01839e+00 8.83573e-01 5.53583e+01 247.517 -1.52159e+00 -3.67656e+00 0.00000e+00 0.00000e+00 4.07639e+01 247.517 1.45944e+01 67.517  0.8627 
1 1 1 -2  104 10 f 0  4.75987e+00 1.06564e+00 5.95865e+01 166.078 -6.71555e+00 1.66461e+00  0.00000e+00 0.00000e+00 1.02764e+02 166.078 4.31774e+01 166.078 0.9246 
1 1 1 -2  104 11 o 15 4.20885e+00 1.06795e+00 6.90131e+01 13.950  7.09929e+00  1.76352e+00  0.00000e+00 0.00000e+00 7.51029e+01 13.950  6.08976e+00 13.950  0.9289 
1 1 1 -2  105 1  f 0  6.10150e+00 6.61622e-01 1.23459e+02 48.216  9.78633e+00  1.09516e+01  0.00000e+00 0.00000e+00 9.45699e+01 48.216  2.88895e+01 228.216 0.9653 
1 1 1 -2  105 2  o 13 5.25540e+00 7.47330e-01 1.12826e+02 141.947 -8.89116e+00 6.95977e+00  0.00000e+00 0.00000e+00 7.28566e+01 141.947 3.99689e+01 321.947 0.9546 
1 1 1 -2  105 3  o 9  9.35300e+00 5.58145e-01 1.76707e+02 98.915  -5.42361e+00 3.45745e+01  0.00000e+00 0.00000e+00 1.64392e+02 98.915  1.23147e+01 278.915 0.9856 
1 1 1 -2  105 4  o 11 8.84651e+00 5.96112e-01 1.55162e+02 283.054 7.05317e+00  -3.04205e+01 0.00000e+00 0.00000e+00 1.66797e+02 283.054 1.16347e+01 283.054 0.9839 
1 1 1 -2  105 5  o 7  2.85128e+00 8.26067e-01 3.56572e+01 351.632 2.14550e+00  -3.15605e-01 0.00000e+00 0.00000e+00 4.06357e+01 351.632 4.97841e+00 351.632 0.7236 
1 1 1 -2  105 6  o 18 6.93237e+00 7.25965e-01 5.37637e+01 351.447 8.40437e+00  -1.26401e+00 0.00000e+00 0.00000e+00 1.86891e+02 351.447 1.33127e+02 351.447 0.9392 
1 1 1 -2  105 7  o 14 1.03538e+01 7.59337e-01 1.00406e+02 188.008 -2.42922e+01 -3.41747e+00 0.00000e+00 0.00000e+00 2.74234e+02 188.008 1.73827e+02 188.008 0.9794 
1 1 1 -2  105 8  o 15 2.42589e+00 7.68490e-01 3.78951e+01 238.645 -1.17111e+00 -1.92195e+00 0.00000e+00 0.00000e+00 2.79366e+01 238.645 9.95850e+00 58.645  0.7349 
1 1 1 -2  105 9  o 16 2.84716e+00 8.46541e-01 5.50051e+01 147.286 -3.85138e+00 2.47387e+00  0.00000e+00 0.00000e+00 3.77243e+01 147.286 1.72808e+01 327.286 0.8826 
1 1 1 -2  105 10 o 9  7.78868e+00 9.20512e-01 1.32980e+02 161.973 -2.62571e+01 8.54510e+00  0.00000e+00 0.00000e+00 1.49004e+02 161.973 1.60237e+01 161.973 0.9817 
1 1 1 -2  105 11 o 19 2.19690e+00 7.50709e-01 2.54670e+01 174.783 -2.00298e+00 1.82898e-01  0.00000e+00 0.00000e+00 3.11744e+01 174.783 5.70743e+00 174.783 0.6996 
1 1 1 -2  106 1  o 17 5.53695e+00 7.31188e-01 4.71921e+01 302.634 2.74635e+00  -4.28871e+00 0.00000e+00 0.00000e+00 1.36295e+02 302.634 8.91033e+01 302.634 0.8955 
1 1 1 -2  106 2  o 19 2.67285e+00 7.49411e-01 9.84872e+01 350.320 5.08556e+00  -8.67449e-01 0.00000e+00 0.00000e+00 9.78348e+00 170.320 1.08271e+02 170.320 0.8969 
1 1 1 -2  106 3  o 15 4.39573e+00 8.03866e-01 5.02044e+01 107.287 -1.32933e+00 4.27132e+00  0.00000e+00 0.00000e+00 9.28129e+01 107.287 4.26085e+01 107.287 0.8795 
1 1 1 -2  106 4  o 7  1.05923e+01 5.56276e-01 1.57736e+02 21.481  3.65963e+01  1.44017e+01  0.00000e+00 0.00000e+00 2.28958e+02 21.481  7.12218e+01 21.481  0.9872 
1 1 1 -2  106 5  o 3  8.18093e+00 6.35747e-01 1.81717e+02 215.721 -2.94009e+01 -2.11431e+01 0.00000e+00 0.00000e+00 1.16504e+02 215.721 6.52129e+01 35.721  0.9861 
1 1 1 -2  106 6  o 8  8.38583e+00 6.56599e-01 1.08376e+02 86.139  1.44519e+00  2.14143e+01  0.00000e+00 0.00000e+00 1.94189e+02 86.139  8.58120e+01 86.139  0.9764 
1 1 1 -2  106 7  o 8  4.37246e+00 9.95876e-01 8.97652e+01 241.299 -4.08644e+00 -7.46376e+00 0.00000e+00 0.00000e+00 6.19190e+01 241.299 2.78461e+01 61.299  0.9393 
1 1 1 -2  106 8  o 4  3.50429e+00 9.22265e-01 4.93847e+01 210.476 -3.57756e+00 -2.10535e+00 0.00000e+00 0.00000e+00 6.30396e+01 210.476 1.36549e+01 210.476 0.8691 
1 1 1 -2  106 9  o 10 3.73109e+00 9.77808e-01 2.93797e+01 237.562 -1.41855e+00 -2.23204e+00 0.00000e+00 0.00000e+00 7.79664e+01 237.562 4.85867e+01 237.562 0.7799 
1 1 1 -2  106 10 o 7  1.96378e+00 6.73822e-01 3.26144e+01 51.653  1.39459e+00  1.76288e+00  0.00000e+00 0.00000e+00 2.05669e+01 51.653  1.20475e+01 231.653 0.7345 
1 1 1 -2  107 1  o 5  9.75157e+00 5.47578e-01 2.09424e+02 258.893 -9.17177e+00 -4.67186e+01 0.00000e+00 0.00000e+00 1.47531e+02 258.893 6.18932e+01 78.893  0.9894 
1 1 1 -2  107 2  o 12 5.09304e+00 7.65914e-01 1.39470e+02 61.340  7.00534e+00  1.28166e+01  0.00000e+00 0.00000e+00 4.23496e+01 61.340  9.71201e+01 241.340 0.9651 
1 1 1 -2  107 3  o 14 6.30938e+00 6.96293e-01 1.13934e+02 117.982 -7.37616e+00 1.38831e+01  0.00000e+00 0.00000e+00 1.11843e+02 117.982 2.09052e+00 297.982 0.9677 
1 1 1 -2  107 4  o 5  7.97808e+00 6.38003e-01 6.06960e+01 285.374 2.86689e+00  -1.04265e+01 0.00000e+00 0.00000e+00 2.20263e+02 285.374 1.59567e+02 285.374 0.9526 
1 1 1 -2  107 5  o 19 4.93029e+00 8.24794e-01 8.07470e+01 242.135 -4.00720e+00 -7.57939e+00 0.00000e+00 0.00000e+00 9.04781e+01 242.135 9.73118e+00 242.135 0.9397 
1 1 1 -2  107 6  o 2  3.07987e+00 8.67117e-01 3.55830e+01 62.622  1.10418e+00  2.13222e+00  0.00000e+00 0.00000e+00 5.01801e+01 62.622  1.45970e+01 62.622  0.7538 
1 1 1 -2  107 7  o 12 4.53631e+00 9.40946e-01 2.71582e+01 218.865 -2.07449e+00 -1.67180e+00 0.00000e+00 0.00000e+00 1.03781e+02 218.865 7.66229e+01 218.865 0.7817 
1 1 1 -2  107 8  o 5  3.24010e+00 8.91724e-01 6.87290e+01 263.030 -6.53792e-01 -5.34826e+00 0.00000e+00 0.00000e+00 3.90842e+01 263.030 2.96448e+01 83.030  0.9017 
1 1 1 -2  107 9  o 12 3.94634e+00 9.68284e-01 3.18541e+01 176.127 -3.27840e+00 2.21967e-01  0.00000e+00 0.00000e+00 8.88164e+01 176.127 5.69623e+01 176.127 0.8291 
1 1 1 -2  107 10 o 3  2.42720e+00 8.01157e-01 3.04375e+01 152.333 -2.14520e+00 1.12468e+00  0.00000e+00 0.00000e+00 3.72166e+01 152.333 6.77909e+00 152.333 0.7563 
1 1 1 -2  108 1  o 4  3.26434e+00 8.18336e-01 8.35105e+01 267.894 -2.03946e-01 -5.54658e+00 0.00000e+00 0.00000e+00 2.57205e+01 267.894 5.77899e+01 87.894  0.9048 
1 1 1 -2  108 2  o 10 3.40416e+00 8.11818e-01 8.12040e+01 174.537 -5.92419e+00 5.66592e-01  0.00000e+00 0.00000e+00 3.35474e+01 174.537 4.76566e+01 354.537 0.9116 
1 1 1 -2  108 3  o 9  4.86150e+00 7.75906e-01 1.02994e+02 216.615 -8.30577e+00 -6.17182e+00 0.00000e+00 0.00000e+00 6.78151e+01 216.615 3.51790e+01 36.615  0.9504 
1 1 1 -2  108 4  o 1  4.07790e+00 8.63736e-01 6.58677e+01 288.399 1.76892e+00  -5.31782e+00 0.00000e+00 0.00000e+00 7.06395e+01 288.399 4.77177e+00 288.399 0.9057 
1 1 1 -2  108 5  o 13 1.03886e+01 5.86893e-01 1.90586e+02 154.906 -4.71062e+01 2.20601e+01  0.00000e+00 0.00000e+00 1.89519e+02 154.906 1.06707e+00 334.906 0.9903 
1 1 1 -2  108 6  o 1  6.73187e+00 7.82889e-01 1.13152e+02 28.196  1.79026e+01  9.59772e+00  0.00000e+00 0.00000e+00 1.29259e+02 28.196  1.61068e+01 28.196  0.9751 
1 1 1 -2  108 7  o 13 2.69540e+00 8.40342e-01 6.27674e+01 93.334  -2.45010e-01 4.20545e+00  0.00000e+00 0.00000e+00 2.39144e+01 93.334  3.88530e+01 273.334 0.8712 
1 1 1 -2  108 8  o 13 4.05780e+00 9.74455e-01 6.99135e+01 249.708 -2.48621e+00 -6.72412e+00 0.00000e+00 0.00000e+00 6.89170e+01 249.708 9.96575e-01 69.708  0.9274 
1 1 1 -2  108 9  o 4  3.42356e+00 9.39018e-01 5.72914e+01 179.336 -5.13675e+00 5.94975e-02  0.00000e+00 0.00000e+00 5.58683e+01 179.336 1.42306e+00 359.336 0.8965 
1 1 1 -2  108 10 o 6  2.06095e+00 6.97837e-01 3.84503e+01 85.082  2.38047e-01  2.76677e+00  0.00000e+00 0.00000e+00 2.16959e+01 85.082  1.67544e+01 265.082 0.7920 
1 1 1 -2  109 1  o 10 5.39091e+00 7.57547e-01 3.41668e+01 207.367 -3.41931e+00 -1.76992e+00 0.00000e+00 0.00000e+00 1.36752e+02 207.367 1.02585e+02 207.367 0.8575 
1 1 1 -2  109 2  o 9  2.45910e+00 7.40720e-01 4.61858e+01 149.862 -2.24625e+00 1.30411e+00  0.00000e+00 0.00000e+00 2.42833e+01 149.862 2.19024e+01 329.862 0.7752 
1 1 1 -2  109 3  o 4  6.12595e+00 7.00444e-01 7.65847e+01 78.604  2.14516e+00  1.06430e+01  0.00000e+00 0.00000e+00 1.39129e+02 78.604  6.25443e+01 78.604  0.9528 
1 1 1 -2  109 4  o 18 3.66226e+00 8.49061e-01 6.64411e+01 64.236  2.21547e+00  4.59025e+00  0.00000e+00 0.00000e+00 5.47423e+01 64.236  1.16987e+01 244.236 0.8956 
1 1 1 -2  109 5  o 13 7.25833e+00 7.27327e-01 1.17232e+02 256.943 -4.97102e+00 -2.14347e+01 0.00000e+00 0.00000e+00 1.44687e+02 256.943 2.74552e+01 256.943 0.9770 
1 1 1 -2  109 6  o 15 7.33313e+00 7.26514e-01 5.81931e+01 286.506 3.05601e+00  -1.03130e+01 0.00000e+00 0.00000e+00 1.99630e+02 286.506 1.41437e+02 286.506 0.9523 
1 1 1 -2  109 7  o 9  3.29602e+00 9.07902e-01 5.40285e+01 135.419 -3.03199e+00 2.98796e+00  0.00000e+00 0.00000e+00 5.21189e+01 135.419 1.90956e+00 315.419 0.8727 
1 1 1 -2  109 8  o 9  2.36441e+00 7.49764e-01 3.50763e+01 160.008 -2.56520e+00 9.33227e-01  0.00000e+00 0.00000e+00 3.36252e+01 160.008 1.45107e+00 340.008 0.7878 
1 1 1 -2  109 9  o 14 3.37899e+00 8.78560e-01 4.11996e+01 251.567 -1.29634e+00 -3.88951e+00 0.00000e+00 0.00000e+00 6.68152e+01 251.567 2.56157e+01 251.567 0.8673 
1 1 1 -2  109 10 o 18 2.50715e+00 8.12186e-01 2.30504e+01 125.524 -1.23139e+00 1.72485e+00  0.00000e+00 0.00000e+00 4.31123e+01 125.524 2.00619e+01 125.524 0.7164 
1 1 1 -2  110 1  o 6  3.93199e+00 8.02003e-01 7.07609e+01 302.709 3.26771e+00  -5.08823e+00 0.00000e+00 0.00000e+00 6.19435e+01 302.709 8.81733e+00 122.709 0.9131 
1 1 1 -2  110 2  o 18 2.61163e+00 7.63428e-01 6.96417e+01 289.618 1.36771e+00  -3.83715e+00 0.00000e+00 0.00000e+00 1.39694e+01 289.618 5.56723e+01 109.618 0.8663 
1 1 1 -2  110 3  o 7  4.54662e+00 8.43554e-01 9.27568e+01 83.373  1.02302e+00  8.80521e+00  0.00000e+00 0.00000e+00 6.54495e+01 83.373  2.73072e+01 263.373 0.9418 
1 1 1 -2  110 4  o 17 8.60506e+00 6.54185e-01 1.54394e+02 230.852 -2.28229e+01 -2.80353e+01 0.00000e+00 0.00000e+00 1.59020e+02 230.852 4.62619e+00 230.852 0.9861 
1 1 1 -2  110 5  o 9  2.79069e+00 8.10083e-01 5.15249e+01 46.543  2.59039e+00  2.73383e+00  0.00000e+00 0.00000e+00 3.64613e+01 46.543  1.50637e+01 226.543 0.8539 
1 1 1 -2  110 6  o 17 6.63474e+00 7.46454e-01 1.16208e+02 32.337  1.79606e+01  1.13703e+01  0.00000e+00 0.00000e+00 1.22837e+02 32.337  6.62931e+00 32.337  0.9762 
1 1 1 -2  110 7  o 6  4.44941e+00 9.64018e-01 5.11316e+01 32.575  4.89369e+00  3.12661e+00  0.00000e+00 0.00000e+00 9.81144e+01 32.575  4.69828e+01 32.575  0.9093 
1 1 1 -2  110 8  o 8  2.70022e+00 8.36898e-01 3.91823e+01 35.267  2.71083e+00  1.91700e+00  0.00000e+00 0.00000e+00 4.35637e+01 35.267  4.38139e+00 35.267  0.8311 
1 1 1 -2  110 9  o 11 2.35905e+00 7.69382e-01 1.90417e+01 99.737  -2.56452e-01 1.49457e+00  0.00000e+00 0.00000e+00 3.31289e+01 99.737  1.40872e+01 99.737  0.6002 
1 1 1 -2  111 1  o 15 2.46544e+00 7.31572e-01 5.09293e+00 216.567 -2.27683e-01 -1.68890e-01 0.00000e+00 0.00000e+00 7.69196e+00 216.567 2.59903e+00 216.567 0.1403 
1 1 1 -2  111 2  o 10 2.28965e+00 7.19975e-01 5.21888e+01 111.933 -1.08084e+00 2.68419e+00  0.00000e+00 0.00000e+00 1.56363e+01 111.933 3.65526e+01 291.933 0.8018 
1 1 1 -2  111 3  o 7  1.91912e+00 6.40386e-01 1.38076e+01 109.983 -2.48588e-01 6.83617e-01  0.00000e+00 0.00000e+00 1.04064e+01 109.983 3.40112e+00 289.983 0.3416 
1 1 1 -2  111 4  o 1  2.75763e+00 7.77825e-01 2.64958e+01 108.658 -6.25158e-01 1.85141e+00  0.00000e+00 0.00000e+00 4.37741e+01 108.658 1.72783e+01 108.658 0.6901 
1 1 1 -2  111 5  o 11 4.67181e+00 9.07094e-01 8.66332e+01 316.332 6.99742e+00  -6.67933e+00 0.00000e+00 0.00000e+00 7.66415e+01 316.332 9.99170e+00 136.332 0.9468 
1 1 1 -2  111 6  o 16 7.90623e+00 7.10988e-01 9.75768e+01 167.290 -2.09107e+01 4.71625e+00  0.00000e+00 0.00000e+00 1.87251e+02 167.290 8.96742e+01 167.290 0.9764 
1 1 1 -2  111 7  o 3  3.20827e+00 8.85703e-01 5.90006e+01 313.913 3.50452e+00  -3.64007e+00 0.00000e+00 0.00000e+00 4.68468e+01 313.913 1.21538e+01 133.913 0.8946 
1 1 1 -2  111 8  o 12 3.49981e+00 9.52901e-01 5.46198e+01 272.736 2.47751e-01  -5.18363e+00 0.00000e+00 0.00000e+00 6.11717e+01 272.736 6.55187e+00 272.736 0.8976 
1 1 1 -2  111 9  o 16 3.26849e+00 9.14697e-01 4.04532e+01 232.164 -2.46683e+00 -3.17610e+00 0.00000e+00 0.00000e+00 6.36160e+01 232.164 2.31628e+01 232.164 0.8643 
1 1 1 -2  112 1  o 9  2.69788e+00 7.89302e-01 5.53885e+01 249.085 -1.23214e+00 -3.22419e+00 0.00000e+00 0.00000e+00 2.81794e+01 249.085 2.72091e+01 69.085  0.8385 
1 1 1 -2  112 2  o 1  2.80494e+00 7.91040e-01 2.03824e+01 133.541 -1.00230e+00 1.05469e+00  0.00000e+00 0.00000e+00 4.02016e+01 133.541 1.98192e+01 133.541 0.5848 
1 1 1 -2  112 3  o 16 4.32075e+00 9.04708e-01 7.07559e+01 39.827  5.67927e+00  4.73627e+00  0.00000e+00 0.00000e+00 7.75713e+01 39.827  6.81541e+00 39.827  0.9297 
1 1 1 -2  112 4  o 8  5.43522e+00 8.53710e-01 3.95766e+01 339.818 5.04030e+00  -1.85272e+00 0.00000e+00 0.00000e+00 1.41259e+02 339.818 1.01683e+02 339.818 0.9013 
1 1 1 -2  112 5  o 4  3.72637e+00 8.80355e-01 7.21988e+01 281.133 1.24048e+00  -6.30332e+00 0.00000e+00 0.00000e+00 5.40988e+01 281.133 1.81000e+01 101.133 0.9185 
1 1 1 -2  112 6  o 15 2.49418e+00 7.69810e-01 5.42948e+01 217.074 -3.27449e+00 -2.47411e+00 0.00000e+00 0.00000e+00 2.55061e+01 217.074 2.87887e+01 37.074  0.8674 
1 1 1 -2  112 7  o 7  2.95408e+00 8.61437e-01 3.61425e+01 251.352 -1.04658e+00 -3.10123e+00 0.00000e+00 0.00000e+00 5.40695e+01 251.352 1.79270e+01 251.352 0.8283 
1 1 1 -2  112 8  o 17 6.62382e+00 8.78123e-01 9.78665e+01 307.777 1.26427e+01  -1.63121e+01 0.00000e+00 0.00000e+00 1.40220e+02 307.777 4.23538e+01 307.777 0.9755 
1 1 1 -2  112 9  o 6  4.60080e+00 9.64009e-01 6.92546e+01 27.317  9.12232e+00  4.71180e+00  0.00000e+00 0.00000e+00 9.16997e+01 27.317  2.24451e+01 27.317  0.9500 
1 1 1 -2  113 1  o 7  3.66818e+00 7.69196e-01 6.61628e+01 98.260  -9.38790e-01 6.46658e+00  0.00000e+00 0.00000e+00 5.84522e+01 98.260  7.71062e+00 278.260 0.9199 
1 1 1 -2  113 2  o 2  7.88870e+00 6.57043e-01 1.39364e+02 30.267  2.78778e+01  1.62692e+01  0.00000e+00 0.00000e+00 1.47356e+02 30.267  7.99129e+00 30.267  0.9844 
1 1 1 -2  113 3  o 5  3.47101e+00 8.63468e-01 8.10696e+01 171.756 -6.89720e+00 9.99351e-01  0.00000e+00 0.00000e+00 3.74724e+01 171.756 4.35971e+01 351.756 0.9252 
1 1 1 -2  113 4  o 19 3.48739e+00 8.85818e-01 6.18863e+01 309.821 3.41057e+00  -4.09040e+00 0.00000e+00 0.00000e+00 5.39934e+01 309.821 7.89284e+00 129.821 0.9004 
1 1 1 -2  113 5  o 12 2.93635e+00 8.33458e-01 4.54644e+00 323.204 3.16175e-01  -2.36490e-01 0.00000e+00 0.00000e+00 1.64318e+01 323.204 1.18853e+01 323.204 0.1937 
1 1 1 -2  113 6  o 10 4.60696e+00 9.04346e-01 5.55368e+01 204.212 -6.64641e+00 -2.98874e+00 0.00000e+00 0.00000e+00 1.02214e+02 204.212 4.66769e+01 204.212 0.9286 
1 1 1 -2  113 7  o 15 2.68155e+00 8.28412e-01 2.97666e+01 263.882 -2.59852e-01 -2.42443e+00 0.00000e+00 0.00000e+00 4.51603e+01 263.882 1.53937e+01 263.882 0.7581 
1 1 1 -2  113 8  o 7  8.63378e+00 8.14224e-01 1.65047e+02 78.948  8.59968e+00  4.40287e+01  0.00000e+00 0.00000e+00 1.49429e+02 78.948  1.56176e+01 258.948 0.9888 
1 1 1 -2  113 9  o 8  2.92382e+00 8.80959e-01 6.73607e+01 252.994 -1.91979e+00 -6.27682e+00 0.00000e+00 0.00000e+00 3.17014e+01 252.994 3.56593e+01 72.994  0.9203 
1 1 1 -2  114 1  o 17 2.49702e+00 7.53193e-01 2.06960e+01 224.694 -9.90828e-01 -9.80316e-01 0.00000e+00 0.00000e+00 3.17349e+01 224.694 1.10388e+01 224.694 0.5688 
1 1 1 -2  114 2  o 11 3.62800e+00 8.60109e-01 4.20153e+01 263.410 -4.29498e-01 -3.71795e+00 0.00000e+00 0.00000e+00 7.21908e+01 263.410 3.01755e+01 263.410 0.8528 
1 1 1 -2  114 3  o 12 3.35351e+00 8.37604e-01 4.31762e+01 4.420   3.56594e+00  2.75621e-01  0.00000e+00 0.00000e+00 6.13947e+01 4.420   1.82185e+01 4.420   0.8450 
1 1 1 -2  114 4  o 8  4.77521e+00 8.86966e-01 9.47229e+01 319.615 8.61544e+00  -7.32853e+00 0.00000e+00 0.00000e+00 7.34632e+01 319.615 2.12597e+01 139.615 0.9547 
1 1 1 -2  114 5  o 6  2.94609e+00 8.27822e-01 2.83687e+01 108.240 -7.17242e-01 2.17640e+00  0.00000e+00 0.00000e+00 5.20610e+01 108.240 2.36923e+01 108.240 0.7403 
1 1 1 -2  114 6  o 3  4.18983e+00 8.07128e-01 4.16504e+01 266.052 -3.87844e-01 -5.61935e+00 0.00000e+00 0.00000e+00 9.83182e+01 266.052 5.66678e+01 266.052 0.9062 
1 1 1 -2  114 7  o 5  2.54308e+00 8.02459e-01 3.85628e+01 101.707 -6.84792e-01 3.30463e+00  0.00000e+00 0.00000e+00 3.96101e+01 101.707 1.04730e+00 101.707 0.8343 
1 1 1 -2  114 8  o 1  3.46524e+00 9.39544e-01 1.05313e+02 247.804 -4.39435e+00 -1.07704e+01 0.00000e+00 0.00000e+00 1.66812e+01 247.804 8.86312e+01 67.804  0.9560 
1 1 1 -2  115 1  o 6  3.50553e+00 8.75845e-01 5.40273e+01 55.122  2.59821e+00  3.72745e+00  0.00000e+00 0.00000e+00 6.00282e+01 55.122  6.00082e+00 55.122  0.8816 
1 1 1 -2  115 2  o 5  3.08092e+00 8.14401e-01 8.26401e+01 25.979  5.89536e+00  2.87266e+00  0.00000e+00 0.00000e+00 2.19757e+01 25.979  6.06645e+01 205.979 0.9202 
1 1 1 -2  115 3  o 10 2.87990e+00 8.18555e-01 3.58177e+01 108.604 -8.69374e-01 2.58262e+00  0.00000e+00 0.00000e+00 4.78374e+01 108.604 1.20197e+01 108.604 0.7874 
1 1 1 -2  115 4  o 13 3.02916e+00 8.18541e-01 4.31338e+01 59.326  1.84381e+00  3.10851e+00  0.00000e+00 0.00000e+00 5.14718e+01 59.326  8.33793e+00 59.326  0.8469 
1 1 1 -2  115 5  f 0  5.99455e+00 8.31383e-01 1.50084e+02 249.358 -9.40016e+00 -2.49528e+01 0.00000e+00 0.00000e+00 6.67303e+01 249.358 8.33536e+01 69.358  0.9811 
1 1 1 -2  115 6  o 4  3.30432e+00 9.40953e-01 5.09737e+01 95.903  -4.75352e-01 4.59745e+00  0.00000e+00 0.00000e+00 5.66460e+01 95.903  5.67232e+00 95.903  0.8838 
1 1 1 -2  115 7  o 10 2.51405e+00 7.69665e-01 6.06681e+01 341.672 4.75382e+00  -1.57479e+00 0.00000e+00 0.00000e+00 2.20775e+01 341.672 3.85906e+01 161.672 0.8936 
1 1 1 -2  115 8  o 15 5.10695e+00 9.40867e-01 8.10775e+01 52.902  8.04232e+00  1.06346e+01  0.00000e+00 0.00000e+00 9.97348e+01 52.902  1.86573e+01 52.902  0.9617 
1 1 1 -2  116 1  o 3  3.56176e+00 8.80681e-01 7.87239e+01 165.964 -6.83570e+00 1.70893e+00  0.00000e+00 0.00000e+00 4.29646e+01 165.964 3.57593e+01 345.964 0.9260 
1 1 1 -2  116 2  o 9  3.02773e+00 8.30863e-01 4.90919e+01 94.444  -3.41142e-01 4.38946e+00  0.00000e+00 0.00000e+00 4.89007e+01 94.444  1.91216e-01 274.444 0.8774 
1 1 1 -2  116 3  o 13 4.16548e+00 8.73625e-01 6.56952e+01 132.167 -4.84895e+00 5.35385e+00  0.00000e+00 0.00000e+00 7.68539e+01 132.167 1.11587e+01 132.167 0.9279 
1 1 1 -2  116 4  o 10 3.84007e+00 8.66431e-01 6.05245e+01 305.720 3.89866e+00  -5.42158e+00 0.00000e+00 0.00000e+00 6.99724e+01 305.720 9.44783e+00 305.720 0.9217 
1 1 1 -2  116 5  o 19 4.24849e+00 9.30861e-01 9.08696e+01 311.052 7.31462e+00  -8.39905e+00 0.00000e+00 0.00000e+00 5.85042e+01 311.052 3.23654e+01 131.052 0.9540 
1 1 1 -2  116 6  o 11 6.27816e+00 9.39391e-01 1.06922e+02 194.542 -1.85946e+01 -4.82341e+00 0.00000e+00 0.00000e+00 1.18260e+02 194.542 1.13377e+01 194.542 0.9736 
1 1 1 -2  116 7  f 0  3.97151e+00 8.66985e-01 2.23230e+01 250.842 -1.00485e+00 -2.89231e+00 0.00000e+00 0.00000e+00 9.67823e+01 250.842 7.44592e+01 250.842 0.8145 
1 1 1 -2  116 8  o 10 6.25348e+00 9.62734e-01 1.06192e+02 169.365 -2.14665e+01 4.03100e+00  0.00000e+00 0.00000e+00 1.18618e+02 169.365 1.24265e+01 169.365 0.9768 
1 1 1 -2  117 1  o 1  6.56153e+00 7.81348e-01 1.11110e+02 64.010  9.11118e+00  1.86889e+01  0.00000e+00 0.00000e+00 1.24999e+02 64.010  1.38883e+01 64.010  0.9756 
1 1 1 -2  117 2  o 9  2.87325e+00 8.13875e-01 2.83027e+01 330.899 2.01858e+00  -1.12358e+00 0.00000e+00 0.00000e+00 5.03861e+01 330.899 2.20834e+01 330.899 0.7427 
1 1 1 -2  117 3  o 1  2.62556e+00 7.67216e-01 3.09835e+01 283.998 6.18195e-01  -2.47976e+00 0.00000e+00 0.00000e+00 4.36387e+01 283.998 1.26552e+01 283.998 0.7709 
1 1 1 -2  117 4  o 5  4.08588e+00 7.80572e-01 5.15684e+01 261.674 -9.19857e-01 -6.28573e+00 0.00000e+00 0.00000e+00 8.65997e+01 261.674 3.50313e+01 261.674 0.9175 
1 1 1 -2  117 5  o 17 6.13903e+00 8.71697e-01 1.01858e+02 167.336 -1.95781e+01 4.39923e+00  0.00000e+00 0.00000e+00 1.18613e+02 167.336 1.67555e+01 167.336 0.9748 
1 1 1 -2  117 6  o 19 2.81057e+00 8.60922e-01 4.48487e+01 340.136 3.81203e+00  -1.37724e+00 0.00000e+00 0.00000e+00 4.47404e+01 340.136 1.08231e-01 160.136 0.8655 
1 1 1 -2  117 7  o 4  2.87418e+00 8.58047e-01 7.41715e+01 136.798 -5.48899e+00 5.15486e+00  0.00000e+00 0.00000e+00 2.43288e+01 136.798 4.98427e+01 316.798 0.9310 
1 1 1 -2  118 1  o 5  5.14668e+00 8.14450e-01 9.76166e+01 94.600  -1.21329e+00 1.50809e+01  0.00000e+00 0.00000e+00 8.57598e+01 94.600  1.18568e+01 274.600 0.9664 
1 1 1 -2  118 2  f 0  2.14990e+00 6.87910e-01 2.77694e+01 356.736 2.15469e+00  -1.22887e-01 0.00000e+00 0.00000e+00 2.94608e+01 356.736 1.69139e+00 356.736 0.7221 
1 1 1 -2  118 3  o 6  2.83839e+00 8.15369e-01 4.31055e+01 283.039 8.92438e-01  -3.85343e+00 0.00000e+00 0.00000e+00 4.70454e+01 283.039 3.93996e+00 283.039 0.8618 
1 1 1 -2  118 4  o 10 4.24494e+00 8.50968e-01 8.05530e+01 121.950 -5.46740e+00 8.76660e+00  0.00000e+00 0.00000e+00 6.80756e+01 121.950 1.24774e+01 301.950 0.9503 
1 1 1 -2  118 5  o 14 3.02673e+00 8.40547e-01 5.40018e+01 142.027 -4.37440e+00 3.41429e+00  0.00000e+00 0.00000e+00 4.68561e+01 142.027 7.14571e+00 322.027 0.9047 
1 1 1 -2  118 6  o 4  2.86898e+00 8.53164e-01 5.00802e+01 116.965 -2.28179e+00 4.48504e+00  0.00000e+00 0.00000e+00 4.43605e+01 116.965 5.71978e+00 296.965 0.8941 
1 1 1 -2  118 7  o 11 2.28531e+00 7.41870e-01 3.13319e+01 195.368 -2.94093e+00 -8.08301e-01 0.00000e+00 0.00000e+00 3.70895e+01 195.368 5.75754e+00 195.368 0.8136 
1 1 1 -2  119 1  o 18 2.62803e+00 7.98019e-01 3.66411e+01 194.937 -3.05890e+00 -8.16010e-01 0.00000e+00 0.00000e+00 4.29364e+01 194.937 6.29527e+00 194.937 0.8215 
1 1 1 -2  119 2  o 14 2.27898e+00 7.29800e-01 8.05717e+01 90.724  -7.75562e-02 6.13842e+00  0.00000e+00 0.00000e+00 3.77069e+00 270.724 8.43424e+01 270.724 0.9145 
1 1 1 -2  119 3  o 7  2.44408e+00 7.41085e-01 5.87034e+01 202.565 -4.43253e+00 -1.84195e+00 0.00000e+00 0.00000e+00 2.13065e+01 202.565 3.73969e+01 22.565  0.8885 
1 1 1 -2  119 4  o 13 2.19825e+00 7.08016e-01 4.04359e+01 22.625  3.19832e+00  1.33294e+00  0.00000e+00 0.00000e+00 2.75156e+01 22.625  1.29203e+01 202.625 0.8393 
1 1 1 -2  119 5  o 18 4.54251e+00 8.14402e-01 5.21792e+01 262.953 -1.04403e+00 -8.44547e+00 0.00000e+00 0.00000e+00 1.04914e+02 262.953 5.27350e+01 262.953 0.9393 
1 1 1 -2  119 6  o 7  3.17735e+00 8.85107e-01 5.21885e+01 204.772 -4.99634e+00 -2.30572e+00 0.00000e+00 0.00000e+00 5.35088e+01 204.772 1.32031e+00 204.772 0.9039 
1 1 1 -2  119 7  o 15 2.47992e+00 8.02183e-01 6.12274e+01 63.357  2.60337e+00  5.18905e+00  0.00000e+00 0.00000e+00 2.17189e+01 63.357  3.95085e+01 243.357 0.9092 
1 1 1 -2  120 1  o 7  4.63727e+00 8.49778e-01 7.13013e+01 194.059 -9.69659e+00 -2.42828e+00 0.00000e+00 0.00000e+00 9.07776e+01 194.059 1.94762e+01 194.059 0.9486 
1 1 1 -2  120 2  o 3  2.40161e+00 7.48835e-01 6.51527e+01 31.306  4.85444e+00  2.95221e+00  0.00000e+00 0.00000e+00 1.51036e+01 31.306  5.00490e+01 211.306 0.9071 
1 1 1 -2  120 3  o 9  3.03224e+00 7.83552e-01 3.36428e+01 174.142 -3.65794e+00 3.75280e-01  0.00000e+00 0.00000e+00 6.12690e+01 174.142 2.76262e+01 174.142 0.8498 
1 1 1 -2  120 4  o 6  4.81015e+00 8.80683e-01 9.13322e+01 90.740  -1.89811e-01 1.46905e+01  0.00000e+00 0.00000e+00 7.96408e+01 90.740  1.16914e+01 270.740 0.9653 
1 1 1 -2  120 5  o 1  3.43776e+00 8.76207e-01 4.33718e+01 233.161 -3.09619e+00 -4.13286e+00 0.00000e+00 0.00000e+00 7.01360e+01 233.161 2.67642e+01 233.161 0.8971 
1 1 1 -2  120 6  o 14 3.85658e+00 9.28333e-01 3.92952e+01 349.013 5.13059e+00  -9.96026e-01 0.00000e+00 0.00000e+00 8.81767e+01 349.013 4.88815e+01 349.013 0.8984 
1 1 1 -2  121 1  o 11 4.01604e+00 9.23234e-01 7.40217e+01 61.002  4.48447e+00  8.09100e+00  0.00000e+00 0.00000e+00 6.56647e+01 61.002  8.35701e+00 241.002 0.9443 
1 1 1 -2  121 2  o 14 5.26632e+00 8.52230e-01 8.43544e+01 338.706 1.25622e+01  -4.89627e+00 0.00000e+00 0.00000e+00 1.02254e+02 338.706 1.78999e+01 338.706 0.9622 
1 1 1 -2  121 3  o 15 4.79241e+00 9.14589e-01 8.53952e+01 115.427 -5.66139e+00 1.19086e+01  0.00000e+00 0.00000e+00 8.42275e+01 115.427 1.16763e+00 295.427 0.9613 
1 1 1 -2  121 4  o 14 2.33679e+00 7.32885e-01 4.38598e+01 184.392 -4.15233e+00 -3.18909e-01 0.00000e+00 0.00000e+00 3.09337e+01 184.392 1.29261e+01 4.392   0.8696 
1 1 1 -2  121 5  o 14 3.25666e+00 8.83751e-01 3.12744e+01 78.773  7.15688e-01  3.60552e+00  0.00000e+00 0.00000e+00 7.05547e+01 78.773  3.92803e+01 78.773  0.8498 
1 1 1 -2  121 6  o 4  3.28059e+00 9.13047e-01 5.52608e+01 267.760 -2.50896e-01 -6.41482e+00 0.00000e+00 0.00000e+00 5.55553e+01 267.760 2.94426e-01 267.760 0.9184 
1 1 1 -2  122 1  o 3  3.75608e+00 9.28003e-01 6.27924e+01 186.694 -7.43742e+00 -8.72855e-01 0.00000e+00 0.00000e+00 6.59160e+01 186.694 3.12364e+00 186.694 0.9306 
1 1 1 -2  122 2  o 2  2.90108e+00 8.23778e-01 8.24752e+01 20.036  8.13432e+00  2.96644e+00  0.00000e+00 0.00000e+00 1.79573e+01 20.036  6.45179e+01 200.036 0.9403 
1 1 1 -2  122 3  o 17 2.50092e+00 7.71628e-01 2.64189e+01 303.594 1.42254e+00  -2.14160e+00 0.00000e+00 0.00000e+00 4.46907e+01 303.594 1.82718e+01 303.594 0.7725 
1 1 1 -2  122 4  o 9  3.33531e+00 8.82815e-01 8.74253e+01 104.381 -2.51824e+00 9.82163e+00  0.00000e+00 0.00000e+00 2.90816e+01 104.381 5.83437e+01 284.381 0.9493 
1 1 1 -2  122 5  o 4  3.95930e+00 9.28015e-01 6.52257e+01 192.337 -8.36813e+00 -1.83020e+00 0.00000e+00 0.00000e+00 7.16231e+01 192.337 6.39741e+00 192.337 0.9397 
1 1 1 -2  123 1  o 15 3.15862e+00 8.78559e-01 7.13252e+01 352.654 7.71798e+00  -9.95012e-01 0.00000e+00 0.00000e+00 3.71914e+01 352.654 3.41338e+01 172.654 0.9333 
1 1 1 -2  123 2  o 11 2.32593e+00 7.39341e-01 1.20552e+01 354.933 1.08383e+00  -9.61015e-02 0.00000e+00 0.00000e+00 2.87534e+01 354.933 1.66982e+01 354.933 0.4767 
1 1 1 -2  123 3  o 6  2.50332e+00 7.53359e-01 2.29090e+01 126.558 -1.43647e+00 1.93719e+00  0.00000e+00 0.00000e+00 4.66358e+01 126.558 2.37268e+01 126.558 0.7550 
1 1 1 -2  123 4  o 4  2.23551e+00 7.17648e-01 2.51953e+01 315.207 1.78239e+00  -1.76957e+00 0.00000e+00 0.00000e+00 3.78139e+01 315.207 1.26187e+01 315.207 0.7663 
1 1 1 -2  123 5  o 1  1.84849e+00 6.36285e-01 4.88634e+00 55.429  2.55450e-01  3.70695e-01  0.00000e+00 0.00000e+00 1.00383e+01 55.429  5.15194e+00 55.429  0.2196 
1 1 1 -2  124 1  o 11 2.49954e+00 7.72490e-01 5.13467e+01 90.997  -9.18670e-02 5.27618e+00  0.00000e+00 0.00000e+00 3.13787e+01 90.997  1.99681e+01 270.998 0.8994 
1 1 1 -2  124 2  o 10 2.30603e+00 7.33435e-01 1.04132e+02 294.395 4.30538e+00  -9.49327e+00 0.00000e+00 0.00000e+00 2.34698e+01 114.395 1.27601e+02 114.395 0.9508 
1 1 1 -2  124 3  o 14 2.34298e+00 7.36686e-01 3.21969e+01 135.839 -2.22783e+00 2.16350e+00  0.00000e+00 0.00000e+00 3.82537e+01 135.839 6.05677e+00 135.839 0.8175 
1 1 1 -2  124 4  o 16 2.64946e+00 7.94608e-01 3.17772e+01 200.308 -3.45520e+00 -1.27867e+00 0.00000e+00 0.00000e+00 5.10500e+01 200.308 1.92728e+01 200.308 0.8502 
1 1 1 -2  125 1  o 18 2.32522e+00 7.38936e-01 1.85004e+01 311.405 1.16799e+00  -1.32460e+00 0.00000e+00 0.00000e+00 3.75529e+01 311.405 1.90525e+01 311.405 0.6554 
1 1 1 -2  125 2  o 10 2.40673e+00 7.68795e-01 4.45747e+01 338.722 4.20395e+00  -1.63716e+00 0.00000e+00 0.00000e+00 3.33769e+01 338.722 1.11978e+01 158.722 0.8807 
1 1 1 -2  125 3  o 10 1.86099e+00 6.34692e-01 3.16421e+01 22.846  2.70941e+00  1.14149e+00  0.00000e+00 0.00000e+00 2.34729e+01 22.846  8.16921e+00 202.846 0.8055 
1 1 1 -2  125 4  o 18 1.79768e+00 6.18508e-01 7.15001e+01 202.755 -6.37820e+00 -2.67529e+00 0.00000e+00 0.00000e+00 1.04034e+01 22.755  8.19035e+01 22.755  0.9246 
1 1 1 -2  126 1  o 19 2.53898e+00 7.53366e-01 5.34601e+01 184.498 -5.86717e+00 -4.61509e-01 0.00000e+00 0.00000e+00 3.15500e+01 184.498 2.19101e+01 4.498   0.9105 
1 1 1 -2  126 2  o 14 1.83829e+00 6.31035e-01 3.47623e+01 285.081 9.34753e-01  -3.46890e+00 0.00000e+00 0.00000e+00 2.24011e+01 285.081 1.23611e+01 105.081 0.8458 
1 1 1 -2  127 1  o 17 2.20368e+00 7.27752e-01 2.86026e+01 354.361 3.46517e+00  -3.42131e-01 0.00000e+00 0.00000e+00 3.94540e+01 354.361 1.08514e+01 354.361 0.8402 
1 1 1 -1  0   3  o 4  2.62307e+01 7.14507e-01 1.93531e+02 0.000   7.69657e-01  0.00000e+00  0.00000e+00 0.00000e+00 4.43671e+02 0.000   2.50139e+02 0.000   0.6467 
1 1 1 -1  0   4  o 7  6.94499e+00 2.49845e-01 2.21666e+02 0.000   3.71457e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.29013e+02 180.000 3.50680e+02 180.000 0.3553 
1 1 1 -1  0   5  o 10 4.41627e+00 2.79714e-01 4.88890e+02 0.000   8.58483e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.73589e+02 180.000 8.62478e+02 180.000 0.6955 
1 1 1 -1  0   6  o 18 4.57744e+00 3.34253e-01 3.17169e+02 180.000 -5.47015e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.31578e+02 0.000   5.48747e+02 0.000   0.4983 
1 1 1 -1  0   7  o 3  1.26202e+01 5.36228e-01 9.42897e+01 0.000   5.68828e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.49262e+02 0.000   5.49726e+01 0.000   0.5145 
1 1 1 -1  0   8  o 19 1.61891e+01 4.16635e-01 1.99234e+02 0.000   1.77470e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.73796e+02 0.000   1.74561e+02 0.000   0.9441 
1 1 1 -1  0   9  o 3  1.00265e+00 6.57401e-01 8.59669e+01 180.000 -5.85937e-02 0.00000e+00  0.00000e+00 0.00000e+00 8.37681e+01 0.000   1.69735e+02 0.000   0.0585 
1 1 1 -1  0   10 o 1  4.32331e+01 1.08022e+00 8.89133e+02 0.000   3.97768e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.29807e+02 0.000   1.59326e+02 180.000 1.0000 
1 1 1 -1  0   11 o 1  4.01550e+01 8.74535e-01 6.41936e+02 180.000 -3.51618e+01 0.00000e+00  0.00000e+00 0.00000e+00 8.60713e+02 180.000 2.18777e+02 180.000 1.0000 
1 1 1 -1  0   12 o 3  2.35831e+01 6.54820e-01 4.50614e+02 0.000   1.89445e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.31239e+02 0.000   1.93749e+01 180.000 1.0000 
1 1 1 -1  0   13 o 11 1.44548e+01 6.54255e-01 2.84447e+02 180.000 -1.12887e+01 0.00000e+00  0.00000e+00 0.00000e+00 2.55634e+02 180.000 2.88131e+01 0.000   1.0000 
1 1 1 -1  0   14 o 7  7.27349e+00 9.79999e-01 6.67813e+01 0.000   1.74544e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.88686e+02 0.000   1.21905e+02 0.000   0.9409 
1 1 1 -1  0   15 o 19 1.15042e+01 8.49128e-01 2.55178e+02 180.000 -1.42012e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.73889e+02 180.000 8.12896e+01 0.000   1.0000 
1 1 1 -1  0   16 o 3  5.20095e+00 1.61162e+00 1.14868e+02 0.000   3.19855e+00  0.00000e+00  0.00000e+00 0.00000e+00 7.82730e+01 0.000   3.65950e+01 180.000 0.9967 
1 1 1 -1  0   17 o 12 5.38526e+00 1.89363e+00 7.59885e+01 0.000   2.35793e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.20897e+02 0.000   4.49087e+01 0.000   0.9823 
1 1 1 -1  0   18 o 5  1.01029e+01 1.40346e+00 1.70115e+02 180.000 -1.30638e+01 -0.00000e+00 0.00000e+00 0.00000e+00 2.05505e+02 180.000 3.53896e+01 180.000 1.0000 
1 1 1 -1  0   19 o 19 2.13864e+00 1.51461e+00 5.10539e+00 180.000 -8.72133e-02 -0.00000e+00 0.00000e+00 0.00000e+00 1.80361e+00 180.000 3.30178e+00 0.000   0.0870 
1 1 1 -1  0   20 o 6  2.08870e+00 1.50969e+00 2.93129e+01 0.000   5.80604e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.12122e+01 0.000   1.81007e+01 180.000 0.5231 
1 1 1 -1  0   21 o 15 4.43636e+00 2.62072e+00 6.23725e+01 0.000   1.59960e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.90777e+01 0.000   2.67053e+01 0.000   0.9216 
1 1 1 -1  1   2  o 9  2.84299e+01 5.43944e-01 3.51740e+02 293.776 7.56074e-01  -1.71619e+00 0.00000e+00 0.00000e+00 3.70500e+02 293.776 1.87601e+01 293.776 0.6762 
1 1 1 -1  1   3  o 12 4.56743e+01 7.05467e-01 8.79878e+02 75.954  2.94506e+00  1.17720e+01  0.00000e+00 0.00000e+00 7.63437e+02 75.954  1.16442e+02 255.954 0.9579 
1 1 1 -1  1   4  o 12 4.37028e+01 6.17939e-01 3.95856e+02 34.163  6.87597e+00  4.66638e+00  0.00000e+00 0.00000e+00 1.14310e+03 34.163  7.47249e+02 34.163  0.9377 
1 1 1 -1  1   5  o 14 3.43401e+01 5.33144e-01 6.15861e+02 186.771 -1.66264e+01 -1.97396e+00 0.00000e+00 0.00000e+00 6.34162e+02 186.771 1.83017e+01 186.771 0.9697 
1 1 1 -1  1   6  o 15 1.32094e+01 2.96490e-01 5.76739e+01 36.365  4.61871e-01  3.40086e-01  0.00000e+00 0.00000e+00 7.89424e+01 36.365  2.12685e+01 36.365  0.2756 
1 1 1 -1  1   7  o 1  3.76945e+01 5.50071e-01 7.41684e+02 164.685 -2.57001e+01 7.03782e+00  0.00000e+00 0.00000e+00 6.45434e+02 164.685 9.62505e+01 344.685 0.9811 
1 1 1 -1  1   8  o 11 1.02196e+01 3.22902e-01 2.04565e+02 11.207  2.25556e+00  4.46879e-01  0.00000e+00 0.00000e+00 7.94585e+01 11.207  1.25106e+02 191.206 0.7413 
1 1 1 -1  1   9  o 14 2.84101e+01 4.81916e-01 5.27855e+02 245.185 -8.55247e+00 -1.84969e+01 0.00000e+00 0.00000e+00 5.10213e+02 245.185 1.76419e+01 65.185  0.9751 
1 1 1 -1  1   10 o 17 3.10182e+01 4.90986e-01 5.14101e+02 63.997  1.46620e+01  3.00582e+01  0.00000e+00 0.00000e+00 6.29929e+02 63.997  1.15828e+02 63.997  0.9849 
1 1 1 -1  1   11 f 0  2.35445e+01 4.31256e-01 3.00120e+02 27.521  1.72686e+01  8.99767e+00  0.00000e+00 0.00000e+00 5.58013e+02 27.521  2.57893e+02 27.521  0.9740 
1 1 1 -1  1   12 o 11 1.33584e+01 5.17823e-01 1.27437e+02 92.951  -3.11384e-01 6.03949e+00  0.00000e+00 0.00000e+00 3.28667e+02 92.951  2.01230e+02 92.951  0.9131 
1 1 1 -1  1   13 o 6  3.17038e+00 8.44538e-01 6.42291e+01 216.832 -8.51328e-01 -6.37626e-01 0.00000e+00 0.00000e+00 8.73420e+00 36.832  7.29633e+01 36.832  0.4685 
1 1 1 -1  1   14 o 17 2.79038e+01 5.62896e-01 4.29419e+02 33.554  7.33696e+01  4.86620e+01  0.00000e+00 0.00000e+00 6.06325e+02 33.554  1.76906e+02 33.554  0.9943 
1 1 1 -1  1   15 o 2  1.38213e+01 5.69657e-01 2.97783e+02 85.796  2.93818e+00  3.99717e+01  0.00000e+00 0.00000e+00 2.11232e+02 85.796  8.65513e+01 265.796 0.9874 
1 1 1 -1  1   16 o 14 7.25884e+00 8.69573e-01 1.73058e+02 187.201 -1.49643e+01 -1.89072e+00 0.00000e+00 0.00000e+00 8.82778e+01 187.201 8.47806e+01 7.201   0.9663 
1 1 1 -1  1   17 o 14 1.58568e+01 6.97381e-01 2.28348e+02 266.812 -3.22412e+00 -5.78817e+01 0.00000e+00 0.00000e+00 3.56739e+02 266.812 1.28391e+02 266.812 0.9913 
1 1 1 -1  1   18 o 10 8.34920e+00 1.08445e+00 1.92636e+02 331.873 2.04574e+01  -1.09357e+01 0.00000e+00 0.00000e+00 1.11015e+02 331.873 8.16216e+01 151.873 0.9782 
1 1 1 -1  1   19 o 4  8.51932e+00 1.28002e+00 1.41024e+02 181.729 -1.67433e+01 -5.05558e-01 0.00000e+00 0.00000e+00 1.65754e+02 181.729 2.47302e+01 181.729 0.9697 
1 1 1 -1  1   20 o 12 3.80339e+00 1.24001e+00 5.05546e+01 88.215  9.96276e-02  3.19730e+00  0.00000e+00 0.00000e+00 6.56397e+01 88.215  1.50851e+01 88.215  0.8237 
1 1 1 -1  1   21 o 13 3.31959e+00 1.14883e+00 5.68921e+01 68.831  1.44084e+00  3.72062e+00  0.00000e+00 0.00000e+00 4.92427e+01 68.831  7.64944e+00 248.831 0.8631 
1 1 1 -1  2   2  o 12 1.83682e+01 3.67230e-01 2.65188e+02 237.414 -4.83341e-01 -7.56176e-01 0.00000e+00 0.00000e+00 1.69660e+01 237.414 2.48222e+02 57.414  0.4089 
1 1 1 -1  2   3  o 12 1.75127e+01 2.85668e-01 1.45936e+02 116.907 -3.47115e-01 6.84002e-01  0.00000e+00 0.00000e+00 8.94418e+01 116.907 5.64941e+01 296.907 0.3578 
1 1 1 -1  2   4  o 15 4.82575e+01 7.74831e-01 8.17629e+02 226.936 -1.28591e+01 -1.37588e+01 0.00000e+00 0.00000e+00 9.45743e+02 226.936 1.28113e+02 226.936 0.9731 
1 1 1 -1  2   5  o 8  1.58605e+01 2.53099e-01 2.58241e+02 257.221 -7.17807e-01 -3.16493e+00 0.00000e+00 0.00000e+00 2.33922e+02 257.221 2.43199e+01 77.221  0.8266 
1 1 1 -1  2   6  o 19 2.18204e+01 3.35175e-01 5.96708e+02 229.537 -6.35082e+00 -7.44559e+00 0.00000e+00 0.00000e+00 1.79086e+02 229.537 4.17622e+02 49.537  0.9474 
1 1 1 -1  2   7  o 10 1.18179e+01 3.35803e-01 1.86845e+02 318.063 1.56969e+00  -1.41024e+00 0.00000e+00 0.00000e+00 1.30127e+02 318.063 5.67182e+01 138.063 0.7151 
1 1 1 -1  2   8  o 18 2.20022e+01 3.68591e-01 4.82198e+02 142.065 -1.10445e+01 8.60881e+00  0.00000e+00 0.00000e+00 3.12662e+02 142.065 1.69535e+02 322.065 0.9636 
1 1 1 -1  2   9  o 7  3.83374e+01 6.73610e-01 7.13072e+02 219.955 -2.83088e+01 -2.37164e+01 0.00000e+00 0.00000e+00 7.03840e+02 219.955 9.23179e+00 39.955  0.9864 
1 1 1 -1  2   10 o 10 1.86107e+01 5.00486e-01 2.80756e+02 74.787  2.87385e+00  1.05681e+01  0.00000e+00 0.00000e+00 3.83528e+02 74.787  1.02773e+02 74.787  0.9532 
1 1 1 -1  2   11 f 0  1.02549e+01 4.52480e-01 1.88294e+02 175.010 -5.29507e+00 4.62323e-01  0.00000e+00 0.00000e+00 1.57163e+02 175.010 3.11308e+01 355.010 0.9002 
1 1 1 -1  2   12 o 14 2.70401e+01 4.93521e-01 4.37515e+02 164.767 -4.06097e+01 1.10586e+01  0.00000e+00 0.00000e+00 5.61518e+02 164.767 1.24003e+02 164.767 0.9880 
1 1 1 -1  2   13 o 12 2.12317e+01 5.79132e-01 3.47298e+02 282.585 8.71220e+00  -3.90235e+01 0.00000e+00 0.00000e+00 4.36002e+02 282.585 8.87045e+01 282.585 0.9874 
1 1 1 -1  2   14 f 0  1.08894e+01 5.35136e-01 2.98609e+02 150.635 -2.09063e+01 1.17630e+01  0.00000e+00 0.00000e+00 9.93356e+01 150.635 1.99274e+02 330.635 0.9789 
1 1 1 -1  2   15 o 8  9.04424e+00 6.86243e-01 1.69287e+02 302.113 7.74093e+00  -1.23339e+01 0.00000e+00 0.00000e+00 1.56233e+02 302.113 1.30546e+01 122.113 0.9650 
1 1 1 -1  2   16 o 17 3.03357e+00 8.95978e-01 1.11769e+02 64.776  1.71692e+00  3.64472e+00  0.00000e+00 0.00000e+00 1.40411e+01 244.776 1.25810e+02 244.776 0.8646 
1 1 1 -1  2   17 o 19 3.99377e+00 1.06832e+00 6.31976e+01 0.245   3.38096e+00  1.44728e-02  0.00000e+00 0.00000e+00 6.08712e+01 0.245   2.32637e+00 180.245 0.8346 
1 1 1 -1  2   18 o 2  6.37435e+00 1.15626e+00 9.33712e+01 177.790 -8.22241e+00 3.17319e-01  0.00000e+00 0.00000e+00 1.28716e+02 177.790 3.53453e+01 177.790 0.9371 
1 1 1 -1  2   19 o 6  4.66663e+00 1.31428e+00 1.32862e+02 261.819 -1.20242e+00 -8.36357e+00 0.00000e+00 0.00000e+00 2.98329e+01 261.819 1.03029e+02 81.819  0.9388 
1 1 1 -1  2   20 o 1  4.12153e+00 1.30563e+00 7.55802e+01 112.763 -1.90677e+00 4.54428e+00  0.00000e+00 0.00000e+00 6.07296e+01 112.763 1.48506e+01 292.763 0.8917 
1 1 1 -1  2   21 o 17 4.41584e+00 1.43021e+00 1.08062e+02 6.080   7.80721e+00  8.31605e-01  0.00000e+00 0.00000e+00 4.47071e+01 6.080   6.33548e+01 186.080 0.9340 
1 1 1 -1  3   2  o 15 9.61148e+00 2.25519e-01 4.54127e+02 278.765 1.18998e-01  -7.71803e-01 0.00000e+00 0.00000e+00 3.22895e+02 98.765  7.77023e+02 98.765  0.3634 
1 1 1 -1  3   3  o 8  2.98092e+01 5.13068e-01 6.76710e+02 309.579 3.80050e+00  -4.59740e+00 0.00000e+00 0.00000e+00 3.44214e+02 309.579 3.32496e+02 129.579 0.9118 
1 1 1 -1  3   4  o 19 4.62545e+01 7.41319e-01 8.98816e+02 72.308  5.98937e+00  1.87764e+01  0.00000e+00 0.00000e+00 7.93457e+02 72.308  1.05359e+02 252.308 0.9743 
1 1 1 -1  3   5  o 19 2.06855e+01 3.13151e-01 3.26993e+02 173.430 -5.30000e+00 6.10374e-01  0.00000e+00 0.00000e+00 3.72357e+02 173.430 4.53639e+01 173.430 0.9006 
1 1 1 -1  3   6  o 17 3.88106e+00 2.77113e-01 2.43529e+02 299.334 3.47415e-01  -6.18225e-01 0.00000e+00 0.00000e+00 1.94885e+02 119.334 4.38414e+02 119.334 0.3340 
1 1 1 -1  3   7  o 8  2.38625e+01 3.79929e-01 2.23435e+02 54.354  2.96397e+00  4.13309e+00  0.00000e+00 0.00000e+00 5.77953e+02 54.354  3.54518e+02 54.354  0.8953 
1 1 1 -1  3   8  o 13 1.23619e+01 4.45324e-01 9.07953e+01 55.373  8.39884e-01  1.21627e+00  0.00000e+00 0.00000e+00 1.82952e+02 55.373  9.21570e+01 55.373  0.5907 
1 1 1 -1  3   9  o 10 1.41457e+01 4.14747e-01 2.32230e+02 79.979  7.77425e-01  4.39957e+00  0.00000e+00 0.00000e+00 2.33867e+02 79.979  1.63720e+00 79.979  0.8794 
1 1 1 -1  3   10 f 0  2.84379e+01 4.77499e-01 4.76007e+02 236.501 -1.56684e+01 -2.36729e+01 0.00000e+00 0.00000e+00 5.69960e+02 236.501 9.39528e+01 236.501 0.9822 
1 1 1 -1  3   11 o 4  2.62845e+01 6.01021e-01 2.55003e+02 168.589 -1.79369e+01 3.62031e+00  0.00000e+00 0.00000e+00 7.01319e+02 168.589 4.46316e+02 168.589 0.9723 
1 1 1 -1  3   12 o 9  1.07274e+01 4.37304e-01 3.04327e+02 291.584 4.28631e+00  -1.08345e+01 0.00000e+00 0.00000e+00 7.91814e+01 291.584 2.25146e+02 111.585 0.9561 
1 1 1 -1  3   13 o 7  1.43824e+01 4.66479e-01 2.65042e+02 103.203 -4.77699e+00 2.03618e+01  0.00000e+00 0.00000e+00 2.59318e+02 103.203 5.72375e+00 283.203 0.9758 
1 1 1 -1  3   14 o 12 1.00839e+01 5.77470e-01 2.35727e+02 123.840 -9.70012e+00 1.44682e+01  0.00000e+00 0.00000e+00 1.29741e+02 123.840 1.05986e+02 303.840 0.9709 
1 1 1 -1  3   15 f 0  2.12355e+01 5.66043e-01 1.94993e+02 96.970  -4.90898e+00 4.01564e+01  0.00000e+00 0.00000e+00 5.87156e+02 96.970  3.92163e+02 96.970  0.9876 
1 1 1 -1  3   16 o 6  8.17285e+00 7.94087e-01 1.16126e+02 316.153 8.45469e+00  -8.12112e+00 0.00000e+00 0.00000e+00 1.75096e+02 316.153 5.89705e+01 316.153 0.9563 
1 1 1 -1  3   17 o 6  3.70271e+00 1.01758e+00 9.87583e+01 121.317 -2.61491e+00 4.29784e+00  0.00000e+00 0.00000e+00 2.44616e+01 121.317 7.42968e+01 301.317 0.8941 
1 1 1 -1  3   18 o 2  9.36406e+00 1.01138e+00 1.38225e+02 302.526 1.06900e+01  -1.67630e+01 0.00000e+00 0.00000e+00 2.01049e+02 302.526 6.28243e+01 302.526 0.9745 
1 1 1 -1  3   19 o 2  3.79175e+00 1.18087e+00 4.50001e+01 50.890  1.60156e+00  1.97004e+00  0.00000e+00 0.00000e+00 6.33043e+01 50.890  1.83042e+01 50.890  0.7692 
1 1 1 -1  3   20 o 5  4.13302e+00 1.26124e+00 6.55370e+01 136.573 -3.21945e+00 3.04735e+00  0.00000e+00 0.00000e+00 6.91040e+01 136.573 3.56705e+00 136.573 0.8783 
1 1 1 -1  3   21 o 7  4.11055e+00 1.35924e+00 1.70105e+01 209.671 -1.06375e+00 -6.06029e-01 0.00000e+00 0.00000e+00 6.22013e+01 209.671 4.51908e+01 209.671 0.5202 
1 1 1 -1  4   2  o 4  3.07685e+01 5.93024e-01 2.70201e+02 157.380 -1.31806e+00 5.49197e-01  0.00000e+00 0.00000e+00 3.97683e+02 157.380 1.27482e+02 157.380 0.5778 
1 1 1 -1  4   3  o 4  1.62620e+01 3.40303e-01 5.02028e+02 50.643  1.50336e+00  1.83305e+00  0.00000e+00 0.00000e+00 4.38148e+01 230.643 5.45842e+02 230.643 0.7502 
1 1 1 -1  4   4  o 19 1.01116e+01 2.59802e-01 1.87893e+02 144.262 -7.26858e-01 5.23036e-01  0.00000e+00 0.00000e+00 3.29233e+01 324.262 2.20816e+02 324.262 0.4081 
1 1 1 -1  4   5  o 10 1.68636e+01 4.01934e-01 3.19989e+02 151.266 -3.70770e+00 2.03280e+00  0.00000e+00 0.00000e+00 2.31882e+02 151.266 8.81072e+01 331.266 0.8718 
1 1 1 -1  4   6  o 6  2.00915e+01 3.23831e-01 5.57704e+02 269.311 -1.00748e-01 -8.37745e+00 0.00000e+00 0.00000e+00 1.49696e+02 269.311 4.08008e+02 89.311  0.9383 
1 1 1 -1  4   7  o 9  1.82878e+01 3.47382e-01 4.53986e+02 357.760 7.90359e+00  -3.09159e-01 0.00000e+00 0.00000e+00 1.87016e+02 357.760 2.66970e+02 177.760 0.9345 
1 1 1 -1  4   8  o 3  3.03791e+01 5.45750e-01 4.69757e+02 192.983 -1.82493e+01 -4.20741e+00 0.00000e+00 0.00000e+00 6.38324e+02 192.983 1.68568e+02 192.983 0.9729 
1 1 1 -1  4   9  o 3  3.68850e+01 7.86530e-01 7.86601e+02 7.775   3.86334e+01  5.27504e+00  0.00000e+00 0.00000e+00 5.77612e+02 7.775   2.08989e+02 187.775 0.9871 
1 1 1 -1  4   10 o 3  3.05274e+01 5.04058e-01 4.05376e+02 19.471  2.44316e+01  8.63762e+00  0.00000e+00 0.00000e+00 7.15474e+02 19.471  3.10098e+02 19.471  0.9805 
1 1 1 -1  4   11 o 3  2.28619e+01 5.30421e-01 3.42062e+02 31.684  1.82367e+01  1.12561e+01  0.00000e+00 0.00000e+00 4.93237e+02 31.684  1.51175e+02 31.684  0.9764 
1 1 1 -1  4   12 o 2  1.15288e+01 6.29622e-01 1.53335e+02 48.015  4.16180e+00  4.62454e+00  0.00000e+00 0.00000e+00 2.41403e+02 48.015  8.80682e+01 48.015  0.9157 
1 1 1 -1  4   13 o 15 2.34126e+01 5.53643e-01 4.68330e+02 135.886 -4.27871e+01 4.14843e+01  0.00000e+00 0.00000e+00 3.99055e+02 135.886 6.92749e+01 315.886 0.9916 
1 1 1 -1  4   14 o 13 7.33867e+00 6.53010e-01 1.72677e+02 292.626 3.52655e+00  -8.46102e+00 0.00000e+00 0.00000e+00 8.58722e+01 292.626 8.68047e+01 112.626 0.9438 
1 1 1 -1  4   15 o 6  1.07980e+01 6.01942e-01 2.06415e+02 352.241 2.14078e+01  -2.91695e+00 0.00000e+00 0.00000e+00 1.86870e+02 352.241 1.95450e+01 172.241 0.9766 
1 1 1 -1  4   16 o 12 7.66262e+00 8.05610e-01 1.72525e+02 21.332  1.51446e+01  5.91428e+00  0.00000e+00 0.00000e+00 1.04051e+02 21.332  6.84744e+01 201.332 0.9687 
1 1 1 -1  4   17 f 0  1.14922e+01 7.51806e-01 1.93794e+02 256.056 -8.19354e+00 -3.30006e+01 0.00000e+00 0.00000e+00 2.27607e+02 256.056 3.38124e+01 256.056 0.9852 
1 1 1 -1  4   18 o 16 4.48741e+00 1.17324e+00 1.10805e+02 197.898 -6.60064e+00 -2.13171e+00 0.00000e+00 0.00000e+00 4.34869e+01 197.898 6.73178e+01 17.898  0.9248 
1 1 1 -1  4   19 o 12 4.20238e+00 1.24367e+00 1.06120e+02 342.799 6.08204e+00  -1.88280e+00 0.00000e+00 0.00000e+00 3.70934e+01 342.799 6.90262e+01 162.799 0.9177 
1 1 1 -1  4   20 o 2  4.95662e+00 1.46310e+00 1.07195e+02 147.288 -6.26924e+00 4.02671e+00  0.00000e+00 0.00000e+00 6.38202e+01 147.288 4.33744e+01 327.287 0.9302 
1 1 1 -1  4   21 o 3  3.27927e+00 1.13838e+00 6.76259e+01 84.318  4.68120e-01  4.70499e+00  0.00000e+00 0.00000e+00 4.00773e+01 84.318  2.75486e+01 264.318 0.8867 
1 1 1 -1  5   2  o 2  2.93947e+01 5.69881e-01 5.51122e+02 247.214 -2.32358e+00 -5.53144e+00 0.00000e+00 0.00000e+00 4.56378e+02 247.214 9.47440e+01 67.214  0.9124 
1 1 1 -1  5   3  o 11 1.57299e+01 3.35141e-01 3.52656e+02 279.724 2.65718e-01  -1.55056e+00 0.00000e+00 0.00000e+00 9.93258e+00 279.724 3.42723e+02 99.724  0.6137 
1 1 1 -1  5   4  o 3  4.99083e+01 9.54867e-01 7.98982e+02 268.004 -6.41630e-01 -1.84108e+01 0.00000e+00 0.00000e+00 1.02352e+03 268.004 2.24535e+02 268.004 0.9725 
1 1 1 -1  5   5  o 5  1.94820e+01 4.38107e-01 3.94909e+02 318.914 4.50978e+00  -3.93217e+00 0.00000e+00 0.00000e+00 2.72139e+02 318.914 1.22770e+02 138.914 0.9121 
1 1 1 -1  5   6  o 9  2.37194e+01 5.07562e-01 4.39225e+02 319.860 5.91903e+00  -4.99137e+00 0.00000e+00 0.00000e+00 3.91199e+02 319.860 4.80257e+01 139.860 0.9330 
1 1 1 -1  5   7  o 1  3.25033e+01 4.94751e-01 7.97667e+02 319.076 1.85813e+01  -1.61093e+01 0.00000e+00 0.00000e+00 3.96430e+02 319.076 4.01237e+02 139.076 0.9795 
1 1 1 -1  5   8  o 8  2.61848e+01 4.22203e-01 3.74764e+02 175.346 -1.28568e+01 1.04657e+00  0.00000e+00 0.00000e+00 5.68044e+02 175.346 1.93280e+02 175.346 0.9604 
1 1 1 -1  5   9  o 2  3.09757e+01 6.10752e-01 5.82106e+02 293.089 9.55475e+00  -2.24124e+01 0.00000e+00 0.00000e+00 5.54440e+02 293.089 2.76663e+01 113.089 0.9793 
1 1 1 -1  5   10 o 12 2.05741e+01 5.28637e-01 1.70571e+02 61.233  3.53081e+00  6.43131e+00  0.00000e+00 0.00000e+00 5.45223e+02 61.233  3.74652e+02 61.233  0.9291 
1 1 1 -1  5   11 o 9  7.37879e+00 5.81944e-01 1.97035e+02 55.739  2.23555e+00  3.28204e+00  0.00000e+00 0.00000e+00 4.10865e+01 55.739  1.55948e+02 235.739 0.8624 
1 1 1 -1  5   12 o 11 2.62141e+01 6.04396e-01 3.88014e+02 296.124 1.53955e+01  -3.13932e+01 0.00000e+00 0.00000e+00 5.78066e+02 296.124 1.90052e+02 296.124 0.9856 
1 1 1 -1  5   13 o 18 2.64831e+01 5.25163e-01 4.14536e+02 301.626 3.13721e+01  -5.09434e+01 0.00000e+00 0.00000e+00 5.66625e+02 301.626 1.52089e+02 301.626 0.9916 
1 1 1 -1  5   14 o 9  3.31695e+01 6.25867e-01 6.10162e+02 77.254  3.24380e+01  1.43403e+02  0.00000e+00 0.00000e+00 6.23831e+02 77.254  1.36690e+01 77.254  0.9966 
1 1 1 -1  5   15 o 11 2.79737e+01 6.08226e-01 5.56876e+02 324.880 1.23306e+02  -8.67236e+01 0.00000e+00 0.00000e+00 4.82943e+02 324.880 7.39334e+01 144.880 0.9967 
1 1 1 -1  5   16 o 12 1.05726e+01 6.98196e-01 1.85392e+02 217.612 -1.98260e+01 -1.52746e+01 0.00000e+00 0.00000e+00 2.00573e+02 217.612 1.51814e+01 217.612 0.9798 
1 1 1 -1  5   17 o 8  4.48236e+00 1.06310e+00 1.01821e+02 66.349  2.40830e+00  5.49912e+00  0.00000e+00 0.00000e+00 5.03967e+01 66.349  5.14246e+01 246.349 0.9124 
1 1 1 -1  5   18 o 13 1.41433e+01 8.73567e-01 1.43457e+02 226.101 -2.33338e+01 -2.42479e+01 0.00000e+00 0.00000e+00 3.74491e+02 226.101 2.31034e+02 226.101 0.9850 
1 1 1 -1  5   19 o 2  8.56662e+00 1.37973e+00 1.44123e+02 296.225 7.20062e+00  -1.46173e+01 0.00000e+00 0.00000e+00 1.64073e+02 296.225 1.99498e+01 296.225 0.9688 
1 1 1 -1  5   20 o 14 6.42101e+00 1.60895e+00 1.32841e+02 180.334 -1.07118e+01 -6.24382e-02 0.00000e+00 0.00000e+00 9.39026e+01 180.334 3.89388e+01 0.334   0.9521 
1 1 1 -1  5   21 o 10 3.68833e+00 1.23946e+00 6.76987e+01 22.153  4.50279e+00  1.83324e+00  0.00000e+00 0.00000e+00 5.39026e+01 22.153  1.37961e+01 202.153 0.8901 
1 1 1 -1  6   2  o 18 1.46249e+01 3.15398e-01 4.32232e+02 58.464  1.15969e+00  1.88980e+00  0.00000e+00 0.00000e+00 3.09348e+01 238.464 4.63167e+02 238.464 0.7304 
1 1 1 -1  6   3  f 0  1.08718e+01 2.66031e-01 1.45722e+02 330.903 5.29283e-01  -2.94562e-01 0.00000e+00 0.00000e+00 2.73952e+01 150.903 1.73117e+02 150.903 0.2898 
1 1 1 -1  6   4  o 16 1.88601e+01 3.49288e-01 3.28665e+02 192.232 -2.77564e+00 -6.01761e-01 0.00000e+00 0.00000e+00 2.36079e+02 192.232 9.25866e+01 12.232  0.7974 
1 1 1 -1  6   5  o 9  1.30706e+01 3.98398e-01 1.12098e+02 319.361 8.57738e-01  -7.36181e-01 0.00000e+00 0.00000e+00 1.28649e+02 319.361 1.65509e+01 319.361 0.4907 
1 1 1 -1  6   6  o 19 9.54193e+00 2.29721e-01 1.32906e+02 225.086 -6.64210e-01 -6.66203e-01 0.00000e+00 0.00000e+00 1.92670e+01 225.086 1.13639e+02 45.086  0.4250 
1 1 1 -1  6   7  o 6  1.87773e+01 3.32529e-01 2.63707e+02 206.611 -4.19832e+00 -2.10334e+00 0.00000e+00 0.00000e+00 3.60166e+02 206.611 9.64585e+01 206.611 0.8858 
1 1 1 -1  6   8  o 7  2.42644e+01 6.93068e-01 3.71099e+02 318.109 8.73262e+00  -7.83278e+00 0.00000e+00 0.00000e+00 4.98874e+02 318.109 1.27775e+02 318.109 0.9564 
1 1 1 -1  6   9  o 7  3.04576e+01 6.20418e-01 5.26452e+02 136.055 -1.55807e+01 1.50170e+01  0.00000e+00 0.00000e+00 5.88051e+02 136.055 6.15989e+01 136.055 0.9766 
1 1 1 -1  6   10 o 13 1.50862e+01 5.62649e-01 2.21833e+02 18.794  6.60906e+00  2.24909e+00  0.00000e+00 0.00000e+00 3.00882e+02 18.794  7.90485e+01 18.794  0.9253 
1 1 1 -1  6   11 o 16 9.94204e+00 4.16334e-01 2.11420e+02 345.283 5.59757e+00  -1.47022e+00 0.00000e+00 0.00000e+00 1.26722e+02 345.283 8.46981e+01 165.283 0.9089 
1 1 1 -1  6   12 o 9  2.77108e+01 5.30845e-01 3.94890e+02 158.285 -3.51182e+01 1.39856e+01  0.00000e+00 0.00000e+00 6.27463e+02 158.285 2.32573e+02 158.285 0.9867 
1 1 1 -1  6   13 o 7  6.33654e+00 9.47485e-01 2.03916e+02 40.546  5.02968e+00  4.30277e+00  0.00000e+00 0.00000e+00 1.41276e+01 40.546  1.89789e+02 220.546 0.9210 
1 1 1 -1  6   14 o 13 1.31718e+01 5.11422e-01 1.66390e+02 229.088 -1.06085e+01 -1.22418e+01 0.00000e+00 0.00000e+00 3.09874e+02 229.088 1.43484e+02 229.088 0.9686 
1 1 1 -1  6   15 o 8  1.14046e+01 6.18958e-01 1.70000e+02 264.666 -1.73914e+00 -1.86291e+01 0.00000e+00 0.00000e+00 2.43803e+02 264.666 7.38024e+01 264.666 0.9729 
1 1 1 -1  6   16 o 18 1.41569e+01 6.18706e-01 1.61991e+02 273.068 1.60685e+00  -2.99805e+01 0.00000e+00 0.00000e+00 3.56603e+02 273.068 1.94611e+02 273.068 0.9832 
1 1 1 -1  6   17 o 18 4.34007e+00 1.02581e+00 1.34656e+02 140.442 -6.04084e+00 4.98987e+00  0.00000e+00 0.00000e+00 1.61853e+01 140.442 1.18471e+02 320.442 0.9338 
1 1 1 -1  6   18 o 16 3.23624e+00 1.02132e+00 8.26652e+01 327.089 3.42832e+00  -2.21877e+00 0.00000e+00 0.00000e+00 2.16080e+01 327.089 6.10572e+01 147.089 0.8667 
1 1 1 -1  6   19 o 18 4.97513e+00 1.38180e+00 9.00970e+01 323.326 4.73710e+00  -3.52763e+00 0.00000e+00 0.00000e+00 7.81844e+01 323.326 1.19125e+01 143.326 0.9109 
1 1 1 -1  6   20 o 8  4.36862e+00 1.34458e+00 5.00692e+01 34.889  2.75349e+00  1.92005e+00  0.00000e+00 0.00000e+00 8.49397e+01 34.889  3.48705e+01 34.889  0.8333 
1 1 1 -1  6   21 o 5  3.25316e+00 1.13192e+00 4.89568e+01 222.811 -2.67607e+00 -2.47904e+00 0.00000e+00 0.00000e+00 5.32823e+01 222.811 4.32555e+00 222.811 0.8485 
1 1 1 -1  7   2  o 5  3.46473e+01 5.59983e-01 3.33756e+02 98.935  -5.91514e-01 3.76242e+00  0.00000e+00 0.00000e+00 7.80049e+02 98.935  4.46293e+02 98.935  0.8557 
1 1 1 -1  7   3  o 11 2.78320e+01 5.48208e-01 4.28263e+02 98.117  -6.22382e-01 4.36386e+00  0.00000e+00 0.00000e+00 4.89093e+02 98.117  6.08297e+01 98.117  0.8776 
1 1 1 -1  7   4  o 5  3.82090e+01 6.58948e-01 7.16333e+02 239.841 -6.17536e+00 -1.06280e+01 0.00000e+00 0.00000e+00 6.58737e+02 239.841 5.75964e+01 59.841  0.9584 
1 1 1 -1  7   5  o 6  1.40829e+01 3.02405e-01 3.08964e+02 231.081 -1.60212e+00 -1.98420e+00 0.00000e+00 0.00000e+00 9.82760e+01 231.081 2.10688e+02 51.081  0.7704 
1 1 1 -1  7   6  o 12 2.23916e+01 3.71326e-01 3.27524e+02 108.322 -2.00384e+00 6.05112e+00  0.00000e+00 0.00000e+00 4.43631e+02 108.322 1.16107e+02 108.322 0.9178 
1 1 1 -1  7   7  o 9  1.17181e+01 3.59674e-01 1.19851e+02 302.920 7.21365e-01  -1.11422e+00 0.00000e+00 0.00000e+00 1.22086e+02 302.920 2.23525e+00 302.920 0.5505 
1 1 1 -1  7   8  o 19 1.33501e+01 2.90172e-01 2.55160e+02 102.530 -9.70379e-01 4.36644e+00  0.00000e+00 0.00000e+00 1.85023e+02 102.530 7.01369e+01 282.530 0.8795 
1 1 1 -1  7   9  o 8  3.63385e+01 7.75069e-01 5.53968e+02 172.089 -2.67336e+01 3.71490e+00  0.00000e+00 0.00000e+00 7.82078e+02 172.089 2.28111e+02 172.089 0.9813 
1 1 1 -1  7   10 o 19 2.78682e+01 5.39823e-01 5.65571e+02 3.700   3.28147e+01  2.12208e+00  0.00000e+00 0.00000e+00 4.61941e+02 3.700   1.03630e+02 183.700 0.9847 
1 1 1 -1  7   11 o 13 2.80761e+01 6.70003e-01 5.56133e+02 305.416 2.45517e+01  -3.45273e+01 0.00000e+00 0.00000e+00 4.81964e+02 305.416 7.41686e+01 125.416 0.9881 
1 1 1 -1  7   12 o 8  1.80677e+01 4.55382e-01 2.67245e+02 267.796 -6.44012e-01 -1.67379e+01 0.00000e+00 0.00000e+00 3.87836e+02 267.796 1.20591e+02 267.796 0.9697 
1 1 1 -1  7   13 o 12 6.69018e+00 7.21052e-01 6.80126e+01 341.098 2.28644e+00  -7.82913e-01 0.00000e+00 0.00000e+00 1.20858e+02 341.098 5.28457e+01 341.098 0.7556 
1 1 1 -1  7   14 o 18 1.93468e+01 5.80254e-01 3.01186e+02 351.068 4.20833e+01  -6.61415e+00 0.00000e+00 0.00000e+00 4.12473e+02 351.068 1.11287e+02 351.068 0.9882 
1 1 1 -1  7   15 o 9  7.26845e+00 7.45911e-01 1.29035e+02 348.230 8.58885e+00  -1.78964e+00 0.00000e+00 0.00000e+00 1.26084e+02 348.230 2.95070e+00 168.230 0.9412 
1 1 1 -1  7   16 o 9  9.82427e+00 7.24748e-01 2.25876e+02 283.695 6.28140e+00  -2.57766e+01 0.00000e+00 0.00000e+00 1.33183e+02 283.695 9.26932e+01 103.695 0.9810 
1 1 1 -1  7   17 o 11 4.40648e+00 1.02765e+00 1.38301e+02 353.486 8.10822e+00  -9.25860e-01 0.00000e+00 0.00000e+00 1.52966e+01 353.486 1.23004e+02 173.486 0.9366 
1 1 1 -1  7   18 o 5  1.08143e+01 9.62109e-01 1.83918e+02 137.121 -2.30091e+01 2.13659e+01  0.00000e+00 0.00000e+00 2.11669e+02 137.121 2.77513e+01 137.121 0.9839 
1 1 1 -1  7   19 o 15 1.29855e+01 1.06870e+00 1.90241e+02 195.301 -3.86405e+01 -1.05713e+01 0.00000e+00 0.00000e+00 2.85897e+02 195.301 9.56562e+01 195.301 0.9874 
1 1 1 -1  7   20 o 4  1.03926e+01 1.47997e+00 8.98938e+01 10.155  1.27249e+01  2.27932e+00  0.00000e+00 0.00000e+00 2.80322e+02 10.155  1.90428e+02 10.155  0.9605 
1 1 1 -1  7   21 o 10 3.82799e+00 1.28858e+00 6.65829e+01 66.928  1.97049e+00  4.62599e+00  0.00000e+00 0.00000e+00 6.01799e+01 66.928  6.40303e+00 246.928 0.8940 
1 1 1 -1  8   2  o 11 3.70846e+01 6.62423e-01 4.05085e+02 255.710 -1.14276e+00 -4.48634e+00 0.00000e+00 0.00000e+00 8.26448e+02 255.710 4.21363e+02 255.710 0.8840 
1 1 1 -1  8   3  o 14 2.41098e+01 4.28550e-01 6.70694e+02 328.997 4.95402e+00  -2.97707e+00 0.00000e+00 0.00000e+00 1.52243e+02 328.997 5.18451e+02 148.997 0.9088 
1 1 1 -1  8   4  o 4  8.40074e+00 2.60071e-01 2.47307e+02 220.722 -6.95652e-01 -5.98823e-01 0.00000e+00 0.00000e+00 1.15914e+02 40.722  3.63221e+02 40.722  0.4165 
1 1 1 -1  8   5  f 0  3.29507e+01 5.83684e-01 6.04843e+02 239.837 -5.78931e+00 -9.96194e+00 0.00000e+00 0.00000e+00 5.77070e+02 239.837 2.77723e+01 59.837  0.9556 
1 1 1 -1  8   6  o 2  1.33193e+01 2.56641e-01 2.52077e+02 61.468  1.38681e+00  2.55081e+00  0.00000e+00 0.00000e+00 1.49036e+02 61.468  1.03041e+02 241.468 0.8026 
1 1 1 -1  8   7  o 11 3.07564e+01 4.93723e-01 8.35807e+02 291.549 8.57262e+00  -2.17087e+01 0.00000e+00 0.00000e+00 2.92767e+02 291.549 5.43040e+02 111.549 0.9783 
1 1 1 -1  8   8  o 16 7.57732e+00 3.13981e-01 6.75107e+01 351.991 6.63562e-01  -9.33636e-02 0.00000e+00 0.00000e+00 2.26912e+01 351.991 4.48195e+01 171.991 0.3175 
1 1 1 -1  8   9  o 6  5.41410e+01 9.29985e-01 9.38571e+02 331.411 6.98005e+01  -3.80388e+01 0.00000e+00 0.00000e+00 1.07711e+03 331.411 1.38544e+02 331.411 0.9937 
1 1 1 -1  8   10 o 8  4.60533e+01 7.36398e-01 9.48977e+02 262.314 -1.20836e+01 -8.95401e+01 0.00000e+00 0.00000e+00 7.65850e+02 262.314 1.83127e+02 82.314  0.9945 
1 1 1 -1  8   11 o 19 2.33606e+01 4.60624e-01 5.58515e+02 350.258 3.52937e+01  -6.05954e+00 0.00000e+00 0.00000e+00 3.03300e+02 350.258 2.55214e+02 170.258 0.9859 
1 1 1 -1  8   12 o 14 2.89192e+01 6.09426e-01 5.59354e+02 106.316 -1.55884e+01 5.32529e+01  0.00000e+00 0.00000e+00 5.12151e+02 106.316 4.72034e+01 286.316 0.9909 
1 1 1 -1  8   13 f 0  1.78879e+01 5.01993e-01 1.93141e+02 296.740 8.47554e+00  -1.68227e+01 0.00000e+00 0.00000e+00 4.57164e+02 296.740 2.64023e+02 296.740 0.9731 
1 1 1 -1  8   14 o 4  4.70109e+00 8.60418e-01 1.63153e+02 276.149 5.68909e-01  -5.28049e+00 0.00000e+00 0.00000e+00 5.19701e+00 96.149  1.68350e+02 96.149  0.9001 
1 1 1 -1  8   15 o 14 3.04757e+00 8.45946e-01 1.07368e+02 172.277 -2.94965e+00 3.99995e-01  0.00000e+00 0.00000e+00 1.55077e+01 352.277 1.22876e+02 352.277 0.8082 
1 1 1 -1  8   16 o 14 1.18222e+01 6.46863e-01 2.60713e+02 348.595 3.69892e+01  -7.46158e+00 0.00000e+00 0.00000e+00 1.73864e+02 348.595 8.68491e+01 168.595 0.9867 
1 1 1 -1  8   17 o 3  7.57761e+00 9.80126e-01 1.58217e+02 64.388  7.10733e+00  1.48260e+01  0.00000e+00 0.00000e+00 1.15087e+02 64.388  4.31301e+01 244.388 0.9691 
1 1 1 -1  8   18 o 3  9.12114e+00 1.07923e+00 1.59602e+02 123.336 -1.17986e+01 1.79368e+01  0.00000e+00 0.00000e+00 1.71492e+02 123.336 1.18901e+01 123.336 0.9764 
1 1 1 -1  8   19 o 14 1.05795e+01 1.23057e+00 1.57931e+02 212.597 -2.05201e+01 -1.31216e+01 0.00000e+00 0.00000e+00 2.26764e+02 212.597 6.88328e+01 212.597 0.9793 
1 1 1 -1  8   20 o 18 4.55740e+00 1.38794e+00 2.74731e+01 37.212  1.54710e+00  1.17480e+00  0.00000e+00 0.00000e+00 8.88323e+01 37.212  6.13592e+01 37.212  0.6881 
1 1 1 -1  8   21 o 11 3.64030e+00 1.23377e+00 3.77355e+01 295.308 1.21990e+00  -2.57974e+00 0.00000e+00 0.00000e+00 6.99360e+01 295.308 3.22005e+01 295.308 0.7986 
1 1 1 -1  9   1  o 6  2.92447e+01 4.23339e-01 2.14927e+02 301.033 6.51511e-01  -1.08290e+00 0.00000e+00 0.00000e+00 3.69691e+02 301.033 1.54764e+02 301.033 0.5321 
1 1 1 -1  9   2  o 17 6.34971e+00 2.20954e-01 7.74297e+01 232.994 -8.53343e-02 -1.13216e-01 0.00000e+00 0.00000e+00 6.05637e+01 52.994  1.37993e+02 52.994  0.0707 
1 1 1 -1  9   3  o 1  1.22002e+01 2.23957e-01 7.87095e+01 36.419  2.66244e-01  1.96429e-01  0.00000e+00 0.00000e+00 3.92604e+00 216.419 8.26356e+01 216.419 0.1632 
1 1 1 -1  9   4  o 3  4.04736e+01 6.97719e-01 7.30002e+02 164.813 -1.46747e+01 3.98340e+00  0.00000e+00 0.00000e+00 7.38841e+02 164.813 8.83962e+00 164.813 0.9665 
1 1 1 -1  9   5  f 0  3.21899e+01 5.67692e-01 5.78878e+02 122.474 -5.71548e+00 8.98067e+00  0.00000e+00 0.00000e+00 5.71169e+02 122.474 7.70935e+00 302.473 0.9518 
1 1 1 -1  9   6  o 10 1.58717e+01 4.08415e-01 2.17818e+02 172.054 -2.93576e+00 4.09778e-01  0.00000e+00 0.00000e+00 2.62963e+02 172.054 4.51451e+01 172.054 0.8073 
1 1 1 -1  9   7  o 3  2.35836e+01 3.95758e-01 6.04773e+02 359.454 1.29185e+01  -1.23091e-01 0.00000e+00 0.00000e+00 2.44790e+02 359.454 3.59982e+02 179.454 0.9605 
1 1 1 -1  9   8  o 9  3.21761e+01 5.22042e-01 5.76161e+02 19.064  2.28029e+01  7.88025e+00  0.00000e+00 0.00000e+00 6.04751e+02 19.064  2.85903e+01 19.064  0.9791 
1 1 1 -1  9   9  o 14 3.67346e+01 5.94309e-01 7.59161e+02 258.128 -9.09481e+00 -4.32628e+01 0.00000e+00 0.00000e+00 6.01476e+02 258.128 1.57685e+02 78.128  0.9886 
1 1 1 -1  9   10 o 10 2.30519e+01 4.33202e-01 4.18933e+02 269.467 -1.88190e-01 -2.02205e+01 0.00000e+00 0.00000e+00 4.22570e+02 269.467 3.63696e+00 269.467 0.9750 
1 1 1 -1  9   11 o 18 1.35071e+01 4.53174e-01 2.11937e+02 95.945  -8.34534e-01 8.01373e+00  0.00000e+00 0.00000e+00 2.60969e+02 95.945  4.90327e+01 95.945  0.9357 
1 1 1 -1  9   12 o 6  4.50439e+01 7.49644e-01 7.45883e+02 224.307 -8.14144e+01 -7.94690e+01 0.00000e+00 0.00000e+00 9.30859e+02 224.307 1.84976e+02 224.307 0.9956 
1 1 1 -1  9   13 o 4  3.15117e+01 6.27033e-01 5.84919e+02 359.825 1.09168e+02  -3.33375e-01 0.00000e+00 0.00000e+00 5.86930e+02 359.825 2.01078e+00 359.825 0.9954 
1 1 1 -1  9   14 o 10 1.22081e+01 6.78310e-01 2.27336e+02 263.549 -2.36845e+00 -2.09464e+01 0.00000e+00 0.00000e+00 2.17411e+02 263.549 9.92529e+00 83.549  0.9760 
1 1 1 -1  9   15 o 8  8.90018e+00 6.48712e-01 9.88690e+01 93.450  -5.06716e-01 8.40598e+00  0.00000e+00 0.00000e+00 2.12661e+02 93.450  1.13792e+02 93.450  0.9386 
1 1 1 -1  9   16 o 17 8.18604e+00 7.94048e-01 1.23001e+02 158.807 -1.09585e+01 4.24887e+00  0.00000e+00 0.00000e+00 1.68698e+02 158.807 4.56969e+01 158.807 0.9565 
1 1 1 -1  9   17 o 5  7.15739e+00 9.79341e-01 1.30533e+02 110.959 -4.58339e+00 1.19658e+01  0.00000e+00 0.00000e+00 1.25225e+02 110.959 5.30779e+00 290.959 0.9601 
1 1 1 -1  9   18 o 5  9.67418e+00 1.03222e+00 2.09550e+02 170.222 -3.02777e+01 5.21813e+00  0.00000e+00 0.00000e+00 1.44187e+02 170.222 6.53630e+01 350.221 0.9836 
1 1 1 -1  9   19 o 5  4.53166e+00 1.28785e+00 4.92568e+01 183.774 -3.12379e+00 -2.06084e-01 0.00000e+00 0.00000e+00 8.85876e+01 183.774 3.93308e+01 183.774 0.8192 
1 1 1 -1  9   20 o 3  1.08111e+01 1.48934e+00 2.42106e+02 297.938 1.75492e+01  -3.30918e+01 0.00000e+00 0.00000e+00 1.53447e+02 297.938 8.86595e+01 117.938 0.9866 
1 1 1 -1  9   21 o 17 4.88540e+00 1.49862e+00 7.40557e+01 58.496  3.07162e+00  5.01160e+00  0.00000e+00 0.00000e+00 9.06811e+01 58.496  1.66254e+01 58.496  0.9104 
1 1 1 -1  10  1  f 0  2.66079e+01 3.88685e-01 1.30377e+02 179.939 -6.19744e-01 6.63062e-04  0.00000e+00 0.00000e+00 1.65400e+02 179.939 3.50232e+01 179.939 0.2959 
1 1 1 -1  10  2  o 16 4.70833e+01 7.57487e-01 4.43731e+02 327.481 4.72192e+00  -3.01034e+00 0.00000e+00 0.00000e+00 1.15803e+03 327.481 7.14303e+02 327.481 0.9057 
1 1 1 -1  10  3  o 13 4.90682e+01 7.62691e-01 8.74540e+02 238.475 -7.40524e+00 -1.20725e+01 0.00000e+00 0.00000e+00 9.01990e+02 238.475 2.74501e+01 238.475 0.9640 
1 1 1 -1  10  4  o 19 4.74003e+01 7.39479e-01 8.18237e+02 100.129 -3.42948e+00 1.91968e+01  0.00000e+00 0.00000e+00 9.15249e+02 100.129 9.70119e+01 100.129 0.9740 
1 1 1 -1  10  5  o 5  2.65360e+01 4.79469e-01 4.14662e+02 168.777 -6.09141e+00 1.20866e+00  0.00000e+00 0.00000e+00 4.97210e+02 168.777 8.25473e+01 168.777 0.9155 
1 1 1 -1  10  6  o 8  1.34564e+01 3.17456e-01 1.47693e+02 290.901 6.04010e-01  -1.58169e+00 0.00000e+00 0.00000e+00 1.75628e+02 290.901 2.79356e+01 290.901 0.6404 
1 1 1 -1  10  7  o 18 2.15096e+01 3.68957e-01 2.39294e+02 101.498 -9.25795e-01 4.55110e+00  0.00000e+00 0.00000e+00 4.74177e+02 101.498 2.34884e+02 101.498 0.8844 
1 1 1 -1  10  8  o 15 1.86169e+01 3.47037e-01 5.15054e+02 309.431 7.26517e+00  -8.83508e+00 0.00000e+00 0.00000e+00 1.51579e+02 309.431 3.63475e+02 129.431 0.9552 
1 1 1 -1  10  9  o 16 4.17870e+01 6.66997e-01 6.95877e+02 173.431 -4.55776e+01 5.24859e+00  0.00000e+00 0.00000e+00 8.52511e+02 173.431 1.56634e+02 173.431 0.9890 
1 1 1 -1  10  10 o 12 1.99477e+01 4.73376e-01 4.48037e+02 25.151  1.68958e+01  7.93294e+00  0.00000e+00 0.00000e+00 2.78548e+02 25.151  1.69490e+02 205.151 0.9728 
1 1 1 -1  10  11 o 13 1.95306e+01 4.26720e-01 2.20625e+02 337.341 1.11949e+01  -4.67337e+00 0.00000e+00 0.00000e+00 4.79335e+02 337.341 2.58710e+02 337.341 0.9579 
1 1 1 -1  10  12 o 19 8.79286e+00 5.40537e-01 2.86853e+02 214.606 -7.14600e+00 -4.93079e+00 0.00000e+00 0.00000e+00 2.23408e+01 214.606 2.64512e+02 34.606  0.9405 
1 1 1 -1  10  13 o 3  1.34658e+01 5.10377e-01 2.52836e+02 169.617 -2.01122e+01 3.68526e+00  0.00000e+00 0.00000e+00 2.37763e+02 169.617 1.50731e+01 349.616 0.9752 
1 1 1 -1  10  14 o 1  6.03484e+00 8.63135e-01 6.70640e+01 241.670 -1.40118e+00 -2.59907e+00 0.00000e+00 0.00000e+00 1.14589e+02 241.670 4.75246e+01 241.670 0.8064 
1 1 1 -1  10  15 o 10 3.73825e+00 9.26705e-01 6.71442e+01 36.252  1.97758e+00  1.45011e+00  0.00000e+00 0.00000e+00 3.87617e+01 36.252  2.83825e+01 216.252 0.7597 
1 1 1 -1  10  16 o 10 1.94152e+01 6.25144e-01 2.96866e+02 300.650 3.61665e+01  -6.10330e+01 0.00000e+00 0.00000e+00 4.21322e+02 300.650 1.24457e+02 300.650 0.9929 
1 1 1 -1  10  17 o 11 1.01989e+01 7.89959e-01 1.87029e+02 210.463 -2.48337e+01 -1.46067e+01 0.00000e+00 0.00000e+00 1.85883e+02 210.463 1.14649e+00 30.463  0.9825 
1 1 1 -1  10  18 o 7  9.27319e+00 1.05561e+00 1.22992e+02 13.592  1.57843e+01  3.81630e+00  0.00000e+00 0.00000e+00 2.10943e+02 13.592  8.79509e+01 13.592  0.9687 
1 1 1 -1  10  19 o 4  1.36797e+01 1.00521e+00 1.50849e+02 357.423 3.47655e+01  -1.56437e+00 0.00000e+00 0.00000e+00 3.49735e+02 357.423 1.98887e+02 357.423 0.9855 
1 1 1 -1  10  20 o 16 1.08768e+01 1.43699e+00 1.15785e+02 192.861 -1.83101e+01 -4.18064e+00 0.00000e+00 0.00000e+00 2.76692e+02 192.861 1.60907e+02 192.861 0.9730 
1 1 1 -1  10  21 o 4  3.91872e+00 1.30928e+00 5.80169e+01 123.121 -2.40214e+00 3.68191e+00  0.00000e+00 0.00000e+00 6.92982e+01 123.121 1.12813e+01 123.121 0.8772 
1 1 1 -1  11  1  o 10 2.71221e+01 3.86789e-01 5.53098e+02 298.376 2.57350e+00  -4.76443e+00 0.00000e+00 0.00000e+00 3.66160e+02 298.376 1.86939e+02 118.376 0.9022 
1 1 1 -1  11  2  o 2  6.86213e+00 1.67862e-01 2.51026e+02 275.221 5.26419e-02  -5.76108e-01 0.00000e+00 0.00000e+00 1.79422e+02 95.221  4.30448e+02 95.221  0.2778 
1 1 1 -1  11  3  o 17 3.29567e+01 5.21773e-01 6.66873e+02 163.969 -1.04027e+01 2.98909e+00  0.00000e+00 0.00000e+00 5.12187e+02 163.969 1.54686e+02 343.969 0.9526 
1 1 1 -1  11  4  o 12 2.39655e+01 3.93412e-01 3.70401e+02 205.647 -3.94210e+00 -1.89275e+00 0.00000e+00 0.00000e+00 4.18255e+02 205.647 4.78540e+01 205.647 0.8765 
1 1 1 -1  11  5  o 9  3.15989e+01 5.60717e-01 8.88079e+02 307.749 9.55265e+00  -1.23379e+01 0.00000e+00 0.00000e+00 2.59298e+02 307.749 6.28781e+02 127.749 0.9674 
1 1 1 -1  11  6  o 3  1.43163e+01 3.30648e-01 2.19271e+01 324.415 2.15717e-01  -1.54353e-01 0.00000e+00 0.00000e+00 4.86929e+01 324.415 2.67657e+01 324.415 0.1315 
1 1 1 -1  11  7  o 16 8.24987e+00 2.37320e-01 3.15596e+02 288.970 7.61290e-01  -2.21469e+00 0.00000e+00 0.00000e+00 8.45840e+01 108.970 4.00180e+02 108.970 0.7466 
1 1 1 -1  11  8  o 13 1.73470e+01 3.33018e-01 3.00544e+02 177.834 -6.19819e+00 2.34409e-01  0.00000e+00 0.00000e+00 2.94692e+02 177.834 5.85221e+00 357.834 0.9154 
1 1 1 -1  11  9  o 16 3.16383e+01 8.70002e-01 2.44262e+02 183.582 -1.20317e+01 -7.53235e-01 0.00000e+00 0.00000e+00 8.90751e+02 183.582 6.46489e+02 183.582 0.9576 
1 1 1 -1  11  10 o 18 1.52188e+01 3.65021e-01 2.53818e+02 94.919  -6.93378e-01 8.05599e+00  0.00000e+00 0.00000e+00 2.79486e+02 94.919  2.56682e+01 94.919  0.9360 
1 1 1 -1  11  11 o 16 5.13272e+00 9.53345e-01 9.27200e+01 348.316 1.26245e+00  -2.61075e-01 0.00000e+00 0.00000e+00 1.08926e+01 348.316 8.18274e+01 168.316 0.5395 
1 1 1 -1  11  12 o 13 1.39841e+01 7.13266e-01 2.13685e+02 244.260 -5.00138e+00 -1.03737e+01 0.00000e+00 0.00000e+00 2.85899e+02 244.260 7.22138e+01 244.260 0.9555 
1 1 1 -1  11  13 o 5  5.79478e+00 8.03969e-01 4.82904e+01 30.271  1.38988e+00  8.11221e-01  0.00000e+00 0.00000e+00 8.63611e+01 30.271  3.80707e+01 30.271  0.6220 
1 1 1 -1  11  14 o 4  1.12946e+01 5.82182e-01 3.04798e+02 93.867  -1.79178e+00 2.65043e+01  0.00000e+00 0.00000e+00 1.08760e+02 93.867  1.96038e+02 273.868 0.9810 
1 1 1 -1  11  15 o 5  1.84689e+01 5.52343e-01 4.11003e+02 332.115 7.28494e+01  -3.85480e+01 0.00000e+00 0.00000e+00 2.73516e+02 332.115 1.37487e+02 152.115 0.9939 
1 1 1 -1  11  16 o 3  1.19439e+01 6.75450e-01 1.64633e+02 203.905 -2.17884e+01 -9.65747e+00 0.00000e+00 0.00000e+00 2.70881e+02 203.905 1.06248e+02 203.905 0.9788 
1 1 1 -1  11  17 o 14 6.98704e+00 9.67266e-01 1.28696e+02 37.428  9.91250e+00  7.58624e+00  0.00000e+00 0.00000e+00 1.20679e+02 37.428  8.01665e+00 217.428 0.9591 
1 1 1 -1  11  18 o 4  3.68952e+00 1.10810e+00 4.50286e+01 231.642 -1.42439e+00 -1.79987e+00 0.00000e+00 0.00000e+00 5.65693e+01 231.642 1.15407e+01 231.642 0.7408 
1 1 1 -1  11  19 o 8  5.20201e+00 1.32268e+00 8.22786e+01 100.403 -1.07218e+00 5.84005e+00  0.00000e+00 0.00000e+00 9.37534e+01 100.403 1.14747e+01 100.403 0.9114 
1 1 1 -1  11  20 o 3  4.89868e+00 1.44960e+00 7.89507e+01 254.897 -1.48740e+00 -5.51151e+00 0.00000e+00 0.00000e+00 8.59229e+01 254.897 6.97217e+00 254.897 0.9076 
1 1 1 -1  11  21 o 18 6.37854e+00 1.76226e+00 1.01683e+02 324.906 6.77082e+00  -4.75747e+00 0.00000e+00 0.00000e+00 1.19782e+02 324.906 1.80982e+01 324.906 0.9375 
1 1 1 -1  12  1  o 6  2.04907e+01 3.03870e-01 4.40405e+02 138.103 -2.17382e+00 1.95025e+00  0.00000e+00 0.00000e+00 1.78427e+02 138.103 2.61978e+02 318.103 0.8039 
1 1 1 -1  12  2  o 16 2.22369e+01 3.15869e-01 4.40915e+02 277.161 3.82116e-01  -3.04145e+00 0.00000e+00 0.00000e+00 2.39567e+02 277.161 2.01347e+02 97.161  0.8147 
1 1 1 -1  12  3  f 0  8.89716e+00 1.97868e-01 1.76034e+02 49.971  4.76413e-01  5.67193e-01  0.00000e+00 0.00000e+00 6.00638e+01 229.971 2.36098e+02 229.971 0.3471 
1 1 1 -1  12  4  o 1  3.14448e+01 5.03324e-01 9.24942e+02 182.797 -1.39416e+01 -6.81201e-01 0.00000e+00 0.00000e+00 2.12534e+02 182.797 7.12408e+02 2.797   0.9635 
1 1 1 -1  12  5  o 6  1.70442e+01 3.06625e-01 4.54511e+02 296.768 2.83369e+00  -5.61741e+00 0.00000e+00 0.00000e+00 1.31896e+02 296.768 3.22615e+02 116.769 0.9167 
1 1 1 -1  12  6  o 7  3.07497e+01 5.79815e-01 8.48003e+02 342.329 1.92448e+01  -6.13097e+00 0.00000e+00 0.00000e+00 2.76753e+02 342.329 5.71250e+02 162.329 0.9749 
1 1 1 -1  12  7  o 18 1.19316e+01 2.72692e-01 3.31477e+02 218.281 -3.32131e+00 -2.62122e+00 0.00000e+00 0.00000e+00 5.86446e+01 218.281 2.72833e+02 38.281  0.8719 
1 1 1 -1  12  8  o 18 4.72614e+01 7.40248e-01 9.77145e+02 58.379  2.84404e+01  4.61919e+01  0.00000e+00 0.00000e+00 7.77975e+02 58.379  1.99170e+02 238.379 0.9907 
1 1 1 -1  12  9  o 12 3.53458e+01 5.78256e-01 5.87006e+02 4.090   3.26099e+01  2.33175e+00  0.00000e+00 0.00000e+00 7.16728e+02 4.090   1.29722e+02 4.090   0.9846 
1 1 1 -1  12  10 o 16 3.33140e+01 5.60743e-01 6.08537e+02 160.119 -4.13831e+01 1.49650e+01  0.00000e+00 0.00000e+00 6.24463e+02 160.119 1.59265e+01 160.119 0.9886 
1 1 1 -1  12  11 o 13 2.90894e+01 5.78804e-01 6.12526e+02 274.570 3.95646e+00  -4.94993e+01 0.00000e+00 0.00000e+00 4.64806e+02 274.570 1.47721e+02 94.570  0.9899 
1 1 1 -1  12  12 o 15 2.77433e+01 5.39241e-01 5.53371e+02 155.288 -5.45458e+01 2.51018e+01  0.00000e+00 0.00000e+00 4.75169e+02 155.288 7.82024e+01 335.288 0.9916 
1 1 1 -1  12  13 o 12 7.96433e+00 6.31571e-01 1.09701e+02 325.949 4.27213e+00  -2.88710e+00 0.00000e+00 0.00000e+00 1.57136e+02 325.949 4.74354e+01 325.949 0.8969 
1 1 1 -1  12  14 o 6  3.05677e+00 8.73291e-01 6.83571e+01 75.737  3.74099e-01  1.47161e+00  0.00000e+00 0.00000e+00 1.71209e-01 75.737  6.81859e+01 255.737 0.6007 
1 1 1 -1  12  15 f 0  7.53118e+00 8.14085e-01 1.55966e+02 219.866 -9.12125e+00 -7.61726e+00 0.00000e+00 0.00000e+00 1.12777e+02 219.866 4.31891e+01 39.866  0.9570 
1 1 1 -1  12  16 o 10 2.23472e+01 6.51732e-01 3.84673e+02 198.936 -1.09136e+02 -3.74414e+01 0.00000e+00 0.00000e+00 4.44199e+02 198.936 5.95266e+01 198.936 0.9957 
1 1 1 -1  12  17 o 14 5.42487e+00 1.03697e+00 1.15581e+02 142.730 -6.68197e+00 5.08473e+00  0.00000e+00 0.00000e+00 7.38638e+01 142.730 4.17167e+01 322.730 0.9384 
1 1 1 -1  12  18 o 5  6.21191e+00 1.21475e+00 1.31472e+02 334.561 9.57507e+00  -4.55456e+00 0.00000e+00 0.00000e+00 8.82630e+01 334.561 4.32090e+01 154.561 0.9516 
1 1 1 -1  12  19 o 13 4.33546e+00 1.26474e+00 1.01506e+02 257.498 -1.37399e+00 -6.19690e+00 0.00000e+00 0.00000e+00 4.61735e+01 257.498 5.53326e+01 77.498  0.9174 
1 1 1 -1  12  20 o 10 8.95875e+00 1.52696e+00 1.49120e+02 37.419  1.49738e+01  1.14563e+01  0.00000e+00 0.00000e+00 1.74161e+02 37.419  2.50406e+01 37.419  0.9731 
1 1 1 -1  12  21 o 11 3.94819e+00 1.31689e+00 3.84981e+01 142.464 -2.27415e+00 1.74727e+00  0.00000e+00 0.00000e+00 7.84378e+01 142.464 3.99397e+01 142.464 0.7997 
1 1 1 -1  13  1  o 18 2.37996e+01 3.46917e-01 4.27933e+02 291.196 1.07311e+00  -2.76723e+00 0.00000e+00 0.00000e+00 2.94084e+02 291.196 1.33849e+02 111.196 0.8076 
1 1 1 -1  13  2  o 6  4.17090e+01 5.64822e-01 5.83706e+02 19.624  6.67418e+00  2.37967e+00  0.00000e+00 0.00000e+00 8.67710e+02 19.624  2.84003e+02 19.624  0.9265 
1 1 1 -1  13  3  o 17 2.28744e+01 3.25200e-01 4.33540e+02 115.223 -1.91279e+00 4.06062e+00  0.00000e+00 0.00000e+00 3.22377e+02 115.223 1.11164e+02 295.223 0.8800 
1 1 1 -1  13  4  o 1  4.94465e+01 7.73053e-01 8.48564e+02 114.462 -1.13611e+01 2.49733e+01  0.00000e+00 0.00000e+00 9.73673e+02 114.462 1.25108e+02 114.462 0.9816 
1 1 1 -1  13  5  o 14 1.42713e+01 2.72162e-01 2.77587e+02 184.721 -3.15810e+00 -2.60815e-01 0.00000e+00 0.00000e+00 1.62553e+02 184.721 1.15034e+02 4.721   0.8217 
1 1 1 -1  13  6  o 3  1.13322e+01 3.00052e-01 4.53841e+02 258.931 -7.60783e-01 -3.88899e+00 0.00000e+00 0.00000e+00 8.73268e+01 78.931  5.41168e+02 78.931  0.8621 
1 1 1 -1  13  7  o 14 2.75895e+01 5.25075e-01 4.21188e+02 198.592 -1.16763e+01 -3.92779e+00 0.00000e+00 0.00000e+00 5.70519e+02 198.592 1.49330e+02 198.592 0.9585 
1 1 1 -1  13  8  o 10 4.36954e+01 8.09724e-01 1.06087e+03 347.776 5.29178e+01  -1.14642e+01 0.00000e+00 0.00000e+00 5.61743e+02 347.776 4.99122e+02 167.776 0.9907 
1 1 1 -1  13  9  o 3  3.90096e+01 6.28938e-01 6.77972e+02 191.367 -3.99271e+01 -8.02676e+00 0.00000e+00 0.00000e+00 7.65326e+02 191.367 8.73541e+01 191.367 0.9876 
1 1 1 -1  13  10 o 7  2.87736e+01 5.04191e-01 4.12449e+02 265.408 -2.06409e+00 -2.57006e+01 0.00000e+00 0.00000e+00 6.43677e+02 265.408 2.31228e+02 265.408 0.9804 
1 1 1 -1  13  11 o 9  2.17218e+01 4.52348e-01 3.02414e+02 349.374 1.95908e+01  -3.67549e+00 0.00000e+00 0.00000e+00 4.89600e+02 349.374 1.87187e+02 349.374 0.9746 
1 1 1 -1  13  12 o 16 2.25735e+01 4.90302e-01 3.89334e+02 261.628 -5.01736e+00 -3.40911e+01 0.00000e+00 0.00000e+00 4.42234e+02 261.628 5.29004e+01 261.628 0.9854 
1 1 1 -1  13  13 o 18 9.30433e+00 5.61607e-01 1.49817e+02 343.712 7.66183e+00  -2.23869e+00 0.00000e+00 0.00000e+00 1.75181e+02 343.712 2.53638e+01 343.712 0.9351 
1 1 1 -1  13  14 o 14 9.28084e+00 6.51691e-01 1.07875e+02 83.239  9.72720e-01  8.20527e+00  0.00000e+00 0.00000e+00 2.16817e+02 83.239  1.08943e+02 83.239  0.9374 
1 1 1 -1  13  15 o 13 9.86009e+00 6.96130e-01 2.33954e+02 223.107 -1.76160e+01 -1.64888e+01 0.00000e+00 0.00000e+00 1.26006e+02 223.107 1.07949e+02 43.107  0.9791 
1 1 1 -1  13  16 o 8  6.01884e+00 9.27634e-01 1.14346e+02 175.830 -8.30294e+00 6.05402e-01  0.00000e+00 0.00000e+00 9.59307e+01 175.830 1.84151e+01 355.830 0.9379 
1 1 1 -1  13  17 o 13 1.02360e+01 7.88542e-01 2.05178e+02 306.198 1.87145e+01  -2.55723e+01 0.00000e+00 0.00000e+00 1.69665e+02 306.198 3.55127e+01 126.198 0.9841 
1 1 1 -1  13  18 o 11 3.87645e+00 1.12681e+00 1.17228e+02 254.233 -1.68603e+00 -5.97127e+00 0.00000e+00 0.00000e+00 1.46761e+01 254.233 1.02552e+02 74.233  0.9154 
1 1 1 -1  13  19 o 1  4.34461e+00 1.25979e+00 8.82529e+01 86.326  3.55443e-01  5.53485e+00  0.00000e+00 0.00000e+00 5.76748e+01 86.326  3.05781e+01 266.326 0.9047 
1 1 1 -1  13  20 o 8  6.22306e+00 1.47182e+00 1.03932e+02 210.584 -8.21052e+00 -4.85253e+00 0.00000e+00 0.00000e+00 1.14374e+02 210.584 1.04421e+01 210.584 0.9460 
1 1 1 -1  13  21 o 14 3.53750e+00 1.20178e+00 6.36876e+01 288.723 1.51772e+00  -4.47805e+00 0.00000e+00 0.00000e+00 5.24726e+01 288.723 1.12150e+01 108.723 0.8867 
1 1 1 -1  14  1  o 9  2.16338e+01 3.13055e-01 3.67531e+02 256.751 -6.45008e-01 -2.73938e+00 0.00000e+00 0.00000e+00 2.78733e+02 256.751 8.87971e+01 76.751  0.7953 
1 1 1 -1  14  2  o 8  3.73864e+01 5.09918e-01 6.15552e+02 114.606 -3.60728e+00 7.87689e+00  0.00000e+00 0.00000e+00 7.04921e+02 114.606 8.93695e+01 114.606 0.9404 
1 1 1 -1  14  3  o 8  4.28073e+01 5.80118e-01 9.06481e+02 359.053 1.67784e+01  -2.77193e-01 0.00000e+00 0.00000e+00 6.52339e+02 359.053 2.54142e+02 179.053 0.9697 
1 1 1 -1  14  4  o 19 2.15883e+01 3.35994e-01 5.77124e+02 286.937 2.32452e+00  -7.63311e+00 0.00000e+00 0.00000e+00 1.80713e+02 286.937 3.96411e+02 106.937 0.9351 
1 1 1 -1  14  5  o 6  1.67068e+01 3.05783e-01 6.01678e+02 329.416 6.81011e+00  -4.02486e+00 0.00000e+00 0.00000e+00 1.57559e+01 149.416 6.17433e+02 149.416 0.9345 
1 1 1 -1  14  6  o 19 2.78381e+01 5.69453e-01 4.95430e+02 264.507 -1.00460e+00 -1.04460e+01 0.00000e+00 0.00000e+00 4.97865e+02 264.507 2.43486e+00 264.507 0.9511 
1 1 1 -1  14  7  o 10 1.43798e+01 3.59803e-01 3.62437e+02 120.146 -2.76837e+00 4.76680e+00  0.00000e+00 0.00000e+00 1.25061e+02 120.146 2.37376e+02 300.146 0.9040 
1 1 1 -1  14  8  o 14 2.04165e+01 3.73331e-01 2.33129e+02 357.343 5.85620e+00  -2.71734e-01 0.00000e+00 0.00000e+00 4.63357e+02 357.343 2.30228e+02 357.343 0.9102 
1 1 1 -1  14  9  o 17 1.39643e+01 3.99252e-01 2.28591e+02 67.839  1.86243e+00  4.57262e+00  0.00000e+00 0.00000e+00 2.37968e+02 67.839  9.37713e+00 67.839  0.8919 
1 1 1 -1  14  10 o 9  2.79438e+01 4.95738e-01 4.65661e+02 69.126  1.00596e+01  2.63798e+01  0.00000e+00 0.00000e+00 5.61764e+02 69.126  9.61035e+01 69.126  0.9821 
1 1 1 -1  14  11 o 13 1.86885e+01 5.58453e-01 5.54182e+02 73.865  8.66605e+00  2.99563e+01  0.00000e+00 0.00000e+00 1.33673e+02 73.865  4.20508e+02 253.865 0.9838 
1 1 1 -1  14  12 o 18 2.59560e+01 5.24131e-01 3.71819e+02 67.234  1.60887e+01  3.83373e+01  0.00000e+00 0.00000e+00 5.86762e+02 67.234  2.14942e+02 67.234  0.9879 
1 1 1 -1  14  13 o 15 2.06723e+01 5.61142e-01 2.20102e+02 251.316 -8.33475e+00 -2.46466e+01 0.00000e+00 0.00000e+00 5.37089e+02 251.316 3.16987e+02 251.316 0.9806 
1 1 1 -1  14  14 o 13 1.56739e+01 5.49824e-01 3.21388e+02 47.187  2.87586e+01  3.10419e+01  0.00000e+00 0.00000e+00 2.56623e+02 47.187  6.47656e+01 227.187 0.9881 
1 1 1 -1  14  15 o 19 9.84425e+00 6.70761e-01 1.70533e+02 278.355 2.52688e+00  -1.72052e+01 0.00000e+00 0.00000e+00 1.85809e+02 278.355 1.52753e+01 278.355 0.9708 
1 1 1 -1  14  16 o 14 1.54656e+01 6.13075e-01 2.58953e+02 185.928 -5.40516e+01 -5.61265e+00 0.00000e+00 0.00000e+00 3.11811e+02 185.928 5.28582e+01 185.928 0.9908 
1 1 1 -1  14  17 o 10 5.66378e+00 9.43937e-01 9.41349e+01 206.457 -6.65210e+00 -3.31041e+00 0.00000e+00 0.00000e+00 1.01875e+02 206.457 7.73969e+00 206.457 0.9300 
1 1 1 -1  14  18 f 0  4.88622e+00 1.23552e+00 8.28678e+01 200.891 -5.18315e+00 -1.97830e+00 0.00000e+00 0.00000e+00 8.14432e+01 200.891 1.42463e+00 20.891  0.9047 
1 1 1 -1  14  19 f 0  1.24511e+01 1.04057e+00 2.05188e+02 27.288  3.96128e+01  2.04354e+01  0.00000e+00 0.00000e+00 2.51855e+02 27.288  4.66674e+01 27.288  0.9887 
1 1 1 -1  14  20 o 6  3.74281e+00 1.23177e+00 3.66670e+01 317.305 1.80736e+00  -1.66750e+00 0.00000e+00 0.00000e+00 6.88744e+01 317.305 3.22074e+01 317.305 0.7605 
1 1 1 -1  15  1  o 17 1.75667e+01 2.67567e-01 4.52677e+02 164.502 -2.46796e+00 6.84351e-01  0.00000e+00 0.00000e+00 5.63804e+01 164.502 3.96297e+02 344.501 0.7715 
1 1 1 -1  15  2  o 3  4.01659e+01 5.46826e-01 6.59442e+02 44.607  6.63386e+00  6.54345e+00  0.00000e+00 0.00000e+00 7.65677e+02 44.607  1.06235e+02 44.607  0.9447 
1 1 1 -1  15  3  o 3  1.10700e+01 1.96375e-01 2.29546e+02 87.242  5.83812e-02  1.21171e+00  0.00000e+00 0.00000e+00 1.47125e+01 267.242 2.44258e+02 267.242 0.5168 
1 1 1 -1  15  4  o 18 1.95215e+01 2.91162e-01 4.50922e+02 221.827 -4.08947e+00 -3.65990e+00 0.00000e+00 0.00000e+00 2.11273e+02 221.827 2.39649e+02 41.827  0.9036 
1 1 1 -1  15  5  o 14 3.04875e+01 4.58346e-01 8.10710e+02 197.530 -1.79589e+01 -5.67285e+00 0.00000e+00 0.00000e+00 3.02642e+02 197.530 5.08068e+02 17.530  0.9731 
1 1 1 -1  15  6  o 14 2.53265e+01 3.95789e-01 6.96171e+02 101.108 -2.92234e+00 1.48841e+01  0.00000e+00 0.00000e+00 2.22069e+02 101.108 4.74102e+02 281.108 0.9665 
1 1 1 -1  15  7  o 9  3.57492e+01 6.03391e-01 6.97374e+02 151.481 -2.28929e+01 1.24396e+01  0.00000e+00 0.00000e+00 6.17173e+02 151.481 8.02008e+01 331.481 0.9806 
1 1 1 -1  15  8  o 19 1.40443e+01 3.57536e-01 1.92983e+02 127.409 -2.02181e+00 2.64359e+00  0.00000e+00 0.00000e+00 2.44744e+02 127.409 5.17608e+01 127.409 0.8316 
1 1 1 -1  15  9  o 11 3.73495e+01 7.17091e-01 6.01066e+02 8.411   3.39166e+01  5.01497e+00  0.00000e+00 0.00000e+00 7.77430e+02 8.411   1.76363e+02 8.411   0.9853 
1 1 1 -1  15  10 o 10 3.00110e+01 5.21571e-01 4.96250e+02 119.853 -1.64613e+01 2.86814e+01  0.00000e+00 0.00000e+00 6.10100e+02 119.853 1.13850e+02 119.853 0.9848 
1 1 1 -1  15  11 o 19 3.58388e+01 6.15730e-01 5.89915e+02 264.070 -6.54091e+00 -6.29685e+01 0.00000e+00 0.00000e+00 7.40170e+02 264.070 1.50255e+02 264.070 0.9921 
1 1 1 -1  15  12 o 12 8.55057e+00 5.55443e-01 2.01068e+02 128.216 -4.56225e+00 5.79418e+00  0.00000e+00 0.00000e+00 9.60317e+01 128.216 1.05036e+02 308.216 0.9295 
1 1 1 -1  15  13 o 3  1.83508e+01 5.03029e-01 3.43171e+02 325.923 2.99769e+01  -2.02783e+01 0.00000e+00 0.00000e+00 3.32727e+02 325.923 1.04434e+01 145.923 0.9861 
1 1 1 -1  15  14 o 17 1.27095e+01 5.69947e-01 1.99415e+02 329.496 1.82530e+01  -1.07534e+01 0.00000e+00 0.00000e+00 2.63563e+02 329.496 6.41477e+01 329.496 0.9761 
1 1 1 -1  15  15 o 3  3.44979e+00 9.34854e-01 7.09433e+01 229.167 -1.53083e+00 -1.77139e+00 0.00000e+00 0.00000e+00 2.50834e+01 229.167 4.58599e+01 49.167  0.7466 
1 1 1 -1  15  16 o 7  1.46707e+01 7.31967e-01 2.79014e+02 171.354 -5.06228e+01 7.69750e+00  0.00000e+00 0.00000e+00 2.62083e+02 171.354 1.69308e+01 351.354 0.9902 
1 1 1 -1  15  17 f 0  8.72788e+00 8.39554e-01 1.54867e+02 249.625 -6.88697e+00 -1.85433e+01 0.00000e+00 0.00000e+00 1.61572e+02 249.625 6.70514e+00 249.625 0.9744 
1 1 1 -1  15  18 o 18 1.06427e+01 9.78766e-01 1.66383e+02 329.539 2.44366e+01  -1.43717e+01 0.00000e+00 0.00000e+00 2.22143e+02 329.539 5.57600e+01 329.539 0.9822 
1 1 1 -1  15  19 o 14 6.91765e+00 1.33983e+00 1.42297e+02 94.879  -1.18633e+00 1.38970e+01  0.00000e+00 0.00000e+00 1.05131e+02 94.879  3.71660e+01 274.879 0.9635 
1 1 1 -1  15  20 o 9  4.34554e+00 1.34408e+00 5.37267e+01 269.442 -3.71449e-02 -3.81475e+00 0.00000e+00 0.00000e+00 8.41995e+01 269.442 3.04729e+01 269.442 0.8560 
1 1 1 -1  16  1  o 14 2.50377e+01 3.57272e-01 4.89369e+02 58.293  1.89563e+00  3.06846e+00  0.00000e+00 0.00000e+00 3.06700e+02 58.293  1.82669e+02 238.293 0.8465 
1 1 1 -1  16  2  o 19 2.98292e+01 4.16476e-01 8.04944e+02 125.386 -4.58443e+00 6.45428e+00  0.00000e+00 0.00000e+00 2.41965e+02 125.386 5.62979e+02 305.386 0.9345 
1 1 1 -1  16  3  o 19 1.65680e+01 2.57058e-01 1.81122e+02 310.793 8.95911e-01  -1.03820e+00 0.00000e+00 0.00000e+00 1.68920e+02 310.793 1.22020e+01 130.792 0.5627 
1 1 1 -1  16  4  o 13 3.91565e+01 5.36983e-01 7.00220e+02 185.361 -2.20879e+01 -2.07287e+00 0.00000e+00 0.00000e+00 7.36153e+02 185.361 3.59329e+01 185.361 0.9772 
1 1 1 -1  16  5  o 17 6.83317e+00 1.96662e-01 4.83790e+01 83.461  2.82820e-02  2.46736e-01  0.00000e+00 0.00000e+00 1.67798e+01 263.461 6.51588e+01 263.461 0.1232 
1 1 1 -1  16  6  o 1  1.35172e+01 2.82902e-01 2.34583e+02 345.515 2.61897e+00  -6.76566e-01 0.00000e+00 0.00000e+00 1.63753e+02 345.515 7.08300e+01 165.515 0.7856 
1 1 1 -1  16  7  o 10 1.38723e+01 3.53315e-01 1.78030e+02 69.309  9.10874e-01  2.41176e+00  0.00000e+00 0.00000e+00 2.24173e+02 69.309  4.61426e+01 69.309  0.7732 
1 1 1 -1  16  8  o 7  1.77524e+01 6.11802e-01 5.87023e+02 356.342 1.26554e+01  -8.08994e-01 0.00000e+00 0.00000e+00 5.15034e+01 356.342 5.35519e+02 176.342 0.9597 
1 1 1 -1  16  9  f 0  1.93177e+01 4.33599e-01 2.72502e+02 321.012 7.75137e+00  -6.27423e+00 0.00000e+00 0.00000e+00 4.13779e+02 321.012 1.41277e+02 321.012 0.9485 
1 1 1 -1  16  10 o 3  1.10279e+01 3.84398e-01 2.18709e+02 17.897  5.11398e+00  1.65152e+00  0.00000e+00 0.00000e+00 1.53396e+02 17.897  6.53122e+01 197.897 0.9014 
1 1 1 -1  16  11 f 0  3.50320e+01 6.05769e-01 3.62391e+02 305.210 2.09142e+01  -2.96364e+01 0.00000e+00 0.00000e+00 9.29897e+02 305.210 5.67505e+02 305.210 0.9861 
1 1 1 -1  16  12 o 18 1.86556e+01 4.72349e-01 3.90403e+02 110.278 -1.08838e+01 2.94569e+01  0.00000e+00 0.00000e+00 2.95755e+02 110.278 9.46484e+01 290.278 0.9839 
1 1 1 -1  16  13 o 1  7.40212e+00 6.82265e-01 1.20789e+02 227.384 -3.43149e+00 -3.72968e+00 0.00000e+00 0.00000e+00 1.26636e+02 227.384 5.84666e+00 227.384 0.8949 
1 1 1 -1  16  14 o 10 7.80275e+00 7.25123e-01 1.47832e+02 45.639  6.18857e+00  6.32827e+00  0.00000e+00 0.00000e+00 1.26372e+02 45.639  2.14602e+01 225.639 0.9417 
1 1 1 -1  16  15 o 1  6.97162e+00 8.58425e-01 1.06392e+02 189.920 -7.15748e+00 -1.25176e+00 0.00000e+00 0.00000e+00 1.34921e+02 189.920 2.85288e+01 189.920 0.9284 
1 1 1 -1  16  16 o 1  9.80026e+00 8.09861e-01 2.35389e+02 169.166 -2.75494e+01 5.27208e+00  0.00000e+00 0.00000e+00 1.23071e+02 169.166 1.12318e+02 349.166 0.9820 
1 1 1 -1  16  17 o 3  2.65428e+00 8.63437e-01 6.99500e+01 354.471 2.67321e+00  -2.58752e-01 0.00000e+00 0.00000e+00 7.45478e+00 354.471 6.24952e+01 174.471 0.7838 
1 1 1 -1  16  18 o 14 3.75174e+00 1.10667e+00 9.82895e+01 152.937 -4.86741e+00 2.48677e+00  0.00000e+00 0.00000e+00 2.76473e+01 152.937 7.06422e+01 332.937 0.9032 
1 1 1 -1  16  19 o 18 1.00875e+01 1.21677e+00 1.32663e+02 343.318 1.97902e+01  -5.93062e+00 0.00000e+00 0.00000e+00 2.32635e+02 343.318 9.99725e+01 343.318 0.9755 
1 1 1 -1  16  20 o 2  4.11420e+00 1.30151e+00 6.43330e+01 261.023 -7.18367e-01 -4.54742e+00 0.00000e+00 0.00000e+00 7.04087e+01 261.023 6.07568e+00 261.023 0.8833 
1 1 1 -1  17  1  o 15 2.12930e+01 3.13717e-01 4.22817e+02 77.850  7.10366e-01  3.29949e+00  0.00000e+00 0.00000e+00 2.44410e+02 77.850  1.78408e+02 257.850 0.8343 
1 1 1 -1  17  2  o 6  3.67908e+01 5.05434e-01 8.70671e+02 14.989  1.48536e+01  3.97705e+00  0.00000e+00 0.00000e+00 4.65261e+02 14.989  4.05410e+02 194.989 0.9669 
1 1 1 -1  17  3  o 7  4.91168e+01 6.64979e-01 9.04288e+02 115.912 -1.01137e+01 2.08174e+01  0.00000e+00 0.00000e+00 8.99597e+02 115.912 4.69046e+00 295.912 0.9782 
1 1 1 -1  17  4  o 1  2.38575e+01 3.46427e-01 2.67202e+02 136.267 -3.63520e+00 3.47786e+00  0.00000e+00 0.00000e+00 5.33497e+02 136.267 2.66295e+02 136.267 0.8941 
1 1 1 -1  17  5  o 14 1.64128e+01 2.83822e-01 3.62791e+02 335.149 3.98914e+00  -1.84755e+00 0.00000e+00 0.00000e+00 1.77474e+02 335.149 1.85317e+02 155.149 0.8772 
1 1 1 -1  17  6  o 6  2.40664e+01 3.82161e-01 4.83052e+02 329.801 8.47866e+00  -4.93455e+00 0.00000e+00 0.00000e+00 3.72379e+02 329.801 1.10673e+02 149.801 0.9476 
1 1 1 -1  17  7  o 4  2.28301e+01 4.17491e-01 4.59840e+02 290.100 3.74009e+00  -1.02205e+01 0.00000e+00 0.00000e+00 3.55844e+02 290.100 1.03997e+02 110.100 0.9529 
1 1 1 -1  17  8  o 9  1.95058e+01 3.88712e-01 2.77484e+02 355.850 7.04167e+00  -5.10921e-01 0.00000e+00 0.00000e+00 3.99570e+02 355.850 1.22086e+02 355.850 0.9262 
1 1 1 -1  17  9  o 6  7.20274e+00 5.11366e-01 2.63380e+02 61.613  1.69915e+00  3.14421e+00  0.00000e+00 0.00000e+00 3.54498e+01 241.613 2.98830e+02 241.613 0.8449 
1 1 1 -1  17  10 o 12 7.81966e+00 4.47257e-01 1.10434e+02 144.869 -1.56738e+00 1.10283e+00  0.00000e+00 0.00000e+00 8.96509e+01 144.869 2.07828e+01 324.869 0.6836 
1 1 1 -1  17  11 o 4  1.53328e+01 4.26705e-01 3.40264e+02 181.375 -1.50207e+01 -3.60472e-01 0.00000e+00 0.00000e+00 2.13854e+02 181.375 1.26409e+02 1.375   0.9661 
1 1 1 -1  17  12 o 9  1.42053e+01 4.93547e-01 1.19787e+02 209.703 -6.34514e+00 -3.61961e+00 0.00000e+00 0.00000e+00 3.73378e+02 209.703 2.53591e+02 209.703 0.9288 
1 1 1 -1  17  13 f 0  1.48616e+01 5.11127e-01 2.83191e+02 143.277 -1.95194e+01 1.45612e+01  0.00000e+00 0.00000e+00 2.60350e+02 143.277 2.28414e+01 323.277 0.9792 
1 1 1 -1  17  14 o 14 1.31838e+01 5.73797e-01 2.18345e+02 262.735 -2.87012e+00 -2.25128e+01 0.00000e+00 0.00000e+00 2.62664e+02 262.735 4.43189e+01 262.735 0.9777 
1 1 1 -1  17  15 o 14 1.28791e+01 6.28098e-01 1.51989e+02 281.066 4.11388e+00  -2.10340e+01 0.00000e+00 0.00000e+00 3.16829e+02 281.066 1.64840e+02 281.066 0.9764 
1 1 1 -1  17  16 o 6  3.33267e+00 9.77669e-01 7.49108e+01 235.791 -1.59678e+00 -2.34881e+00 0.00000e+00 0.00000e+00 2.40713e+01 235.791 5.08396e+01 55.791  0.7974 
1 1 1 -1  17  17 o 8  4.95569e+00 9.92229e-01 9.12788e+01 121.804 -3.25760e+00 5.25321e+00  0.00000e+00 0.00000e+00 7.74459e+01 121.804 1.38328e+01 301.804 0.9151 
1 1 1 -1  17  18 o 15 9.52703e+00 1.04425e+00 8.05846e+01 180.752 -1.23080e+01 -1.61497e-01 0.00000e+00 0.00000e+00 2.58782e+02 180.752 1.78197e+02 180.752 0.9585 
1 1 1 -1  17  19 o 18 2.92540e+00 9.90323e-01 4.04208e+01 288.292 6.64386e-01  -2.00988e+00 0.00000e+00 0.00000e+00 3.73392e+01 288.292 3.08162e+00 108.292 0.7161 
1 1 1 -1  17  20 o 16 5.12728e+00 1.38617e+00 5.67383e+01 210.140 -4.07495e+00 -2.36595e+00 0.00000e+00 0.00000e+00 1.11734e+02 210.140 5.49953e+01 210.140 0.8862 
1 1 1 -1  18  1  o 13 1.88708e+01 2.87755e-01 1.80836e+02 22.262  1.09279e+00  4.47333e-01  0.00000e+00 0.00000e+00 1.78348e+02 22.262  2.48876e+00 202.262 0.5068 
1 1 1 -1  18  2  o 13 2.35732e+01 3.42455e-01 3.80131e+02 292.400 1.54350e+00  -3.74481e+00 0.00000e+00 0.00000e+00 3.85974e+02 292.400 5.84263e+00 292.400 0.8654 
1 1 1 -1  18  3  o 2  1.54612e+01 2.49800e-01 5.83490e+02 164.222 -4.35290e+00 1.22995e+00  0.00000e+00 0.00000e+00 7.20720e+01 344.222 6.55562e+02 344.222 0.8810 
1 1 1 -1  18  4  o 18 1.55315e+01 2.54030e-01 3.41507e+02 330.089 3.53312e+00  -2.03253e+00 0.00000e+00 0.00000e+00 1.63578e+02 330.089 1.77929e+02 150.089 0.8664 
1 1 1 -1  18  5  o 17 2.59511e+01 4.02187e-01 5.41515e+02 346.573 1.03815e+01  -2.47838e+00 0.00000e+00 0.00000e+00 3.85458e+02 346.573 1.56057e+02 166.573 0.9519 
1 1 1 -1  18  6  o 13 1.50748e+01 2.78072e-01 3.51748e+02 130.235 -3.04439e+00 3.59807e+00  0.00000e+00 0.00000e+00 1.49394e+02 130.235 2.02354e+02 310.235 0.8863 
1 1 1 -1  18  7  f 0  2.04073e+01 3.54087e-01 2.22098e+02 276.641 6.31921e-01  -5.42738e+00 0.00000e+00 0.00000e+00 4.68921e+02 276.641 2.46823e+02 276.641 0.9031 
1 1 1 -1  18  8  o 5  9.05667e+00 3.01632e-01 2.86769e+02 140.956 -2.62601e+00 2.12982e+00  0.00000e+00 0.00000e+00 3.49644e+00 320.956 2.90265e+02 320.956 0.8346 
1 1 1 -1  18  9  o 2  5.74434e+00 4.94348e-01 1.94124e+02 145.998 -1.62622e+00 1.09697e+00  0.00000e+00 0.00000e+00 4.53792e+01 325.998 2.39503e+02 325.998 0.6914 
1 1 1 -1  18  10 o 6  9.80143e+00 4.77571e-01 1.82356e+02 208.945 -3.83321e+00 -2.11997e+00 0.00000e+00 0.00000e+00 1.39281e+02 208.945 4.30751e+01 28.945  0.8767 
1 1 1 -1  18  11 f 0  3.16665e+01 5.66588e-01 6.82703e+02 248.064 -2.59768e+01 -6.45010e+01 0.00000e+00 0.00000e+00 4.93220e+02 248.064 1.89483e+02 68.064  0.9928 
1 1 1 -1  18  12 o 17 3.46498e+01 6.22459e-01 7.14391e+02 74.768  2.75488e+01  1.01176e+02  0.00000e+00 0.00000e+00 5.74518e+02 74.768  1.39873e+02 254.768 0.9952 
1 1 1 -1  18  13 o 14 1.02316e+01 5.71702e-01 3.05001e+02 257.066 -4.00770e+00 -1.74512e+01 0.00000e+00 0.00000e+00 6.62885e+01 257.066 2.38713e+02 77.066  0.9717 
1 1 1 -1  18  14 o 16 1.46002e+01 5.48494e-01 2.52958e+02 76.823  6.65481e+00  2.84248e+01  0.00000e+00 0.00000e+00 2.82426e+02 76.823  2.94683e+01 76.823  0.9827 
1 1 1 -1  18  15 o 14 1.38404e+01 6.08238e-01 1.74366e+02 272.516 1.16472e+00  -2.65043e+01 0.00000e+00 0.00000e+00 3.31782e+02 272.516 1.57417e+02 272.516 0.9810 
1 1 1 -1  18  16 o 8  6.75782e+00 1.00775e+00 2.17782e+02 298.223 8.30207e+00  -1.54684e+01 0.00000e+00 0.00000e+00 2.66239e+01 298.223 1.91158e+02 118.223 0.9711 
1 1 1 -1  18  17 o 13 8.75532e+00 9.06780e-01 1.52049e+02 162.923 -1.81227e+01 5.56721e+00  0.00000e+00 0.00000e+00 1.64974e+02 162.923 1.29256e+01 162.923 0.9733 
1 1 1 -1  18  18 o 3  6.16444e+00 1.19528e+00 1.03040e+02 255.420 -2.32763e+00 -8.94878e+00 0.00000e+00 0.00000e+00 1.13281e+02 255.420 1.02413e+01 255.420 0.9443 
1 1 1 -1  18  19 o 12 3.55892e+00 1.14284e+00 4.47285e+01 9.618   2.53370e+00  4.29356e-01  0.00000e+00 0.00000e+00 5.73070e+01 9.618   1.25785e+01 9.618   0.7724 
1 1 1 -1  18  20 o 19 3.16603e+00 1.08085e+00 4.18142e+01 48.319  1.84943e+00  2.07715e+00  0.00000e+00 0.00000e+00 5.11959e+01 48.319  9.38170e+00 48.319  0.7924 
1 1 1 -1  19  1  o 16 4.64995e+01 6.32408e-01 9.08471e+02 342.830 1.29217e+01  -3.99261e+00 0.00000e+00 0.00000e+00 7.71974e+02 342.830 1.36497e+02 162.830 0.9623 
1 1 1 -1  19  2  o 16 2.59473e+01 4.28964e-01 3.60410e+02 249.552 -1.60054e+00 -4.29274e+00 0.00000e+00 0.00000e+00 4.99606e+02 249.552 1.39196e+02 249.552 0.8827 
1 1 1 -1  19  3  o 11 2.03177e+01 3.05705e-01 6.45136e+02 39.836  4.84101e+00  4.03856e+00  0.00000e+00 0.00000e+00 5.42212e+01 39.836  5.90915e+02 219.836 0.9168 
1 1 1 -1  19  4  o 13 3.33522e+01 4.66848e-01 6.84890e+02 97.330  -1.66813e+00 1.29673e+01  0.00000e+00 0.00000e+00 5.18065e+02 97.330  1.66825e+02 277.330 0.9610 
1 1 1 -1  19  5  o 6  9.10424e+00 2.17868e-01 2.59536e+02 65.592  7.30487e-01  1.60973e+00  0.00000e+00 0.00000e+00 3.55464e+01 245.592 2.95083e+02 245.592 0.6557 
1 1 1 -1  19  6  o 16 4.37272e+00 2.47221e-01 1.54638e+02 18.490  5.64507e-01  1.88767e-01  0.00000e+00 0.00000e+00 1.07868e+02 198.490 2.62506e+02 198.490 0.2852 
1 1 1 -1  19  7  o 1  1.06982e+01 2.60768e-01 2.02206e+02 297.789 1.20987e+00  -2.29581e+00 0.00000e+00 0.00000e+00 1.08620e+02 297.789 9.35866e+01 117.789 0.7750 
1 1 1 -1  19  8  o 3  3.10766e+01 5.44262e-01 5.24214e+02 193.304 -2.02569e+01 -4.79004e+00 0.00000e+00 0.00000e+00 6.11976e+02 193.304 8.77617e+01 193.304 0.9757 
1 1 1 -1  19  9  o 18 1.59230e+01 4.22981e-01 2.72212e+02 26.651  6.80806e+00  3.41687e+00  0.00000e+00 0.00000e+00 2.83482e+02 26.651  1.12697e+01 26.651  0.9318 
1 1 1 -1  19  10 o 2  2.70446e+01 4.95439e-01 5.46462e+02 199.795 -3.39737e+01 -1.22282e+01 0.00000e+00 0.00000e+00 4.51651e+02 199.795 9.48112e+01 19.795  0.9861 
1 1 1 -1  19  11 o 14 8.50160e+00 8.45298e-01 7.71107e+01 19.074  1.94275e+00  6.71755e-01  0.00000e+00 0.00000e+00 1.47607e+02 19.074  7.04967e+01 19.074  0.7067 
1 1 1 -1  19  12 o 16 9.48968e+00 5.25148e-01 2.97203e+02 30.362  1.07279e+01  6.28461e+00  0.00000e+00 0.00000e+00 4.28961e+01 30.362  2.54307e+02 210.362 0.9589 
1 1 1 -1  19  13 o 14 2.52877e+01 5.47349e-01 4.59110e+02 167.612 -6.96303e+01 1.52934e+01  0.00000e+00 0.00000e+00 4.78611e+02 167.612 1.95016e+01 167.612 0.9930 
1 1 1 -1  19  14 o 9  1.50004e+01 5.57530e-01 2.76301e+02 7.277   3.54611e+01  4.52848e+00  0.00000e+00 0.00000e+00 2.75517e+02 7.277   7.83605e-01 187.277 0.9859 
1 1 1 -1  19  15 o 6  8.41883e+00 7.69644e-01 7.59770e+01 67.578  2.47874e+00  6.00728e+00  0.00000e+00 0.00000e+00 2.12587e+02 67.578  1.36610e+02 67.578  0.9195 
1 1 1 -1  19  16 o 9  2.76473e+00 8.94817e-01 9.10531e+01 87.655  1.28884e-01  3.14775e+00  0.00000e+00 0.00000e+00 6.57099e+00 267.655 9.76240e+01 267.655 0.8205 
1 1 1 -1  19  17 o 9  3.95016e+00 1.14170e+00 1.11772e+02 176.964 -5.57536e+00 2.95705e-01  0.00000e+00 0.00000e+00 2.12743e+01 176.964 9.04975e+01 356.964 0.9054 
1 1 1 -1  19  18 o 5  2.84314e+00 9.30712e-01 7.31481e+01 337.386 3.11374e+00  -1.29702e+00 0.00000e+00 0.00000e+00 1.49872e+01 337.386 5.81610e+01 157.386 0.8342 
1 1 1 -1  19  19 o 4  1.13359e+01 1.07757e+00 2.26055e+02 67.459  1.69103e+01  4.07428e+01  0.00000e+00 0.00000e+00 1.89909e+02 67.459  3.61457e+01 247.459 0.9886 
1 1 1 -1  19  20 o 3  1.11188e+01 1.42681e+00 1.14297e+02 196.302 -1.91444e+01 -5.59890e+00 0.00000e+00 0.00000e+00 2.87427e+02 196.302 1.73130e+02 196.302 0.9746 
1 1 1 -1  20  1  o 1  3.06753e+01 4.32314e-01 7.43829e+02 315.595 7.55209e+00  -7.39694e+00 0.00000e+00 0.00000e+00 3.52207e+02 315.595 3.91622e+02 135.595 0.9515 
1 1 1 -1  20  2  o 18 2.15244e+01 3.72553e-01 7.45647e+02 52.246  4.55116e+00  5.87712e+00  0.00000e+00 0.00000e+00 6.04324e+00 52.246  7.39603e+02 232.246 0.9301 
1 1 1 -1  20  3  o 17 1.77208e+01 2.78531e-01 2.94561e+02 345.145 3.27619e+00  -8.68983e-01 0.00000e+00 0.00000e+00 2.61006e+02 345.145 3.35552e+01 165.145 0.8351 
1 1 1 -1  20  4  o 8  3.82378e+00 2.04259e-01 1.03293e+02 301.249 1.14411e-01  -1.88551e-01 0.00000e+00 0.00000e+00 8.75625e+01 121.249 1.90855e+02 121.249 0.1096 
1 1 1 -1  20  5  o 15 2.51217e+01 3.95322e-01 5.41840e+02 265.036 -1.02069e+00 -1.17508e+01 0.00000e+00 0.00000e+00 3.59830e+02 265.036 1.82011e+02 85.036  0.9566 
1 1 1 -1  20  6  o 2  1.72212e+01 3.06093e-01 3.68133e+02 334.606 5.49090e+00  -2.60660e+00 0.00000e+00 0.00000e+00 2.21925e+02 334.606 1.46208e+02 154.606 0.9136 
1 1 1 -1  20  7  o 2  1.57716e+01 3.12923e-01 4.25128e+02 203.744 -6.82180e+00 -3.00088e+00 0.00000e+00 0.00000e+00 1.24902e+02 203.744 3.00226e+02 23.744  0.9303 
1 1 1 -1  20  8  o 18 3.79502e+01 6.46278e-01 8.26962e+02 215.802 -3.22982e+01 -2.32956e+01 0.00000e+00 0.00000e+00 5.77078e+02 215.802 2.49883e+02 35.802  0.9874 
1 1 1 -1  20  9  o 4  1.02528e+01 4.14630e-01 2.60603e+02 230.764 -2.90115e+00 -3.55254e+00 0.00000e+00 0.00000e+00 7.83655e+01 230.764 1.82238e+02 50.764  0.8828 
1 1 1 -1  20  10 o 2  6.07167e+01 9.58719e-01 1.06497e+03 40.374  1.15123e+02  9.78874e+01  0.00000e+00 0.00000e+00 1.19989e+03 40.374  1.34921e+02 40.374  0.9967 
1 1 1 -1  20  11 o 8  1.82233e+01 4.41669e-01 2.31390e+02 94.665  -1.10661e+00 1.35624e+01  0.00000e+00 0.00000e+00 4.24633e+02 94.665  1.93243e+02 94.665  0.9625 
1 1 1 -1  20  12 o 9  1.26324e+01 4.98827e-01 2.57194e+02 164.517 -1.38086e+01 3.82499e+00  0.00000e+00 0.00000e+00 1.98130e+02 164.517 5.90640e+01 344.517 0.9644 
1 1 1 -1  20  13 o 15 2.11421e+01 5.17091e-01 3.11879e+02 237.969 -2.15134e+01 -3.43870e+01 0.00000e+00 0.00000e+00 4.67836e+02 237.969 1.55957e+02 237.969 0.9876 
1 1 1 -1  20  14 o 1  1.54147e+01 5.44303e-01 2.22451e+02 338.899 2.76130e+01  -1.06554e+01 0.00000e+00 0.00000e+00 3.42879e+02 338.899 1.20429e+02 338.899 0.9830 
1 1 1 -1  20  15 o 7  5.72850e+00 8.62224e-01 8.79628e+01 86.790  2.78397e-01  4.96374e+00  0.00000e+00 0.00000e+00 1.02665e+02 86.790  1.47018e+01 86.790  0.8927 
1 1 1 -1  20  16 o 16 6.58737e+00 9.81076e-01 2.10541e+02 313.303 1.15359e+01  -1.22404e+01 0.00000e+00 0.00000e+00 2.73596e+01 313.303 1.83182e+02 133.303 0.9698 
1 1 1 -1  20  17 o 3  4.17997e+00 1.15979e+00 9.67160e+01 216.939 -4.04235e+00 -3.03937e+00 0.00000e+00 0.00000e+00 4.24060e+01 216.939 5.43100e+01 36.939  0.8947 
1 1 1 -1  20  18 o 1  8.06041e+00 1.09561e+00 1.80355e+02 186.534 -2.12659e+01 -2.43557e+00 0.00000e+00 0.00000e+00 1.12079e+02 186.534 6.82756e+01 6.534   0.9764 
1 1 1 -1  20  19 o 12 4.02482e+00 1.22176e+00 3.49912e+01 119.317 -1.07261e+00 1.91002e+00  0.00000e+00 0.00000e+00 7.35679e+01 119.317 3.85766e+01 119.317 0.7267 
1 1 1 -1  20  20 o 17 4.05853e+00 1.29322e+00 5.00771e+01 297.630 1.55183e+00  -2.96456e+00 0.00000e+00 0.00000e+00 7.51935e+01 297.630 2.51165e+01 297.630 0.8326 
1 1 1 -1  21  1  o 11 3.23340e+01 4.54222e-01 5.68974e+02 201.018 -7.43515e+00 -2.85677e+00 0.00000e+00 0.00000e+00 5.66209e+02 201.018 2.76450e+00 21.018  0.9349 
1 1 1 -1  21  2  o 8  2.36826e+01 4.02232e-01 5.16024e+02 8.917   5.29594e+00  8.30978e-01  0.00000e+00 0.00000e+00 2.85248e+02 8.917   2.30776e+02 188.917 0.9011 
1 1 1 -1  21  3  o 9  1.15024e+01 2.18930e-01 1.11603e+02 100.599 -1.47496e-01 7.88227e-01  0.00000e+00 0.00000e+00 4.89514e+01 100.599 6.26515e+01 280.599 0.3718 
1 1 1 -1  21  4  o 4  1.66207e+01 2.71695e-01 4.70191e+02 189.194 -6.20535e+00 -1.00435e+00 0.00000e+00 0.00000e+00 1.01542e+02 189.194 3.68649e+02 9.194   0.9166 
1 1 1 -1  21  5  o 16 3.14628e+01 4.79096e-01 7.44401e+02 18.565  1.89007e+01  6.34795e+00  0.00000e+00 0.00000e+00 4.06014e+02 18.565  3.38387e+02 198.565 0.9746 
1 1 1 -1  21  6  o 10 1.11919e+01 2.50965e-01 3.15833e+02 161.338 -3.18047e+00 1.07419e+00  0.00000e+00 0.00000e+00 3.39189e+01 161.338 2.81914e+02 341.338 0.8333 
1 1 1 -1  21  7  o 10 2.26212e+01 3.93202e-01 5.23539e+02 156.193 -1.19566e+01 5.27525e+00  0.00000e+00 0.00000e+00 2.91341e+02 156.193 2.32198e+02 336.193 0.9609 
1 1 1 -1  21  8  o 12 3.95720e+01 6.23705e-01 6.30275e+02 192.240 -3.21272e+01 -6.96962e+00 0.00000e+00 0.00000e+00 8.29693e+02 192.240 1.99418e+02 192.240 0.9847 
1 1 1 -1  21  9  o 15 2.08835e+01 7.00621e-01 2.69268e+02 103.798 -2.27082e+00 9.24661e+00  0.00000e+00 0.00000e+00 4.70480e+02 103.798 2.01213e+02 103.798 0.9459 
1 1 1 -1  21  10 o 16 2.41171e+01 4.67003e-01 2.09749e+02 17.512  1.16086e+01  3.66291e+00  0.00000e+00 0.00000e+00 6.54906e+02 17.512  4.45157e+02 17.512  0.9580 
1 1 1 -1  21  11 o 14 1.18787e+01 4.42729e-01 2.05023e+02 257.601 -1.63121e+00 -7.41948e+00 0.00000e+00 0.00000e+00 2.08859e+02 257.601 3.83555e+00 257.601 0.9316 
1 1 1 -1  21  12 o 1  2.74564e+01 5.42064e-01 5.03173e+02 89.131  9.18945e-01  6.05817e+01  0.00000e+00 0.00000e+00 5.14393e+02 89.131  1.12204e+01 89.131  0.9917 
1 1 1 -1  21  13 o 17 1.03096e+01 8.02970e-01 2.51732e+02 301.990 8.27228e+00  -1.32434e+01 0.00000e+00 0.00000e+00 1.20697e+02 301.990 1.31035e+02 121.990 0.9674 
1 1 1 -1  21  14 o 19 4.64503e+00 8.82542e-01 1.09613e+02 141.870 -3.24898e+00 2.55023e+00  0.00000e+00 0.00000e+00 4.08714e+01 141.870 6.87419e+01 321.870 0.8684 
1 1 1 -1  21  15 o 4  1.82317e+01 5.81171e-01 3.66763e+02 351.656 7.46390e+01  -1.09474e+01 0.00000e+00 0.00000e+00 3.08283e+02 351.656 5.84805e+01 171.656 0.9933 
1 1 1 -1  21  16 o 10 3.40340e+00 9.43707e-01 7.36975e+01 112.935 -1.20409e+00 2.84559e+00  0.00000e+00 0.00000e+00 2.97691e+01 112.935 4.39284e+01 292.935 0.8164 
1 1 1 -1  21  17 o 11 1.20880e+01 8.38847e-01 2.07732e+02 196.060 -3.69715e+01 -1.06437e+01 0.00000e+00 0.00000e+00 2.36036e+02 196.060 2.83044e+01 196.060 0.9869 
1 1 1 -1  21  18 o 12 6.14548e+00 1.19122e+00 1.25852e+02 72.839  3.22845e+00  1.04549e+01  0.00000e+00 0.00000e+00 9.17963e+01 72.839  3.40557e+01 252.839 0.9531 
1 1 1 -1  21  19 o 5  8.15844e+00 1.27561e+00 1.49106e+02 305.862 1.06628e+01  -1.47507e+01 0.00000e+00 0.00000e+00 1.45242e+02 305.862 3.86402e+00 125.862 0.9721 
1 1 1 -1  21  20 o 4  3.58888e+00 1.17297e+00 4.92962e+01 107.394 -9.56598e-01 3.05363e+00  0.00000e+00 0.00000e+00 6.02880e+01 107.394 1.09918e+01 107.394 0.8237 
1 1 1 -1  22  1  o 8  3.32616e+01 4.67132e-01 3.91201e+02 153.847 -5.45725e+00 2.67979e+00  0.00000e+00 0.00000e+00 7.49804e+02 153.847 3.58603e+02 153.847 0.9136 
1 1 1 -1  22  2  o 13 2.97323e+01 4.86745e-01 5.81732e+02 301.638 4.51165e+00  -7.32264e+00 0.00000e+00 0.00000e+00 4.67482e+02 301.638 1.14250e+02 121.638 0.9399 
1 1 1 -1  22  3  o 7  2.12123e+01 3.21909e-01 3.30160e+02 98.507  -8.33306e-01 5.57100e+00  0.00000e+00 0.00000e+00 3.91433e+02 98.507  6.12727e+01 98.507  0.9063 
1 1 1 -1  22  4  o 12 3.60720e+00 2.28267e-01 1.31748e+02 304.069 2.08802e-01  -3.08756e-01 0.00000e+00 0.00000e+00 1.06948e+02 124.069 2.38696e+02 124.069 0.1832 
1 1 1 -1  22  5  o 15 1.04374e+01 2.38463e-01 3.18145e+01 335.231 2.34873e-01  -1.08374e-01 0.00000e+00 0.00000e+00 1.84094e+01 335.231 1.34051e+01 155.231 0.1283 
1 1 1 -1  22  6  f 0  1.74417e+01 3.42593e-01 2.54870e+02 202.586 -3.72410e+00 -1.54912e+00 0.00000e+00 0.00000e+00 3.10779e+02 202.586 5.59089e+01 202.586 0.8648 
1 1 1 -1  22  7  o 14 2.43889e+01 4.31665e-01 4.53924e+02 304.129 8.17679e+00  -1.20639e+01 0.00000e+00 0.00000e+00 4.28344e+02 304.129 2.55808e+01 124.129 0.9651 
1 1 1 -1  22  8  o 4  2.81212e+01 4.66992e-01 3.76014e+02 102.279 -2.96377e+00 1.36176e+01  0.00000e+00 0.00000e+00 6.39043e+02 102.279 2.63029e+02 102.279 0.9634 
1 1 1 -1  22  9  o 3  3.51371e+01 6.14507e-01 6.12588e+02 96.053  -3.84318e+00 3.62423e+01  0.00000e+00 0.00000e+00 6.84947e+02 96.053  7.23589e+01 96.053  0.9862 
1 1 1 -1  22  10 o 16 3.20208e+01 6.57959e-01 5.83121e+02 16.815  4.74668e+01  1.43444e+01  0.00000e+00 0.00000e+00 6.03015e+02 16.815  1.98942e+01 16.815  0.9899 
1 1 1 -1  22  11 o 1  1.58631e+01 4.34232e-01 3.11156e+02 116.616 -6.88533e+00 1.37400e+01  0.00000e+00 0.00000e+00 2.62432e+02 116.616 4.87238e+01 296.616 0.9669 
1 1 1 -1  22  12 o 5  2.90457e+01 5.60983e-01 5.62819e+02 344.598 7.22521e+01  -1.99039e+01 0.00000e+00 0.00000e+00 5.15313e+02 344.598 4.75056e+01 164.598 0.9933 
1 1 1 -1  22  13 o 11 1.03615e+01 5.43363e-01 2.02445e+02 144.909 -1.07278e+01 7.53718e+00  0.00000e+00 0.00000e+00 1.69380e+02 144.909 3.30647e+01 324.909 0.9611 
1 1 1 -1  22  14 o 10 6.14305e+00 8.07607e-01 1.14785e+02 199.662 -5.48296e+00 -1.95905e+00 0.00000e+00 0.00000e+00 9.36514e+01 199.662 2.11333e+01 19.662  0.9095 
1 1 1 -1  22  15 o 19 1.47137e+01 6.03521e-01 2.55464e+02 176.982 -4.20568e+01 2.21711e+00  0.00000e+00 0.00000e+00 2.86391e+02 176.982 3.09270e+01 176.982 0.9881 
1 1 1 -1  22  16 o 14 3.95087e+00 1.07177e+00 1.08944e+02 24.053  4.72025e+00  2.10679e+00  0.00000e+00 0.00000e+00 2.30374e+01 24.053  8.59070e+01 204.053 0.8972 
1 1 1 -1  22  17 o 12 7.95224e+00 1.00356e+00 2.02842e+02 211.788 -1.93184e+01 -1.19723e+01 0.00000e+00 0.00000e+00 8.63669e+01 211.788 1.16475e+02 31.788  0.9777 
1 1 1 -1  22  18 o 19 5.38701e+00 1.18871e+00 1.10327e+02 352.326 8.33925e+00  -1.12365e+00 0.00000e+00 0.00000e+00 7.75264e+01 352.326 3.28008e+01 172.326 0.9386 
1 1 1 -1  22  19 o 6  4.99599e+00 1.27054e+00 4.27710e+01 185.505 -3.31928e+00 -3.19927e-01 0.00000e+00 0.00000e+00 1.11484e+02 185.505 6.87128e+01 185.505 0.8320 
1 1 1 -1  22  20 o 9  4.69068e+00 1.39933e+00 1.41352e+02 65.465  4.38657e+00  9.60985e+00  0.00000e+00 0.00000e+00 2.40640e+01 65.465  1.17289e+02 245.465 0.9514 
1 1 1 -1  23  1  o 1  4.17366e+01 5.75151e-01 7.41612e+02 248.551 -4.97562e+00 -1.26644e+01 0.00000e+00 0.00000e+00 7.66723e+02 248.551 2.51112e+01 248.551 0.9625 
1 1 1 -1  23  2  o 2  2.64041e+01 4.46063e-01 4.71181e+02 356.801 8.26335e+00  -4.61895e-01 0.00000e+00 0.00000e+00 4.58101e+02 356.801 1.30806e+01 176.801 0.9375 
1 1 1 -1  23  3  o 16 2.49031e+01 3.66399e-01 3.73317e+02 310.319 4.66310e+00  -5.49491e+00 0.00000e+00 0.00000e+00 4.93893e+02 310.319 1.20577e+02 310.319 0.9278 
1 1 1 -1  23  4  o 18 1.05810e+01 2.20753e-01 1.50959e+02 224.686 -8.56665e-01 -8.47319e-01 0.00000e+00 0.00000e+00 5.32460e+01 224.686 9.77125e+01 44.686  0.5143 
1 1 1 -1  23  5  o 12 1.11008e+01 2.34364e-01 1.73403e+02 192.640 -1.44020e+00 -3.22985e-01 0.00000e+00 0.00000e+00 7.23447e+01 192.640 1.01058e+02 12.640  0.5901 
1 1 1 -1  23  6  o 12 1.14651e+01 3.35179e-01 2.67725e+02 277.389 3.54683e-01  -2.73516e+00 0.00000e+00 0.00000e+00 7.20800e+01 277.389 1.95645e+02 97.389  0.7904 
1 1 1 -1  23  7  o 17 2.25491e+01 3.80370e-01 4.33209e+02 145.192 -1.05026e+01 7.30151e+00  0.00000e+00 0.00000e+00 3.78246e+02 145.192 5.49629e+01 325.193 0.9601 
1 1 1 -1  23  8  o 18 3.82245e+01 6.07106e-01 7.74098e+02 160.985 -3.79003e+01 1.30615e+01  0.00000e+00 0.00000e+00 6.39960e+02 160.985 1.34138e+02 340.985 0.9874 
1 1 1 -1  23  9  o 16 1.61230e+01 4.13613e-01 2.32357e+02 64.278  2.79520e+00  5.80232e+00  0.00000e+00 0.00000e+00 3.22255e+02 64.278  8.98983e+01 64.278  0.9187 
1 1 1 -1  23  10 o 10 1.81604e+01 4.20660e-01 3.03154e+02 99.976  -2.55966e+00 1.45525e+01  0.00000e+00 0.00000e+00 3.52988e+02 99.976  4.98348e+01 99.976  0.9655 
1 1 1 -1  23  11 o 15 2.01171e+01 5.34718e-01 1.33544e+02 84.265  8.57814e-01  8.54100e+00  0.00000e+00 0.00000e+00 5.73436e+02 84.265  4.39892e+02 84.265  0.9398 
1 1 1 -1  23  12 o 8  1.09814e+01 5.36599e-01 1.67303e+02 184.265 -8.39745e+00 -6.26284e-01 0.00000e+00 0.00000e+00 2.17837e+02 184.265 5.05340e+01 184.265 0.9386 
1 1 1 -1  23  13 o 9  6.98339e+00 6.97782e-01 7.89406e+01 59.779  1.86090e+00  3.19471e+00  0.00000e+00 0.00000e+00 1.42885e+02 59.779  6.39448e+01 59.779  0.8508 
1 1 1 -1  23  14 o 11 7.71105e+00 6.92997e-01 1.28598e+02 28.659  7.76393e+00  4.24334e+00  0.00000e+00 0.00000e+00 1.42275e+02 28.659  1.36772e+01 28.659  0.9417 
1 1 1 -1  23  15 o 18 1.88282e+01 5.81459e-01 3.03350e+02 208.940 -5.27586e+01 -2.91728e+01 0.00000e+00 0.00000e+00 3.92524e+02 208.940 8.91738e+01 208.940 0.9917 
1 1 1 -1  23  16 f 0  4.41713e+00 9.25070e-01 6.89900e+01 83.723  4.27843e-01  3.88954e+00  0.00000e+00 0.00000e+00 7.24619e+01 83.723  3.47193e+00 83.723  0.8601 
1 1 1 -1  23  17 o 12 3.89037e+00 1.10288e+00 1.34805e+02 4.421   6.58213e+00  5.08940e-01  0.00000e+00 0.00000e+00 1.56798e+00 184.421 1.36373e+02 184.421 0.9208 
1 1 1 -1  23  18 o 6  5.18859e+00 1.20871e+00 8.06739e+01 53.510  3.28156e+00  4.43639e+00  0.00000e+00 0.00000e+00 9.36192e+01 53.510  1.29453e+01 53.510  0.9042 
1 1 1 -1  23  19 o 7  3.35506e+00 1.08520e+00 6.30684e+01 107.650 -1.14496e+00 3.59855e+00  0.00000e+00 0.00000e+00 4.32984e+01 107.650 1.97700e+01 287.650 0.8543 
1 1 1 -1  23  20 o 9  8.41156e+00 1.51530e+00 1.55811e+02 210.166 -1.64059e+01 -9.53527e+00 0.00000e+00 0.00000e+00 1.47620e+02 210.166 8.19093e+00 30.166  0.9733 
1 1 1 -1  24  1  o 18 2.22268e+01 3.37006e-01 2.21133e+02 334.568 2.20683e+00  -1.04939e+00 0.00000e+00 0.00000e+00 4.12012e+02 334.568 1.90879e+02 334.568 0.7587 
1 1 1 -1  24  2  o 10 1.68874e+01 3.17107e-01 7.99411e+01 274.724 7.06678e-02  -8.55149e-01 0.00000e+00 0.00000e+00 1.69735e+02 274.724 8.97937e+01 274.724 0.3938 
1 1 1 -1  24  3  o 3  1.65127e+01 2.74258e-01 3.21859e+02 174.079 -3.03610e+00 3.14891e-01  0.00000e+00 0.00000e+00 1.82487e+02 174.079 1.39371e+02 354.079 0.8138 
1 1 1 -1  24  4  o 11 2.43147e+01 3.63000e-01 5.90895e+02 201.000 -9.86718e+00 -3.78758e+00 0.00000e+00 0.00000e+00 2.77156e+02 201.000 3.13739e+02 21.000  0.9514 
1 1 1 -1  24  5  o 13 3.20575e+00 2.85708e-01 9.39932e+01 340.254 2.43758e-01  -8.75012e-02 0.00000e+00 0.00000e+00 7.85507e+01 160.254 1.72544e+02 160.254 0.1284 
1 1 1 -1  24  6  o 7  3.08412e+01 4.78119e-01 6.38666e+02 203.689 -1.91422e+01 -8.39856e+00 0.00000e+00 0.00000e+00 4.89763e+02 203.689 1.48903e+02 23.689  0.9758 
1 1 1 -1  24  7  o 1  2.75661e+01 4.81621e-01 5.80536e+02 124.250 -1.07092e+01 1.57288e+01  0.00000e+00 0.00000e+00 4.25118e+02 124.250 1.55418e+02 304.250 0.9734 
1 1 1 -1  24  8  o 17 3.81467e+01 6.09091e-01 5.25983e+02 57.877  1.43954e+01  2.29274e+01  0.00000e+00 0.00000e+00 8.76401e+02 57.877  3.50418e+02 57.877  0.9814 
1 1 1 -1  24  9  o 18 2.22256e+01 4.55197e-01 4.00384e+02 55.557  1.05848e+01  1.54339e+01  0.00000e+00 0.00000e+00 4.09206e+02 55.557  8.82173e+00 55.557  0.9729 
1 1 1 -1  24  10 o 7  1.55668e+01 4.13891e-01 2.95831e+02 105.829 -3.29551e+00 1.16238e+01  0.00000e+00 0.00000e+00 2.61985e+02 105.829 3.38464e+01 285.829 0.9577 
1 1 1 -1  24  11 o 4  2.55302e+01 5.79784e-01 4.57975e+02 316.450 2.69191e+01  -2.55899e+01 0.00000e+00 0.00000e+00 4.83703e+02 316.450 2.57285e+01 316.450 0.9864 
1 1 1 -1  24  12 o 8  1.20392e+01 4.81474e-01 2.88842e+02 55.282  9.64349e+00  1.39178e+01  0.00000e+00 0.00000e+00 1.47498e+02 55.282  1.41344e+02 235.282 0.9700 
1 1 1 -1  24  13 o 16 9.32897e+00 5.87459e-01 1.99251e+02 256.122 -3.03749e+00 -1.22945e+01 0.00000e+00 0.00000e+00 1.34988e+02 256.122 6.42628e+01 76.122  0.9597 
1 1 1 -1  24  14 o 3  2.59964e+00 7.86888e-01 5.96480e+01 11.592  1.32207e+00  2.71194e-01  0.00000e+00 0.00000e+00 5.66491e+00 191.592 6.53129e+01 191.592 0.5567 
1 1 1 -1  24  15 o 15 5.14326e+00 1.02056e+00 7.31705e+01 350.630 3.43767e+00  -5.67266e-01 0.00000e+00 0.00000e+00 8.78880e+01 350.630 1.47174e+01 350.630 0.8403 
1 1 1 -1  24  16 o 17 9.71891e+00 7.55681e-01 1.81404e+02 1.084   2.30707e+01  4.36612e-01  0.00000e+00 0.00000e+00 1.72504e+02 1.084   8.89993e+00 181.084 0.9781 
1 1 1 -1  24  17 o 1  8.11714e+00 1.04998e+00 1.46892e+02 144.089 -1.24769e+01 9.03549e+00  0.00000e+00 0.00000e+00 1.45026e+02 144.089 1.86586e+00 324.089 0.9670 
1 1 1 -1  24  18 o 16 5.38952e+00 1.17284e+00 9.52701e+01 291.541 2.53546e+00  -6.42313e+00 0.00000e+00 0.00000e+00 8.98260e+01 291.541 5.44408e+00 111.541 0.9245 
1 1 1 -1  24  19 o 4  3.62783e+00 1.13345e+00 8.43554e+01 62.848  2.30677e+00  4.49782e+00  0.00000e+00 0.00000e+00 3.60777e+01 62.848  4.82777e+01 242.848 0.8946 
1 1 1 -1  24  20 o 9  5.88450e+00 1.49722e+00 7.41016e+01 298.671 3.05491e+00  -5.58651e+00 0.00000e+00 0.00000e+00 1.26037e+02 298.671 5.19356e+01 298.671 0.9177 
1 1 1 -1  25  1  o 12 1.37519e+01 2.50330e-01 2.51994e+02 17.261  2.19336e+00  6.81530e-01  0.00000e+00 0.00000e+00 1.30543e+02 17.261  1.21450e+02 197.261 0.7410 
1 1 1 -1  25  2  o 14 1.59665e+01 2.70073e-01 5.20540e+02 302.572 3.64152e+00  -5.70016e+00 0.00000e+00 0.00000e+00 3.25211e+01 302.572 4.88019e+02 122.572 0.9228 
1 1 1 -1  25  3  o 18 1.14550e+01 2.30498e-01 5.37480e+02 286.416 9.66843e-01  -3.28162e+00 0.00000e+00 0.00000e+00 1.77708e+02 106.416 7.15188e+02 106.416 0.8369 
1 1 1 -1  25  4  o 13 9.39287e+00 2.20476e-01 1.38347e+02 1.827   9.79053e-01  3.12272e-02  0.00000e+00 0.00000e+00 1.63992e+01 1.827   1.21948e+02 181.827 0.4391 
1 1 1 -1  25  5  f 0  1.31679e+01 2.53591e-01 8.47364e+01 330.071 8.19052e-01  -4.71525e-01 0.00000e+00 0.00000e+00 1.25958e+02 330.071 4.12214e+01 330.071 0.4266 
1 1 1 -1  25  6  o 15 1.49222e+01 2.94568e-01 3.24358e+02 155.174 -4.63145e+00 2.14255e+00  0.00000e+00 0.00000e+00 1.76790e+02 155.174 1.47568e+02 335.174 0.8957 
1 1 1 -1  25  7  o 7  3.20346e+01 4.99936e-01 5.65585e+02 207.087 -1.90465e+01 -9.74117e+00 0.00000e+00 0.00000e+00 6.06588e+02 207.087 4.10034e+01 207.087 0.9763 
1 1 1 -1  25  8  o 7  3.51660e+01 5.64403e-01 5.76710e+02 277.440 4.16268e+00  -3.18759e+01 0.00000e+00 0.00000e+00 7.19914e+02 277.440 1.43204e+02 277.440 0.9843 
1 1 1 -1  25  9  o 8  3.82829e+01 6.09614e-01 6.56711e+02 206.783 -4.67394e+01 -2.35923e+01 0.00000e+00 0.00000e+00 7.62766e+02 206.783 1.06056e+02 206.783 0.9904 
1 1 1 -1  25  10 o 4  1.16593e+01 5.32438e-01 2.89531e+02 302.804 4.76380e+00  -7.39082e+00 0.00000e+00 0.00000e+00 1.21086e+02 302.804 1.68446e+02 122.804 0.9413 
1 1 1 -1  25  11 o 9  2.45166e+01 5.14510e-01 3.91230e+02 2.676   3.15664e+01  1.47535e+00  0.00000e+00 0.00000e+00 5.10803e+02 2.676   1.19574e+02 2.676   0.9840 
1 1 1 -1  25  12 o 11 2.73675e+01 5.66290e-01 3.75111e+02 110.993 -1.73617e+01 4.52449e+01  0.00000e+00 0.00000e+00 6.36772e+02 110.993 2.61660e+02 110.993 0.9896 
1 1 1 -1  25  13 o 8  1.26113e+01 5.13482e-01 1.63749e+02 143.582 -1.18365e+01 8.73241e+00  0.00000e+00 0.00000e+00 2.90751e+02 143.582 1.27002e+02 143.582 0.9654 
1 1 1 -1  25  14 o 6  5.41281e+00 8.20993e-01 8.15222e+01 305.595 2.21454e+00  -3.09385e+00 0.00000e+00 0.00000e+00 9.12113e+01 305.595 9.68909e+00 305.595 0.8556 
1 1 1 -1  25  15 o 5  6.71364e+00 8.75778e-01 7.55816e+01 91.354  -1.25866e-01 5.32415e+00  0.00000e+00 0.00000e+00 1.49687e+02 91.354  7.41056e+01 91.354  0.9004 
1 1 1 -1  25  16 o 10 5.69861e+00 9.16959e-01 1.12138e+02 58.380  4.10939e+00  6.67449e+00  0.00000e+00 0.00000e+00 8.59728e+01 58.380  2.61655e+01 238.380 0.9338 
1 1 1 -1  25  17 o 4  4.23592e+00 1.12527e+00 1.24991e+02 342.385 6.93140e+00  -2.20074e+00 0.00000e+00 0.00000e+00 2.12676e+01 342.385 1.03723e+02 162.385 0.9285 
1 1 1 -1  25  18 o 19 5.47950e+00 1.35170e+00 9.71722e+01 196.126 -6.61420e+00 -1.91232e+00 0.00000e+00 0.00000e+00 9.09536e+01 196.126 6.21867e+00 16.126  0.9242 
1 1 1 -1  25  19 o 17 8.07950e+00 1.25963e+00 1.88210e+02 63.941  1.00405e+01  2.05327e+01  0.00000e+00 0.00000e+00 1.04939e+02 63.941  8.32710e+01 243.941 0.9779 
1 1 1 -1  25  20 o 12 4.79683e+00 1.36877e+00 4.87854e+01 198.098 -3.60443e+00 -1.17797e+00 0.00000e+00 0.00000e+00 1.03205e+02 198.098 5.44198e+01 198.098 0.8550 
1 1 1 -1  26  1  o 4  1.67895e+00 3.11906e-01 1.95637e+02 313.324 1.42015e-01  -1.50577e-01 0.00000e+00 0.00000e+00 1.89149e+02 133.324 3.84786e+02 133.324 0.1029 
1 1 1 -1  26  2  o 13 1.93702e+01 3.07588e-01 6.20877e+02 37.741  7.41862e+00  5.74225e+00  0.00000e+00 0.00000e+00 6.62484e+01 37.741  5.54628e+02 217.741 0.9451 
1 1 1 -1  26  3  o 17 2.73596e+01 4.01043e-01 7.57055e+02 128.153 -1.01713e+01 1.29472e+01  0.00000e+00 0.00000e+00 2.37978e+02 128.153 5.19077e+02 308.153 0.9691 
1 1 1 -1  26  4  o 19 7.03262e+00 2.16186e-01 1.33682e+02 140.019 -6.26668e-01 5.25476e-01  0.00000e+00 0.00000e+00 3.39107e+01 320.019 1.67593e+02 320.019 0.3781 
1 1 1 -1  26  5  o 15 4.88103e+00 2.43322e-01 1.73876e+02 225.122 -5.31315e-01 -5.33586e-01 0.00000e+00 0.00000e+00 1.09416e+02 45.122  2.83291e+02 45.122  0.3521 
1 1 1 -1  26  6  o 1  1.95838e+01 3.46607e-01 2.43115e+02 177.139 -4.95288e+00 2.47556e-01  0.00000e+00 0.00000e+00 4.12124e+02 177.139 1.69009e+02 177.139 0.8924 
1 1 1 -1  26  7  o 1  4.37171e+01 6.55792e-01 9.36596e+02 314.933 3.53426e+01  -3.54254e+01 0.00000e+00 0.00000e+00 6.85244e+02 314.933 2.51352e+02 134.933 0.9900 
1 1 1 -1  26  8  o 15 2.63136e+01 5.41631e-01 4.93524e+02 216.742 -1.64198e+01 -1.22578e+01 0.00000e+00 0.00000e+00 4.67724e+02 216.742 2.58006e+01 36.742  0.9753 
1 1 1 -1  26  9  o 10 2.97749e+01 5.00581e-01 6.11211e+02 259.735 -6.77396e+00 -3.74054e+01 0.00000e+00 0.00000e+00 4.88661e+02 259.735 1.22549e+02 79.735  0.9868 
1 1 1 -1  26  10 o 2  2.86776e+01 5.11244e-01 4.05553e+02 132.440 -2.15270e+01 2.35420e+01  0.00000e+00 0.00000e+00 6.50382e+02 132.440 2.44829e+02 132.440 0.9842 
1 1 1 -1  26  11 o 14 2.81274e+01 5.19876e-01 3.95607e+02 120.150 -1.99054e+01 3.42690e+01  0.00000e+00 0.00000e+00 6.42626e+02 120.150 2.47019e+02 120.150 0.9873 
1 1 1 -1  26  12 o 7  1.43039e+01 5.64407e-01 3.65751e+02 26.783  2.19868e+01  1.10982e+01  0.00000e+00 0.00000e+00 1.57661e+02 26.783  2.08090e+02 206.783 0.9795 
1 1 1 -1  26  13 o 2  1.33678e+01 5.99040e-01 1.76410e+02 117.392 -8.05619e+00 1.55475e+01  0.00000e+00 0.00000e+00 3.08128e+02 117.392 1.31719e+02 117.392 0.9710 
1 1 1 -1  26  14 o 3  5.96791e+00 7.81106e-01 9.29773e+01 159.899 -4.53788e+00 1.66070e+00  0.00000e+00 0.00000e+00 1.04974e+02 159.899 1.19966e+01 159.899 0.8893 
1 1 1 -1  26  15 o 6  1.06141e+01 6.83545e-01 1.84642e+02 264.311 -2.16268e+00 -2.17082e+01 0.00000e+00 0.00000e+00 2.01687e+02 264.311 1.70451e+01 264.311 0.9768 
1 1 1 -1  26  16 o 18 4.47979e+00 1.02215e+00 7.01709e+01 121.980 -2.01322e+00 3.22430e+00  0.00000e+00 0.00000e+00 7.24795e+01 121.980 2.30863e+00 121.980 0.8554 
1 1 1 -1  26  17 o 12 3.64053e+00 1.04428e+00 6.17759e+01 301.281 1.67775e+00  -2.76144e+00 0.00000e+00 0.00000e+00 5.00082e+01 301.281 1.17677e+01 121.281 0.8257 
1 1 1 -1  26  18 o 1  7.27859e+00 1.12898e+00 1.35799e+02 101.438 -2.91915e+00 1.44282e+01  0.00000e+00 0.00000e+00 1.25213e+02 101.438 1.05859e+01 281.438 0.9654 
1 1 1 -1  26  19 o 19 4.95639e+00 1.26803e+00 1.20073e+02 42.062  6.59526e+00  5.95131e+00  0.00000e+00 0.00000e+00 5.31341e+01 42.062  6.69390e+01 222.062 0.9419 
1 1 1 -1  26  20 o 2  4.14891e+00 1.21501e+00 1.20505e+02 201.930 -8.71262e+00 -3.50768e+00 0.00000e+00 0.00000e+00 2.48055e+01 201.930 9.56993e+01 21.930  0.9452 
1 1 1 -1  27  1  o 14 1.60760e+01 2.75926e-01 2.32432e+02 91.245  -6.53555e-02 3.00607e+00  0.00000e+00 0.00000e+00 2.56643e+02 91.245  2.42117e+01 91.245  0.8105 
1 1 1 -1  27  2  o 8  2.48302e+01 3.71574e-01 3.92551e+02 163.735 -5.37505e+00 1.56823e+00  0.00000e+00 0.00000e+00 4.51428e+02 163.735 5.88762e+01 163.735 0.9056 
1 1 1 -1  27  3  o 13 1.05601e+01 2.31242e-01 3.07437e+02 177.828 -2.47046e+00 9.37001e-02  0.00000e+00 0.00000e+00 5.51118e+00 357.828 3.12948e+02 357.828 0.7619 
1 1 1 -1  27  4  o 17 1.90048e+01 3.08689e-01 4.19761e+02 178.149 -6.78383e+00 2.19177e-01  0.00000e+00 0.00000e+00 2.38353e+02 178.149 1.81408e+02 358.149 0.9231 
1 1 1 -1  27  5  o 12 1.14366e+01 2.91940e-01 1.99691e+02 96.690  -2.56106e-01 2.18351e+00  0.00000e+00 0.00000e+00 1.12472e+02 96.690  8.72192e+01 276.690 0.7278 
1 1 1 -1  27  6  o 1  3.78100e+01 5.73303e-01 4.89426e+02 304.894 1.27090e+01  -1.82220e+01 0.00000e+00 0.00000e+00 8.95741e+02 304.894 4.06315e+02 304.894 0.9772 
1 1 1 -1  27  7  o 19 9.60669e+00 2.84248e-01 1.63300e+02 184.151 -1.91625e+00 -1.39089e-01 0.00000e+00 0.00000e+00 8.30789e+01 184.151 8.02209e+01 4.151   0.6844 
1 1 1 -1  27  8  o 14 4.10900e+01 6.45653e-01 7.52520e+02 134.283 -3.31458e+01 3.39864e+01  0.00000e+00 0.00000e+00 7.70151e+02 134.283 1.76308e+01 134.283 0.9894 
1 1 1 -1  27  9  o 1  2.84266e+01 5.33744e-01 5.09305e+02 174.439 -2.99619e+01 2.91714e+00  0.00000e+00 0.00000e+00 5.36949e+02 174.439 2.76437e+01 174.439 0.9832 
1 1 1 -1  27  10 o 4  8.56411e+00 5.13188e-01 1.32512e+02 277.929 4.28381e-01  -3.07583e+00 0.00000e+00 0.00000e+00 1.29395e+02 277.929 3.11685e+00 97.929  0.8175 
1 1 1 -1  27  11 o 17 1.51712e+01 5.44485e-01 2.92457e+02 304.729 8.95915e+00  -1.29248e+01 0.00000e+00 0.00000e+00 2.56363e+02 304.729 3.60934e+01 124.729 0.9677 
1 1 1 -1  27  12 o 16 6.38952e+00 6.89657e-01 1.46228e+02 177.944 -4.65392e+00 1.67054e-01  0.00000e+00 0.00000e+00 6.49552e+01 177.944 8.12725e+01 357.944 0.8848 
1 1 1 -1  27  13 o 13 1.01418e+01 6.55399e-01 1.49772e+02 85.583  8.58145e-01  1.11101e+01  0.00000e+00 0.00000e+00 2.11375e+02 85.583  6.16029e+01 85.583  0.9540 
1 1 1 -1  27  14 o 15 4.32491e+00 8.77054e-01 3.53084e+01 31.926  1.09870e+00  6.84566e-01  0.00000e+00 0.00000e+00 5.19644e+01 31.926  1.66560e+01 31.926  0.5411 
1 1 1 -1  27  15 o 16 1.06499e+01 6.25614e-01 2.27938e+02 153.048 -2.57059e+01 1.30710e+01  0.00000e+00 0.00000e+00 1.61927e+02 153.048 6.60110e+01 333.047 0.9825 
1 1 1 -1  27  16 o 7  9.51067e+00 7.45698e-01 1.29995e+02 291.855 6.61755e+00  -1.64991e+01 0.00000e+00 0.00000e+00 2.13910e+02 291.855 8.39142e+01 291.855 0.9715 
1 1 1 -1  27  17 o 16 4.43164e+00 1.14096e+00 9.40975e+01 56.709  2.91531e+00  4.43961e+00  0.00000e+00 0.00000e+00 5.42298e+01 56.709  3.98677e+01 236.709 0.9001 
1 1 1 -1  27  18 o 10 4.25652e+00 1.20511e+00 1.67910e+02 140.006 -7.68110e+00 6.44385e+00  0.00000e+00 0.00000e+00 1.79184e+01 320.006 1.85829e+02 320.006 0.9487 
1 1 1 -1  27  19 o 1  1.33626e+01 8.90773e-01 2.17700e+02 307.525 3.67610e+01  -4.78652e+01 0.00000e+00 0.00000e+00 2.73911e+02 307.525 5.62103e+01 307.525 0.9917 
1 1 1 -1  27  20 o 13 4.06040e+00 1.26212e+00 8.20777e+01 264.009 -6.27337e-01 -5.97753e+00 0.00000e+00 0.00000e+00 5.52113e+01 264.009 2.68665e+01 84.009  0.9125 
1 1 1 -1  28  1  o 9  9.41504e+00 2.26904e-01 1.85907e+02 22.931  1.24159e+00  5.25264e-01  0.00000e+00 0.00000e+00 1.06728e+01 22.931  1.75234e+02 202.931 0.5563 
1 1 1 -1  28  2  o 13 2.03863e+01 3.23180e-01 3.12941e+02 11.208  5.12429e+00  1.01537e+00  0.00000e+00 0.00000e+00 3.74343e+02 11.208  6.14020e+01 11.208  0.8983 
1 1 1 -1  28  3  o 10 6.04359e+00 2.24009e-01 3.27699e+02 353.155 1.45507e+00  -1.74668e-01 0.00000e+00 0.00000e+00 1.94477e+02 173.155 5.22175e+02 173.155 0.5875 
1 1 1 -1  28  4  o 2  4.12409e+01 5.76533e-01 6.24688e+02 162.772 -1.89622e+01 5.87998e+00  0.00000e+00 0.00000e+00 8.82851e+02 162.772 2.58163e+02 162.772 0.9745 
1 1 1 -1  28  5  o 19 1.88391e+01 3.13428e-01 3.64216e+02 308.960 4.09597e+00  -5.06539e+00 0.00000e+00 0.00000e+00 2.85500e+02 308.960 7.87154e+01 128.960 0.9197 
1 1 1 -1  28  6  o 1  1.42542e+01 2.94763e-01 2.05656e+02 243.368 -1.57174e+00 -3.13427e+00 0.00000e+00 0.00000e+00 2.43947e+02 243.368 3.82916e+01 243.368 0.8414 
1 1 1 -1  28  7  o 12 2.33698e+01 3.99310e-01 5.98684e+02 227.860 -1.22123e+01 -1.34966e+01 0.00000e+00 0.00000e+00 2.52562e+02 227.860 3.46122e+02 47.860  0.9721 
1 1 1 -1  28  8  o 10 2.21759e+01 4.13975e-01 3.14060e+02 157.962 -1.22429e+01 4.95579e+00  0.00000e+00 0.00000e+00 4.84357e+02 157.962 1.70297e+02 157.962 0.9614 
1 1 1 -1  28  9  o 13 2.72714e+00 6.05015e-01 4.34124e+01 268.145 -8.28038e-03 -2.55607e-01 0.00000e+00 0.00000e+00 3.04655e+01 88.145  7.38779e+01 88.145  0.1268 
1 1 1 -1  28  10 o 9  9.50012e+00 4.16086e-01 2.36710e+02 320.077 4.85133e+00  -4.05964e+00 0.00000e+00 0.00000e+00 8.92117e+01 320.077 1.47498e+02 140.077 0.9171 
1 1 1 -1  28  11 o 14 7.65727e+00 6.12392e-01 1.66228e+02 153.027 -3.89032e+00 1.97993e+00  0.00000e+00 0.00000e+00 8.45809e+01 153.027 8.16470e+01 333.027 0.8762 
1 1 1 -1  28  12 o 10 2.32709e+01 4.84431e-01 3.69806e+02 268.027 -1.62342e+00 -4.71263e+01 0.00000e+00 0.00000e+00 4.90170e+02 268.027 1.20364e+02 268.027 0.9893 
1 1 1 -1  28  13 o 2  1.65803e+01 5.07752e-01 2.67218e+02 348.357 3.27915e+01  -6.75649e+00 0.00000e+00 0.00000e+00 3.42299e+02 348.357 7.50812e+01 348.357 0.9850 
1 1 1 -1  28  14 o 16 6.51610e+00 7.10372e-01 7.69260e+01 9.430   4.61651e+00  7.66781e-01  0.00000e+00 0.00000e+00 1.38215e+02 9.430   6.12890e+01 9.430   0.8854 
1 1 1 -1  28  15 o 11 2.20724e+01 6.71685e-01 3.84888e+02 104.896 -2.70340e+01 1.01626e+02  0.00000e+00 0.00000e+00 4.33530e+02 104.896 4.86424e+01 104.896 0.9952 
1 1 1 -1  28  16 o 16 3.82048e+00 1.00227e+00 5.24882e+01 287.659 7.80178e-01  -2.45070e+00 0.00000e+00 0.00000e+00 5.73724e+01 287.659 4.88419e+00 287.659 0.7726 
1 1 1 -1  28  17 o 19 5.21766e+00 1.14153e+00 7.30461e+01 178.179 -5.27148e+00 1.67634e-01  0.00000e+00 0.00000e+00 1.01429e+02 178.179 2.83830e+01 178.179 0.8994 
1 1 1 -1  28  18 f 0  1.08092e+01 9.35895e-01 1.58611e+02 353.445 2.96148e+01  -3.40279e+00 0.00000e+00 0.00000e+00 2.36043e+02 353.445 7.74316e+01 353.445 0.9831 
1 1 1 -1  28  19 o 17 3.84945e+00 1.10712e+00 1.52578e+01 64.923  4.39303e-01  9.38778e-01  0.00000e+00 0.00000e+00 5.03108e+01 64.923  3.50530e+01 64.923  0.4592 
1 1 1 -1  28  20 o 1  3.90366e+00 1.18859e+00 2.51684e+01 136.373 -1.32583e+00 1.26377e+00  0.00000e+00 0.00000e+00 7.14596e+01 136.373 4.62912e+01 136.373 0.6681 
1 1 1 -1  29  1  o 17 4.88971e+00 2.32629e-01 6.14571e+01 248.429 -6.25925e-02 -1.58323e-01 0.00000e+00 0.00000e+00 4.58922e+01 68.429  1.07349e+02 68.429  0.0848 
1 1 1 -1  29  2  o 15 9.14361e+00 2.41177e-01 2.36368e+02 250.036 -5.83743e-01 -1.60693e+00 0.00000e+00 0.00000e+00 1.54489e+01 70.036  2.51817e+02 70.036  0.6439 
1 1 1 -1  29  3  o 15 2.42881e+01 3.70263e-01 4.42953e+02 123.042 -4.41961e+00 6.79477e+00  0.00000e+00 0.00000e+00 4.10080e+02 123.042 3.28737e+01 303.042 0.9361 
1 1 1 -1  29  4  o 17 1.69738e+01 2.92440e-01 3.48910e+02 186.841 -5.07972e+00 -6.09428e-01 0.00000e+00 0.00000e+00 2.21548e+02 186.841 1.27363e+02 6.841   0.8960 
1 1 1 -1  29  5  o 5  1.10029e+01 2.50149e-01 2.16902e+02 282.689 4.74730e-01  -2.10847e+00 0.00000e+00 0.00000e+00 8.12069e+01 282.689 1.35695e+02 102.689 0.7226 
1 1 1 -1  29  6  o 12 1.96025e+01 3.49302e-01 5.83976e+02 168.866 -1.24157e+01 2.44354e+00  0.00000e+00 0.00000e+00 1.21125e+02 168.866 4.62851e+02 348.866 0.9596 
1 1 1 -1  29  7  o 7  4.48386e+01 6.73572e-01 8.91723e+02 218.804 -3.96231e+01 -3.18624e+01 0.00000e+00 0.00000e+00 7.71618e+02 218.804 1.20106e+02 38.804  0.9901 
1 1 1 -1  29  8  o 18 3.87097e+01 6.15883e-01 6.63389e+02 127.855 -2.95172e+01 3.79778e+01  0.00000e+00 0.00000e+00 7.71055e+02 127.855 1.07666e+02 127.855 0.9895 
1 1 1 -1  29  9  o 8  3.30979e+01 5.50247e-01 4.58182e+02 114.981 -1.41861e+01 3.04486e+01  0.00000e+00 0.00000e+00 7.61988e+02 114.981 3.03805e+02 114.981 0.9850 
1 1 1 -1  29  10 o 15 8.81679e+00 5.18090e-01 1.36867e+02 235.291 -2.07572e+00 -2.99670e+00 0.00000e+00 0.00000e+00 1.42902e+02 235.291 6.03584e+00 235.291 0.8484 
1 1 1 -1  29  11 o 3  2.03056e+01 4.48208e-01 4.26287e+02 299.447 1.67730e+01  -2.97099e+01 0.00000e+00 0.00000e+00 3.21490e+02 299.447 1.04797e+02 119.447 0.9852 
1 1 1 -1  29  12 o 10 1.65264e+01 4.57718e-01 1.80032e+02 128.995 -1.02558e+01 1.26669e+01  0.00000e+00 0.00000e+00 4.17987e+02 128.995 2.37955e+02 128.995 0.9688 
1 1 1 -1  29  13 o 16 3.48413e+00 7.91008e-01 8.31101e+01 252.471 -6.14953e-01 -1.94695e+00 0.00000e+00 0.00000e+00 8.49716e+00 252.471 7.46130e+01 72.471  0.7045 
1 1 1 -1  29  14 o 14 4.68482e+00 8.50180e-01 1.84040e+02 50.207  5.01869e+00  6.02519e+00  0.00000e+00 0.00000e+00 2.09045e+01 230.207 2.04945e+02 230.207 0.9339 
1 1 1 -1  29  15 o 1  4.19672e+00 9.63646e-01 8.79126e+01 287.126 1.21006e+00  -3.92700e+00 0.00000e+00 0.00000e+00 4.77293e+01 287.126 4.01833e+01 107.126 0.8676 
1 1 1 -1  29  16 o 14 7.85707e+00 7.68287e-01 1.65521e+02 177.436 -1.80574e+01 8.08619e-01  0.00000e+00 0.00000e+00 1.18686e+02 177.436 4.68348e+01 357.436 0.9719 
1 1 1 -1  29  17 o 5  7.62690e+00 9.87290e-01 1.45577e+02 13.125  1.63243e+01  3.80634e+00  0.00000e+00 0.00000e+00 1.29381e+02 13.125  1.61956e+01 193.125 0.9697 
1 1 1 -1  29  18 o 13 4.93097e+00 1.19001e+00 3.16639e+01 294.636 9.62572e-01  -2.09893e+00 0.00000e+00 0.00000e+00 1.04309e+02 294.636 7.26451e+01 294.636 0.7425 
1 1 1 -1  29  19 o 17 3.98854e+00 1.16736e+00 8.89102e+01 160.310 -5.63325e+00 2.01593e+00  0.00000e+00 0.00000e+00 4.60318e+01 160.310 4.28784e+01 340.309 0.9121 
1 1 1 -1  29  20 o 10 9.58460e+00 1.24817e+00 8.70169e+01 313.118 1.02983e+01  -1.09980e+01 0.00000e+00 0.00000e+00 2.56074e+02 313.118 1.69057e+02 313.118 0.9662 
1 1 1 -1  30  1  o 16 2.32880e+01 3.59140e-01 3.61956e+02 322.768 5.40635e+00  -4.10837e+00 0.00000e+00 0.00000e+00 4.44789e+02 322.768 8.28330e+01 322.768 0.9231 
1 1 1 -1  30  2  o 2  8.15333e+00 2.26184e-01 1.95019e+02 9.966   1.18187e+00  2.07672e-01  0.00000e+00 0.00000e+00 3.81440e+01 189.966 2.33163e+02 189.966 0.5128 
1 1 1 -1  30  3  o 16 1.14115e+01 2.46427e-01 1.62341e+02 80.724  2.59019e-01  1.58587e+00  0.00000e+00 0.00000e+00 1.03712e+02 80.724  5.86295e+01 260.724 0.6215 
1 1 1 -1  30  4  o 3  2.42364e+01 3.71531e-01 4.30057e+02 328.239 7.51071e+00  -4.64978e+00 0.00000e+00 0.00000e+00 4.25835e+02 328.239 4.22193e+00 148.239 0.9416 
1 1 1 -1  30  5  o 18 1.41777e+01 3.12456e-01 1.19039e+02 180.772 -1.80289e+00 -2.42997e-02 0.00000e+00 0.00000e+00 2.33201e+02 180.772 1.14162e+02 180.772 0.6626 
1 1 1 -1  30  6  o 15 3.34946e+01 5.19891e-01 5.87347e+02 250.969 -8.41661e+00 -2.44014e+01 0.00000e+00 0.00000e+00 6.43462e+02 250.969 5.61149e+01 250.969 0.9804 
1 1 1 -1  30  7  f 0  1.58852e+01 3.28023e-01 4.71011e+02 105.507 -2.65812e+00 9.58055e+00  0.00000e+00 0.00000e+00 9.33302e+01 105.507 3.77680e+02 285.507 0.9483 
1 1 1 -1  30  8  o 5  3.87666e+01 6.19537e-01 6.61995e+02 338.500 4.16608e+01  -1.64109e+01 0.00000e+00 0.00000e+00 7.73307e+02 338.500 1.11313e+02 338.500 0.9888 
1 1 1 -1  30  9  f 0  8.50409e+00 3.92661e-01 2.05687e+02 331.008 3.39902e+00  -1.88346e+00 0.00000e+00 0.00000e+00 6.76915e+01 331.008 1.37995e+02 151.008 0.8590 
1 1 1 -1  30  10 o 3  1.83791e+01 4.53715e-01 2.65846e+02 254.737 -3.88526e+00 -1.42386e+01 0.00000e+00 0.00000e+00 3.97831e+02 254.737 1.31985e+02 254.737 0.9655 
1 1 1 -1  30  11 f 0  2.44076e+01 4.85683e-01 3.42538e+02 117.021 -1.48898e+01 2.91962e+01  0.00000e+00 0.00000e+00 5.55671e+02 117.021 2.13133e+02 117.021 0.9846 
1 1 1 -1  30  12 o 11 2.64501e+01 5.20869e-01 5.04071e+02 304.021 4.47103e+01  -6.62333e+01 0.00000e+00 0.00000e+00 4.77569e+02 304.021 2.65027e+01 124.021 0.9937 
1 1 1 -1  30  13 o 16 1.14271e+01 4.91529e-01 1.57312e+02 119.934 -6.64275e+00 1.15361e+01  0.00000e+00 0.00000e+00 2.52772e+02 119.934 9.54598e+01 119.934 0.9617 
1 1 1 -1  30  14 o 17 1.37236e+01 5.02495e-01 2.74604e+02 343.418 3.56428e+01  -1.06135e+01 0.00000e+00 0.00000e+00 2.30153e+02 343.418 4.44516e+01 163.418 0.9865 
1 1 1 -1  30  15 o 13 1.08236e+01 6.25579e-01 1.68550e+02 52.928  1.44141e+01  1.90782e+01  0.00000e+00 0.00000e+00 2.26111e+02 52.928  5.75613e+01 52.928  0.9789 
1 1 1 -1  30  16 o 8  6.13242e+00 9.43834e-01 9.31338e+01 75.223  1.84934e+00  7.01086e+00  0.00000e+00 0.00000e+00 1.18698e+02 75.223  2.55640e+01 75.223  0.9282 
1 1 1 -1  30  17 o 5  3.71685e+00 1.06324e+00 3.41404e+01 14.302  1.68337e+00  4.29148e-01  0.00000e+00 0.00000e+00 5.56091e+01 14.302  2.14687e+01 14.302  0.6495 
1 1 1 -1  30  18 o 9  4.07005e+00 1.11223e+00 1.15688e+01 320.609 5.24356e-01  -4.30567e-01 0.00000e+00 0.00000e+00 3.69619e+01 320.609 2.53931e+01 320.609 0.3211 
1 1 1 -1  30  19 o 10 3.26560e+00 1.04682e+00 7.57631e+01 297.874 2.14063e+00  -4.04742e+00 0.00000e+00 0.00000e+00 3.11383e+01 297.874 4.46248e+01 117.874 0.8826 
1 1 1 -1  30  20 o 17 4.98381e+00 1.21682e+00 8.36979e+01 50.820  4.88186e+00  5.99003e+00  0.00000e+00 0.00000e+00 8.85274e+01 50.820  4.82944e+00 50.820  0.9329 
1 1 1 -1  31  1  o 13 1.89708e+01 3.14851e-01 1.35911e+02 205.150 -1.78892e+00 -8.39914e-01 0.00000e+00 0.00000e+00 3.58010e+02 205.150 2.22099e+02 205.150 0.6938 
1 1 1 -1  31  2  o 15 1.96218e+01 3.20239e-01 5.40135e+02 153.866 -7.28725e+00 3.57540e+00  0.00000e+00 0.00000e+00 1.49098e+02 153.866 3.91037e+02 333.866 0.9362 
1 1 1 -1  31  3  o 5  1.16497e+01 2.49745e-01 1.57359e+02 298.673 7.44646e-01  -1.36164e+00 0.00000e+00 0.00000e+00 1.08654e+02 298.673 4.87047e+01 118.673 0.6087 
1 1 1 -1  31  4  o 4  1.60160e+01 2.88331e-01 1.87503e+02 13.797  2.58368e+00  6.34489e-01  0.00000e+00 0.00000e+00 2.81826e+02 13.797  9.43229e+01 13.797  0.7814 
1 1 1 -1  31  5  o 1  2.98943e+01 4.41991e-01 6.57374e+02 116.242 -9.15535e+00 1.85719e+01  0.00000e+00 0.00000e+00 4.35978e+02 116.242 2.21396e+02 296.242 0.9755 
1 1 1 -1  31  6  o 5  1.63333e+01 3.22821e-01 2.30937e+02 42.093  3.65654e+00  3.30313e+00  0.00000e+00 0.00000e+00 3.14874e+02 42.093  8.39372e+01 42.093  0.8917 
1 1 1 -1  31  7  o 1  1.52545e+01 3.43540e-01 1.90942e+02 340.718 3.63012e+00  -1.26998e+00 0.00000e+00 0.00000e+00 2.98965e+02 340.718 1.08023e+02 340.718 0.8573 
1 1 1 -1  31  8  o 1  1.23238e+01 3.95768e-01 1.27501e+02 201.500 -2.50476e+00 -9.86645e-01 0.00000e+00 0.00000e+00 2.34426e+02 201.500 1.06925e+02 201.500 0.7844 
1 1 1 -1  31  9  f 0  8.74037e+00 4.13620e-01 2.20042e+02 231.262 -2.94951e+00 -3.67662e+00 0.00000e+00 0.00000e+00 6.98361e+01 231.262 1.50206e+02 51.262  0.8863 
1 1 1 -1  31  10 o 7  1.92462e+01 4.25200e-01 2.96792e+02 231.321 -1.02730e+01 -1.28325e+01 0.00000e+00 0.00000e+00 4.00719e+02 231.321 1.03927e+02 231.321 0.9691 
1 1 1 -1  31  11 o 9  6.92198e+00 6.40366e-01 1.03584e+02 77.349  6.67629e-01  2.97429e+00  0.00000e+00 0.00000e+00 1.06857e+02 77.349  3.27368e+00 77.349  0.8135 
1 1 1 -1  31  12 o 3  4.64927e+00 9.32173e-01 1.32407e+02 158.787 -3.10135e+00 1.20373e+00  0.00000e+00 0.00000e+00 1.19637e+01 158.787 1.20443e+02 338.787 0.8315 
1 1 1 -1  31  13 o 5  4.32439e+00 8.06211e-01 1.06538e+02 55.908  1.90765e+00  2.81844e+00  0.00000e+00 0.00000e+00 2.83425e+01 55.908  7.81952e+01 235.908 0.8359 
1 1 1 -1  31  14 o 17 1.19171e+01 6.13450e-01 1.91559e+02 140.975 -1.71253e+01 1.38799e+01  0.00000e+00 0.00000e+00 2.42535e+02 140.975 5.09761e+01 140.975 0.9770 
1 1 1 -1  31  15 o 2  5.50491e+00 8.50247e-01 9.30303e+01 126.370 -3.67418e+00 4.98894e+00  0.00000e+00 0.00000e+00 9.46459e+01 126.370 1.61564e+00 126.370 0.9153 
1 1 1 -1  31  16 o 12 1.02788e+01 6.46829e-01 1.94338e+02 284.700 7.23405e+00  -2.75738e+01 0.00000e+00 0.00000e+00 1.81374e+02 284.700 1.29649e+01 104.700 0.9823 
1 1 1 -1  31  17 o 2  4.60528e+00 1.04518e+00 8.87146e+01 264.394 -5.91777e-01 -6.02843e+00 0.00000e+00 0.00000e+00 6.76193e+01 264.394 2.10953e+01 84.394  0.9132 
1 1 1 -1  31  18 o 6  5.38885e+00 1.28040e+00 1.37411e+02 318.996 7.60085e+00  -6.60825e+00 0.00000e+00 0.00000e+00 5.24699e+01 318.996 8.49411e+01 138.996 0.9490 
1 1 1 -1  31  19 o 11 3.54284e+00 1.15243e+00 6.80524e+01 274.223 2.99139e-01  -4.05104e+00 0.00000e+00 0.00000e+00 4.57164e+01 274.223 2.23361e+01 94.223  0.8659 
1 1 1 -1  31  20 o 2  8.40954e+00 1.19771e+00 1.66445e+02 100.310 -4.82279e+00 2.65109e+01  0.00000e+00 0.00000e+00 1.39220e+02 100.310 2.72253e+01 280.310 0.9813 
1 1 1 -1  32  1  o 19 2.33751e+01 4.18228e-01 3.58492e+02 147.407 -5.22851e+00 3.34293e+00  0.00000e+00 0.00000e+00 4.44406e+02 147.407 8.59145e+01 147.407 0.9154 
1 1 1 -1  32  2  o 5  2.61073e+01 3.94137e-01 6.11281e+02 293.373 4.70855e+00  -1.08950e+01 0.00000e+00 0.00000e+00 3.25948e+02 293.373 2.85334e+02 113.373 0.9569 
1 1 1 -1  32  3  o 19 2.12304e+01 3.40224e-01 4.26245e+02 7.737   6.87801e+00  9.34471e-01  0.00000e+00 0.00000e+00 3.10254e+02 7.737   1.15991e+02 187.737 0.9249 
1 1 1 -1  32  4  o 9  1.65900e+01 2.95450e-01 2.98162e+02 148.293 -4.03635e+00 2.49359e+00  0.00000e+00 0.00000e+00 2.53716e+02 148.293 4.44467e+01 328.293 0.8871 
1 1 1 -1  32  5  o 3  3.71248e+01 5.30443e-01 7.74523e+02 27.091  2.65613e+01  1.35870e+01  0.00000e+00 0.00000e+00 5.93669e+02 27.091  1.80853e+02 207.091 0.9831 
1 1 1 -1  32  6  o 18 3.91407e+01 5.59295e-01 7.47617e+02 182.899 -3.44962e+01 -1.74665e+00 0.00000e+00 0.00000e+00 6.97728e+02 182.899 4.98894e+01 2.899   0.9854 
1 1 1 -1  32  7  o 5  5.39722e+01 7.99538e-01 9.61852e+02 330.408 6.06092e+01  -3.44198e+01 0.00000e+00 0.00000e+00 1.04523e+03 330.408 8.33777e+01 330.408 0.9928 
1 1 1 -1  32  8  o 11 2.87917e+01 5.11873e-01 4.68664e+02 163.838 -2.22485e+01 6.44772e+00  0.00000e+00 0.00000e+00 5.85721e+02 163.838 1.17057e+02 163.838 0.9782 
1 1 1 -1  32  9  o 6  1.36511e+01 4.10727e-01 1.75619e+02 269.652 -3.51304e-02 -5.78477e+00 0.00000e+00 0.00000e+00 2.88629e+02 269.652 1.13010e+02 269.652 0.9089 
1 1 1 -1  32  10 o 10 2.35609e+01 4.65007e-01 4.55870e+02 299.372 1.70111e+01  -3.02248e+01 0.00000e+00 0.00000e+00 4.12376e+02 299.372 4.34941e+01 119.372 0.9855 
1 1 1 -1  32  11 o 5  2.60221e+01 5.07996e-01 4.69270e+02 249.130 -1.86397e+01 -4.88903e+01 0.00000e+00 0.00000e+00 4.93806e+02 249.130 2.45361e+01 249.130 0.9904 
1 1 1 -1  32  12 o 18 1.75471e+01 5.17325e-01 1.95303e+02 351.595 1.94371e+01  -2.87190e+00 0.00000e+00 0.00000e+00 4.43024e+02 351.595 2.47721e+02 351.595 0.9742 
1 1 1 -1  32  13 o 10 2.22188e+01 6.20506e-01 2.76636e+02 288.305 1.60241e+01  -4.84378e+01 0.00000e+00 0.00000e+00 5.44205e+02 288.305 2.67569e+02 288.305 0.9902 
1 1 1 -1  32  14 o 2  9.55834e+00 5.59582e-01 1.38820e+02 238.097 -7.60284e+00 -1.22130e+01 0.00000e+00 0.00000e+00 2.04886e+02 238.097 6.60666e+01 238.097 0.9646 
1 1 1 -1  32  15 o 6  1.48170e+01 5.52101e-01 1.96170e+02 30.054  3.16263e+01  1.82994e+01  0.00000e+00 0.00000e+00 3.48071e+02 30.054  1.51901e+02 30.054  0.9862 
1 1 1 -1  32  16 o 3  1.29374e+01 6.23123e-01 1.59831e+02 254.530 -9.09614e+00 -3.28675e+01 0.00000e+00 0.00000e+00 3.14425e+02 254.530 1.54594e+02 254.530 0.9852 
1 1 1 -1  32  17 o 4  8.85848e+00 8.36930e-01 1.68276e+02 191.307 -2.42639e+01 -4.85132e+00 0.00000e+00 0.00000e+00 1.54256e+02 191.307 1.40195e+01 11.307  0.9796 
1 1 1 -1  32  18 o 16 2.83698e+00 9.42699e-01 2.70289e+01 110.193 -4.52165e-01 1.22942e+00  0.00000e+00 0.00000e+00 3.04301e+01 110.193 3.40120e+00 110.193 0.5455 
1 1 1 -1  32  19 o 8  3.18976e+00 1.04495e+00 3.40097e+01 50.470  1.25413e+00  1.51977e+00  0.00000e+00 0.00000e+00 4.79471e+01 50.470  1.39374e+01 50.470  0.6929 
1 1 1 -1  32  20 o 4  6.58394e+00 1.25551e+00 1.07504e+02 314.276 9.85982e+00  -1.01123e+01 0.00000e+00 0.00000e+00 1.27554e+02 314.276 2.00496e+01 314.276 0.9639 
1 1 1 -1  33  1  o 2  2.96724e+00 3.49873e-01 7.74693e+01 63.729  7.65691e-02  1.55126e-01  0.00000e+00 0.00000e+00 6.78759e+01 243.729 1.45345e+02 243.729 0.0862 
1 1 1 -1  33  2  o 14 9.12751e+00 2.39332e-01 1.61085e+02 79.805  2.22580e-01  1.23767e+00  0.00000e+00 0.00000e+00 2.04680e+01 79.805  1.40617e+02 259.805 0.5302 
1 1 1 -1  33  3  o 19 1.60223e+01 2.89315e-01 3.14406e+02 163.618 -4.13518e+00 1.21561e+00  0.00000e+00 0.00000e+00 2.11088e+02 163.618 1.03318e+02 343.618 0.8745 
1 1 1 -1  33  4  o 3  2.86472e+01 4.27195e-01 4.49522e+02 49.567  7.60459e+00  8.92489e+00  0.00000e+00 0.00000e+00 5.77755e+02 49.567  1.28233e+02 49.567  0.9564 
1 1 1 -1  33  5  o 4  9.23861e+00 2.86110e-01 1.88052e+02 67.593  7.97304e-01  1.93376e+00  0.00000e+00 0.00000e+00 5.86087e+01 67.593  1.29443e+02 247.593 0.7123 
1 1 1 -1  33  6  o 12 1.12208e+01 2.78481e-01 1.96718e+02 50.757  1.71929e+00  2.10481e+00  0.00000e+00 0.00000e+00 1.34065e+02 50.757  6.26532e+01 230.757 0.7867 
1 1 1 -1  33  7  o 11 1.42496e+01 3.46052e-01 3.32966e+02 53.545  4.49825e+00  6.08903e+00  0.00000e+00 0.00000e+00 1.64121e+02 53.545  1.68845e+02 233.545 0.9314 
1 1 1 -1  33  8  f 0  2.52316e+01 4.40226e-01 2.63078e+02 162.546 -1.08658e+01 3.41640e+00  0.00000e+00 0.00000e+00 6.39001e+02 162.546 3.75924e+02 162.546 0.9550 
1 1 1 -1  33  9  o 7  4.72243e+01 7.44688e-01 8.28765e+02 18.658  9.78340e+01  3.30345e+01  0.00000e+00 0.00000e+00 9.29512e+02 18.658  1.00747e+02 18.658  0.9951 
1 1 1 -1  33  10 o 19 2.31849e+01 4.67641e-01 3.68899e+02 307.284 1.61479e+01  -2.12095e+01 0.00000e+00 0.00000e+00 4.81587e+02 307.284 1.12687e+02 307.284 0.9811 
1 1 1 -1  33  11 o 3  1.89429e+01 4.83833e-01 3.67104e+02 111.581 -1.13103e+01 2.85950e+01  0.00000e+00 0.00000e+00 3.29099e+02 111.581 3.80056e+01 291.581 0.9836 
1 1 1 -1  33  12 o 14 6.20046e+00 6.68492e-01 8.53805e+01 21.464  2.79285e+00  1.09808e+00  0.00000e+00 0.00000e+00 1.02156e+02 21.464  1.67754e+01 21.464  0.8101 
1 1 1 -1  33  13 o 2  6.59832e+00 6.78468e-01 1.09221e+02 90.117  -1.20722e-02 5.89445e+00  0.00000e+00 0.00000e+00 1.14961e+02 90.117  5.74059e+00 90.117  0.9107 
1 1 1 -1  33  14 o 12 1.01459e+01 5.52707e-01 1.60041e+02 326.088 1.43663e+01  -9.65794e+00 0.00000e+00 0.00000e+00 2.07060e+02 326.088 4.70184e+01 326.088 0.9707 
1 1 1 -1  33  15 o 18 7.20687e+00 7.14383e-01 1.52107e+02 359.373 1.31255e+01  -1.43714e-01 0.00000e+00 0.00000e+00 1.05848e+02 359.373 4.62588e+01 179.373 0.9611 
1 1 1 -1  33  16 o 11 9.03446e+00 6.90961e-01 1.12223e+02 168.494 -1.55425e+01 3.16381e+00  0.00000e+00 0.00000e+00 2.13121e+02 168.494 1.00897e+02 168.494 0.9679 
1 1 1 -1  33  17 o 18 3.26647e+00 9.70649e-01 5.79576e+01 348.641 2.85676e+00  -5.73915e-01 0.00000e+00 0.00000e+00 3.95751e+01 348.641 1.83825e+01 168.641 0.8034 
1 1 1 -1  33  18 o 17 8.32460e+00 1.03136e+00 1.43299e+02 238.895 -9.95844e+00 -1.65048e+01 0.00000e+00 0.00000e+00 1.57617e+02 238.895 1.43178e+01 238.895 0.9737 
1 1 1 -1  33  19 f 0  4.18795e+00 1.22764e+00 1.35470e+02 294.453 3.77225e+00  -8.29550e+00 0.00000e+00 0.00000e+00 1.10357e+01 294.453 1.24434e+02 114.453 0.9434 
1 1 1 -1  33  20 o 19 4.37268e+00 1.23122e+00 8.49995e+01 223.154 -5.42042e+00 -5.08186e+00 0.00000e+00 0.00000e+00 6.56128e+01 223.154 1.93867e+01 43.154  0.9300 
1 1 1 -1  34  1  f 0  2.14759e+01 3.97698e-01 4.28543e+02 342.328 7.55987e+00  -2.40859e+00 0.00000e+00 0.00000e+00 3.24482e+02 342.328 1.04061e+02 162.328 0.9347 
1 1 1 -1  34  2  f 0  1.17568e+01 2.58426e-01 2.49158e+02 274.599 1.81702e-01  -2.25861e+00 0.00000e+00 0.00000e+00 7.58307e+01 274.599 1.73327e+02 94.599  0.7369 
1 1 1 -1  34  3  f 0  3.13534e+01 4.59140e-01 4.97069e+02 187.130 -1.37568e+01 -1.72086e+00 0.00000e+00 0.00000e+00 6.35518e+02 187.130 1.38448e+02 187.130 0.9632 
1 1 1 -1  34  4  o 6  3.09542e+01 4.55721e-01 8.11942e+02 342.968 2.15493e+01  -6.60144e+00 0.00000e+00 0.00000e+00 3.22566e+02 342.968 4.89376e+02 162.968 0.9776 
1 1 1 -1  34  5  o 2  3.99736e+01 5.67860e-01 6.33309e+02 226.986 -1.90928e+01 -2.04647e+01 0.00000e+00 0.00000e+00 8.37918e+02 226.986 2.04609e+02 226.986 0.9820 
1 1 1 -1  34  6  o 5  4.31552e+01 6.11317e-01 6.72661e+02 91.983  -1.30477e+00 3.76764e+01  0.00000e+00 0.00000e+00 9.22629e+02 91.983  2.49968e+02 91.983  0.9866 
1 1 1 -1  34  7  o 12 5.01660e+01 7.49249e-01 1.11493e+03 281.085 1.65046e+01  -8.42407e+01 0.00000e+00 0.00000e+00 7.52823e+02 281.085 3.62107e+02 101.085 0.9942 
1 1 1 -1  34  8  o 3  1.15057e+01 3.39412e-01 1.03538e+02 74.352  6.75964e-01  2.41328e+00  0.00000e+00 0.00000e+00 2.26216e+02 74.352  1.22678e+02 74.352  0.7657 
1 1 1 -1  34  9  o 10 3.36491e+01 5.67332e-01 5.06368e+02 281.512 9.04612e+00  -4.44170e+01 0.00000e+00 0.00000e+00 7.38504e+02 281.512 2.32136e+02 281.512 0.9889 
1 1 1 -1  34  10 o 9  3.44787e+01 5.91979e-01 5.53377e+02 343.295 5.82784e+01  -1.74900e+01 0.00000e+00 0.00000e+00 7.25054e+02 343.295 1.71677e+02 343.295 0.9917 
1 1 1 -1  34  11 o 12 1.24454e+01 4.61547e-01 2.18332e+02 173.889 -1.19308e+01 1.27731e+00  0.00000e+00 0.00000e+00 2.26833e+02 173.889 8.50167e+00 173.889 0.9574 
1 1 1 -1  34  12 o 19 2.64959e+00 7.63110e-01 1.01870e+02 10.102  1.57963e+00  2.81446e-01  0.00000e+00 0.00000e+00 4.04474e+01 190.102 1.42317e+02 190.102 0.6209 
1 1 1 -1  34  13 o 18 1.92113e+01 5.00594e-01 3.60962e+02 185.578 -5.49980e+01 -5.37129e+00 0.00000e+00 0.00000e+00 3.49185e+02 185.578 1.17771e+01 5.578   0.9909 
1 1 1 -1  34  14 f 0  8.21891e+00 6.09372e-01 6.49073e+01 43.198  4.08325e+00  3.83419e+00  0.00000e+00 0.00000e+00 2.12534e+02 43.198  1.47627e+02 43.198  0.9057 
1 1 1 -1  34  15 o 1  1.04440e+01 5.87067e-01 2.14043e+02 319.181 2.31432e+01  -1.99902e+01 0.00000e+00 0.00000e+00 1.68450e+02 319.181 4.55927e+01 139.181 0.9835 
1 1 1 -1  34  16 o 2  6.12591e+00 9.03313e-01 6.11519e+01 132.746 -3.64202e+00 3.94046e+00  0.00000e+00 0.00000e+00 1.44227e+02 132.746 8.30749e+01 132.746 0.9012 
1 1 1 -1  34  17 o 9  1.27861e+01 6.99262e-01 2.23128e+02 154.432 -4.65868e+01 2.22885e+01  0.00000e+00 0.00000e+00 2.47402e+02 154.432 2.42735e+01 154.432 0.9903 
1 1 1 -1  34  18 o 13 5.63134e+00 1.15429e+00 1.40304e+02 316.384 8.66377e+00  -8.25490e+00 0.00000e+00 0.00000e+00 5.97999e+01 316.384 8.05038e+01 136.384 0.9573 
1 1 1 -1  34  19 o 14 3.92714e+00 1.16928e+00 6.93194e+01 118.475 -2.27882e+00 4.20147e+00  0.00000e+00 0.00000e+00 5.99807e+01 118.475 9.33867e+00 298.475 0.8880 
1 1 1 -1  34  20 f 0  3.73007e+00 1.22701e+00 3.34324e+01 353.004 2.48147e+00  -3.04511e-01 0.00000e+00 0.00000e+00 7.22376e+01 353.004 3.88053e+01 353.004 0.7650 
1 1 1 -1  35  1  o 18 2.21956e+01 4.44407e-01 3.66548e+02 268.072 -2.12961e-01 -6.32720e+00 0.00000e+00 0.00000e+00 3.97097e+02 268.072 3.05484e+01 268.072 0.9172 
1 1 1 -1  35  2  o 9  7.19804e+00 3.41337e-01 8.40616e+01 80.597  8.50222e-02  5.13415e-01  0.00000e+00 0.00000e+00 1.60903e+01 260.597 1.00152e+02 260.597 0.2518 
1 1 1 -1  35  3  o 16 1.67576e+01 3.52543e-01 1.89510e+02 36.694  2.45116e+00  1.82668e+00  0.00000e+00 0.00000e+00 3.22066e+02 36.694  1.32555e+02 36.694  0.8141 
1 1 1 -1  35  4  o 16 1.57575e+01 2.95639e-01 2.67107e+02 12.641  4.35030e+00  9.75707e-01  0.00000e+00 0.00000e+00 2.52202e+02 12.641  1.49048e+01 192.641 0.8791 
1 1 1 -1  35  5  o 9  2.57124e+01 4.00168e-01 4.32559e+02 29.828  1.05971e+01  6.07584e+00  0.00000e+00 0.00000e+00 4.90744e+02 29.828  5.81848e+01 29.828  0.9582 
1 1 1 -1  35  6  o 18 2.56300e+01 4.05670e-01 5.51030e+02 262.526 -2.35819e+00 -1.79744e+01 0.00000e+00 0.00000e+00 3.82280e+02 262.526 1.68750e+02 82.526  0.9720 
1 1 1 -1  35  7  o 4  5.63939e+01 8.35392e-01 9.37352e+02 166.000 -7.79424e+01 1.94335e+01  0.00000e+00 0.00000e+00 1.16123e+03 166.000 2.23876e+02 166.000 0.9938 
1 1 1 -1  35  8  o 16 3.54063e+01 5.61491e-01 4.43990e+02 327.870 2.77084e+01  -1.74018e+01 0.00000e+00 0.00000e+00 8.60788e+02 327.870 4.16798e+02 327.870 0.9846 
1 1 1 -1  35  9  f 0  3.31310e+01 5.61202e-01 4.52713e+02 4.475   3.88808e+01  3.04317e+00  0.00000e+00 0.00000e+00 7.70629e+02 4.475   3.17916e+02 4.475   0.9871 
1 1 1 -1  35  10 f 0  3.80995e+01 6.35509e-01 5.38746e+02 304.431 3.67398e+01  -5.35943e+01 0.00000e+00 0.00000e+00 8.74559e+02 304.431 3.35813e+02 304.431 0.9923 
1 1 1 -1  35  11 o 6  2.31686e+01 4.89505e-01 3.63859e+02 156.444 -3.56163e+01 1.55275e+01  0.00000e+00 0.00000e+00 4.90469e+02 156.444 1.26610e+02 156.444 0.9870 
1 1 1 -1  35  12 o 17 2.60175e+01 5.29148e-01 3.79523e+02 90.261  -2.82079e-01 6.19452e+01  0.00000e+00 0.00000e+00 5.83857e+02 90.261  2.04334e+02 90.261  0.9919 
1 1 1 -1  35  13 o 10 1.45160e+01 4.90881e-01 3.02767e+02 222.691 -2.81589e+01 -2.59759e+01 0.00000e+00 0.00000e+00 2.31577e+02 222.691 7.11909e+01 42.691  0.9869 
1 1 1 -1  35  14 o 8  5.93874e+00 8.54128e-01 1.05974e+02 288.690 2.06526e+00  -6.10494e+00 0.00000e+00 0.00000e+00 9.73728e+01 288.690 8.60108e+00 108.690 0.9188 
1 1 1 -1  35  15 o 16 3.14270e+00 8.75111e-01 9.27102e+01 351.769 3.42109e+00  -4.94880e-01 0.00000e+00 0.00000e+00 5.44321e+00 351.769 8.72670e+01 171.769 0.8388 
1 1 1 -1  35  16 o 11 8.66797e+00 7.27506e-01 1.48764e+02 239.240 -1.01426e+01 -1.70415e+01 0.00000e+00 0.00000e+00 1.65422e+02 239.240 1.66575e+01 239.240 0.9745 
1 1 1 -1  35  17 o 7  7.86119e+00 8.84511e-01 1.43921e+02 26.232  1.58303e+01  7.80033e+00  0.00000e+00 0.00000e+00 1.39785e+02 26.232  4.13596e+00 206.232 0.9712 
1 1 1 -1  35  18 o 15 3.62292e+00 1.06827e+00 7.54683e+01 162.288 -4.22359e+00 1.34888e+00  0.00000e+00 0.00000e+00 4.26453e+01 162.288 3.28230e+01 342.288 0.8784 
1 1 1 -1  35  19 o 15 4.27543e+00 1.20974e+00 8.18601e+01 196.108 -5.72578e+00 -1.65349e+00 0.00000e+00 0.00000e+00 6.26537e+01 196.108 1.92065e+01 16.108  0.9117 
1 1 1 -1  35  20 o 8  5.35968e+00 1.36183e+00 8.23205e+01 181.628 -7.59534e+00 -2.15930e-01 0.00000e+00 0.00000e+00 1.02575e+02 181.628 2.02543e+01 181.628 0.9317 
1 1 1 -1  36  1  o 12 2.14805e+01 4.02902e-01 3.60467e+02 61.232  3.22325e+00  5.87073e+00  0.00000e+00 0.00000e+00 3.82352e+02 61.232  2.18845e+01 61.232  0.9220 
1 1 1 -1  36  2  o 7  1.87758e+01 3.21780e-01 5.72334e+02 249.661 -3.34215e+00 -9.01600e+00 0.00000e+00 0.00000e+00 9.41120e+01 249.661 4.78222e+02 69.661  0.9465 
1 1 1 -1  36  3  o 2  1.03978e+01 2.90720e-01 3.12017e+02 15.117  2.96478e+00  8.00896e-01  0.00000e+00 0.00000e+00 5.76417e+00 15.117  3.06253e+02 195.117 0.8151 
1 1 1 -1  36  4  o 8  1.14037e+01 2.67904e-01 2.30502e+02 72.440  8.27550e-01  2.61511e+00  0.00000e+00 0.00000e+00 1.06785e+02 72.440  1.23716e+02 252.440 0.7890 
1 1 1 -1  36  5  o 1  2.43754e+01 3.86752e-01 4.51277e+02 144.042 -1.16329e+01 8.43876e+00  0.00000e+00 0.00000e+00 4.29781e+02 144.042 2.14963e+01 324.042 0.9646 
1 1 1 -1  36  6  o 9  3.64848e+01 5.31441e-01 5.73649e+02 116.274 -1.17718e+01 2.38455e+01  0.00000e+00 0.00000e+00 7.67103e+02 116.274 1.93454e+02 116.274 0.9810 
1 1 1 -1  36  7  o 11 2.74989e+01 4.60640e-01 3.41322e+02 105.365 -4.69195e+00 1.70745e+01  0.00000e+00 0.00000e+00 6.58812e+02 105.365 3.17490e+02 105.365 0.9713 
1 1 1 -1  36  8  o 9  4.99221e+01 7.54145e-01 9.63046e+02 317.019 7.54538e+01  -7.03146e+01 0.00000e+00 0.00000e+00 8.96178e+02 317.019 6.68683e+01 137.019 0.9951 
1 1 1 -1  36  9  o 7  2.19437e+01 4.40912e-01 4.47799e+02 81.782  3.86140e+00  2.67382e+01  0.00000e+00 0.00000e+00 3.57635e+02 81.782  9.01636e+01 261.782 0.9813 
1 1 1 -1  36  10 o 9  5.12865e+00 7.52130e-01 6.69346e+01 4.797   1.10578e+00  9.28011e-02  0.00000e+00 0.00000e+00 2.58339e+01 4.797   4.11007e+01 184.797 0.4839 
1 1 1 -1  36  11 o 9  1.01144e+01 4.83223e-01 1.42151e+02 176.303 -6.98497e+00 4.51376e-01  0.00000e+00 0.00000e+00 2.07532e+02 176.303 6.53814e+01 176.303 0.9255 
1 1 1 -1  36  12 o 11 1.03891e+01 5.17739e-01 1.51823e+02 175.749 -1.08547e+01 8.06775e-01  0.00000e+00 0.00000e+00 2.17705e+02 175.749 6.58820e+01 175.749 0.9529 
1 1 1 -1  36  13 o 4  1.52806e+01 4.91537e-01 3.32074e+02 357.770 4.47550e+01  -1.74248e+00 0.00000e+00 0.00000e+00 2.31449e+02 357.770 1.00625e+02 177.770 0.9888 
1 1 1 -1  36  14 o 7  1.38966e+01 5.26559e-01 3.55637e+02 255.850 -1.30422e+01 -5.17307e+01 0.00000e+00 0.00000e+00 1.57339e+02 255.850 1.98298e+02 75.850  0.9906 
1 1 1 -1  36  15 o 11 7.18090e+00 8.38362e-01 1.41253e+02 342.628 1.24088e+01  -3.88202e+00 0.00000e+00 0.00000e+00 1.15598e+02 342.628 2.56554e+01 162.628 0.9607 
1 1 1 -1  36  16 o 14 4.77387e+00 9.68933e-01 7.68577e+01 105.070 -1.31148e+00 4.87075e+00  0.00000e+00 0.00000e+00 8.19491e+01 105.070 5.09143e+00 105.070 0.8944 
1 1 1 -1  36  17 o 6  9.65105e+00 7.44741e-01 1.79458e+02 78.925  6.05696e+00  3.09444e+01  0.00000e+00 0.00000e+00 1.73390e+02 78.925  6.06831e+00 258.925 0.9840 
1 1 1 -1  36  18 o 1  4.08816e+00 1.13056e+00 1.00333e+02 38.660  5.05606e+00  4.04490e+00  0.00000e+00 0.00000e+00 3.91267e+01 38.660  6.12063e+01 218.660 0.9192 
1 1 1 -1  36  19 o 2  4.98840e+00 1.24790e+00 1.22058e+02 246.702 -4.18026e+00 -9.70761e+00 0.00000e+00 0.00000e+00 5.38836e+01 246.702 6.81741e+01 66.702  0.9514 
1 1 1 -1  36  20 o 16 5.79148e+00 1.34313e+00 1.11168e+02 288.546 3.63753e+00  -1.08426e+01 0.00000e+00 0.00000e+00 9.36571e+01 288.546 1.75107e+01 108.546 0.9552 
1 1 1 -1  37  1  o 12 2.22321e+01 3.60354e-01 4.09084e+02 17.280  7.34708e+00  2.28555e+00  0.00000e+00 0.00000e+00 3.68457e+02 17.280  4.06267e+01 197.280 0.9326 
1 1 1 -1  37  2  o 8  1.49632e+01 2.90202e-01 2.03404e+02 137.453 -1.96743e+00 1.80578e+00  0.00000e+00 0.00000e+00 2.35563e+02 137.453 3.21598e+01 137.453 0.7823 
1 1 1 -1  37  3  o 12 9.43729e+00 3.36749e-01 1.29637e+02 46.620  7.55432e-01  7.99417e-01  0.00000e+00 0.00000e+00 4.04288e+01 46.620  8.92084e+01 226.620 0.4807 
1 1 1 -1  37  4  o 5  2.11276e+01 3.51840e-01 4.74911e+02 31.114  1.03339e+01  6.23733e+00  0.00000e+00 0.00000e+00 2.83438e+02 31.114  1.91474e+02 211.114 0.9576 
1 1 1 -1  37  5  o 17 1.30076e+01 2.87006e-01 3.45349e+02 299.154 2.59600e+00  -4.65376e+00 0.00000e+00 0.00000e+00 9.35426e+01 299.154 2.51807e+02 119.154 0.9005 
1 1 1 -1  37  6  f 0  3.49357e+01 5.15225e-01 7.14261e+02 69.603  1.14401e+01  3.07660e+01  0.00000e+00 0.00000e+00 5.74190e+02 69.603  1.40071e+02 249.603 0.9846 
1 1 1 -1  37  7  o 2  2.51167e+01 4.37606e-01 4.19316e+02 7.083   1.83520e+01  2.28048e+00  0.00000e+00 0.00000e+00 4.95249e+02 7.083   7.59325e+01 7.083   0.9726 
1 1 1 -1  37  8  o 15 2.61009e+01 4.53031e-01 5.79558e+02 274.230 2.48209e+00  -3.35590e+01 0.00000e+00 0.00000e+00 3.82529e+02 274.230 1.97029e+02 94.230  0.9850 
1 1 1 -1  37  9  o 5  7.09911e+00 4.88986e-01 1.19759e+02 92.594  -1.07935e-01 2.38197e+00  0.00000e+00 0.00000e+00 7.98520e+01 92.594  3.99070e+01 272.594 0.7518 
1 1 1 -1  37  10 o 15 1.15363e+01 4.47282e-01 1.51794e+02 313.625 4.31435e+00  -4.52658e+00 0.00000e+00 0.00000e+00 2.43226e+02 313.625 9.14325e+01 313.625 0.9161 
1 1 1 -1  37  11 o 10 8.85045e+00 5.18317e-01 2.47471e+02 326.014 8.60138e+00  -5.79852e+00 0.00000e+00 0.00000e+00 6.67408e+01 326.014 1.80730e+02 146.015 0.9505 
1 1 1 -1  37  12 o 18 1.66452e+01 4.70080e-01 3.30132e+02 47.504  2.56852e+01  2.80345e+01  0.00000e+00 0.00000e+00 2.82898e+02 47.504  4.72331e+01 227.504 0.9868 
1 1 1 -1  37  13 o 8  1.74376e+01 4.85378e-01 3.32867e+02 207.281 -4.79967e+01 -2.47524e+01 0.00000e+00 0.00000e+00 3.11388e+02 207.281 2.14788e+01 27.281  0.9907 
1 1 1 -1  37  14 o 8  8.52241e+00 6.09933e-01 2.27720e+02 56.142  1.21032e+01  1.80401e+01  0.00000e+00 0.00000e+00 8.24370e+01 56.142  1.45283e+02 236.142 0.9767 
1 1 1 -1  37  15 o 3  4.32877e+00 9.10475e-01 1.73795e+02 238.682 -4.88969e+00 -8.03632e+00 0.00000e+00 0.00000e+00 2.14720e+01 58.682  1.95267e+02 58.682  0.9453 
1 1 1 -1  37  16 f 0  1.04124e+01 6.56738e-01 1.20611e+02 349.872 1.96335e+01  -3.50724e+00 0.00000e+00 0.00000e+00 2.56787e+02 349.872 1.36176e+02 349.872 0.9746 
1 1 1 -1  37  17 o 4  3.12320e+00 9.52252e-01 5.58395e+01 47.172  2.01145e+00  2.17005e+00  0.00000e+00 0.00000e+00 3.77846e+01 47.172  1.80549e+01 227.172 0.8069 
1 1 1 -1  37  18 o 7  6.84408e+00 1.07480e+00 1.26472e+02 270.837 2.15469e-01  -1.47513e+01 0.00000e+00 0.00000e+00 1.18745e+02 270.837 7.72733e+00 90.837  0.9655 
1 1 1 -1  37  19 o 8  7.98652e+00 1.36794e+00 1.28435e+02 164.394 -1.55597e+01 4.34599e+00  0.00000e+00 0.00000e+00 1.58281e+02 164.394 2.98463e+01 164.394 0.9685 
1 1 1 -1  37  20 o 11 4.62143e+00 1.27099e+00 7.69385e+01 333.329 6.37195e+00  -3.20067e+00 0.00000e+00 0.00000e+00 8.16537e+01 333.329 4.71525e+00 333.329 0.9270 
1 1 1 -1  38  1  o 17 1.21570e+01 2.70423e-01 2.24942e+02 155.372 -2.19060e+00 1.00422e+00  0.00000e+00 0.00000e+00 1.19166e+02 155.372 1.05776e+02 335.372 0.7548 
1 1 1 -1  38  2  o 5  1.00635e+01 2.80264e-01 1.70095e+02 224.874 -1.15005e+00 -1.14502e+00 0.00000e+00 0.00000e+00 6.57595e+01 224.874 1.04335e+02 44.874  0.6251 
1 1 1 -1  38  3  o 7  1.73031e+01 3.65602e-01 2.45811e+02 329.731 3.88648e+00  -2.26820e+00 0.00000e+00 0.00000e+00 3.25211e+02 329.731 7.93995e+01 329.731 0.8803 
1 1 1 -1  38  4  o 12 6.34577e+00 2.75756e-01 6.22418e+01 355.585 4.37126e-01  -3.37531e-02 0.00000e+00 0.00000e+00 1.13210e+01 175.585 7.35628e+01 175.585 0.2141 
1 1 1 -1  38  5  o 15 1.89011e+01 3.36485e-01 3.88349e+02 179.503 -9.01830e+00 7.82988e-02  0.00000e+00 0.00000e+00 2.79302e+02 179.503 1.09048e+02 359.502 0.9428 
1 1 1 -1  38  6  o 12 2.94588e+01 4.52766e-01 2.99000e+02 148.904 -1.02270e+01 6.16826e+00  0.00000e+00 0.00000e+00 7.57038e+02 148.904 4.58038e+02 148.904 0.9572 
1 1 1 -1  38  7  o 17 5.01302e+01 7.53384e-01 1.09337e+03 301.801 4.87876e+01  -7.86834e+01 0.00000e+00 0.00000e+00 7.73114e+02 301.801 3.20256e+02 121.801 0.9946 
1 1 1 -1  38  8  o 12 2.62822e+01 4.57340e-01 5.55508e+02 111.752 -1.32783e+01 3.32788e+01  0.00000e+00 0.00000e+00 4.14067e+02 111.752 1.41440e+02 291.752 0.9859 
1 1 1 -1  38  9  o 18 1.41438e+01 4.07655e-01 2.39803e+02 134.320 -7.19678e+00 7.36955e+00  0.00000e+00 0.00000e+00 2.62747e+02 134.320 2.29444e+01 134.320 0.9501 
1 1 1 -1  38  10 o 6  4.64315e+01 7.51188e-01 7.86123e+02 22.806  1.13995e+02  4.79326e+01  0.00000e+00 0.00000e+00 9.42115e+02 22.806  1.55992e+02 22.806  0.9959 
1 1 1 -1  38  11 o 2  1.16930e+01 4.67525e-01 1.29765e+02 2.037   7.74644e+00  2.75481e-01  0.00000e+00 0.00000e+00 2.77708e+02 2.037   1.47943e+02 2.037   0.9331 
1 1 1 -1  38  12 o 10 8.33965e+00 5.43258e-01 2.06784e+02 109.904 -4.15844e+00 1.14849e+01  0.00000e+00 0.00000e+00 9.14218e+01 109.904 1.15362e+02 289.904 0.9581 
1 1 1 -1  38  13 o 16 4.04251e+00 7.76202e-01 7.47729e+01 328.127 2.24084e+00  -1.39333e+00 0.00000e+00 0.00000e+00 4.26977e+01 328.127 3.20753e+01 148.127 0.7793 
1 1 1 -1  38  14 o 13 1.36367e+01 5.19906e-01 2.60248e+02 292.273 1.43864e+01  -3.51243e+01 0.00000e+00 0.00000e+00 2.41081e+02 292.273 1.91669e+01 112.273 0.9867 
1 1 1 -1  38  15 o 6  7.85554e+00 6.88367e-01 8.30377e+01 266.295 -5.96218e-01 -9.20739e+00 0.00000e+00 0.00000e+00 1.93035e+02 266.295 1.09997e+02 266.295 0.9441 
1 1 1 -1  38  16 o 12 5.71800e+00 9.41467e-01 4.88399e+01 223.672 -2.82830e+00 -2.70017e+00 0.00000e+00 0.00000e+00 1.34017e+02 223.672 8.51774e+01 223.672 0.8600 
1 1 1 -1  38  17 o 14 6.50359e+00 1.01434e+00 5.68936e+01 357.293 6.03041e+00  -2.85082e-01 0.00000e+00 0.00000e+00 1.63661e+02 357.293 1.06767e+02 357.293 0.9129 
1 1 1 -1  38  18 o 13 8.00620e+00 1.00172e+00 1.31313e+02 280.579 3.44968e+00  -1.84707e+01 0.00000e+00 0.00000e+00 1.57747e+02 280.579 2.64342e+01 280.579 0.9730 
1 1 1 -1  38  19 o 15 4.61703e+00 1.46190e+00 3.82077e+01 170.997 -2.58852e+00 4.10132e-01  0.00000e+00 0.00000e+00 9.48406e+01 170.997 5.66330e+01 170.997 0.7775 
1 1 1 -1  39  1  o 11 3.14392e+01 4.66558e-01 7.33518e+02 354.737 2.17892e+01  -2.00699e+00 0.00000e+00 0.00000e+00 4.18050e+02 354.737 3.15468e+02 174.737 0.9769 
1 1 1 -1  39  2  o 7  1.73765e+01 3.16137e-01 2.37383e+02 38.258  2.91395e+00  2.29780e+00  0.00000e+00 0.00000e+00 3.17271e+02 38.258  7.98882e+01 38.258  0.8514 
1 1 1 -1  39  3  o 1  2.49301e+01 4.56007e-01 4.41182e+02 329.097 9.80830e+00  -5.87086e+00 0.00000e+00 0.00000e+00 4.51421e+02 329.097 1.02392e+01 329.097 0.9552 
1 1 1 -1  39  4  o 5  2.44666e+01 3.89972e-01 3.59992e+02 111.826 -4.31147e+00 1.07650e+01  0.00000e+00 0.00000e+00 5.16393e+02 111.826 1.56400e+02 111.826 0.9559 
1 1 1 -1  39  5  o 17 3.08030e+01 4.63234e-01 7.01122e+02 269.588 -2.01871e-01 -2.80951e+01 0.00000e+00 0.00000e+00 4.32095e+02 269.588 2.69027e+02 89.588  0.9820 
1 1 1 -1  39  6  o 14 9.46495e+00 3.25267e-01 1.69079e+02 17.083  2.43527e+00  7.48386e-01  0.00000e+00 0.00000e+00 1.03872e+02 17.083  6.52066e+01 197.083 0.7701 
1 1 1 -1  39  7  o 8  1.43061e+01 3.49385e-01 2.81042e+02 216.269 -5.58321e+00 -4.09656e+00 0.00000e+00 0.00000e+00 2.14127e+02 216.269 6.69150e+01 36.269  0.9247 
1 1 1 -1  39  8  o 2  1.96695e+01 3.94244e-01 4.68700e+02 202.723 -2.08200e+01 -8.71897e+00 0.00000e+00 0.00000e+00 2.50703e+02 202.723 2.17997e+02 22.723  0.9776 
1 1 1 -1  39  9  o 17 2.89872e+01 5.21767e-01 5.14273e+02 211.813 -3.63535e+01 -2.25517e+01 0.00000e+00 0.00000e+00 5.56869e+02 211.813 4.25961e+01 211.813 0.9882 
1 1 1 -1  39  10 o 8  7.94320e+00 5.30218e-01 1.23541e+02 327.185 3.22798e+00  -2.08149e+00 0.00000e+00 0.00000e+00 1.30874e+02 327.185 7.33292e+00 327.185 0.8571 
1 1 1 -1  39  11 o 4  2.57225e+01 5.15926e-01 4.00845e+02 179.976 -5.62695e+01 2.35867e-02  0.00000e+00 0.00000e+00 5.51142e+02 179.976 1.50297e+02 179.976 0.9911 
1 1 1 -1  39  12 f 0  9.15265e+00 5.23430e-01 1.34299e+02 171.492 -9.10872e+00 1.36253e+00  0.00000e+00 0.00000e+00 1.88125e+02 171.492 5.38252e+01 171.492 0.9440 
1 1 1 -1  39  13 o 17 4.93026e+00 7.48004e-01 7.91947e+01 336.169 3.13601e+00  -1.38515e+00 0.00000e+00 0.00000e+00 7.47181e+01 336.169 4.47658e+00 156.169 0.8373 
1 1 1 -1  39  14 o 14 4.70858e+00 8.33306e-01 1.19453e+02 252.285 -1.82266e+00 -5.70614e+00 0.00000e+00 0.00000e+00 4.05574e+01 252.285 7.88951e+01 72.285  0.9122 
1 1 1 -1  39  15 o 16 5.13652e+00 8.95123e-01 9.52991e+01 124.005 -3.56005e+00 5.27704e+00  0.00000e+00 0.00000e+00 8.01403e+01 124.005 1.51588e+01 304.005 0.9177 
1 1 1 -1  39  16 o 8  3.95489e+00 1.03505e+00 1.08068e+02 301.126 3.06117e+00  -5.06940e+00 0.00000e+00 0.00000e+00 2.59139e+01 301.126 8.21544e+01 121.126 0.9111 
1 1 1 -1  39  17 o 8  7.03424e+00 9.61742e-01 1.08107e+02 326.736 1.01202e+01  -6.63859e+00 0.00000e+00 0.00000e+00 1.42128e+02 326.736 3.40214e+01 326.736 0.9578 
1 1 1 -1  39  18 o 16 3.64658e+00 1.01228e+00 6.08520e+01 227.429 -2.64448e+00 -2.87881e+00 0.00000e+00 0.00000e+00 5.54927e+01 227.429 5.35935e+00 47.429  0.8599 
1 1 1 -1  39  19 o 18 4.55335e+00 1.36036e+00 5.55306e+01 27.904  3.69832e+00  1.95852e+00  0.00000e+00 0.00000e+00 9.13195e+01 27.904  3.57890e+01 27.904  0.8703 
1 1 1 -1  40  1  o 15 9.88130e+00 2.84479e-01 9.23305e+01 264.700 -7.60372e-02 -8.19621e-01 0.00000e+00 0.00000e+00 4.85344e+01 264.700 4.37961e+01 84.700  0.3802 
1 1 1 -1  40  2  o 16 1.32615e+01 3.05290e-01 2.05664e+02 75.617  7.17105e-01  2.79641e+00  0.00000e+00 0.00000e+00 1.92666e+02 75.617  1.29989e+01 255.617 0.8013 
1 1 1 -1  40  3  o 8  2.39798e+01 3.85893e-01 6.35941e+02 209.983 -1.58450e+01 -9.14190e+00 0.00000e+00 0.00000e+00 2.37883e+02 209.983 3.98058e+02 29.983  0.9723 
1 1 1 -1  40  4  o 7  3.40471e+01 5.00905e-01 5.12239e+02 284.106 5.05774e+00  -2.01259e+01 0.00000e+00 0.00000e+00 7.32370e+02 284.106 2.20132e+02 284.106 0.9756 
1 1 1 -1  40  5  o 3  3.93565e+01 5.66138e-01 6.39682e+02 185.922 -3.19173e+01 -3.31077e+00 0.00000e+00 0.00000e+00 8.11374e+02 185.922 1.71692e+02 185.922 0.9843 
1 1 1 -1  40  6  o 15 5.65482e+01 7.85786e-01 1.09208e+03 27.709  8.35005e+01  4.38551e+01  0.00000e+00 0.00000e+00 1.01405e+03 27.709  7.80350e+01 207.709 0.9947 
1 1 1 -1  40  7  o 5  3.24236e+01 5.25329e-01 5.13143e+02 204.893 -3.16060e+01 -1.46662e+01 0.00000e+00 0.00000e+00 6.82848e+02 204.893 1.69705e+02 204.893 0.9855 
1 1 1 -1  40  8  o 19 2.68877e+01 4.69547e-01 4.08048e+02 272.604 1.19750e+00  -2.63321e+01 0.00000e+00 0.00000e+00 5.78522e+02 272.604 1.70474e+02 272.604 0.9808 
1 1 1 -1  40  9  o 2  1.65610e+01 4.21157e-01 3.26765e+02 20.742  1.63982e+01  6.21016e+00  0.00000e+00 0.00000e+00 2.74492e+02 20.742  5.22728e+01 200.742 0.9711 
1 1 1 -1  40  10 o 2  1.69609e+01 4.45310e-01 2.77377e+02 327.808 1.72341e+01  -1.08494e+01 0.00000e+00 0.00000e+00 3.40599e+02 327.808 6.32216e+01 327.808 0.9751 
1 1 1 -1  40  11 f 0  2.81266e+00 7.70090e-01 4.10035e+01 188.398 -6.60683e-01 -9.75426e-02 0.00000e+00 0.00000e+00 7.75430e+00 8.398   4.87578e+01 8.398   0.3166 
1 1 1 -1  40  12 o 18 1.47215e+01 4.72329e-01 1.83538e+02 290.802 7.27809e+00  -1.91574e+01 0.00000e+00 0.00000e+00 3.52170e+02 290.802 1.68632e+02 290.802 0.9753 
1 1 1 -1  40  13 o 19 5.07789e+00 7.90775e-01 1.57522e+02 148.366 -5.90313e+00 3.63648e+00  0.00000e+00 0.00000e+00 1.75490e+01 148.366 1.39973e+02 328.366 0.9248 
1 1 1 -1  40  14 o 8  9.48047e+00 5.73879e-01 1.42919e+02 319.498 1.24245e+01  -1.06122e+01 0.00000e+00 0.00000e+00 1.99239e+02 319.498 5.63205e+01 319.498 0.9689 
1 1 1 -1  40  15 o 1  1.46125e+01 6.25583e-01 1.49159e+02 243.433 -1.33214e+01 -2.66411e+01 0.00000e+00 0.00000e+00 3.85433e+02 243.433 2.36274e+02 243.433 0.9831 
1 1 1 -1  40  16 o 2  7.45709e+00 8.86521e-01 1.41912e+02 202.852 -1.36394e+01 -5.74815e+00 0.00000e+00 0.00000e+00 1.25792e+02 202.852 1.61205e+01 22.852  0.9656 
1 1 1 -1  40  17 o 17 6.53789e+00 1.01361e+00 7.02709e+01 2.313   7.23014e+00  2.92001e-01  0.00000e+00 0.00000e+00 1.55077e+02 2.313   8.48056e+01 2.313   0.9281 
1 1 1 -1  40  18 o 15 6.91450e+00 1.09195e+00 1.11171e+02 153.525 -1.17101e+01 5.83195e+00  0.00000e+00 0.00000e+00 1.35334e+02 153.525 2.41625e+01 153.525 0.9610 
1 1 1 -1  40  19 o 1  3.48304e+00 1.19813e+00 3.14175e+01 6.385   2.06779e+00  2.31398e-01  0.00000e+00 0.00000e+00 6.02930e+01 6.385   2.88755e+01 6.385   0.7106 
1 1 1 -1  41  1  o 6  2.08496e+01 3.52097e-01 4.51056e+02 173.455 -9.90201e+00 1.13610e+00  0.00000e+00 0.00000e+00 2.90229e+02 173.455 1.60827e+02 353.455 0.9484 
1 1 1 -1  41  2  o 12 3.09543e+01 4.62551e-01 7.93380e+02 335.874 2.32674e+01  -1.04204e+01 0.00000e+00 0.00000e+00 3.43871e+02 335.874 4.49510e+02 155.874 0.9802 
1 1 1 -1  41  3  o 17 1.67983e+01 3.17113e-01 1.99386e+02 21.136  3.45592e+00  1.33599e+00  0.00000e+00 0.00000e+00 3.36423e+02 21.136  1.37036e+02 21.136  0.8511 
1 1 1 -1  41  4  o 10 1.71797e+01 3.24600e-01 3.03381e+02 197.508 -6.13940e+00 -1.93670e+00 0.00000e+00 0.00000e+00 2.87916e+02 197.508 1.54642e+01 17.508  0.9187 
1 1 1 -1  41  5  o 16 9.99301e+00 3.10772e-01 2.61862e+02 87.654  1.41927e-01  3.46454e+00  0.00000e+00 0.00000e+00 5.22999e+01 87.654  2.09562e+02 267.654 0.8394 
1 1 1 -1  41  6  o 7  2.02467e+01 3.62959e-01 4.23795e+02 302.766 8.80292e+00  -1.36774e+01 0.00000e+00 0.00000e+00 3.10551e+02 302.766 1.13244e+02 122.766 0.9688 
1 1 1 -1  41  7  o 14 4.84189e+01 7.32913e-01 9.44352e+02 241.041 -4.57232e+01 -8.26248e+01 0.00000e+00 0.00000e+00 8.58022e+02 241.041 8.63305e+01 61.041  0.9947 
1 1 1 -1  41  8  o 12 1.67654e+01 3.81907e-01 3.21068e+02 251.496 -4.58646e+00 -1.37041e+01 0.00000e+00 0.00000e+00 2.83935e+02 251.496 3.71333e+01 71.496  0.9648 
1 1 1 -1  41  9  o 9  3.67358e+01 6.19126e-01 6.22020e+02 128.783 -4.41919e+01 5.49969e+01  0.00000e+00 0.00000e+00 7.41533e+02 128.783 1.19513e+02 128.783 0.9929 
1 1 1 -1  41  10 o 7  4.90698e+00 6.76264e-01 1.54319e+01 125.840 -1.87007e-01 2.58908e-01  0.00000e+00 0.00000e+00 1.34768e+01 125.840 1.95507e+00 305.840 0.1577 
1 1 1 -1  41  11 o 16 1.05302e+01 4.94332e-01 1.86245e+02 115.045 -4.78876e+00 1.02487e+01  0.00000e+00 0.00000e+00 1.89101e+02 115.045 2.85579e+00 115.045 0.9547 
1 1 1 -1  41  12 o 15 7.39903e+00 6.60881e-01 1.94621e+02 168.783 -1.01866e+01 2.02021e+00  0.00000e+00 0.00000e+00 6.77703e+01 168.783 1.26851e+02 348.783 0.9506 
1 1 1 -1  41  13 o 9  8.12991e+00 5.80618e-01 1.53701e+02 84.194  1.21331e+00  1.19322e+01  0.00000e+00 0.00000e+00 1.36437e+02 84.194  1.72644e+01 264.194 0.9574 
1 1 1 -1  41  14 f 0  6.67315e+00 6.95442e-01 2.87931e+02 308.633 1.47412e+01  -1.84444e+01 0.00000e+00 0.00000e+00 4.47100e+01 128.633 3.32641e+02 128.633 0.9786 
1 1 1 -1  41  15 o 2  7.21256e+00 7.38566e-01 1.76980e+02 161.431 -1.64692e+01 5.53247e+00  0.00000e+00 0.00000e+00 8.35617e+01 161.431 9.34184e+01 341.431 0.9708 
1 1 1 -1  41  16 o 8  7.03448e+00 8.99578e-01 1.72243e+02 278.174 2.67774e+00  -1.86417e+01 0.00000e+00 0.00000e+00 8.22161e+01 278.174 9.00267e+01 98.174  0.9731 
1 1 1 -1  41  17 o 8  1.56089e+01 6.87812e-01 2.35661e+02 113.433 -2.53929e+01 5.85883e+01  0.00000e+00 0.00000e+00 3.39417e+02 113.433 1.03756e+02 113.433 0.9921 
1 1 1 -1  41  18 o 8  4.36695e+00 1.28614e+00 1.51120e+02 303.105 5.55760e+00  -8.52383e+00 0.00000e+00 0.00000e+00 2.68845e+00 303.105 1.48431e+02 123.105 0.9495 
1 1 1 -1  41  19 o 12 5.00705e+00 1.48007e+00 1.33254e+02 112.592 -3.64138e+00 8.75137e+00  0.00000e+00 0.00000e+00 4.21816e+01 112.592 9.10728e+01 292.592 0.9457 
1 1 1 -1  42  1  o 9  2.10540e+01 3.55389e-01 3.14303e+02 210.545 -5.93471e+00 -3.50207e+00 0.00000e+00 0.00000e+00 4.15119e+02 210.545 1.00816e+02 210.545 0.9243 
1 1 1 -1  42  2  o 5  4.14427e+00 3.25553e-01 1.06241e+02 220.831 -3.99362e-01 -3.45099e-01 0.00000e+00 0.00000e+00 6.66153e+01 40.831  1.72856e+02 40.831  0.2551 
1 1 1 -1  42  3  f 0  2.72128e+01 4.22253e-01 4.40378e+02 171.972 -1.55565e+01 2.19414e+00  0.00000e+00 0.00000e+00 5.46302e+02 171.972 1.05924e+02 171.972 0.9676 
1 1 1 -1  42  4  o 13 2.18482e+01 3.68636e-01 4.52167e+02 338.278 1.20082e+01  -4.78394e+00 0.00000e+00 0.00000e+00 3.33970e+02 338.278 1.18196e+02 158.278 0.9605 
1 1 1 -1  42  5  o 16 1.88488e+01 3.92700e-01 2.83133e+02 167.029 -7.07503e+00 1.62967e+00  0.00000e+00 0.00000e+00 3.72156e+02 167.029 8.90229e+01 167.029 0.9283 
1 1 1 -1  42  6  o 5  7.70638e+00 3.39966e-01 1.37544e+02 201.206 -1.74124e+00 -6.75596e-01 0.00000e+00 0.00000e+00 5.71328e+01 201.206 8.04108e+01 21.206  0.6748 
1 1 1 -1  42  7  o 8  2.55525e+01 4.27285e-01 4.90111e+02 74.232  7.41637e+00  2.62645e+01  0.00000e+00 0.00000e+00 4.48357e+02 74.232  4.17547e+01 254.232 0.9815 
1 1 1 -1  42  8  o 5  4.29833e+00 6.05733e-01 9.81028e+01 148.850 -9.35702e-01 5.65569e-01  0.00000e+00 0.00000e+00 2.11812e+01 328.850 1.19284e+02 328.850 0.4785 
1 1 1 -1  42  9  o 3  2.41389e+01 4.78327e-01 4.08216e+02 162.081 -3.00952e+01 9.73173e+00  0.00000e+00 0.00000e+00 4.79704e+02 162.081 7.14885e+01 162.081 0.9841 
1 1 1 -1  42  10 o 9  1.96211e+01 4.63929e-01 4.39983e+02 125.852 -2.23753e+01 3.09645e+01  0.00000e+00 0.00000e+00 2.83330e+02 125.852 1.56653e+02 305.852 0.9868 
1 1 1 -1  42  11 o 15 6.98560e+00 6.15711e-01 1.11698e+02 131.210 -2.94008e+00 3.35727e+00  0.00000e+00 0.00000e+00 1.17585e+02 131.210 5.88712e+00 131.210 0.8792 
1 1 1 -1  42  12 o 10 1.56281e+01 4.81165e-01 2.84101e+02 248.214 -1.29077e+01 -3.22942e+01 0.00000e+00 0.00000e+00 2.90432e+02 248.214 6.33185e+00 248.214 0.9855 
1 1 1 -1  42  13 o 4  1.39692e+01 5.14026e-01 2.30406e+02 28.322  2.78840e+01  1.50279e+01  0.00000e+00 0.00000e+00 2.81984e+02 28.322  5.15783e+01 28.322  0.9841 
1 1 1 -1  42  14 o 8  1.10112e+01 5.70260e-01 1.36771e+02 228.663 -1.26584e+01 -1.43899e+01 0.00000e+00 0.00000e+00 2.62449e+02 228.663 1.25677e+02 228.663 0.9736 
1 1 1 -1  42  15 o 17 9.27920e+00 6.64982e-01 1.38835e+02 129.058 -1.20218e+01 1.48148e+01  0.00000e+00 0.00000e+00 1.97237e+02 129.058 5.84017e+01 129.058 0.9734 
1 1 1 -1  42  16 o 11 1.15042e+01 6.78909e-01 2.02200e+02 173.035 -3.67182e+01 4.48557e+00  0.00000e+00 0.00000e+00 2.19589e+02 173.035 1.73890e+01 173.035 0.9864 
1 1 1 -1  42  17 o 3  7.93572e+00 1.30646e+00 2.13924e+02 288.965 7.34133e+00  -2.13632e+01 0.00000e+00 0.00000e+00 7.41373e+01 288.965 1.39786e+02 108.965 0.9776 
1 1 1 -1  42  18 o 5  6.17187e+00 1.19871e+00 1.50463e+02 51.654  9.08836e+00  1.14887e+01  0.00000e+00 0.00000e+00 7.04921e+01 51.654  7.99705e+01 231.654 0.9652 
1 1 1 -1  42  19 o 16 3.73695e+00 1.24245e+00 6.51977e+01 104.778 -1.12741e+00 4.27363e+00  0.00000e+00 0.00000e+00 5.63420e+01 104.778 8.85564e+00 284.778 0.8779 
1 1 1 -1  43  1  o 13 3.18539e+01 4.74868e-01 5.95082e+02 295.788 9.86894e+00  -2.04253e+01 0.00000e+00 0.00000e+00 5.72141e+02 295.788 2.29406e+01 115.789 0.9777 
1 1 1 -1  43  2  o 16 2.53170e+01 4.02037e-01 4.78493e+02 233.532 -7.93927e+00 -1.07417e+01 0.00000e+00 0.00000e+00 4.33995e+02 233.532 4.44980e+01 53.531  0.9618 
1 1 1 -1  43  3  o 12 1.61220e+01 3.17492e-01 3.42508e+02 29.213  5.72883e+00  3.20347e+00  0.00000e+00 0.00000e+00 2.13393e+02 29.213  1.29116e+02 209.213 0.9203 
1 1 1 -1  43  4  o 4  3.06193e+01 4.65122e-01 4.14924e+02 137.716 -1.20505e+01 1.09587e+01  0.00000e+00 0.00000e+00 6.96197e+02 137.716 2.81273e+02 137.716 0.9688 
1 1 1 -1  43  5  o 4  3.00494e+01 4.60710e-01 4.64218e+02 0.208   2.21740e+01  8.05299e-02  0.00000e+00 0.00000e+00 6.35315e+02 0.208   1.71097e+02 0.208   0.9772 
1 1 1 -1  43  6  o 16 8.03839e+01 1.09993e+00 1.48632e+03 149.758 -1.70899e+02 9.96343e+01  0.00000e+00 0.00000e+00 1.51491e+03 149.758 2.85911e+01 149.758 0.9975 
1 1 1 -1  43  7  o 5  1.60936e+01 3.56861e-01 2.77050e+02 309.412 6.31391e+00  -7.68334e+00 0.00000e+00 0.00000e+00 2.93962e+02 309.412 1.69122e+01 309.412 0.9483 
1 1 1 -1  43  8  o 4  8.21182e+00 4.19953e-01 1.25400e+02 150.999 -2.47614e+00 1.37258e+00  0.00000e+00 0.00000e+00 1.19253e+02 150.999 6.14714e+00 330.999 0.7967 
1 1 1 -1  43  9  f 0  1.29632e+01 4.29834e-01 2.35750e+02 137.207 -7.43644e+00 6.88449e+00  0.00000e+00 0.00000e+00 2.24188e+02 137.207 1.15619e+01 317.207 0.9493 
1 1 1 -1  43  10 o 19 1.91324e+01 4.65620e-01 3.86190e+02 336.676 3.13933e+01  -1.35354e+01 0.00000e+00 0.00000e+00 3.17911e+02 336.676 6.82791e+01 156.676 0.9853 
1 1 1 -1  43  11 o 14 1.69057e+01 4.78016e-01 2.71791e+02 180.063 -2.84687e+01 -3.13464e-02 0.00000e+00 0.00000e+00 3.48056e+02 180.063 7.62654e+01 180.063 0.9823 
1 1 1 -1  43  12 o 8  3.59239e+00 8.22616e-01 1.08552e+02 172.611 -3.06542e+00 3.97537e-01  0.00000e+00 0.00000e+00 8.52493e-01 172.611 1.07699e+02 352.611 0.8165 
1 1 1 -1  43  13 o 11 6.53315e+00 6.66225e-01 1.13033e+02 28.510  6.18150e+00  3.35766e+00  0.00000e+00 0.00000e+00 1.12411e+02 28.510  6.21364e-01 208.510 0.9259 
1 1 1 -1  43  14 o 2  3.80388e+00 8.93347e-01 8.28922e+01 119.193 -1.83187e+00 3.27870e+00  0.00000e+00 0.00000e+00 3.79897e+01 119.193 4.49025e+01 299.193 0.8534 
1 1 1 -1  43  15 o 15 3.64419e+00 9.14275e-01 8.19685e+01 175.698 -3.88975e+00 2.92636e-01  0.00000e+00 0.00000e+00 3.45677e+01 175.698 4.74008e+01 355.698 0.8596 
1 1 1 -1  43  16 o 8  5.62274e+00 9.31604e-01 1.27686e+02 77.576  2.40543e+00  1.09184e+01  0.00000e+00 0.00000e+00 7.17080e+01 77.576  5.59784e+01 257.576 0.9542 
1 1 1 -1  43  17 o 1  1.81381e+01 7.51639e-01 2.85935e+02 321.917 7.44418e+01  -5.83338e+01 0.00000e+00 0.00000e+00 3.83898e+02 321.917 9.79632e+01 321.917 0.9947 
1 1 1 -1  43  18 o 7  3.75598e+00 1.11869e+00 4.82482e+01 280.241 5.33479e-01  -2.95294e+00 0.00000e+00 0.00000e+00 6.45833e+01 280.241 1.63351e+01 280.241 0.8100 
1 1 1 -1  43  19 o 17 6.77068e+00 1.14691e+00 6.97027e+01 88.758  1.99179e-01  9.18620e+00  0.00000e+00 0.00000e+00 1.67027e+02 88.758  9.73243e+01 88.758  0.9439 
1 1 1 -1  44  1  o 13 2.54461e+01 4.04236e-01 4.71873e+02 302.663 7.14909e+00  -1.11516e+01 0.00000e+00 0.00000e+00 4.44967e+02 302.663 2.69059e+01 122.663 0.9615 
1 1 1 -1  44  2  o 2  3.14879e+01 4.73028e-01 5.61377e+02 44.047  1.65966e+01  1.60537e+01  0.00000e+00 0.00000e+00 5.92612e+02 44.047  3.12347e+01 44.047  0.9781 
1 1 1 -1  44  3  o 11 1.23374e+01 2.92425e-01 3.20727e+02 45.184  3.43119e+00  3.45335e+00  0.00000e+00 0.00000e+00 9.07250e+01 45.184  2.30002e+02 225.184 0.8902 
1 1 1 -1  44  4  o 11 3.35933e+01 5.01305e-01 6.84904e+02 86.182  2.02773e+00  3.03826e+01  0.00000e+00 0.00000e+00 5.52415e+02 86.182  1.32489e+02 266.182 0.9834 
1 1 1 -1  44  5  o 11 2.75412e+01 4.35554e-01 4.69946e+02 264.456 -1.93459e+00 -1.99318e+01 0.00000e+00 0.00000e+00 5.35131e+02 264.456 6.51851e+01 264.456 0.9747 
1 1 1 -1  44  6  o 15 2.40789e+01 4.05101e-01 5.07870e+02 347.428 2.05215e+01  -4.57655e+00 0.00000e+00 0.00000e+00 3.71622e+02 347.428 1.36248e+02 167.428 0.9759 
1 1 1 -1  44  7  o 11 9.68175e+00 3.52344e-01 1.65143e+02 280.023 6.84596e-01  -3.87348e+00 0.00000e+00 0.00000e+00 1.46678e+02 280.023 1.84643e+01 100.023 0.8609 
1 1 1 -1  44  8  o 3  3.24107e+01 5.40605e-01 5.43606e+02 318.080 3.66020e+01  -3.28642e+01 0.00000e+00 0.00000e+00 6.55898e+02 318.080 1.12292e+02 318.080 0.9898 
1 1 1 -1  44  9  o 3  2.94171e+01 5.35996e-01 5.23808e+02 169.473 -5.38742e+01 1.00114e+01  0.00000e+00 0.00000e+00 5.65449e+02 169.473 4.16404e+01 169.473 0.9908 
1 1 1 -1  44  10 o 16 3.06421e+01 5.64910e-01 4.92684e+02 21.014  6.81241e+01  2.61701e+01  0.00000e+00 0.00000e+00 6.43855e+02 21.014  1.51171e+02 21.014  0.9931 
1 1 1 -1  44  11 o 10 1.48135e+01 4.81396e-01 2.48584e+02 146.903 -1.94713e+01 1.26920e+01  0.00000e+00 0.00000e+00 2.92260e+02 146.903 4.36754e+01 146.903 0.9782 
1 1 1 -1  44  12 o 10 1.61223e+01 5.19860e-01 1.87601e+02 180.480 -2.40343e+01 -2.01575e-01 0.00000e+00 0.00000e+00 4.01024e+02 180.480 2.13423e+02 180.480 0.9790 
1 1 1 -1  44  13 o 19 6.69409e+00 6.72712e-01 6.01834e+01 213.582 -3.53105e+00 -2.34447e+00 0.00000e+00 0.00000e+00 1.57364e+02 213.582 9.71803e+01 213.582 0.8721 
1 1 1 -1  44  14 o 10 1.71179e+01 5.51916e-01 2.20804e+02 319.921 3.63510e+01  -3.05872e+01 0.00000e+00 0.00000e+00 4.09787e+02 319.921 1.88982e+02 319.921 0.9894 
1 1 1 -1  44  15 o 2  7.85916e+00 7.61939e-01 1.88946e+02 135.751 -1.45508e+01 1.41744e+01  0.00000e+00 0.00000e+00 9.61068e+01 135.751 9.28394e+01 315.750 0.9751 
1 1 1 -1  44  16 o 18 7.37405e+00 1.25128e+00 1.44363e+02 224.104 -9.42181e+00 -9.13178e+00 0.00000e+00 0.00000e+00 1.19004e+02 224.104 2.53590e+01 44.104  0.9611 
1 1 1 -1  44  17 o 9  3.03174e+00 9.69586e-01 1.00659e+02 21.310  4.83739e+00  1.88701e+00  0.00000e+00 0.00000e+00 3.67509e-01 21.310  1.00291e+02 201.310 0.8977 
1 1 1 -1  44  18 o 1  7.64645e+00 1.06758e+00 1.10002e+02 169.183 -1.51125e+01 2.88742e+00  0.00000e+00 0.00000e+00 1.64160e+02 169.183 5.41583e+01 169.183 0.9669 
1 1 1 -1  44  19 o 4  4.55708e+00 1.36642e+00 6.84607e+01 193.628 -5.01177e+00 -1.21506e+00 0.00000e+00 0.00000e+00 8.29201e+01 193.628 1.44594e+01 193.628 0.8969 
1 1 1 -1  45  1  f 0  1.96538e+01 3.45335e-01 5.50469e+02 75.452  3.55986e+00  1.37178e+01  0.00000e+00 0.00000e+00 1.59476e+02 75.452  3.90993e+02 255.452 0.9640 
1 1 1 -1  45  2  o 10 1.15968e+01 3.16889e-01 1.68677e+02 101.883 -4.77402e-01 2.26868e+00  0.00000e+00 0.00000e+00 1.54443e+02 101.883 1.42340e+01 281.883 0.7437 
1 1 1 -1  45  3  o 19 2.77785e+01 4.32914e-01 5.55752e+02 183.821 -2.00401e+01 -1.33830e+00 0.00000e+00 0.00000e+00 4.58517e+02 183.821 9.72350e+01 3.821   0.9748 
1 1 1 -1  45  4  o 12 4.83347e+01 6.81376e-01 7.94291e+02 316.001 3.73415e+01  -3.60583e+01 0.00000e+00 0.00000e+00 9.98221e+02 316.001 2.03931e+02 316.001 0.9903 
1 1 1 -1  45  5  o 15 7.49776e+00 3.20417e-01 2.96222e+02 15.870  4.05377e+00  1.15244e+00  0.00000e+00 0.00000e+00 5.16624e+01 195.870 3.47884e+02 195.870 0.8713 
1 1 1 -1  45  6  o 7  3.91485e+01 5.73141e-01 6.94900e+02 158.930 -5.29852e+01 2.04133e+01  0.00000e+00 0.00000e+00 7.57156e+02 158.930 6.22552e+01 158.930 0.9912 
1 1 1 -1  45  7  o 11 2.42254e+01 4.19125e-01 4.49284e+02 236.887 -1.43422e+01 -2.19896e+01 0.00000e+00 0.00000e+00 4.39454e+02 236.887 9.83044e+00 56.887  0.9808 
1 1 1 -1  45  8  f 0  2.51676e+01 4.63922e-01 4.60456e+02 129.040 -2.20406e+01 2.71789e+01  0.00000e+00 0.00000e+00 4.66940e+02 129.040 6.48420e+00 129.040 0.9856 
1 1 1 -1  45  9  o 18 2.27786e+01 4.70766e-01 3.17639e+02 301.404 1.30641e+01  -2.13988e+01 0.00000e+00 0.00000e+00 5.16357e+02 301.404 1.98718e+02 301.404 0.9798 
1 1 1 -1  45  10 o 18 1.08153e+01 5.14529e-01 1.16262e+02 160.170 -5.60491e+00 2.02119e+00  0.00000e+00 0.00000e+00 2.51953e+02 160.170 1.35691e+02 160.170 0.9117 
1 1 1 -1  45  11 o 15 2.15844e+01 5.38539e-01 4.38610e+02 199.553 -6.13653e+01 -2.17942e+01 0.00000e+00 0.00000e+00 3.60656e+02 199.553 7.79538e+01 19.553  0.9923 
1 1 1 -1  45  12 o 6  2.35406e+01 5.39148e-01 4.10921e+02 236.087 -4.66340e+01 -6.93657e+01 0.00000e+00 0.00000e+00 4.61634e+02 236.087 5.07127e+01 236.087 0.9940 
1 1 1 -1  45  13 o 4  7.12016e+00 6.46400e-01 1.01792e+02 312.831 5.12270e+00  -5.52600e+00 0.00000e+00 0.00000e+00 1.45215e+02 312.831 4.34232e+01 312.831 0.9311 
1 1 1 -1  45  14 o 13 1.45907e+01 5.99600e-01 2.22155e+02 91.126  -8.68928e-01 4.42106e+01  0.00000e+00 0.00000e+00 3.14844e+02 91.126  9.26883e+01 91.126  0.9886 
1 1 1 -1  45  15 o 7  5.71723e+00 9.21704e-01 8.05795e+01 123.203 -3.64310e+00 5.56656e+00  0.00000e+00 0.00000e+00 1.15356e+02 123.203 3.47766e+01 123.203 0.9214 
1 1 1 -1  45  16 o 4  3.38748e+00 9.93281e-01 7.10096e+01 268.987 -6.49282e-02 -3.67079e+00 0.00000e+00 0.00000e+00 3.59236e+01 268.987 3.50859e+01 88.987  0.8496 
1 1 1 -1  45  17 o 18 8.79828e+00 9.69299e-01 1.05422e+02 283.106 3.29042e+00  -1.41332e+01 0.00000e+00 0.00000e+00 2.09686e+02 283.106 1.04264e+02 283.106 0.9649 
1 1 1 -1  45  18 o 3  3.79487e+00 1.09800e+00 1.46827e+01 16.632  9.46976e-01  2.82876e-01  0.00000e+00 0.00000e+00 4.75397e+01 16.632  3.28570e+01 16.632  0.4422 
1 1 1 -1  45  19 o 5  4.30508e+00 1.27335e+00 7.69039e+01 245.820 -2.35790e+00 -5.25159e+00 0.00000e+00 0.00000e+00 6.79224e+01 245.820 8.98150e+00 65.821  0.9084 
1 1 1 -1  46  1  o 7  1.77506e+01 3.31512e-01 2.38852e+02 6.022   4.99602e+00  5.27070e-01  0.00000e+00 0.00000e+00 3.55634e+02 6.022   1.16783e+02 6.022   0.8939 
1 1 1 -1  46  2  o 11 3.97706e+01 5.73636e-01 7.46371e+02 263.904 -3.84537e+00 -3.60054e+01 0.00000e+00 0.00000e+00 7.22717e+02 263.904 2.36537e+01 83.904  0.9861 
1 1 1 -1  46  3  o 9  2.46718e+01 4.00275e-01 4.82948e+02 341.519 1.44319e+01  -4.82362e+00 0.00000e+00 0.00000e+00 4.10180e+02 341.519 7.27678e+01 161.519 0.9666 
1 1 1 -1  46  4  o 15 3.43418e+01 5.12875e-01 4.64056e+02 199.495 -2.38791e+01 -8.45389e+00 0.00000e+00 0.00000e+00 7.96170e+02 199.495 3.32114e+02 199.495 0.9801 
1 1 1 -1  46  5  o 7  3.86234e+01 5.66541e-01 6.99238e+02 31.842  4.01256e+01  2.49197e+01  0.00000e+00 0.00000e+00 7.31105e+02 31.842  3.18670e+01 31.842  0.9894 
1 1 1 -1  46  6  f 0  2.51988e+01 4.20121e-01 3.89939e+02 178.665 -2.05377e+01 4.78768e-01  0.00000e+00 0.00000e+00 5.29690e+02 178.665 1.39750e+02 178.665 0.9753 
1 1 1 -1  46  7  o 18 1.00333e+01 3.61220e-01 1.19285e+02 194.909 -3.11244e+00 -8.28694e-01 0.00000e+00 0.00000e+00 1.90327e+02 194.909 7.10425e+01 194.909 0.8251 
1 1 1 -1  46  8  o 15 2.31588e+01 4.48933e-01 3.64949e+02 36.046  1.96109e+01  1.42725e+01  0.00000e+00 0.00000e+00 4.82743e+02 36.046  1.17794e+02 36.046  0.9792 
1 1 1 -1  46  9  o 9  1.28962e+01 4.67915e-01 2.46333e+02 89.480  1.13393e-01  1.24900e+01  0.00000e+00 0.00000e+00 2.15776e+02 89.480  3.05567e+01 269.480 0.9591 
1 1 1 -1  46  10 o 7  2.01184e+01 4.75735e-01 3.92320e+02 266.821 -2.23273e+00 -4.01956e+01 0.00000e+00 0.00000e+00 3.49477e+02 266.821 4.28429e+01 86.821  0.9875 
1 1 1 -1  46  11 o 11 1.36642e+01 4.78465e-01 2.47517e+02 13.805  2.35127e+01  5.77756e+00  0.00000e+00 0.00000e+00 2.51691e+02 13.805  4.17406e+00 13.805  0.9791 
1 1 1 -1  46  12 o 17 1.20745e+01 5.14846e-01 1.85311e+02 58.353  1.03072e+01  1.67233e+01  0.00000e+00 0.00000e+00 2.53275e+02 58.353  6.79641e+01 58.353  0.9742 
1 1 1 -1  46  13 f 0  9.83771e+00 5.57583e-01 1.59755e+02 74.739  4.43872e+00  1.62693e+01  0.00000e+00 0.00000e+00 1.95711e+02 74.739  3.59560e+01 74.739  0.9699 
1 1 1 -1  46  14 f 0  1.25715e+01 6.05260e-01 1.54186e+02 170.118 -2.48583e+01 4.33023e+00  0.00000e+00 0.00000e+00 3.04394e+02 170.118 1.50209e+02 170.118 0.9800 
1 1 1 -1  46  15 o 3  9.32595e+00 7.02926e-01 1.17207e+02 286.948 4.95479e+00  -1.62585e+01 0.00000e+00 0.00000e+00 2.19248e+02 286.948 1.02040e+02 286.948 0.9701 
1 1 1 -1  46  16 o 6  1.53307e+01 8.28850e-01 2.21876e+02 69.420  1.98559e+01  5.28812e+01  0.00000e+00 0.00000e+00 3.42621e+02 69.420  1.20745e+02 69.420  0.9911 
1 1 1 -1  46  17 o 9  9.07765e+00 1.33722e+00 1.63055e+02 209.709 -1.68362e+01 -9.60684e+00 0.00000e+00 0.00000e+00 1.65033e+02 209.709 1.97748e+00 209.709 0.9739 
1 1 1 -1  46  18 o 16 4.28420e+00 1.13847e+00 6.14604e+01 62.761  2.08452e+00  4.04934e+00  0.00000e+00 0.00000e+00 7.86064e+01 62.761  1.71460e+01 62.761  0.8819 
1 1 1 -1  46  19 o 5  4.69337e+00 1.27672e+00 1.24772e+02 187.060 -1.02444e+01 -1.26883e+00 0.00000e+00 0.00000e+00 4.03702e+01 187.060 8.44015e+01 7.060   0.9503 
1 1 1 -1  47  1  o 18 2.40958e+01 3.93681e-01 4.71779e+02 334.640 1.25782e+01  -5.96166e+00 0.00000e+00 0.00000e+00 3.97801e+02 334.640 7.39776e+01 154.641 0.9634 
1 1 1 -1  47  2  o 19 7.74988e+00 3.17291e-01 1.09706e+02 65.813  4.52841e-01  1.00823e+00  0.00000e+00 0.00000e+00 3.03348e+01 65.813  7.93716e+01 245.813 0.4824 
1 1 1 -1  47  3  o 10 1.89077e+01 3.50862e-01 2.82633e+02 248.555 -2.57949e+00 -6.56685e+00 0.00000e+00 0.00000e+00 3.73129e+02 248.555 9.04956e+01 248.555 0.9261 
1 1 1 -1  47  4  o 14 5.29218e+01 7.40844e-01 1.04455e+03 74.064  2.32568e+01  8.14487e+01  0.00000e+00 0.00000e+00 9.25034e+02 74.064  1.19513e+02 254.064 0.9941 
1 1 1 -1  47  5  o 7  1.75931e+01 3.93904e-01 2.37154e+02 112.803 -2.76397e+00 6.57417e+00  0.00000e+00 0.00000e+00 3.73213e+02 112.803 1.36059e+02 112.803 0.9270 
1 1 1 -1  47  6  o 15 1.00957e+01 3.55119e-01 1.89810e+02 50.824  2.63761e+00  3.23684e+00  0.00000e+00 0.00000e+00 1.38772e+02 50.824  5.10377e+01 230.824 0.8699 
1 1 1 -1  47  7  o 13 1.91505e+01 3.83834e-01 3.20120e+02 146.402 -1.33926e+01 8.89723e+00  0.00000e+00 0.00000e+00 3.73394e+02 146.402 5.32744e+01 146.402 0.9684 
1 1 1 -1  47  8  o 1  1.82064e+01 4.13758e-01 2.69975e+02 40.804  1.16324e+01  1.00420e+01  0.00000e+00 0.00000e+00 3.88007e+02 40.804  1.18033e+02 40.804  0.9669 
1 1 1 -1  47  9  o 3  1.88623e+01 4.31058e-01 3.07761e+02 137.574 -1.85530e+01 1.69568e+01  0.00000e+00 0.00000e+00 3.82708e+02 137.574 7.49471e+01 137.574 0.9799 
1 1 1 -1  47  10 o 5  1.15351e+01 4.84181e-01 1.41221e+02 206.072 -7.99913e+00 -3.91392e+00 0.00000e+00 0.00000e+00 2.64472e+02 206.072 1.23251e+02 206.072 0.9421 
1 1 1 -1  47  11 o 1  7.95465e+00 5.67775e-01 1.42376e+02 171.798 -8.35493e+00 1.20428e+00  0.00000e+00 0.00000e+00 1.36220e+02 171.798 6.15610e+00 351.798 0.9388 
1 1 1 -1  47  12 o 17 1.59344e+01 5.04993e-01 2.78144e+02 154.686 -3.70560e+01 1.75270e+01  0.00000e+00 0.00000e+00 3.08606e+02 154.686 3.04617e+01 154.686 0.9877 
1 1 1 -1  47  13 o 13 5.15681e+00 8.04098e-01 1.44177e+02 211.789 -6.69180e+00 -4.14738e+00 0.00000e+00 0.00000e+00 3.52660e+01 211.789 1.08911e+02 31.789  0.9341 
1 1 1 -1  47  14 o 19 1.47363e+01 6.04841e-01 2.07151e+02 317.928 3.15801e+01  -2.85069e+01 0.00000e+00 0.00000e+00 3.34820e+02 317.928 1.27669e+02 317.928 0.9882 
1 1 1 -1  47  15 o 7  4.11650e+00 9.80065e-01 7.78273e+01 154.910 -3.97120e+00 1.85937e+00  0.00000e+00 0.00000e+00 5.63891e+01 154.910 2.14382e+01 334.910 0.8768 
1 1 1 -1  47  16 o 7  7.03990e+00 1.04797e+00 9.83094e+01 159.316 -9.72403e+00 3.67131e+00  0.00000e+00 0.00000e+00 1.50284e+02 159.316 5.19750e+01 159.316 0.9506 
1 1 1 -1  47  17 o 19 9.34268e+00 9.70377e-01 1.64545e+02 245.151 -1.08303e+01 -2.33860e+01 0.00000e+00 0.00000e+00 1.75349e+02 245.151 1.08043e+01 245.151 0.9804 
1 1 1 -1  47  18 o 11 4.51040e+00 1.16952e+00 8.50992e+01 6.319   6.40025e+00  7.08762e-01  0.00000e+00 0.00000e+00 6.84928e+01 6.319   1.66064e+01 186.319 0.9187 
1 1 1 -1  47  19 o 17 2.87646e+00 9.38163e-01 4.22158e+01 341.454 2.76102e+00  -9.26260e-01 0.00000e+00 0.00000e+00 4.33310e+01 341.454 1.11517e+00 341.454 0.8033 
1 1 1 -1  48  1  o 14 2.68602e+01 4.25224e-01 5.45700e+02 344.220 1.82937e+01  -5.16977e+00 0.00000e+00 0.00000e+00 4.33526e+02 344.220 1.12174e+02 164.220 0.9733 
1 1 1 -1  48  2  o 19 8.72677e+00 4.17712e-01 1.49121e+02 264.364 -1.62601e-01 -1.64770e+00 0.00000e+00 0.00000e+00 5.75385e+01 264.364 9.15829e+01 84.364  0.6323 
1 1 1 -1  48  3  o 3  2.69909e+01 4.29927e-01 3.76185e+02 58.016  7.28445e+00  1.16648e+01  0.00000e+00 0.00000e+00 5.96970e+02 58.016  2.20786e+02 58.016  0.9629 
1 1 1 -1  48  4  o 17 2.34435e+01 3.96623e-01 4.47449e+02 214.604 -1.63537e+01 -1.12835e+01 0.00000e+00 0.00000e+00 4.07749e+02 214.604 3.97002e+01 34.604  0.9745 
1 1 1 -1  48  5  o 2  1.56980e+01 3.42493e-01 3.98050e+01 320.138 8.25057e-01  -6.88918e-01 0.00000e+00 0.00000e+00 2.37639e+02 320.138 1.97833e+02 320.138 0.4723 
1 1 1 -1  48  6  o 16 2.16547e+01 3.91091e-01 3.56620e+02 290.411 5.98452e+00  -1.60822e+01 0.00000e+00 0.00000e+00 4.29463e+02 290.411 7.28438e+01 290.411 0.9704 
1 1 1 -1  48  7  o 1  2.62167e+01 4.44936e-01 6.42096e+02 95.256  -4.23728e+00 4.60605e+01  0.00000e+00 0.00000e+00 3.27528e+02 95.256  3.14568e+02 275.256 0.9891 
1 1 1 -1  48  8  o 18 3.67198e+01 5.99027e-01 4.66161e+02 265.342 -4.42558e+00 -5.43134e+01 0.00000e+00 0.00000e+00 8.93508e+02 265.342 4.27347e+02 265.342 0.9908 
1 1 1 -1  48  9  o 10 3.63460e+00 7.27888e-01 1.24020e+02 254.272 -5.11670e-01 -1.81698e+00 0.00000e+00 0.00000e+00 3.19171e+01 74.273  1.55938e+02 74.273  0.6784 
1 1 1 -1  48  10 f 0  6.80690e+00 6.11414e-01 1.18230e+02 195.954 -4.57956e+00 -1.30921e+00 0.00000e+00 0.00000e+00 1.07298e+02 195.954 1.09317e+01 15.954  0.8876 
1 1 1 -1  48  11 o 18 8.49564e+00 5.51256e-01 1.74703e+02 158.594 -1.03676e+01 4.06424e+00  0.00000e+00 0.00000e+00 1.27629e+02 158.594 4.70740e+01 338.594 0.9540 
1 1 1 -1  48  12 f 0  1.33684e+01 5.05392e-01 2.35816e+02 275.306 2.69028e+00  -2.89674e+01 0.00000e+00 0.00000e+00 2.53858e+02 275.306 1.80413e+01 275.306 0.9827 
1 1 1 -1  48  13 o 17 9.86752e+00 6.05732e-01 2.03007e+02 3.105   2.09774e+01  1.13800e+00  0.00000e+00 0.00000e+00 1.55657e+02 3.105   4.73497e+01 183.105 0.9759 
1 1 1 -1  48  14 o 9  3.96821e+00 9.05011e-01 5.57719e+01 104.736 -7.05176e-01 2.68105e+00  0.00000e+00 0.00000e+00 6.11277e+01 104.736 5.35582e+00 104.736 0.7916 
1 1 1 -1  48  15 o 14 8.73703e+00 8.56447e-01 1.68227e+02 330.898 1.87400e+01  -1.04312e+01 0.00000e+00 0.00000e+00 1.48941e+02 330.898 1.92860e+01 150.898 0.9764 
1 1 1 -1  48  16 o 4  1.31469e+01 8.78170e-01 2.01545e+02 18.543  3.92658e+01  1.31706e+01  0.00000e+00 0.00000e+00 2.80825e+02 18.543  7.92798e+01 18.543  0.9879 
1 1 1 -1  48  17 o 3  7.58926e+00 1.01493e+00 8.52165e+01 78.775  2.11332e+00  1.06484e+01  0.00000e+00 0.00000e+00 1.83069e+02 78.775  9.78528e+01 78.775  0.9528 
1 1 1 -1  48  18 o 5  7.38896e+00 1.09765e+00 1.19701e+02 0.902   1.63997e+01  2.58144e-01  0.00000e+00 0.00000e+00 1.45664e+02 0.902   2.59630e+01 0.902   0.9690 
1 1 1 -1  48  19 o 3  3.65011e+00 1.07947e+00 9.53372e+01 129.373 -5.19050e+00 6.32508e+00  0.00000e+00 0.00000e+00 3.12366e+01 129.373 6.41007e+01 309.373 0.9367 
1 1 1 -1  49  1  o 7  7.77784e+00 3.13711e-01 1.50946e+02 268.391 -4.37725e-02 -1.55863e+00 0.00000e+00 0.00000e+00 2.68647e+01 268.391 1.24081e+02 88.391  0.6104 
1 1 1 -1  49  2  o 4  1.99675e+01 4.12394e-01 4.39580e+02 7.694   1.18442e+01  1.60020e+00  0.00000e+00 0.00000e+00 2.76113e+02 7.694   1.63466e+02 187.694 0.9572 
1 1 1 -1  49  3  o 17 5.29574e+01 7.41411e-01 9.08095e+02 316.755 5.48225e+01  -5.15630e+01 0.00000e+00 0.00000e+00 1.06131e+03 316.755 1.53218e+02 316.755 0.9933 
1 1 1 -1  49  4  o 7  1.48295e+01 3.28369e-01 2.98992e+02 265.975 -5.47868e-01 -7.78695e+00 0.00000e+00 0.00000e+00 2.19179e+02 265.975 7.98136e+01 85.975  0.9336 
1 1 1 -1  49  5  o 14 2.86567e+01 4.54974e-01 4.43770e+02 182.318 -2.65888e+01 -1.07643e+00 0.00000e+00 0.00000e+00 6.08130e+02 182.318 1.64360e+02 182.318 0.9810 
1 1 1 -1  49  6  o 13 1.08534e+01 3.48358e-01 1.05426e+02 221.885 -2.08838e+00 -1.87280e+00 0.00000e+00 0.00000e+00 2.17091e+02 221.885 1.11665e+02 221.885 0.7945 
1 1 1 -1  49  7  o 9  1.67198e+01 3.81249e-01 2.22821e+02 123.386 -5.76899e+00 8.75389e+00  0.00000e+00 0.00000e+00 3.71669e+02 123.386 1.48847e+02 123.386 0.9510 
1 1 1 -1  49  8  f 0  3.68095e+01 6.00660e-01 5.87704e+02 330.081 6.14390e+01  -3.53566e+01 0.00000e+00 0.00000e+00 7.78047e+02 330.081 1.90343e+02 330.081 0.9929 
1 1 1 -1  49  9  o 9  1.46697e+01 4.24141e-01 2.36355e+02 177.916 -1.53477e+01 5.58531e-01  0.00000e+00 0.00000e+00 2.93364e+02 177.916 5.70085e+01 177.916 0.9669 
1 1 1 -1  49  10 o 17 6.24246e+00 6.37896e-01 5.99064e+01 34.324  1.74492e+00  1.19137e+00  0.00000e+00 0.00000e+00 1.06790e+02 34.324  4.68835e+01 34.324  0.7155 
1 1 1 -1  49  11 o 15 2.05966e+00 6.62056e-01 1.31227e+02 238.146 -1.02854e+00 -1.65537e+00 0.00000e+00 0.00000e+00 7.82818e+01 58.146  2.09509e+02 58.146  0.6892 
1 1 1 -1  49  12 o 2  2.01720e+01 5.36640e-01 2.93560e+02 69.197  2.04119e+01  5.37261e+01  0.00000e+00 0.00000e+00 4.51690e+02 69.197  1.58129e+02 69.197  0.9913 
1 1 1 -1  49  13 o 1  4.41189e+00 8.44443e-01 9.28290e+01 115.279 -1.85380e+00 3.92553e+00  0.00000e+00 0.00000e+00 5.10120e+01 115.279 4.18171e+01 295.279 0.8755 
1 1 1 -1  49  14 o 16 4.64541e+00 9.54926e-01 5.27633e+01 268.000 -1.08389e-01 -3.10381e+00 0.00000e+00 0.00000e+00 8.85410e+01 268.000 3.57777e+01 268.000 0.8175 
1 1 1 -1  49  15 o 10 5.94803e+00 9.85014e-01 1.13434e+02 49.505  6.00640e+00  7.03393e+00  0.00000e+00 0.00000e+00 9.53594e+01 49.505  1.80743e+01 229.505 0.9443 
1 1 1 -1  49  16 o 5  6.14932e+00 1.10858e+00 8.58399e+01 60.082  3.89715e+00  6.77248e+00  0.00000e+00 0.00000e+00 1.27371e+02 60.082  4.15310e+01 60.082  0.9336 
1 1 1 -1  49  17 o 12 4.20912e+00 1.12774e+00 5.18536e+01 274.119 2.47941e-01  -3.44259e+00 0.00000e+00 0.00000e+00 7.90839e+01 274.119 2.72303e+01 274.119 0.8385 
1 1 1 -1  49  18 o 14 6.04528e+00 1.14228e+00 1.13038e+02 85.560  9.48167e-01  1.22108e+01  0.00000e+00 0.00000e+00 1.01633e+02 85.560  1.14050e+01 265.560 0.9583 
1 1 1 -1  49  19 o 10 9.40625e+00 9.77746e-01 1.28505e+02 256.634 -6.75155e+00 -2.84151e+01 0.00000e+00 0.00000e+00 2.13642e+02 256.634 8.51374e+01 256.634 0.9827 
1 1 1 -1  50  1  o 19 3.39727e+01 5.07796e-01 6.36193e+02 323.793 2.36766e+01  -1.73331e+01 0.00000e+00 0.00000e+00 6.14053e+02 323.793 2.21397e+01 143.793 0.9828 
1 1 1 -1  50  2  o 17 2.78332e+01 5.03516e-01 4.49872e+02 112.370 -7.56673e+00 1.83855e+01  0.00000e+00 0.00000e+00 5.65654e+02 112.370 1.15782e+02 112.370 0.9745 
1 1 1 -1  50  3  o 19 2.44931e+01 4.06814e-01 3.41491e+02 317.623 1.17226e+01  -1.06955e+01 0.00000e+00 0.00000e+00 5.45984e+02 317.623 2.04492e+02 317.623 0.9680 
1 1 1 -1  50  4  o 19 1.07254e+01 3.23440e-01 1.06272e+02 214.149 -1.61348e+00 -1.09441e+00 0.00000e+00 0.00000e+00 1.70411e+02 214.149 6.41397e+01 214.149 0.6893 
1 1 1 -1  50  5  o 9  2.41276e+01 4.10308e-01 3.11764e+02 31.881  1.39394e+01  8.66997e+00  0.00000e+00 0.00000e+00 5.62949e+02 31.881  2.51185e+02 31.881  0.9690 
1 1 1 -1  50  6  o 10 8.12323e+00 3.79272e-01 7.95996e+01 72.725  5.16961e-01  1.66234e+00  0.00000e+00 0.00000e+00 1.17952e+02 72.725  3.83519e+01 72.725  0.6503 
1 1 1 -1  50  7  o 11 3.36773e+01 5.24454e-01 6.83272e+02 191.649 -6.77989e+01 -1.39782e+01 0.00000e+00 0.00000e+00 5.66501e+02 191.649 1.16771e+02 11.650  0.9928 
1 1 1 -1  50  8  o 15 1.84089e+01 4.62846e-01 2.75426e+02 346.227 1.75650e+01  -4.30554e+00 0.00000e+00 0.00000e+00 3.93084e+02 346.227 1.17658e+02 346.227 0.9719 
1 1 1 -1  50  9  o 15 1.06398e+01 4.57021e-01 1.47584e+02 61.969  3.40598e+00  6.39737e+00  0.00000e+00 0.00000e+00 2.21196e+02 61.969  7.36128e+01 61.969  0.9282 
1 1 1 -1  50  10 o 13 2.50008e+01 5.19307e-01 4.44538e+02 48.289  4.26617e+01  4.78632e+01  0.00000e+00 0.00000e+00 4.81153e+02 48.289  3.66152e+01 48.289  0.9922 
1 1 1 -1  50  11 o 2  1.29363e+01 5.01949e-01 2.26346e+02 101.006 -4.36291e+00 2.24325e+01  0.00000e+00 0.00000e+00 2.45412e+02 101.006 1.90660e+01 101.006 0.9779 
1 1 1 -1  50  12 o 11 7.01376e+00 7.37707e-01 1.48561e+02 135.905 -7.01224e+00 6.79425e+00  0.00000e+00 0.00000e+00 9.90401e+01 135.905 4.95210e+01 315.905 0.9473 
1 1 1 -1  50  13 o 1  2.44524e+00 7.67587e-01 7.49909e+01 174.417 -2.07597e+00 2.02927e-01  0.00000e+00 0.00000e+00 1.02198e+01 354.417 8.52108e+01 354.417 0.7114 
1 1 1 -1  50  14 o 15 1.30232e+01 6.25767e-01 2.53385e+02 266.300 -2.91083e+00 -4.50079e+01 0.00000e+00 0.00000e+00 2.25718e+02 266.300 2.76666e+01 86.300  0.9889 
1 1 1 -1  50  15 o 14 9.81674e+00 8.51592e-01 1.61677e+02 338.080 2.23939e+01  -9.01125e+00 0.00000e+00 0.00000e+00 1.95560e+02 338.080 3.38824e+01 338.080 0.9791 
1 1 1 -1  50  16 o 3  4.40084e+00 1.13247e+00 1.25681e+02 270.012 1.69690e-03  -7.97041e+00 0.00000e+00 0.00000e+00 2.71072e+01 270.012 9.85739e+01 90.012  0.9350 
1 1 1 -1  50  17 o 8  7.25752e+00 1.06542e+00 9.44685e+01 126.566 -7.00154e+00 9.43933e+00  0.00000e+00 0.00000e+00 1.63016e+02 126.566 6.85472e+01 126.566 0.9565 
1 1 1 -1  50  18 o 7  6.86505e+00 1.16515e+00 8.36976e+01 339.371 9.96957e+00  -3.75306e+00 0.00000e+00 0.00000e+00 1.58416e+02 339.371 7.47188e+01 339.371 0.9518 
1 1 1 -1  50  19 o 3  5.14801e+00 1.16144e+00 3.76425e+01 33.860  3.36292e+00  2.25637e+00  0.00000e+00 0.00000e+00 1.27236e+02 33.860  8.95939e+01 33.860  0.8654 
1 1 1 -1  51  1  o 1  5.00732e+01 7.04945e-01 9.26647e+02 152.380 -6.47407e+01 3.38746e+01  0.00000e+00 0.00000e+00 9.35220e+02 152.380 8.57256e+00 152.380 0.9931 
1 1 1 -1  51  2  o 15 1.62131e+01 5.01852e-01 2.08946e+02 288.666 1.67256e+00  -4.95100e+00 0.00000e+00 0.00000e+00 3.36310e+02 288.666 1.27364e+02 288.666 0.8984 
1 1 1 -1  51  3  o 10 3.22680e+01 4.92484e-01 6.46116e+02 44.655  2.60328e+01  2.57212e+01  0.00000e+00 0.00000e+00 5.44989e+02 44.655  1.01127e+02 224.655 0.9862 
1 1 1 -1  51  4  o 8  1.60814e+01 3.91896e-01 3.75453e+02 255.787 -2.54531e+00 -1.00496e+01 0.00000e+00 0.00000e+00 1.96485e+02 255.787 1.78967e+02 75.787  0.9505 
1 1 1 -1  51  5  o 7  2.29746e+01 4.01970e-01 4.36384e+02 295.727 9.69124e+00  -2.01127e+01 0.00000e+00 0.00000e+00 4.03543e+02 295.727 3.28414e+01 115.727 0.9773 
1 1 1 -1  51  6  o 18 5.57091e+00 4.57191e-01 9.14222e+01 293.980 5.41486e-01  -1.21735e+00 0.00000e+00 0.00000e+00 2.35388e+01 293.980 6.78834e+01 113.980 0.5519 
1 1 1 -1  51  7  o 7  2.00317e+01 4.03110e-01 3.53844e+02 109.249 -7.57868e+00 2.17029e+01  0.00000e+00 0.00000e+00 3.78392e+02 109.249 2.45478e+01 109.249 0.9780 
1 1 1 -1  51  8  o 17 3.48398e+00 7.20683e-01 4.55833e+01 104.928 -1.38804e-01 5.20643e-01  0.00000e+00 0.00000e+00 1.17323e+01 284.928 5.73157e+01 284.928 0.2601 
1 1 1 -1  51  9  o 7  1.99763e+01 4.49169e-01 4.05449e+02 13.481  3.75722e+01  9.00732e+00  0.00000e+00 0.00000e+00 3.30681e+02 13.481  7.47679e+01 193.481 0.9870 
1 1 1 -1  51  10 o 17 3.63433e+01 6.40439e-01 6.45194e+02 157.609 -1.33981e+02 5.51990e+01  0.00000e+00 0.00000e+00 7.06211e+02 157.609 6.10165e+01 157.609 0.9965 
1 1 1 -1  51  11 o 9  2.56799e+01 5.93954e-01 4.30935e+02 274.073 6.53319e+00  -9.17581e+01 0.00000e+00 0.00000e+00 5.21399e+02 274.073 9.04638e+01 274.073 0.9945 
1 1 1 -1  51  12 o 9  1.54074e+01 5.85682e-01 3.14734e+02 127.040 -2.83639e+01 3.75849e+01  0.00000e+00 0.00000e+00 2.53223e+02 127.040 6.15108e+01 307.040 0.9893 
1 1 1 -1  51  13 o 13 1.05549e+01 6.45789e-01 1.55051e+02 44.220  1.46092e+01  1.42169e+01  0.00000e+00 0.00000e+00 2.28148e+02 44.220  7.30970e+01 44.220  0.9752 
1 1 1 -1  51  14 o 18 1.14762e+01 7.28238e-01 1.70419e+02 300.156 1.34190e+01  -2.30969e+01 0.00000e+00 0.00000e+00 2.48404e+02 300.156 7.79851e+01 300.156 0.9811 
1 1 1 -1  51  15 o 11 6.10895e+00 1.43462e+00 2.11986e+02 321.733 1.06814e+01  -8.42573e+00 0.00000e+00 0.00000e+00 6.53566e+00 321.733 2.05450e+02 141.733 0.9625 
1 1 1 -1  51  16 o 7  5.74172e+00 1.14125e+00 9.53216e+01 98.270  -1.14845e+00 7.90119e+00  0.00000e+00 0.00000e+00 1.04017e+02 98.270  8.69530e+00 98.270  0.9351 
1 1 1 -1  51  17 o 14 6.52003e+00 1.08481e+00 9.86987e+01 171.164 -1.06764e+01 1.65973e+00  0.00000e+00 0.00000e+00 1.31639e+02 171.164 3.29405e+01 171.164 0.9525 
1 1 1 -1  51  18 o 18 2.71191e+00 9.12540e-01 3.84515e+01 48.986  1.58662e+00  1.82430e+00  0.00000e+00 0.00000e+00 3.74765e+01 48.986  9.75011e-01 228.986 0.7557 
1 1 1 -1  51  19 f 0  6.79688e+00 1.13738e+00 4.47848e+01 168.204 -6.78653e+00 1.41727e+00  0.00000e+00 0.00000e+00 1.87805e+02 168.204 1.43020e+02 168.204 0.9248 
1 1 1 -1  52  1  o 13 6.15833e+00 3.48985e-01 2.00927e+02 267.701 -7.67912e-02 -1.91243e+00 0.00000e+00 0.00000e+00 4.34419e+01 87.701  2.44369e+02 87.701  0.6831 
1 1 1 -1  52  2  f 0  4.72105e+01 7.24120e-01 8.02341e+02 54.950  4.05717e+01  5.78343e+01  0.00000e+00 0.00000e+00 9.52187e+02 54.950  1.49846e+02 54.950  0.9929 
1 1 1 -1  52  3  o 1  4.72304e+01 6.72109e-01 9.82329e+02 344.038 7.55457e+01  -2.16075e+01 0.00000e+00 0.00000e+00 7.73869e+02 344.038 2.08460e+02 164.038 0.9936 
1 1 1 -1  52  4  o 5  1.92274e+01 4.20759e-01 3.16430e+02 229.957 -8.20146e+00 -9.75913e+00 0.00000e+00 0.00000e+00 3.74107e+02 229.957 5.76772e+01 229.957 0.9599 
1 1 1 -1  52  5  o 11 1.80034e+01 3.63817e-01 3.93586e+02 218.551 -1.36122e+01 -1.08473e+01 0.00000e+00 0.00000e+00 2.60126e+02 218.551 1.33461e+02 38.551  0.9708 
1 1 1 -1  52  6  o 7  3.26667e+01 5.10336e-01 6.35394e+02 347.532 5.55225e+01  -1.22761e+01 0.00000e+00 0.00000e+00 5.75135e+02 347.532 6.02589e+01 167.532 0.9912 
1 1 1 -1  52  7  o 10 4.34973e+01 6.41847e-01 6.78682e+02 136.960 -6.64316e+01 6.20342e+01  0.00000e+00 0.00000e+00 9.37882e+02 136.960 2.59200e+02 136.960 0.9945 
1 1 1 -1  52  8  o 11 9.17708e+00 4.51114e-01 1.02531e+02 307.190 2.23266e+00  -2.94247e+00 0.00000e+00 0.00000e+00 1.89046e+02 307.190 8.65158e+01 307.190 0.8506 
1 1 1 -1  52  9  o 5  9.09677e+00 4.74895e-01 1.92820e+02 329.123 7.68258e+00  -4.59378e+00 0.00000e+00 0.00000e+00 1.27202e+02 329.123 6.56184e+01 149.123 0.9424 
1 1 1 -1  52  10 o 3  1.33824e+01 4.79298e-01 2.29160e+02 135.854 -1.52397e+01 1.47918e+01  0.00000e+00 0.00000e+00 2.58214e+02 135.854 2.90545e+01 135.854 0.9762 
1 1 1 -1  52  11 o 5  2.01610e+01 5.71767e-01 4.42636e+02 75.644  1.90405e+01  7.43958e+01  0.00000e+00 0.00000e+00 3.04111e+02 75.644  1.38525e+02 255.644 0.9935 
1 1 1 -1  52  12 o 7  1.30514e+01 5.84722e-01 1.76796e+02 39.175  1.92460e+01  1.56827e+01  0.00000e+00 0.00000e+00 2.99540e+02 39.175  1.22744e+02 39.175  0.9796 
1 1 1 -1  52  13 o 16 7.39592e+00 7.31776e-01 1.65562e+02 54.291  9.02793e+00  1.25597e+01  0.00000e+00 0.00000e+00 1.00698e+02 54.291  6.48646e+01 234.291 0.9671 
1 1 1 -1  52  14 o 9  6.41761e+00 9.52067e-01 1.45617e+02 245.806 -4.92177e+00 -1.09545e+01 0.00000e+00 0.00000e+00 8.29078e+01 245.806 6.27093e+01 65.806  0.9574 
1 1 1 -1  52  15 o 3  6.86140e+00 1.06779e+00 1.06483e+02 193.211 -1.00813e+01 -2.36660e+00 0.00000e+00 0.00000e+00 1.35834e+02 193.211 2.93515e+01 193.211 0.9504 
1 1 1 -1  52  16 o 16 1.77397e+01 7.48436e-01 2.35341e+02 41.829  5.25480e+01  4.70316e+01  0.00000e+00 0.00000e+00 4.18503e+02 41.829  1.83162e+02 41.829  0.9929 
1 1 1 -1  52  17 o 6  4.41807e+00 1.17570e+00 7.69948e+01 315.118 3.86983e+00  -3.85395e+00 0.00000e+00 0.00000e+00 7.09624e+01 315.118 6.03241e+00 135.118 0.9031 
1 1 1 -1  52  18 o 4  3.23263e+00 1.04620e+00 1.63983e+01 230.813 -7.21470e-01 -8.85014e-01 0.00000e+00 0.00000e+00 4.28012e+01 230.813 2.64029e+01 230.813 0.4944 
1 1 1 -1  52  19 o 2  4.81979e+00 1.23334e+00 7.90340e+01 322.607 6.16778e+00  -4.71438e+00 0.00000e+00 0.00000e+00 8.73738e+01 322.607 8.33979e+00 322.607 0.9332 
1 1 1 -1  53  1  o 11 3.14343e+01 4.82447e-01 6.19676e+02 5.638   3.64805e+01  3.60160e+00  0.00000e+00 0.00000e+00 5.40730e+02 5.638   7.89467e+01 185.638 0.9863 
1 1 1 -1  53  2  o 4  3.16272e+01 4.86209e-01 4.26327e+02 5.857   2.34443e+01  2.40501e+00  0.00000e+00 0.00000e+00 7.31910e+02 5.857   3.05583e+02 5.857   0.9785 
1 1 1 -1  53  3  o 15 2.18811e+01 3.87614e-01 2.81476e+02 87.981  3.72662e-01  1.05731e+01  0.00000e+00 0.00000e+00 4.97543e+02 87.981  2.16068e+02 87.981  0.9515 
1 1 1 -1  53  4  o 7  2.66743e+01 5.06978e-01 6.62885e+02 152.005 -3.38882e+01 1.80146e+01  0.00000e+00 0.00000e+00 3.21853e+02 152.005 3.41031e+02 332.005 0.9869 
1 1 1 -1  53  5  o 5  5.49651e+00 4.40488e-01 4.99140e+01 357.794 6.59650e-01  -2.54153e-02 0.00000e+00 0.00000e+00 1.44847e+01 357.794 3.54293e+01 177.794 0.3133 
1 1 1 -1  53  6  o 7  1.85650e+01 3.85004e-01 2.49029e+02 285.446 3.46406e+00  -1.25368e+01 0.00000e+00 0.00000e+00 4.17729e+02 285.446 1.68700e+02 285.446 0.9608 
1 1 1 -1  53  7  o 12 1.84307e+01 3.95842e-01 2.90701e+02 91.344  -4.04165e-01 1.72216e+01  0.00000e+00 0.00000e+00 3.77673e+02 91.344  8.69720e+01 91.344  0.9705 
1 1 1 -1  53  8  o 12 1.30568e+01 4.17396e-01 2.08026e+02 292.573 4.49745e+00  -1.08190e+01 0.00000e+00 0.00000e+00 2.58306e+02 292.573 5.02804e+01 292.573 0.9563 
1 1 1 -1  53  9  o 17 1.58784e+01 4.38569e-01 2.74323e+02 213.182 -2.00099e+01 -1.30853e+01 0.00000e+00 0.00000e+00 3.05824e+02 213.182 3.15017e+01 213.182 0.9789 
1 1 1 -1  53  10 o 2  1.03766e+01 5.12246e-01 1.89124e+02 93.891  -9.47675e-01 1.39344e+01  0.00000e+00 0.00000e+00 1.83828e+02 93.891  5.29587e+00 273.891 0.9635 
1 1 1 -1  53  11 o 1  6.88364e+00 6.99587e-01 1.82272e+02 257.407 -2.31893e+00 -1.03806e+01 0.00000e+00 0.00000e+00 6.19547e+01 257.407 1.20317e+02 77.407  0.9518 
1 1 1 -1  53  12 o 1  8.07013e+00 6.73590e-01 1.95249e+02 88.011  5.64624e-01  1.62578e+01  0.00000e+00 0.00000e+00 9.59695e+01 88.011  9.92794e+01 268.011 0.9688 
1 1 1 -1  53  13 o 10 1.11976e+01 6.92529e-01 2.22248e+02 291.157 1.08372e+01  -2.80030e+01 0.00000e+00 0.00000e+00 1.87522e+02 291.157 3.47263e+01 111.157 0.9832 
1 1 1 -1  53  14 o 6  5.15329e+00 9.98643e-01 1.30588e+02 209.696 -7.23463e+00 -4.12597e+00 0.00000e+00 0.00000e+00 4.91477e+01 209.696 8.14400e+01 29.696  0.9379 
1 1 1 -1  53  15 o 3  4.72289e+00 9.97724e-01 7.51583e+01 291.288 1.93584e+00  -4.96834e+00 0.00000e+00 0.00000e+00 8.28620e+01 291.288 7.70370e+00 291.288 0.9006 
1 1 1 -1  53  16 o 9  6.42953e+00 1.04770e+00 1.37124e+02 293.064 5.40906e+00  -1.27033e+01 0.00000e+00 0.00000e+00 9.27062e+01 293.064 4.44173e+01 113.064 0.9631 
1 1 1 -1  53  17 o 14 5.16805e+00 1.17058e+00 9.34529e+01 202.882 -7.16735e+00 -3.02496e+00 0.00000e+00 0.00000e+00 8.53888e+01 202.882 8.06409e+00 22.882  0.9333 
1 1 1 -1  53  18 o 9  6.58261e+00 1.24690e+00 1.25612e+02 27.996  1.24664e+01  6.62751e+00  0.00000e+00 0.00000e+00 1.09385e+02 27.996  1.62277e+01 207.996 0.9639 
1 1 1 -1  53  19 o 1  3.93098e+00 1.17087e+00 5.45970e+01 140.303 -3.73068e+00 3.09693e+00  0.00000e+00 0.00000e+00 7.47896e+01 140.303 2.01926e+01 140.303 0.8897 
1 1 1 -1  54  1  o 3  3.01468e+01 4.70639e-01 5.08487e+02 215.276 -2.14108e+01 -1.51462e+01 0.00000e+00 0.00000e+00 5.98001e+02 215.276 8.95146e+01 215.276 0.9807 
1 1 1 -1  54  2  o 6  1.35075e+01 3.56177e-01 2.77082e+02 206.504 -5.76838e+00 -2.87657e+00 0.00000e+00 0.00000e+00 1.87298e+02 206.504 8.97833e+01 26.505  0.9188 
1 1 1 -1  54  3  o 15 8.86683e+00 3.46329e-01 2.13881e+02 278.154 5.65030e-01  -3.94342e+00 0.00000e+00 0.00000e+00 7.23610e+01 278.154 1.41520e+02 98.154  0.8629 
1 1 1 -1  54  4  o 19 3.30176e+01 5.84264e-01 5.47061e+02 46.106  2.76271e+01  2.87150e+01  0.00000e+00 0.00000e+00 6.72275e+02 46.106  1.25215e+02 46.106  0.9874 
1 1 1 -1  54  5  o 2  1.26473e+01 3.48843e-01 2.96337e+02 5.925   1.00114e+01  1.03902e+00  0.00000e+00 0.00000e+00 1.52405e+02 5.925   1.43933e+02 185.925 0.9489 
1 1 1 -1  54  6  o 15 2.21928e+01 4.11960e-01 2.86875e+02 1.774   1.83770e+01  5.69125e-01  0.00000e+00 0.00000e+00 5.19728e+02 1.774   2.32853e+02 1.774   0.9724 
1 1 1 -1  54  7  o 8  2.75463e+01 4.67757e-01 4.55031e+02 198.784 -3.91300e+01 -1.33088e+01 0.00000e+00 0.00000e+00 5.61570e+02 198.784 1.06540e+02 198.784 0.9878 
1 1 1 -1  54  8  o 19 1.38150e+01 4.17304e-01 2.47394e+02 321.631 1.18839e+01  -9.40848e+00 0.00000e+00 0.00000e+00 2.51158e+02 321.631 3.76398e+00 321.631 0.9664 
1 1 1 -1  54  9  o 14 1.97107e+01 4.53357e-01 3.45193e+02 74.497  1.09584e+01  3.95058e+01  0.00000e+00 0.00000e+00 3.81393e+02 74.497  3.62000e+01 74.497  0.9877 
1 1 1 -1  54  10 o 17 4.09229e+00 8.38027e-01 2.13036e+02 72.571  1.84467e+00  5.87604e+00  0.00000e+00 0.00000e+00 7.34148e+01 252.571 2.86450e+02 252.571 0.9148 
1 1 1 -1  54  11 o 14 7.37510e+00 6.68855e-01 2.44683e+02 128.914 -1.01535e+01 1.25772e+01  0.00000e+00 0.00000e+00 2.15576e+01 128.914 2.23125e+02 308.914 0.9686 
1 1 1 -1  54  12 o 7  1.49942e+01 5.80624e-01 2.56701e+02 57.845  2.18536e+01  3.47634e+01  0.00000e+00 0.00000e+00 2.94905e+02 57.845  3.82047e+01 57.845  0.9877 
1 1 1 -1  54  13 o 12 1.14442e+01 7.49618e-01 1.67945e+02 208.911 -2.18039e+01 -1.20420e+01 0.00000e+00 0.00000e+00 2.49304e+02 208.911 8.13585e+01 208.911 0.9797 
1 1 1 -1  54  14 o 7  7.11992e+00 9.20489e-01 1.39797e+02 306.025 8.45992e+00  -1.16335e+01 0.00000e+00 0.00000e+00 1.15561e+02 306.025 2.42358e+01 126.025 0.9646 
1 1 1 -1  54  15 o 17 4.81162e+00 1.07279e+00 7.22942e+01 154.528 -4.27629e+00 2.03710e+00  0.00000e+00 0.00000e+00 8.62299e+01 154.528 1.39357e+01 154.528 0.8869 
1 1 1 -1  54  16 o 10 9.19128e+00 8.75268e-01 1.85875e+02 340.908 2.75434e+01  -9.53357e+00 0.00000e+00 0.00000e+00 1.49318e+02 340.908 3.65570e+01 160.908 0.9827 
1 1 1 -1  54  17 f 0  2.76165e+00 9.17482e-01 4.96714e+01 83.886  2.76958e-01  2.58568e+00  0.00000e+00 0.00000e+00 2.97241e+01 83.886  1.99473e+01 263.886 0.7755 
1 1 1 -1  54  18 o 5  4.92498e+00 1.16754e+00 7.68335e+01 144.210 -5.92955e+00 4.27497e+00  0.00000e+00 0.00000e+00 9.25652e+01 144.210 1.57318e+01 144.210 0.9288 
1 1 1 -1  55  1  o 7  7.82892e+01 1.07404e+00 1.51084e+03 311.708 1.31104e+02  -1.47106e+02 0.00000e+00 0.00000e+00 1.41116e+03 311.708 9.96741e+01 131.708 0.9975 
1 1 1 -1  55  2  o 18 1.10448e+01 3.31187e-01 8.06692e+01 313.736 1.29626e+00  -1.35473e+00 0.00000e+00 0.00000e+00 1.98727e+02 313.736 1.18057e+02 313.736 0.6761 
1 1 1 -1  55  3  o 1  3.18077e+01 4.92705e-01 6.44798e+02 150.522 -3.87784e+01 2.19196e+01  0.00000e+00 0.00000e+00 5.31574e+02 150.522 1.13224e+02 330.523 0.9887 
1 1 1 -1  55  4  o 6  1.05474e+01 3.88486e-01 2.65073e+02 36.895  5.47374e+00  4.10909e+00  0.00000e+00 0.00000e+00 9.92892e+01 36.895  1.65784e+02 216.895 0.9238 
1 1 1 -1  55  5  o 4  1.32561e+01 3.60364e-01 2.62535e+02 105.603 -2.58403e+00 9.25323e+00  0.00000e+00 0.00000e+00 2.06494e+02 105.603 5.60410e+01 285.603 0.9464 
1 1 1 -1  55  6  o 19 3.40824e+01 5.67360e-01 6.03159e+02 0.410   6.59640e+01  4.71791e-01  0.00000e+00 0.00000e+00 6.60833e+02 0.410   5.76737e+01 0.410   0.9924 
1 1 1 -1  55  7  o 15 9.34798e+00 4.25373e-01 2.45540e+02 1.030   7.97315e+00  1.43388e-01  0.00000e+00 0.00000e+00 8.09572e+01 1.030   1.64583e+02 181.030 0.9350 
1 1 1 -1  55  8  o 11 2.12423e+01 4.33390e-01 4.41848e+02 335.929 3.96412e+01  -1.77086e+01 0.00000e+00 0.00000e+00 3.42063e+02 335.929 9.97842e+01 155.929 0.9884 
1 1 1 -1  55  9  o 1  8.29726e+00 5.14829e-01 1.63226e+02 80.266  1.32525e+00  7.72522e+00  0.00000e+00 0.00000e+00 1.25901e+02 80.266  3.73252e+01 260.266 0.9338 
1 1 1 -1  55  10 o 3  7.22069e+00 6.41893e-01 8.10456e+01 161.191 -4.01484e+00 1.36747e+00  0.00000e+00 0.00000e+00 1.53813e+02 161.191 7.27677e+01 161.191 0.8722 
1 1 1 -1  55  11 o 1  6.78168e+00 7.04786e-01 1.30933e+02 336.059 7.19025e+00  -3.19248e+00 0.00000e+00 0.00000e+00 1.05139e+02 336.059 2.57935e+01 156.059 0.9341 
1 1 1 -1  55  12 o 8  7.80840e+00 7.23766e-01 1.93145e+02 159.602 -1.53240e+01 5.69819e+00  0.00000e+00 0.00000e+00 8.85918e+01 159.602 1.04553e+02 339.602 0.9689 
1 1 1 -1  55  13 o 15 1.02705e+01 7.33942e-01 1.82250e+02 94.206  -1.71250e+00 2.32860e+01  0.00000e+00 0.00000e+00 1.91627e+02 94.206  9.37721e+00 94.206  0.9783 
1 1 1 -1  55  14 o 3  7.58464e+00 9.54729e-01 1.76268e+02 311.995 1.24105e+01  -1.37858e+01 0.00000e+00 0.00000e+00 9.79931e+01 311.995 7.82752e+01 131.995 0.9727 
1 1 1 -1  55  15 o 15 1.10347e+01 7.37919e-01 2.12478e+02 102.841 -9.08656e+00 3.98634e+01  0.00000e+00 0.00000e+00 1.92328e+02 102.841 2.01499e+01 282.841 0.9877 
1 1 1 -1  55  16 o 11 4.37135e+00 1.08523e+00 1.13204e+02 238.246 -3.81438e+00 -6.16301e+00 0.00000e+00 0.00000e+00 3.73508e+01 238.246 7.58534e+01 58.246  0.9282 
1 1 1 -1  55  17 o 9  6.93039e+00 1.17643e+00 9.73279e+01 180.253 -1.13973e+01 -5.03923e-02 0.00000e+00 0.00000e+00 1.48015e+02 180.253 5.06875e+01 180.253 0.9551 
1 1 1 -1  55  18 o 2  4.17632e+00 1.16424e+00 5.46122e+01 109.998 -1.49676e+00 4.11285e+00  0.00000e+00 0.00000e+00 8.09354e+01 109.998 2.63232e+01 109.998 0.8766 
1 1 1 -1  56  1  o 1  2.52987e+01 4.23921e-01 4.08730e+02 204.827 -1.96681e+01 -9.09933e+00 0.00000e+00 0.00000e+00 5.15656e+02 204.827 1.06926e+02 204.827 0.9766 
1 1 1 -1  56  2  o 14 9.84626e+00 3.63171e-01 2.01757e+02 68.773  1.50404e+00  3.87217e+00  0.00000e+00 0.00000e+00 1.18389e+02 68.773  8.33681e+01 248.773 0.8692 
1 1 1 -1  56  3  o 1  3.01728e+01 4.75918e-01 5.04747e+02 272.226 1.31101e+00  -3.37264e+01 0.00000e+00 0.00000e+00 6.06884e+02 272.226 1.02138e+02 272.226 0.9851 
1 1 1 -1  56  4  f 0  1.97908e+01 4.12946e-01 4.97796e+02 357.230 2.64398e+01  -1.27912e+00 0.00000e+00 0.00000e+00 2.28084e+02 357.230 2.69712e+02 177.230 0.9809 
1 1 1 -1  56  5  o 7  2.63138e+01 4.47072e-01 3.93846e+02 97.780  -3.93939e+00 2.88315e+01  0.00000e+00 0.00000e+00 5.72689e+02 97.780  1.78843e+02 97.780  0.9827 
1 1 1 -1  56  6  o 15 3.05791e+01 4.95845e-01 5.51783e+02 1.331   5.23667e+01  1.21658e+00  0.00000e+00 0.00000e+00 5.79849e+02 1.331   2.80663e+01 1.331   0.9904 
1 1 1 -1  56  7  o 12 1.67561e+01 3.98837e-01 3.69706e+02 356.926 2.44060e+01  -1.31058e+00 0.00000e+00 0.00000e+00 2.43175e+02 356.926 1.26532e+02 176.926 0.9793 
1 1 1 -1  56  8  o 1  1.63706e+01 4.13805e-01 2.33822e+02 102.222 -3.87551e+00 1.78919e+01  0.00000e+00 0.00000e+00 3.60362e+02 102.222 1.26540e+02 102.222 0.9723 
1 1 1 -1  56  9  o 7  6.65332e+00 5.68033e-01 1.98424e+02 347.699 7.89254e+00  -1.72093e+00 0.00000e+00 0.00000e+00 3.38906e+01 347.699 1.64534e+02 167.699 0.9359 
1 1 1 -1  56  10 o 4  1.28299e+01 5.22052e-01 2.05088e+02 21.886  1.90141e+01  7.63822e+00  0.00000e+00 0.00000e+00 2.61466e+02 21.886  5.63781e+01 21.886  0.9753 
1 1 1 -1  56  11 o 14 8.27819e+00 6.64420e-01 1.41759e+02 48.992  7.26744e+00  8.35802e+00  0.00000e+00 0.00000e+00 1.52420e+02 48.992  1.06612e+01 48.992  0.9537 
1 1 1 -1  56  12 o 5  2.14439e+01 6.78162e-01 4.13079e+02 350.106 8.97229e+01  -1.56495e+01 0.00000e+00 0.00000e+00 3.80947e+02 350.106 3.21320e+01 170.106 0.9945 
1 1 1 -1  56  13 o 6  5.21607e+00 9.92284e-01 9.69679e+01 222.700 -4.48395e+00 -4.13763e+00 0.00000e+00 0.00000e+00 8.03787e+01 222.700 1.65892e+01 42.700  0.9139 
1 1 1 -1  56  14 o 10 3.46334e+00 9.23518e-01 1.03979e+02 31.607  4.31420e+00  2.65488e+00  0.00000e+00 0.00000e+00 1.12237e+01 31.607  9.27557e+01 211.607 0.8949 
1 1 1 -1  56  15 o 15 2.91540e+00 8.83371e-01 6.16752e+01 308.519 1.84696e+00  -2.32040e+00 0.00000e+00 0.00000e+00 2.57420e+01 308.519 3.59332e+01 128.519 0.8074 
1 1 1 -1  56  16 f 0  3.49865e+00 1.03039e+00 2.64376e+01 342.587 1.40419e+00  -4.40387e-01 0.00000e+00 0.00000e+00 5.00194e+01 342.587 2.35819e+01 342.587 0.5890 
1 1 1 -1  56  17 o 3  6.73599e+00 1.20073e+00 3.96139e+01 309.353 2.78458e+00  -3.39572e+00 0.00000e+00 0.00000e+00 1.79335e+02 309.353 1.39721e+02 309.353 0.8771 
1 1 1 -1  56  18 o 3  3.44978e+00 1.09626e+00 6.13562e+01 297.544 2.03030e+00  -3.89288e+00 0.00000e+00 0.00000e+00 5.06486e+01 297.544 1.07076e+01 117.544 0.8770 
1 1 1 -1  57  1  o 12 3.98435e+01 5.85577e-01 6.91926e+02 225.244 -4.20428e+01 -4.24024e+01 0.00000e+00 0.00000e+00 7.85957e+02 225.244 9.40313e+01 225.244 0.9916 
1 1 1 -1  57  2  o 1  2.76911e+01 4.84197e-01 6.13066e+02 304.001 2.10796e+01  -3.12508e+01 0.00000e+00 0.00000e+00 4.08802e+02 304.001 2.04264e+02 124.001 0.9866 
1 1 1 -1  57  3  o 12 1.66284e+01 3.62417e-01 3.18061e+02 51.498  8.06411e+00  1.01374e+01  0.00000e+00 0.00000e+00 2.79248e+02 51.498  3.88126e+01 231.498 0.9606 
1 1 1 -1  57  4  o 3  3.78209e+01 5.67225e-01 5.90903e+02 36.544  4.66691e+01  3.45885e+01  0.00000e+00 0.00000e+00 8.10811e+02 36.544  2.19908e+02 36.544  0.9914 
1 1 1 -1  57  5  o 10 8.41576e+00 4.13208e-01 1.90905e+02 272.580 2.18896e-01  -4.85695e+00 0.00000e+00 0.00000e+00 8.90466e+01 272.580 1.01859e+02 92.580  0.8901 
1 1 1 -1  57  6  o 7  1.10910e+01 3.97070e-01 1.59487e+02 275.414 5.35467e-01  -5.64982e+00 0.00000e+00 0.00000e+00 2.16328e+02 275.414 5.68411e+01 275.414 0.9070 
1 1 1 -1  57  7  o 15 1.78945e+01 4.04172e-01 2.43584e+02 320.708 1.46011e+01  -1.19475e+01 0.00000e+00 0.00000e+00 4.06689e+02 320.708 1.63106e+02 320.708 0.9731 
1 1 1 -1  57  8  o 16 2.20537e+01 4.42145e-01 2.86086e+02 351.505 3.19107e+01  -4.76625e+00 0.00000e+00 0.00000e+00 5.24197e+02 351.505 2.38111e+02 351.505 0.9844 
1 1 1 -1  57  9  o 18 2.35327e+01 5.63938e-01 4.22990e+02 285.188 1.62492e+01  -5.98578e+01 0.00000e+00 0.00000e+00 4.47755e+02 285.188 2.47657e+01 285.188 0.9919 
1 1 1 -1  57  10 o 5  4.76727e+00 7.92318e-01 6.59372e+01 184.883 -2.49828e+00 -2.13412e-01 0.00000e+00 0.00000e+00 7.01641e+01 184.883 4.22699e+00 184.883 0.7658 
1 1 1 -1  57  11 o 4  7.08912e+00 7.01272e-01 1.23176e+02 119.584 -4.07385e+00 7.17593e+00  0.00000e+00 0.00000e+00 1.24366e+02 119.584 1.18972e+00 119.584 0.9373 
1 1 1 -1  57  12 o 11 5.28980e+00 9.47503e-01 8.60396e+01 147.355 -4.09591e+00 2.62399e+00  0.00000e+00 0.00000e+00 8.92505e+01 147.355 3.21097e+00 147.355 0.8901 
1 1 1 -1  57  13 o 18 4.98910e+00 1.02504e+00 1.03542e+02 288.875 2.05023e+00  -5.99674e+00 0.00000e+00 0.00000e+00 6.66925e+01 288.875 3.68491e+01 108.875 0.9173 
1 1 1 -1  57  14 f 0  3.47472e+00 9.49400e-01 9.57621e+01 55.167  2.65044e+00  3.80875e+00  0.00000e+00 0.00000e+00 1.84363e+01 55.167  7.73258e+01 235.167 0.8843 
1 1 1 -1  57  15 o 17 3.92194e+00 1.02978e+00 6.96132e+01 142.112 -3.10916e+00 2.41937e+00  0.00000e+00 0.00000e+00 5.57923e+01 142.112 1.38208e+01 322.112 0.8612 
1 1 1 -1  57  16 o 10 3.51492e+00 1.02521e+00 2.88972e+01 183.459 -1.64364e+00 -9.93605e-02 0.00000e+00 0.00000e+00 5.32892e+01 183.459 2.43919e+01 183.459 0.6303 
1 1 1 -1  57  17 o 19 6.87256e+00 1.21906e+00 9.72496e+01 107.788 -3.27718e+00 1.02143e+01  0.00000e+00 0.00000e+00 1.45237e+02 107.788 4.79874e+01 107.788 0.9522 
1 1 1 -1  57  18 o 10 6.32631e+00 1.32412e+00 1.19739e+02 318.256 9.58388e+00  -8.55222e+00 0.00000e+00 0.00000e+00 1.05115e+02 318.256 1.46247e+01 138.256 0.9602 
1 1 1 -1  58  1  o 16 3.85935e+01 5.71495e-01 5.81626e+02 47.266  3.36495e+01  3.64220e+01  0.00000e+00 0.00000e+00 8.47174e+02 47.266  2.65548e+02 47.266  0.9899 
1 1 1 -1  58  2  o 17 3.61521e+01 5.44038e-01 6.61119e+02 286.003 1.60558e+01  -5.59825e+01 0.00000e+00 0.00000e+00 6.79163e+02 286.003 1.80443e+01 286.003 0.9914 
1 1 1 -1  58  3  o 5  2.65487e+01 4.43319e-01 3.77277e+02 56.119  1.49750e+01  2.23013e+01  0.00000e+00 0.00000e+00 5.96691e+02 56.119  2.19414e+02 56.119  0.9812 
1 1 1 -1  58  4  o 19 1.80643e+01 3.78830e-01 5.22707e+02 308.995 1.63494e+01  -2.01935e+01 0.00000e+00 0.00000e+00 1.39396e+02 308.995 3.83311e+02 128.995 0.9806 
1 1 1 -1  58  5  o 1  2.08102e+01 4.41005e-01 3.91947e+02 45.555  1.84725e+01  1.88341e+01  0.00000e+00 0.00000e+00 3.70794e+02 45.555  2.11533e+01 225.555 0.9809 
1 1 1 -1  58  6  o 17 2.74005e+01 4.65899e-01 5.21537e+02 196.744 -4.88335e+01 -1.46915e+01 0.00000e+00 0.00000e+00 4.91877e+02 196.744 2.96596e+01 16.744  0.9901 
1 1 1 -1  58  7  o 11 3.20882e+01 5.20277e-01 5.20552e+02 34.570  6.05727e+01  4.17394e+01  0.00000e+00 0.00000e+00 6.69356e+02 34.570  1.48804e+02 34.570  0.9932 
1 1 1 -1  58  8  o 4  2.07440e+01 4.39398e-01 3.45497e+02 349.798 3.86687e+01  -6.95928e+00 0.00000e+00 0.00000e+00 4.18720e+02 349.798 7.32232e+01 349.798 0.9872 
1 1 1 -1  58  9  o 4  5.94332e+00 7.04684e-01 1.24282e+02 35.707  4.14605e+00  2.98002e+00  0.00000e+00 0.00000e+00 7.42870e+01 35.707  4.99952e+01 215.707 0.8958 
1 1 1 -1  58  10 o 9  4.57754e+00 8.37466e-01 1.33174e+02 260.111 -8.49815e-01 -4.87462e+00 0.00000e+00 0.00000e+00 1.90518e+01 260.111 1.14122e+02 80.111  0.8922 
1 1 1 -1  58  11 o 1  2.26972e+00 7.25376e-01 1.30441e+01 46.802  1.90188e-01  2.02547e-01  0.00000e+00 0.00000e+00 1.41094e+00 226.802 1.44550e+01 226.802 0.1376 
1 1 1 -1  58  12 o 19 1.62229e+01 6.61122e-01 3.26895e+02 283.996 1.59081e+01  -6.38242e+01 0.00000e+00 0.00000e+00 2.72333e+02 283.996 5.45618e+01 103.996 0.9924 
1 1 1 -1  58  13 o 17 7.76827e+00 7.75458e-01 8.12909e+01 191.041 -8.03814e+00 -1.56841e+00 0.00000e+00 0.00000e+00 1.89361e+02 191.041 1.08070e+02 191.041 0.9368 
1 1 1 -1  58  14 o 4  7.57477e+00 8.50531e-01 1.84663e+02 37.013  1.63129e+01  1.22983e+01  0.00000e+00 0.00000e+00 8.98313e+01 37.013  9.48320e+01 217.013 0.9752 
1 1 1 -1  58  15 o 3  9.28982e+00 8.56784e-01 8.53841e+01 225.037 -9.60565e+00 -9.61814e+00 0.00000e+00 0.00000e+00 2.46560e+02 225.037 1.61176e+02 225.037 0.9625 
1 1 1 -1  58  16 o 4  9.16611e+00 1.00090e+00 1.16434e+02 37.486  1.43336e+01  1.09930e+01  0.00000e+00 0.00000e+00 2.13972e+02 37.486  9.75388e+01 37.486  0.9719 
1 1 1 -1  58  17 o 1  9.52285e+00 1.04525e+00 1.45198e+02 208.845 -2.21896e+01 -1.22217e+01 0.00000e+00 0.00000e+00 2.00582e+02 208.845 5.53847e+01 208.845 0.9801 
1 1 1 -1  58  18 o 8  2.63742e+00 9.00482e-01 4.77399e+01 330.582 2.71443e+00  -1.53060e+00 0.00000e+00 0.00000e+00 3.21238e+01 330.582 1.56161e+01 150.582 0.8182 
1 1 1 -1  59  1  o 5  2.68854e+01 4.43281e-01 5.04445e+02 337.210 3.05567e+01  -1.28387e+01 0.00000e+00 0.00000e+00 4.85647e+02 337.210 1.87971e+01 157.210 0.9848 
1 1 1 -1  59  2  o 6  4.48678e+00 4.97744e-01 1.03639e+02 236.458 -6.16146e-01 -9.29427e-01 0.00000e+00 0.00000e+00 2.21591e+01 56.458  1.25798e+02 56.458  0.4857 
1 1 1 -1  59  3  o 16 2.15801e+01 4.00362e-01 4.64585e+02 254.220 -7.13877e+00 -2.52623e+01 0.00000e+00 0.00000e+00 3.26618e+02 254.220 1.37967e+02 74.220  0.9808 
1 1 1 -1  59  4  o 7  1.17787e+01 3.88430e-01 2.52686e+02 316.174 6.52443e+00  -6.26245e+00 0.00000e+00 0.00000e+00 1.62421e+02 316.174 9.02650e+01 136.174 0.9430 
1 1 1 -1  59  5  o 3  2.63243e+01 4.55128e-01 4.76932e+02 164.229 -3.75885e+01 1.06159e+01  0.00000e+00 0.00000e+00 4.93908e+02 164.229 1.69763e+01 164.229 0.9871 
1 1 1 -1  59  6  o 8  2.15637e+01 4.21005e-01 3.36523e+02 152.703 -2.23581e+01 1.15383e+01  0.00000e+00 0.00000e+00 4.52655e+02 152.703 1.16132e+02 152.703 0.9799 
1 1 1 -1  59  7  o 19 1.54474e+01 4.46147e-01 2.43542e+02 314.510 1.21970e+01  -1.24074e+01 0.00000e+00 0.00000e+00 3.16301e+02 314.510 7.27583e+01 314.510 0.9708 
1 1 1 -1  59  8  o 13 1.42116e+01 4.78329e-01 2.97592e+02 269.517 -2.05675e-01 -2.44146e+01 0.00000e+00 0.00000e+00 2.21701e+02 269.517 7.58917e+01 89.517  0.9793 
1 1 1 -1  59  9  o 18 7.60918e+00 6.46545e-01 1.40220e+02 214.946 -6.42725e+00 -4.49137e+00 0.00000e+00 0.00000e+00 1.24772e+02 214.946 1.54473e+01 34.946  0.9339 
1 1 1 -1  59  10 o 13 9.10965e+00 5.66055e-01 1.29142e+02 33.151  8.57377e+00  5.59997e+00  0.00000e+00 0.00000e+00 1.93332e+02 33.151  6.41893e+01 33.151  0.9498 
1 1 1 -1  59  11 o 15 2.31146e+00 7.28845e-01 3.58385e+01 14.212  8.18158e-01  2.07209e-01  0.00000e+00 0.00000e+00 2.40319e+00 194.212 3.82417e+01 194.212 0.3884 
1 1 1 -1  59  12 o 12 9.52805e+00 7.24249e-01 2.19492e+02 254.120 -7.25492e+00 -2.55017e+01 0.00000e+00 0.00000e+00 1.28345e+02 254.120 9.11462e+01 74.120  0.9810 
1 1 1 -1  59  13 o 11 2.21065e+01 6.45526e-01 4.04079e+02 79.925  2.33203e+01  1.31246e+02  0.00000e+00 0.00000e+00 4.14871e+02 79.925  1.07920e+01 79.925  0.9962 
1 1 1 -1  59  14 o 10 1.02360e+01 7.11136e-01 1.54089e+02 315.182 1.68758e+01  -1.67687e+01 0.00000e+00 0.00000e+00 2.18131e+02 315.182 6.40417e+01 315.182 0.9788 
1 1 1 -1  59  15 o 18 3.54379e+00 1.00345e+00 6.18592e+01 94.190  -2.49157e-01 3.40070e+00  0.00000e+00 0.00000e+00 4.81424e+01 94.190  1.37168e+01 274.190 0.8363 
1 1 1 -1  59  16 o 14 5.13380e+00 1.21749e+00 1.08381e+02 101.572 -1.66105e+00 8.11242e+00  0.00000e+00 0.00000e+00 7.00968e+01 101.572 3.82843e+01 281.572 0.9375 
1 1 1 -1  59  17 o 16 1.02881e+01 1.01286e+00 1.40860e+02 295.765 1.24268e+01  -2.57458e+01 0.00000e+00 0.00000e+00 2.33519e+02 295.765 9.26588e+01 295.765 0.9824 
1 1 1 -1  59  18 o 18 3.04688e+00 1.01847e+00 3.52936e+01 306.694 1.56134e+00  -2.09519e+00 0.00000e+00 0.00000e+00 5.22778e+01 306.694 1.69842e+01 306.694 0.7767 
1 1 1 -1  60  1  o 16 1.68478e+01 3.62331e-01 2.80909e+02 126.608 -7.59727e+00 1.02268e+01  0.00000e+00 0.00000e+00 3.23758e+02 126.608 4.28493e+01 126.608 0.9599 
1 1 1 -1  60  2  o 1  7.41435e+00 4.04028e-01 1.69196e+02 219.648 -2.53184e+00 -2.09813e+00 0.00000e+00 0.00000e+00 6.06458e+01 219.648 1.08550e+02 39.648  0.8292 
1 1 1 -1  60  3  o 2  2.18341e+01 4.06185e-01 3.01081e+02 172.273 -1.83539e+01 2.49022e+00  0.00000e+00 0.00000e+00 4.92660e+02 172.273 1.91579e+02 172.273 0.9726 
1 1 1 -1  60  4  o 2  1.72499e+01 3.79998e-01 3.90353e+02 127.461 -1.17995e+01 1.53993e+01  0.00000e+00 0.00000e+00 2.37386e+02 127.461 1.52968e+02 307.461 0.9739 
1 1 1 -1  60  5  o 9  1.35102e+01 3.83803e-01 2.63036e+02 208.677 -1.03618e+01 -5.66749e+00 0.00000e+00 0.00000e+00 2.19778e+02 208.677 4.32586e+01 28.677  0.9567 
1 1 1 -1  60  6  o 9  1.58702e+01 4.46725e-01 1.46322e+02 98.875  -1.55075e+00 9.93175e+00  0.00000e+00 0.00000e+00 4.15992e+02 98.875  2.69670e+02 98.875  0.9489 
1 1 1 -1  60  7  o 8  7.95235e+00 4.75446e-01 1.33227e+02 1.828   5.14740e+00  1.64302e-01  0.00000e+00 0.00000e+00 1.32947e+02 1.828   2.80052e-01 181.828 0.8967 
1 1 1 -1  60  8  o 10 1.33544e+01 4.78361e-01 1.55809e+02 34.049  9.99944e+00  6.75714e+00  0.00000e+00 0.00000e+00 3.21285e+02 34.049  1.65476e+02 34.049  0.9576 
1 1 1 -1  60  9  o 7  2.73616e+01 6.22260e-01 4.73405e+02 308.809 6.01097e+01  -7.47365e+01 0.00000e+00 0.00000e+00 5.41451e+02 308.809 6.80455e+01 308.809 0.9948 
1 1 1 -1  60  10 o 7  8.29663e+00 6.48679e-01 1.54330e+02 346.891 1.12071e+01  -2.60979e+00 0.00000e+00 0.00000e+00 1.41067e+02 346.891 1.32630e+01 166.891 0.9555 
1 1 1 -1  60  11 o 16 6.01117e+00 8.24011e-01 6.83417e+01 73.815  1.18307e+00  4.07610e+00  0.00000e+00 0.00000e+00 1.26912e+02 73.815  5.85700e+01 73.815  0.8723 
1 1 1 -1  60  12 o 11 1.09424e+01 6.88870e-01 2.07710e+02 297.072 1.24912e+01  -2.44398e+01 0.00000e+00 0.00000e+00 1.91961e+02 297.072 1.57491e+01 117.072 0.9816 
1 1 1 -1  60  13 o 18 6.91226e+00 8.16709e-01 1.51056e+02 202.335 -1.31507e+01 -5.40290e+00 0.00000e+00 0.00000e+00 9.67275e+01 202.335 5.43286e+01 22.335  0.9642 
1 1 1 -1  60  14 o 15 5.83365e+00 9.66564e-01 1.28646e+02 304.279 6.33587e+00  -9.29548e+00 0.00000e+00 0.00000e+00 7.81892e+01 304.279 5.04571e+01 124.279 0.9545 
1 1 1 -1  60  15 o 12 2.35513e+00 8.01575e-01 3.28120e+01 57.512  7.36759e-01  1.15702e+00  0.00000e+00 0.00000e+00 1.63776e+01 57.512  1.64344e+01 237.512 0.5628 
1 1 1 -1  60  16 o 2  1.03474e+01 8.91751e-01 1.37394e+02 356.301 2.70568e+01  -1.74924e+00 0.00000e+00 0.00000e+00 2.39105e+02 356.301 1.01711e+02 356.301 0.9814 
1 1 1 -1  60  17 o 9  5.05397e+00 1.32523e+00 9.25654e+01 187.100 -7.57103e+00 -9.43053e-01 0.00000e+00 0.00000e+00 8.18827e+01 187.100 1.06827e+01 7.100   0.9320 
1 1 1 -1  60  18 o 18 3.40573e+00 1.07661e+00 3.88411e+01 301.778 1.54227e+00  -2.48955e+00 0.00000e+00 0.00000e+00 6.25329e+01 301.778 2.36918e+01 301.778 0.8046 
1 1 1 -1  61  1  o 3  3.01276e+00 6.33394e-01 1.48307e+02 207.098 -1.02955e+00 -5.26795e-01 0.00000e+00 0.00000e+00 9.20961e+01 27.098  2.40403e+02 27.098  0.4991 
1 1 1 -1  61  2  o 18 9.63446e+00 4.00611e-01 1.52248e+02 76.245  9.59434e-01  3.91930e+00  0.00000e+00 0.00000e+00 1.59197e+02 76.245  6.94888e+00 76.245  0.8649 
1 1 1 -1  61  3  o 10 1.61283e+01 3.69449e-01 3.63585e+02 168.982 -1.74791e+01 3.40315e+00  0.00000e+00 0.00000e+00 2.21962e+02 168.982 1.41622e+02 348.982 0.9715 
1 1 1 -1  61  4  o 5  1.76230e+01 3.85527e-01 2.58254e+02 309.991 9.14979e+00  -1.09076e+01 0.00000e+00 0.00000e+00 3.76596e+02 309.991 1.18342e+02 309.991 0.9642 
1 1 1 -1  61  5  o 15 1.02925e+01 4.03415e-01 2.74573e+02 66.757  3.99097e+00  9.29236e+00  0.00000e+00 0.00000e+00 9.03099e+01 66.757  1.84263e+02 246.757 0.9492 
1 1 1 -1  61  6  o 5  1.46312e+01 3.90520e-01 9.24230e+01 75.222  1.48754e+00  5.63885e+00  0.00000e+00 0.00000e+00 4.04486e+02 75.222  3.12063e+02 75.222  0.9097 
1 1 1 -1  61  7  o 12 1.43349e+01 4.61884e-01 1.22186e+02 161.321 -8.46947e+00 2.86322e+00  0.00000e+00 0.00000e+00 3.81902e+02 161.321 2.59715e+02 161.321 0.9423 
1 1 1 -1  61  8  o 2  3.97796e+00 7.78958e-01 7.10581e+01 32.759  1.40532e+00  9.04249e-01  0.00000e+00 0.00000e+00 2.32623e+01 32.759  4.77958e+01 212.759 0.6357 
1 1 1 -1  61  9  o 3  7.15947e+00 6.48256e-01 1.59376e+02 277.077 1.07213e+00  -8.63597e+00 0.00000e+00 0.00000e+00 9.16847e+01 277.077 6.76917e+01 97.077  0.9407 
1 1 1 -1  61  10 o 19 7.63450e+00 6.81172e-01 1.83650e+02 105.126 -3.25911e+00 1.20573e+01  0.00000e+00 0.00000e+00 8.91467e+01 105.126 9.45032e+01 285.126 0.9591 
1 1 1 -1  61  11 o 19 4.71351e+00 9.07973e-01 5.36889e+01 346.963 2.52139e+00  -5.83824e-01 0.00000e+00 0.00000e+00 8.21823e+01 346.963 2.84934e+01 346.963 0.7743 
1 1 1 -1  61  12 o 7  1.35970e+01 5.77357e-01 2.37068e+02 260.638 -7.18714e+00 -4.35927e+01 0.00000e+00 0.00000e+00 2.63025e+02 260.638 2.59570e+01 260.638 0.9886 
1 1 1 -1  61  13 o 18 4.45636e+00 9.52708e-01 1.28754e+02 61.502  3.89495e+00  7.17415e+00  0.00000e+00 0.00000e+00 2.63980e+01 61.502  1.02356e+02 241.502 0.9366 
1 1 1 -1  61  14 o 19 7.99510e+00 8.30859e-01 1.19313e+02 194.906 -1.51345e+01 -4.02857e+00 0.00000e+00 0.00000e+00 1.67991e+02 194.906 4.86786e+01 194.906 0.9675 
1 1 1 -1  61  15 o 6  2.77211e+00 8.82705e-01 4.79971e+01 19.329  1.98195e+00  6.95206e-01  0.00000e+00 0.00000e+00 2.54047e+01 19.329  2.25924e+01 199.329 0.7136 
1 1 1 -1  61  16 o 16 4.22859e+00 1.10865e+00 5.68727e+01 47.929  2.71201e+00  3.00447e+00  0.00000e+00 0.00000e+00 7.87700e+01 47.929  2.18972e+01 47.929  0.8653 
1 1 1 -1  61  17 o 16 4.04985e+00 1.21317e+00 7.69284e+01 103.581 -1.33063e+00 5.50803e+00  0.00000e+00 0.00000e+00 5.90717e+01 103.581 1.78567e+01 283.581 0.9068 
1 1 1 -1  61  18 o 6  4.17397e+00 1.21264e+00 6.92942e+01 246.709 -2.28120e+00 -5.29908e+00 0.00000e+00 0.00000e+00 7.09921e+01 246.709 1.69784e+00 246.709 0.9086 
1 1 1 -1  62  1  o 2  2.08391e+01 3.94596e-01 4.63225e+02 6.474   2.70393e+01  3.06811e+00  0.00000e+00 0.00000e+00 3.01216e+02 6.474   1.62008e+02 186.474 0.9815 
1 1 1 -1  62  2  o 16 1.87848e+01 3.82270e-01 3.29673e+02 178.103 -1.88212e+01 6.23326e-01  0.00000e+00 0.00000e+00 3.53440e+02 178.103 2.37666e+01 178.103 0.9731 
1 1 1 -1  62  3  o 12 5.96555e+00 4.78986e-01 1.37898e+02 284.342 6.58316e-01  -2.57485e+00 0.00000e+00 0.00000e+00 3.62095e+01 284.342 1.01689e+02 104.342 0.7811 
1 1 1 -1  62  4  o 14 1.54586e+01 3.82331e-01 8.97175e+01 353.682 4.43334e+00  -4.90826e-01 0.00000e+00 0.00000e+00 4.17951e+02 353.682 3.28234e+02 353.682 0.8792 
1 1 1 -1  62  5  o 3  1.48416e+01 3.92397e-01 2.28303e+02 15.150  1.13463e+01  3.07216e+00  0.00000e+00 0.00000e+00 3.01801e+02 15.150  7.34975e+01 15.150  0.9565 
1 1 1 -1  62  6  o 4  3.65600e+00 7.23163e-01 1.43321e+01 188.601 -2.22774e-01 -3.36940e-02 0.00000e+00 0.00000e+00 9.45521e-01 188.601 1.33866e+01 8.601   0.1119 
1 1 1 -1  62  7  o 2  1.09337e+01 4.78639e-01 1.53617e+02 105.716 -2.48351e+00 8.82601e+00  0.00000e+00 0.00000e+00 2.31413e+02 105.716 7.77960e+01 105.716 0.9438 
1 1 1 -1  62  8  o 13 2.20988e+01 5.21028e-01 3.54854e+02 178.695 -5.39667e+01 1.22971e+00  0.00000e+00 0.00000e+00 4.61625e+02 178.695 1.06771e+02 178.695 0.9907 
1 1 1 -1  62  9  o 3  1.66783e+01 5.01473e-01 3.21867e+02 120.557 -2.30596e+01 3.90584e+01  0.00000e+00 0.00000e+00 2.92889e+02 120.557 2.89780e+01 300.557 0.9889 
1 1 1 -1  62  10 o 18 1.54651e+01 5.87418e-01 2.94620e+02 330.510 3.80061e+01  -2.14941e+01 0.00000e+00 0.00000e+00 2.74816e+02 330.510 1.98036e+01 150.510 0.9885 
1 1 1 -1  62  11 o 12 1.06780e+01 6.50786e-01 2.05690e+02 229.730 -1.47060e+01 -1.73592e+01 0.00000e+00 0.00000e+00 1.82957e+02 229.730 2.27332e+01 49.730  0.9778 
1 1 1 -1  62  12 o 18 4.61770e+00 8.83943e-01 1.51827e+02 60.350  4.36247e+00  7.66387e+00  0.00000e+00 0.00000e+00 9.88304e+00 60.350  1.41944e+02 240.350 0.9415 
1 1 1 -1  62  13 o 3  7.94661e+00 7.92369e-01 1.29558e+02 126.876 -9.25247e+00 1.23341e+01  0.00000e+00 0.00000e+00 1.56049e+02 126.876 2.64914e+01 126.876 0.9670 
1 1 1 -1  62  14 f 0  1.19452e+01 7.22952e-01 2.57076e+02 202.745 -4.58238e+01 -1.92112e+01 0.00000e+00 0.00000e+00 1.82019e+02 202.745 7.50571e+01 22.745  0.9899 
1 1 1 -1  62  15 o 3  4.17183e+00 1.02508e+00 1.38984e+02 3.642   9.06394e+00  5.76865e-01  0.00000e+00 0.00000e+00 7.00566e+00 3.642   1.31978e+02 183.642 0.9432 
1 1 1 -1  62  16 o 12 4.14530e+00 1.15517e+00 6.15747e+01 34.937  3.54962e+00  2.47969e+00  0.00000e+00 0.00000e+00 7.28778e+01 34.937  1.13031e+01 34.937  0.8751 
1 1 1 -1  62  17 o 11 1.07590e+01 1.10306e+00 1.62347e+02 154.534 -3.25062e+01 1.54812e+01  0.00000e+00 0.00000e+00 2.30433e+02 154.534 6.80866e+01 154.534 0.9860 
1 1 1 -1  62  18 o 9  4.09221e+00 1.22357e+00 8.25244e+01 150.516 -6.04872e+00 3.41996e+00  0.00000e+00 0.00000e+00 5.74633e+01 150.516 2.50612e+01 330.516 0.9250 
1 1 1 -1  63  1  o 13 1.25003e+01 3.64490e-01 1.82396e+02 101.439 -1.37321e+00 6.78624e+00  0.00000e+00 0.00000e+00 2.49548e+02 101.439 6.71526e+01 101.439 0.9247 
1 1 1 -1  63  2  o 18 2.60321e+01 4.43682e-01 4.84831e+02 303.372 1.99482e+01  -3.02856e+01 0.00000e+00 0.00000e+00 4.74351e+02 303.372 1.04793e+01 123.372 0.9861 
1 1 1 -1  63  3  o 10 1.38735e+01 3.91588e-01 3.16542e+02 223.724 -9.90889e+00 -9.47716e+00 0.00000e+00 0.00000e+00 1.82465e+02 223.724 1.34077e+02 43.724  0.9628 
1 1 1 -1  63  4  o 13 7.95485e+00 4.28714e-01 1.99529e+02 5.746   5.65414e+00  5.68977e-01  0.00000e+00 0.00000e+00 6.99779e+01 5.746   1.29551e+02 185.746 0.9071 
1 1 1 -1  63  5  o 19 2.23970e+01 4.29159e-01 4.29206e+02 299.710 2.06193e+01  -3.61352e+01 0.00000e+00 0.00000e+00 3.96907e+02 299.710 3.22986e+01 119.710 0.9879 
1 1 1 -1  63  6  f 0  1.73866e+01 4.59793e-01 2.52329e+02 138.496 -1.60157e+01 1.41713e+01  0.00000e+00 0.00000e+00 3.81221e+02 138.496 1.28893e+02 138.496 0.9763 
1 1 1 -1  63  7  o 14 2.20455e+01 5.10209e-01 3.77106e+02 267.016 -2.48729e+00 -4.77169e+01 0.00000e+00 0.00000e+00 4.36673e+02 267.016 5.95666e+01 267.016 0.9895 
1 1 1 -1  63  8  o 4  1.50657e+01 4.80865e-01 1.82521e+02 169.984 -1.93248e+01 3.41305e+00  0.00000e+00 0.00000e+00 3.64734e+02 169.984 1.82213e+02 169.984 0.9742 
1 1 1 -1  63  9  o 9  1.51475e+01 5.26873e-01 3.10531e+02 302.586 2.19612e+01  -3.43577e+01 0.00000e+00 0.00000e+00 2.47001e+02 302.586 6.35304e+01 122.586 0.9877 
1 1 1 -1  63  10 o 8  8.53083e+00 6.38631e-01 1.55240e+02 59.285  6.49386e+00  1.09303e+01  0.00000e+00 0.00000e+00 1.49714e+02 59.285  5.52617e+00 239.285 0.9598 
1 1 1 -1  63  11 o 18 6.58562e+00 7.28858e-01 8.23263e+01 131.453 -4.13767e+00 4.68448e+00  0.00000e+00 0.00000e+00 1.42209e+02 131.453 5.98824e+01 131.453 0.9161 
1 1 1 -1  63  12 o 19 7.28486e+00 7.35375e-01 1.60229e+02 172.863 -1.55005e+01 1.94089e+00  0.00000e+00 0.00000e+00 1.01878e+02 172.863 5.83504e+01 352.863 0.9674 
1 1 1 -1  63  13 o 8  8.87566e+00 7.19559e-01 1.77390e+02 238.582 -1.27406e+01 -2.08579e+01 0.00000e+00 0.00000e+00 1.45615e+02 238.582 3.17745e+01 58.582  0.9793 
1 1 1 -1  63  14 o 15 3.78549e+00 1.01869e+00 7.59695e+01 214.841 -3.53932e+00 -2.46362e+00 0.00000e+00 0.00000e+00 4.69466e+01 214.841 2.90230e+01 34.841  0.8745 
1 1 1 -1  63  15 o 8  5.33438e+00 1.11454e+00 1.49066e+02 291.042 4.43292e+00  -1.15228e+01 0.00000e+00 0.00000e+00 4.06166e+01 291.042 1.08449e+02 111.042 0.9586 
1 1 1 -1  63  16 o 12 1.15946e+01 9.10950e-01 1.62430e+02 72.921  1.05250e+01  3.42576e+01  0.00000e+00 0.00000e+00 2.61198e+02 72.921  9.87683e+01 72.921  0.9859 
1 1 1 -1  63  17 o 13 5.41104e+00 1.35435e+00 1.24620e+02 148.676 -9.02890e+00 5.49487e+00  0.00000e+00 0.00000e+00 6.59635e+01 148.676 5.86570e+01 328.676 0.9514 
1 1 1 -1  63  18 o 5  3.44980e+00 1.10939e+00 3.13208e+01 38.496  2.02971e+00  1.61430e+00  0.00000e+00 0.00000e+00 6.75146e+01 38.496  3.61939e+01 38.496  0.7748 
1 1 1 -1  64  1  o 5  2.37167e+01 4.24252e-01 2.48167e+02 85.132  1.61782e+00  1.89951e+01  0.00000e+00 0.00000e+00 6.14405e+02 85.132  3.66237e+02 85.132  0.9734 
1 1 1 -1  64  2  o 18 9.20400e+00 3.90307e-01 9.02373e+01 334.715 2.34816e+00  -1.10921e+00 0.00000e+00 0.00000e+00 1.76294e+02 334.715 8.60567e+01 334.715 0.7751 
1 1 1 -1  64  3  o 13 1.91509e+01 4.44488e-01 4.47297e+02 216.620 -2.19965e+01 -1.63479e+01 0.00000e+00 0.00000e+00 2.54837e+02 216.620 1.92460e+02 36.620  0.9816 
1 1 1 -1  64  4  o 17 2.36759e+01 4.33165e-01 4.78088e+02 200.388 -3.67739e+01 -1.36672e+01 0.00000e+00 0.00000e+00 3.94669e+02 200.388 8.34194e+01 20.388  0.9872 
1 1 1 -1  64  5  o 17 1.45243e+01 4.01936e-01 2.41781e+02 120.090 -7.57431e+00 1.30716e+01  0.00000e+00 0.00000e+00 2.82147e+02 120.090 4.03666e+01 120.090 0.9663 
1 1 1 -1  64  6  o 12 1.81160e+01 4.66574e-01 2.94603e+02 180.996 -2.52907e+01 -4.39797e-01 0.00000e+00 0.00000e+00 3.67911e+02 180.996 7.33075e+01 180.996 0.9800 
1 1 1 -1  64  7  o 8  3.59151e+00 7.44897e-01 1.12493e+02 168.100 -2.21255e+00 4.66243e-01  0.00000e+00 0.00000e+00 1.38544e+01 348.100 1.26347e+02 348.100 0.7363 
1 1 1 -1  64  8  o 7  1.06051e+01 4.50195e-01 1.16882e+02 49.112  6.17237e+00  7.12870e+00  0.00000e+00 0.00000e+00 2.56894e+02 49.112  1.40012e+02 49.112  0.9454 
1 1 1 -1  64  9  o 6  6.36408e+00 6.91053e-01 1.37701e+02 244.334 -3.21932e+00 -6.69932e+00 0.00000e+00 0.00000e+00 8.28430e+01 244.334 5.48578e+01 64.334  0.9301 
1 1 1 -1  64  10 o 16 8.01834e+00 6.84159e-01 1.88522e+02 181.653 -1.58477e+01 -4.57346e-01 0.00000e+00 0.00000e+00 1.00481e+02 181.653 8.80412e+01 1.653   0.9679 
1 1 1 -1  64  11 o 9  4.98030e+00 8.32146e-01 1.29560e+02 353.219 7.50240e+00  -8.92067e-01 0.00000e+00 0.00000e+00 4.30245e+01 353.219 8.65354e+01 173.219 0.9313 
1 1 1 -1  64  12 o 2  7.03608e+00 7.30278e-01 1.24741e+02 241.821 -5.47226e+00 -1.02147e+01 0.00000e+00 0.00000e+00 1.25332e+02 241.821 5.91483e-01 241.821 0.9558 
1 1 1 -1  64  13 o 11 2.63015e+00 8.14587e-01 6.46958e+01 172.429 -2.50653e+00 3.33136e-01  0.00000e+00 0.00000e+00 1.03604e+01 172.429 5.43355e+01 352.429 0.7681 
1 1 1 -1  64  14 f 0  3.70046e+00 9.86117e-01 1.00228e+02 135.419 -4.11109e+00 4.05136e+00  0.00000e+00 0.00000e+00 2.45938e+01 135.419 7.56338e+01 315.419 0.9087 
1 1 1 -1  64  15 o 19 4.91400e+00 1.15820e+00 1.42834e+02 122.077 -5.47997e+00 8.74360e+00  0.00000e+00 0.00000e+00 3.03448e+01 122.077 1.12489e+02 302.077 0.9502 
1 1 1 -1  64  16 o 7  3.44569e+00 1.03867e+00 4.05927e+01 120.385 -1.32085e+00 2.25268e+00  0.00000e+00 0.00000e+00 5.85511e+01 120.385 1.79583e+01 120.385 0.7766 
1 1 1 -1  64  17 o 9  4.86374e+00 1.31415e+00 1.11769e+02 69.245  3.26790e+00  8.62309e+00  0.00000e+00 0.00000e+00 5.81874e+01 69.245  5.35821e+01 249.245 0.9441 
1 1 1 -1  64  18 o 8  2.94381e+00 9.96040e-01 2.41724e+01 46.794  1.31761e+00  1.40282e+00  0.00000e+00 0.00000e+00 5.03793e+01 46.794  2.62068e+01 46.794  0.6850 
1 1 1 -1  65  1  o 10 2.66815e+00 6.17457e-01 1.50419e+02 293.256 4.87989e-01  -1.13551e+00 0.00000e+00 0.00000e+00 9.82130e+01 113.256 2.48632e+02 113.256 0.5238 
1 1 1 -1  65  2  o 18 2.19127e+01 4.15380e-01 2.12950e+02 65.034  6.32038e+00  1.35752e+01  0.00000e+00 0.00000e+00 5.77709e+02 65.034  3.64759e+02 65.034  0.9660 
1 1 1 -1  65  3  o 19 7.76273e+00 4.73168e-01 1.59776e+02 233.730 -2.61402e+00 -3.56248e+00 0.00000e+00 0.00000e+00 9.47205e+01 233.730 6.50557e+01 53.730  0.8779 
1 1 1 -1  65  4  o 19 1.39707e+01 3.86315e-01 1.99372e+02 135.209 -8.59072e+00 8.52829e+00  0.00000e+00 0.00000e+00 3.00193e+02 135.209 1.00822e+02 135.209 0.9578 
1 1 1 -1  65  5  o 12 1.96523e+01 4.76148e-01 3.91877e+02 148.289 -3.02353e+01 1.86820e+01  0.00000e+00 0.00000e+00 3.31220e+02 148.289 6.06570e+01 328.288 0.9858 
1 1 1 -1  65  6  o 2  1.29978e+01 4.68590e-01 2.15449e+02 200.130 -1.43849e+01 -5.27265e+00 0.00000e+00 0.00000e+00 2.53387e+02 200.130 3.79378e+01 200.130 0.9668 
1 1 1 -1  65  7  o 18 6.83512e+00 5.78302e-01 1.11169e+02 209.033 -4.13632e+00 -2.29594e+00 0.00000e+00 0.00000e+00 1.14863e+02 209.033 3.69365e+00 209.033 0.8867 
1 1 1 -1  65  8  o 14 6.22006e+00 6.42955e-01 1.32340e+02 273.128 3.24346e-01  -5.93541e+00 0.00000e+00 0.00000e+00 7.89862e+01 273.128 5.33541e+01 93.128  0.9115 
1 1 1 -1  65  9  o 18 4.06167e+00 7.67759e-01 5.31164e+01 37.806  1.48974e+00  1.15582e+00  0.00000e+00 0.00000e+00 4.94804e+01 37.806  3.63600e+00 217.806 0.6781 
1 1 1 -1  65  10 o 10 1.27790e+01 5.09953e-01 2.17853e+02 5.491   3.11669e+01  2.99623e+00  0.00000e+00 0.00000e+00 2.50256e+02 5.491   3.24028e+01 5.491   0.9839 
1 1 1 -1  65  11 f 0  1.33846e+01 5.50556e-01 2.57367e+02 116.012 -2.01745e+01 4.13424e+01  0.00000e+00 0.00000e+00 2.35165e+02 116.012 2.22022e+01 296.012 0.9891 
1 1 1 -1  65  12 o 1  8.58247e+00 6.62695e-01 1.50728e+02 50.515  1.15015e+01  1.39599e+01  0.00000e+00 0.00000e+00 1.59396e+02 50.515  8.66877e+00 50.515  0.9720 
1 1 1 -1  65  13 o 9  9.47414e+00 7.09464e-01 1.69937e+02 154.648 -2.25882e+01 1.07023e+01  0.00000e+00 0.00000e+00 1.74890e+02 154.648 4.95377e+00 154.648 0.9798 
1 1 1 -1  65  14 o 1  9.26226e+00 8.08099e-01 1.50199e+02 183.925 -2.44453e+01 -1.67732e+00 0.00000e+00 0.00000e+00 1.86483e+02 183.925 3.62844e+01 183.925 0.9794 
1 1 1 -1  65  15 o 19 2.77991e+00 8.81726e-01 9.50516e+01 290.014 1.59740e+00  -4.38543e+00 0.00000e+00 0.00000e+00 3.81899e+00 110.014 9.88706e+01 110.014 0.8850 
1 1 1 -1  65  16 o 6  8.94541e+00 1.07886e+00 1.99826e+02 41.547  2.41822e+01  2.14300e+01  0.00000e+00 0.00000e+00 1.26382e+02 41.547  7.34439e+01 221.547 0.9844 
1 1 1 -1  65  17 o 9  3.35142e+00 1.08688e+00 4.05508e+01 281.419 5.62728e-01  -2.78605e+00 0.00000e+00 0.00000e+00 5.83704e+01 281.419 1.78197e+01 281.419 0.7976 
1 1 1 -1  65  18 o 9  2.81312e+00 9.69041e-01 9.10164e+01 157.394 -6.31435e+00 2.62919e+00  0.00000e+00 0.00000e+00 5.03507e+00 157.394 8.59814e+01 337.394 0.9237 
1 1 1 -1  66  1  o 14 7.90424e+00 4.32631e-01 1.77995e+02 42.849  3.41699e+00  3.16965e+00  0.00000e+00 0.00000e+00 8.32395e+01 42.849  9.47558e+01 222.849 0.8849 
1 1 1 -1  66  2  o 4  3.68548e+01 5.63153e-01 7.39609e+02 191.780 -9.46036e+01 -1.97291e+01 0.00000e+00 0.00000e+00 6.29599e+02 191.780 1.10010e+02 11.780  0.9948 
1 1 1 -1  66  3  o 7  4.24126e+00 6.41274e-01 1.24297e+02 162.745 -1.95245e+00 6.06422e-01  0.00000e+00 0.00000e+00 1.26626e+01 342.745 1.36960e+02 342.745 0.7049 
1 1 1 -1  66  4  o 1  6.46799e+00 4.86895e-01 7.49088e+01 190.791 -2.03736e+00 -3.88302e-01 0.00000e+00 0.00000e+00 9.64084e+01 190.791 2.14996e+01 190.791 0.7096 
1 1 1 -1  66  5  o 3  2.10549e+01 4.87167e-01 3.47343e+02 267.394 -1.61385e+00 -3.54644e+01 0.00000e+00 0.00000e+00 4.27209e+02 267.394 7.98663e+01 267.394 0.9858 
1 1 1 -1  66  6  o 1  1.13702e+01 4.68451e-01 1.89900e+02 336.969 1.14832e+01  -4.88166e+00 0.00000e+00 0.00000e+00 2.16872e+02 336.969 2.69715e+01 336.969 0.9591 
1 1 1 -1  66  7  o 4  4.35051e+00 6.74760e-01 4.99524e+01 248.189 -5.41931e-01 -1.35418e+00 0.00000e+00 0.00000e+00 4.50612e+01 248.189 4.89118e+00 68.189  0.5857 
1 1 1 -1  66  8  o 16 1.27305e+01 4.83706e-01 2.68226e+02 233.489 -1.72305e+01 -2.32764e+01 0.00000e+00 0.00000e+00 1.97946e+02 233.489 7.02799e+01 53.489  0.9826 
1 1 1 -1  66  9  o 7  1.39033e+01 5.33398e-01 2.42630e+02 124.323 -1.74429e+01 2.55480e+01  0.00000e+00 0.00000e+00 2.66785e+02 124.323 2.41549e+01 124.323 0.9837 
1 1 1 -1  66  10 o 15 7.59474e+00 6.03646e-01 2.58309e+02 212.782 -1.74651e+01 -1.12478e+01 0.00000e+00 0.00000e+00 1.75046e+01 212.782 2.40805e+02 32.782  0.9756 
1 1 1 -1  66  11 o 3  2.91439e+00 8.06745e-01 4.83839e+01 0.269   1.63643e+00  7.68670e-03  0.00000e+00 0.00000e+00 1.97085e+01 0.269   2.86754e+01 180.269 0.6281 
1 1 1 -1  66  12 o 7  6.56925e+00 7.80096e-01 1.26033e+02 125.101 -6.58292e+00 9.36632e+00  0.00000e+00 0.00000e+00 1.07229e+02 125.101 1.88042e+01 305.101 0.9553 
1 1 1 -1  66  13 o 7  7.08535e+00 8.53813e-01 9.04360e+01 11.498  8.90694e+00  1.81183e+00  0.00000e+00 0.00000e+00 1.57792e+02 11.498  6.73558e+01 11.498  0.9433 
1 1 1 -1  66  14 o 6  7.23707e+00 9.76769e-01 8.88602e+01 146.621 -8.96546e+00 5.90694e+00  0.00000e+00 0.00000e+00 1.66868e+02 146.621 7.80076e+01 146.621 0.9522 
1 1 1 -1  66  15 o 13 4.54232e+00 1.14083e+00 1.43839e+02 92.299  -4.05296e-01 1.00959e+01  0.00000e+00 0.00000e+00 1.60000e+01 92.299  1.27839e+02 272.299 0.9491 
1 1 1 -1  66  16 o 7  8.46027e+00 1.14667e+00 1.35181e+02 34.570  1.60621e+01  1.10680e+01  0.00000e+00 0.00000e+00 1.70027e+02 34.570  3.48458e+01 34.570  0.9740 
1 1 1 -1  66  17 o 5  5.29840e+00 1.34066e+00 7.56023e+01 234.246 -3.91480e+00 -5.43724e+00 0.00000e+00 0.00000e+00 1.05146e+02 234.246 2.95439e+01 234.246 0.9220 
1 1 1 -1  66  18 o 10 2.86555e+00 9.97986e-01 2.46451e+01 101.156 -3.84561e-01 1.95006e+00  0.00000e+00 0.00000e+00 4.90362e+01 101.156 2.43912e+01 101.156 0.6957 
1 1 1 -1  67  1  o 3  1.57702e+01 3.82646e-01 3.07944e+02 270.779 2.36073e-01  -1.73695e+01 0.00000e+00 0.00000e+00 2.63756e+02 270.779 4.41881e+01 90.779  0.9708 
1 1 1 -1  67  2  o 2  1.74297e+01 3.89695e-01 2.43686e+02 236.237 -8.19216e+00 -1.22543e+01 0.00000e+00 0.00000e+00 3.84632e+02 236.237 1.40946e+02 236.237 0.9655 
1 1 1 -1  67  3  o 6  1.14075e+01 4.39354e-01 2.56816e+02 162.650 -1.20783e+01 3.77358e+00  0.00000e+00 0.00000e+00 1.51847e+02 162.650 1.04968e+02 342.650 0.9596 
1 1 1 -1  67  4  o 15 1.32427e+01 4.43881e-01 1.76955e+02 146.452 -9.04432e+00 5.99731e+00  0.00000e+00 0.00000e+00 2.93928e+02 146.452 1.16973e+02 146.452 0.9527 
1 1 1 -1  67  5  o 19 2.31846e+01 5.62111e-01 5.09215e+02 26.944  5.31398e+01  2.70107e+01  0.00000e+00 0.00000e+00 3.48510e+02 26.944  1.60705e+02 206.944 0.9916 
1 1 1 -1  67  6  o 5  1.73805e+01 4.68341e-01 2.81039e+02 107.415 -8.48278e+00 2.70436e+01  0.00000e+00 0.00000e+00 3.55641e+02 107.415 7.46015e+01 107.415 0.9822 
1 1 1 -1  67  7  o 5  4.13849e+00 7.60049e-01 1.18301e+02 162.146 -3.35027e+00 1.07912e+00  0.00000e+00 0.00000e+00 1.16237e+01 162.146 1.06677e+02 342.146 0.8421 
1 1 1 -1  67  8  o 1  1.61849e+01 4.88354e-01 3.22552e+02 153.562 -3.72386e+01 1.85164e+01  0.00000e+00 0.00000e+00 2.73215e+02 153.562 4.93366e+01 333.562 0.9879 
1 1 1 -1  67  9  o 17 3.50136e+00 8.09214e-01 5.00015e+01 222.949 -1.17736e+00 -1.09594e+00 0.00000e+00 0.00000e+00 3.10795e+01 222.949 1.89221e+01 42.949  0.6218 
1 1 1 -1  67  10 o 5  4.45359e+00 7.34092e-01 1.02346e+02 340.660 4.35998e+00  -1.53026e+00 0.00000e+00 0.00000e+00 4.41383e+01 340.660 5.82079e+01 160.660 0.8838 
1 1 1 -1  67  11 o 19 4.00352e+00 8.48309e-01 6.67994e+01 223.489 -2.32490e+00 -2.20538e+00 0.00000e+00 0.00000e+00 5.58973e+01 223.489 1.09020e+01 43.489  0.8240 
1 1 1 -1  67  12 o 18 7.67304e+00 7.90466e-01 2.11722e+02 247.953 -8.24438e+00 -2.03577e+01 0.00000e+00 0.00000e+00 6.68687e+01 247.953 1.44854e+02 67.953  0.9770 
1 1 1 -1  67  13 o 17 7.09401e+00 8.53308e-01 1.25464e+02 120.373 -6.63268e+00 1.13176e+01  0.00000e+00 0.00000e+00 1.27717e+02 120.373 2.25275e+00 120.373 0.9611 
1 1 1 -1  67  14 o 1  8.86076e+00 8.74699e-01 1.46412e+02 129.419 -1.40615e+01 1.71070e+01  0.00000e+00 0.00000e+00 1.74829e+02 129.419 2.84170e+01 129.419 0.9772 
1 1 1 -1  67  15 o 5  5.27500e+00 1.17911e+00 7.58276e+01 345.879 6.15358e+00  -1.54810e+00 0.00000e+00 0.00000e+00 1.03555e+02 345.879 2.77275e+01 345.879 0.9174 
1 1 1 -1  67  16 o 14 3.47002e+00 1.06200e+00 2.97571e+00 257.624 -4.21164e-02 -1.91942e-01 0.00000e+00 0.00000e+00 9.58919e+00 257.624 6.61348e+00 257.624 0.0978 
1 1 1 -1  67  17 o 12 5.44150e+00 1.34679e+00 8.26416e+01 216.534 -6.12652e+00 -4.53897e+00 0.00000e+00 0.00000e+00 1.04945e+02 216.534 2.23032e+01 216.534 0.9319 
1 1 1 -1  67  18 o 5  3.63160e+00 1.16284e+00 7.70642e+01 82.615  8.24141e-01  6.35836e+00  0.00000e+00 0.00000e+00 4.61661e+01 82.615  3.08981e+01 262.615 0.9183 
1 1 1 -1  68  1  o 15 1.79363e+01 3.90363e-01 3.15078e+02 243.227 -1.00496e+01 -1.99182e+01 0.00000e+00 0.00000e+00 3.39412e+02 243.227 2.43344e+01 243.227 0.9773 
1 1 1 -1  68  2  f 0  8.60251e+00 4.17483e-01 2.49409e+02 65.464  3.85828e+00  8.45207e+00  0.00000e+00 0.00000e+00 5.39260e+01 65.464  1.95483e+02 245.464 0.9445 
1 1 1 -1  68  3  o 4  1.74948e+01 3.99251e-01 2.76534e+02 15.445  2.07112e+01  5.72234e+00  0.00000e+00 0.00000e+00 3.61066e+02 15.445  8.45322e+01 15.445  0.9764 
1 1 1 -1  68  4  o 8  1.86896e+01 4.66310e-01 3.32112e+02 164.166 -2.90537e+01 8.23974e+00  0.00000e+00 0.00000e+00 3.53640e+02 164.166 2.15283e+01 164.166 0.9833 
1 1 1 -1  68  5  f 0  2.90987e+01 6.27163e-01 5.65452e+02 238.853 -5.03158e+01 -8.32564e+01 0.00000e+00 0.00000e+00 5.14421e+02 238.853 5.10309e+01 58.853  0.9948 
1 1 1 -1  68  6  o 18 8.33231e+00 4.70216e-01 1.74943e+02 200.245 -8.63084e+00 -3.18328e+00 0.00000e+00 0.00000e+00 1.18352e+02 200.245 5.65905e+01 20.245  0.9440 
1 1 1 -1  68  7  o 7  6.87175e+00 5.50224e-01 7.34885e+01 180.759 -3.71386e+00 -4.91921e-02 0.00000e+00 0.00000e+00 1.44619e+02 180.759 7.11302e+01 180.759 0.8516 
1 1 1 -1  68  8  o 15 1.24954e+01 4.89646e-01 2.24764e+02 122.542 -1.33155e+01 2.08671e+01  0.00000e+00 0.00000e+00 2.31238e+02 122.542 6.47480e+00 122.542 0.9796 
1 1 1 -1  68  9  o 17 4.44419e+00 7.51856e-01 5.30879e+01 276.202 2.37514e-01  -2.18550e+00 0.00000e+00 0.00000e+00 6.73425e+01 276.202 1.42547e+01 276.202 0.7278 
1 1 1 -1  68  10 o 16 5.36317e+00 7.33295e-01 1.51762e+02 163.321 -8.54380e+00 2.55985e+00  0.00000e+00 0.00000e+00 3.62570e+01 163.321 1.15505e+02 343.321 0.9422 
1 1 1 -1  68  11 o 7  1.31712e+01 5.55120e-01 2.43227e+02 342.605 4.31623e+01  -1.35221e+01 0.00000e+00 0.00000e+00 2.41096e+02 342.605 2.13089e+00 162.605 0.9889 
1 1 1 -1  68  12 o 17 5.53838e+00 8.78561e-01 1.32388e+02 135.445 -7.52321e+00 7.40716e+00  0.00000e+00 0.00000e+00 6.33994e+01 135.445 6.89885e+01 315.445 0.9514 
1 1 1 -1  68  13 o 14 2.88962e+00 8.87453e-01 6.89807e+01 171.743 -3.14137e+00 4.55888e-01  0.00000e+00 0.00000e+00 1.92157e+01 171.743 4.97650e+01 351.743 0.8221 
1 1 1 -1  68  14 o 2  9.14751e+00 8.65089e-01 1.40957e+02 62.595  9.45586e+00  1.82380e+01  0.00000e+00 0.00000e+00 1.90006e+02 62.595  4.90496e+01 62.595  0.9753 
1 1 1 -1  68  15 o 7  3.58222e+00 1.06817e+00 8.89872e+01 330.995 4.73262e+00  -2.62388e+00 0.00000e+00 0.00000e+00 3.07783e+01 330.995 5.82089e+01 150.995 0.9021 
1 1 1 -1  68  16 o 6  6.35811e+00 1.21311e+00 1.46618e+02 308.608 1.03816e+01  -1.30013e+01 0.00000e+00 0.00000e+00 8.15975e+01 308.608 6.50205e+01 128.608 0.9695 
1 1 1 -1  68  17 o 12 5.24878e+00 1.36173e+00 5.66772e+01 198.545 -5.01028e+00 -1.68082e+00 0.00000e+00 0.00000e+00 1.17959e+02 198.545 6.12814e+01 198.545 0.8996 
1 1 1 -1  68  18 o 16 3.32267e+00 1.07368e+00 2.68196e+01 96.093  -2.31857e-01 2.17222e+00  0.00000e+00 0.00000e+00 6.22835e+01 96.093  3.54639e+01 96.093  0.7259 
1 1 1 -1  69  1  o 6  1.45315e+01 3.83507e-01 1.99286e+02 240.849 -6.10659e+00 -1.09484e+01 0.00000e+00 0.00000e+00 3.21059e+02 240.849 1.21774e+02 240.849 0.9592 
1 1 1 -1  69  2  o 10 2.79814e+01 4.75240e-01 4.96217e+02 200.662 -5.74306e+01 -2.16582e+01 0.00000e+00 0.00000e+00 5.39627e+02 200.662 4.34098e+01 200.662 0.9918 
1 1 1 -1  69  3  o 5  8.29076e+00 4.90905e-01 2.06955e+02 239.175 -4.04368e+00 -6.77667e+00 0.00000e+00 0.00000e+00 8.21077e+01 239.175 1.24847e+02 59.175  0.9343 
1 1 1 -1  69  4  o 10 7.08851e+00 5.38241e-01 1.11775e+02 243.334 -1.80073e+00 -3.58572e+00 0.00000e+00 0.00000e+00 1.16715e+02 243.334 4.93985e+00 243.334 0.8640 
1 1 1 -1  69  5  o 1  9.42629e+00 5.38652e-01 2.08418e+02 123.077 -6.12837e+00 9.40933e+00  0.00000e+00 0.00000e+00 1.27105e+02 123.077 8.13122e+01 303.076 0.9544 
1 1 1 -1  69  6  o 14 9.85985e+00 4.84197e-01 1.04799e+02 13.785  6.92722e+00  1.69958e+00  0.00000e+00 0.00000e+00 2.35954e+02 13.785  1.31155e+02 13.785  0.9270 
1 1 1 -1  69  7  f 0  2.65719e+00 7.14066e-01 2.76423e+02 138.922 -4.16330e+00 3.62906e+00  0.00000e+00 0.00000e+00 1.86883e+02 318.922 4.63306e+02 318.922 0.9042 
1 1 1 -1  69  8  o 19 7.58884e+00 5.49341e-01 1.73329e+02 226.314 -8.32898e+00 -8.72001e+00 0.00000e+00 0.00000e+00 9.73455e+01 226.314 7.59838e+01 46.314  0.9576 
1 1 1 -1  69  9  o 18 1.23022e+01 4.67321e-01 1.84663e+02 82.442  3.23275e+00  2.43661e+01  0.00000e+00 0.00000e+00 2.63887e+02 82.442  7.92239e+01 82.442  0.9794 
1 1 1 -1  69  10 o 2  8.07291e+00 5.74854e-01 1.51462e+02 285.321 4.10574e+00  -1.49866e+01 0.00000e+00 0.00000e+00 1.39044e+02 285.321 1.24171e+01 105.321 0.9673 
1 1 1 -1  69  11 o 4  1.28243e+01 5.60530e-01 2.03617e+02 161.583 -3.65200e+01 1.21605e+01  0.00000e+00 0.00000e+00 2.66924e+02 161.583 6.33073e+01 161.583 0.9869 
1 1 1 -1  69  12 f 0  1.32760e+01 6.15846e-01 2.01161e+02 110.130 -1.48573e+01 4.05329e+01  0.00000e+00 0.00000e+00 2.86295e+02 110.130 8.51341e+01 110.130 0.9883 
1 1 1 -1  69  13 o 14 4.15245e+00 1.01585e+00 5.06155e+01 33.473  2.64138e+00  1.74649e+00  0.00000e+00 0.00000e+00 7.60228e+01 33.473  2.54073e+01 33.473  0.8216 
1 1 1 -1  69  14 o 18 8.09490e+00 9.36996e-01 1.45222e+02 302.215 1.03336e+01  -1.64002e+01 0.00000e+00 0.00000e+00 1.47153e+02 302.215 1.93131e+00 302.215 0.9739 
1 1 1 -1  69  15 o 7  8.42221e+00 1.03780e+00 1.29119e+02 203.212 -1.84715e+01 -7.92159e+00 0.00000e+00 0.00000e+00 1.75090e+02 203.212 4.59710e+01 203.212 0.9748 
1 1 1 -1  69  16 o 5  8.05585e+00 1.23251e+00 1.50796e+02 92.949  -1.11898e+00 2.17205e+01  0.00000e+00 0.00000e+00 1.40471e+02 92.949  1.03247e+01 272.949 0.9767 
1 1 1 -1  69  17 o 15 5.48903e+00 1.34145e+00 1.24514e+02 174.923 -1.21202e+01 1.07673e+00  0.00000e+00 0.00000e+00 6.99330e+01 174.923 5.45813e+01 354.923 0.9580 
1 1 1 -1  70  1  o 3  1.09548e+01 3.91939e-01 1.68425e+02 222.044 -6.07972e+00 -5.48262e+00 0.00000e+00 0.00000e+00 2.14580e+02 222.044 4.61553e+01 222.044 0.9368 
1 1 1 -1  70  2  o 16 9.14303e+00 4.20161e-01 1.42898e+02 295.997 2.65080e+00  -5.43558e+00 0.00000e+00 0.00000e+00 1.68642e+02 295.997 2.57442e+01 295.997 0.9131 
1 1 1 -1  70  3  o 6  1.32702e+01 4.51163e-01 2.72448e+02 347.460 1.67824e+01  -3.73297e+00 0.00000e+00 0.00000e+00 2.08041e+02 347.460 6.44068e+01 167.460 0.9705 
1 1 1 -1  70  4  o 3  1.69847e+01 4.65474e-01 3.96963e+02 66.826  1.60011e+01  3.73809e+01  0.00000e+00 0.00000e+00 2.28738e+02 66.826  1.68226e+02 246.826 0.9876 
1 1 1 -1  70  5  o 2  2.15572e+01 4.99723e-01 3.68267e+02 179.485 -4.89466e+01 4.39506e-01  0.00000e+00 0.00000e+00 4.27322e+02 179.485 5.90548e+01 179.485 0.9897 
1 1 1 -1  70  6  o 8  7.69416e+00 5.28738e-01 1.11223e+02 111.058 -2.30203e+00 5.97895e+00  0.00000e+00 0.00000e+00 1.52129e+02 111.058 4.09056e+01 111.058 0.9182 
1 1 1 -1  70  7  o 13 1.45922e+01 4.74537e-01 2.87827e+02 241.862 -1.58520e+01 -2.96407e+01 0.00000e+00 0.00000e+00 2.47707e+02 241.862 4.01200e+01 61.862  0.9850 
1 1 1 -1  70  8  o 2  7.51560e+00 5.00581e-01 1.92450e+02 97.937  -1.84140e+00 1.32076e+01  0.00000e+00 0.00000e+00 7.67222e+01 97.937  1.15728e+02 277.937 0.9617 
1 1 1 -1  70  9  o 14 4.31002e+00 6.94118e-01 3.66873e+01 136.015 -1.17925e+00 1.13818e+00  0.00000e+00 0.00000e+00 6.41571e+01 136.015 2.74699e+01 136.015 0.6286 
1 1 1 -1  70  10 o 4  5.06084e+00 7.69014e-01 2.78590e+01 123.944 -9.80673e-01 1.45698e+00  0.00000e+00 0.00000e+00 9.51401e+01 123.944 6.72810e+01 123.944 0.6534 
1 1 1 -1  70  11 o 2  3.78820e+00 8.69160e-01 1.47795e+02 14.847  6.99973e+00  1.85561e+00  0.00000e+00 0.00000e+00 1.71048e+01 194.847 1.64900e+02 194.847 0.9281 
1 1 1 -1  70  12 o 9  1.10578e+01 6.50839e-01 1.95835e+02 287.531 1.03745e+01  -3.28419e+01 0.00000e+00 0.00000e+00 2.08876e+02 287.531 1.30408e+01 287.531 0.9854 
1 1 1 -1  70  13 o 17 3.69124e+00 9.90232e-01 7.48093e+01 225.989 -2.91771e+00 -3.02020e+00 0.00000e+00 0.00000e+00 4.44809e+01 225.989 3.03284e+01 45.989  0.8708 
1 1 1 -1  70  14 o 10 3.55183e+00 9.58249e-01 7.13153e+01 312.797 2.71238e+00  -2.92941e+00 0.00000e+00 0.00000e+00 4.23762e+01 312.797 2.89390e+01 132.797 0.8632 
1 1 1 -1  70  15 o 4  4.08067e+00 1.13554e+00 5.64645e+01 198.880 -3.59269e+00 -1.22869e+00 0.00000e+00 0.00000e+00 7.28260e+01 198.880 1.63616e+01 198.880 0.8552 
1 1 1 -1  70  16 o 13 6.30437e+00 1.26561e+00 9.23444e+01 76.072  2.51798e+00  1.01536e+01  0.00000e+00 0.00000e+00 1.29532e+02 76.072  3.71880e+01 76.072  0.9509 
1 1 1 -1  70  17 o 6  3.59569e+00 1.13809e+00 6.94759e+01 123.982 -3.17729e+00 4.71367e+00  0.00000e+00 0.00000e+00 5.11197e+01 123.982 1.83562e+01 303.982 0.9072 
1 1 1 -1  71  1  o 13 2.92665e+01 4.87792e-01 5.32201e+02 213.029 -6.35304e+01 -4.13027e+01 0.00000e+00 0.00000e+00 5.52645e+02 213.029 2.04432e+01 213.029 0.9934 
1 1 1 -1  71  2  o 13 9.59998e+00 4.71987e-01 2.61108e+02 92.956  -6.14190e-01 1.18927e+01  0.00000e+00 0.00000e+00 8.16826e+01 92.956  1.79425e+02 272.956 0.9570 
1 1 1 -1  71  3  o 9  1.23439e+01 4.48709e-01 2.16742e+02 231.374 -9.16493e+00 -1.14702e+01 0.00000e+00 0.00000e+00 2.27751e+02 231.374 1.10084e+01 231.374 0.9653 
1 1 1 -1  71  4  o 16 3.20268e+00 6.86276e-01 1.10595e+02 94.772  -1.65236e-01 1.97935e+00  0.00000e+00 0.00000e+00 2.75257e+01 274.772 1.38121e+02 274.772 0.6955 
1 1 1 -1  71  5  o 6  8.08290e+00 5.05580e-01 1.33761e+02 247.255 -2.88599e+00 -6.88413e+00 0.00000e+00 0.00000e+00 1.46603e+02 247.255 1.28427e+01 247.255 0.9304 
1 1 1 -1  71  6  o 7  2.45024e+01 5.30223e-01 4.43176e+02 89.063  1.30928e+00  8.00496e+01  0.00000e+00 0.00000e+00 4.64248e+02 89.063  2.10724e+01 89.063  0.9937 
1 1 1 -1  71  7  o 16 7.03350e+00 5.89799e-01 9.32176e+01 152.372 -4.96421e+00 2.59827e+00  0.00000e+00 0.00000e+00 1.44086e+02 152.372 5.08680e+01 152.372 0.9057 
1 1 1 -1  71  8  o 6  5.49082e+00 6.11090e-01 3.77866e+01 2.180   2.00005e+00  7.61370e-02  0.00000e+00 0.00000e+00 1.04915e+02 2.180   6.71287e+01 2.180   0.6980 
1 1 1 -1  71  9  o 7  2.17706e+00 6.48491e-01 5.91857e+01 12.676  1.38972e+00  3.12582e-01  0.00000e+00 0.00000e+00 1.24501e+01 192.676 7.16358e+01 192.676 0.5769 
1 1 1 -1  71  10 o 13 3.46049e+00 7.77093e-01 1.15524e+02 24.427  4.26424e+00  1.93680e+00  0.00000e+00 0.00000e+00 1.56957e+00 204.427 1.17093e+02 204.427 0.8855 
1 1 1 -1  71  11 o 5  3.57617e+00 8.58898e-01 2.38629e+01 145.952 -9.67718e-01 6.53919e-01  0.00000e+00 0.00000e+00 4.29525e+01 145.952 1.90896e+01 145.952 0.5027 
1 1 1 -1  71  12 o 15 4.90458e+00 8.40581e-01 1.16776e+02 111.650 -3.23019e+00 8.13762e+00  0.00000e+00 0.00000e+00 5.46186e+01 111.650 6.21578e+01 291.650 0.9410 
1 1 1 -1  71  13 o 15 5.57016e+00 9.76298e-01 1.21644e+02 136.883 -7.34147e+00 6.87420e+00  0.00000e+00 0.00000e+00 7.44813e+01 136.883 4.71623e+01 316.883 0.9489 
1 1 1 -1  71  14 o 18 7.70420e+00 1.01734e+00 1.30569e+02 236.775 -8.83448e+00 -1.34879e+01 0.00000e+00 0.00000e+00 1.46051e+02 236.775 1.54822e+01 236.775 0.9685 
1 1 1 -1  71  15 o 12 1.10333e+01 1.00022e+00 2.22942e+02 95.484  -4.51357e+00 4.70167e+01  0.00000e+00 0.00000e+00 1.81378e+02 95.484  4.15635e+01 275.484 0.9894 
1 1 1 -1  71  16 o 5  4.37903e+00 1.24020e+00 5.73836e+01 281.856 9.38958e-01  -4.47277e+00 0.00000e+00 0.00000e+00 8.55916e+01 281.856 2.82080e+01 281.856 0.8824 
1 1 1 -1  71  17 o 3  4.53070e+00 1.31468e+00 9.30546e+01 61.754  3.92474e+00  7.30558e+00  0.00000e+00 0.00000e+00 6.39711e+01 61.754  2.90834e+01 241.754 0.9376 
1 1 1 -1  72  1  o 12 1.72859e+01 4.60352e-01 3.35881e+02 357.815 2.75065e+01  -1.04956e+00 0.00000e+00 0.00000e+00 2.97191e+02 357.815 3.86903e+01 177.815 0.9817 
1 1 1 -1  72  2  o 10 1.60946e+01 4.53441e-01 3.09961e+02 174.869 -2.72699e+01 2.44851e+00  0.00000e+00 0.00000e+00 2.79344e+02 174.869 3.06176e+01 354.869 0.9816 
1 1 1 -1  72  3  o 16 2.37250e+01 5.12747e-01 3.24812e+02 45.697  3.21892e+01  3.29821e+01  0.00000e+00 0.00000e+00 5.50371e+02 45.697  2.25559e+02 45.697  0.9891 
1 1 1 -1  72  4  o 5  1.27972e+01 4.29912e-01 1.90822e+02 97.786  -2.05462e+00 1.50269e+01  0.00000e+00 0.00000e+00 2.70325e+02 97.786  7.95031e+01 97.786  0.9664 
1 1 1 -1  72  5  o 12 8.11969e+00 5.14265e-01 1.67855e+02 338.734 9.02459e+00  -3.51228e+00 0.00000e+00 0.00000e+00 1.18720e+02 338.734 4.91352e+01 158.734 0.9469 
1 1 1 -1  72  6  o 17 7.51268e+00 5.48272e-01 1.68040e+02 110.404 -3.40715e+00 9.15948e+00  0.00000e+00 0.00000e+00 9.71509e+01 110.404 7.08889e+01 290.404 0.9474 
1 1 1 -1  72  7  o 14 1.57770e+01 4.22551e-01 2.66257e+02 54.052  2.31099e+01  3.18691e+01  0.00000e+00 0.00000e+00 3.13828e+02 54.052  4.75708e+01 54.052  0.9872 
1 1 1 -1  72  8  o 9  5.93522e+00 5.75820e-01 1.41921e+02 53.724  5.37726e+00  7.32668e+00  0.00000e+00 0.00000e+00 6.64846e+01 53.724  7.54368e+01 233.724 0.9433 
1 1 1 -1  72  9  o 14 7.96435e+00 5.35154e-01 1.33376e+02 184.683 -1.22409e+01 -1.00279e+00 0.00000e+00 0.00000e+00 1.50602e+02 184.683 1.72260e+01 184.683 0.9584 
1 1 1 -1  72  10 o 11 3.29842e+00 8.38672e-01 8.03285e+01 69.563  1.11151e+00  2.98284e+00  0.00000e+00 0.00000e+00 2.05634e+01 69.563  5.97651e+01 249.563 0.8227 
1 1 1 -1  72  11 o 13 2.21471e+00 7.18964e-01 8.97957e+01 270.687 3.31619e-02  -2.76473e+00 0.00000e+00 0.00000e+00 2.47057e+01 90.687  1.14501e+02 90.687  0.7910 
1 1 1 -1  72  12 o 11 5.92993e+00 8.92862e-01 9.78796e+01 203.019 -7.43589e+00 -3.15922e+00 0.00000e+00 0.00000e+00 1.08176e+02 203.019 1.02965e+01 203.019 0.9359 
1 1 1 -1  72  13 o 2  8.43352e+00 8.70456e-01 1.25233e+02 323.097 1.50182e+01  -1.12772e+01 0.00000e+00 0.00000e+00 1.79192e+02 323.097 5.39588e+01 323.097 0.9730 
1 1 1 -1  72  14 o 6  3.92016e+00 1.03754e+00 7.84538e+01 90.771  -6.74984e-02 5.01833e+00  0.00000e+00 0.00000e+00 5.14241e+01 90.771  2.70297e+01 270.771 0.8938 
1 1 1 -1  72  15 o 19 1.25052e+01 8.77048e-01 1.92784e+02 220.320 -3.83009e+01 -3.25046e+01 0.00000e+00 0.00000e+00 2.65680e+02 220.320 7.28962e+01 220.320 0.9900 
1 1 1 -1  72  16 o 2  4.36273e+00 1.23390e+00 1.58031e+02 16.829  1.19521e+01  3.61517e+00  0.00000e+00 0.00000e+00 3.23314e+00 196.829 1.61264e+02 196.829 0.9591 
1 1 1 -1  72  17 o 13 3.71335e+00 1.13215e+00 4.12655e+01 161.178 -3.42760e+00 1.16831e+00  0.00000e+00 0.00000e+00 7.49985e+01 161.178 3.37330e+01 161.178 0.8472 
1 1 1 -1  73  1  o 12 5.49774e+00 6.55485e-01 4.60584e+01 125.730 -7.91253e-01 1.09994e+00  0.00000e+00 0.00000e+00 6.84064e+01 125.730 2.23480e+01 125.730 0.5582 
1 1 1 -1  73  2  o 12 7.84972e+00 5.25042e-01 1.12055e+02 214.259 -4.34341e+00 -2.95834e+00 0.00000e+00 0.00000e+00 1.51129e+02 214.259 3.90736e+01 214.259 0.8990 
1 1 1 -1  73  3  o 6  1.50339e+01 4.54151e-01 2.93214e+02 100.474 -4.65596e+00 2.51862e+01  0.00000e+00 0.00000e+00 2.56317e+02 100.474 3.68968e+01 280.474 0.9803 
1 1 1 -1  73  4  o 18 1.60825e+01 4.49837e-01 2.68686e+02 96.299  -3.29455e+00 2.98468e+01  0.00000e+00 0.00000e+00 3.20776e+02 96.299  5.20906e+01 96.299  0.9832 
1 1 1 -1  73  5  o 4  1.86631e+01 4.71049e-01 3.94014e+02 247.580 -2.12638e+01 -5.15379e+01 0.00000e+00 0.00000e+00 2.95234e+02 247.580 9.87807e+01 67.580  0.9910 
1 1 1 -1  73  6  o 19 1.92635e+01 4.86045e-01 4.04919e+02 13.952  6.04200e+01  1.50110e+01  0.00000e+00 0.00000e+00 3.06914e+02 13.952  9.80057e+01 193.952 0.9919 
1 1 1 -1  73  7  o 13 3.31248e+00 5.97734e-01 5.24294e+01 199.677 -1.48222e+00 -5.30052e-01 0.00000e+00 0.00000e+00 2.32966e+01 199.677 2.91328e+01 19.677  0.6139 
1 1 1 -1  73  8  o 4  4.81074e+00 6.63227e-01 1.54046e+02 310.458 4.97463e+00  -5.83309e+00 0.00000e+00 0.00000e+00 1.28768e+01 310.458 1.41170e+02 130.458 0.9323 
1 1 1 -1  73  9  o 8  3.47836e+00 6.68979e-01 8.49045e+01 185.887 -3.63477e+00 -3.74785e-01 0.00000e+00 0.00000e+00 2.49127e+01 185.887 5.99918e+01 5.887   0.8488 
1 1 1 -1  73  10 o 8  8.28455e+00 6.23630e-01 2.03525e+02 109.002 -7.63730e+00 2.21776e+01  0.00000e+00 0.00000e+00 9.78074e+01 109.002 1.05717e+02 289.002 0.9784 
1 1 1 -1  73  11 o 9  4.19113e+00 9.05771e-01 1.05555e+02 269.970 -3.28681e-03 -6.28990e+00 0.00000e+00 0.00000e+00 3.71610e+01 269.970 6.83944e+01 89.970  0.9166 
1 1 1 -1  73  12 o 19 1.39999e+01 6.24469e-01 2.59340e+02 42.804  4.31888e+01  3.99996e+01  0.00000e+00 0.00000e+00 2.55919e+02 42.804  3.42025e+00 222.804 0.9915 
1 1 1 -1  73  13 o 4  3.55413e+00 9.84625e-01 5.76516e+01 342.006 3.12472e+00  -1.01490e+00 0.00000e+00 0.00000e+00 5.16406e+01 342.006 6.01097e+00 162.006 0.8291 
1 1 1 -1  73  14 o 3  2.37024e+01 7.93625e-01 3.33629e+02 221.013 -1.16214e+02 -1.01070e+02 0.00000e+00 0.00000e+00 5.41905e+02 221.013 2.08275e+02 221.013 0.9967 
1 1 1 -1  73  15 o 14 3.99620e+00 1.14127e+00 4.34371e+01 60.144  1.46500e+00  2.55220e+00  0.00000e+00 0.00000e+00 7.57681e+01 60.144  3.23310e+01 60.144  0.8057 
1 1 1 -1  73  16 o 13 3.03219e+00 1.00243e+00 4.19934e+01 116.554 -1.23501e+00 2.47119e+00  0.00000e+00 0.00000e+00 4.66970e+01 116.554 4.70355e+00 116.554 0.7908 
1 1 1 -1  73  17 o 6  6.06200e+00 1.43593e+00 1.20527e+02 32.328  1.06121e+01  6.71595e+00  0.00000e+00 0.00000e+00 9.43499e+01 32.328  2.61772e+01 212.328 0.9593 
1 1 1 -1  74  1  o 15 1.08889e+01 4.65347e-01 1.29536e+02 349.268 7.99549e+00  -1.51535e+00 0.00000e+00 0.00000e+00 2.50706e+02 349.268 1.21170e+02 349.268 0.9364 
1 1 1 -1  74  2  f 0  2.17199e+01 4.94991e-01 4.63481e+02 84.786  5.29467e+00  5.80212e+01  0.00000e+00 0.00000e+00 3.39424e+02 84.786  1.24057e+02 264.786 0.9914 
1 1 1 -1  74  3  o 2  9.46603e+00 5.00670e-01 1.66156e+02 108.066 -3.06577e+00 9.39840e+00  0.00000e+00 0.00000e+00 1.68387e+02 108.066 2.23089e+00 108.066 0.9480 
1 1 1 -1  74  4  o 14 7.71646e+00 5.02068e-01 6.81000e+01 306.538 2.22549e+00  -3.00337e+00 0.00000e+00 0.00000e+00 1.77119e+02 306.538 1.09019e+02 306.538 0.8526 
1 1 1 -1  74  5  o 7  8.50939e+00 4.99510e-01 1.23510e+02 49.861  5.29387e+00  6.27802e+00  0.00000e+00 0.00000e+00 1.73562e+02 49.861  5.00521e+01 49.861  0.9370 
1 1 1 -1  74  6  o 15 1.32741e+01 4.11916e-01 2.02694e+02 155.741 -2.18909e+01 9.86512e+00  0.00000e+00 0.00000e+00 2.81298e+02 155.741 7.86039e+01 155.741 0.9789 
1 1 1 -1  74  7  o 6  8.29778e+00 4.79817e-01 1.17019e+02 71.962  2.97941e+00  9.14882e+00  0.00000e+00 0.00000e+00 1.75377e+02 71.962  5.83583e+01 71.962  0.9465 
1 1 1 -1  74  8  o 13 7.44574e+00 5.22177e-01 1.49793e+02 102.429 -2.58891e+00 1.17469e+01  0.00000e+00 0.00000e+00 1.15488e+02 102.429 3.43049e+01 282.429 0.9575 
1 1 1 -1  74  9  o 11 3.02343e+00 6.95623e-01 3.14636e+01 80.235  2.06372e-01  1.19915e+00  0.00000e+00 0.00000e+00 2.67746e+01 80.235  4.68895e+00 260.235 0.5179 
1 1 1 -1  74  10 o 8  3.89262e+00 8.69592e-01 5.44182e+01 332.347 2.34855e+00  -1.23057e+00 0.00000e+00 0.00000e+00 5.85025e+01 332.347 4.08432e+00 332.347 0.7805 
1 1 1 -1  74  11 o 9  9.08195e+00 6.72059e-01 1.56680e+02 56.803  1.23270e+01  1.88399e+01  0.00000e+00 0.00000e+00 1.73057e+02 56.803  1.63776e+01 56.803  0.9775 
1 1 1 -1  74  12 o 13 2.94839e+00 8.65855e-01 1.91682e+01 147.534 -7.22187e-01 4.59479e-01  0.00000e+00 0.00000e+00 2.38400e+01 147.534 4.67182e+00 147.534 0.3930 
1 1 1 -1  74  13 o 6  3.98724e+00 9.94733e-01 6.16024e+01 117.296 -1.67507e+00 3.24593e+00  0.00000e+00 0.00000e+00 6.38875e+01 117.296 2.28510e+00 117.296 0.8487 
1 1 1 -1  74  14 o 11 3.31635e+00 1.01243e+00 5.52070e+01 192.447 -3.17203e+00 -7.00116e-01 0.00000e+00 0.00000e+00 4.63865e+01 192.447 8.82048e+00 12.447  0.8268 
1 1 1 -1  74  15 o 12 7.90162e+00 1.14437e+00 4.95056e+01 159.374 -6.54657e+00 2.46412e+00  0.00000e+00 0.00000e+00 2.21194e+02 159.374 1.71688e+02 159.374 0.9255 
1 1 1 -1  74  16 o 2  2.53063e+00 8.74229e-01 1.65036e+01 208.257 -9.30951e-01 -5.00371e-01 0.00000e+00 0.00000e+00 2.71247e+01 208.257 1.06212e+01 208.257 0.4662 
1 1 1 -1  74  17 o 16 2.92465e+00 1.00209e+00 5.97030e+01 9.660   4.82298e+00  8.20938e-01  0.00000e+00 0.00000e+00 3.65442e+01 9.660   2.31588e+01 189.660 0.8908 
1 1 1 -1  75  1  o 10 5.05854e+00 6.54774e-01 2.38249e+01 24.708  6.61971e-01  3.04585e-01  0.00000e+00 0.00000e+00 4.07016e+01 24.708  1.68767e+01 24.708  0.3421 
1 1 1 -1  75  2  o 15 2.16534e+01 4.98439e-01 3.92486e+02 153.378 -4.77770e+01 2.39473e+01  0.00000e+00 0.00000e+00 4.07168e+02 153.378 1.46813e+01 153.378 0.9906 
1 1 1 -1  75  3  o 3  7.69761e+00 4.98980e-01 1.56246e+02 45.667  5.99719e+00  6.13844e+00  0.00000e+00 0.00000e+00 1.13392e+02 45.667  4.28536e+01 225.667 0.9398 
1 1 1 -1  75  4  o 3  1.10724e+01 4.57137e-01 2.95787e+02 18.653  2.35552e+01  7.95152e+00  0.00000e+00 0.00000e+00 1.08422e+02 18.653  1.87365e+02 198.653 0.9797 
1 1 1 -1  75  5  o 10 1.27394e+01 4.55258e-01 1.37235e+02 226.674 -1.01905e+01 -1.08041e+01 0.00000e+00 0.00000e+00 3.21062e+02 226.674 1.83827e+02 226.674 0.9657 
1 1 1 -1  75  6  o 13 1.48278e+01 4.12902e-01 2.51066e+02 228.470 -2.31523e+01 -2.61418e+01 0.00000e+00 0.00000e+00 2.93125e+02 228.470 4.20587e+01 228.470 0.9856 
1 1 1 -1  75  7  o 10 3.30496e+00 7.16830e-01 7.93090e+01 37.374  1.95823e+00  1.49576e+00  0.00000e+00 0.00000e+00 1.43104e+01 37.374  6.49986e+01 217.374 0.7610 
1 1 1 -1  75  8  o 6  1.42135e+01 4.53826e-01 2.58064e+02 221.804 -2.95627e+01 -2.64360e+01 0.00000e+00 0.00000e+00 2.64009e+02 221.804 5.94482e+00 221.804 0.9873 
1 1 1 -1  75  9  o 10 2.37435e+00 6.73007e-01 7.66835e+01 329.633 1.90341e+00  -1.11523e+00 0.00000e+00 0.00000e+00 1.23365e+01 149.633 8.90199e+01 149.633 0.7289 
1 1 1 -1  75  10 o 12 1.45633e+01 5.44956e-01 3.13601e+02 95.386  -6.21933e+00 6.59658e+01  0.00000e+00 0.00000e+00 2.23456e+02 95.386  9.01453e+01 275.386 0.9924 
1 1 1 -1  75  11 o 1  5.65751e+00 8.73519e-01 8.29996e+01 63.983  2.97701e+00  6.09911e+00  0.00000e+00 0.00000e+00 1.10923e+02 63.983  2.79234e+01 63.983  0.9231 
1 1 1 -1  75  12 o 14 6.18353e+00 9.08990e-01 1.20726e+02 306.232 7.02556e+00  -9.58801e+00 0.00000e+00 0.00000e+00 9.88458e+01 306.232 2.18806e+01 126.232 0.9570 
1 1 1 -1  75  13 o 17 7.48709e+00 9.77391e-01 1.29074e+02 237.820 -8.28755e+00 -1.31708e+01 0.00000e+00 0.00000e+00 1.39446e+02 237.820 1.03721e+01 237.820 0.9673 
1 1 1 -1  75  14 o 12 9.78938e+00 9.84562e-01 1.35027e+02 228.463 -1.60451e+01 -1.81123e+01 0.00000e+00 0.00000e+00 2.20038e+02 228.463 8.50112e+01 228.463 0.9791 
1 1 1 -1  75  15 o 16 3.71595e+00 1.03620e+00 6.41002e+01 178.865 -4.89137e+00 9.69171e-02  0.00000e+00 0.00000e+00 5.84120e+01 178.865 5.68822e+00 358.865 0.8908 
1 1 1 -1  75  16 o 3  4.08409e+00 1.18269e+00 1.19554e+02 333.628 9.33785e+00  -4.62957e+00 0.00000e+00 0.00000e+00 2.40108e+01 333.628 9.55433e+01 153.628 0.9507 
1 1 1 -1  75  17 o 9  3.20512e+00 1.07635e+00 6.01443e+01 92.559  -2.27870e-01 5.09918e+00  0.00000e+00 0.00000e+00 4.58938e+01 92.559  1.42505e+01 272.559 0.8957 
1 1 1 -1  76  1  f 0  1.72933e+01 4.75771e-01 2.65534e+02 51.347  1.80331e+01  2.25467e+01  0.00000e+00 0.00000e+00 3.67849e+02 51.347  1.02315e+02 51.347  0.9825 
1 1 1 -1  76  2  o 12 1.43144e+01 4.47672e-01 2.08595e+02 239.293 -1.09513e+01 -1.84393e+01 0.00000e+00 0.00000e+00 3.12346e+02 239.293 1.03751e+02 239.293 0.9764 
1 1 1 -1  76  3  o 1  2.16251e+01 4.93337e-01 4.35268e+02 162.117 -6.72917e+01 2.17128e+01  0.00000e+00 0.00000e+00 3.64879e+02 162.117 7.03883e+01 342.117 0.9929 
1 1 1 -1  76  4  o 17 1.71712e+01 4.61599e-01 4.20395e+02 355.926 5.65172e+01  -4.02513e+00 0.00000e+00 0.00000e+00 2.13661e+02 355.926 2.06734e+02 175.926 0.9911 
1 1 1 -1  76  5  o 1  2.50635e+01 4.63282e-01 3.33772e+02 217.828 -5.77226e+01 -4.48199e+01 0.00000e+00 0.00000e+00 5.93286e+02 217.828 2.59514e+02 217.828 0.9931 
1 1 1 -1  76  6  o 7  1.18816e+01 4.23550e-01 3.19297e+02 37.113  2.82343e+01  2.13632e+01  0.00000e+00 0.00000e+00 1.16765e+02 37.113  2.02532e+02 217.113 0.9858 
1 1 1 -1  76  7  o 19 1.65589e+01 4.35987e-01 3.34838e+02 73.937  1.66846e+01  5.79440e+01  0.00000e+00 0.00000e+00 2.76249e+02 73.937  5.85895e+01 253.937 0.9917 
1 1 1 -1  76  8  o 7  1.55723e+01 4.52392e-01 2.80318e+02 289.416 1.79718e+01  -5.09887e+01 0.00000e+00 0.00000e+00 2.93513e+02 289.416 1.31948e+01 289.416 0.9907 
1 1 1 -1  76  9  o 11 1.26863e+01 4.74540e-01 2.29045e+02 106.064 -1.08148e+01 3.75584e+01  0.00000e+00 0.00000e+00 2.36489e+02 106.064 7.44329e+00 106.064 0.9871 
1 1 1 -1  76  10 f 0  5.46284e+00 8.19493e-01 2.04044e+02 284.767 3.86217e+00  -1.46521e+01 0.00000e+00 0.00000e+00 7.90760e+00 104.767 2.11951e+02 104.767 0.9664 
1 1 1 -1  76  11 o 12 3.55534e+00 8.83729e-01 9.39211e+01 22.594  4.61371e+00  1.91991e+00  0.00000e+00 0.00000e+00 2.39927e+01 22.594  6.99283e+01 202.594 0.8933 
1 1 1 -1  76  12 o 13 6.47749e+00 9.31946e-01 1.05928e+02 345.776 1.06598e+01  -2.70213e+00 0.00000e+00 0.00000e+00 1.23175e+02 345.776 1.72476e+01 345.776 0.9534 
1 1 1 -1  76  13 o 3  7.84589e+00 9.49688e-01 1.41504e+02 288.594 5.60207e+00  -1.66515e+01 0.00000e+00 0.00000e+00 1.40930e+02 288.594 5.73481e-01 108.594 0.9711 
1 1 1 -1  76  14 o 1  6.44697e+00 1.14413e+00 8.82650e+01 57.732  4.98056e+00  7.88808e+00  0.00000e+00 0.00000e+00 1.37323e+02 57.732  4.90577e+01 57.732  0.9448 
1 1 1 -1  76  15 o 18 3.01629e+00 9.83367e-01 5.32052e+01 104.740 -9.27559e-01 3.52553e+00  0.00000e+00 0.00000e+00 4.14794e+01 104.740 1.17259e+01 284.740 0.8484 
1 1 1 -1  76  16 o 2  5.00569e+00 1.32189e+00 2.37082e+01 172.917 -2.10055e+00 2.61006e-01  0.00000e+00 0.00000e+00 1.08787e+02 172.917 8.50783e+01 172.917 0.7160 
1 1 1 -1  76  17 o 18 3.60269e+00 1.15382e+00 9.61236e+01 6.951   8.18806e+00  9.98291e-01  0.00000e+00 0.00000e+00 2.85667e+01 6.951   6.75570e+01 186.951 0.9373 
1 1 1 -1  77  1  o 10 2.07455e+01 4.98870e-01 4.70355e+02 165.325 -6.71976e+01 1.75980e+01  0.00000e+00 0.00000e+00 2.97233e+02 165.325 1.73121e+02 345.325 0.9928 
1 1 1 -1  77  2  o 5  7.22711e+00 5.35219e-01 6.80630e+01 175.525 -3.66193e+00 2.86586e-01  0.00000e+00 0.00000e+00 1.60764e+02 175.525 9.27006e+01 175.525 0.8497 
1 1 1 -1  77  3  o 13 1.73212e+01 4.62477e-01 2.49683e+02 197.851 -3.05620e+01 -9.84254e+00 0.00000e+00 0.00000e+00 3.85529e+02 197.851 1.35846e+02 197.851 0.9843 
1 1 1 -1  77  4  o 16 6.43879e+00 5.39130e-01 8.25168e+01 295.670 1.82409e+00  -3.79525e+00 0.00000e+00 0.00000e+00 1.26416e+02 295.670 4.38997e+01 295.670 0.8712 
1 1 1 -1  77  5  o 6  6.06735e+00 5.02489e-01 1.27141e+02 35.334  5.82321e+00  4.12827e+00  0.00000e+00 0.00000e+00 8.23018e+01 35.334  4.48389e+01 215.334 0.9270 
1 1 1 -1  77  6  o 7  2.07183e+01 4.47994e-01 4.15892e+02 30.901  7.35725e+01  4.40342e+01  0.00000e+00 0.00000e+00 3.50779e+02 30.901  6.51136e+01 210.901 0.9942 
1 1 1 -1  77  7  o 18 1.47404e+01 4.34493e-01 2.79656e+02 225.233 -3.18595e+01 -3.21198e+01 0.00000e+00 0.00000e+00 2.62679e+02 225.233 1.69773e+01 45.233  0.9889 
1 1 1 -1  77  8  o 4  1.13203e+01 4.63929e-01 2.19062e+02 71.479  1.07860e+01  3.21968e+01  0.00000e+00 0.00000e+00 1.95663e+02 71.479  2.33988e+01 251.479 0.9852 
1 1 1 -1  77  9  o 6  5.25501e+00 6.97422e-01 1.03015e+02 344.421 7.07447e+00  -1.97246e+00 0.00000e+00 0.00000e+00 7.84650e+01 344.421 2.45502e+01 164.421 0.9292 
1 1 1 -1  77  10 o 2  5.92477e+00 7.98884e-01 1.08605e+02 308.072 6.07271e+00  -7.75273e+00 0.00000e+00 0.00000e+00 9.99703e+01 308.072 8.63426e+00 128.072 0.9478 
1 1 1 -1  77  11 o 14 3.50719e+00 8.41785e-01 9.45538e+01 291.006 1.90195e+00  -4.95314e+00 0.00000e+00 0.00000e+00 2.26114e+01 291.006 7.19425e+01 111.006 0.9000 
1 1 1 -1  77  12 o 5  2.37693e+00 7.71680e-01 2.06582e+01 60.838  4.28626e-01  7.68131e-01  0.00000e+00 0.00000e+00 1.47932e+01 60.838  5.86505e+00 240.838 0.4021 
1 1 1 -1  77  13 o 17 3.02516e+00 9.01813e-01 2.85830e+01 86.370  9.57038e-02  1.50869e+00  0.00000e+00 0.00000e+00 3.85760e+01 86.370  9.99305e+00 86.370  0.5990 
1 1 1 -1  77  14 o 4  5.58116e+00 1.08951e+00 1.17852e+02 169.335 -1.16449e+01 2.19298e+00  0.00000e+00 0.00000e+00 7.98894e+01 169.335 3.79622e+01 349.335 0.9568 
1 1 1 -1  77  15 o 9  6.01569e+00 1.29653e+00 9.80487e+01 217.807 -7.65309e+00 -5.93795e+00 0.00000e+00 0.00000e+00 1.12677e+02 217.807 1.46288e+01 217.807 0.9469 
1 1 1 -1  77  16 o 2  2.63213e+00 9.02827e-01 5.58871e+01 214.426 -3.46052e+00 -2.37177e+00 0.00000e+00 0.00000e+00 2.88064e+01 214.426 2.70808e+01 34.426  0.8706 
1 1 1 -1  77  17 o 17 6.75988e+00 1.53722e+00 1.25505e+02 341.205 1.35597e+01  -4.61485e+00 0.00000e+00 0.00000e+00 1.15189e+02 341.205 1.03156e+01 161.205 0.9644 
1 1 1 -1  78  1  o 13 9.76694e+00 5.79125e-01 2.22484e+02 292.490 6.19940e+00  -1.49743e+01 0.00000e+00 0.00000e+00 1.30035e+02 292.490 9.24491e+01 112.490 0.9686 
1 1 1 -1  78  2  o 12 1.90657e+01 5.37058e-01 3.82523e+02 140.843 -4.15538e+01 3.38388e+01  0.00000e+00 0.00000e+00 3.21142e+02 140.843 6.13807e+01 320.843 0.9906 
1 1 1 -1  78  3  o 16 1.14152e+01 4.61091e-01 1.51449e+02 225.171 -1.03647e+01 -1.04269e+01 0.00000e+00 0.00000e+00 2.59035e+02 225.171 1.07585e+02 225.171 0.9654 
1 1 1 -1  78  4  o 15 3.11006e+00 6.83497e-01 1.24511e+02 138.418 -2.46446e+00 2.18668e+00  0.00000e+00 0.00000e+00 2.84259e+01 318.418 1.52937e+02 318.418 0.8296 
1 1 1 -1  78  5  o 11 1.56956e+01 4.11096e-01 3.48730e+02 347.041 4.99212e+01  -1.14878e+01 0.00000e+00 0.00000e+00 2.29858e+02 347.041 1.18873e+02 167.041 0.9902 
1 1 1 -1  78  6  o 15 7.62715e+00 4.86300e-01 1.26710e+02 217.259 -8.45233e+00 -6.42941e+00 0.00000e+00 0.00000e+00 1.43416e+02 217.259 1.67061e+01 217.259 0.9517 
1 1 1 -1  78  7  o 3  4.27713e+00 6.89220e-01 9.11280e+01 20.624  3.74289e+00  1.40865e+00  0.00000e+00 0.00000e+00 4.62541e+01 20.624  4.48740e+01 200.624 0.8635 
1 1 1 -1  78  8  o 14 6.67951e+00 5.78331e-01 1.46522e+02 294.305 5.32826e+00  -1.17981e+01 0.00000e+00 0.00000e+00 9.20251e+01 294.305 5.44969e+01 114.305 0.9606 
1 1 1 -1  78  9  o 7  1.96133e+00 6.13044e-01 3.90403e+01 16.977  1.00520e+00  3.06874e-01  0.00000e+00 0.00000e+00 5.21158e+00 196.977 4.42519e+01 196.977 0.4642 
1 1 1 -1  78  10 o 12 5.41025e+00 8.12180e-01 6.65383e+01 216.255 -4.33353e+00 -3.17808e+00 0.00000e+00 0.00000e+00 1.14562e+02 216.255 4.80241e+01 216.255 0.9014 
1 1 1 -1  78  11 o 11 1.16608e+01 6.26448e-01 2.21266e+02 258.249 -9.48364e+00 -4.55925e+01 0.00000e+00 0.00000e+00 2.06799e+02 258.249 1.44671e+01 78.250  0.9892 
1 1 1 -1  78  12 o 13 8.99461e+00 7.53682e-01 1.30322e+02 104.562 -5.24080e+00 2.01741e+01  0.00000e+00 0.00000e+00 1.95120e+02 104.562 6.47975e+01 104.562 0.9757 
1 1 1 -1  78  13 o 16 8.40915e+00 8.93053e-01 1.41195e+02 40.326  1.61079e+01  1.36733e+01  0.00000e+00 0.00000e+00 1.62923e+02 40.326  2.17276e+01 40.326  0.9760 
1 1 1 -1  78  14 o 9  4.01884e+00 1.07042e+00 7.98432e+01 268.455 -1.57448e-01 -5.83756e+00 0.00000e+00 0.00000e+00 5.55166e+01 268.455 2.43266e+01 88.455  0.9098 
1 1 1 -1  78  15 o 5  3.30093e+00 1.04583e+00 4.02084e+01 92.699  -1.33468e-01 2.83167e+00  0.00000e+00 0.00000e+00 5.70963e+01 92.699  1.68879e+01 92.699  0.7970 
1 1 1 -1  78  16 o 7  4.48423e+00 1.29709e+00 7.79921e+01 317.440 5.15369e+00  -4.73239e+00 0.00000e+00 0.00000e+00 7.53559e+01 317.440 2.63611e+00 137.440 0.9255 
1 1 1 -1  79  1  o 12 2.16900e+01 6.09552e-01 3.79703e+02 164.205 -6.07858e+01 1.71953e+01  0.00000e+00 0.00000e+00 4.21903e+02 164.205 4.21999e+01 164.205 0.9921 
1 1 1 -1  79  2  o 16 1.17098e+01 5.65859e-01 2.05704e+02 271.457 5.12199e-01  -2.01314e+01 0.00000e+00 0.00000e+00 2.19498e+02 271.457 1.37939e+01 271.457 0.9748 
1 1 1 -1  79  3  o 6  1.36709e+01 4.59586e-01 2.61167e+02 19.422  2.94715e+01  1.03911e+01  0.00000e+00 0.00000e+00 2.39743e+02 19.422  2.14238e+01 199.422 0.9839 
1 1 1 -1  79  4  o 18 7.25144e+00 5.25636e-01 1.14654e+02 57.051  4.16115e+00  6.42018e+00  0.00000e+00 0.00000e+00 1.37014e+02 57.051  2.23598e+01 57.051  0.9322 
1 1 1 -1  79  5  o 17 9.16463e+00 4.30941e-01 2.51175e+02 306.767 1.37593e+01  -1.84145e+01 0.00000e+00 0.00000e+00 8.24311e+01 306.767 1.68744e+02 126.767 0.9780 
1 1 1 -1  79  6  o 1  1.22907e+01 4.35351e-01 2.69319e+02 281.503 7.53010e+00  -3.70025e+01 0.00000e+00 0.00000e+00 1.81875e+02 281.503 8.74446e+01 101.503 0.9867 
1 1 1 -1  79  7  o 16 1.43107e+01 4.38490e-01 2.84845e+02 62.698  2.32249e+01  4.49943e+01  0.00000e+00 0.00000e+00 2.42089e+02 62.698  4.27563e+01 242.698 0.9901 
1 1 1 -1  79  8  o 18 1.06153e+01 4.77287e-01 2.09616e+02 355.239 3.12112e+01  -2.59966e+00 0.00000e+00 0.00000e+00 1.78619e+02 355.239 3.09971e+01 175.239 0.9839 
1 1 1 -1  79  9  o 13 6.00540e+00 6.41621e-01 8.22769e+01 60.387  3.64706e+00  6.41649e+00  0.00000e+00 0.00000e+00 1.25110e+02 60.387  4.28333e+01 60.387  0.9296 
1 1 1 -1  79  10 o 13 3.15485e+00 8.27735e-01 9.80896e+01 120.563 -2.32506e+00 3.93731e+00  0.00000e+00 0.00000e+00 5.27075e+00 120.563 9.28188e+01 300.563 0.8824 
1 1 1 -1  79  11 o 5  7.80161e+00 7.48843e-01 1.64855e+02 247.884 -7.73604e+00 -1.90360e+01 0.00000e+00 0.00000e+00 1.17469e+02 247.884 4.73864e+01 67.884  0.9754 
1 1 1 -1  79  12 o 5  1.89098e+01 6.53112e-01 3.25138e+02 48.125  7.22886e+01  8.06370e+01  0.00000e+00 0.00000e+00 3.72693e+02 48.125  4.75548e+01 48.125  0.9954 
1 1 1 -1  79  13 o 3  3.76162e+00 1.00922e+00 1.39884e+02 189.040 -8.86310e+00 -1.41006e+00 0.00000e+00 0.00000e+00 8.54490e+00 9.040   1.48429e+02 9.040   0.9425 
1 1 1 -1  79  14 o 13 5.43504e+00 1.06932e+00 1.43760e+02 290.271 4.83045e+00  -1.30788e+01 0.00000e+00 0.00000e+00 5.00527e+01 290.271 9.37070e+01 110.271 0.9634 
1 1 1 -1  79  15 o 11 5.40170e+00 1.26351e+00 1.08526e+02 90.909  -1.67603e-01 1.05639e+01  0.00000e+00 0.00000e+00 8.15195e+01 90.909  2.70065e+01 270.909 0.9514 
1 1 1 -1  79  16 o 10 5.37891e+00 1.41183e+00 1.16570e+02 190.668 -1.11095e+01 -2.09276e+00 0.00000e+00 0.00000e+00 7.31358e+01 190.668 4.34337e+01 10.668  0.9547 
1 1 1 -1  80  1  o 2  1.11473e+01 5.67976e-01 1.94328e+02 64.444  7.36852e+00  1.54095e+01  0.00000e+00 0.00000e+00 2.08516e+02 64.444  1.41883e+01 64.444  0.9703 
1 1 1 -1  80  2  o 2  1.11175e+01 5.83545e-01 1.98616e+02 349.106 1.85825e+01  -3.57631e+00 0.00000e+00 0.00000e+00 2.04313e+02 349.106 5.69677e+00 349.106 0.9732 
1 1 1 -1  80  3  o 15 5.89325e+00 6.54513e-01 1.01808e+02 129.594 -3.43819e+00 4.15701e+00  0.00000e+00 0.00000e+00 9.60687e+01 129.594 5.73963e+00 309.594 0.9018 
1 1 1 -1  80  4  o 8  4.80015e+00 6.64590e-01 1.09998e+02 297.412 2.16960e+00  -4.18334e+00 0.00000e+00 0.00000e+00 4.83594e+01 297.412 6.16382e+01 117.413 0.8863 
1 1 1 -1  80  5  o 12 1.35725e+01 4.16095e-01 2.66989e+02 23.732  3.69658e+01  1.62517e+01  0.00000e+00 0.00000e+00 2.31780e+02 23.732  3.52086e+01 203.732 0.9875 
1 1 1 -1  80  6  o 13 8.35890e+00 4.75570e-01 1.15530e+02 214.813 -9.14273e+00 -6.35737e+00 0.00000e+00 0.00000e+00 1.81098e+02 214.813 6.55677e+01 214.813 0.9540 
1 1 1 -1  80  7  o 17 4.33764e+00 6.44744e-01 4.66032e+01 117.332 -1.20905e+00 2.33927e+00  0.00000e+00 0.00000e+00 7.89943e+01 117.332 3.23911e+01 117.332 0.7787 
1 1 1 -1  80  8  o 4  5.29135e+00 6.62110e-01 9.42785e+01 201.528 -6.33588e+00 -2.49937e+00 0.00000e+00 0.00000e+00 8.72948e+01 201.528 6.98372e+00 21.528  0.9234 
1 1 1 -1  80  9  o 10 1.02313e+01 5.19544e-01 1.72601e+02 150.254 -2.31781e+01 1.32453e+01  0.00000e+00 0.00000e+00 2.00228e+02 150.254 2.76265e+01 150.254 0.9811 
1 1 1 -1  80  10 o 18 6.16108e+00 7.73049e-01 6.19861e+01 340.310 5.43211e+00  -1.94395e+00 0.00000e+00 0.00000e+00 1.45812e+02 340.310 8.38261e+01 340.310 0.9086 
1 1 1 -1  80  11 o 11 6.75468e+00 8.43955e-01 9.29168e+01 143.412 -8.29208e+00 6.15555e+00  0.00000e+00 0.00000e+00 1.45184e+02 143.412 5.22672e+01 143.412 0.9503 
1 1 1 -1  80  12 o 17 4.94832e+00 1.01585e+00 1.25995e+02 273.777 6.46584e-01  -9.79513e+00 0.00000e+00 0.00000e+00 4.78133e+01 273.777 7.81815e+01 93.777  0.9476 
1 1 1 -1  80  13 o 6  8.46064e+00 9.67728e-01 2.04156e+02 312.838 2.12983e+01  -2.29693e+01 0.00000e+00 0.00000e+00 1.04157e+02 312.838 9.99992e+01 132.838 0.9839 
1 1 1 -1  80  14 o 7  9.10163e+00 9.76063e-01 1.45932e+02 208.906 -2.35704e+01 -1.30147e+01 0.00000e+00 0.00000e+00 1.84558e+02 208.906 3.86259e+01 208.906 0.9813 
1 1 1 -1  80  15 o 9  4.68069e+00 1.27120e+00 1.01366e+02 26.342  7.53223e+00  3.72959e+00  0.00000e+00 0.00000e+00 6.10357e+01 26.342  4.03301e+01 206.342 0.9385 
1 1 1 -1  80  16 o 14 4.00548e+00 1.23072e+00 5.30919e+01 163.569 -4.28055e+00 1.26231e+00  0.00000e+00 0.00000e+00 7.69799e+01 163.569 2.38879e+01 163.569 0.8792 
1 1 1 -1  81  1  o 8  3.14229e+00 7.98040e-01 8.18455e+01 88.017  7.37060e-02  2.12839e+00  0.00000e+00 0.00000e+00 2.16315e+00 88.017  7.96823e+01 268.017 0.7180 
1 1 1 -1  81  2  o 17 3.19442e+00 7.71488e-01 6.70034e+01 358.558 1.87104e+00  -4.70966e-02 0.00000e+00 0.00000e+00 1.33406e+01 358.558 5.36629e+01 178.558 0.6755 
1 1 1 -1  81  3  o 3  5.15903e+00 6.80838e-01 9.92240e+01 241.636 -2.16600e+00 -4.01197e+00 0.00000e+00 0.00000e+00 7.01695e+01 241.636 2.90546e+01 61.636  0.8820 
1 1 1 -1  81  4  o 19 1.47333e+01 4.69813e-01 2.91203e+02 17.095  4.06438e+01  1.25000e+01  0.00000e+00 0.00000e+00 2.50622e+02 17.095  4.05807e+01 197.095 0.9882 
1 1 1 -1  81  5  o 7  1.29953e+01 4.27600e-01 2.90689e+02 246.182 -1.74382e+01 -3.95048e+01 0.00000e+00 0.00000e+00 1.87156e+02 246.182 1.03533e+02 66.182  0.9884 
1 1 1 -1  81  6  o 7  3.55771e+00 6.74651e-01 6.15296e+01 182.227 -2.44245e+00 -9.50014e-02 0.00000e+00 0.00000e+00 3.88677e+01 182.227 2.26619e+01 2.227   0.7588 
1 1 1 -1  81  7  o 19 6.47010e+00 5.33618e-01 1.19183e+02 351.471 1.02095e+01  -1.53106e+00 0.00000e+00 0.00000e+00 1.09371e+02 351.471 9.81196e+00 171.471 0.9503 
1 1 1 -1  81  8  o 17 5.27522e+00 6.60055e-01 9.68608e+01 92.523  -3.20696e-01 7.27824e+00  0.00000e+00 0.00000e+00 8.51438e+01 92.523  1.17170e+01 272.523 0.9286 
1 1 1 -1  81  9  o 16 7.06866e+00 6.32830e-01 1.44858e+02 187.164 -1.66649e+01 -2.09466e+00 0.00000e+00 0.00000e+00 1.09694e+02 187.164 3.51640e+01 7.164   0.9698 
1 1 1 -1  81  10 f 0  1.58360e+01 5.64978e-01 2.88906e+02 336.094 6.64183e+01  -2.94404e+01 0.00000e+00 0.00000e+00 2.94729e+02 336.094 5.82260e+00 336.094 0.9931 
1 1 1 -1  81  11 o 15 8.89388e+00 7.17830e-01 1.70494e+02 196.100 -2.45772e+01 -7.09391e+00 0.00000e+00 0.00000e+00 1.52832e+02 196.100 1.76625e+01 16.100  0.9803 
1 1 1 -1  81  12 o 11 9.50549e+00 8.15426e-01 1.63794e+02 20.166  2.48538e+01  9.12752e+00  0.00000e+00 0.00000e+00 1.81748e+02 20.166  1.79540e+01 20.166  0.9809 
1 1 1 -1  81  13 o 13 7.62081e+00 1.04036e+00 1.35115e+02 203.162 -1.74493e+01 -7.46510e+00 0.00000e+00 0.00000e+00 1.39536e+02 203.162 4.42078e+00 203.162 0.9733 
1 1 1 -1  81  14 o 7  6.06325e+00 1.22946e+00 1.20161e+02 300.490 6.50726e+00  -1.10515e+01 0.00000e+00 0.00000e+00 9.52279e+01 300.490 2.49332e+01 120.490 0.9602 
1 1 1 -1  81  15 o 10 8.04210e+00 1.28478e+00 1.21140e+02 206.698 -1.69079e+01 -8.50323e+00 0.00000e+00 0.00000e+00 1.68152e+02 206.698 4.70116e+01 206.698 0.9732 
1 1 1 -1  81  16 o 11 3.61254e+00 1.15468e+00 1.34103e+02 51.768  6.93293e+00  8.80015e+00  0.00000e+00 0.00000e+00 6.80733e+00 231.768 1.40911e+02 231.768 0.9543 
1 1 1 -1  82  1  o 3  1.06750e+01 5.63059e-01 2.57492e+02 136.880 -1.83409e+01 1.71748e+01  0.00000e+00 0.00000e+00 1.31938e+02 136.880 1.25554e+02 316.881 0.9799 
1 1 1 -1  82  2  o 18 1.32822e+01 4.78611e-01 2.73227e+02 286.442 9.51649e+00  -3.22460e+01 0.00000e+00 0.00000e+00 2.13781e+02 286.442 5.94462e+01 106.442 0.9850 
1 1 1 -1  82  3  o 10 1.17783e+01 5.33846e-01 1.87597e+02 129.280 -1.37205e+01 1.67751e+01  0.00000e+00 0.00000e+00 2.40520e+02 129.280 5.29231e+01 129.280 0.9766 
1 1 1 -1  82  4  o 7  1.83776e+01 6.25847e-01 3.75339e+02 310.190 4.73799e+01  -5.60857e+01 0.00000e+00 0.00000e+00 3.03771e+02 310.190 7.15683e+01 130.190 0.9932 
1 1 1 -1  82  5  o 6  8.51371e+00 4.64366e-01 1.23710e+02 210.360 -9.90413e+00 -5.80141e+00 0.00000e+00 0.00000e+00 1.78837e+02 210.360 5.51270e+01 210.360 0.9554 
1 1 1 -1  82  6  o 17 3.93262e+00 6.66756e-01 1.15560e+02 137.827 -4.17044e+00 3.77801e+00  0.00000e+00 0.00000e+00 1.69387e+01 137.827 9.86209e+01 317.827 0.9061 
1 1 1 -1  82  7  f 0  3.46270e+00 7.32614e-01 3.91975e+01 120.619 -8.99900e-01 1.52051e+00  0.00000e+00 0.00000e+00 4.51635e+01 120.619 5.96601e+00 120.619 0.6555 
1 1 1 -1  82  8  o 18 8.98540e+00 5.34298e-01 2.12716e+02 135.263 -1.97718e+01 1.95909e+01  0.00000e+00 0.00000e+00 1.15011e+02 135.263 9.77051e+01 315.263 0.9819 
1 1 1 -1  82  9  f 0  3.32367e+00 8.22167e-01 7.91781e+01 33.846  3.24449e+00  2.17578e+00  0.00000e+00 0.00000e+00 2.69203e+01 33.846  5.22578e+01 213.846 0.8598 
1 1 1 -1  82  10 o 12 3.24463e+00 8.29533e-01 4.97224e+01 180.282 -2.39910e+00 -1.17961e-02 0.00000e+00 0.00000e+00 4.09959e+01 180.282 8.72652e+00 0.282   0.7536 
1 1 1 -1  82  11 o 13 5.73082e+00 9.15076e-01 3.38856e+01 89.066  5.47844e-02  3.36186e+00  0.00000e+00 0.00000e+00 1.43237e+02 89.066  1.09352e+02 89.066  0.8336 
1 1 1 -1  82  12 o 8  1.38338e+01 7.00506e-01 2.37839e+02 226.811 -4.39474e+01 -4.68171e+01 0.00000e+00 0.00000e+00 2.70698e+02 226.811 3.28596e+01 226.811 0.9922 
1 1 1 -1  82  13 o 9  4.28425e+00 1.08759e+00 4.05851e+01 296.857 1.32875e+00  -2.62398e+00 0.00000e+00 0.00000e+00 8.71781e+01 296.857 4.65930e+01 296.857 0.8055 
1 1 1 -1  82  14 o 7  4.00742e+00 1.13467e+00 7.52187e+01 169.508 -5.93018e+00 1.09829e+00  0.00000e+00 0.00000e+00 6.00894e+01 169.508 1.51293e+01 349.507 0.9128 
1 1 1 -1  82  15 o 18 3.66902e+00 1.11982e+00 4.60395e+01 66.066  1.46045e+00  3.29042e+00  0.00000e+00 0.00000e+00 6.86875e+01 66.066  2.26480e+01 66.066  0.8462 
1 1 1 -1  82  16 o 19 2.89079e+00 9.85262e-01 2.81003e+01 78.341  4.78209e-01  2.31748e+00  0.00000e+00 0.00000e+00 5.19019e+01 78.341  2.38017e+01 78.341  0.7496 
1 1 1 -1  83  1  o 12 9.85703e+00 4.94553e-01 1.95988e+02 45.916  1.31322e+01  1.35591e+01  0.00000e+00 0.00000e+00 1.61041e+02 45.916  3.49477e+01 225.916 0.9731 
1 1 1 -1  83  2  o 10 8.26592e+00 5.39766e-01 1.08475e+02 226.693 -6.02341e+00 -6.39035e+00 0.00000e+00 0.00000e+00 1.81062e+02 226.693 7.25864e+01 226.693 0.9412 
1 1 1 -1  83  3  o 16 1.13222e+01 4.98998e-01 2.19921e+02 164.146 -2.35946e+01 6.70055e+00  0.00000e+00 0.00000e+00 1.92682e+02 164.146 2.72390e+01 344.146 0.9794 
1 1 1 -1  83  4  o 10 4.03548e+00 8.47470e-01 9.91875e+01 177.935 -4.10000e+00 1.47860e-01  0.00000e+00 0.00000e+00 3.10163e+01 177.935 6.81712e+01 357.935 0.8674 
1 1 1 -1  83  5  o 17 9.30063e+00 5.16294e-01 2.31055e+02 212.664 -1.92894e+01 -1.23663e+01 0.00000e+00 0.00000e+00 1.07176e+02 212.664 1.23880e+02 32.664  0.9779 
1 1 1 -1  83  6  o 3  1.03358e+01 4.80883e-01 2.40189e+02 322.670 2.68546e+01  -2.04799e+01 0.00000e+00 0.00000e+00 1.38294e+02 322.670 1.01895e+02 142.670 0.9851 
1 1 1 -1  83  7  o 3  6.69219e+00 5.39466e-01 9.47791e+01 65.353  3.74933e+00  8.17152e+00  0.00000e+00 0.00000e+00 1.39616e+02 65.353  4.48368e+01 65.353  0.9426 
1 1 1 -1  83  8  o 5  1.04959e+01 5.03214e-01 1.82342e+02 336.791 2.67392e+01  -1.14656e+01 0.00000e+00 0.00000e+00 2.00701e+02 336.791 1.83595e+01 336.791 0.9827 
1 1 1 -1  83  9  o 19 6.49267e+00 6.71899e-01 1.06864e+02 194.662 -1.05827e+01 -2.76872e+00 0.00000e+00 0.00000e+00 1.22834e+02 194.662 1.59695e+01 194.662 0.9531 
1 1 1 -1  83  10 o 4  5.23526e+00 8.85632e-01 9.22158e+01 356.708 7.22321e+00  -4.15509e-01 0.00000e+00 0.00000e+00 8.80152e+01 356.708 4.20056e+00 176.708 0.9281 
1 1 1 -1  83  11 o 9  1.08799e+01 7.10441e-01 1.72511e+02 165.687 -3.37852e+01 8.61974e+00  0.00000e+00 0.00000e+00 2.24974e+02 165.687 5.24623e+01 165.687 0.9856 
1 1 1 -1  83  12 o 14 8.69044e+00 8.28488e-01 1.35241e+02 2.876   2.20431e+01  1.10725e+00  0.00000e+00 0.00000e+00 1.79289e+02 2.876   4.40482e+01 2.876   0.9771 
1 1 1 -1  83  13 o 16 5.23231e+00 1.16641e+00 1.16100e+02 232.129 -6.29619e+00 -8.09632e+00 0.00000e+00 0.00000e+00 6.78608e+01 232.129 4.82387e+01 52.129  0.9499 
1 1 1 -1  83  14 o 19 3.44850e+00 1.06090e+00 6.38394e+01 256.861 -9.87639e-01 -4.23105e+00 0.00000e+00 0.00000e+00 4.78200e+01 256.861 1.60194e+01 76.861  0.8756 
1 1 1 -1  83  15 o 19 3.33899e+00 1.05957e+00 6.41490e+01 52.363  3.21089e+00  4.16388e+00  0.00000e+00 0.00000e+00 4.67583e+01 52.363  1.73907e+01 232.363 0.8990 
1 1 1 -1  84  1  o 12 1.53097e+01 4.70248e-01 2.66769e+02 340.932 3.83277e+01  -1.32477e+01 0.00000e+00 0.00000e+00 2.95866e+02 340.932 2.90971e+01 340.932 0.9876 
1 1 1 -1  84  2  o 13 5.52113e+00 6.31916e-01 1.64824e+02 100.392 -1.74696e+00 9.52558e+00  0.00000e+00 0.00000e+00 2.96869e+01 100.392 1.35137e+02 280.392 0.9469 
1 1 1 -1  84  3  o 13 1.22642e+01 5.01547e-01 2.87095e+02 326.677 3.15624e+01  -2.07508e+01 0.00000e+00 0.00000e+00 1.63050e+02 326.677 1.24045e+02 146.677 0.9867 
1 1 1 -1  84  4  o 5  7.85162e+00 5.70804e-01 9.82115e+01 233.002 -5.23347e+00 -6.94550e+00 0.00000e+00 0.00000e+00 1.76453e+02 233.002 7.82417e+01 233.002 0.9406 
1 1 1 -1  84  5  o 10 6.34351e+00 6.50649e-01 8.42193e+01 239.193 -3.21955e+00 -5.39928e+00 0.00000e+00 0.00000e+00 1.31953e+02 239.193 4.77332e+01 239.193 0.9166 
1 1 1 -1  84  6  o 2  1.13228e+01 5.32378e-01 1.90616e+02 276.567 3.10710e+00  -2.69884e+01 0.00000e+00 0.00000e+00 2.22373e+02 276.567 3.17575e+01 276.567 0.9814 
1 1 1 -1  84  7  o 13 3.66462e+00 7.43873e-01 5.44056e+01 212.689 -2.31884e+00 -1.48803e+00 0.00000e+00 0.00000e+00 5.31578e+01 212.689 1.24772e+00 32.689  0.7901 
1 1 1 -1  84  8  o 11 9.54491e+00 5.23539e-01 1.59305e+02 136.027 -1.86773e+01 1.80198e+01  0.00000e+00 0.00000e+00 1.88201e+02 136.027 2.88962e+01 136.027 0.9805 
1 1 1 -1  84  9  o 5  1.49231e+01 5.04326e-01 2.35974e+02 24.007  5.63427e+01  2.50941e+01  0.00000e+00 0.00000e+00 3.13301e+02 24.007  7.73277e+01 24.007  0.9919 
1 1 1 -1  84  10 o 4  5.13517e+00 8.96432e-01 9.38732e+01 161.323 -7.31066e+00 2.47127e+00  0.00000e+00 0.00000e+00 8.37646e+01 161.323 1.01086e+01 341.323 0.9328 
1 1 1 -1  84  11 o 12 5.41665e+00 9.90808e-01 9.11663e+01 347.343 7.80657e+00  -1.75310e+00 0.00000e+00 0.00000e+00 9.65796e+01 347.343 5.41334e+00 347.343 0.9352 
1 1 1 -1  84  12 o 4  7.01856e+00 1.00792e+00 1.59778e+02 196.054 -1.92006e+01 -5.52523e+00 0.00000e+00 0.00000e+00 9.35522e+01 196.054 6.62255e+01 16.054  0.9746 
1 1 1 -1  84  13 o 8  2.18558e+00 7.57157e-01 6.66659e+01 33.049  2.68724e+00  1.74841e+00  0.00000e+00 0.00000e+00 1.49792e-02 213.049 6.66808e+01 213.049 0.8241 
1 1 1 -1  84  14 o 15 5.22040e+00 1.26255e+00 1.07095e+02 142.602 -7.85962e+00 6.00864e+00  0.00000e+00 0.00000e+00 7.58801e+01 142.602 3.12150e+01 322.602 0.9480 
1 1 1 -1  84  15 o 13 4.00396e+00 1.15937e+00 9.43748e+01 32.820  7.26209e+00  4.68374e+00  0.00000e+00 0.00000e+00 4.46802e+01 32.820  4.96946e+01 212.820 0.9402 
1 1 1 -1  85  1  o 4  7.43595e+00 5.29533e-01 7.92416e+01 193.606 -6.12457e+00 -1.48236e+00 0.00000e+00 0.00000e+00 1.74385e+02 193.606 9.51429e+01 193.606 0.9168 
1 1 1 -1  85  2  o 6  4.23636e+00 7.41144e-01 1.23054e+02 84.990  4.82620e-01  5.50501e+00  0.00000e+00 0.00000e+00 1.94516e+01 84.990  1.03603e+02 264.990 0.9043 
1 1 1 -1  85  3  o 6  1.08592e+01 4.38030e-01 1.36583e+02 261.502 -2.39961e+00 -1.60609e+01 0.00000e+00 0.00000e+00 2.54644e+02 261.502 1.18061e+02 261.502 0.9687 
1 1 1 -1  85  4  o 6  8.45602e+00 6.20136e-01 1.31642e+02 78.709  2.46665e+00  1.23540e+01  0.00000e+00 0.00000e+00 1.70019e+02 78.709  3.83762e+01 78.709  0.9595 
1 1 1 -1  85  5  o 2  5.58956e+00 7.17184e-01 7.18351e+01 257.981 -1.06161e+00 -4.98649e+00 0.00000e+00 0.00000e+00 1.14241e+02 257.981 4.24061e+01 257.981 0.8956 
1 1 1 -1  85  6  o 9  7.56767e+00 7.97971e-01 1.91849e+02 264.782 -1.60848e+00 -1.76117e+01 0.00000e+00 0.00000e+00 8.12663e+01 264.782 1.10583e+02 84.782  0.9713 
1 1 1 -1  85  7  o 11 1.09998e+01 4.75520e-01 2.23168e+02 179.910 -3.62962e+01 5.70338e-02  0.00000e+00 0.00000e+00 1.79695e+02 179.910 4.34732e+01 359.910 0.9861 
1 1 1 -1  85  8  o 17 5.73658e+00 6.73212e-01 1.12288e+02 6.478   1.01298e+01  1.15020e+00  0.00000e+00 0.00000e+00 8.99313e+01 6.478   2.23569e+01 186.478 0.9496 
1 1 1 -1  85  9  o 2  4.35239e+00 7.88449e-01 7.13002e+01 27.945  4.49771e+00  2.38595e+00  0.00000e+00 0.00000e+00 7.32951e+01 27.945  1.99492e+00 27.945  0.8955 
1 1 1 -1  85  10 o 10 8.89186e+00 7.10560e-01 1.41277e+02 183.842 -2.12089e+01 -1.42425e+00 0.00000e+00 0.00000e+00 1.80560e+02 183.842 3.92825e+01 183.842 0.9762 
1 1 1 -1  85  11 o 5  3.86047e+00 9.50254e-01 1.20415e+02 197.449 -7.63143e+00 -2.39875e+00 0.00000e+00 0.00000e+00 1.33595e+01 197.449 1.07056e+02 17.449  0.9352 
1 1 1 -1  85  12 o 10 1.21386e+01 7.61566e-01 1.94475e+02 349.234 4.89471e+01  -9.30749e+00 0.00000e+00 0.00000e+00 2.50419e+02 349.234 5.59446e+01 349.234 0.9899 
1 1 1 -1  85  13 o 12 3.77973e+00 1.09494e+00 9.63314e+01 179.070 -6.75957e+00 1.09774e-01  0.00000e+00 0.00000e+00 3.26984e+01 179.070 6.36331e+01 359.070 0.9228 
1 1 1 -1  85  14 o 18 4.72670e+00 1.20406e+00 8.49411e+01 206.545 -6.61198e+00 -3.30317e+00 0.00000e+00 0.00000e+00 7.74820e+01 206.545 7.45906e+00 26.545  0.9297 
1 1 1 -1  85  15 o 9  3.13711e+00 1.01999e+00 4.66012e+01 316.360 2.79402e+00  -2.66444e+00 0.00000e+00 0.00000e+00 5.27917e+01 316.360 6.19048e+00 316.360 0.8579 
1 1 1 -1  86  1  o 3  2.37194e+00 6.52655e-01 8.45294e+01 205.357 -1.89776e+00 -8.99398e-01 0.00000e+00 0.00000e+00 2.15778e+01 25.358  1.06107e+02 25.358  0.7135 
1 1 1 -1  86  2  f 0  1.75533e+01 4.92903e-01 3.70751e+02 355.559 7.45395e+01  -5.78918e+00 0.00000e+00 0.00000e+00 2.77670e+02 355.559 9.30808e+01 175.559 0.9933 
1 1 1 -1  86  3  o 8  5.41734e+00 6.35129e-01 1.25953e+02 82.713  8.98054e-01  7.02313e+00  0.00000e+00 0.00000e+00 6.06559e+01 82.713  6.52970e+01 262.713 0.9264 
1 1 1 -1  86  4  o 8  7.18456e+00 5.86874e-01 1.35629e+02 336.972 1.13525e+01  -4.82545e+00 0.00000e+00 0.00000e+00 1.20378e+02 336.972 1.52513e+01 156.972 0.9586 
1 1 1 -1  86  5  o 13 1.98950e+01 5.49230e-01 3.37798e+02 216.286 -6.79000e+01 -4.98518e+01 0.00000e+00 0.00000e+00 3.97127e+02 216.286 5.93289e+01 216.286 0.9940 
1 1 1 -1  86  6  o 16 1.00951e+01 7.66212e-01 1.95485e+02 167.056 -2.54139e+01 5.84116e+00  0.00000e+00 0.00000e+00 1.72259e+02 167.056 2.32265e+01 347.056 0.9806 
1 1 1 -1  86  7  o 18 3.39497e+00 8.22287e-01 1.74612e+01 4.598   8.01814e-01  6.44876e-02  0.00000e+00 0.00000e+00 2.95371e+01 4.598   1.20759e+01 4.598   0.3728 
1 1 1 -1  86  8  o 19 5.37592e+00 7.10662e-01 5.66140e+01 166.092 -4.58846e+00 1.13618e+00  0.00000e+00 0.00000e+00 1.20284e+02 166.092 6.36698e+01 166.092 0.8866 
1 1 1 -1  86  9  o 17 6.22485e+00 7.36985e-01 1.53980e+02 225.999 -1.14230e+01 -1.18285e+01 0.00000e+00 0.00000e+00 6.97763e+01 225.999 8.42042e+01 45.999  0.9691 
1 1 1 -1  86  10 o 15 4.48266e+00 9.20828e-01 6.07650e+01 18.170  4.46460e+00  1.46533e+00  0.00000e+00 0.00000e+00 8.64419e+01 18.170  2.56769e+01 18.170  0.8859 
1 1 1 -1  86  11 o 2  3.41586e+00 9.27824e-01 6.92417e+01 135.589 -2.85564e+00 2.79754e+00  0.00000e+00 0.00000e+00 4.00131e+01 135.589 2.92286e+01 315.589 0.8634 
1 1 1 -1  86  12 o 19 5.85176e+00 1.06430e+00 9.23658e+01 13.852  9.09280e+00  2.24212e+00  0.00000e+00 0.00000e+00 1.12329e+02 13.852  1.99637e+01 13.852  0.9450 
1 1 1 -1  86  13 o 13 4.55160e+00 1.10332e+00 4.13725e+01 358.686 3.66618e+00  -8.40990e-02 0.00000e+00 0.00000e+00 1.01618e+02 358.686 6.02453e+01 358.686 0.8494 
1 1 1 -1  86  14 o 5  6.04089e+00 1.23230e+00 9.44741e+01 98.512  -1.57936e+00 1.05529e+01  0.00000e+00 0.00000e+00 1.18030e+02 98.512  2.35558e+01 98.512  0.9519 
1 1 1 -1  86  15 o 7  5.85858e+00 1.36834e+00 8.82411e+01 43.301  6.93347e+00  6.53390e+00  0.00000e+00 0.00000e+00 1.16370e+02 43.301  2.81292e+01 43.301  0.9460 
1 1 1 -1  87  1  o 8  3.74852e+00 7.11367e-01 6.13377e+01 61.259  1.12789e+00  2.05663e+00  0.00000e+00 0.00000e+00 4.28025e+01 61.259  1.85352e+01 241.259 0.7471 
1 1 1 -1  87  2  o 9  3.32081e+00 7.46467e-01 1.08080e+02 233.900 -2.31116e+00 -3.16944e+00 0.00000e+00 0.00000e+00 1.83634e+00 53.900  1.09917e+02 53.900  0.8605 
1 1 1 -1  87  3  o 4  7.38257e+00 5.75169e-01 1.75644e+02 174.567 -1.64106e+01 1.56078e+00  0.00000e+00 0.00000e+00 9.03346e+01 174.567 8.53095e+01 354.567 0.9692 
1 1 1 -1  87  4  o 19 6.19449e+00 6.23081e-01 1.30633e+02 274.702 8.65960e-01  -1.05290e+01 0.00000e+00 0.00000e+00 8.83985e+01 274.702 4.22343e+01 94.702  0.9514 
1 1 1 -1  87  5  o 7  6.90176e+00 6.71176e-01 1.10521e+02 85.842  7.03368e-01  9.67437e+00  0.00000e+00 0.00000e+00 1.32296e+02 85.842  2.17757e+01 85.842  0.9470 
1 1 1 -1  87  6  o 3  1.07833e+01 6.52613e-01 2.16164e+02 100.060 -5.50540e+00 3.10326e+01  0.00000e+00 0.00000e+00 1.77907e+02 100.060 3.82575e+01 280.060 0.9840 
1 1 1 -1  87  7  o 9  8.73661e+00 6.32765e-01 1.80514e+02 160.149 -2.43260e+01 8.78253e+00  0.00000e+00 0.00000e+00 1.37476e+02 160.149 4.30372e+01 340.149 0.9805 
1 1 1 -1  87  8  o 2  4.44798e+00 7.81164e-01 5.31556e+01 248.489 -1.36161e+00 -3.45467e+00 0.00000e+00 0.00000e+00 8.73761e+01 248.489 3.42205e+01 248.489 0.8515 
1 1 1 -1  87  9  o 13 6.97767e+00 6.74681e-01 1.72099e+02 87.052  1.10766e+00  2.15117e+01  0.00000e+00 0.00000e+00 8.05746e+01 87.052  9.15244e+01 267.052 0.9765 
1 1 1 -1  87  10 o 13 4.50856e+00 7.97821e-01 6.47322e+01 270.546 4.94390e-02  -5.18311e+00 0.00000e+00 0.00000e+00 8.52234e+01 270.546 2.04913e+01 270.546 0.8975 
1 1 1 -1  87  11 o 4  1.29529e+01 6.85772e-01 1.90689e+02 42.532  3.63287e+01  3.33260e+01  0.00000e+00 0.00000e+00 2.84127e+02 42.532  9.34377e+01 42.532  0.9898 
1 1 1 -1  87  12 o 11 5.33839e+00 1.09439e+00 1.35874e+02 284.421 3.24265e+00  -1.26097e+01 0.00000e+00 0.00000e+00 5.39400e+01 284.421 8.19340e+01 104.421 0.9608 
1 1 1 -1  87  13 f 0  3.46332e+00 1.00855e+00 6.14306e+01 198.348 -4.48982e+00 -1.48901e+00 0.00000e+00 0.00000e+00 5.21281e+01 198.348 9.30252e+00 18.348  0.8867 
1 1 1 -1  87  14 o 5  3.35277e+00 1.02323e+00 3.07515e+01 29.735  2.16402e+00  1.23611e+00  0.00000e+00 0.00000e+00 6.39027e+01 29.735  3.31512e+01 29.735  0.7641 
1 1 1 -1  87  15 o 14 6.40588e+00 1.37354e+00 1.11306e+02 185.421 -1.32744e+01 -1.25981e+00 0.00000e+00 0.00000e+00 1.16097e+02 185.421 4.79146e+00 185.421 0.9617 
1 1 1 -1  88  1  o 16 1.37115e+01 4.21921e-01 2.57321e+02 32.988  3.68632e+01  2.39282e+01  0.00000e+00 0.00000e+00 2.46595e+02 32.988  1.07268e+01 212.988 0.9886 
1 1 1 -1  88  2  o 13 9.07019e+00 5.18618e-01 1.32570e+02 149.748 -1.33935e+01 7.81160e+00  0.00000e+00 0.00000e+00 1.93526e+02 149.748 6.09560e+01 149.748 0.9672 
1 1 1 -1  88  3  o 7  6.30937e+00 6.16374e-01 1.07278e+02 22.901  8.16336e+00  3.44842e+00  0.00000e+00 0.00000e+00 1.13553e+02 22.901  6.27587e+00 22.901  0.9418 
1 1 1 -1  88  4  o 14 5.72267e+00 6.63507e-01 1.07648e+02 317.155 6.02110e+00  -5.58433e+00 0.00000e+00 0.00000e+00 9.15784e+01 317.155 1.60700e+01 137.155 0.9370 
1 1 1 -1  88  5  o 12 9.29852e+00 5.14988e-01 2.02835e+02 163.258 -2.59086e+01 7.79342e+00  0.00000e+00 0.00000e+00 1.36102e+02 163.258 6.67330e+01 343.258 0.9813 
1 1 1 -1  88  6  f 0  8.80120e+00 6.18180e-01 9.36135e+01 346.233 1.17416e+01  -2.87675e+00 0.00000e+00 0.00000e+00 2.19350e+02 346.233 1.25736e+02 346.233 0.9577 
1 1 1 -1  88  7  o 19 1.07029e+01 6.01803e-01 1.71483e+02 260.982 -4.67178e+00 -2.94375e+01 0.00000e+00 0.00000e+00 2.19018e+02 260.982 4.75359e+01 260.982 0.9831 
1 1 1 -1  88  8  o 7  9.27956e+00 6.89126e-01 1.84860e+02 38.995  2.29021e+01  1.85422e+01  0.00000e+00 0.00000e+00 1.53472e+02 38.995  3.13873e+01 218.995 0.9829 
1 1 1 -1  88  9  o 11 3.40199e+00 8.43093e-01 4.86524e+01 64.356  1.20453e+00  2.50906e+00  0.00000e+00 0.00000e+00 5.13133e+01 64.356  2.66098e+00 64.356  0.7926 
1 1 1 -1  88  10 o 5  4.28092e+00 9.69170e-01 6.28913e+01 200.371 -4.13915e+00 -1.53699e+00 0.00000e+00 0.00000e+00 7.63373e+01 200.371 1.34459e+01 200.371 0.8778 
1 1 1 -1  88  11 o 3  3.15784e+00 9.42219e-01 6.20666e+01 42.224  2.58223e+00  2.34342e+00  0.00000e+00 0.00000e+00 3.61973e+01 42.224  2.58693e+01 222.224 0.8404 
1 1 1 -1  88  12 o 15 6.05522e+00 1.08721e+00 1.10640e+02 267.526 -5.19670e-01 -1.20276e+01 0.00000e+00 0.00000e+00 1.03876e+02 267.526 6.76397e+00 87.526  0.9575 
1 1 1 -1  88  13 o 9  3.18006e+00 1.00315e+00 2.27719e+01 88.321  4.37664e-02  1.49333e+00  0.00000e+00 0.00000e+00 4.71355e+01 88.321  2.43637e+01 88.321  0.5946 
1 1 1 -1  88  14 o 10 5.14305e+00 1.24233e+00 7.97307e+01 93.745  -5.20511e-01 7.95166e+00  0.00000e+00 0.00000e+00 9.78830e+01 93.745  1.81523e+01 93.745  0.9350 
1 1 1 -1  88  15 o 12 4.87124e+00 1.32827e+00 6.72619e+01 319.091 4.75584e+00  -4.12093e+00 0.00000e+00 0.00000e+00 9.75217e+01 319.091 3.02598e+01 319.091 0.9167 
1 1 1 -1  89  1  o 15 6.58179e+00 5.07442e-01 9.75033e+01 157.557 -8.02665e+00 3.31542e+00  0.00000e+00 0.00000e+00 1.32580e+02 157.557 3.50763e+01 157.557 0.9405 
1 1 1 -1  89  2  o 4  3.56873e+00 7.19709e-01 8.60063e+01 56.466  2.14688e+00  3.23939e+00  0.00000e+00 0.00000e+00 2.79183e+01 56.466  5.80880e+01 236.466 0.8590 
1 1 1 -1  89  3  o 12 1.44421e+01 4.92151e-01 2.19468e+02 255.458 -1.11687e+01 -4.30548e+01 0.00000e+00 0.00000e+00 3.11073e+02 255.458 9.16046e+01 255.458 0.9887 
1 1 1 -1  89  4  o 17 9.77543e+00 5.28382e-01 1.62665e+02 125.406 -1.30969e+01 1.84250e+01  0.00000e+00 0.00000e+00 1.92331e+02 125.406 2.96656e+01 125.406 0.9776 
1 1 1 -1  89  5  o 17 5.38804e+00 6.97483e-01 1.09083e+02 118.754 -3.90676e+00 7.11991e+00  0.00000e+00 0.00000e+00 7.82422e+01 118.754 3.08413e+01 298.754 0.9362 
1 1 1 -1  89  6  o 5  6.95962e+00 7.05806e-01 1.03854e+02 47.083  7.84370e+00  8.43581e+00  0.00000e+00 0.00000e+00 1.43010e+02 47.083  3.91565e+01 47.083  0.9556 
1 1 1 -1  89  7  o 2  7.27672e+00 7.36091e-01 1.21494e+02 116.507 -6.05535e+00 1.21411e+01  0.00000e+00 0.00000e+00 1.38356e+02 116.507 1.68620e+01 116.507 0.9624 
1 1 1 -1  89  8  o 7  3.26895e+00 8.62266e-01 1.01586e+02 81.901  7.54660e-01  5.30292e+00  0.00000e+00 0.00000e+00 7.64852e+00 81.901  9.39376e+01 261.901 0.9010 
1 1 1 -1  89  9  f 0  3.47770e+00 9.23020e-01 6.27044e+01 357.847 3.59548e+00  -1.35158e-01 0.00000e+00 0.00000e+00 4.63546e+01 357.847 1.63498e+01 177.847 0.8461 
1 1 1 -1  89  10 o 18 1.10576e+01 6.64133e-01 2.18721e+02 255.339 -1.23407e+01 -4.71693e+01 0.00000e+00 0.00000e+00 1.86656e+02 255.339 3.20647e+01 75.339  0.9897 
1 1 1 -1  89  11 o 9  8.27158e+00 8.51423e-01 1.40908e+02 318.814 1.71166e+01  -1.49768e+01 0.00000e+00 0.00000e+00 1.58471e+02 318.814 1.75634e+01 318.814 0.9778 
1 1 1 -1  89  12 o 1  4.59842e+00 1.08074e+00 6.56466e+01 212.743 -4.53655e+00 -2.91728e+00 0.00000e+00 0.00000e+00 8.77387e+01 212.743 2.20921e+01 212.743 0.9018 
1 1 1 -1  89  13 o 2  4.42143e+00 1.14467e+00 6.86088e+01 255.547 -1.47650e+00 -5.72840e+00 0.00000e+00 0.00000e+00 8.02666e+01 255.547 1.16578e+01 255.547 0.9110 
1 1 1 -1  89  14 f 0  4.43243e+00 1.21304e+00 6.08718e+01 176.114 -5.59179e+00 3.79800e-01  0.00000e+00 0.00000e+00 8.73796e+01 176.114 2.65078e+01 176.114 0.9057 
1 1 1 -1  90  1  o 16 7.61986e+00 4.81083e-01 1.58054e+02 42.251  1.13704e+01  1.03287e+01  0.00000e+00 0.00000e+00 1.15713e+02 42.251  4.23402e+01 222.251 0.9669 
1 1 1 -1  90  2  o 16 6.42666e+00 5.25163e-01 7.82883e+01 103.113 -1.58682e+00 6.81210e+00  0.00000e+00 0.00000e+00 1.42691e+02 103.113 6.44024e+01 103.113 0.9255 
1 1 1 -1  90  3  o 3  2.89480e+00 6.78534e-01 6.46070e+01 129.417 -1.61278e+00 1.96226e+00  0.00000e+00 0.00000e+00 1.81150e+01 129.417 4.64920e+01 309.417 0.7693 
1 1 1 -1  90  4  o 1  5.73746e+00 7.37413e-01 8.49401e+01 71.898  2.09689e+00  6.41450e+00  0.00000e+00 0.00000e+00 1.11644e+02 71.898  2.67037e+01 71.898  0.9226 
1 1 1 -1  90  5  o 17 8.54497e+00 5.77254e-01 1.77737e+02 106.282 -6.33006e+00 2.16722e+01  0.00000e+00 0.00000e+00 1.32392e+02 106.282 4.53450e+01 286.282 0.9776 
1 1 1 -1  90  6  o 10 9.70222e+00 5.50550e-01 2.01653e+02 297.390 1.49010e+01  -2.87593e+01 0.00000e+00 0.00000e+00 1.52808e+02 297.390 4.88448e+01 117.390 0.9844 
1 1 1 -1  90  7  o 9  6.92137e+00 7.56061e-01 1.31435e+02 177.827 -1.34535e+01 5.10489e-01  0.00000e+00 0.00000e+00 1.15588e+02 177.827 1.58477e+01 357.827 0.9621 
1 1 1 -1  90  8  o 3  5.98235e+00 8.93342e-01 1.24207e+02 350.937 1.18147e+01  -1.88457e+00 0.00000e+00 0.00000e+00 8.81172e+01 350.937 3.60898e+01 170.937 0.9573 
1 1 1 -1  90  9  o 15 5.78924e+00 9.77003e-01 1.06847e+02 347.652 9.52139e+00  -2.08429e+00 0.00000e+00 0.00000e+00 9.63568e+01 347.652 1.04906e+01 167.652 0.9472 
1 1 1 -1  90  10 o 12 5.54099e+00 9.16744e-01 1.16652e+02 163.712 -1.07501e+01 3.14106e+00  0.00000e+00 0.00000e+00 7.91609e+01 163.712 3.74907e+01 343.712 0.9543 
1 1 1 -1  90  11 o 6  4.80898e+00 1.06897e+00 8.70980e+01 93.711  -4.89318e-01 7.54357e+00  0.00000e+00 0.00000e+00 7.86441e+01 93.711  8.45396e+00 273.711 0.9313 
1 1 1 -1  90  12 o 14 3.56298e+00 1.03091e+00 2.07464e+01 202.331 -1.33155e+00 -5.46954e-01 0.00000e+00 0.00000e+00 5.57825e+01 202.331 3.50362e+01 202.331 0.5808 
1 1 1 -1  90  13 o 9  2.64121e+00 8.79981e-01 3.11607e+01 327.519 1.65831e+00  -1.05570e+00 0.00000e+00 0.00000e+00 3.63826e+01 327.519 5.22196e+00 327.519 0.6921 
1 1 1 -1  90  14 o 1  3.94188e+00 1.15242e+00 7.45595e+01 197.026 -6.05416e+00 -1.85396e+00 0.00000e+00 0.00000e+00 5.89229e+01 197.026 1.56366e+01 17.026  0.9172 
1 1 1 -1  91  1  o 3  3.96559e+00 6.84089e-01 6.90845e+01 169.608 -3.41520e+00 6.26282e-01  0.00000e+00 0.00000e+00 5.46103e+01 169.608 1.44742e+01 349.608 0.8396 
1 1 1 -1  91  2  o 18 4.21153e+00 6.80264e-01 9.44340e+01 352.658 5.34986e+00  -6.89348e-01 0.00000e+00 0.00000e+00 4.66371e+01 352.658 4.77969e+01 172.658 0.9018 
1 1 1 -1  91  3  o 4  7.80517e+00 5.01073e-01 1.92585e+02 285.565 6.04460e+00  -2.16999e+01 0.00000e+00 0.00000e+00 9.07704e+01 285.565 1.01814e+02 105.565 0.9775 
1 1 1 -1  91  4  o 16 1.04954e+01 5.83751e-01 2.45336e+02 58.603  2.04299e+01  3.34729e+01  0.00000e+00 0.00000e+00 1.39337e+02 58.603  1.05999e+02 238.603 0.9872 
1 1 1 -1  91  5  o 17 1.36530e+01 5.43707e-01 2.75417e+02 321.749 5.00446e+01  -3.94537e+01 0.00000e+00 0.00000e+00 2.27340e+02 321.749 4.80774e+01 141.749 0.9921 
1 1 1 -1  91  6  o 1  8.61068e+00 5.81306e-01 1.49483e+02 107.272 -6.23392e+00 2.00487e+01  0.00000e+00 0.00000e+00 1.62290e+02 107.272 1.28067e+01 107.272 0.9759 
1 1 1 -1  91  7  o 18 5.82841e+00 7.63844e-01 1.03169e+02 327.217 7.74920e+00  -4.99071e+00 0.00000e+00 0.00000e+00 1.00898e+02 327.217 2.27055e+00 147.217 0.9441 
1 1 1 -1  91  8  o 8  5.42415e+00 9.19873e-01 8.29285e+01 180.764 -7.25611e+00 -9.67493e-02 0.00000e+00 0.00000e+00 1.03714e+02 180.764 2.07856e+01 180.764 0.9283 
1 1 1 -1  91  9  o 11 2.91101e+00 8.83572e-01 5.89679e+01 9.290   2.92302e+00  4.78131e-01  0.00000e+00 0.00000e+00 2.80756e+01 9.290   3.08923e+01 189.290 0.8071 
1 1 1 -1  91  10 o 1  1.09598e+01 9.36438e-01 1.51802e+02 176.181 -2.92268e+01 1.95119e+00  0.00000e+00 0.00000e+00 2.46985e+02 176.181 9.51833e+01 176.181 0.9828 
1 1 1 -1  91  11 o 2  3.74960e+00 9.30775e-01 4.31384e+01 356.916 3.25842e+00  -1.75539e-01 0.00000e+00 0.00000e+00 7.16889e+01 356.916 2.85506e+01 356.916 0.8277 
1 1 1 -1  91  12 o 2  5.77472e+00 1.15786e+00 9.15188e+01 173.877 -1.00018e+01 1.07298e+00  0.00000e+00 0.00000e+00 1.11072e+02 173.877 1.95529e+01 173.877 0.9489 
1 1 1 -1  91  13 o 11 3.17395e+00 9.53097e-01 6.97377e+01 38.810  4.08287e+00  3.28386e+00  0.00000e+00 0.00000e+00 3.56303e+01 38.810  3.41073e+01 218.810 0.8987 
1 1 1 -1  91  14 o 9  3.54898e+00 1.09944e+00 2.49821e+01 228.533 -1.38392e+00 -1.56604e+00 0.00000e+00 0.00000e+00 6.82836e+01 228.533 4.33015e+01 228.533 0.7120 
1 1 1 -1  92  1  o 4  4.31139e+00 6.51103e-01 8.53422e+01 28.026  4.47182e+00  2.38032e+00  0.00000e+00 0.00000e+00 5.79524e+01 28.026  2.73897e+01 208.026 0.8949 
1 1 1 -1  92  2  f 0  7.62868e+00 4.92202e-01 8.33658e+01 52.430  5.82176e+00  7.56779e+00  0.00000e+00 0.00000e+00 1.84654e+02 52.430  1.01288e+02 52.430  0.9461 
1 1 1 -1  92  3  o 5  6.28055e+00 5.61456e-01 5.73194e+01 204.634 -4.72321e+00 -2.16587e+00 0.00000e+00 0.00000e+00 1.52020e+02 204.634 9.47007e+01 204.634 0.8977 
1 1 1 -1  92  4  o 13 9.91202e+00 5.02377e-01 1.31251e+02 164.293 -1.86814e+01 5.25342e+00  0.00000e+00 0.00000e+00 2.27061e+02 164.293 9.58101e+01 164.293 0.9739 
1 1 1 -1  92  5  o 14 1.09490e+01 5.51505e-01 1.97498e+02 35.612  2.90776e+01  2.08266e+01  0.00000e+00 0.00000e+00 2.03064e+02 35.612  5.56523e+00 35.612  0.9859 
1 1 1 -1  92  6  o 1  5.34284e+00 7.34933e-01 1.22178e+02 218.636 -8.17073e+00 -6.53114e+00 0.00000e+00 0.00000e+00 6.62790e+01 218.636 5.58987e+01 38.637  0.9509 
1 1 1 -1  92  7  o 13 3.24097e+00 7.83679e-01 3.34799e+01 238.346 -8.96143e-01 -1.45357e+00 0.00000e+00 0.00000e+00 4.38374e+01 238.346 1.03575e+01 238.346 0.6434 
1 1 1 -1  92  8  o 2  2.87041e+00 8.71609e-01 7.79561e+01 62.502  1.75363e+00  3.36904e+00  0.00000e+00 0.00000e+00 1.30227e+01 62.502  6.49334e+01 242.502 0.8553 
1 1 1 -1  92  9  o 6  5.91869e+00 9.99857e-01 7.33951e+01 278.352 1.05363e+00  -7.17697e+00 0.00000e+00 0.00000e+00 1.30093e+02 278.352 5.66979e+01 278.352 0.9283 
1 1 1 -1  92  10 o 11 4.00868e+00 1.07581e+00 5.67839e+01 332.675 3.44045e+00  -1.77763e+00 0.00000e+00 0.00000e+00 7.05906e+01 332.675 1.38067e+01 332.675 0.8584 
1 1 1 -1  92  11 o 2  2.93275e+00 9.14476e-01 5.05615e+01 38.404  2.35944e+00  1.87031e+00  0.00000e+00 0.00000e+00 3.73924e+01 38.404  1.31692e+01 218.404 0.8108 
1 1 1 -1  92  12 o 19 3.29310e+00 9.93010e-01 7.94640e+01 143.995 -4.77948e+00 3.47308e+00  0.00000e+00 0.00000e+00 3.14106e+01 143.995 4.80534e+01 323.995 0.9109 
1 1 1 -1  92  13 o 9  3.84559e+00 1.09872e+00 9.56960e+01 81.606  1.16694e+00  7.90826e+00  0.00000e+00 0.00000e+00 3.71242e+01 81.606  5.85718e+01 261.606 0.9352 
1 1 1 -1  92  14 o 12 3.04561e+00 9.96095e-01 1.92419e+01 196.416 -1.52130e+00 -4.48194e-01 0.00000e+00 0.00000e+00 5.00621e+01 196.416 3.08202e+01 196.416 0.6167 
1 1 1 -1  93  1  o 2  5.82608e+00 5.81042e-01 1.05740e+02 331.846 7.51115e+00  -4.01969e+00 0.00000e+00 0.00000e+00 9.74622e+01 331.846 8.27822e+00 151.846 0.9393 
1 1 1 -1  93  2  o 16 5.30713e+00 5.95727e-01 1.14158e+02 191.400 -8.47475e+00 -1.70886e+00 0.00000e+00 0.00000e+00 7.11017e+01 191.400 4.30561e+01 11.400  0.9403 
1 1 1 -1  93  3  o 2  1.46892e+01 4.47507e-01 2.52033e+02 137.599 -4.21367e+01 3.84774e+01  0.00000e+00 0.00000e+00 2.88414e+02 137.599 3.63813e+01 137.599 0.9912 
1 1 1 -1  93  4  o 18 7.59503e+00 5.31440e-01 1.20661e+02 301.668 7.96329e+00  -1.29097e+01 0.00000e+00 0.00000e+00 1.51730e+02 301.668 3.10684e+01 301.668 0.9665 
1 1 1 -1  93  5  o 2  6.81505e+00 6.58542e-01 1.17174e+02 144.381 -1.02835e+01 7.36745e+00  0.00000e+00 0.00000e+00 1.25440e+02 144.381 8.26573e+00 144.381 0.9596 
1 1 1 -1  93  6  o 1  5.00386e+00 7.80129e-01 1.11381e+02 292.687 3.53911e+00  -8.46598e+00 0.00000e+00 0.00000e+00 6.37568e+01 292.687 4.76237e+01 112.687 0.9438 
1 1 1 -1  93  7  o 7  1.43074e+01 5.66191e-01 2.26922e+02 80.311  1.02114e+01  5.98060e+01  0.00000e+00 0.00000e+00 2.99027e+02 80.311  7.21049e+01 80.311  0.9917 
1 1 1 -1  93  8  o 15 2.87599e+00 8.10423e-01 7.55678e+01 167.813 -3.75206e+00 8.10345e-01  0.00000e+00 0.00000e+00 1.57492e+01 167.813 5.98186e+01 347.813 0.8570 
1 1 1 -1  93  9  o 12 4.98642e+00 9.51741e-01 9.18773e+01 299.008 3.70296e+00  -6.67799e+00 0.00000e+00 0.00000e+00 8.02076e+01 299.008 1.16697e+01 119.008 0.9320 
1 1 1 -1  93  10 f 0  1.33965e+01 8.82651e-01 2.41510e+02 146.042 -5.24949e+01 3.53527e+01  0.00000e+00 0.00000e+00 2.50297e+02 146.042 8.78706e+00 146.042 0.9921 
1 1 1 -1  93  11 o 5  5.29339e+00 1.32326e+00 1.38479e+02 358.711 1.09779e+01  -2.46945e-01 0.00000e+00 0.00000e+00 4.81327e+01 358.711 9.03458e+01 178.711 0.9533 
1 1 1 -1  93  12 o 6  4.10773e+00 1.09904e+00 6.51763e+01 337.685 5.06070e+00  -2.07710e+00 0.00000e+00 0.00000e+00 7.19300e+01 337.685 6.75370e+00 337.685 0.9033 
1 1 1 -1  93  13 o 15 2.92690e+00 9.53365e-01 4.07977e+01 323.576 2.61211e+00  -1.92751e+00 0.00000e+00 0.00000e+00 4.85395e+01 323.576 7.74177e+00 323.576 0.8267 
1 1 1 -1  93  14 o 6  2.84337e+00 9.41047e-01 2.98878e+01 232.666 -1.43779e+00 -1.88504e+00 0.00000e+00 0.00000e+00 4.88018e+01 232.666 1.89140e+01 232.666 0.7502 
1 1 1 -1  94  1  o 7  1.72302e+01 4.51352e-01 2.23319e+02 358.021 5.92904e+01  -2.04833e+00 0.00000e+00 0.00000e+00 4.10875e+02 358.021 1.87556e+02 358.021 0.9915 
1 1 1 -1  94  2  o 1  1.63264e+01 4.47947e-01 2.73299e+02 163.058 -6.45907e+01 1.96759e+01  0.00000e+00 0.00000e+00 3.28171e+02 163.058 5.48720e+01 163.058 0.9926 
1 1 1 -1  94  3  o 8  6.86680e+00 5.37464e-01 1.25744e+02 347.030 1.42763e+01  -3.28813e+00 0.00000e+00 0.00000e+00 1.20220e+02 347.030 5.52383e+00 167.030 0.9652 
1 1 1 -1  94  4  o 9  3.14497e+00 7.69001e-01 7.33312e+01 281.586 6.98023e-01  -3.40468e+00 0.00000e+00 0.00000e+00 2.46560e+01 281.586 4.86752e+01 101.586 0.8398 
1 1 1 -1  94  5  o 12 7.47126e+00 5.76149e-01 1.37100e+02 67.351  6.73245e+00  1.61347e+01  0.00000e+00 0.00000e+00 1.31949e+02 67.351  5.15063e+00 247.351 0.9710 
1 1 1 -1  94  6  o 11 6.13758e+00 7.04665e-01 1.13782e+02 324.812 9.92952e+00  -7.00148e+00 0.00000e+00 0.00000e+00 1.04188e+02 324.812 9.59434e+00 144.812 0.9579 
1 1 1 -1  94  7  o 12 4.86522e+00 8.58707e-01 1.09746e+02 65.741  3.45819e+00  7.67370e+00  0.00000e+00 0.00000e+00 5.94727e+01 65.741  5.02736e+01 245.741 0.9386 
1 1 1 -1  94  8  o 10 2.19495e+00 7.13862e-01 3.80286e+01 31.842  1.33870e+00  8.31379e-01  0.00000e+00 0.00000e+00 1.19164e+01 31.842  2.61122e+01 211.842 0.6143 
1 1 1 -1  94  9  o 7  2.55077e+00 8.24434e-01 2.13490e+01 12.109  9.85977e-01  2.11529e-01  0.00000e+00 0.00000e+00 2.10826e+01 12.109  2.66448e-01 192.109 0.4494 
1 1 1 -1  94  10 o 8  6.97601e+00 1.16068e+00 1.10857e+02 248.056 -4.67955e+00 -1.16149e+01 0.00000e+00 0.00000e+00 1.36696e+02 248.056 2.58392e+01 248.056 0.9592 
1 1 1 -1  94  11 o 15 2.90182e+00 9.71923e-01 5.22291e+01 340.439 2.90379e+00  -1.03176e+00 0.00000e+00 0.00000e+00 3.52961e+01 340.439 1.69329e+01 160.439 0.8158 
1 1 1 -1  94  12 o 5  7.90412e+00 1.22047e+00 1.32155e+02 156.694 -1.74349e+01 7.51067e+00  0.00000e+00 0.00000e+00 1.52049e+02 156.694 1.98946e+01 156.694 0.9733 
1 1 1 -1  94  13 o 14 7.43099e+00 1.21916e+00 1.42541e+02 301.084 1.17971e+01  -1.95689e+01 0.00000e+00 0.00000e+00 1.25690e+02 301.084 1.68512e+01 121.084 0.9779 
1 1 1 -1  95  1  o 15 9.77380e+00 4.70626e-01 1.93383e+02 173.140 -3.25582e+01 3.91693e+00  0.00000e+00 0.00000e+00 1.63764e+02 173.140 2.96186e+01 353.140 0.9846 
1 1 1 -1  95  2  o 8  1.25880e+01 4.53833e-01 2.09907e+02 155.017 -4.05898e+01 1.89125e+01  0.00000e+00 0.00000e+00 2.51947e+02 155.017 4.20398e+01 155.017 0.9888 
1 1 1 -1  95  3  f 0  7.89939e+00 5.11857e-01 1.26418e+02 297.293 7.60528e+00  -1.47394e+01 0.00000e+00 0.00000e+00 1.57669e+02 297.293 3.12515e+01 297.293 0.9694 
1 1 1 -1  95  4  o 10 3.99989e+00 7.41175e-01 3.84848e+01 151.771 -2.07685e+00 1.11494e+00  0.00000e+00 0.00000e+00 7.25642e+01 151.771 3.40794e+01 151.771 0.7485 
1 1 1 -1  95  5  o 6  1.10156e+01 6.26952e-01 2.43914e+02 35.057  3.56462e+01  2.50126e+01  0.00000e+00 0.00000e+00 1.59810e+02 35.057  8.41041e+01 215.057 0.9885 
1 1 1 -1  95  6  o 6  5.29578e+00 7.39810e-01 1.44282e+02 105.825 -3.61303e+00 1.27473e+01  0.00000e+00 0.00000e+00 4.44446e+01 105.825 9.98369e+01 285.825 0.9615 
1 1 1 -1  95  7  o 15 5.55950e+00 8.08176e-01 1.24815e+02 289.487 4.00628e+00  -1.13215e+01 0.00000e+00 0.00000e+00 7.23841e+01 289.487 5.24306e+01 109.487 0.9574 
1 1 1 -1  95  8  o 12 7.52224e+00 7.48909e-01 1.20730e+02 57.679  9.37437e+00  1.48167e+01  0.00000e+00 0.00000e+00 1.49753e+02 57.679  2.90229e+01 57.679  0.9711 
1 1 1 -1  95  9  o 17 3.43160e+00 9.23079e-01 4.97870e+01 171.076 -3.03654e+00 4.76809e-01  0.00000e+00 0.00000e+00 5.37555e+01 171.076 3.96847e+00 171.076 0.8153 
1 1 1 -1  95  10 o 9  4.94912e+00 1.20073e+00 7.40936e+01 95.184  -5.49415e-01 6.05607e+00  0.00000e+00 0.00000e+00 9.31395e+01 95.184  1.90460e+01 95.184  0.9136 
1 1 1 -1  95  11 o 5  5.75268e+00 1.32704e+00 1.16059e+02 329.186 9.50487e+00  -5.66926e+00 0.00000e+00 0.00000e+00 8.67190e+01 329.186 2.93399e+01 149.186 0.9537 
1 1 1 -1  95  12 o 13 4.59791e+00 1.23417e+00 9.18740e+01 230.140 -5.05519e+00 -6.05462e+00 0.00000e+00 0.00000e+00 6.67812e+01 230.140 2.50928e+01 50.140  0.9343 
1 1 1 -1  95  13 o 4  3.84358e+00 1.11319e+00 6.51141e+01 347.072 5.87014e+00  -1.34747e+00 0.00000e+00 0.00000e+00 6.43473e+01 347.072 7.66857e-01 167.072 0.9127 
1 1 1 -1  96  1  f 0  3.30427e+00 7.47269e-01 5.32656e+01 309.387 1.71312e+00  -2.08652e+00 0.00000e+00 0.00000e+00 4.29809e+01 309.387 1.02848e+01 129.387 0.7851 
1 1 1 -1  96  2  o 12 7.99387e+00 5.11191e-01 1.52667e+02 271.000 3.53648e-01  -2.02527e+01 0.00000e+00 0.00000e+00 1.36467e+02 271.000 1.62000e+01 91.000  0.9750 
1 1 1 -1  96  3  o 1  4.76362e+00 6.90174e-01 9.40150e+01 148.749 -5.99206e+00 3.63615e+00  0.00000e+00 0.00000e+00 6.95276e+01 148.749 2.44874e+01 328.749 0.9256 
1 1 1 -1  96  4  o 19 2.96296e+00 7.59227e-01 8.33898e+01 78.122  8.46614e-01  4.02515e+00  0.00000e+00 0.00000e+00 1.19468e+01 78.122  7.14430e+01 258.122 0.8677 
1 1 1 -1  96  5  o 13 7.13564e+00 6.67425e-01 1.42609e+02 317.298 1.23763e+01  -1.14214e+01 0.00000e+00 0.00000e+00 1.13922e+02 317.298 2.86872e+01 137.298 0.9698 
1 1 1 -1  96  6  o 16 9.14435e+00 5.50465e-01 1.67199e+02 177.951 -2.76079e+01 9.87540e-01  0.00000e+00 0.00000e+00 1.65452e+02 177.951 1.74664e+00 357.951 0.9817 
1 1 1 -1  96  7  o 7  4.70386e+00 8.86283e-01 4.03753e+01 354.298 2.97942e+00  -2.97508e-01 0.00000e+00 0.00000e+00 1.00669e+02 354.298 6.02940e+01 354.298 0.8096 
1 1 1 -1  96  8  o 18 1.04502e+01 6.48766e-01 1.05971e+02 258.770 -4.22269e+00 -2.12667e+01 0.00000e+00 0.00000e+00 2.71865e+02 258.770 1.65894e+02 258.770 0.9767 
1 1 1 -1  96  9  o 12 3.92053e+00 9.70005e-01 6.22322e+01 293.230 1.77941e+00  -4.14576e+00 0.00000e+00 0.00000e+00 6.55148e+01 293.230 3.28260e+00 293.230 0.8807 
1 1 1 -1  96  10 o 2  3.24906e+00 9.62932e-01 1.11535e+02 81.511  1.02902e+00  6.89408e+00  0.00000e+00 0.00000e+00 3.82969e-01 261.511 1.11918e+02 261.511 0.9252 
1 1 1 -1  96  11 o 11 3.59258e+00 1.12944e+00 7.79408e+01 236.021 -2.93025e+00 -4.34774e+00 0.00000e+00 0.00000e+00 4.13655e+01 236.021 3.65752e+01 56.021  0.8987 
1 1 1 -1  96  12 o 11 4.33760e+00 1.21847e+00 5.43008e+01 76.186  1.13714e+00  4.62471e+00  0.00000e+00 0.00000e+00 8.78521e+01 76.186  3.35513e+01 76.186  0.8876 
1 1 1 -1  96  13 o 16 3.09544e+00 1.03940e+00 5.30014e+01 108.781 -1.33119e+00 3.91456e+00  0.00000e+00 0.00000e+00 4.61852e+01 108.781 6.81617e+00 288.781 0.8685 
1 1 1 -1  97  1  o 10 6.89655e+00 5.56520e-01 7.71733e+01 145.401 -7.19879e+00 4.96585e+00  0.00000e+00 0.00000e+00 1.63531e+02 145.401 8.63579e+01 145.401 0.9410 
1 1 1 -1  97  2  o 4  6.41700e+00 5.67044e-01 1.00812e+02 118.841 -5.10665e+00 9.27325e+00  0.00000e+00 0.00000e+00 1.25641e+02 118.841 2.48289e+01 118.841 0.9515 
1 1 1 -1  97  3  o 9  3.93459e+00 7.06953e-01 1.28192e+02 197.063 -7.26716e+00 -2.23060e+00 0.00000e+00 0.00000e+00 7.73693e+00 197.063 1.20455e+02 17.063  0.9317 
1 1 1 -1  97  4  o 18 5.62484e+00 6.34550e-01 9.51008e+01 317.266 7.05779e+00  -6.52056e+00 0.00000e+00 0.00000e+00 1.02247e+02 317.266 7.14614e+00 317.266 0.9464 
1 1 1 -1  97  5  o 1  6.03767e+00 7.57645e-01 9.24565e+01 1.256   9.58437e+00  2.10142e-01  0.00000e+00 0.00000e+00 1.19280e+02 1.256   2.68236e+01 1.256   0.9463 
1 1 1 -1  97  6  o 5  2.46979e+00 7.28907e-01 5.09610e+01 2.199   2.41307e+00  9.26451e-02  0.00000e+00 0.00000e+00 1.81536e+01 2.199   3.28074e+01 182.199 0.7554 
1 1 1 -1  97  7  o 11 4.07031e+00 8.58393e-01 7.92072e+01 124.331 -3.12981e+00 4.58273e+00  0.00000e+00 0.00000e+00 5.71535e+01 124.331 2.20537e+01 304.331 0.9047 
1 1 1 -1  97  8  o 9  2.65182e+00 8.13938e-01 3.41728e+01 118.098 -8.07856e-01 1.51312e+00  0.00000e+00 0.00000e+00 2.91327e+01 118.098 5.04006e+00 298.098 0.6450 
1 1 1 -1  97  9  o 7  5.80239e+00 9.54001e-01 7.57565e+01 341.865 7.78727e+00  -2.55053e+00 0.00000e+00 0.00000e+00 1.25314e+02 341.865 4.95573e+01 341.865 0.9368 
1 1 1 -1  97  10 o 5  3.37493e+00 9.73932e-01 5.39157e+01 295.806 1.60849e+00  -3.32642e+00 0.00000e+00 0.00000e+00 5.22140e+01 295.806 1.70164e+00 115.806 0.8507 
1 1 1 -1  97  11 o 19 2.40630e+00 8.16435e-01 2.71814e+01 37.644  1.31569e+00  1.01485e+00  0.00000e+00 0.00000e+00 2.91426e+01 37.644  1.96121e+00 37.644  0.6336 
1 1 1 -1  97  12 o 7  2.47840e+00 8.67996e-01 2.87739e+01 326.852 1.61848e+00  -1.05700e+00 0.00000e+00 0.00000e+00 3.40295e+01 326.852 5.25569e+00 326.852 0.6865 
1 1 1 -1  97  13 o 15 2.76783e+00 9.65505e-01 1.16614e+01 123.383 -5.28842e-01 8.02560e-01  0.00000e+00 0.00000e+00 3.24869e+01 123.383 2.08255e+01 123.383 0.4324 
1 1 1 -1  98  1  o 5  7.12076e+00 5.64340e-01 9.52571e+01 164.817 -1.04066e+01 2.82412e+00  0.00000e+00 0.00000e+00 1.56237e+02 164.817 6.09799e+01 164.817 0.9524 
1 1 1 -1  98  2  o 4  2.39945e+00 6.80780e-01 2.96580e+01 140.320 -9.44296e-01 7.83415e-01  0.00000e+00 0.00000e+00 1.66975e+01 140.320 1.29605e+01 320.320 0.5211 
1 1 1 -1  98  3  o 6  6.31500e+00 5.91794e-01 8.80581e+01 217.412 -8.07951e+00 -6.17985e+00 0.00000e+00 0.00000e+00 1.34217e+02 217.412 4.61585e+01 217.412 0.9495 
1 1 1 -1  98  4  o 18 7.89184e+00 5.51405e-01 1.29320e+02 21.592  1.79168e+01  7.09068e+00  0.00000e+00 0.00000e+00 1.55464e+02 21.592  2.61435e+01 21.592  0.9737 
1 1 1 -1  98  5  o 16 9.30217e+00 5.80419e-01 1.75246e+02 269.698 -1.53262e-01 -2.90829e+01 0.00000e+00 0.00000e+00 1.63412e+02 269.698 1.18340e+01 89.698  0.9827 
1 1 1 -1  98  6  o 11 6.53843e+00 6.54330e-01 8.67737e+01 109.910 -3.40290e+00 9.39547e+00  0.00000e+00 0.00000e+00 1.42921e+02 109.910 5.61475e+01 109.910 0.9486 
1 1 1 -1  98  7  o 4  5.56541e+00 8.18776e-01 5.64413e+01 10.865  5.22632e+00  1.00313e+00  0.00000e+00 0.00000e+00 1.29052e+02 10.865  7.26110e+01 10.865  0.9003 
1 1 1 -1  98  8  o 13 3.88882e+00 8.94924e-01 9.27833e+01 241.689 -3.27819e+00 -6.08558e+00 0.00000e+00 0.00000e+00 4.02468e+01 241.689 5.25365e+01 61.689  0.9245 
1 1 1 -1  98  9  o 10 2.78838e+00 8.30515e-01 2.86244e+01 52.103  1.05709e+00  1.35802e+00  0.00000e+00 0.00000e+00 3.80077e+01 52.103  9.38333e+00 52.103  0.6462 
1 1 1 -1  98  10 o 10 3.66707e+00 1.03820e+00 4.28979e+01 322.807 2.56748e+00  -1.94831e+00 0.00000e+00 0.00000e+00 6.89370e+01 322.807 2.60392e+01 322.807 0.8252 
1 1 1 -1  98  11 o 3  2.58930e+00 8.54155e-01 6.18245e+01 181.578 -3.89962e+00 -1.07402e-01 0.00000e+00 0.00000e+00 2.03771e+01 181.578 4.14474e+01 1.578   0.8596 
1 1 1 -1  98  12 o 18 3.42517e+00 1.10080e+00 5.84036e+01 88.911  9.21236e-02  4.84585e+00  0.00000e+00 0.00000e+00 5.40574e+01 88.911  4.34628e+00 268.911 0.8897 
1 1 1 -1  98  13 o 18 5.80295e+00 1.45704e+00 1.29115e+02 289.489 4.41703e+00  -1.24808e+01 0.00000e+00 0.00000e+00 7.66183e+01 289.489 5.24969e+01 109.489 0.9615 
1 1 1 -1  99  1  o 3  9.52928e+00 4.95683e-01 1.68904e+02 345.846 2.64365e+01  -6.66675e+00 0.00000e+00 0.00000e+00 1.77826e+02 345.846 8.92279e+00 345.846 0.9815 
1 1 1 -1  99  2  o 14 5.23128e+00 6.67637e-01 8.54839e+01 246.428 -3.16524e+00 -7.25452e+00 0.00000e+00 0.00000e+00 9.57263e+01 246.428 1.02425e+01 246.428 0.9345 
1 1 1 -1  99  3  o 12 5.10812e+00 7.39701e-01 1.10979e+02 275.346 9.19484e-01  -9.82555e+00 0.00000e+00 0.00000e+00 6.84642e+01 275.346 4.25146e+01 95.346  0.9479 
1 1 1 -1  99  4  o 14 8.38038e+00 5.62382e-01 1.43126e+02 83.545  2.58329e+00  2.28321e+01  0.00000e+00 0.00000e+00 1.60539e+02 83.545  1.74124e+01 83.545  0.9780 
1 1 1 -1  99  5  o 2  1.27800e+01 5.05719e-01 2.27275e+02 207.514 -5.10524e+01 -2.65925e+01 0.00000e+00 0.00000e+00 2.41953e+02 207.514 1.46774e+01 207.514 0.9913 
1 1 1 -1  99  6  o 8  3.73618e+00 8.66019e-01 1.12999e+02 307.512 4.40802e+00  -5.74215e+00 0.00000e+00 0.00000e+00 1.53884e+01 307.512 9.76107e+01 127.512 0.9281 
1 1 1 -1  99  7  o 19 4.67747e+00 8.91524e-01 1.26881e+02 290.029 3.62483e+00  -9.94371e+00 0.00000e+00 0.00000e+00 3.78338e+01 290.029 8.90472e+01 110.029 0.9515 
1 1 1 -1  99  8  o 9  9.10855e+00 6.65468e-01 1.19308e+02 101.999 -5.02783e+00 2.36569e+01  0.00000e+00 0.00000e+00 2.10581e+02 101.999 9.12731e+01 101.999 0.9791 
1 1 1 -1  99  9  o 3  7.06644e+00 8.94198e-01 1.45056e+02 345.313 1.99847e+01  -5.23800e+00 0.00000e+00 0.00000e+00 1.09785e+02 345.313 3.52716e+01 165.313 0.9755 
1 1 1 -1  99  10 o 15 3.73249e+00 1.03774e+00 8.19053e+01 39.421  5.14189e+00  4.22680e+00  0.00000e+00 0.00000e+00 4.51700e+01 39.421  3.67353e+01 219.421 0.9215 
1 1 1 -1  99  11 o 8  6.55616e+00 1.12450e+00 8.21571e+01 238.493 -5.76489e+00 -9.40497e+00 0.00000e+00 0.00000e+00 1.48659e+02 238.493 6.65024e+01 238.493 0.9535 
1 1 1 -1  99  12 o 4  3.09914e+00 9.95463e-01 6.21750e+01 270.483 4.39194e-02  -5.21249e+00 0.00000e+00 0.00000e+00 4.05129e+01 270.483 2.16621e+01 90.483  0.8981 
1 1 1 -1  100 1  o 10 7.85967e+00 5.63034e-01 1.80669e+02 319.700 1.86360e+01  -1.58044e+01 0.00000e+00 0.00000e+00 1.04602e+02 319.700 7.60668e+01 139.700 0.9793 
1 1 1 -1  100 2  o 7  2.10821e+00 6.45727e-01 4.09820e+01 61.216  7.55148e-01  1.37451e+00  0.00000e+00 0.00000e+00 6.87420e+00 61.216  3.41078e+01 241.216 0.6126 
1 1 1 -1  100 3  o 17 5.94074e+00 6.52699e-01 1.26769e+02 252.144 -4.25949e+00 -1.32226e+01 0.00000e+00 0.00000e+00 8.52592e+01 252.144 4.15096e+01 72.144  0.9633 
1 1 1 -1  100 4  o 3  5.48726e+00 7.13278e-01 9.46667e+01 128.997 -6.32634e+00 7.81331e+00  0.00000e+00 0.00000e+00 9.81942e+01 128.997 3.52752e+00 128.997 0.9489 
1 1 1 -1  100 5  o 16 4.71671e+00 7.75008e-01 9.80259e+01 208.364 -6.77275e+00 -3.65657e+00 0.00000e+00 0.00000e+00 6.48523e+01 208.364 3.31736e+01 28.364  0.9326 
1 1 1 -1  100 6  o 15 2.74361e+00 7.84543e-01 7.84914e+01 212.958 -3.11577e+00 -2.02015e+00 0.00000e+00 0.00000e+00 7.98427e+00 212.958 7.05071e+01 32.958  0.8515 
1 1 1 -1  100 7  o 18 2.70285e+00 8.32221e-01 1.16271e+01 218.554 -4.67239e-01 -3.72372e-01 0.00000e+00 0.00000e+00 1.69888e+01 218.554 5.36176e+00 218.554 0.2862 
1 1 1 -1  100 8  o 1  9.39845e+00 6.69581e-01 1.71365e+02 305.253 2.04277e+01  -2.89008e+01 0.00000e+00 0.00000e+00 1.71246e+02 305.253 1.18527e-01 125.253 0.9858 
1 1 1 -1  100 9  o 8  2.69169e+00 8.44724e-01 6.49484e+01 130.118 -2.50895e+00 2.97755e+00  0.00000e+00 0.00000e+00 2.05387e+01 130.118 4.44097e+01 310.118 0.8593 
1 1 1 -1  100 10 o 7  1.27019e+01 8.12224e-01 2.14637e+02 177.432 -7.02179e+01 3.14866e+00  0.00000e+00 0.00000e+00 2.51177e+02 177.432 3.65401e+01 177.432 0.9929 
1 1 1 -1  100 11 o 17 6.03728e+00 1.17504e+00 1.25810e+02 19.954  1.44945e+01  5.26251e+00  0.00000e+00 0.00000e+00 8.96836e+01 19.954  3.61264e+01 199.954 0.9670 
1 1 1 -1  100 12 f 0  3.07695e+00 9.19882e-01 4.09338e+01 19.227  3.36355e+00  1.17309e+00  0.00000e+00 0.00000e+00 5.48851e+01 19.227  1.39513e+01 19.227  0.8443 
1 1 1 -1  101 1  o 4  2.97649e+00 7.64616e-01 8.17550e+01 235.550 -2.41091e+00 -3.51451e+00 0.00000e+00 0.00000e+00 1.45111e+01 235.550 6.72439e+01 55.550  0.8729 
1 1 1 -1  101 2  o 16 9.74380e+00 5.09204e-01 1.60238e+02 323.440 2.30019e+01  -1.70575e+01 0.00000e+00 0.00000e+00 1.94380e+02 323.440 3.41413e+01 323.440 0.9824 
1 1 1 -1  101 3  o 10 3.42826e+00 7.09811e-01 8.37371e+01 147.642 -4.70300e+00 2.97977e+00  0.00000e+00 0.00000e+00 3.11903e+01 147.642 5.25468e+01 327.642 0.9051 
1 1 1 -1  101 4  o 12 9.16690e+00 5.35472e-01 1.79837e+02 113.306 -1.30853e+01 3.03746e+01  0.00000e+00 0.00000e+00 1.54445e+02 113.306 2.53915e+01 293.306 0.9848 
1 1 1 -1  101 5  o 1  6.11924e+00 7.04613e-01 1.19003e+02 346.329 1.39961e+01  -3.40433e+00 0.00000e+00 0.00000e+00 9.95126e+01 346.329 1.94905e+01 166.329 0.9646 
1 1 1 -1  101 6  o 13 3.53433e+00 7.96697e-01 5.55968e+01 269.014 -6.36823e-02 -3.69978e+00 0.00000e+00 0.00000e+00 5.56924e+01 269.014 9.55989e-02 269.014 0.8509 
1 1 1 -1  101 7  o 1  3.41254e+00 9.04928e-01 5.85911e+01 226.255 -2.60760e+00 -2.72437e+00 0.00000e+00 0.00000e+00 4.92188e+01 226.255 9.37233e+00 46.255  0.8541 
1 1 1 -1  101 8  o 19 5.78926e+00 9.23284e-01 1.28785e+02 2.185   1.49456e+01  5.70277e-01  0.00000e+00 0.00000e+00 7.79605e+01 2.185   5.08248e+01 182.185 0.9660 
1 1 1 -1  101 9  o 3  6.08726e+00 8.73901e-01 9.34113e+01 278.900 2.04566e+00  -1.30631e+01 0.00000e+00 0.00000e+00 1.22829e+02 278.900 2.94181e+01 278.900 0.9614 
1 1 1 -1  101 10 o 16 4.20027e+00 1.06599e+00 3.44269e+01 295.116 1.30583e+00  -2.78561e+00 0.00000e+00 0.00000e+00 9.20557e+01 295.116 5.76288e+01 295.116 0.8155 
1 1 1 -1  101 11 o 10 9.91524e+00 9.44363e-01 1.26727e+02 107.299 -1.02386e+01 3.28747e+01  0.00000e+00 0.00000e+00 2.33805e+02 107.299 1.07078e+02 107.299 0.9854 
1 1 1 -1  101 12 f 0  2.98987e+00 9.69633e-01 6.97480e+01 251.612 -1.95022e+00 -5.86674e+00 0.00000e+00 0.00000e+00 3.11404e+01 251.612 3.86076e+01 71.612  0.9151 
1 1 1 -1  102 1  o 9  1.18747e+01 4.94163e-01 1.53135e+02 268.453 -9.94936e-01 -3.68419e+01 0.00000e+00 0.00000e+00 2.80712e+02 268.453 1.27576e+02 268.453 0.9863 
1 1 1 -1  102 2  o 19 6.14152e+00 6.36856e-01 7.45754e+01 318.684 6.90811e+00  -6.07230e+00 0.00000e+00 0.00000e+00 1.40139e+02 318.684 6.55640e+01 318.684 0.9440 
1 1 1 -1  102 3  o 9  9.74109e+00 5.31139e-01 1.63451e+02 138.048 -2.38061e+01 2.13988e+01  0.00000e+00 0.00000e+00 1.91576e+02 138.048 2.81249e+01 138.048 0.9843 
1 1 1 -1  102 4  o 6  5.78771e+00 6.90027e-01 1.47884e+02 33.422  1.34211e+01  8.85701e+00  0.00000e+00 0.00000e+00 5.96040e+01 33.422  8.82800e+01 213.422 0.9684 
1 1 1 -1  102 5  f 0  4.93174e+00 7.61900e-01 7.14829e+01 341.456 6.19115e+00  -2.07675e+00 0.00000e+00 0.00000e+00 9.64098e+01 341.456 2.49269e+01 341.456 0.9199 
1 1 1 -1  102 6  o 8  6.38359e+00 7.49233e-01 5.78198e+01 61.522  3.50804e+00  6.46692e+00  0.00000e+00 0.00000e+00 1.61645e+02 61.522  1.03825e+02 61.522  0.9293 
1 1 1 -1  102 7  o 4  6.25712e+00 8.86537e-01 1.35740e+02 278.720 2.50830e+00  -1.63528e+01 0.00000e+00 0.00000e+00 8.85316e+01 278.720 4.72088e+01 98.720  0.9693 
1 1 1 -1  102 8  o 4  6.08985e+00 8.95658e-01 9.93002e+01 223.769 -8.77672e+00 -8.40756e+00 0.00000e+00 0.00000e+00 1.16311e+02 223.769 1.70112e+01 223.769 0.9579 
1 1 1 -1  102 9  o 17 4.30791e+00 1.01695e+00 1.02177e+02 120.535 -4.95375e+00 8.39789e+00  0.00000e+00 0.00000e+00 4.85579e+01 120.535 5.36188e+01 300.535 0.9472 
1 1 1 -1  102 10 o 15 3.11828e+00 9.57994e-01 9.11380e+01 96.343  -7.40986e-01 6.66600e+00  0.00000e+00 0.00000e+00 1.50104e+01 96.343  7.61275e+01 276.343 0.9221 
1 1 1 -1  102 11 o 10 6.24632e+00 1.17718e+00 1.32026e+02 23.417  1.59550e+01  6.91013e+00  0.00000e+00 0.00000e+00 9.16791e+01 23.417  4.03472e+01 203.417 0.9708 
1 1 1 -1  102 12 o 15 3.11325e+00 9.99563e-01 7.98001e+01 254.326 -1.87074e+00 -6.66684e+00 0.00000e+00 0.00000e+00 2.63212e+01 254.326 5.34789e+01 74.326  0.9247 
1 1 1 -1  103 1  o 5  9.60922e+00 5.17292e-01 1.42884e+02 21.989  2.57633e+01  1.04035e+01  0.00000e+00 0.00000e+00 2.06492e+02 21.989  6.36074e+01 21.989  0.9818 
1 1 1 -1  103 2  o 7  5.29524e+00 7.22483e-01 1.00497e+02 141.018 -7.06672e+00 5.71887e+00  0.00000e+00 0.00000e+00 8.44448e+01 141.018 1.60526e+01 321.018 0.9433 
1 1 1 -1  103 3  o 17 5.27070e+00 7.17069e-01 8.37841e+01 232.084 -5.10637e+00 -6.55559e+00 0.00000e+00 0.00000e+00 9.91850e+01 232.084 1.54009e+01 232.084 0.9377 
1 1 1 -1  103 4  o 10 3.79837e+00 8.00298e-01 5.15232e+01 71.184  1.08024e+00  3.17027e+00  0.00000e+00 0.00000e+00 6.55521e+01 71.184  1.40289e+01 71.184  0.8328 
1 1 1 -1  103 5  o 10 8.69535e+00 5.90670e-01 1.73340e+02 311.818 2.09720e+01  -2.34413e+01 0.00000e+00 0.00000e+00 1.43214e+02 311.818 3.01265e+01 131.818 0.9840 
1 1 1 -1  103 6  o 7  7.26614e+00 6.84101e-01 1.44311e+02 228.395 -1.49625e+01 -1.68498e+01 0.00000e+00 0.00000e+00 1.18388e+02 228.395 2.59230e+01 48.395  0.9776 
1 1 1 -1  103 7  o 3  4.40747e+00 9.29386e-01 5.62551e+01 42.706  3.67334e+00  3.39042e+00  0.00000e+00 0.00000e+00 8.93036e+01 42.706  3.30485e+01 42.706  0.8934 
1 1 1 -1  103 8  o 6  8.26192e+00 7.29475e-01 1.35969e+02 255.166 -6.92315e+00 -2.61398e+01 0.00000e+00 0.00000e+00 1.63605e+02 255.166 2.76367e+01 255.166 0.9813 
1 1 1 -1  103 9  o 13 3.00947e+00 8.84766e-01 2.78279e+01 293.520 8.13691e-01  -1.86962e+00 0.00000e+00 0.00000e+00 5.04204e+01 293.520 2.25926e+01 293.520 0.7041 
1 1 1 -1  103 10 o 3  3.60584e+00 1.00690e+00 5.12112e+01 199.508 -4.26930e+00 -1.51248e+00 0.00000e+00 0.00000e+00 6.60539e+01 199.508 1.48427e+01 199.508 0.8812 
1 1 1 -1  103 11 o 7  2.72987e+00 8.84706e-01 8.10014e+01 10.135  6.30237e+00  1.12661e+00  0.00000e+00 0.00000e+00 1.14413e+01 10.135  6.95601e+01 190.135 0.9182 
1 1 1 -1  104 1  o 19 1.12440e+01 4.92483e-01 1.69483e+02 11.773  3.88184e+01  8.09062e+00  0.00000e+00 0.00000e+00 2.41494e+02 11.773  7.20116e+01 11.773  0.9873 
1 1 1 -1  104 2  o 7  3.72954e+00 7.98757e-01 7.76631e+01 110.147 -1.77273e+00 4.83182e+00  0.00000e+00 0.00000e+00 4.61245e+01 110.147 3.15387e+01 290.147 0.8967 
1 1 1 -1  104 3  o 6  8.03785e+00 5.80093e-01 1.48693e+02 102.877 -5.04558e+00 2.20704e+01  0.00000e+00 0.00000e+00 1.42131e+02 102.877 6.56185e+00 282.877 0.9777 
1 1 1 -1  104 4  o 15 8.15544e+00 6.02459e-01 1.46312e+02 351.080 2.40481e+01  -3.77447e+00 0.00000e+00 0.00000e+00 1.49168e+02 351.080 2.85649e+00 351.080 0.9792 
1 1 1 -1  104 5  o 8  2.49250e+00 7.16030e-01 2.29361e+01 23.336  1.12014e+00  4.83236e-01  0.00000e+00 0.00000e+00 2.49030e+01 23.336  1.96684e+00 23.336  0.5189 
1 1 1 -1  104 6  o 17 6.72917e+00 7.44211e-01 1.26834e+02 121.509 -9.47936e+00 1.54637e+01  0.00000e+00 0.00000e+00 1.15008e+02 121.509 1.18260e+01 301.508 0.9720 
1 1 1 -1  104 7  o 6  3.56684e+00 9.14944e-01 3.96524e+01 220.625 -2.13302e+00 -1.82986e+00 0.00000e+00 0.00000e+00 6.51355e+01 220.625 2.54831e+01 220.625 0.7949 
1 1 1 -1  104 8  o 15 5.50515e+00 9.07090e-01 5.22634e+01 241.702 -3.17266e+00 -5.89271e+00 0.00000e+00 0.00000e+00 1.35215e+02 241.702 8.29514e+01 241.702 0.9219 
1 1 1 -1  104 9  o 11 4.32880e+00 1.00598e+00 7.47700e+01 124.584 -3.97632e+00 5.76750e+00  0.00000e+00 0.00000e+00 7.31505e+01 124.584 1.61947e+00 304.584 0.9256 
1 1 1 -1  104 10 f 0  5.26370e+00 1.06965e+00 9.23161e+01 11.937  1.15616e+01  2.44418e+00  0.00000e+00 0.00000e+00 9.34819e+01 11.937  1.16585e+00 11.937  0.9567 
1 1 1 -1  104 11 o 11 2.59352e+00 8.44685e-01 3.80041e+01 311.594 2.15584e+00  -2.42865e+00 0.00000e+00 0.00000e+00 4.10513e+01 311.594 3.04727e+00 311.594 0.8267 
1 1 1 -1  105 1  o 9  2.82234e+00 7.15154e-01 4.20519e+01 316.587 1.69255e+00  -1.60131e+00 0.00000e+00 0.00000e+00 3.57845e+01 316.587 6.26743e+00 136.587 0.7452 
1 1 1 -1  105 2  f 0  1.26252e+01 5.06177e-01 2.72829e+02 110.752 -2.54582e+01 6.71881e+01  0.00000e+00 0.00000e+00 1.91105e+02 110.752 8.17240e+01 290.752 0.9930 
1 1 1 -1  105 3  o 19 1.05106e+01 5.27361e-01 1.53979e+02 251.267 -1.09572e+01 -3.23095e+01 0.00000e+00 0.00000e+00 2.29149e+02 251.267 7.51709e+01 251.267 0.9852 
1 1 1 -1  105 4  o 9  1.86575e+00 6.11318e-01 6.13106e+01 306.890 1.47047e+00  -1.95918e+00 0.00000e+00 0.00000e+00 8.90320e+00 126.890 7.02138e+01 126.890 0.7594 
1 1 1 -1  105 5  o 10 5.70371e+00 7.84529e-01 7.39605e+01 128.221 -5.42219e+00 6.88522e+00  0.00000e+00 0.00000e+00 1.24520e+02 128.221 5.05598e+01 128.221 0.9411 
1 1 1 -1  105 6  o 3  1.08720e+01 5.86581e-01 1.58605e+02 227.204 -2.92830e+01 -3.16275e+01 0.00000e+00 0.00000e+00 2.38565e+02 227.204 7.99602e+01 227.204 0.9883 
1 1 1 -1  105 7  o 19 3.67268e+00 9.34227e-01 1.01724e+02 209.053 -6.82295e+00 -3.79024e+00 0.00000e+00 0.00000e+00 2.49525e+01 209.053 7.67716e+01 29.053  0.9335 
1 1 1 -1  105 8  f 0  3.03774e+00 8.77960e-01 5.66371e+01 216.217 -3.14729e+00 -2.30487e+00 0.00000e+00 0.00000e+00 3.97922e+01 216.217 1.68449e+01 36.217  0.8596 
1 1 1 -1  105 9  o 6  3.44592e+00 9.21311e-01 9.23173e+01 314.263 5.39912e+00  -5.53992e+00 0.00000e+00 0.00000e+00 2.63333e+01 314.263 6.59841e+01 134.263 0.9329 
1 1 1 -1  105 10 o 10 2.53802e+00 8.40195e-01 3.12287e+01 77.114  5.53002e-01  2.41716e+00  0.00000e+00 0.00000e+00 4.01766e+01 77.114  8.94792e+00 77.114  0.7628 
1 1 1 -1  105 11 o 5  6.69219e+00 1.14527e+00 1.23663e+02 194.115 -1.83625e+01 -4.61764e+00 0.00000e+00 0.00000e+00 1.16404e+02 194.115 7.25923e+00 14.116  0.9732 
1 1 1 -1  106 1  o 8  4.67585e+00 8.00641e-01 1.12318e+02 63.226  4.37315e+00  8.66699e+00  0.00000e+00 0.00000e+00 5.15161e+01 63.226  6.08020e+01 243.226 0.9470 
1 1 1 -1  106 2  o 17 1.53314e+01 4.94207e-01 2.67806e+02 0.894   8.93507e+01  1.39374e+00  0.00000e+00 0.00000e+00 2.96186e+02 0.894   2.83792e+01 0.894   0.9944 
1 1 1 -1  106 3  o 18 1.19165e+01 5.20158e-01 1.58394e+02 274.194 3.08239e+00  -4.20361e+01 0.00000e+00 0.00000e+00 2.77104e+02 274.194 1.18710e+02 274.194 0.9881 
1 1 1 -1  106 4  o 11 1.14011e+01 5.37498e-01 1.66641e+02 93.470  -2.66036e+00 4.38699e+01  0.00000e+00 0.00000e+00 2.50124e+02 93.470  8.34824e+01 93.470  0.9886 
1 1 1 -1  106 5  o 10 7.17933e+00 7.17152e-01 1.41655e+02 309.240 1.37601e+01  -1.68472e+01 0.00000e+00 0.00000e+00 1.17563e+02 309.240 2.40923e+01 129.241 0.9767 
1 1 1 -1  106 6  o 12 2.96136e+00 8.34367e-01 6.38809e+01 16.304  3.80329e+00  1.11248e+00  0.00000e+00 0.00000e+00 3.04546e+01 16.304  3.34264e+01 196.304 0.8621 
1 1 1 -1  106 7  o 12 5.56592e+00 8.40935e-01 7.66480e+01 154.690 -9.45106e+00 4.46952e+00  0.00000e+00 0.00000e+00 1.18841e+02 154.690 4.21932e+01 154.690 0.9509 
1 1 1 -1  106 8  o 12 2.86072e+00 8.58739e-01 4.22219e+01 106.810 -8.57974e-01 2.83991e+00  0.00000e+00 0.00000e+00 4.30582e+01 106.810 8.36252e-01 106.810 0.8075 
1 1 1 -1  106 9  o 7  3.10525e+00 9.08885e-01 4.41272e+01 23.325  3.22600e+00  1.39099e+00  0.00000e+00 0.00000e+00 5.23198e+01 23.325  8.19259e+00 23.325  0.8418 
1 1 1 -1  106 10 o 15 4.47993e+00 1.05251e+00 5.20743e+01 304.126 3.23090e+00  -4.76729e+00 0.00000e+00 0.00000e+00 9.79944e+01 304.126 4.59202e+01 304.126 0.9084 
1 1 1 -1  106 11 o 6  2.29559e+00 7.85044e-01 1.67855e+01 351.341 1.41108e+00  -2.14896e-01 0.00000e+00 0.00000e+00 3.20783e+01 351.341 1.52928e+01 351.341 0.5777 
1 1 1 -1  107 1  o 8  1.45639e+01 5.05783e-01 2.28425e+02 130.229 -4.72937e+01 5.59068e+01  0.00000e+00 0.00000e+00 3.06578e+02 130.229 7.81526e+01 130.229 0.9931 
1 1 1 -1  107 2  o 5  1.22055e+01 5.34056e-01 2.05063e+02 326.109 4.87330e+01  -3.27367e+01 0.00000e+00 0.00000e+00 2.42480e+02 326.109 3.74169e+01 326.109 0.9914 
1 1 1 -1  107 3  o 1  4.47956e+00 7.89955e-01 1.12968e+02 202.842 -9.43691e+00 -3.97502e+00 0.00000e+00 0.00000e+00 4.43617e+01 202.842 6.86063e+01 22.842  0.9498 
1 1 1 -1  107 4  o 4  2.70999e+00 7.69953e-01 4.36019e+01 224.277 -1.77025e+00 -1.72613e+00 0.00000e+00 0.00000e+00 3.27326e+01 224.277 1.08693e+01 44.277  0.7620 
1 1 1 -1  107 5  o 12 4.51347e+00 8.56281e-01 1.84854e+01 73.969  4.83233e-01  1.68183e+00  0.00000e+00 0.00000e+00 9.02857e+01 73.969  7.18003e+01 73.969  0.6521 
1 1 1 -1  107 6  o 1  7.84064e+00 6.88784e-01 1.30648e+02 143.163 -2.02291e+01 1.51535e+01  0.00000e+00 0.00000e+00 1.53207e+02 143.163 2.25591e+01 143.163 0.9800 
1 1 1 -1  107 7  o 11 5.31242e+00 9.05872e-01 8.92298e+01 54.375  6.69544e+00  9.34358e+00  0.00000e+00 0.00000e+00 9.81958e+01 54.375  8.96606e+00 54.375  0.9555 
1 1 1 -1  107 8  o 9  4.37713e+00 9.51973e-01 8.43894e+01 187.072 -8.46214e+00 -1.04977e+00 0.00000e+00 0.00000e+00 6.73656e+01 187.072 1.70239e+01 7.072   0.9394 
1 1 1 -1  107 9  o 8  4.63309e+00 1.04330e+00 1.17614e+02 246.861 -5.33804e+00 -1.24914e+01 0.00000e+00 0.00000e+00 4.68680e+01 246.861 7.07456e+01 66.861  0.9625 
1 1 1 -1  107 10 o 19 2.38395e+00 8.06148e-01 1.44377e+01 162.003 -1.12255e+00 3.64677e-01  0.00000e+00 0.00000e+00 3.00857e+01 162.003 1.56480e+01 162.003 0.5066 
1 1 1 -1  108 1  o 15 4.79600e+00 8.24496e-01 1.06434e+02 0.356   1.01258e+01  6.29810e-02  0.00000e+00 0.00000e+00 6.19114e+01 0.356   4.45227e+01 180.356 0.9493 
1 1 1 -1  108 2  o 4  3.63303e+00 8.43824e-01 7.92683e+01 284.069 1.40275e+00  -5.59750e+00 0.00000e+00 0.00000e+00 4.27829e+01 284.069 3.64854e+01 104.069 0.9086 
1 1 1 -1  108 3  o 5  5.87005e+00 7.17651e-01 9.05003e+01 237.094 -6.22675e+00 -9.62280e+00 0.00000e+00 0.00000e+00 1.16796e+02 237.094 2.62954e+01 237.094 0.9553 
1 1 1 -1  108 4  o 10 6.57895e+00 7.11377e-01 6.75155e+01 133.374 -7.09102e+00 7.50543e+00  0.00000e+00 0.00000e+00 1.63525e+02 133.374 9.60100e+01 133.374 0.9503 
1 1 1 -1  108 5  o 6  3.04918e+00 8.21187e-01 5.03402e+01 237.717 -1.74946e+00 -2.76921e+00 0.00000e+00 0.00000e+00 4.29859e+01 237.717 7.35434e+00 57.717  0.8285 
1 1 1 -1  108 6  o 9  4.45447e+00 8.93515e-01 6.02314e+01 274.742 5.21744e-01  -6.28955e+00 0.00000e+00 0.00000e+00 9.06105e+01 274.742 3.03792e+01 274.742 0.9169 
1 1 1 -1  108 7  o 12 2.43585e+00 7.63830e-01 5.09496e+01 30.614  2.82356e+00  1.67080e+00  0.00000e+00 0.00000e+00 2.35726e+01 30.614  2.73771e+01 210.614 0.8288 
1 1 1 -1  108 8  o 9  3.19531e+00 8.94965e-01 3.17606e+01 109.925 -9.66119e-01 2.66519e+00  0.00000e+00 0.00000e+00 6.22009e+01 109.925 3.04403e+01 109.925 0.7970 
1 1 1 -1  108 9  o 13 2.96712e+00 9.10552e-01 3.32329e+01 157.380 -2.44910e+00 1.02046e+00  0.00000e+00 0.00000e+00 5.21843e+01 157.380 1.89514e+01 157.380 0.7807 
1 1 1 -1  108 10 o 1  3.08847e+00 9.28694e-01 1.81780e+01 262.584 -2.04633e-01 -1.57211e+00 0.00000e+00 0.00000e+00 5.19951e+01 262.584 3.38172e+01 262.584 0.6165 
1 1 1 -1  109 1  o 7  9.60133e+00 5.85099e-01 1.70906e+02 63.008  1.72713e+01  3.39091e+01  0.00000e+00 0.00000e+00 1.79327e+02 63.008  8.42146e+00 63.008  0.9868 
1 1 1 -1  109 2  o 10 4.47566e+00 7.80331e-01 7.17685e+01 67.581  2.52614e+00  6.12312e+00  0.00000e+00 0.00000e+00 8.06026e+01 67.581  8.83406e+00 67.581  0.9211 
1 1 1 -1  109 3  o 12 6.73527e+00 7.09906e-01 1.34830e+02 278.817 3.23881e+00  -2.08791e+01 0.00000e+00 0.00000e+00 1.08106e+02 278.817 2.67239e+01 98.818  0.9760 
1 1 1 -1  109 4  o 7  7.79151e+00 6.46543e-01 1.29286e+02 120.800 -1.20996e+01 2.02969e+01  0.00000e+00 0.00000e+00 1.52414e+02 120.800 2.31281e+01 120.800 0.9786 
1 1 1 -1  109 5  o 12 3.44087e+00 8.75562e-01 6.23722e+01 340.050 4.39159e+00  -1.59406e+00 0.00000e+00 0.00000e+00 5.01187e+01 340.050 1.22535e+01 160.050 0.8852 
1 1 1 -1  109 6  o 1  5.18978e+00 8.72645e-01 5.16794e+01 169.545 -6.56585e+00 1.21162e+00  0.00000e+00 0.00000e+00 1.24929e+02 169.545 7.32495e+01 169.545 0.9217 
1 1 1 -1  109 7  o 10 2.80697e+00 8.49300e-01 2.86118e+01 200.515 -1.83894e+00 -6.88086e-01 0.00000e+00 0.00000e+00 4.30373e+01 200.515 1.44255e+01 200.515 0.6917 
1 1 1 -1  109 8  o 8  2.33141e+00 7.61264e-01 2.94612e+01 128.144 -1.26044e+00 1.60496e+00  0.00000e+00 0.00000e+00 3.11090e+01 128.144 1.64778e+00 128.144 0.7044 
1 1 1 -1  109 9  o 9  2.96800e+00 9.05227e-01 6.63569e+01 154.118 -5.03019e+00 2.44059e+00  0.00000e+00 0.00000e+00 3.27167e+01 154.118 3.36401e+01 334.118 0.9055 
1 1 1 -1  109 10 o 6  3.13640e+00 9.41225e-01 7.38627e+01 48.343  4.81864e+00  5.41658e+00  0.00000e+00 0.00000e+00 3.33928e+01 48.343  4.04698e+01 228.343 0.9282 
1 1 1 -1  110 1  o 11 8.81843e+00 5.89005e-01 1.76679e+02 338.231 3.61280e+01  -1.44278e+01 0.00000e+00 0.00000e+00 1.44993e+02 338.231 3.16863e+01 158.231 0.9871 
1 1 1 -1  110 2  o 6  3.93120e+00 7.72666e-01 9.74476e+01 143.471 -6.81593e+00 5.04893e+00  0.00000e+00 0.00000e+00 3.89600e+01 143.471 5.84876e+01 323.471 0.9391 
1 1 1 -1  110 3  o 3  4.66632e+00 8.15033e-01 1.16424e+02 175.811 -1.14838e+01 8.41059e-01  0.00000e+00 0.00000e+00 4.83007e+01 175.811 6.81237e+01 355.811 0.9555 
1 1 1 -1  110 4  o 1  7.21276e+00 6.77737e-01 1.18605e+02 322.555 1.68990e+01  -1.29414e+01 0.00000e+00 0.00000e+00 1.41456e+02 322.555 2.28514e+01 322.555 0.9762 
1 1 1 -1  110 5  o 3  5.63745e+00 8.02912e-01 1.24994e+02 138.095 -1.37620e+01 1.23499e+01  0.00000e+00 0.00000e+00 7.74450e+01 138.095 4.75491e+01 318.095 0.9726 
1 1 1 -1  110 6  f 0  3.22337e+00 9.12997e-01 4.74274e+01 327.851 3.04733e+00  -1.91526e+00 0.00000e+00 0.00000e+00 5.32355e+01 327.851 5.80810e+00 327.851 0.8461 
1 1 1 -1  110 7  o 18 4.07318e+00 7.93135e-01 6.22710e+01 305.708 4.54015e+00  -6.31632e+00 0.00000e+00 0.00000e+00 7.79775e+01 305.708 1.57064e+01 305.708 0.9333 
1 1 1 -1  110 8  o 13 3.08401e+00 8.97427e-01 2.68387e+01 221.476 -1.72924e+00 -1.52861e+00 0.00000e+00 0.00000e+00 5.75863e+01 221.476 3.07477e+01 221.476 0.7424 
1 1 1 -1  110 9  o 12 2.41490e+00 7.93914e-01 4.17884e+01 68.420  1.22543e+00  3.09816e+00  0.00000e+00 0.00000e+00 3.22398e+01 68.420  9.54854e+00 248.419 0.8318 
1 1 1 -1  110 10 o 17 2.48782e+00 8.33632e-01 6.13387e+01 90.523  -5.05740e-02 5.54399e+00  0.00000e+00 0.00000e+00 2.15512e+01 90.523  3.97875e+01 270.523 0.9046 
1 1 1 -1  111 1  f 0  5.42976e+00 7.77882e-01 9.86413e+01 27.131  1.03494e+01  5.30315e+00  0.00000e+00 0.00000e+00 9.31280e+01 27.131  5.51333e+00 207.131 0.9560 
1 1 1 -1  111 2  o 15 4.72868e+00 8.06994e-01 1.19357e+02 212.131 -1.02912e+01 -6.46343e+00 0.00000e+00 0.00000e+00 4.79688e+01 212.131 7.13879e+01 32.131  0.9579 
1 1 1 -1  111 3  o 15 4.40250e+00 8.31471e-01 1.02793e+02 37.731  8.04661e+00  6.22614e+00  0.00000e+00 0.00000e+00 5.15911e+01 37.731  5.12019e+01 217.731 0.9495 
1 1 1 -1  111 4  o 1  5.53335e+00 7.87599e-01 6.98924e+01 33.126  8.25025e+00  5.38357e+00  0.00000e+00 0.00000e+00 1.23750e+02 33.126  5.38574e+01 33.126  0.9478 
1 1 1 -1  111 5  o 6  5.06013e+00 8.70539e-01 9.34300e+01 177.718 -1.16421e+01 4.63971e-01  0.00000e+00 0.00000e+00 8.51409e+01 177.718 8.28909e+00 357.718 0.9561 
1 1 1 -1  111 6  o 3  4.04644e+00 9.95235e-01 8.17524e+01 11.543  7.22371e+00  1.47527e+00  0.00000e+00 0.00000e+00 5.70208e+01 11.543  2.47316e+01 191.543 0.9295 
1 1 1 -1  111 7  f 0  2.36973e+00 7.66545e-01 5.23114e+01 221.547 -2.67579e+00 -2.37126e+00 0.00000e+00 0.00000e+00 2.15351e+01 221.547 3.07764e+01 41.547  0.8449 
1 1 1 -1  111 8  o 12 2.35149e+00 7.70566e-01 3.46163e+01 177.710 -2.74367e+00 1.09700e-01  0.00000e+00 0.00000e+00 3.38013e+01 177.710 8.15045e-01 357.710 0.7893 
1 1 1 -1  111 9  o 19 2.97266e+00 9.06613e-01 5.00717e+01 299.653 2.12142e+00  -3.72639e+00 0.00000e+00 0.00000e+00 4.56205e+01 299.653 4.45115e+00 119.653 0.8737 
1 1 1 -1  112 1  o 11 1.30561e+01 5.45362e-01 2.05105e+02 233.930 -4.23019e+01 -5.80741e+01 0.00000e+00 0.00000e+00 2.73728e+02 233.930 6.86229e+01 233.930 0.9930 
1 1 1 -1  112 2  o 9  6.09401e+00 7.46318e-01 1.10350e+02 84.883  1.42523e+00  1.59170e+01  0.00000e+00 0.00000e+00 1.07531e+02 84.883  2.81812e+00 264.883 0.9682 
1 1 1 -1  112 3  o 5  1.94521e+00 6.28749e-01 4.97474e+01 119.032 -1.33756e+00 2.40986e+00  0.00000e+00 0.00000e+00 7.00469e+00 119.032 4.27427e+01 299.032 0.7902 
1 1 1 -1  112 4  o 12 8.60669e+00 6.39865e-01 1.69492e+02 266.964 -2.06287e+00 -3.88914e+01 0.00000e+00 0.00000e+00 1.44088e+02 266.964 2.54040e+01 86.964  0.9871 
1 1 1 -1  112 5  o 1  9.36859e+00 6.51667e-01 1.24880e+02 79.380  6.36764e+00  3.39608e+01  0.00000e+00 0.00000e+00 2.15780e+02 79.380  9.09000e+01 79.380  0.9854 
1 1 1 -1  112 6  f 0  7.29721e+00 9.23554e-01 1.15243e+02 296.137 1.00779e+01  -2.05381e+01 0.00000e+00 0.00000e+00 1.47971e+02 296.137 3.27280e+01 296.137 0.9779 
1 1 1 -1  112 7  o 13 2.82760e+00 8.32869e-01 2.96549e+01 247.380 -9.54608e-01 -2.29110e+00 0.00000e+00 0.00000e+00 4.98931e+01 247.380 2.02382e+01 247.380 0.7630 
1 1 1 -1  112 8  o 14 4.59549e+00 1.00932e+00 8.02287e+01 113.299 -4.05810e+00 9.42335e+00  0.00000e+00 0.00000e+00 8.06445e+01 113.299 4.15831e-01 113.299 0.9499 
1 1 1 -1  112 9  o 18 2.40716e+00 7.76351e-01 2.57923e+01 328.416 2.01655e+00  -1.23981e+00 0.00000e+00 0.00000e+00 4.06784e+01 328.416 1.48861e+01 328.416 0.7497 
1 1 1 -1  113 1  o 5  2.71140e+00 7.95514e-01 2.17214e+01 340.340 1.40499e+00  -5.01956e-01 0.00000e+00 0.00000e+00 3.77574e+01 340.340 1.60359e+01 340.340 0.5941 
1 1 1 -1  113 2  o 7  3.39531e+00 8.06528e-01 6.14296e+01 315.156 3.86807e+00  -3.84712e+00 0.00000e+00 0.00000e+00 5.17524e+01 315.156 9.67717e+00 135.156 0.9030 
1 1 1 -1  113 3  o 17 4.16526e+00 8.21572e-01 6.71592e+01 201.103 -6.15997e+00 -2.37734e+00 0.00000e+00 0.00000e+00 7.44042e+01 201.103 7.24499e+00 201.103 0.9208 
1 1 1 -1  113 4  o 13 4.39619e+00 8.79548e-01 9.36217e+01 351.937 1.01272e+01  -1.43460e+00 0.00000e+00 0.00000e+00 6.04520e+01 351.937 3.31697e+01 171.937 0.9498 
1 1 1 -1  113 5  o 9  6.92271e+00 7.51398e-01 1.06196e+02 99.394  -3.34509e+00 2.02194e+01  0.00000e+00 0.00000e+00 1.42862e+02 99.394  3.66666e+01 99.394  0.9753 
1 1 1 -1  113 6  o 19 5.52643e+00 9.62448e-01 8.26318e+01 246.932 -4.46652e+00 -1.04878e+01 0.00000e+00 0.00000e+00 1.11999e+02 246.932 2.93668e+01 246.932 0.9551 
1 1 1 -1  113 7  o 6  2.93870e+00 8.60445e-01 7.18393e+01 153.655 -5.85133e+00 2.89763e+00  0.00000e+00 0.00000e+00 2.77978e+01 153.655 4.40415e+01 333.655 0.9199 
1 1 1 -1  113 8  o 7  2.24875e+00 7.41158e-01 3.04935e+01 213.435 -2.15487e+00 -1.42276e+00 0.00000e+00 0.00000e+00 3.35989e+01 213.435 3.10536e+00 213.435 0.7736 
1 1 1 -1  113 9  o 18 5.56287e+00 1.07334e+00 6.19803e+01 215.180 -7.63896e+00 -5.38466e+00 0.00000e+00 0.00000e+00 1.31553e+02 215.180 6.95726e+01 215.180 0.9449 
1 1 1 -1  114 1  o 5  2.96704e+00 8.05328e-01 5.00036e+01 101.783 -7.23823e-01 3.46974e+00  0.00000e+00 0.00000e+00 4.23593e+01 101.783 7.64435e+00 281.783 0.8434 
1 1 1 -1  114 2  o 17 3.70967e+00 8.54589e-01 9.17464e+01 160.383 -7.99697e+00 2.85030e+00  0.00000e+00 0.00000e+00 3.68239e+01 160.383 5.49225e+01 340.383 0.9391 
1 1 1 -1  114 3  o 7  2.70656e+00 7.97781e-01 5.07811e+01 41.453  2.73106e+00  2.41221e+00  0.00000e+00 0.00000e+00 3.39335e+01 41.453  1.68476e+01 221.453 0.8483 
1 1 1 -1  114 4  f 0  5.60338e+00 8.08100e-01 3.77427e+01 229.294 -3.56457e+00 -4.14329e+00 0.00000e+00 0.00000e+00 1.48943e+02 229.294 1.11200e+02 229.294 0.9032 
1 1 1 -1  114 5  o 12 2.55083e+00 7.89974e-01 3.27468e+01 235.769 -1.33173e+00 -1.95728e+00 0.00000e+00 0.00000e+00 3.77815e+01 235.769 5.03470e+00 235.769 0.7498 
1 1 1 -1  114 6  o 17 3.62229e+00 8.99532e-01 5.96656e+01 158.945 -5.95961e+00 2.29423e+00  0.00000e+00 0.00000e+00 6.29097e+01 158.945 3.24410e+00 158.945 0.9180 
1 1 1 -1  114 7  o 6  6.26686e+00 8.85056e-01 9.74954e+01 304.570 1.01353e+01  -1.47083e+01 0.00000e+00 0.00000e+00 1.26860e+02 304.570 2.93643e+01 304.570 0.9716 
1 1 1 -1  114 8  o 10 5.08684e+00 9.42741e-01 4.80756e+01 81.361  1.14798e+00  7.55614e+00  0.00000e+00 0.00000e+00 1.26541e+02 81.361  7.84654e+01 81.361  0.9321 
1 1 1 -1  114 9  o 1  4.22320e+00 1.09194e+00 6.33518e+01 346.959 7.38450e+00  -1.71039e+00 0.00000e+00 0.00000e+00 8.14461e+01 346.959 1.80943e+01 346.959 0.9315 
1 1 1 -1  115 1  o 19 5.56440e+00 7.79713e-01 8.56866e+01 314.274 8.67831e+00  -8.90108e+00 0.00000e+00 0.00000e+00 1.11192e+02 314.274 2.55050e+01 314.274 0.9589 
1 1 1 -1  115 2  o 6  5.52536e+00 8.08215e-01 7.90769e+01 223.172 -8.04960e+00 -7.55171e+00 0.00000e+00 0.00000e+00 1.15308e+02 223.172 3.62307e+01 223.172 0.9536 
1 1 1 -1  115 3  o 6  2.21579e+00 7.08194e-01 5.34128e+01 219.246 -2.55223e+00 -2.08498e+00 0.00000e+00 0.00000e+00 1.43982e+01 219.246 3.90146e+01 39.246  0.8297 
1 1 1 -1  115 4  o 6  5.31321e+00 8.32722e-01 9.87933e+01 284.498 3.77094e+00  -1.45834e+01 0.00000e+00 0.00000e+00 9.05225e+01 284.498 8.27081e+00 104.498 0.9662 
1 1 1 -1  115 5  o 2  4.06423e+00 8.98982e-01 8.61608e+01 128.131 -6.18539e+00 7.87970e+00  0.00000e+00 0.00000e+00 5.59815e+01 128.131 3.01793e+01 308.131 0.9487 
1 1 1 -1  115 6  o 14 4.46401e+00 9.41606e-01 8.66715e+01 84.266  1.10263e+00  1.09808e+01  0.00000e+00 0.00000e+00 7.01944e+01 84.266  1.64772e+01 264.266 0.9536 
1 1 1 -1  115 7  o 15 3.78003e+00 8.93768e-01 6.87203e+01 95.037  -7.32303e-01 8.30870e+00  0.00000e+00 0.00000e+00 6.18841e+01 95.037  6.83619e+00 275.037 0.9380 
1 1 1 -1  115 8  o 3  2.74270e+00 8.60912e-01 4.02208e+01 311.878 2.59557e+00  -2.89505e+00 0.00000e+00 0.00000e+00 4.65280e+01 311.878 6.30716e+00 311.878 0.8591 
1 1 1 -1  116 1  o 7  2.43739e+00 7.55301e-01 4.65070e+01 353.846 3.03212e+00  -3.26900e-01 0.00000e+00 0.00000e+00 2.66410e+01 353.846 1.98660e+01 173.847 0.8136 
1 1 1 -1  116 2  o 3  6.76926e+00 7.06986e-01 1.21897e+02 118.129 -1.12071e+01 2.09638e+01  0.00000e+00 0.00000e+00 1.22457e+02 118.129 5.59474e-01 118.129 0.9787 
1 1 1 -1  116 3  o 17 8.58291e+00 6.55786e-01 1.43930e+02 310.213 2.65840e+01  -3.14436e+01 0.00000e+00 0.00000e+00 1.68695e+02 310.213 2.47652e+01 310.213 0.9878 
1 1 1 -1  116 4  o 5  2.37733e+00 7.40864e-01 5.15182e+01 87.785  1.57043e-01  4.05952e+00  0.00000e+00 0.00000e+00 2.43690e+01 87.785  2.71492e+01 267.785 0.8659 
1 1 1 -1  116 5  o 7  8.67822e+00 6.88554e-01 1.42814e+02 122.678 -2.18301e+01 3.40323e+01  0.00000e+00 0.00000e+00 1.73031e+02 122.678 3.02177e+01 122.678 0.9876 
1 1 1 -1  116 6  o 6  6.17721e+00 8.95617e-01 1.16723e+02 315.025 1.59572e+01  -1.59430e+01 0.00000e+00 0.00000e+00 1.05741e+02 315.025 1.09821e+01 135.025 0.9776 
1 1 1 -1  116 7  o 1  2.29594e+00 7.42641e-01 4.06203e+01 339.430 3.38664e+00  -1.27093e+00 0.00000e+00 0.00000e+00 3.09896e+01 339.430 9.63068e+00 159.430 0.8470 
1 1 1 -1  116 8  o 12 5.70939e+00 1.04860e+00 1.04865e+02 154.498 -1.55953e+01 7.43933e+00  0.00000e+00 0.00000e+00 9.90967e+01 154.498 5.76875e+00 334.498 0.9706 
1 1 1 -1  117 1  o 14 6.30350e+00 7.53606e-01 7.42988e+01 130.233 -9.29774e+00 1.09896e+01  0.00000e+00 0.00000e+00 1.49918e+02 130.233 7.56189e+01 130.233 0.9646 
1 1 1 -1  117 2  o 1  8.49703e+00 6.30044e-01 1.61632e+02 278.897 6.82282e+00  -4.35848e+01 0.00000e+00 0.00000e+00 1.48083e+02 278.897 1.35491e+01 98.897  0.9886 
1 1 1 -1  117 3  o 7  7.90928e+00 6.64315e-01 9.63464e+01 140.408 -2.08422e+01 1.72374e+01  0.00000e+00 0.00000e+00 1.89771e+02 140.408 9.34249e+01 140.408 0.9813 
1 1 1 -1  117 4  o 5  5.66473e+00 8.66994e-01 1.05615e+02 245.259 -7.62742e+00 -1.65517e+01 0.00000e+00 0.00000e+00 9.73398e+01 245.259 8.27527e+00 65.259  0.9722 
1 1 1 -1  117 5  o 6  2.67295e+00 7.73080e-01 6.35025e+01 68.223  2.04832e+00  5.12713e+00  0.00000e+00 0.00000e+00 2.55415e+01 68.223  3.79609e+01 248.223 0.9042 
1 1 1 -1  117 6  o 17 3.42373e+00 8.91316e-01 7.44281e+01 68.417  2.74315e+00  6.93431e+00  0.00000e+00 0.00000e+00 4.28741e+01 68.417  3.15541e+01 248.417 0.9303 
1 1 1 -1  117 7  o 12 2.50371e+00 7.99931e-01 2.55984e+01 290.541 8.48507e-01  -2.26448e+00 0.00000e+00 0.00000e+00 4.40614e+01 290.541 1.84630e+01 290.541 0.7558 
1 1 1 -1  117 8  o 12 4.11501e+00 1.02109e+00 8.90590e+01 173.824 -1.13417e+01 1.22728e+00  0.00000e+00 0.00000e+00 5.55511e+01 173.824 3.35079e+01 353.824 0.9551 
1 1 1 -1  118 1  o 11 2.46190e+00 7.64743e-01 2.23635e+01 336.899 1.64348e+00  -7.01031e-01 0.00000e+00 0.00000e+00 3.74842e+01 336.899 1.51207e+01 336.899 0.6595 
1 1 1 -1  118 2  o 5  3.46972e+00 8.59808e-01 7.39948e+01 66.355  2.97530e+00  6.79568e+00  0.00000e+00 0.00000e+00 4.49315e+01 66.355  2.90633e+01 246.355 0.9299 
1 1 1 -1  118 3  o 11 6.17368e+00 8.27663e-01 1.48619e+02 164.065 -2.55612e+01 7.29811e+00  0.00000e+00 0.00000e+00 7.45667e+01 164.065 7.40522e+01 344.065 0.9810 
1 1 1 -1  118 4  o 2  4.75203e+00 8.37305e-01 8.66458e+01 272.670 5.80409e-01  -1.24446e+01 0.00000e+00 0.00000e+00 8.12465e+01 272.670 5.39927e+00 92.670  0.9590 
1 1 1 -1  118 5  o 3  2.54251e+00 7.61354e-01 1.49912e+01 80.881  2.23084e-01  1.38981e+00  0.00000e+00 0.00000e+00 3.86131e+01 80.881  2.36220e+01 80.881  0.5724 
1 1 1 -1  118 6  o 15 2.83184e+00 8.21638e-01 3.25150e+01 249.393 -1.17661e+00 -3.12920e+00 0.00000e+00 0.00000e+00 5.42761e+01 249.393 2.17611e+01 249.393 0.8325 
1 1 1 -1  118 7  o 8  6.30060e+00 8.92908e-01 5.49270e+01 207.813 -1.05237e+01 -5.55153e+00 0.00000e+00 0.00000e+00 1.66968e+02 207.813 1.12041e+02 207.813 0.9570 
1 1 1 -1  119 1  o 4  4.09061e+00 8.90282e-01 6.42101e+01 315.682 5.14981e+00  -5.02865e+00 0.00000e+00 0.00000e+00 7.56312e+01 315.682 1.14211e+01 315.682 0.9277 
1 1 1 -1  119 2  o 18 3.33308e+00 8.64307e-01 1.21316e+02 204.041 -1.13806e+01 -5.07676e+00 0.00000e+00 0.00000e+00 3.54038e+00 24.041  1.24856e+02 24.041  0.9590 
1 1 1 -1  119 3  o 9  2.39549e+00 7.45524e-01 4.90868e+01 44.468  2.76142e+00  2.71064e+00  0.00000e+00 0.00000e+00 2.66571e+01 44.468  2.24297e+01 224.468 0.8583 
1 1 1 -1  119 4  o 14 2.19924e+00 7.10196e-01 2.53940e+01 31.027  1.70985e+00  1.02848e+00  0.00000e+00 0.00000e+00 3.10618e+01 31.027  5.66777e+00 31.027  0.6970 
1 1 1 -1  119 5  o 17 3.40424e+00 8.81092e-01 6.53193e+01 323.471 5.62181e+00  -4.16431e+00 0.00000e+00 0.00000e+00 5.06795e+01 323.471 1.46398e+01 143.471 0.9255 
1 1 1 -1  119 6  f 0  2.84635e+00 8.11333e-01 5.26122e+01 47.498  3.76462e+00  4.10806e+00  0.00000e+00 0.00000e+00 4.22096e+01 47.498  1.04026e+01 227.498 0.9052 
1 1 1 -1  119 7  o 11 2.29318e+00 7.46548e-01 6.93360e+01 201.210 -6.38986e+00 -2.47970e+00 0.00000e+00 0.00000e+00 8.60331e+00 201.210 6.07326e+01 21.210  0.9239 
1 1 1 -1  120 1  o 8  2.95292e+00 7.51568e-01 4.03108e+01 36.365  3.13750e+00  2.31025e+00  0.00000e+00 0.00000e+00 5.31785e+01 36.365  1.28677e+01 36.365  0.8594 
1 1 1 -1  120 2  o 7  3.03996e+00 8.36509e-01 4.82243e+01 5.061   4.47023e+00  3.95853e-01  0.00000e+00 0.00000e+00 5.03097e+01 5.061   2.08536e+00 5.061   0.8800 
1 1 1 -1  120 3  o 7  2.54290e+00 7.78644e-01 5.94204e+01 92.912  -2.56891e-01 5.05017e+00  0.00000e+00 0.00000e+00 2.43642e+01 92.912  3.50562e+01 272.912 0.8947 
1 1 1 -1  120 4  o 6  4.69846e+00 9.01031e-01 1.02672e+02 129.741 -9.51548e+00 1.14449e+01  0.00000e+00 0.00000e+00 6.43985e+01 129.741 3.82734e+01 309.741 0.9658 
1 1 1 -1  120 5  o 10 3.22791e+00 8.81780e-01 7.54657e+01 271.793 2.69816e-01  -8.61683e+00 0.00000e+00 0.00000e+00 3.62220e+01 271.793 3.92437e+01 91.793  0.9401 
1 1 1 -1  120 6  o 16 5.19228e+00 9.38313e-01 5.79039e+01 353.636 1.01116e+01  -1.12777e+00 0.00000e+00 0.00000e+00 1.23486e+02 353.636 6.55817e+01 353.636 0.9495 
1 1 1 -1  121 1  o 15 2.81560e+00 7.79462e-01 6.14020e+01 231.317 -3.61364e+00 -4.51329e+00 0.00000e+00 0.00000e+00 3.28339e+01 231.317 2.85681e+01 51.317  0.9088 
1 1 1 -1  121 2  o 11 2.02366e+00 6.64761e-01 5.19337e+01 143.510 -3.43772e+00 2.54280e+00  0.00000e+00 0.00000e+00 1.31445e+01 143.510 3.87892e+01 323.510 0.8734 
1 1 1 -1  121 3  o 15 2.70245e+00 7.82229e-01 3.00548e+01 297.916 1.32289e+00  -2.49680e+00 0.00000e+00 0.00000e+00 4.91611e+01 297.916 1.91063e+01 297.916 0.7962 
1 1 1 -1  121 4  o 1  2.59313e+00 7.79938e-01 4.12272e+01 329.866 3.68015e+00  -2.13623e+00 0.00000e+00 0.00000e+00 4.20614e+01 329.866 8.34251e-01 329.866 0.8727 
1 1 1 -1  121 5  o 13 4.81372e+00 9.14164e-01 5.89249e+01 252.570 -2.85347e+00 -9.08902e+00 0.00000e+00 0.00000e+00 1.08620e+02 252.570 4.96948e+01 252.570 0.9460 
1 1 1 -1  121 6  o 11 4.20191e+00 9.30465e-01 7.33968e+01 142.300 -8.06786e+00 6.23560e+00  0.00000e+00 0.00000e+00 7.33638e+01 142.300 3.29962e-02 322.300 0.9496 
1 1 1 -1  122 1  o 3  3.33801e+00 8.72166e-01 5.82264e+01 271.308 1.40980e-01  -6.17200e+00 0.00000e+00 0.00000e+00 5.42124e+01 271.308 4.01393e+00 91.308  0.9150 
1 1 1 -1  122 2  o 3  3.27657e+00 8.66140e-01 6.22486e+01 51.825  4.28018e+00  5.44406e+00  0.00000e+00 0.00000e+00 4.92774e+01 51.825  1.29712e+01 231.825 0.9247 
1 1 1 -1  122 3  o 18 3.49634e+00 8.92387e-01 7.30987e+01 126.539 -5.32117e+00 7.18100e+00  0.00000e+00 0.00000e+00 4.81481e+01 126.539 2.49507e+01 306.539 0.9423 
1 1 1 -1  122 4  f 0  2.23898e+00 7.24789e-01 4.42482e+01 280.090 7.21840e-01  -4.05631e+00 0.00000e+00 0.00000e+00 2.72557e+01 280.090 1.69925e+01 100.090 0.8680 
1 1 1 -1  122 5  f 0  2.27532e+00 7.23857e-01 5.40444e+01 150.015 -4.71890e+00 2.72284e+00  0.00000e+00 0.00000e+00 2.15138e+01 150.015 3.25307e+01 330.015 0.9028 
1 1 1 -1  122 6  o 19 2.07935e+00 6.62979e-01 2.07218e+01 197.019 -1.98922e+00 -6.08877e-01 0.00000e+00 0.00000e+00 3.36008e+01 197.019 1.28790e+01 197.019 0.7105 
1 1 1 -1  123 1  o 3  2.52453e+00 7.63642e-01 4.62405e+01 79.277  8.80321e-01  4.64881e+00  0.00000e+00 0.00000e+00 3.61468e+01 79.277  1.00937e+01 259.277 0.8868 
1 1 1 -1  123 2  o 15 2.54236e+00 7.61264e-01 2.37169e+01 8.563   2.34636e+00  3.53317e-01  0.00000e+00 0.00000e+00 4.64870e+01 8.563   2.27701e+01 8.563   0.7504 
1 1 1 -1  123 3  o 17 3.14488e+00 8.55498e-01 3.93041e+01 242.060 -2.07885e+00 -3.91961e+00 0.00000e+00 0.00000e+00 6.23328e+01 242.060 2.30287e+01 242.060 0.8784 
1 1 1 -1  123 4  o 9  1.97968e+00 6.65277e-01 3.60577e+01 198.570 -3.17674e+00 -1.06724e+00 0.00000e+00 0.00000e+00 2.45922e+01 198.570 1.14655e+01 18.570  0.8329 
1 1 1 -1  123 5  o 12 2.42346e+00 7.59088e-01 2.17746e+01 136.127 -1.74308e+00 1.67582e+00  0.00000e+00 0.00000e+00 4.55717e+01 136.127 2.37971e+01 136.127 0.7558 
1 1 1 -1  124 1  o 14 2.27469e+00 7.15483e-01 5.12118e+01 212.049 -4.14612e+00 -2.59569e+00 0.00000e+00 0.00000e+00 2.33355e+01 212.049 2.78764e+01 32.049  0.8908 
1 1 1 -1  124 2  o 11 1.95812e+00 6.53034e-01 7.55186e+01 347.953 6.82490e+00  -1.45648e+00 0.00000e+00 0.00000e+00 8.87053e+00 167.953 8.43891e+01 167.953 0.9253 
1 1 1 -1  124 3  o 9  3.11619e+00 8.68465e-01 5.16958e+01 159.752 -5.63902e+00 2.08015e+00  0.00000e+00 0.00000e+00 5.28851e+01 159.752 1.18927e+00 159.752 0.9125 
1 1 1 -1  124 4  o 1  3.20877e+00 8.68518e-01 5.55624e+01 146.936 -5.57635e+00 3.63021e+00  0.00000e+00 0.00000e+00 5.31517e+01 146.936 2.41071e+00 326.936 0.9215 
1 1 1 -1  124 5  o 4  1.86289e+00 6.37205e-01 3.60458e+01 344.690 3.40882e+00  -9.33202e-01 0.00000e+00 0.00000e+00 2.16691e+01 344.690 1.43767e+01 164.690 0.8429 
1 1 1 -1  125 1  o 6  4.66850e+00 8.98014e-01 8.08651e+01 132.707 -9.22248e+00 9.99177e+00  0.00000e+00 0.00000e+00 8.43898e+01 132.707 3.52470e+00 132.707 0.9625 
1 1 1 -1  125 2  o 18 3.87734e+00 9.16236e-01 8.32275e+01 64.554  4.65966e+00  9.79313e+00  0.00000e+00 0.00000e+00 5.26098e+01 64.554  3.06177e+01 244.554 0.9527 
1 1 1 -1  125 3  o 15 3.97996e+00 9.16634e-01 3.66247e+01 273.980 3.79267e-01  -5.45110e+00 0.00000e+00 0.00000e+00 9.55267e+01 273.980 5.89020e+01 273.980 0.9031 
1 1 1 -1  125 4  o 5  1.91837e+00 6.41375e-01 1.95219e+01 6.833   2.06103e+00  2.46965e-01  0.00000e+00 0.00000e+00 3.05294e+01 6.833   1.10075e+01 6.833   0.7098 
1 1 1 -1  126 1  o 14 2.44849e+00 7.58722e-01 4.33740e+01 21.128  4.54109e+00  1.75481e+00  0.00000e+00 0.00000e+00 3.67631e+01 21.128  6.61083e+00 201.128 0.8902 
1 1 1 -1  126 2  o 19 3.52536e+00 8.85081e-01 4.81292e+01 247.838 -2.36786e+00 -5.81342e+00 0.00000e+00 0.00000e+00 7.06361e+01 247.838 2.25070e+01 247.838 0.9165 
1 1 1 -1  126 3  o 1  1.93180e+00 6.43939e-01 2.38521e+01 224.880 -1.70416e+00 -1.69702e+00 0.00000e+00 0.00000e+00 2.96991e+01 224.880 5.84707e+00 224.880 0.7543 
1 1 1 -1  126 4  o 17 4.69362e+00 9.60808e-01 1.09069e+02 41.737  1.27999e+01  1.14193e+01  0.00000e+00 0.00000e+00 5.82853e+01 41.737  5.07832e+01 221.737 0.9704 
1 1 1 -1  127 1  o 4  3.60412e+00 9.16436e-01 2.99202e+01 184.878 -3.98312e+00 -3.39928e-01 0.00000e+00 0.00000e+00 8.44479e+01 184.878 5.45277e+01 184.878 0.8634 
1 1 1 -1  127 2  o 17 2.35563e+00 7.32021e-01 5.75172e+01 295.252 3.17306e+00  -6.72731e+00 0.00000e+00 0.00000e+00 2.29961e+01 295.252 3.45210e+01 115.252 0.9301 
1 1 1 -1  127 3  o 7  3.58576e+00 9.11686e-01 4.20511e+01 74.179  1.39700e+00  4.93016e+00  0.00000e+00 0.00000e+00 7.60130e+01 74.179  3.39619e+01 74.179  0.8962 
1 1 1 -1  127 4  o 6  2.31076e+00 7.44566e-01 6.42629e+01 104.838 -1.95625e+00 7.38403e+00  0.00000e+00 0.00000e+00 1.48444e+01 104.838 4.94185e+01 284.838 0.9320 
1 1 1 -1  128 1  o 10 5.02641e+00 8.91053e-01 9.46448e+01 313.937 1.14825e+01  -1.19169e+01 0.00000e+00 0.00000e+00 8.43506e+01 313.937 1.02942e+01 133.937 0.9693 
1 1 1 -1  128 2  o 9  2.79924e+00 8.41478e-01 7.45208e+01 171.079 -9.33172e+00 1.46480e+00  0.00000e+00 0.00000e+00 2.27012e+01 171.079 5.18197e+01 351.079 0.9455 
1 1 1 -1  128 3  f 0  2.81751e+00 8.41678e-01 9.11753e+01 57.568  5.17767e+00  8.14858e+00  0.00000e+00 0.00000e+00 6.78803e+00 57.568  8.43873e+01 237.568 0.9467 
1 1 1 0   0   2  o 13 2.63691e+01 7.99865e-01 2.73556e+02 180.000 -7.96248e-01 -0.00000e+00 0.00000e+00 0.00000e+00 3.82195e+02 180.000 1.08639e+02 180.000 0.6619 
1 1 1 0   0   3  f 0  8.09634e+00 2.38573e-01 2.27550e+02 180.000 -2.95600e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.40180e+02 0.000   3.67730e+02 0.000   0.2873 
1 1 1 0   0   4  o 18 2.36943e+01 5.27737e-01 2.63447e+02 180.000 -1.33675e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.11510e+02 180.000 2.48063e+02 180.000 0.8709 
1 1 1 0   0   5  f 0  2.88007e+01 6.38213e-01 4.60785e+02 180.000 -5.30812e+00 -0.00000e+00 0.00000e+00 0.00000e+00 6.20482e+02 180.000 1.59697e+02 180.000 1.0000 
1 1 1 0   0   6  o 5  2.13715e+01 5.09847e-01 3.54517e+02 0.000   2.85938e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.42354e+02 0.000   8.78371e+01 0.000   0.9935 
1 1 1 0   0   7  o 5  3.93862e+01 9.57838e-01 5.55165e+02 0.000   1.03990e+01  0.00000e+00  0.00000e+00 0.00000e+00 9.22504e+02 0.000   3.67339e+02 0.000   1.0000 
1 1 1 0   0   8  o 13 9.15004e+00 4.08368e-01 2.60244e+02 180.000 -1.31006e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.63176e+01 180.000 2.23927e+02 0.000   0.8643 
1 1 1 0   0   9  o 18 4.04726e+01 1.00269e+00 6.60538e+02 0.000   1.80347e+01  0.00000e+00  0.00000e+00 0.00000e+00 8.56402e+02 0.000   1.95864e+02 0.000   1.0000 
1 1 1 0   0   10 f 0  5.03969e+01 1.23646e+00 4.60409e+02 0.000   2.38314e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.42741e+03 0.000   9.66997e+02 0.000   1.0000 
1 1 1 0   0   11 o 17 2.40863e+01 7.06428e-01 3.28595e+02 0.000   1.08665e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.73075e+02 0.000   2.44480e+02 0.000   1.0000 
1 1 1 0   0   12 o 16 1.49443e+01 7.34283e-01 7.72843e+01 180.000 -2.04978e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.63524e+02 180.000 3.86240e+02 180.000 0.9674 
1 1 1 0   0   13 o 8  9.27946e+00 9.89616e-01 9.47793e+01 180.000 -2.34646e+00 -0.00000e+00 0.00000e+00 0.00000e+00 2.45791e+02 180.000 1.51011e+02 180.000 0.9818 
1 1 1 0   0   14 o 18 2.03148e+00 1.35290e+00 1.44005e+01 0.000   9.92384e-02  0.00000e+00  0.00000e+00 0.00000e+00 6.89549e+00 180.000 2.12960e+01 180.000 0.0989 
1 1 1 0   0   15 f 0  1.14412e+01 1.12617e+00 1.48504e+02 180.000 -7.84808e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.78437e+02 180.000 1.29933e+02 180.000 1.0000 
1 1 1 0   0   16 o 13 5.06141e+00 2.19140e+00 6.40275e+01 0.000   1.42172e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.03902e+02 0.000   3.98744e+01 0.000   0.8900 
1 1 1 0   0   17 o 18 1.54747e+00 1.11325e+00 1.26827e+01 0.000   1.47526e-01  0.00000e+00  0.00000e+00 0.00000e+00 4.24149e+00 180.000 1.69242e+01 180.000 0.1465 
1 1 1 0   0   18 o 19 4.10347e+00 2.22004e+00 6.88361e+01 180.000 -1.53611e+00 -0.00000e+00 0.00000e+00 0.00000e+00 7.03111e+01 180.000 1.47504e+00 180.000 0.9115 
1 1 1 0   0   19 o 13 4.60311e+00 2.48372e+00 2.92249e+01 180.000 -6.88146e-01 0.00000e+00  0.00000e+00 0.00000e+00 7.28607e+01 180.000 4.36358e+01 180.000 0.5968 
1 1 1 0   0   20 o 5  2.40532e+00 1.70245e+00 1.20087e+02 0.000   2.46763e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.20831e+01 180.000 1.52171e+02 180.000 0.9857 
1 1 1 0   1   2  o 9  1.48400e+01 3.34753e-01 2.52358e+02 93.498  -5.01206e-02 8.19868e-01  0.00000e+00 0.00000e+00 4.07478e+01 273.498 2.93106e+02 273.498 0.3796 
1 1 1 0   1   3  o 15 3.67106e+01 5.52885e-01 3.66180e+02 223.778 -3.10001e+00 -2.97050e+00 0.00000e+00 0.00000e+00 8.38939e+02 223.778 4.72759e+02 223.778 0.8739 
1 1 1 0   1   4  o 2  5.53857e+01 8.29762e-01 8.55460e+02 160.803 -2.19018e+01 7.62592e+00  0.00000e+00 0.00000e+00 1.17921e+03 160.803 3.23748e+02 160.803 0.9782 
1 1 1 0   1   5  o 4  1.79005e+01 3.05551e-01 3.57369e+02 329.520 4.41388e+00  -2.59786e+00 0.00000e+00 0.00000e+00 2.44894e+02 329.520 1.12475e+02 149.520 0.8961 
1 1 1 0   1   6  o 2  8.31230e+00 2.27392e-01 1.44680e+02 234.273 -5.30390e-01 -7.37391e-01 0.00000e+00 0.00000e+00 1.58426e+01 54.273  1.60522e+02 54.273  0.4130 
1 1 1 0   1   7  o 6  3.71890e+01 5.84026e-01 8.54718e+02 50.755  1.91625e+01  2.34577e+01  0.00000e+00 0.00000e+00 5.17285e+02 50.755  3.37432e+02 230.755 0.9834 
1 1 1 0   1   8  o 6  2.89085e+01 4.80627e-01 5.54280e+02 95.963  -2.19234e+00 2.09900e+01  0.00000e+00 0.00000e+00 5.03789e+02 95.963  5.04908e+01 275.963 0.9760 
1 1 1 0   1   9  o 1  1.84188e+01 3.78179e-01 4.28972e+02 322.092 8.48744e+00  -6.60913e+00 0.00000e+00 0.00000e+00 2.28460e+02 322.092 2.00512e+02 142.092 0.9523 
1 1 1 0   1   10 o 17 2.00614e+01 4.28051e-01 3.09460e+02 166.994 -1.27087e+01 2.93551e+00  0.00000e+00 0.00000e+00 4.12611e+02 166.994 1.03151e+02 166.994 0.9609 
1 1 1 0   1   11 o 12 2.66884e+01 5.22266e-01 2.68516e+02 29.082  1.71759e+01  9.55276e+00  0.00000e+00 0.00000e+00 7.04803e+02 29.082  4.36287e+02 29.082  0.9742 
1 1 1 0   1   12 o 9  2.59727e+01 5.80282e-01 3.20280e+02 286.997 8.37920e+00  -2.74122e+01 0.00000e+00 0.00000e+00 6.34221e+02 286.997 3.13942e+02 286.997 0.9824 
1 1 1 0   1   13 o 8  7.44714e+00 7.70141e-01 1.32092e+02 148.923 -4.44944e+00 2.68168e+00  0.00000e+00 0.00000e+00 1.17810e+02 148.923 1.42812e+01 328.923 0.8977 
1 1 1 0   1   14 o 1  7.33595e+00 9.49836e-01 1.44969e+02 23.315  6.63666e+00  2.86024e+00  0.00000e+00 0.00000e+00 1.09291e+02 23.315  3.56781e+01 203.315 0.9280 
1 1 1 0   1   15 o 11 1.91192e+01 7.08120e-01 3.20542e+02 16.893  5.54387e+01  1.68366e+01  0.00000e+00 0.00000e+00 3.86730e+02 16.893  6.61883e+01 16.893  0.9913 
1 1 1 0   1   16 o 17 7.88747e+00 1.19617e+00 8.80509e+01 157.617 -6.69732e+00 2.75809e+00  0.00000e+00 0.00000e+00 1.84873e+02 157.617 9.68219e+01 157.617 0.9282 
1 1 1 0   1   17 o 7  5.98930e+00 1.12376e+00 1.14393e+02 315.037 6.17583e+00  -6.16786e+00 0.00000e+00 0.00000e+00 9.54716e+01 315.037 1.89216e+01 135.037 0.9408 
1 1 1 0   1   18 f 0  3.90726e+00 1.14268e+00 7.95188e+01 321.228 3.44125e+00  -2.76407e+00 0.00000e+00 0.00000e+00 4.80732e+01 321.228 3.14457e+01 141.228 0.8777 
1 1 1 0   1   19 o 16 5.16689e+00 1.42666e+00 9.35460e+01 186.844 -6.13261e+00 -7.35997e-01 0.00000e+00 0.00000e+00 8.21459e+01 186.844 1.14002e+01 6.844   0.9150 
1 1 1 0   1   20 o 6  4.32106e+00 1.38048e+00 6.03552e+01 203.468 -3.57045e+00 -1.55010e+00 0.00000e+00 0.00000e+00 7.74568e+01 203.468 1.71016e+01 203.468 0.8593 
1 1 1 0   2   2  f 0  4.01909e+01 7.42537e-01 3.56601e+02 273.334 1.78569e-01  -3.06506e+00 0.00000e+00 0.00000e+00 8.74059e+02 273.334 5.17458e+02 273.334 0.8150 
1 1 1 0   2   3  o 9  1.49313e+01 2.48887e-01 2.94649e+02 157.576 -1.28907e+00 5.31941e-01  0.00000e+00 0.00000e+00 2.44577e+01 157.576 2.70192e+02 337.576 0.5690 
1 1 1 0   2   4  o 9  3.44366e+01 5.25983e-01 3.93473e+02 8.916   6.54713e+00  1.02708e+00  0.00000e+00 0.00000e+00 7.97780e+02 8.916   4.04307e+02 8.916   0.9211 
1 1 1 0   2   5  o 4  2.36383e+01 3.80882e-01 2.66898e+02 78.385  1.01368e+00  4.93154e+00  0.00000e+00 0.00000e+00 5.26680e+02 78.385  2.59782e+02 78.385  0.8942 
1 1 1 0   2   6  o 17 1.33047e+01 3.06964e-01 1.23936e+02 153.669 -1.11402e+00 5.51339e-01  0.00000e+00 0.00000e+00 1.38670e+02 153.669 1.47344e+01 153.669 0.5259 
1 1 1 0   2   7  o 16 3.36242e+01 5.34719e-01 7.68094e+02 148.711 -2.10364e+01 1.27848e+01  0.00000e+00 0.00000e+00 4.67495e+02 148.711 3.00599e+02 328.711 0.9795 
1 1 1 0   2   8  o 9  2.97493e+01 5.12984e-01 6.09028e+02 20.974  2.22545e+01  8.53113e+00  0.00000e+00 0.00000e+00 4.82909e+02 20.974  1.26119e+02 200.974 0.9788 
1 1 1 0   2   9  o 8  4.39931e+01 6.96539e-01 7.04329e+02 116.521 -1.86692e+01 3.74106e+01  0.00000e+00 0.00000e+00 9.24714e+02 116.521 2.20385e+02 116.521 0.9880 
1 1 1 0   2   10 o 13 2.09039e+01 4.43110e-01 2.87763e+02 253.734 -3.53730e+00 -1.21236e+01 0.00000e+00 0.00000e+00 4.63601e+02 253.734 1.75839e+02 253.734 0.9596 
1 1 1 0   2   11 o 2  2.89270e+01 6.49759e-01 5.17409e+02 339.927 3.82558e+01  -1.39795e+01 0.00000e+00 0.00000e+00 5.52089e+02 339.927 3.46793e+01 339.927 0.9876 
1 1 1 0   2   12 o 11 2.07934e+01 5.33966e-01 3.98195e+02 53.066  1.71989e+01  2.28785e+01  0.00000e+00 0.00000e+00 3.65941e+02 53.066  3.22534e+01 233.066 0.9824 
1 1 1 0   2   13 o 14 1.99771e+01 5.80729e-01 2.30498e+02 186.002 -2.48077e+01 -2.60812e+00 0.00000e+00 0.00000e+00 5.01120e+02 186.002 2.70622e+02 186.002 0.9797 
1 1 1 0   2   14 o 9  1.15640e+01 6.94511e-01 2.11320e+02 354.163 1.74470e+01  -1.78358e+00 0.00000e+00 0.00000e+00 2.08083e+02 354.163 3.23660e+00 174.163 0.9711 
1 1 1 0   2   15 o 1  2.07036e+01 6.98142e-01 3.36869e+02 197.856 -6.29092e+01 -2.02653e+01 0.00000e+00 0.00000e+00 4.29840e+02 197.856 9.29707e+01 197.856 0.9924 
1 1 1 0   2   16 o 15 1.21338e+01 7.97456e-01 2.02176e+02 48.484  1.89846e+01  2.14459e+01  0.00000e+00 0.00000e+00 2.42212e+02 48.484  4.00356e+01 48.484  0.9824 
1 1 1 0   2   17 o 7  7.61930e+00 1.31368e+00 1.61717e+02 236.487 -7.80900e+00 -1.17923e+01 0.00000e+00 0.00000e+00 1.11826e+02 236.487 4.98917e+01 56.487  0.9640 
1 1 1 0   2   18 o 13 9.49293e+00 1.13440e+00 1.23556e+02 99.918  -2.88430e+00 1.64948e+01  0.00000e+00 0.00000e+00 2.18899e+02 99.918  9.53435e+01 99.918  0.9697 
1 1 1 0   2   19 o 13 5.35037e+00 1.38556e+00 5.24032e+01 5.716   3.66548e+00  3.66918e-01  0.00000e+00 0.00000e+00 1.16630e+02 5.716   6.42273e+01 5.716   0.8502 
1 1 1 0   2   20 o 2  4.72719e+00 1.40705e+00 4.09082e+01 342.873 2.82377e+00  -8.70159e-01 0.00000e+00 0.00000e+00 1.00615e+02 342.873 5.97067e+01 342.873 0.8066 
1 1 1 0   3   2  o 5  3.37302e+01 6.26540e-01 4.90159e+02 158.569 -3.18506e+00 1.25018e+00  0.00000e+00 0.00000e+00 5.70359e+02 158.569 8.02005e+01 158.569 0.8369 
1 1 1 0   3   3  o 15 1.39760e+01 2.94858e-01 2.84958e+02 322.466 9.86107e-01  -7.57592e-01 0.00000e+00 0.00000e+00 8.79105e+00 142.466 2.93749e+02 142.466 0.5261 
1 1 1 0   3   4  o 5  1.87446e+01 3.22254e-01 5.35139e+02 177.669 -4.87290e+00 1.98384e-01  0.00000e+00 0.00000e+00 9.16909e+01 177.669 4.43448e+02 357.669 0.8904 
1 1 1 0   3   5  o 19 1.55709e+01 2.91028e-01 2.04754e+02 34.754  2.08359e+00  1.44568e+00  0.00000e+00 0.00000e+00 2.44720e+02 34.754  3.99664e+01 34.754  0.7689 
1 1 1 0   3   6  o 4  2.76193e+01 4.44603e-01 3.65356e+02 294.997 3.20245e+00  -6.86858e+00 0.00000e+00 0.00000e+00 6.00211e+02 294.997 2.34854e+02 294.997 0.9315 
1 1 1 0   3   7  o 7  2.02222e+01 3.59980e-01 3.76510e+02 305.361 4.20650e+00  -5.92766e+00 0.00000e+00 0.00000e+00 3.27855e+02 305.361 4.86548e+01 125.361 0.9284 
1 1 1 0   3   8  o 1  3.61498e+01 6.03492e-01 5.63430e+02 99.990  -4.63287e+00 2.63022e+01  0.00000e+00 0.00000e+00 7.66549e+02 99.990  2.03119e+02 99.990  0.9811 
1 1 1 0   3   9  o 4  1.77550e+01 4.02434e-01 3.35884e+02 53.933  4.77442e+00  6.55539e+00  0.00000e+00 0.00000e+00 2.87088e+02 53.933  4.87961e+01 233.933 0.9361 
1 1 1 0   3   10 o 7  3.26253e+01 5.82061e-01 4.43897e+02 86.199  2.00384e+00  3.01589e+01  0.00000e+00 0.00000e+00 7.57807e+02 86.199  3.13910e+02 86.199  0.9833 
1 1 1 0   3   11 o 11 1.88056e+01 4.71087e-01 3.42902e+02 272.157 6.67251e-01  -1.77128e+01 0.00000e+00 0.00000e+00 3.40918e+02 272.157 1.98423e+00 92.157  0.9714 
1 1 1 0   3   12 o 15 1.91290e+01 5.25434e-01 2.41262e+02 242.647 -7.33292e+00 -1.41751e+01 0.00000e+00 0.00000e+00 4.51525e+02 242.647 2.10263e+02 242.647 0.9681 
1 1 1 0   3   13 o 6  2.23081e+01 6.00313e-01 2.39800e+02 195.683 -2.78281e+01 -7.81338e+00 0.00000e+00 0.00000e+00 5.79514e+02 195.683 3.39714e+02 195.683 0.9825 
1 1 1 0   3   14 o 6  1.46171e+01 6.47102e-01 2.80150e+02 7.898   2.93533e+01  4.07219e+00  0.00000e+00 0.00000e+00 2.56488e+02 7.898   2.36614e+01 187.898 0.9830 
1 1 1 0   3   15 o 12 1.34058e+01 8.27796e-01 2.46860e+02 197.500 -2.88936e+01 -9.11034e+00 0.00000e+00 0.00000e+00 2.45059e+02 197.500 1.80060e+00 17.500  0.9834 
1 1 1 0   3   16 o 3  1.62827e+01 7.65893e-01 3.42109e+02 215.144 -5.37525e+01 -3.78389e+01 0.00000e+00 0.00000e+00 2.60281e+02 215.144 8.18277e+01 35.144  0.9924 
1 1 1 0   3   17 o 11 4.59167e+00 1.26751e+00 7.71806e+01 358.805 4.17295e+00  -8.70390e-02 0.00000e+00 0.00000e+00 7.15764e+01 358.805 5.60425e+00 178.805 0.8699 
1 1 1 0   3   18 o 10 1.02474e+01 1.16774e+00 1.93505e+02 304.849 1.58518e+01  -2.27664e+01 0.00000e+00 0.00000e+00 1.80792e+02 304.849 1.27129e+01 124.849 0.9818 
1 1 1 0   3   19 o 8  7.65580e+00 1.57693e+00 1.26353e+02 132.331 -7.51764e+00 8.25271e+00  0.00000e+00 0.00000e+00 1.45087e+02 132.331 1.87339e+01 132.331 0.9541 
1 1 1 0   3   20 o 3  1.11422e+01 1.58728e+00 1.33405e+02 81.589  2.88108e+00  1.94847e+01  0.00000e+00 0.00000e+00 2.69519e+02 81.589  1.36114e+02 81.589  0.9743 
1 1 1 0   4   2  o 9  3.08433e+01 5.76353e-01 7.26146e+02 291.458 1.61816e+00  -4.11688e+00 0.00000e+00 0.00000e+00 2.91261e+02 291.458 4.34885e+02 111.458 0.8780 
1 1 1 0   4   3  o 14 2.54824e+01 4.87950e-01 3.87402e+02 1.973   3.01594e+00  1.03884e-01  0.00000e+00 0.00000e+00 3.89148e+02 1.973   1.74534e+00 1.973   0.8113 
1 1 1 0   4   4  o 9  4.00031e+01 6.71110e-01 4.95234e+02 179.523 -9.50197e+00 7.91622e-02  0.00000e+00 0.00000e+00 9.25665e+02 179.523 4.30432e+02 179.523 0.9458 
1 1 1 0   4   5  o 10 3.45786e+01 5.59944e-01 5.73863e+02 4.185   1.55993e+01  1.14133e+00  0.00000e+00 0.00000e+00 6.82148e+02 4.185   1.08284e+02 4.185   0.9675 
1 1 1 0   4   6  f 0  1.53531e+01 3.01928e-01 2.95898e+02 91.476  -8.77609e-02 3.40523e+00  0.00000e+00 0.00000e+00 1.85861e+02 91.476  1.10036e+02 271.476 0.8361 
1 1 1 0   4   7  o 18 2.23134e+01 4.01276e-01 2.24377e+02 323.277 3.82226e+00  -2.85142e+00 0.00000e+00 0.00000e+00 5.18758e+02 323.277 2.94381e+02 323.277 0.8877 
1 1 1 0   4   8  o 4  1.78205e+01 3.61796e-01 3.47556e+02 242.990 -3.70581e+00 -7.26983e+00 0.00000e+00 0.00000e+00 2.78304e+02 242.990 6.92521e+01 62.990  0.9366 
1 1 1 0   4   9  f 0  3.83793e+01 8.50040e-01 2.54747e+02 30.687  1.12659e+01  6.68585e+00  0.00000e+00 0.00000e+00 1.12767e+03 30.687  8.72918e+02 30.687  0.9610 
1 1 1 0   4   10 o 6  2.44203e+01 4.81492e-01 3.05462e+02 23.591  1.43204e+01  6.25377e+00  0.00000e+00 0.00000e+00 5.79508e+02 23.591  2.74046e+02 23.591  0.9675 
1 1 1 0   4   11 o 15 4.31839e+01 1.29955e+00 4.07224e+02 16.803  4.30155e+01  1.29895e+01  0.00000e+00 0.00000e+00 1.19123e+03 16.803  7.84010e+02 16.803  0.9888 
1 1 1 0   4   12 o 15 3.34094e+01 6.47814e-01 5.21315e+02 355.289 5.94547e+01  -4.89914e+00 0.00000e+00 0.00000e+00 7.17938e+02 355.289 1.96623e+02 355.289 0.9916 
1 1 1 0   4   13 o 9  1.85590e+01 9.61595e-01 2.15276e+02 142.893 -1.62828e+01 1.23175e+01  0.00000e+00 0.00000e+00 4.61239e+02 142.893 2.45963e+02 142.893 0.9752 
1 1 1 0   4   14 o 10 5.69315e+00 1.01327e+00 1.20588e+02 277.916 6.32082e-01  -4.54592e+00 0.00000e+00 0.00000e+00 6.71447e+01 277.916 5.34437e+01 97.916  0.8829 
1 1 1 0   4   15 o 14 1.55166e+01 7.63587e-01 1.86470e+02 7.702   2.67088e+01  3.61195e+00  0.00000e+00 0.00000e+00 3.81693e+02 7.702   1.95223e+02 7.702   0.9813 
1 1 1 0   4   16 o 5  1.09489e+01 8.59598e-01 1.88743e+02 128.155 -1.45750e+01 1.85513e+01  0.00000e+00 0.00000e+00 2.10687e+02 128.155 2.19436e+01 128.155 0.9786 
1 1 1 0   4   17 o 11 6.40816e+00 1.24531e+00 6.46267e+01 23.360  4.53273e+00  1.95771e+00  0.00000e+00 0.00000e+00 1.48233e+02 23.360  8.36064e+01 23.360  0.8919 
1 1 1 0   4   18 o 6  3.58190e+00 1.13716e+00 8.47435e+01 201.989 -4.01080e+00 -1.61960e+00 0.00000e+00 0.00000e+00 3.18510e+01 201.989 5.28925e+01 21.989  0.8750 
1 1 1 0   4   19 o 9  5.07401e+00 1.42096e+00 1.18950e+02 100.178 -1.36777e+00 7.61864e+00  0.00000e+00 0.00000e+00 5.69652e+01 100.178 6.19843e+01 280.178 0.9330 
1 1 1 0   4   20 o 13 4.88278e+00 1.48886e+00 6.34674e+00 33.836  3.68498e-01  2.47026e-01  0.00000e+00 0.00000e+00 3.28959e+01 33.836  2.65492e+01 33.836  0.2165 
1 1 1 0   5   2  o 18 2.59095e+01 4.89621e-01 4.69337e+02 220.377 -1.72898e+00 -1.47027e+00 0.00000e+00 0.00000e+00 2.48451e+02 220.377 2.20886e+02 40.377  0.7374 
1 1 1 0   5   3  o 14 1.34839e+01 2.93347e-01 6.24876e+02 323.918 2.03118e+00  -1.48019e+00 0.00000e+00 0.00000e+00 2.36690e+02 143.918 8.61566e+02 143.918 0.7664 
1 1 1 0   5   4  o 6  3.13723e+01 5.06922e-01 7.18503e+02 65.378  4.45354e+00  9.71769e+00  0.00000e+00 0.00000e+00 4.03110e+02 65.378  3.15394e+02 245.378 0.9520 
1 1 1 0   5   5  f 0  3.65398e+01 5.90009e-01 7.62478e+02 341.386 2.06516e+01  -6.95569e+00 0.00000e+00 0.00000e+00 5.77502e+02 341.386 1.84975e+02 161.386 0.9768 
1 1 1 0   5   6  o 10 9.92760e+00 2.49478e-01 1.10258e+02 306.454 4.85937e-01  -6.57810e-01 0.00000e+00 0.00000e+00 3.06365e+01 306.454 7.96215e+01 126.454 0.3781 
1 1 1 0   5   7  o 10 2.48449e+01 4.35871e-01 6.09454e+02 357.261 1.43671e+01  -6.87314e-01 0.00000e+00 0.00000e+00 2.89623e+02 357.261 3.19831e+02 177.261 0.9646 
1 1 1 0   5   8  o 11 4.47793e+01 7.31975e-01 7.26136e+02 316.376 3.06640e+01  -2.92249e+01 0.00000e+00 0.00000e+00 9.33099e+02 316.376 2.06963e+02 316.376 0.9881 
1 1 1 0   5   9  o 15 2.04762e+01 4.13543e-01 4.08540e+02 29.502  9.88491e+00  5.59307e+00  0.00000e+00 0.00000e+00 3.24292e+02 29.502  8.42478e+01 209.502 0.9549 
1 1 1 0   5   10 o 1  2.68317e+01 5.08184e-01 5.79928e+02 310.393 2.10888e+01  -2.47853e+01 0.00000e+00 0.00000e+00 4.09562e+02 310.393 1.70366e+02 130.393 0.9845 
1 1 1 0   5   11 o 14 2.39468e+01 5.60962e-01 5.20610e+02 36.871  2.72662e+01  2.04501e+01  0.00000e+00 0.00000e+00 3.62554e+02 36.871  1.58056e+02 216.871 0.9852 
1 1 1 0   5   12 o 2  2.24121e+01 5.44250e-01 2.87761e+02 189.384 -2.19595e+01 -3.62897e+00 0.00000e+00 0.00000e+00 5.31560e+02 189.384 2.43800e+02 189.384 0.9773 
1 1 1 0   5   13 o 17 2.11672e+01 5.83974e-01 3.03703e+02 150.371 -3.02279e+01 1.71923e+01  0.00000e+00 0.00000e+00 4.76041e+02 150.371 1.72339e+02 150.371 0.9855 
1 1 1 0   5   14 o 14 1.17052e+01 7.33989e-01 1.93600e+02 230.550 -1.02464e+01 -1.24521e+01 0.00000e+00 0.00000e+00 2.29787e+02 230.550 3.61865e+01 230.550 0.9685 
1 1 1 0   5   15 f 0  9.86070e+00 8.14804e-01 7.63293e+01 141.010 -5.37228e+00 4.34878e+00  0.00000e+00 0.00000e+00 2.63854e+02 141.010 1.87525e+02 141.010 0.9245 
1 1 1 0   5   16 o 18 1.30471e+01 7.52106e-01 1.43849e+02 67.204  8.61758e+00  2.05040e+01  0.00000e+00 0.00000e+00 3.31480e+02 67.204  1.87631e+02 67.204  0.9773 
1 1 1 0   5   17 o 12 5.98329e+00 1.29562e+00 1.14678e+02 186.022 -7.90972e+00 -8.34378e-01 0.00000e+00 0.00000e+00 9.36329e+01 186.022 2.10447e+01 6.022   0.9348 
1 1 1 0   5   18 o 11 1.04088e+01 1.19028e+00 1.51591e+02 148.147 -1.84899e+01 1.14877e+01  0.00000e+00 0.00000e+00 2.26638e+02 148.147 7.50469e+01 148.147 0.9768 
1 1 1 0   5   19 o 17 4.95272e+00 1.41206e+00 8.63011e+01 138.184 -4.10943e+00 3.67629e+00  0.00000e+00 0.00000e+00 8.00886e+01 138.184 6.21259e+00 318.184 0.9041 
1 1 1 0   5   20 o 3  9.09456e+00 1.72423e+00 1.82326e+02 355.234 1.96963e+01  -1.64218e+00 0.00000e+00 0.00000e+00 1.46573e+02 355.234 3.57528e+01 175.234 0.9744 
1 1 1 0   6   2  o 18 2.62948e+01 4.77497e-01 4.50368e+02 201.640 -1.92553e+00 -7.63930e-01 0.00000e+00 0.00000e+00 2.50173e+02 201.640 2.00195e+02 21.640  0.7092 
1 1 1 0   6   3  o 1  5.30536e+01 9.84170e-01 2.64445e+02 113.376 -1.60384e+00 3.71049e+00  0.00000e+00 0.00000e+00 1.45955e+03 113.376 1.19511e+03 113.376 0.8651 
1 1 1 0   6   4  o 9  4.69510e+01 7.87375e-01 4.15416e+02 197.120 -8.67474e+00 -2.67209e+00 0.00000e+00 0.00000e+00 1.24759e+03 197.120 8.32174e+02 197.120 0.9432 
1 1 1 0   6   5  o 11 2.54867e+01 4.29026e-01 4.70382e+02 139.539 -7.08981e+00 6.04686e+00  0.00000e+00 0.00000e+00 4.33564e+02 139.539 3.68179e+01 319.539 0.9447 
1 1 1 0   6   6  o 12 3.17708e+01 5.25897e-01 6.28995e+02 222.906 -1.08520e+01 -1.00865e+01 0.00000e+00 0.00000e+00 5.22407e+02 222.906 1.06588e+02 42.906  0.9656 
1 1 1 0   6   7  o 12 3.22368e+01 5.40483e-01 4.07163e+02 80.427  2.06440e+00  1.22403e+01  0.00000e+00 0.00000e+00 7.52433e+02 80.427  3.45270e+02 80.427  0.9588 
1 1 1 0   6   8  o 3  2.53393e+01 4.55121e-01 5.72161e+02 209.277 -1.65825e+01 -9.29681e+00 0.00000e+00 0.00000e+00 3.52684e+02 209.277 2.19477e+02 29.277  0.9733 
1 1 1 0   6   9  o 19 7.37543e+01 1.25485e+00 9.08928e+02 25.986  7.89224e+01  3.84693e+01  0.00000e+00 0.00000e+00 1.83951e+03 25.986  9.30583e+02 25.986  0.9943 
1 1 1 0   6   10 o 5  2.47202e+01 4.83415e-01 3.31239e+02 24.682  1.55640e+01  7.15263e+00  0.00000e+00 0.00000e+00 5.67260e+02 24.682  2.36021e+02 24.682  0.9704 
1 1 1 0   6   11 o 10 1.09868e+01 4.83899e-01 2.67113e+02 70.131  2.73682e+00  7.57329e+00  0.00000e+00 0.00000e+00 1.17703e+02 70.131  1.49409e+02 250.131 0.9357 
1 1 1 0   6   12 o 4  2.34592e+01 5.65722e-01 2.93163e+02 292.653 9.12300e+00  -2.18590e+01 0.00000e+00 0.00000e+00 5.65640e+02 292.653 2.72477e+02 292.653 0.9787 
1 1 1 0   6   13 o 9  2.88614e+01 6.36285e-01 4.68859e+02 81.952  1.01767e+01  7.19759e+01  0.00000e+00 0.00000e+00 6.02483e+02 81.952  1.33624e+02 81.952  0.9931 
1 1 1 0   6   14 o 5  3.26068e+01 7.21487e-01 5.54975e+02 260.652 -2.09559e+01 -1.27304e+02 0.00000e+00 0.00000e+00 6.58074e+02 260.652 1.03099e+02 260.652 0.9961 
1 1 1 0   6   15 o 1  2.20148e+01 6.60177e-01 4.82711e+02 66.845  3.99187e+01  9.33386e+01  0.00000e+00 0.00000e+00 3.34699e+02 66.845  1.48011e+02 246.845 0.9951 
1 1 1 0   6   16 o 4  5.25294e+00 1.12178e+00 1.30929e+02 229.242 -4.61385e+00 -5.35316e+00 0.00000e+00 0.00000e+00 5.04579e+01 229.242 8.04714e+01 49.242  0.9263 
1 1 1 0   6   17 o 17 3.71132e+00 1.11902e+00 3.30023e+01 268.681 -3.59921e-02 -1.56301e+00 0.00000e+00 0.00000e+00 5.15056e+01 268.681 1.85032e+01 268.681 0.6114 
1 1 1 0   6   18 o 12 4.03340e+00 1.23021e+00 9.05264e+01 89.922  6.66151e-03  4.91443e+00  0.00000e+00 0.00000e+00 4.32214e+01 89.922  4.73050e+01 269.922 0.8914 
1 1 1 0   6   19 o 2  4.37770e+00 1.35931e+00 9.38160e+01 350.656 5.41646e+00  -8.91237e-01 0.00000e+00 0.00000e+00 5.31783e+01 350.656 4.06377e+01 170.656 0.9036 
1 1 1 0   6   20 o 13 5.19281e+00 1.55625e+00 8.50073e+01 184.434 -5.97319e+00 -4.63217e-01 0.00000e+00 0.00000e+00 9.08076e+01 184.434 5.80026e+00 184.434 0.9122 
1 1 1 0   7   2  o 11 3.03257e+01 5.47106e-01 3.96510e+02 61.553  2.11262e+00  3.89959e+00  0.00000e+00 0.00000e+00 6.04179e+02 61.553  2.07669e+02 61.553  0.8784 
1 1 1 0   7   3  o 14 2.41178e+01 4.70187e-01 2.16181e+02 314.103 1.01482e+00  -1.04711e+00 0.00000e+00 0.00000e+00 3.14326e+02 314.103 9.81450e+01 314.103 0.5856 
1 1 1 0   7   4  o 14 3.52837e+01 5.98846e-01 6.52481e+02 170.832 -1.04128e+01 1.68053e+00  0.00000e+00 0.00000e+00 6.08051e+02 170.832 4.44302e+01 350.832 0.9513 
1 1 1 0   7   5  o 10 1.21811e+01 2.56788e-01 2.43208e+02 165.590 -2.21173e+00 5.68289e-01  0.00000e+00 0.00000e+00 9.48591e+01 165.590 1.48349e+02 345.590 0.7393 
1 1 1 0   7   6  o 4  2.18291e+01 3.87152e-01 3.34782e+02 200.383 -5.96804e+00 -2.21748e+00 0.00000e+00 0.00000e+00 4.17037e+02 200.383 8.22547e+01 200.383 0.9177 
1 1 1 0   7   7  o 16 3.47176e+01 5.76422e-01 6.03826e+02 0.582   1.97503e+01  2.00766e-01  0.00000e+00 0.00000e+00 6.65188e+02 0.582   6.13627e+01 0.582   0.9743 
1 1 1 0   7   8  o 11 3.82780e+01 6.37260e-01 6.06305e+02 230.430 -1.92568e+01 -2.33020e+01 0.00000e+00 0.00000e+00 8.05088e+02 230.430 1.98783e+02 230.430 0.9833 
1 1 1 0   7   9  o 2  3.01205e+01 6.25901e-01 2.84952e+02 185.901 -1.15034e+01 -1.18888e+00 0.00000e+00 0.00000e+00 7.93941e+02 185.901 5.08989e+02 185.901 0.9557 
1 1 1 0   7   10 o 11 1.60847e+01 4.11792e-01 2.29960e+02 225.213 -5.46879e+00 -5.50954e+00 0.00000e+00 0.00000e+00 3.32253e+02 225.213 1.02294e+02 225.213 0.9332 
1 1 1 0   7   11 o 14 4.18762e+01 7.27989e-01 6.76997e+02 32.810  6.43679e+01  4.14983e+01  0.00000e+00 0.00000e+00 8.80263e+02 32.810  2.03267e+02 32.810  0.9934 
1 1 1 0   7   12 o 18 1.97360e+01 5.44833e-01 3.11479e+02 80.005  3.67802e+00  2.08698e+01  0.00000e+00 0.00000e+00 4.09135e+02 80.005  9.76559e+01 80.005  0.9761 
1 1 1 0   7   13 f 0  3.21917e+01 7.33719e-01 3.62142e+02 256.997 -1.38957e+01 -6.01744e+01 0.00000e+00 0.00000e+00 8.31323e+02 256.997 4.69181e+02 256.997 0.9919 
1 1 1 0   7   14 o 15 1.40842e+01 7.24313e-01 2.08030e+02 247.109 -8.58271e+00 -2.03266e+01 0.00000e+00 0.00000e+00 3.05910e+02 247.109 9.78799e+01 247.109 0.9771 
1 1 1 0   7   15 o 1  1.03456e+01 7.79569e-01 8.28404e+01 224.248 -5.68785e+00 -5.54041e+00 0.00000e+00 0.00000e+00 2.77995e+02 224.248 1.95154e+02 224.248 0.9347 
1 1 1 0   7   16 o 15 1.31155e+01 7.59518e-01 2.48067e+02 42.851  2.81801e+01  2.61415e+01  0.00000e+00 0.00000e+00 2.34456e+02 42.851  1.36102e+01 222.851 0.9869 
1 1 1 0   7   17 o 9  3.50572e+00 1.09161e+00 2.64132e+01 161.498 -1.13699e+00 3.80474e-01  0.00000e+00 0.00000e+00 4.04915e+01 161.498 1.40783e+01 161.498 0.5125 
1 1 1 0   7   18 o 5  5.37212e+00 1.42568e+00 3.00434e+01 45.961  1.28537e+00  1.32921e+00  0.00000e+00 0.00000e+00 1.04127e+02 45.961  7.40833e+01 45.961  0.6714 
1 1 1 0   7   19 o 14 5.43150e+00 1.47727e+00 1.20314e+02 332.942 7.17987e+00  -3.66749e+00 0.00000e+00 0.00000e+00 6.85489e+01 332.942 5.17648e+01 152.942 0.9358 
1 1 1 0   7   20 o 14 6.85515e+00 1.73698e+00 9.47685e+01 240.240 -3.80551e+00 -6.65561e+00 0.00000e+00 0.00000e+00 1.42433e+02 240.240 4.76644e+01 240.240 0.9323 
1 1 1 0   8   2  o 6  8.42070e+00 2.11710e-01 2.37053e+02 42.079  5.07861e-01  4.58551e-01  0.00000e+00 0.00000e+00 1.34706e+02 222.079 3.71760e+02 222.079 0.3235 
1 1 1 0   8   3  o 13 2.22606e+01 3.79785e-01 1.28228e+02 25.914  9.59230e-01  4.66063e-01  0.00000e+00 0.00000e+00 2.64278e+02 25.914  1.36050e+02 25.914  0.4694 
1 1 1 0   8   4  o 14 7.08641e+01 1.18213e+00 1.17771e+03 102.060 -7.76244e+00 3.63317e+01  0.00000e+00 0.00000e+00 1.44731e+03 102.060 2.69594e+02 102.060 0.9864 
1 1 1 0   8   5  o 5  3.68060e+01 6.28602e-01 4.71009e+02 150.793 -8.80789e+00 4.92407e+00  0.00000e+00 0.00000e+00 8.40384e+02 150.793 3.69375e+02 150.793 0.9491 
1 1 1 0   8   6  o 4  2.58376e+01 4.97435e-01 4.38512e+02 140.776 -7.58660e+00 6.19281e+00  0.00000e+00 0.00000e+00 4.80219e+02 140.776 4.17068e+01 140.776 0.9475 
1 1 1 0   8   7  o 10 3.96428e+01 6.87349e-01 4.03823e+02 345.297 1.40112e+01  -3.67652e+00 0.00000e+00 0.00000e+00 1.03105e+03 345.297 6.27229e+02 345.297 0.9648 
1 1 1 0   8   8  o 16 3.89132e+01 6.46476e-01 5.20405e+02 332.305 2.33009e+01  -1.22307e+01 0.00000e+00 0.00000e+00 9.10720e+02 332.305 3.90315e+02 332.305 0.9808 
1 1 1 0   8   9  o 8  5.64747e+01 9.79243e-01 1.16449e+03 151.547 -9.01554e+01 4.88537e+01  0.00000e+00 0.00000e+00 9.41690e+02 151.547 2.22800e+02 331.547 0.9951 
1 1 1 0   8   10 o 14 3.96116e+01 6.80211e-01 6.52663e+02 266.694 -3.09022e+00 -5.35018e+01 0.00000e+00 0.00000e+00 8.17108e+02 266.694 1.64445e+02 266.694 0.9906 
1 1 1 0   8   11 o 2  3.68206e+01 6.90191e-01 4.31008e+02 126.027 -2.59125e+01 3.56298e+01  0.00000e+00 0.00000e+00 9.31515e+02 126.027 5.00507e+02 126.027 0.9886 
1 1 1 0   8   12 o 2  2.99877e+01 6.12947e-01 6.23754e+02 189.997 -6.31382e+01 -1.11291e+01 0.00000e+00 0.00000e+00 4.89165e+02 189.997 1.34589e+02 9.997   0.9922 
1 1 1 0   8   13 o 16 1.13930e+01 6.50078e-01 1.75562e+02 345.915 1.14539e+01  -2.87376e+00 0.00000e+00 0.00000e+00 2.31824e+02 345.915 5.62617e+01 345.915 0.9567 
1 1 1 0   8   14 o 6  1.44765e+01 6.03633e-01 2.39125e+02 96.678  -3.09959e+00 2.64740e+01  0.00000e+00 0.00000e+00 2.91275e+02 96.678  5.21497e+01 96.678  0.9811 
1 1 1 0   8   15 o 11 1.11671e+01 7.47785e-01 1.66792e+02 317.201 1.41303e+01  -1.30844e+01 0.00000e+00 0.00000e+00 2.38918e+02 317.201 7.21260e+01 317.201 0.9737 
1 1 1 0   8   16 o 4  1.42363e+01 8.17986e-01 1.73849e+02 22.839  2.64015e+01  1.11193e+01  0.00000e+00 0.00000e+00 3.47500e+02 22.839  1.73651e+02 22.839  0.9824 
1 1 1 0   8   17 o 16 4.77933e+00 1.18248e+00 1.18187e+02 113.413 -2.78456e+00 6.43065e+00  0.00000e+00 0.00000e+00 4.65568e+01 113.413 7.16300e+01 293.413 0.9256 
1 1 1 0   8   18 o 13 8.33379e+00 1.36386e+00 1.23844e+02 344.801 1.18424e+01  -3.21720e+00 0.00000e+00 0.00000e+00 1.73262e+02 344.801 4.94182e+01 344.801 0.9583 
1 1 1 0   8   19 o 9  8.52598e+00 1.46665e+00 1.25643e+02 130.085 -8.67291e+00 1.03050e+01  0.00000e+00 0.00000e+00 1.79169e+02 130.085 5.35261e+01 130.085 0.9621 
1 1 1 0   8   20 o 17 6.88983e+00 1.67177e+00 3.45003e+01 191.790 -2.88605e+00 -6.02398e-01 0.00000e+00 0.00000e+00 1.71623e+02 191.790 1.37122e+02 191.790 0.8061 
1 1 1 0   9   2  o 13 3.34576e+01 5.26661e-01 4.85455e+02 180.181 -5.14460e+00 -1.62396e-02 0.00000e+00 0.00000e+00 6.41458e+02 180.181 1.56002e+02 180.181 0.8966 
1 1 1 0   9   3  f 0  2.58356e+01 4.32799e-01 4.25848e+02 265.079 -3.38703e-01 -3.93397e+00 0.00000e+00 0.00000e+00 4.10132e+02 265.079 1.57160e+01 85.079  0.8615 
1 1 1 0   9   4  o 12 2.85292e+01 4.96720e-01 1.84198e+02 359.957 2.31080e+00  -1.74456e-03 0.00000e+00 0.00000e+00 6.11511e+02 359.957 4.27313e+02 359.957 0.7428 
1 1 1 0   9   5  o 13 6.92429e+00 2.35502e-01 2.50601e+02 330.870 8.74690e-01  -4.87442e-01 0.00000e+00 0.00000e+00 1.34442e+02 150.870 3.85043e+02 150.870 0.4469 
1 1 1 0   9   6  o 9  1.74989e+01 3.50914e-01 1.14481e+02 205.561 -1.55438e+00 -7.43449e-01 0.00000e+00 0.00000e+00 3.10162e+02 205.561 1.95680e+02 205.561 0.6466 
1 1 1 0   9   7  o 16 2.96353e+01 5.06643e-01 4.59886e+02 291.857 4.59039e+00  -1.14434e+01 0.00000e+00 0.00000e+00 6.05747e+02 291.857 1.45861e+02 291.857 0.9585 
1 1 1 0   9   8  o 10 4.19165e+01 6.91927e-01 6.66680e+02 269.524 -3.00582e-01 -3.61779e+01 0.00000e+00 0.00000e+00 8.83145e+02 269.524 2.16465e+02 269.524 0.9861 
1 1 1 0   9   9  o 18 3.67732e+01 6.26223e-01 4.89004e+02 272.989 1.48373e+00  -2.84198e+01 0.00000e+00 0.00000e+00 8.64694e+02 272.989 3.75690e+02 272.989 0.9823 
1 1 1 0   9   10 o 11 2.47323e+01 7.36496e-01 3.29441e+02 61.560  8.01036e+00  1.47902e+01  0.00000e+00 0.00000e+00 5.68928e+02 61.560  2.39486e+02 61.560  0.9698 
1 1 1 0   9   11 f 0  3.09794e+01 5.88568e-01 3.34550e+02 264.705 -2.67104e+00 -2.88194e+01 0.00000e+00 0.00000e+00 8.04822e+02 264.705 4.70273e+02 264.705 0.9826 
1 1 1 0   9   12 f 0  1.20245e+01 5.63524e-01 3.33669e+02 158.731 -1.28533e+01 5.00333e+00  0.00000e+00 0.00000e+00 9.94762e+01 158.731 2.34193e+02 338.731 0.9630 
1 1 1 0   9   13 o 10 7.73096e+00 7.28877e-01 1.62513e+02 67.014  2.86000e+00  6.74247e+00  0.00000e+00 0.00000e+00 1.05918e+02 67.014  5.65952e+01 247.014 0.9290 
1 1 1 0   9   14 o 12 7.56200e+00 8.63922e-01 1.02595e+02 283.196 1.29192e+00  -5.50991e+00 0.00000e+00 0.00000e+00 1.53465e+02 283.196 5.08705e+01 283.196 0.9067 
1 1 1 0   9   15 o 3  1.22043e+01 7.16957e-01 1.79971e+02 260.811 -3.65609e+00 -2.26020e+01 0.00000e+00 0.00000e+00 2.65337e+02 260.811 8.53654e+01 260.811 0.9779 
1 1 1 0   9   16 o 11 9.38365e+00 9.82793e-01 1.38822e+02 84.922  1.25387e+00  1.41097e+01  0.00000e+00 0.00000e+00 1.98387e+02 84.922  5.95650e+01 84.922  0.9640 
1 1 1 0   9   17 o 7  5.57319e+00 1.29013e+00 1.01854e+02 204.950 -6.01340e+00 -2.79775e+00 0.00000e+00 0.00000e+00 8.93289e+01 204.950 1.25252e+01 24.950  0.9212 
1 1 1 0   9   18 o 12 4.66287e+00 1.30421e+00 1.94553e+01 77.645  2.39132e-01  1.09171e+00  0.00000e+00 0.00000e+00 6.49321e+01 77.645  4.54768e+01 77.645  0.4865 
1 1 1 0   9   19 o 18 1.07768e+01 1.29675e+00 1.76746e+02 266.388 -1.69398e+00 -2.68377e+01 0.00000e+00 0.00000e+00 2.16174e+02 266.388 3.94282e+01 266.388 0.9812 
1 1 1 0   9   20 o 14 7.21779e+00 1.70892e+00 1.01608e+02 143.114 -7.06979e+00 5.30547e+00  0.00000e+00 0.00000e+00 1.50625e+02 143.114 4.90166e+01 143.114 0.9416 
1 1 1 0   10  1  o 2  1.01848e+01 1.72602e-01 3.18508e+02 14.005  6.71801e-01  1.67566e-01  0.00000e+00 0.00000e+00 1.93400e+02 194.005 5.11908e+02 194.005 0.3270 
1 1 1 0   10  2  o 6  1.82394e+01 2.86153e-01 1.58723e+02 96.380  -9.42746e-02 8.43186e-01  0.00000e+00 0.00000e+00 1.08568e+02 96.380  5.01544e+01 276.380 0.3901 
1 1 1 0   10  3  o 14 3.38730e+01 5.56334e-01 6.44091e+02 147.124 -6.30004e+00 4.07194e+00  0.00000e+00 0.00000e+00 5.40002e+02 147.124 1.04089e+02 327.124 0.9307 
1 1 1 0   10  4  o 8  3.95241e+01 6.46750e-01 4.38947e+02 235.192 -5.07191e+00 -7.29547e+00 0.00000e+00 0.00000e+00 9.58994e+02 235.192 5.20047e+02 235.192 0.9419 
1 1 1 0   10  5  o 12 3.38691e+01 5.84430e-01 3.86366e+02 290.076 2.54980e+00  -6.97690e+00 0.00000e+00 0.00000e+00 7.96103e+02 290.076 4.09736e+02 290.076 0.9300 
1 1 1 0   10  6  o 12 1.33274e+01 3.01887e-01 3.14888e+02 276.564 4.09695e-01  -3.56064e+00 0.00000e+00 0.00000e+00 1.07920e+02 276.564 2.06968e+02 96.564  0.8454 
1 1 1 0   10  7  o 4  2.29442e+01 4.15687e-01 5.72056e+02 335.949 1.08133e+01  -4.82598e+00 0.00000e+00 0.00000e+00 2.51447e+02 335.949 3.20609e+02 155.949 0.9568 
1 1 1 0   10  8  o 12 3.74413e+01 7.94536e-01 2.44830e+02 223.325 -7.86364e+00 -7.41693e+00 0.00000e+00 0.00000e+00 1.09243e+03 223.325 8.47602e+02 223.325 0.9526 
1 1 1 0   10  9  o 11 3.08320e+01 6.10998e-01 2.50692e+02 181.748 -1.22089e+01 -3.72703e-01 0.00000e+00 0.00000e+00 8.56398e+02 181.748 6.05707e+02 181.748 0.9581 
1 1 1 0   10  10 o 1  4.70430e+01 7.88686e-01 7.31758e+02 147.601 -5.97497e+01 3.79162e+01  0.00000e+00 0.00000e+00 1.01769e+03 147.601 2.85932e+02 147.601 0.9929 
1 1 1 0   10  11 o 15 5.23173e+01 8.81109e-01 8.29410e+02 163.081 -1.13282e+02 3.44586e+01  0.00000e+00 0.00000e+00 1.12053e+03 163.081 2.91119e+02 163.081 0.9958 
1 1 1 0   10  12 o 7  2.44133e+01 5.80453e-01 3.07490e+02 59.813  1.47358e+01  2.53321e+01  0.00000e+00 0.00000e+00 5.89938e+02 59.813  2.82448e+02 59.813  0.9828 
1 1 1 0   10  13 o 5  1.08310e+01 5.91383e-01 1.28080e+02 359.362 8.24200e+00  -9.17381e-02 0.00000e+00 0.00000e+00 2.51311e+02 359.362 1.23231e+02 359.362 0.9372 
1 1 1 0   10  14 o 11 1.57819e+01 5.87461e-01 2.87960e+02 187.752 -3.47220e+01 -4.72691e+00 0.00000e+00 0.00000e+00 2.92931e+02 187.752 4.97143e+00 187.752 0.9856 
1 1 1 0   10  15 o 7  8.99933e+00 8.01981e-01 9.65481e+01 244.746 -3.76711e+00 -7.98583e+00 0.00000e+00 0.00000e+00 2.19599e+02 244.746 1.23051e+02 244.746 0.9415 
1 1 1 0   10  16 o 16 5.56827e+00 1.14631e+00 2.07825e+02 33.122  1.06466e+01  6.94640e+00  0.00000e+00 0.00000e+00 8.60237e+00 213.122 2.16427e+02 213.122 0.9598 
1 1 1 0   10  17 f 0  7.95207e+00 1.22350e+00 6.91260e+01 340.222 6.26993e+00  -2.25460e+00 0.00000e+00 0.00000e+00 2.03768e+02 340.222 1.34642e+02 340.222 0.9216 
1 1 1 0   10  18 o 8  8.91329e+00 1.40971e+00 2.60030e+02 211.520 -2.28332e+01 -1.40033e+01 0.00000e+00 0.00000e+00 6.52808e+01 211.520 1.94749e+02 31.520  0.9812 
1 1 1 0   10  19 o 14 5.17359e+00 1.38960e+00 6.91569e+01 336.869 4.35848e+00  -1.86183e+00 0.00000e+00 0.00000e+00 1.01347e+02 336.869 3.21900e+01 336.869 0.8870 
1 1 1 0   10  20 o 2  5.32323e+00 1.59715e+00 1.36750e+02 78.665  1.90891e+00  9.52300e+00  0.00000e+00 0.00000e+00 5.03415e+01 78.665  8.64084e+01 258.665 0.9470 
1 1 1 0   11  1  o 13 1.96812e+01 2.82716e-01 1.69789e+02 126.168 -3.66468e-01 5.01298e-01  0.00000e+00 0.00000e+00 4.93681e+01 126.168 1.20421e+02 306.168 0.2964 
1 1 1 0   11  2  o 11 2.09451e+01 3.21707e-01 8.00152e+02 120.019 -2.27028e+00 3.92920e+00  0.00000e+00 0.00000e+00 1.06677e+02 300.019 9.06830e+02 300.019 0.8814 
1 1 1 0   11  3  o 19 3.12109e+01 5.16610e-01 4.45425e+02 111.132 -1.65006e+00 4.26907e+00  0.00000e+00 0.00000e+00 5.89088e+02 111.132 1.43663e+02 111.132 0.8825 
1 1 1 0   11  4  o 18 4.68968e+01 7.61100e-01 7.25078e+02 90.350  -1.03618e-01 1.69618e+01  0.00000e+00 0.00000e+00 9.83128e+02 90.350  2.58049e+02 90.350  0.9701 
1 1 1 0   11  5  o 5  2.42740e+01 4.68385e-01 8.00627e+02 299.682 5.39251e+00  -9.46107e+00 0.00000e+00 0.00000e+00 6.76838e+01 299.682 7.32943e+02 119.682 0.9529 
1 1 1 0   11  6  o 19 2.04246e+01 3.95536e-01 3.83008e+02 119.033 -3.21293e+00 5.78830e+00  0.00000e+00 0.00000e+00 3.22921e+02 119.033 6.00869e+01 299.033 0.9210 
1 1 1 0   11  7  o 10 2.65070e+01 5.20881e-01 1.90395e+02 268.441 -1.23111e-01 -4.52344e+00 0.00000e+00 0.00000e+00 6.85657e+02 268.441 4.95262e+02 268.441 0.8811 
1 1 1 0   11  8  o 19 3.06237e+01 5.33081e-01 2.59308e+02 222.679 -6.91738e+00 -6.37850e+00 0.00000e+00 0.00000e+00 8.26049e+02 222.679 5.66741e+02 222.679 0.9453 
1 1 1 0   11  9  o 9  3.35745e+01 5.83223e-01 7.03014e+02 35.643  3.02762e+01  2.17098e+01  0.00000e+00 0.00000e+00 5.38172e+02 35.643  1.64841e+02 215.643 0.9865 
1 1 1 0   11  10 o 13 1.89493e+01 4.37947e-01 3.47200e+02 99.240  -2.20551e+00 1.35569e+01  0.00000e+00 0.00000e+00 3.36159e+02 99.240  1.10418e+01 279.240 0.9629 
1 1 1 0   11  11 o 2  3.85493e+01 1.13402e+00 4.33081e+02 276.886 5.31795e+00  -4.40381e+01 0.00000e+00 0.00000e+00 9.93413e+02 276.886 5.60331e+02 276.886 0.9887 
1 1 1 0   11  12 o 7  9.20477e+00 6.35906e-01 2.24576e+02 8.094   7.94254e+00  1.12954e+00  0.00000e+00 0.00000e+00 9.74727e+01 8.094   1.27103e+02 188.094 0.9354 
1 1 1 0   11  13 o 11 2.50994e+01 7.59173e-01 3.54656e+02 312.102 3.45570e+01  -3.82424e+01 0.00000e+00 0.00000e+00 5.74259e+02 312.102 2.19603e+02 312.102 0.9903 
1 1 1 0   11  14 o 11 7.62660e+00 7.76470e-01 1.34788e+02 90.915  -1.21967e-01 7.63606e+00  0.00000e+00 0.00000e+00 1.30652e+02 90.915  4.13594e+00 270.915 0.9320 
1 1 1 0   11  15 o 6  1.08491e+01 7.48622e-01 1.06997e+02 129.296 -7.58485e+00 9.26805e+00  0.00000e+00 0.00000e+00 2.80495e+02 129.296 1.73498e+02 129.296 0.9573 
1 1 1 0   11  16 o 1  1.02608e+01 9.84777e-01 1.26361e+02 185.652 -1.52411e+01 -1.50829e+00 0.00000e+00 0.00000e+00 2.43402e+02 185.652 1.17042e+02 185.652 0.9668 
1 1 1 0   11  17 o 3  6.24879e+00 1.24479e+00 1.14282e+02 326.416 7.12381e+00  -4.73015e+00 0.00000e+00 0.00000e+00 1.04344e+02 326.416 9.93787e+00 146.416 0.9396 
1 1 1 0   11  18 o 13 4.52397e+00 1.32651e+00 4.66503e+01 222.094 -1.90214e+00 -1.71833e+00 0.00000e+00 0.00000e+00 8.32138e+01 222.094 3.65635e+01 222.094 0.7717 
1 1 1 0   11  19 o 4  3.83946e+00 1.30767e+00 1.09654e+02 325.320 4.84806e+00  -3.35448e+00 0.00000e+00 0.00000e+00 2.02638e+01 325.320 8.93897e+01 145.320 0.9107 
1 1 1 0   11  20 o 13 4.29252e+00 1.38098e+00 1.17621e+02 95.989  -8.35919e-01 7.96730e+00  0.00000e+00 0.00000e+00 3.13769e+01 95.989  8.62439e+01 275.990 0.9353 
1 1 1 0   12  0  o 17 1.12723e+02 3.02789e+00 7.96333e+02 180.370 -8.66682e+00 -5.59803e-02 0.00000e+00 0.00000e+00 3.18589e+03 180.370 2.38956e+03 180.370 0.9404 
1 1 1 0   12  1  o 13 2.18049e+01 3.10229e-01 4.63719e+02 17.115  3.57292e+00  1.10019e+00  0.00000e+00 0.00000e+00 2.34691e+02 17.115  2.29028e+02 197.115 0.8527 
1 1 1 0   12  2  o 2  1.46718e+01 2.45967e-01 2.69730e+02 120.029 -6.65370e-01 1.15111e+00  0.00000e+00 0.00000e+00 3.39754e+01 120.029 2.35755e+02 300.029 0.5511 
1 1 1 0   12  3  o 5  4.24960e+01 6.90084e-01 9.34103e+02 196.751 -1.85364e+01 -5.57919e+00 0.00000e+00 0.00000e+00 6.20084e+02 196.751 3.14019e+02 16.751  0.9738 
1 1 1 0   12  4  o 19 4.41020e+01 7.18541e-01 5.07238e+02 107.857 -3.33617e+00 1.03556e+01  0.00000e+00 0.00000e+00 1.07066e+03 107.857 5.63418e+02 107.857 0.9529 
1 1 1 0   12  5  o 18 4.01051e+01 6.62748e-01 9.56492e+02 233.127 -1.87170e+01 -2.49536e+01 0.00000e+00 0.00000e+00 5.24622e+02 233.127 4.31870e+02 53.127  0.9838 
1 1 1 0   12  6  o 10 3.57002e+01 6.63380e-01 4.11422e+02 171.792 -1.12680e+01 1.62524e+00  0.00000e+00 0.00000e+00 8.67964e+02 171.792 4.56542e+02 171.792 0.9550 
1 1 1 0   12  7  o 2  1.87815e+01 3.87141e-01 4.35310e+02 231.343 -5.45769e+00 -6.82270e+00 0.00000e+00 0.00000e+00 2.27548e+02 231.343 2.07762e+02 51.343  0.9409 
1 1 1 0   12  8  o 7  3.41213e+01 6.13810e-01 3.33997e+02 3.248   1.34131e+01  7.61107e-01  0.00000e+00 0.00000e+00 8.96733e+02 3.248   5.62736e+02 3.248   0.9620 
1 1 1 0   12  9  o 4  2.45871e+01 5.24165e-01 2.88219e+02 102.147 -2.30857e+00 1.07252e+01  0.00000e+00 0.00000e+00 5.90090e+02 102.147 3.01872e+02 102.147 0.9533 
1 1 1 0   12  10 o 11 1.26365e+01 7.05368e-01 2.33224e+02 296.067 2.78921e+00  -5.70169e+00 0.00000e+00 0.00000e+00 2.00959e+02 296.067 3.22650e+01 116.067 0.9174 
1 1 1 0   12  11 o 2  3.55343e+01 6.24179e-01 5.74757e+02 139.275 -4.65199e+01 4.00483e+01  0.00000e+00 0.00000e+00 7.44328e+02 139.275 1.69572e+02 139.275 0.9918 
1 1 1 0   12  12 o 2  3.32125e+01 7.15028e-01 5.81272e+02 154.419 -6.69846e+01 3.20662e+01  0.00000e+00 0.00000e+00 6.52525e+02 154.419 7.12526e+01 154.419 0.9932 
1 1 1 0   12  13 o 15 1.07850e+01 6.19778e-01 1.69920e+02 87.691  4.19814e-01  1.04134e+01  0.00000e+00 0.00000e+00 2.13292e+02 87.691  4.33725e+01 87.691  0.9507 
1 1 1 0   12  14 o 16 1.83453e+01 6.06102e-01 3.31569e+02 185.677 -5.04126e+01 -5.01115e+00 0.00000e+00 0.00000e+00 3.46685e+02 185.677 1.51166e+01 185.677 0.9901 
1 1 1 0   12  15 o 7  1.69037e+01 6.70287e-01 2.71240e+02 191.833 -4.65397e+01 -9.75061e+00 0.00000e+00 0.00000e+00 3.52750e+02 191.833 8.15102e+01 191.833 0.9894 
1 1 1 0   12  16 o 4  4.54595e+00 1.12838e+00 5.59835e+01 313.317 1.93226e+00  -2.04926e+00 0.00000e+00 0.00000e+00 7.88010e+01 313.317 2.28175e+01 313.317 0.7955 
1 1 1 0   12  17 o 8  1.47755e+01 8.78265e-01 2.51987e+02 285.938 1.47130e+01  -5.15209e+01 0.00000e+00 0.00000e+00 2.93033e+02 285.938 4.10464e+01 285.938 0.9906 
1 1 1 0   12  18 o 6  9.06383e+00 1.35721e+00 1.46283e+02 33.799  1.39762e+01  9.35594e+00  0.00000e+00 0.00000e+00 1.80675e+02 33.799  3.43919e+01 33.799  0.9698 
1 1 1 0   12  19 o 18 4.73785e+00 1.43444e+00 3.76460e+01 13.197  2.30267e+00  5.39952e-01  0.00000e+00 0.00000e+00 9.42881e+01 13.197  5.66422e+01 13.197  0.7495 
1 1 1 0   12  20 o 14 6.91903e+00 1.61426e+00 9.24850e+01 162.549 -8.03114e+00 2.52469e+00  0.00000e+00 0.00000e+00 1.48509e+02 162.549 5.60241e+01 162.549 0.9386 
1 1 1 0   13  1  o 8  2.74581e+01 3.81773e-01 3.25036e+02 90.974  -4.96719e-02 2.92049e+00  0.00000e+00 0.00000e+00 5.04196e+02 90.974  1.79159e+02 90.974  0.8040 
1 1 1 0   13  2  o 12 3.30475e+01 4.88063e-01 5.14792e+02 143.406 -4.24426e+00 3.15133e+00  0.00000e+00 0.00000e+00 6.01888e+02 143.406 8.70964e+01 143.406 0.8996 
1 1 1 0   13  3  o 1  1.91746e+01 3.43218e-01 3.67254e+02 94.167  -2.39207e-01 3.28298e+00  0.00000e+00 0.00000e+00 2.30015e+02 94.167  1.37239e+02 274.167 0.8294 
1 1 1 0   13  4  o 19 3.78245e+01 6.22170e-01 6.71943e+02 220.421 -9.17201e+00 -7.81186e+00 0.00000e+00 0.00000e+00 6.87954e+02 220.421 1.60110e+01 220.421 0.9576 
1 1 1 0   13  5  o 8  2.75507e+01 4.73981e-01 3.67053e+02 166.508 -7.89717e+00 1.89474e+00  0.00000e+00 0.00000e+00 6.01161e+02 166.508 2.34108e+02 166.508 0.9362 
1 1 1 0   13  6  o 3  2.19981e+01 4.06605e-01 1.97972e+02 47.566  2.26646e+00  2.47910e+00  0.00000e+00 0.00000e+00 4.89943e+02 47.566  2.91971e+02 47.566  0.8334 
1 1 1 0   13  7  o 1  3.28020e+01 5.65514e-01 6.39039e+02 204.166 -2.02659e+01 -9.09362e+00 0.00000e+00 0.00000e+00 5.63298e+02 204.166 7.57405e+01 24.166  0.9772 
1 1 1 0   13  8  o 6  2.15822e+01 4.66468e-01 2.78933e+02 348.519 6.95661e+00  -1.41298e+00 0.00000e+00 0.00000e+00 4.70840e+02 348.519 1.91907e+02 348.519 0.9266 
1 1 1 0   13  9  o 11 1.39517e+01 3.93976e-01 2.47021e+02 159.834 -5.01451e+00 1.84163e+00  0.00000e+00 0.00000e+00 2.23892e+02 159.834 2.31292e+01 339.834 0.9008 
1 1 1 0   13  10 o 4  3.98617e+01 6.62516e-01 7.37063e+02 244.108 -2.76543e+01 -5.69728e+01 0.00000e+00 0.00000e+00 7.43934e+02 244.108 6.87093e+00 244.108 0.9921 
1 1 1 0   13  11 o 1  1.81303e+01 4.61828e-01 2.65833e+02 163.951 -1.40388e+01 4.03855e+00  0.00000e+00 0.00000e+00 3.89065e+02 163.951 1.23232e+02 163.951 0.9651 
1 1 1 0   13  12 o 11 4.19350e+01 7.29313e-01 5.25822e+02 59.150  4.33806e+01  7.26277e+01  0.00000e+00 0.00000e+00 1.03325e+03 59.150  5.07424e+02 59.150  0.9941 
1 1 1 0   13  13 f 0  1.10465e+01 7.49973e-01 2.08385e+02 32.272  1.08484e+01  6.85065e+00  0.00000e+00 0.00000e+00 1.88008e+02 32.272  2.03774e+01 212.272 0.9602 
1 1 1 0   13  14 o 8  1.03876e+01 9.80772e-01 8.05445e+01 180.164 -6.37142e+00 -1.82617e-02 0.00000e+00 0.00000e+00 2.75441e+02 180.164 1.94896e+02 180.164 0.9178 
1 1 1 0   13  15 o 16 1.96463e+01 6.49227e-01 3.60040e+02 215.714 -5.98352e+01 -4.30182e+01 0.00000e+00 0.00000e+00 3.67924e+02 215.714 7.88395e+00 215.714 0.9932 
1 1 1 0   13  16 o 10 9.76233e+00 1.09715e+00 1.50023e+02 337.430 1.51765e+01  -6.30799e+00 0.00000e+00 0.00000e+00 2.02592e+02 337.430 5.25691e+01 337.430 0.9691 
1 1 1 0   13  17 o 8  8.00462e+00 1.21927e+00 1.63149e+02 305.387 9.12940e+00  -1.28523e+01 0.00000e+00 0.00000e+00 1.25286e+02 305.387 3.78632e+01 125.387 0.9677 
1 1 1 0   13  18 o 11 3.94280e+00 1.23184e+00 9.70830e+01 20.045  4.93714e+00  1.80137e+00  0.00000e+00 0.00000e+00 3.47555e+01 20.045  6.23275e+01 200.045 0.8990 
1 1 1 0   13  19 o 6  4.79598e+00 1.45668e+00 3.97581e+01 27.364  2.20965e+00  1.14359e+00  0.00000e+00 0.00000e+00 9.63193e+01 27.364  5.65612e+01 27.364  0.7637 
1 1 1 0   13  20 o 9  3.94396e+00 1.24525e+00 8.19466e+01 237.430 -3.08181e+00 -4.82437e+00 0.00000e+00 0.00000e+00 5.09227e+01 237.430 3.10239e+01 57.430  0.9079 
1 1 1 0   14  0  o 16 2.04485e+01 5.92235e-01 1.51126e+02 346.641 5.02709e-01  -1.19381e-01 0.00000e+00 0.00000e+00 4.09729e+01 346.641 1.10153e+02 166.641 0.2501 
1 1 1 0   14  1  o 8  8.24197e+00 1.67373e-01 1.92837e+02 331.888 4.09653e-01  -2.18843e-01 0.00000e+00 0.00000e+00 1.22816e+02 151.888 3.15653e+02 151.888 0.2262 
1 1 1 0   14  2  o 1  2.52458e+01 3.82699e-01 5.87268e+02 24.851  3.87946e+00  1.79676e+00  0.00000e+00 0.00000e+00 2.40829e+02 24.851  3.46439e+02 204.851 0.8733 
1 1 1 0   14  3  o 8  1.97153e+01 3.15592e-01 1.09995e+02 220.598 -7.35260e-01 -6.30140e-01 0.00000e+00 0.00000e+00 2.12111e+02 220.598 1.02116e+02 220.598 0.4351 
1 1 1 0   14  4  o 19 2.30205e+01 4.05492e-01 2.16363e+02 10.111  3.18307e+00  5.67633e-01  0.00000e+00 0.00000e+00 4.97428e+02 10.111  2.81065e+02 10.111  0.8259 
1 1 1 0   14  5  o 2  2.89646e+01 4.96718e-01 5.61638e+02 45.655  8.98136e+00  9.18909e+00  0.00000e+00 0.00000e+00 4.82341e+02 45.655  7.92977e+01 225.655 0.9603 
1 1 1 0   14  6  o 15 2.20627e+01 4.07876e-01 2.46635e+02 120.716 -2.12390e+00 3.57484e+00  0.00000e+00 0.00000e+00 4.73039e+02 120.716 2.26404e+02 120.716 0.8693 
1 1 1 0   14  7  o 13 2.83491e+01 5.55881e-01 1.46120e+02 77.166  9.70143e-01  4.25851e+00  0.00000e+00 0.00000e+00 7.85654e+02 77.166  6.39533e+02 77.166  0.8763 
1 1 1 0   14  8  f 0  4.83793e+01 1.02165e+00 3.03954e+02 192.206 -1.73387e+01 -3.75071e+00 0.00000e+00 0.00000e+00 1.45790e+03 192.206 1.15395e+03 192.206 0.9714 
1 1 1 0   14  9  o 10 2.94850e+01 5.66062e-01 3.92757e+02 276.324 1.96307e+00  -1.77138e+01 0.00000e+00 0.00000e+00 6.80609e+02 276.324 2.87852e+02 276.324 0.9715 
1 1 1 0   14  10 o 15 2.99285e+01 5.40113e-01 5.32230e+02 171.790 -3.41294e+01 4.92395e+00  0.00000e+00 0.00000e+00 5.72188e+02 171.790 3.99574e+01 171.790 0.9854 
1 1 1 0   14  11 o 3  2.62471e+01 5.23583e-01 5.01261e+02 95.530  -3.82308e+00 3.94902e+01  0.00000e+00 0.00000e+00 4.68574e+02 95.530  3.26867e+01 275.530 0.9873 
1 1 1 0   14  12 o 5  1.93059e+01 8.45512e-01 1.81240e+02 315.626 1.03983e+01  -1.01737e+01 0.00000e+00 0.00000e+00 5.15497e+02 315.626 3.34257e+02 315.626 0.9650 
1 1 1 0   14  13 o 18 1.58896e+01 5.54526e-01 2.77098e+02 245.001 -1.06384e+01 -2.28151e+01 0.00000e+00 0.00000e+00 3.04781e+02 245.001 2.76837e+01 245.001 0.9799 
1 1 1 0   14  14 o 18 2.20729e+01 1.04969e+00 3.10834e+02 252.070 -1.57525e+01 -4.86830e+01 0.00000e+00 0.00000e+00 5.05256e+02 252.070 1.94422e+02 252.070 0.9902 
1 1 1 0   14  15 o 9  7.31719e+00 1.05819e+00 1.11158e+02 104.191 -1.82778e+00 7.22801e+00  0.00000e+00 0.00000e+00 1.42790e+02 104.191 3.16326e+01 104.191 0.9303 
1 1 1 0   14  16 o 2  6.60251e+00 1.12647e+00 1.10667e+02 237.333 -4.21419e+00 -6.57255e+00 0.00000e+00 0.00000e+00 1.19067e+02 237.333 8.40051e+00 237.333 0.9336 
1 1 1 0   14  17 o 7  1.21183e+01 9.29863e-01 1.81665e+02 145.941 -2.55808e+01 1.72927e+01  0.00000e+00 0.00000e+00 2.62172e+02 145.941 8.05069e+01 145.941 0.9837 
1 1 1 0   14  18 o 13 8.55235e+00 1.34733e+00 1.76378e+02 325.149 1.57866e+01  -1.09930e+01 0.00000e+00 0.00000e+00 1.33333e+02 325.149 4.30450e+01 145.149 0.9737 
1 1 1 0   14  19 o 17 5.20193e+00 1.51227e+00 5.51760e+01 358.893 3.59893e+00  -6.95386e-02 0.00000e+00 0.00000e+00 1.08349e+02 358.893 5.31727e+01 358.893 0.8461 
1 1 1 0   14  20 o 7  5.63494e+00 1.61361e+00 1.19170e+02 168.572 -8.85012e+00 1.78893e+00  0.00000e+00 0.00000e+00 7.79835e+01 168.572 4.11866e+01 348.572 0.9429 
1 1 1 0   15  1  o 18 2.19730e+01 3.16899e-01 4.09326e+02 100.007 -5.50441e-01 3.11951e+00  0.00000e+00 0.00000e+00 2.68808e+02 100.007 1.40518e+02 280.007 0.8217 
1 1 1 0   15  2  o 1  1.43108e+01 2.68203e-01 3.50453e+02 196.906 -1.78355e+00 -5.42075e-01 0.00000e+00 0.00000e+00 1.18853e+01 196.906 3.38568e+02 16.906  0.6741 
1 1 1 0   15  3  o 19 3.61616e+01 5.34078e-01 4.28574e+02 107.021 -2.22228e+00 7.25922e+00  0.00000e+00 0.00000e+00 8.36472e+02 107.021 4.07898e+02 107.021 0.9316 
1 1 1 0   15  4  o 12 4.51064e+01 7.37872e-01 6.07422e+02 103.616 -4.05339e+00 1.67340e+01  0.00000e+00 0.00000e+00 1.03610e+03 103.616 4.28675e+02 103.616 0.9705 
1 1 1 0   15  5  o 9  1.36267e+01 2.95009e-01 7.76845e+01 358.433 8.12329e-01  -2.22171e-02 0.00000e+00 0.00000e+00 1.14670e+02 358.433 3.69851e+01 358.433 0.3761 
1 1 1 0   15  6  o 12 2.46072e+01 4.42547e-01 6.18993e+02 276.952 1.58811e+00  -1.30245e+01 0.00000e+00 0.00000e+00 2.68374e+02 276.952 3.50619e+02 96.952  0.9611 
1 1 1 0   15  7  o 7  2.25657e+01 4.26270e-01 4.37419e+02 29.883  8.98011e+00  5.16019e+00  0.00000e+00 0.00000e+00 3.66969e+02 29.883  7.04507e+01 209.883 0.9504 
1 1 1 0   15  8  o 5  2.32517e+01 4.47592e-01 2.31786e+02 97.116  -8.18413e-01 6.55527e+00  0.00000e+00 0.00000e+00 5.70899e+02 97.116  3.39112e+02 97.116  0.9209 
1 1 1 0   15  9  o 15 1.81490e+01 3.95176e-01 5.24743e+02 179.811 -1.81061e+01 5.98415e-02  0.00000e+00 0.00000e+00 1.36232e+02 179.811 3.88511e+02 359.811 0.9720 
1 1 1 0   15  10 o 5  2.55697e+01 5.41910e-01 2.40410e+02 16.933  1.30419e+01  3.97063e+00  0.00000e+00 0.00000e+00 6.81294e+02 16.933  4.40884e+02 16.933  0.9626 
1 1 1 0   15  11 o 18 1.40045e+01 5.38072e-01 2.93767e+02 47.817  7.93613e+00  8.75748e+00  0.00000e+00 0.00000e+00 2.07642e+02 47.817  8.61247e+01 227.817 0.9567 
1 1 1 0   15  12 o 9  1.03255e+01 6.95554e-01 1.51754e+02 173.277 -6.57795e+00 7.75360e-01  0.00000e+00 0.00000e+00 2.03911e+02 173.277 5.21573e+01 173.277 0.9211 
1 1 1 0   15  13 o 12 1.34203e+01 5.71698e-01 2.33510e+02 10.235  1.77532e+01  3.20552e+00  0.00000e+00 0.00000e+00 2.53884e+02 10.235  2.03745e+01 10.235  0.9719 
1 1 1 0   15  14 o 12 1.34667e+01 6.27911e-01 1.95607e+02 303.422 1.13531e+01  -1.72035e+01 0.00000e+00 0.00000e+00 2.94855e+02 303.422 9.92480e+01 303.422 0.9754 
1 1 1 0   15  15 o 19 1.72347e+01 6.58675e-01 2.99356e+02 142.820 -4.47071e+01 3.39102e+01  0.00000e+00 0.00000e+00 3.37823e+02 142.820 3.84669e+01 142.820 0.9910 
1 1 1 0   15  16 o 10 6.69238e+00 1.18769e+00 1.43854e+02 314.047 6.95142e+00  -7.18655e+00 0.00000e+00 0.00000e+00 9.27447e+01 314.047 5.11090e+01 134.047 0.9486 
1 1 1 0   15  17 o 12 7.63356e+00 1.21578e+00 1.02512e+02 33.398  7.93708e+00  5.23305e+00  0.00000e+00 0.00000e+00 1.66309e+02 33.398  6.37968e+01 33.398  0.9458 
1 1 1 0   15  18 f 0  8.80403e+00 1.53193e+00 4.33148e+01 191.235 -4.36444e+00 -8.66939e-01 0.00000e+00 0.00000e+00 2.44450e+02 191.235 2.01135e+02 191.235 0.8788 
1 1 1 0   15  19 o 4  4.57498e+00 1.40949e+00 2.88364e+01 196.072 -1.70128e+00 -4.90164e-01 0.00000e+00 0.00000e+00 8.26993e+01 196.072 5.38629e+01 196.072 0.6562 
1 1 1 0   15  20 o 11 7.47562e+00 1.69325e+00 9.15316e+01 91.594  -2.40131e-01 8.62718e+00  0.00000e+00 0.00000e+00 1.69254e+02 91.594  7.77222e+01 91.594  0.9401 
1 1 1 0   16  0  o 7  4.29237e+01 1.16514e+00 5.14537e+02 123.865 -2.16439e+00 3.22525e+00  0.00000e+00 0.00000e+00 8.70233e+02 123.865 3.55696e+02 123.865 0.8589 
1 1 1 0   16  1  o 3  3.14194e+01 4.35544e-01 7.55461e+02 127.759 -4.62905e+00 5.97654e+00  0.00000e+00 0.00000e+00 3.43552e+02 127.759 4.11909e+02 307.759 0.9313 
1 1 1 0   16  2  o 4  2.20644e+01 3.71073e-01 3.73803e+02 150.768 -2.49155e+00 1.39432e+00  0.00000e+00 0.00000e+00 2.88020e+02 150.768 8.57835e+01 330.768 0.7987 
1 1 1 0   16  3  o 15 5.11825e+01 7.41913e-01 4.24780e+02 90.523  -9.27710e-02 1.01532e+01  0.00000e+00 0.00000e+00 1.39988e+03 90.523  9.75101e+02 90.523  0.9494 
1 1 1 0   16  4  f 0  4.71890e+01 7.70845e-01 8.15658e+02 348.332 3.07415e+01  -6.34813e+00 0.00000e+00 0.00000e+00 9.27461e+02 348.332 1.11803e+02 348.332 0.9839 
1 1 1 0   16  5  o 11 2.14177e+01 3.93185e-01 3.95828e+02 257.084 -1.42896e+00 -6.23109e+00 0.00000e+00 0.00000e+00 3.42150e+02 257.084 5.36784e+01 77.084  0.9181 
1 1 1 0   16  6  f 0  2.52880e+01 4.54069e-01 4.68544e+02 284.338 2.50273e+00  -9.79117e+00 0.00000e+00 0.00000e+00 4.31997e+02 284.338 3.65467e+01 104.338 0.9492 
1 1 1 0   16  7  o 6  3.97217e+01 6.71167e-01 7.19802e+02 109.677 -9.99020e+00 2.79371e+01  0.00000e+00 0.00000e+00 7.44603e+02 109.677 2.48014e+01 109.677 0.9830 
1 1 1 0   16  8  o 15 2.29414e+01 6.16491e-01 8.00190e+01 73.414  6.81967e-01  2.28967e+00  0.00000e+00 0.00000e+00 5.67025e+02 73.414  4.87006e+02 73.414  0.7524 
1 1 1 0   16  9  f 0  2.71941e+01 4.91708e-01 5.55402e+02 7.756   2.82859e+01  3.85247e+00  0.00000e+00 0.00000e+00 4.45486e+02 7.756   1.09916e+02 187.756 0.9823 
1 1 1 0   16  10 o 8  2.65037e+01 7.10472e-01 3.54934e+02 17.047  1.97390e+01  6.05268e+00  0.00000e+00 0.00000e+00 6.13178e+02 17.047  2.58244e+02 17.047  0.9755 
1 1 1 0   16  11 o 19 3.75701e+01 6.55132e-01 5.08462e+02 78.534  1.08077e+01  5.32813e+01  0.00000e+00 0.00000e+00 8.84487e+02 78.534  3.76026e+02 78.534  0.9908 
1 1 1 0   16  12 o 3  1.68589e+01 7.89104e-01 2.90960e+02 163.516 -1.96167e+01 5.80458e+00  0.00000e+00 0.00000e+00 3.23879e+02 163.516 3.29190e+01 163.516 0.9752 
1 1 1 0   16  13 o 12 2.25675e+01 7.31852e-01 3.80223e+02 257.485 -1.04568e+01 -4.71085e+01 0.00000e+00 0.00000e+00 4.54270e+02 257.485 7.40471e+01 257.485 0.9896 
1 1 1 0   16  14 o 3  1.11287e+01 7.39145e-01 1.67225e+02 254.959 -3.69202e+00 -1.37391e+01 0.00000e+00 0.00000e+00 2.33399e+02 254.959 6.61740e+01 254.959 0.9642 
1 1 1 0   16  15 f 0  1.03704e+01 8.28728e-01 2.98824e+02 188.684 -3.16655e+01 -4.83643e+00 0.00000e+00 0.00000e+00 8.19366e+01 188.684 2.16888e+02 8.684   0.9843 
1 1 1 0   16  16 o 1  1.26334e+01 8.24437e-01 2.18678e+02 31.453  3.04145e+01  1.86041e+01  0.00000e+00 0.00000e+00 2.45491e+02 31.453  2.68123e+01 31.453  0.9859 
1 1 1 0   16  17 o 14 7.02833e+00 1.31443e+00 1.75226e+02 154.733 -1.28004e+01 6.04173e+00  0.00000e+00 0.00000e+00 7.70210e+01 154.733 9.82047e+01 334.733 0.9640 
1 1 1 0   16  18 o 12 7.01368e+00 1.48465e+00 1.17182e+02 359.055 9.89113e+00  -1.63204e-01 0.00000e+00 0.00000e+00 1.30102e+02 359.055 1.29199e+01 359.055 0.9480 
1 1 1 0   16  19 o 14 4.91440e+00 1.51672e+00 9.50963e+01 92.599  -2.63642e-01 5.80805e+00  0.00000e+00 0.00000e+00 7.09199e+01 92.599  2.41764e+01 272.599 0.9094 
1 1 1 0   16  20 o 2  6.27476e+00 1.79679e+00 2.43972e+01 179.785 -1.78406e+00 6.68205e-03  0.00000e+00 0.00000e+00 1.29015e+02 179.785 1.04617e+02 179.785 0.6589 
1 1 1 0   17  1  o 18 2.65113e+01 3.75590e-01 3.70943e+02 277.655 3.79968e-01  -2.82705e+00 0.00000e+00 0.00000e+00 4.24082e+02 277.655 5.31386e+01 277.655 0.7985 
1 1 1 0   17  2  f 0  3.36524e+01 5.53952e-01 1.42173e+02 217.574 -1.22509e+00 -9.42549e-01 0.00000e+00 0.00000e+00 6.25239e+02 217.574 4.83066e+02 217.574 0.6072 
1 1 1 0   17  3  o 1  5.49282e+01 7.94992e-01 1.04061e+03 44.069  1.83292e+01  1.77431e+01  0.00000e+00 0.00000e+00 9.81023e+02 44.069  5.95822e+01 224.069 0.9802 
1 1 1 0   17  4  o 11 3.45571e+01 5.34481e-01 4.70625e+02 225.391 -9.09858e+00 -9.22352e+00 0.00000e+00 0.00000e+00 7.75545e+02 225.391 3.04920e+02 225.391 0.9606 
1 1 1 0   17  5  o 3  1.70492e+01 3.39498e-01 4.41543e+02 311.075 3.66877e+00  -4.20925e+00 0.00000e+00 0.00000e+00 1.37759e+02 311.075 3.03784e+02 131.075 0.9054 
1 1 1 0   17  6  o 2  8.54709e+00 2.83030e-01 5.81554e+01 184.754 -4.19187e-01 -3.48612e-02 0.00000e+00 0.00000e+00 7.83695e+00 184.754 5.03185e+01 4.754   0.2058 
1 1 1 0   17  7  o 17 9.70920e+00 3.13767e-01 1.20339e+02 35.472  9.88315e-01  7.04225e-01  0.00000e+00 0.00000e+00 6.78956e+01 35.472  5.24436e+01 215.472 0.5170 
1 1 1 0   17  8  o 12 2.99296e+01 5.36782e-01 5.42960e+02 6.478   2.09902e+01  2.38329e+00  0.00000e+00 0.00000e+00 5.52075e+02 6.478   9.11488e+00 6.478   0.9760 
1 1 1 0   17  9  o 19 3.68026e+01 7.15620e-01 4.80732e+02 169.201 -3.24417e+01 6.18828e+00  0.00000e+00 0.00000e+00 8.77071e+02 169.201 3.96339e+02 169.201 0.9847 
1 1 1 0   17  10 o 1  3.04040e+01 6.08805e-01 3.84523e+02 134.065 -1.79124e+01 1.85064e+01  0.00000e+00 0.00000e+00 7.31602e+02 134.065 3.47079e+02 134.065 0.9804 
1 1 1 0   17  11 o 3  4.05226e+01 6.98951e-01 5.12645e+02 218.264 -4.61829e+01 -3.64261e+01 0.00000e+00 0.00000e+00 9.90770e+02 218.264 4.78124e+02 218.264 0.9915 
1 1 1 0   17  12 o 9  3.61601e+01 7.25775e-01 6.61778e+02 324.393 8.16120e+01  -5.84433e+01 0.00000e+00 0.00000e+00 6.83635e+02 324.393 2.18564e+01 324.393 0.9950 
1 1 1 0   17  13 o 17 1.02181e+01 6.23395e-01 1.94224e+02 235.933 -6.34186e+00 -9.37857e+00 0.00000e+00 0.00000e+00 1.70306e+02 235.933 2.39177e+01 55.933  0.9548 
1 1 1 0   17  14 o 14 1.35114e+01 6.49694e-01 2.81246e+02 151.979 -2.60689e+01 1.38735e+01  0.00000e+00 0.00000e+00 2.14579e+02 151.979 6.66672e+01 331.979 0.9829 
1 1 1 0   17  15 o 3  1.52375e+01 6.74500e-01 2.32347e+02 79.994  6.65004e+00  3.76911e+01  0.00000e+00 0.00000e+00 3.28559e+02 79.994  9.62123e+01 79.994  0.9868 
1 1 1 0   17  16 o 9  7.97094e+00 1.02319e+00 9.42916e+01 209.253 -7.76990e+00 -4.35187e+00 0.00000e+00 0.00000e+00 1.85544e+02 209.253 9.12519e+01 209.253 0.9421 
1 1 1 0   17  17 o 18 1.11213e+01 1.17965e+00 1.48602e+02 271.653 5.89975e-01  -2.04445e+01 0.00000e+00 0.00000e+00 2.55175e+02 271.653 1.06574e+02 271.653 0.9752 
1 1 1 0   17  18 o 15 1.08649e+01 1.20000e+00 1.26742e+02 1.807   1.99743e+01  6.30099e-01  0.00000e+00 0.00000e+00 2.67065e+02 1.807   1.40323e+02 1.807   0.9747 
1 1 1 0   17  19 o 15 4.15710e+00 1.32839e+00 8.37430e+01 267.636 -2.03778e-01 -4.93574e+00 0.00000e+00 0.00000e+00 5.39977e+01 267.636 2.97453e+01 87.636  0.8920 
1 1 1 0   17  20 o 11 3.56006e+00 1.23240e+00 9.00887e+01 12.686  5.78157e+00  1.30145e+00  0.00000e+00 0.00000e+00 3.02687e+01 12.686  5.98200e+01 192.686 0.9112 
1 1 1 0   18  0  o 19 3.08082e+00 2.59340e-01 2.07767e+02 45.696  6.43158e-02  6.58988e-02  0.00000e+00 0.00000e+00 2.02446e+02 225.696 4.10213e+02 225.696 0.0460 
1 1 1 0   18  1  o 12 3.63019e+01 4.99758e-01 6.58567e+02 21.336  8.19200e+00  3.19986e+00  0.00000e+00 0.00000e+00 6.24756e+02 21.336  3.38112e+01 201.336 0.9413 
1 1 1 0   18  2  o 4  4.42490e+01 6.98700e-01 9.49082e+02 66.025  8.00189e+00  1.79937e+01  0.00000e+00 0.00000e+00 6.69815e+02 66.025  2.79267e+02 246.025 0.9743 
1 1 1 0   18  3  o 14 3.94200e+01 5.81718e-01 5.98945e+02 351.508 1.19406e+01  -1.78289e+00 0.00000e+00 0.00000e+00 8.18453e+02 351.508 2.19508e+02 351.508 0.9576 
1 1 1 0   18  4  o 13 1.18003e+01 2.74863e-01 2.39878e+02 16.624  2.10734e+00  6.29202e-01  0.00000e+00 0.00000e+00 8.25689e+01 16.624  1.57309e+02 196.624 0.7279 
1 1 1 0   18  5  o 13 1.29503e+01 3.31428e-01 2.81733e+02 178.830 -2.78590e+00 5.68759e-02  0.00000e+00 0.00000e+00 1.03602e+02 178.830 1.78131e+02 358.830 0.7929 
1 1 1 0   18  6  o 5  1.14380e+01 3.00092e-01 2.42687e+02 317.571 1.82394e+00  -1.66716e+00 0.00000e+00 0.00000e+00 8.42095e+01 317.571 1.58478e+02 137.571 0.7618 
1 1 1 0   18  7  o 13 3.72720e+01 6.37449e-01 6.66826e+02 115.251 -1.27061e+01 2.69395e+01  0.00000e+00 0.00000e+00 7.07233e+02 115.251 4.04070e+01 115.251 0.9831 
1 1 1 0   18  8  o 2  3.28563e+01 5.81668e-01 6.25015e+02 257.920 -5.56117e+00 -2.59841e+01 0.00000e+00 0.00000e+00 5.83154e+02 257.920 4.18614e+01 77.920  0.9810 
1 1 1 0   18  9  o 16 5.24439e+01 8.77964e-01 8.15413e+02 2.833   7.38269e+01  3.65389e+00  0.00000e+00 0.00000e+00 1.13601e+03 2.833   3.20602e+02 2.833   0.9932 
1 1 1 0   18  10 o 1  3.98971e+01 9.53763e-01 3.72712e+02 254.406 -9.49550e+00 -3.40237e+01 0.00000e+00 0.00000e+00 1.09983e+03 254.406 7.27117e+02 254.406 0.9857 
1 1 1 0   18  11 o 8  4.47209e+01 7.54880e-01 7.14180e+02 8.759   9.99784e+01  1.54041e+01  0.00000e+00 0.00000e+00 9.50908e+02 8.759   2.36727e+02 8.759   0.9950 
1 1 1 0   18  12 o 8  1.56908e+01 5.13421e-01 2.18900e+02 103.483 -3.42376e+00 1.42793e+01  0.00000e+00 0.00000e+00 3.47468e+02 103.483 1.28568e+02 103.483 0.9653 
1 1 1 0   18  13 o 8  2.12623e+01 5.83747e-01 3.56017e+02 256.687 -1.06640e+01 -4.50657e+01 0.00000e+00 0.00000e+00 4.29790e+02 256.687 7.37736e+01 256.687 0.9891 
1 1 1 0   18  14 o 2  1.75939e+01 5.96745e-01 2.97114e+02 197.322 -4.27656e+01 -1.33378e+01 0.00000e+00 0.00000e+00 3.52341e+02 197.322 5.52267e+01 197.322 0.9888 
1 1 1 0   18  15 o 6  1.05397e+01 1.54440e+00 1.28514e+02 344.128 9.88435e+00  -2.81036e+00 0.00000e+00 0.00000e+00 2.44965e+02 344.128 1.16451e+02 344.128 0.9500 
1 1 1 0   18  16 o 1  8.41443e+00 1.06693e+00 1.01635e+02 322.482 7.87177e+00  -6.04423e+00 0.00000e+00 0.00000e+00 1.95680e+02 322.482 9.40453e+01 322.482 0.9482 
1 1 1 0   18  17 o 14 8.52913e+00 1.19474e+00 1.14236e+02 189.979 -1.17918e+01 -2.07480e+00 0.00000e+00 0.00000e+00 1.89713e+02 189.979 7.54770e+01 189.979 0.9573 
1 1 1 0   18  18 o 12 1.15703e+01 1.19655e+00 1.50931e+02 307.348 1.46809e+01  -1.92378e+01 0.00000e+00 0.00000e+00 2.70347e+02 307.348 1.19415e+02 307.348 0.9791 
1 1 1 0   18  19 o 6  3.96591e+00 1.30087e+00 8.03419e+01 103.541 -1.09772e+00 4.55811e+00  0.00000e+00 0.00000e+00 5.01215e+01 103.541 3.02204e+01 283.540 0.8856 
1 1 1 0   18  20 o 9  6.50601e+00 1.75546e+00 4.53813e+01 164.353 -3.41964e+00 9.57816e-01  0.00000e+00 0.00000e+00 1.58277e+02 164.353 1.12896e+02 164.353 0.8437 
1 1 1 0   19  1  o 9  2.35432e+01 3.66248e-01 5.51840e+02 99.937  -7.60058e-01 4.33826e+00  0.00000e+00 0.00000e+00 2.23948e+02 99.937  3.27892e+02 279.937 0.8775 
1 1 1 0   19  2  o 10 2.53923e+01 5.52208e-01 2.90899e+02 243.832 -1.43711e+00 -2.92476e+00 0.00000e+00 0.00000e+00 4.98052e+02 243.832 2.07154e+02 243.832 0.8274 
1 1 1 0   19  3  o 16 1.34414e+01 2.40382e-01 2.72621e+02 273.470 1.08934e-01  -1.79644e+00 0.00000e+00 0.00000e+00 6.14539e+01 273.470 2.11167e+02 93.470  0.6620 
1 1 1 0   19  4  o 11 2.92643e+01 4.62722e-01 4.31663e+02 4.346   7.28463e+00  5.53660e-01  0.00000e+00 0.00000e+00 5.88602e+02 4.346   1.56939e+02 4.346   0.9288 
1 1 1 0   19  5  o 17 1.17033e+01 2.87478e-01 3.30111e+02 99.570  -4.82445e-01 2.86159e+00  0.00000e+00 0.00000e+00 2.23168e+01 99.570  3.07794e+02 279.570 0.8025 
1 1 1 0   19  6  o 13 2.17331e+01 4.59799e-01 1.12104e+02 139.891 -1.63890e+00 1.38052e+00  0.00000e+00 0.00000e+00 4.74815e+02 139.891 3.62711e+02 139.891 0.7199 
1 1 1 0   19  7  o 14 1.79397e+01 3.80179e-01 3.48562e+02 335.582 6.82139e+00  -3.09689e+00 0.00000e+00 0.00000e+00 2.77496e+02 335.582 7.10662e+01 155.582 0.9306 
1 1 1 0   19  8  o 14 3.50790e+01 7.80115e-01 2.78478e+02 167.021 -1.20717e+01 2.78228e+00  0.00000e+00 0.00000e+00 9.82100e+02 167.021 7.03622e+02 167.021 0.9587 
1 1 1 0   19  9  o 10 3.20650e+01 5.81125e-01 6.66434e+02 320.349 2.87550e+01  -2.38312e+01 0.00000e+00 0.00000e+00 5.18599e+02 320.349 1.47835e+02 140.349 0.9865 
1 1 1 0   19  10 o 5  1.14192e+01 4.56788e-01 2.64166e+02 231.344 -4.60954e+00 -5.76269e+00 0.00000e+00 0.00000e+00 1.33251e+02 231.344 1.30915e+02 51.344  0.9295 
1 1 1 0   19  11 o 3  4.13381e+01 7.91289e-01 6.94083e+02 84.656  8.41819e+00  8.99946e+01  0.00000e+00 0.00000e+00 8.44059e+02 84.656  1.49976e+02 84.656  0.9945 
1 1 1 0   19  12 o 12 1.57018e+01 6.20450e-01 2.37475e+02 172.093 -1.61277e+01 2.24001e+00  0.00000e+00 0.00000e+00 3.31295e+02 172.093 9.38203e+01 172.093 0.9688 
1 1 1 0   19  13 o 5  1.81104e+01 7.03966e-01 2.88468e+02 223.138 -2.28766e+01 -2.14364e+01 0.00000e+00 0.00000e+00 3.77284e+02 223.138 8.88166e+01 223.138 0.9839 
1 1 1 0   19  14 o 5  2.05416e+01 1.22679e+00 2.45086e+02 73.940  1.00692e+01  3.49782e+01  0.00000e+00 0.00000e+00 5.11139e+02 73.940  2.66053e+02 73.940  0.9862 
1 1 1 0   19  15 f 0  1.54552e+01 1.35523e+00 1.53022e+02 345.207 1.87910e+01  -4.96232e+00 0.00000e+00 0.00000e+00 4.08391e+02 345.207 2.55369e+02 345.207 0.9739 
1 1 1 0   19  16 o 7  6.75393e+00 1.19432e+00 1.42354e+02 50.168  6.76230e+00  8.10704e+00  0.00000e+00 0.00000e+00 9.70804e+01 50.168  4.52733e+01 230.168 0.9514 
1 1 1 0   19  17 o 3  5.82783e+00 1.26673e+00 7.61708e+01 53.635  3.10563e+00  4.21772e+00  0.00000e+00 0.00000e+00 1.18776e+02 53.635  4.26048e+01 53.635  0.8986 
1 1 1 0   19  18 o 14 1.11924e+01 1.18543e+00 1.92929e+02 258.389 -6.05962e+00 -2.94921e+01 0.00000e+00 0.00000e+00 2.16290e+02 258.389 2.33610e+01 258.389 0.9833 
1 1 1 0   19  19 o 10 7.12184e+00 1.70917e+00 1.44936e+02 267.501 -4.95435e-01 -1.13535e+01 0.00000e+00 0.00000e+00 1.07670e+02 267.501 3.72669e+01 87.501  0.9549 
1 1 1 0   19  20 o 14 7.57317e+00 1.85677e+00 1.88660e+02 73.116  4.42919e+00  1.45929e+01  0.00000e+00 0.00000e+00 8.29222e+01 73.116  1.05737e+02 253.116 0.9666 
1 1 1 0   20  0  o 3  5.81527e+01 1.11045e+00 9.90675e+02 131.611 -6.36798e+00 7.16974e+00  0.00000e+00 0.00000e+00 1.07592e+03 131.611 8.52463e+01 131.611 0.9463 
1 1 1 0   20  1  o 12 3.85343e+01 5.30437e-01 6.19601e+02 333.404 1.03870e+01  -5.20047e+00 0.00000e+00 0.00000e+00 7.63670e+02 333.404 1.44069e+02 333.404 0.9559 
1 1 1 0   20  2  o 11 2.47158e+01 3.85793e-01 6.04988e+02 355.786 7.13745e+00  -5.25820e-01 0.00000e+00 0.00000e+00 2.55531e+02 355.786 3.49457e+02 175.787 0.9272 
1 1 1 0   20  3  o 5  3.29102e+01 4.63647e-01 5.14451e+02 80.703  1.80716e+00  1.10389e+01  0.00000e+00 0.00000e+00 6.64493e+02 80.703  1.50041e+02 80.703  0.9542 
1 1 1 0   20  4  o 10 3.44220e+01 5.18945e-01 5.29180e+02 325.139 8.40698e+00  -5.85619e+00 0.00000e+00 0.00000e+00 6.98068e+02 325.139 1.68888e+02 325.139 0.9499 
1 1 1 0   20  5  o 4  2.25871e+01 3.85812e-01 4.89453e+02 42.626  7.07995e+00  6.51631e+00  0.00000e+00 0.00000e+00 3.12782e+02 42.626  1.76671e+02 222.626 0.9465 
1 1 1 0   20  6  o 6  9.53794e+00 2.97123e-01 3.27662e+02 336.026 2.74240e+00  -1.21952e+00 0.00000e+00 0.00000e+00 3.78272e+01 156.026 3.65489e+02 156.026 0.8101 
1 1 1 0   20  7  o 4  4.08046e+01 6.92323e-01 5.71362e+02 136.647 -1.87018e+01 1.76564e+01  0.00000e+00 0.00000e+00 9.28636e+02 136.647 3.57274e+02 136.647 0.9804 
1 1 1 0   20  8  o 16 3.22818e+01 5.74965e-01 5.88181e+02 89.048  4.01291e-01  2.41384e+01  0.00000e+00 0.00000e+00 5.96399e+02 89.048  8.21812e+00 89.048  0.9791 
1 1 1 0   20  9  o 1  2.33123e+01 4.72073e-01 3.49825e+02 31.094  1.19639e+01  7.21537e+00  0.00000e+00 0.00000e+00 4.91601e+02 31.094  1.41776e+02 31.094  0.9635 
1 1 1 0   20  10 o 16 2.47350e+01 5.51901e-01 2.79762e+02 191.223 -1.62971e+01 -3.23372e+00 0.00000e+00 0.00000e+00 6.17964e+02 191.223 3.38202e+02 191.223 0.9694 
1 1 1 0   20  11 o 14 1.67245e+01 4.93976e-01 3.35159e+02 358.590 1.74594e+01  -4.29674e-01 0.00000e+00 0.00000e+00 2.72389e+02 358.590 6.27700e+01 178.590 0.9709 
1 1 1 0   20  12 o 10 2.05787e+01 6.06758e-01 2.14595e+02 301.355 1.00300e+01  -1.64607e+01 0.00000e+00 0.00000e+00 5.34574e+02 301.355 3.19979e+02 301.355 0.9737 
1 1 1 0   20  13 o 10 1.93288e+01 5.84027e-01 2.76042e+02 104.836 -8.51984e+00 3.21651e+01  0.00000e+00 0.00000e+00 4.35140e+02 104.836 1.59098e+02 104.836 0.9849 
1 1 1 0   20  14 o 2  1.46166e+01 7.34098e-01 1.57404e+02 15.393  1.86884e+01  5.14529e+00  0.00000e+00 0.00000e+00 3.73951e+02 15.393  2.16547e+02 15.393  0.9739 
1 1 1 0   20  15 o 5  1.99843e+01 6.82855e-01 3.81409e+02 330.655 7.30344e+01  -4.10603e+01 0.00000e+00 0.00000e+00 3.59458e+02 330.655 2.19502e+01 150.655 0.9940 
1 1 1 0   20  16 o 8  6.87769e+00 1.10899e+00 7.02346e+01 300.712 2.82068e+00  -4.74828e+00 0.00000e+00 0.00000e+00 1.61492e+02 300.712 9.12579e+01 300.712 0.9042 
1 1 1 0   20  17 o 14 8.09207e+00 1.23860e+00 1.39343e+02 90.229  -5.58639e-02 1.39722e+01  0.00000e+00 0.00000e+00 1.50880e+02 90.229  1.15366e+01 90.229  0.9635 
1 1 1 0   20  18 o 16 7.32945e+00 1.40484e+00 1.17967e+02 187.618 -1.05817e+01 -1.41526e+00 0.00000e+00 0.00000e+00 1.41468e+02 187.618 2.35015e+01 187.618 0.9519 
1 1 1 0   20  19 o 5  9.14422e+00 1.57385e+00 1.55986e+02 132.991 -1.21489e+01 1.30322e+01  0.00000e+00 0.00000e+00 1.73967e+02 132.991 1.79805e+01 132.991 0.9715 
1 1 1 0   20  20 o 11 4.34894e+00 1.43359e+00 9.76320e+01 69.031  2.23779e+00  5.83899e+00  0.00000e+00 0.00000e+00 5.01677e+01 69.031  4.74643e+01 249.031 0.9161 
1 1 1 0   21  1  o 10 3.77203e+01 5.21408e-01 3.36646e+02 324.250 4.66270e+00  -3.35668e+00 0.00000e+00 0.00000e+00 9.49729e+02 324.250 6.13084e+02 324.250 0.9082 
1 1 1 0   21  2  o 10 3.09469e+01 4.37988e-01 4.93343e+02 354.662 6.86914e+00  -6.41877e-01 0.00000e+00 0.00000e+00 5.80740e+02 354.662 8.73965e+01 354.662 0.9244 
1 1 1 0   21  3  o 4  2.43752e+01 3.60744e-01 5.06819e+02 60.792  3.82870e+00  6.84851e+00  0.00000e+00 0.00000e+00 3.47763e+02 60.792  1.59056e+02 240.792 0.9339 
1 1 1 0   21  4  o 19 8.66066e+00 2.29843e-01 2.46558e+02 332.327 1.53549e+00  -8.05215e-01 0.00000e+00 0.00000e+00 3.56454e+01 152.327 2.82203e+02 152.327 0.6488 
1 1 1 0   21  5  o 8  1.76271e+01 3.27614e-01 3.70569e+02 36.443  4.50031e+00  3.32307e+00  0.00000e+00 0.00000e+00 2.28372e+02 36.443  1.42198e+02 216.442 0.9056 
1 1 1 0   21  6  o 13 1.99873e+01 3.95410e-01 3.28215e+02 253.421 -1.77739e+00 -5.97013e+00 0.00000e+00 0.00000e+00 3.58358e+02 253.421 3.01430e+01 253.421 0.9158 
1 1 1 0   21  7  o 7  1.75044e+01 3.79934e-01 4.45496e+02 143.197 -6.89417e+00 5.15807e+00  0.00000e+00 0.00000e+00 1.71446e+02 143.197 2.74050e+02 323.197 0.9400 
1 1 1 0   21  8  o 5  3.94341e+01 6.79259e-01 8.42171e+02 83.211  5.16477e+00  4.33858e+01  0.00000e+00 0.00000e+00 6.18710e+02 83.211  2.23461e+02 263.211 0.9885 
1 1 1 0   21  9  o 10 4.09816e+01 1.05779e+00 4.82923e+02 17.890  3.12565e+01  1.00894e+01  0.00000e+00 0.00000e+00 1.02862e+03 17.890  5.45693e+02 17.890  0.9847 
1 1 1 0   21  10 o 17 2.08821e+01 6.07038e-01 2.79319e+02 272.846 6.92057e-01  -1.39215e+01 0.00000e+00 0.00000e+00 4.73842e+02 272.846 1.94524e+02 272.846 0.9634 
1 1 1 0   21  11 o 19 3.01309e+01 5.84043e-01 3.58468e+02 37.745  2.64050e+01  2.04409e+01  0.00000e+00 0.00000e+00 7.51791e+02 37.745  3.93323e+02 37.745  0.9849 
1 1 1 0   21  12 o 1  1.47021e+01 5.46496e-01 2.94659e+02 1.732   1.99114e+01  6.02009e-01  0.00000e+00 0.00000e+00 2.41016e+02 1.732   5.36433e+01 181.732 0.9746 
1 1 1 0   21  13 o 18 2.22313e+01 7.21286e-01 3.18766e+02 267.119 -2.17172e+00 -4.31578e+01 0.00000e+00 0.00000e+00 5.02073e+02 267.119 1.83308e+02 267.119 0.9884 
1 1 1 0   21  14 o 16 1.69143e+01 7.77948e-01 2.27482e+02 348.508 3.13912e+01  -6.38174e+00 0.00000e+00 0.00000e+00 3.93940e+02 348.508 1.66458e+02 348.508 0.9843 
1 1 1 0   21  15 o 6  3.66158e+00 1.01273e+00 1.16510e+02 282.030 8.75922e-01  -4.11014e+00 0.00000e+00 0.00000e+00 2.41147e+00 282.030 1.14099e+02 102.030 0.8709 
1 1 1 0   21  16 o 1  6.00688e+00 1.18180e+00 1.09102e+02 123.583 -4.12611e+00 6.21431e+00  0.00000e+00 0.00000e+00 9.91115e+01 123.583 9.99059e+00 303.583 0.9303 
1 1 1 0   21  17 o 18 5.21987e+00 1.25558e+00 9.28702e+01 104.804 -1.51893e+00 5.74736e+00  0.00000e+00 0.00000e+00 8.42211e+01 104.804 8.64905e+00 284.804 0.9115 
1 1 1 0   21  18 o 18 7.62056e+00 1.26041e+00 1.87806e+02 270.566 1.91490e-01  -1.93685e+01 0.00000e+00 0.00000e+00 8.81201e+01 270.566 9.96856e+01 90.566  0.9738 
1 1 1 0   21  19 o 14 6.42149e+00 1.58825e+00 6.41223e+01 102.217 -1.07633e+00 4.97123e+00  0.00000e+00 0.00000e+00 1.49407e+02 102.217 8.52849e+01 102.217 0.8953 
1 1 1 0   21  20 o 19 4.01848e+00 1.34641e+00 1.29184e+01 221.068 -6.51329e-01 -5.67548e-01 0.00000e+00 0.00000e+00 4.61260e+01 221.068 3.32076e+01 221.068 0.3961 
1 1 1 0   22  0  o 16 1.15948e+01 3.11693e-01 2.21376e+02 355.785 5.69467e-01  -4.19714e-02 0.00000e+00 0.00000e+00 1.01881e+02 175.785 3.23257e+02 175.785 0.2745 
1 1 1 0   22  1  o 3  1.68842e+01 2.73280e-01 2.09567e+02 49.489  1.11927e+00  1.30999e+00  0.00000e+00 0.00000e+00 2.00372e+02 49.489  9.19462e+00 229.489 0.6466 
1 1 1 0   22  2  o 10 1.88091e+01 2.96083e-01 3.09685e+02 51.101  1.87173e+00  2.31975e+00  0.00000e+00 0.00000e+00 2.61288e+02 51.101  4.83968e+01 231.101 0.8085 
1 1 1 0   22  3  o 10 3.11337e+01 4.43998e-01 4.36649e+02 146.399 -9.24234e+00 6.14076e+00  0.00000e+00 0.00000e+00 6.78085e+02 146.399 2.41435e+02 146.399 0.9538 
1 1 1 0   22  4  o 9  9.17897e+00 2.37195e-01 2.70384e+02 62.347  9.10996e-01  1.73867e+00  0.00000e+00 0.00000e+00 3.21413e+01 242.347 3.02526e+02 242.347 0.6916 
1 1 1 0   22  5  o 19 2.62759e+01 4.33161e-01 4.32896e+02 256.379 -2.09061e+00 -8.62760e+00 0.00000e+00 0.00000e+00 4.95665e+02 256.379 6.27681e+01 256.379 0.9419 
1 1 1 0   22  6  f 0  3.86623e+01 6.56964e-01 8.59639e+02 228.295 -1.99843e+01 -2.24258e+01 0.00000e+00 0.00000e+00 5.66138e+02 228.295 2.93501e+02 48.295  0.9832 
1 1 1 0   22  7  o 1  2.34216e+01 4.49919e-01 5.14696e+02 12.630  1.54853e+01  3.46985e+00  0.00000e+00 0.00000e+00 3.35303e+02 12.630  1.79393e+02 192.630 0.9680 
1 1 1 0   22  8  o 13 3.45689e+01 6.09756e-01 6.83502e+02 10.046  3.05460e+01  5.41150e+00  0.00000e+00 0.00000e+00 5.90922e+02 10.046  9.25799e+01 190.046 0.9837 
1 1 1 0   22  9  o 3  3.41589e+01 6.15007e-01 6.60173e+02 343.549 3.70019e+01  -1.09261e+01 0.00000e+00 0.00000e+00 6.02588e+02 343.549 5.75849e+01 163.549 0.9870 
1 1 1 0   22  10 o 11 2.52211e+01 5.21224e-01 6.20748e+02 110.903 -1.49501e+01 3.91441e+01  0.00000e+00 0.00000e+00 3.12045e+02 110.903 3.08702e+02 290.903 0.9880 
1 1 1 0   22  11 f 0  2.49584e+01 5.54821e-01 2.74869e+02 263.246 -2.57993e+00 -2.17857e+01 0.00000e+00 0.00000e+00 6.37291e+02 263.246 3.62422e+02 263.246 0.9769 
1 1 1 0   22  12 o 8  8.07888e+00 8.91926e-01 1.56526e+02 102.273 -1.18272e+00 5.43668e+00  0.00000e+00 0.00000e+00 1.16802e+02 102.273 3.97248e+01 282.273 0.9050 
1 1 1 0   22  13 o 6  2.23994e+01 5.91012e-01 3.91033e+02 305.295 3.45821e+01  -4.88516e+01 0.00000e+00 0.00000e+00 4.38684e+02 305.295 4.76511e+01 305.295 0.9916 
1 1 1 0   22  14 o 7  1.84668e+01 6.02115e-01 3.73996e+02 229.176 -4.11376e+01 -4.76183e+01 0.00000e+00 0.00000e+00 3.09767e+02 229.176 6.42296e+01 49.176  0.9920 
1 1 1 0   22  15 o 19 1.76126e+01 7.26401e-01 2.40595e+02 127.712 -2.63991e+01 3.41411e+01  0.00000e+00 0.00000e+00 4.08549e+02 127.712 1.67954e+02 127.712 0.9883 
1 1 1 0   22  16 o 14 1.71499e+01 7.54534e-01 2.81792e+02 242.778 -3.04901e+01 -5.92708e+01 0.00000e+00 0.00000e+00 3.52333e+02 242.778 7.05408e+01 242.778 0.9925 
1 1 1 0   22  17 o 18 5.14848e+00 1.31355e+00 5.58738e+01 156.427 -2.96627e+00 1.29424e+00  0.00000e+00 0.00000e+00 1.02412e+02 156.427 4.65382e+01 156.427 0.8260 
1 1 1 0   22  18 o 11 7.16740e+00 1.47350e+00 1.13878e+02 171.016 -9.05366e+00 1.43144e+00  0.00000e+00 0.00000e+00 1.37612e+02 171.016 2.37335e+01 171.016 0.9438 
1 1 1 0   22  19 o 10 7.10111e+00 1.71523e+00 1.09466e+02 35.174  6.96313e+00  4.90720e+00  0.00000e+00 0.00000e+00 1.38246e+02 35.174  2.87799e+01 35.174  0.9393 
1 1 1 0   22  20 o 6  3.63370e+00 1.24525e+00 3.45275e+01 181.191 -2.26974e+00 -4.72041e-02 0.00000e+00 0.00000e+00 6.48772e+01 181.191 3.03497e+01 181.191 0.7375 
1 1 1 0   23  1  o 10 3.05793e+01 4.34223e-01 5.61442e+02 289.126 2.56646e+00  -7.40078e+00 0.00000e+00 0.00000e+00 5.10657e+02 289.126 5.07856e+01 109.126 0.9338 
1 1 1 0   23  2  o 2  1.64315e+01 2.72299e-01 7.08775e+01 158.609 -5.27010e-01 2.06434e-01  0.00000e+00 0.00000e+00 9.70587e+01 158.609 2.61812e+01 158.609 0.2722 
1 1 1 0   23  3  o 17 4.84669e+01 6.64306e-01 1.09220e+03 33.735  3.44803e+01  2.30262e+01  0.00000e+00 0.00000e+00 7.04981e+02 33.735  3.87218e+02 213.735 0.9879 
1 1 1 0   23  4  o 2  1.52355e+01 2.88164e-01 3.23702e+02 172.235 -3.71315e+00 5.06349e-01  0.00000e+00 0.00000e+00 1.64041e+02 172.235 1.59661e+02 352.235 0.8531 
1 1 1 0   23  5  o 6  9.13456e+00 2.61594e-01 6.12116e+01 320.855 3.33616e-01  -2.71558e-01 0.00000e+00 0.00000e+00 1.08450e+01 320.855 5.03667e+01 140.855 0.2103 
1 1 1 0   23  6  o 6  5.11023e+01 7.81452e-01 9.10158e+02 165.886 -4.02467e+01 1.01196e+01  0.00000e+00 0.00000e+00 9.83201e+02 165.886 7.30422e+01 165.886 0.9879 
1 1 1 0   23  7  o 6  3.71254e+01 6.40232e-01 4.67995e+02 353.256 2.24555e+01  -2.65536e+00 0.00000e+00 0.00000e+00 8.92708e+02 353.256 4.24714e+02 353.256 0.9776 
1 1 1 0   23  8  o 9  3.78180e+01 6.57934e-01 9.19454e+02 158.083 -4.36316e+01 1.75547e+01  0.00000e+00 0.00000e+00 4.82552e+02 158.083 4.36902e+02 338.083 0.9893 
1 1 1 0   23  9  o 11 2.59267e+01 6.72706e-01 4.37667e+02 336.800 1.77692e+01  -7.61569e+00 0.00000e+00 0.00000e+00 5.07920e+02 336.800 7.02522e+01 336.800 0.9738 
1 1 1 0   23  10 o 4  1.15100e+01 5.22805e-01 2.59225e+02 13.910  7.73363e+00  1.91527e+00  0.00000e+00 0.00000e+00 1.43591e+02 13.910  1.15633e+02 193.910 0.9350 
1 1 1 0   23  11 o 2  2.14354e+01 8.39910e-01 2.16658e+02 104.165 -3.54027e+00 1.40274e+01  0.00000e+00 0.00000e+00 5.56966e+02 104.165 3.40308e+02 104.165 0.9648 
1 1 1 0   23  12 o 15 1.32943e+01 5.56800e-01 2.21662e+02 114.435 -5.90216e+00 1.29903e+01  0.00000e+00 0.00000e+00 2.57554e+02 114.435 3.58920e+01 114.435 0.9643 
1 1 1 0   23  13 o 11 4.40382e+00 9.06353e-01 1.34390e+02 205.132 -3.44653e+00 -1.61680e+00 0.00000e+00 0.00000e+00 6.36309e+00 205.132 1.28027e+02 25.132  0.8557 
1 1 1 0   23  14 o 9  1.00812e+01 7.75861e-01 1.89915e+02 329.240 1.43762e+01  -8.55625e+00 0.00000e+00 0.00000e+00 1.74913e+02 329.240 1.50020e+01 149.240 0.9696 
1 1 1 0   23  15 o 1  7.80890e+00 9.43230e-01 1.65410e+02 20.239  1.15315e+01  4.25158e+00  0.00000e+00 0.00000e+00 1.13668e+02 20.239  5.17421e+01 200.238 0.9584 
1 1 1 0   23  16 o 8  8.21850e+00 1.05398e+00 1.37620e+02 174.634 -1.30319e+01 1.22413e+00  0.00000e+00 0.00000e+00 1.56612e+02 174.634 1.89921e+01 174.634 0.9610 
1 1 1 0   23  17 o 14 9.56850e+00 1.20672e+00 1.63932e+02 358.561 1.86787e+01  -4.69116e-01 0.00000e+00 0.00000e+00 1.82508e+02 358.561 1.85758e+01 358.561 0.9729 
1 1 1 0   23  18 o 14 4.61413e+00 1.33843e+00 7.65973e+01 67.564  1.64360e+00  3.98051e+00  0.00000e+00 0.00000e+00 7.33869e+01 67.564  3.21031e+00 247.564 0.8744 
1 1 1 0   23  19 o 1  5.83576e+00 1.57007e+00 1.06199e+02 99.180  -1.19907e+00 7.42006e+00  0.00000e+00 0.00000e+00 9.55305e+01 99.180  1.06684e+01 279.179 0.9309 
1 1 1 0   23  20 o 11 5.49037e+00 1.65233e+00 9.44408e+01 59.686  3.37416e+00  5.77098e+00  0.00000e+00 0.00000e+00 9.32812e+01 59.686  1.15952e+00 239.686 0.9218 
1 1 1 0   24  0  o 3  1.54692e+01 3.71700e-01 2.90230e+02 282.011 2.09071e-01  -9.82674e-01 0.00000e+00 0.00000e+00 3.00186e+01 102.011 3.20248e+02 102.011 0.4480 
1 1 1 0   24  1  o 15 1.77482e+01 2.86172e-01 2.75732e+02 206.607 -2.24774e+00 -1.12593e+00 0.00000e+00 0.00000e+00 2.35004e+02 206.607 4.07281e+01 26.607  0.7665 
1 1 1 0   24  2  o 3  3.12700e+01 4.45433e-01 5.22110e+02 80.102  1.82217e+00  1.04429e+01  0.00000e+00 0.00000e+00 5.94926e+02 80.102  7.28158e+01 80.102  0.9516 
1 1 1 0   24  3  o 17 2.31432e+01 3.75206e-01 2.13997e+02 13.734  2.79879e+00  6.84024e-01  0.00000e+00 0.00000e+00 4.81616e+02 13.734  2.67619e+02 13.734  0.8008 
1 1 1 0   24  4  o 10 2.06792e+01 3.48674e-01 4.77572e+02 149.634 -6.31455e+00 3.69968e+00  0.00000e+00 0.00000e+00 2.43275e+02 149.634 2.34296e+02 329.634 0.9289 
1 1 1 0   24  5  o 13 1.63993e+01 3.19402e-01 1.40663e+02 311.668 1.32205e+00  -1.48550e+00 0.00000e+00 0.00000e+00 2.87466e+02 311.668 1.46804e+02 311.668 0.6959 
1 1 1 0   24  6  o 12 1.83856e+01 3.51703e-01 4.37611e+02 80.073  1.47691e+00  8.43899e+00  0.00000e+00 0.00000e+00 2.10313e+02 80.073  2.27298e+02 260.073 0.9397 
1 1 1 0   24  7  o 19 1.30754e+01 3.54759e-01 2.06011e+02 290.432 1.12121e+00  -3.00962e+00 0.00000e+00 0.00000e+00 1.98127e+02 290.432 7.88373e+00 110.432 0.8245 
1 1 1 0   24  8  o 7  2.64071e+01 5.05258e-01 5.60462e+02 81.004  3.13155e+00  1.97809e+01  0.00000e+00 0.00000e+00 4.04000e+02 81.004  1.56462e+02 261.004 0.9747 
1 1 1 0   24  9  o 11 2.31869e+01 4.84482e-01 4.32006e+02 315.264 1.49446e+01  -1.48076e+01 0.00000e+00 0.00000e+00 4.15473e+02 315.264 1.65331e+01 135.264 0.9759 
1 1 1 0   24  10 o 8  3.41789e+01 6.33320e-01 5.40056e+02 54.435  2.78501e+01  3.89507e+01  0.00000e+00 0.00000e+00 7.25810e+02 54.435  1.85754e+02 54.435  0.9895 
1 1 1 0   24  11 o 14 2.36904e+01 5.48374e-01 2.87600e+02 227.053 -1.52922e+01 -1.64293e+01 0.00000e+00 0.00000e+00 5.78579e+02 227.053 2.90980e+02 227.053 0.9775 
1 1 1 0   24  12 o 13 1.04431e+01 7.17801e-01 1.22138e+02 339.392 5.66480e+00  -2.13011e+00 0.00000e+00 0.00000e+00 2.34318e+02 339.392 1.12180e+02 339.392 0.9132 
1 1 1 0   24  13 f 0  2.31274e+01 5.93729e-01 1.68343e+02 179.946 -2.74449e+01 2.60605e-02  0.00000e+00 0.00000e+00 6.79592e+02 179.946 5.11249e+02 179.946 0.9816 
1 1 1 0   24  14 o 4  1.12370e+01 1.03645e+00 2.23139e+02 168.548 -1.99264e+01 4.03684e+00  0.00000e+00 0.00000e+00 1.85777e+02 168.548 3.73618e+01 348.548 0.9751 
1 1 1 0   24  15 o 6  3.28484e+00 9.83001e-01 5.18498e+01 347.793 1.68291e+00  -3.64077e-01 0.00000e+00 0.00000e+00 2.73200e+01 347.793 2.45298e+01 167.793 0.6464 
1 1 1 0   24  16 o 10 1.15551e+01 8.94491e-01 2.63394e+02 99.155  -5.99903e+00 3.72258e+01  0.00000e+00 0.00000e+00 1.61304e+02 99.155  1.02090e+02 279.155 0.9866 
1 1 1 0   24  17 o 8  6.97987e+00 1.24848e+00 1.56283e+02 357.502 1.39326e+01  -6.07896e-01 0.00000e+00 0.00000e+00 9.39720e+01 357.502 6.23105e+01 177.502 0.9635 
1 1 1 0   24  18 o 5  1.12969e+01 1.21637e+00 2.13203e+02 92.876  -1.70533e+00 3.39449e+01  0.00000e+00 0.00000e+00 2.00526e+02 92.876  1.26774e+01 272.876 0.9852 
1 1 1 0   24  19 o 1  7.39676e+00 1.72137e+00 7.96497e+01 275.080 5.66529e-01  -6.37284e+00 0.00000e+00 0.00000e+00 1.72521e+02 275.080 9.28716e+01 275.080 0.9181 
1 1 1 0   24  20 o 11 4.49699e+00 1.49218e+00 9.14009e+01 275.319 5.58150e-01  -5.99444e+00 0.00000e+00 0.00000e+00 6.08185e+01 275.319 3.05824e+01 95.320  0.9127 
1 1 1 0   25  1  f 0  2.42357e+01 3.60767e-01 3.88745e+02 27.476  4.05651e+00  2.10956e+00  0.00000e+00 0.00000e+00 4.14088e+02 27.476  2.53433e+01 27.476  0.8824 
1 1 1 0   25  2  o 7  1.11596e+01 2.30361e-01 3.34621e+02 222.175 -1.71832e+00 -1.55674e+00 0.00000e+00 0.00000e+00 2.30707e+01 42.175  3.57692e+02 42.175  0.7437 
1 1 1 0   25  3  o 12 4.28454e+01 5.94016e-01 6.88667e+02 224.702 -1.17620e+01 -1.16404e+01 0.00000e+00 0.00000e+00 8.69998e+02 224.702 1.81331e+02 224.702 0.9693 
1 1 1 0   25  4  o 9  2.99757e+01 4.66501e-01 4.55070e+02 171.647 -1.02168e+01 1.50019e+00  0.00000e+00 0.00000e+00 6.13778e+02 171.647 1.58709e+02 171.647 0.9503 
1 1 1 0   25  5  o 2  2.40095e+01 4.08177e-01 2.90579e+02 194.003 -5.74188e+00 -1.43197e+00 0.00000e+00 0.00000e+00 5.29978e+02 194.003 2.39400e+02 194.003 0.9111 
1 1 1 0   25  6  o 4  1.59540e+01 3.31368e-01 1.62684e+02 337.889 2.53706e+00  -1.03075e+00 0.00000e+00 0.00000e+00 3.09131e+02 337.889 1.46446e+02 337.889 0.7886 
1 1 1 0   25  7  o 19 3.76662e+01 8.58685e-01 3.14637e+02 176.986 -1.38296e+01 7.28081e-01  0.00000e+00 0.00000e+00 1.04532e+03 176.986 7.30680e+02 176.986 0.9632 
1 1 1 0   25  8  o 1  3.05200e+01 5.61249e-01 4.06863e+02 22.572  1.81753e+01  7.55506e+00  0.00000e+00 0.00000e+00 7.07224e+02 22.572  3.00361e+02 22.572  0.9743 
1 1 1 0   25  9  o 9  2.36883e+01 4.87035e-01 3.61709e+02 30.591  1.54376e+01  9.12658e+00  0.00000e+00 0.00000e+00 5.00286e+02 30.591  1.38577e+02 30.591  0.9717 
1 1 1 0   25  10 o 5  2.26347e+01 4.99997e-01 4.58264e+02 296.743 1.21771e+01  -2.41664e+01 0.00000e+00 0.00000e+00 3.73080e+02 296.743 8.51840e+01 116.743 0.9813 
1 1 1 0   25  11 o 12 2.14693e+01 6.98686e-01 4.30685e+02 35.729  2.43826e+01  1.75395e+01  0.00000e+00 0.00000e+00 3.58845e+02 35.729  7.18403e+01 215.729 0.9832 
1 1 1 0   25  12 o 1  1.86038e+01 6.36600e-01 3.46307e+02 277.958 4.17605e+00  -2.98742e+01 0.00000e+00 0.00000e+00 3.37416e+02 277.958 8.89092e+00 97.958  0.9833 
1 1 1 0   25  13 o 8  1.24538e+01 6.27879e-01 2.04764e+02 147.098 -1.49819e+01 9.69304e+00  0.00000e+00 0.00000e+00 2.47133e+02 147.098 4.23697e+01 147.098 0.9716 
1 1 1 0   25  14 o 12 1.25293e+01 9.28886e-01 2.25722e+02 180.618 -2.36538e+01 -2.55076e-01 0.00000e+00 0.00000e+00 2.31846e+02 180.618 6.12463e+00 180.618 0.9786 
1 1 1 0   25  15 o 16 1.42223e+01 7.42651e-01 3.01257e+02 317.122 3.43826e+01  -3.19254e+01 0.00000e+00 0.00000e+00 2.23329e+02 317.122 7.79283e+01 137.122 0.9893 
1 1 1 0   25  16 o 11 1.40459e+01 8.07846e-01 1.86130e+02 330.443 3.01841e+01  -1.71167e+01 0.00000e+00 0.00000e+00 3.29468e+02 330.443 1.43338e+02 330.443 0.9855 
1 1 1 0   25  17 o 4  5.30064e+00 1.33144e+00 6.59871e+01 21.187  3.96437e+00  1.53668e+00  0.00000e+00 0.00000e+00 1.06118e+02 21.187  4.01312e+01 21.187  0.8726 
1 1 1 0   25  18 o 2  5.51691e+00 1.43821e+00 4.73215e+01 284.460 7.96183e-01  -3.08739e+00 0.00000e+00 0.00000e+00 1.21454e+02 284.460 7.41320e+01 284.460 0.8230 
1 1 1 0   25  19 o 17 4.25190e+00 1.36251e+00 1.29475e+02 235.979 -4.30170e+00 -6.37255e+00 0.00000e+00 0.00000e+00 1.77396e+01 235.979 1.11736e+02 55.979  0.9325 
1 1 1 0   25  20 o 8  7.80608e+00 1.84828e+00 8.62258e+01 30.973  6.46921e+00  3.88292e+00  0.00000e+00 0.00000e+00 1.83336e+02 30.973  9.71102e+01 30.973  0.9312 
1 1 1 0   26  0  f 0  1.05911e+01 3.16969e-01 2.66823e+02 328.935 5.75776e-01  -3.46853e-01 0.00000e+00 0.00000e+00 1.40221e+02 148.935 4.07044e+02 148.935 0.3184 
1 1 1 0   26  1  o 1  9.45307e+00 2.18636e-01 4.10283e+02 3.899   2.50502e+00  1.70732e-01  0.00000e+00 0.00000e+00 1.38411e+02 183.899 5.48694e+02 183.899 0.7662 
1 1 1 0   26  2  o 18 5.67586e+01 7.72717e-01 9.70005e+02 212.746 -3.65265e+01 -2.34910e+01 0.00000e+00 0.00000e+00 1.13571e+03 212.746 1.65707e+02 212.746 0.9884 
1 1 1 0   26  3  o 7  1.38270e+01 2.60091e-01 3.41263e+01 156.496 -3.48417e-01 1.51526e-01  0.00000e+00 0.00000e+00 6.27129e+01 156.496 2.85866e+01 156.496 0.1866 
1 1 1 0   26  4  o 1  2.23361e+01 3.78453e-01 2.87905e+02 294.739 1.99384e+00  -4.32713e+00 0.00000e+00 0.00000e+00 4.55969e+02 294.739 1.68064e+02 294.739 0.8876 
1 1 1 0   26  5  o 13 2.22064e+01 3.93022e-01 3.06112e+02 293.480 2.40612e+00  -5.53894e+00 0.00000e+00 0.00000e+00 4.54350e+02 293.480 1.48238e+02 293.480 0.9130 
1 1 1 0   26  6  o 6  6.42481e+00 3.20403e-01 1.04846e+02 168.386 -6.88303e-01 1.41465e-01  0.00000e+00 0.00000e+00 2.50302e+01 348.386 1.29876e+02 348.386 0.3313 
1 1 1 0   26  7  o 7  2.53614e+01 4.47866e-01 2.83301e+02 134.600 -6.20021e+00 6.28745e+00  0.00000e+00 0.00000e+00 6.11747e+02 134.600 3.28446e+02 134.600 0.9415 
1 1 1 0   26  8  o 1  5.23369e+01 8.77176e-01 6.86342e+02 147.999 -4.73944e+01 2.96164e+01  0.00000e+00 0.00000e+00 1.25686e+03 147.999 5.70517e+02 147.999 0.9910 
1 1 1 0   26  9  f 0  2.60179e+01 5.15454e-01 5.26510e+02 173.386 -2.84016e+01 3.29329e+00  0.00000e+00 0.00000e+00 4.30563e+02 173.386 9.59464e+01 353.386 0.9824 
1 1 1 0   26  10 o 15 4.49757e+01 9.22067e-01 7.04481e+02 344.153 8.11377e+01  -2.30314e+01 0.00000e+00 0.00000e+00 9.68694e+02 344.153 2.64213e+02 344.153 0.9941 
1 1 1 0   26  11 o 4  3.02345e+01 6.17649e-01 6.27245e+02 294.366 2.76453e+01  -6.10386e+01 0.00000e+00 0.00000e+00 4.95061e+02 294.366 1.32184e+02 114.366 0.9925 
1 1 1 0   26  12 o 12 1.76127e+01 5.62928e-01 1.97456e+02 272.698 7.70217e-01  -1.63436e+01 0.00000e+00 0.00000e+00 4.40355e+02 272.698 2.42899e+02 272.698 0.9689 
1 1 1 0   26  13 o 4  1.19701e+01 6.08972e-01 2.51475e+02 60.594  1.09488e+01  1.94265e+01  0.00000e+00 0.00000e+00 1.85413e+02 60.594  6.60623e+01 240.594 0.9773 
1 1 1 0   26  14 o 8  2.21389e+01 6.29296e-01 3.80408e+02 29.783  6.59221e+01  3.77285e+01  0.00000e+00 0.00000e+00 4.40241e+02 29.783  5.98324e+01 29.783  0.9934 
1 1 1 0   26  15 o 18 1.55604e+01 7.08362e-01 2.81442e+02 124.466 -2.87698e+01 4.19142e+01  0.00000e+00 0.00000e+00 2.92940e+02 124.466 1.14982e+01 124.466 0.9901 
1 1 1 0   26  16 o 4  1.25202e+01 8.54317e-01 1.55313e+02 329.914 2.18860e+01  -1.26799e+01 0.00000e+00 0.00000e+00 3.01705e+02 329.914 1.46392e+02 329.914 0.9800 
1 1 1 0   26  17 o 10 4.64321e+00 1.21903e+00 5.38226e+01 210.659 -2.62476e+00 -1.55592e+00 0.00000e+00 0.00000e+00 8.67597e+01 210.659 3.29370e+01 210.659 0.8137 
1 1 1 0   26  18 o 13 8.78680e+00 1.32917e+00 1.29397e+02 335.015 1.33654e+01  -6.22814e+00 0.00000e+00 0.00000e+00 1.85923e+02 335.015 5.65261e+01 335.015 0.9655 
1 1 1 0   26  19 o 8  4.45678e+00 1.40410e+00 4.23519e+01 104.610 -6.79662e-01 2.60730e+00  0.00000e+00 0.00000e+00 8.74717e+01 104.610 4.51198e+01 104.610 0.7846 
1 1 1 0   26  20 o 9  5.15821e+00 1.61839e+00 6.87923e+01 124.477 -2.69684e+00 3.92735e+00  0.00000e+00 0.00000e+00 1.00991e+02 124.477 3.21982e+01 124.477 0.8876 
1 1 1 0   27  1  o 9  2.01348e+01 3.39802e-01 2.19836e+02 28.215  2.40095e+00  1.28822e+00  0.00000e+00 0.00000e+00 3.75232e+02 28.215  1.55396e+02 28.215  0.7874 
1 1 1 0   27  2  o 12 2.93475e+01 4.25868e-01 5.90982e+02 69.609  3.52849e+00  9.49219e+00  0.00000e+00 0.00000e+00 4.54587e+02 69.609  1.36395e+02 249.609 0.9493 
1 1 1 0   27  3  o 8  1.85829e+01 3.07363e-01 4.37721e+02 339.797 5.95440e+00  -2.19108e+00 0.00000e+00 0.00000e+00 2.02017e+02 339.797 2.35703e+02 159.798 0.9174 
1 1 1 0   27  4  o 10 2.48876e+01 3.80190e-01 4.25621e+02 197.354 -8.64450e+00 -2.70142e+00 0.00000e+00 0.00000e+00 4.54939e+02 197.354 2.93186e+01 197.354 0.9431 
1 1 1 0   27  5  o 10 1.42888e+01 3.17037e-01 2.76425e+02 221.795 -2.58154e+00 -2.30778e+00 0.00000e+00 0.00000e+00 1.73294e+02 221.795 1.03131e+02 41.795  0.8391 
1 1 1 0   27  6  o 16 4.69940e+01 7.27408e-01 9.41689e+02 176.351 -5.28415e+01 3.36971e+00  0.00000e+00 0.00000e+00 8.03623e+02 176.351 1.38066e+02 356.351 0.9905 
1 1 1 0   27  7  o 18 3.95533e+01 6.27849e-01 7.12527e+02 261.301 -5.18473e+00 -3.38864e+01 0.00000e+00 0.00000e+00 7.48143e+02 261.301 3.56152e+01 261.301 0.9853 
1 1 1 0   27  8  o 10 3.45397e+01 6.16674e-01 5.23308e+02 10.674  2.72981e+01  5.14533e+00  0.00000e+00 0.00000e+00 7.47135e+02 10.674  2.23826e+02 10.674  0.9818 
1 1 1 0   27  9  o 12 3.14559e+01 7.58812e-01 2.79596e+02 113.325 -7.15847e+00 1.66020e+01  0.00000e+00 0.00000e+00 8.65165e+02 113.325 5.85570e+02 113.325 0.9719 
1 1 1 0   27  10 o 14 1.18878e+01 7.57279e-01 1.56254e+02 333.795 4.60250e+00  -2.26519e+00 0.00000e+00 0.00000e+00 2.42478e+02 333.795 8.62241e+01 333.795 0.8963 
1 1 1 0   27  11 o 18 3.24981e+01 7.20097e-01 3.51664e+02 60.267  1.97870e+01  3.46445e+01  0.00000e+00 0.00000e+00 8.48356e+02 60.267  4.96692e+02 60.267  0.9874 
1 1 1 0   27  12 o 17 2.58256e+01 5.95306e-01 4.24881e+02 155.741 -5.03883e+01 2.27074e+01  0.00000e+00 0.00000e+00 5.31483e+02 155.741 1.06602e+02 155.741 0.9909 
1 1 1 0   27  13 o 11 1.00112e+01 7.57233e-01 1.80653e+02 117.715 -6.04710e+00 1.15106e+01  0.00000e+00 0.00000e+00 1.78515e+02 117.715 2.13839e+00 297.715 0.9607 
1 1 1 0   27  14 o 7  1.42777e+01 6.36523e-01 1.63460e+02 39.736  1.70739e+01  1.41931e+01  0.00000e+00 0.00000e+00 3.57129e+02 39.736  1.93669e+02 39.736  0.9772 
1 1 1 0   27  15 o 8  4.14126e+00 1.15546e+00 1.31815e+02 358.552 5.35952e+00  -1.35432e-01 0.00000e+00 0.00000e+00 7.30436e+00 358.552 1.24510e+02 178.552 0.9011 
1 1 1 0   27  16 o 6  1.47912e+01 8.02968e-01 1.86228e+02 247.200 -1.49875e+01 -3.56530e+01 0.00000e+00 0.00000e+00 3.57479e+02 247.200 1.71251e+02 247.200 0.9870 
1 1 1 0   27  17 o 13 7.29753e+00 1.19680e+00 1.63640e+02 173.886 -1.46589e+01 1.57017e+00  0.00000e+00 0.00000e+00 9.84961e+01 173.886 6.51437e+01 353.886 0.9655 
1 1 1 0   27  18 o 5  8.51890e+00 1.37759e+00 1.61730e+02 301.516 9.41759e+00  -1.53583e+01 0.00000e+00 0.00000e+00 1.45969e+02 301.516 1.57605e+01 121.516 0.9718 
1 1 1 0   27  19 o 10 1.23772e+01 1.36655e+00 2.23707e+02 115.868 -1.77196e+01 3.65431e+01  0.00000e+00 0.00000e+00 2.30094e+02 115.868 6.38690e+00 115.868 0.9876 
1 1 1 0   27  20 o 17 5.06436e+00 1.61994e+00 1.20117e+02 315.759 5.72668e+00  -5.57703e+00 0.00000e+00 0.00000e+00 5.54982e+01 315.759 6.46185e+01 135.759 0.9352 
1 1 1 0   28  0  o 3  1.19395e+01 3.97738e-01 1.33338e+02 9.781   6.33452e-01  1.09197e-01  0.00000e+00 0.00000e+00 3.72888e+00 9.781   1.29609e+02 189.781 0.3059 
1 1 1 0   28  1  o 3  2.32307e+01 4.09200e-01 3.30497e+02 4.488   6.01327e+00  4.71945e-01  0.00000e+00 0.00000e+00 4.65414e+02 4.488   1.34917e+02 4.488   0.9129 
1 1 1 0   28  2  o 12 2.46044e+01 3.71408e-01 5.39014e+02 131.085 -4.89774e+00 5.61731e+00  0.00000e+00 0.00000e+00 3.19965e+02 131.085 2.19050e+02 311.085 0.9303 
1 1 1 0   28  3  o 11 2.05628e+01 3.29879e-01 4.07051e+02 210.467 -5.38525e+00 -3.16798e+00 0.00000e+00 0.00000e+00 2.99749e+02 210.467 1.07302e+02 30.467  0.9160 
1 1 1 0   28  4  o 15 7.31712e+00 2.38409e-01 8.24322e+01 261.338 -7.06457e-02 -4.63754e-01 0.00000e+00 0.00000e+00 1.97560e+01 81.338  1.02188e+02 81.338  0.2283 
1 1 1 0   28  5  f 0  4.88652e+01 7.28897e-01 8.99193e+02 229.273 -2.70765e+01 -3.14494e+01 0.00000e+00 0.00000e+00 9.11258e+02 229.273 1.20654e+01 229.273 0.9879 
1 1 1 0   28  6  f 0  3.10989e+01 5.57241e-01 4.73862e+02 57.811  9.35268e+00  1.48583e+01  0.00000e+00 0.00000e+00 6.58389e+02 57.811  1.84527e+02 57.811  0.9711 
1 1 1 0   28  7  o 15 2.47236e+01 5.37650e-01 1.98748e+02 290.669 2.25000e+00  -5.96412e+00 0.00000e+00 0.00000e+00 6.51664e+02 290.669 4.52916e+02 290.669 0.9178 
1 1 1 0   28  8  o 7  5.14470e+01 7.97282e-01 8.17385e+02 50.811  4.95727e+01  6.08049e+01  0.00000e+00 0.00000e+00 1.09749e+03 50.811  2.80104e+02 50.811  0.9936 
1 1 1 0   28  9  o 19 2.23837e+01 4.84629e-01 4.50596e+02 210.386 -1.88912e+01 -1.10772e+01 0.00000e+00 0.00000e+00 3.68097e+02 210.386 8.24982e+01 30.386  0.9769 
1 1 1 0   28  10 o 9  1.75393e+01 6.36649e-01 2.11739e+02 242.912 -4.69851e+00 -9.18635e+00 0.00000e+00 0.00000e+00 4.11898e+02 242.912 2.00159e+02 242.912 0.9502 
1 1 1 0   28  11 o 7  2.87035e+01 1.01205e+00 4.57750e+02 355.752 4.31248e+01  -3.20317e+00 0.00000e+00 0.00000e+00 6.03122e+02 355.752 1.45372e+02 355.752 0.9884 
1 1 1 0   28  12 o 6  8.22307e+00 8.17298e-01 1.93397e+02 282.891 1.86031e+00  -8.12872e+00 0.00000e+00 0.00000e+00 9.48257e+01 282.891 9.85713e+01 102.890 0.9380 
1 1 1 0   28  13 o 9  1.54518e+01 5.88591e-01 3.26749e+02 197.841 -3.58538e+01 -1.15399e+01 0.00000e+00 0.00000e+00 2.42509e+02 197.841 8.42400e+01 17.841  0.9866 
1 1 1 0   28  14 o 9  1.67970e+01 6.17660e-01 2.65665e+02 338.396 3.95584e+01  -1.56654e+01 0.00000e+00 0.00000e+00 3.53606e+02 338.396 8.79403e+01 338.396 0.9882 
1 1 1 0   28  15 o 17 1.42621e+01 6.98453e-01 1.93947e+02 353.365 3.37144e+01  -3.92206e+00 0.00000e+00 0.00000e+00 3.29797e+02 353.365 1.35851e+02 353.365 0.9852 
1 1 1 0   28  16 o 16 8.26313e+00 1.11052e+00 2.29642e+02 229.579 -1.46713e+01 -1.72258e+01 0.00000e+00 0.00000e+00 7.12042e+01 229.579 1.58438e+02 49.579  0.9776 
1 1 1 0   28  17 o 4  8.52420e+00 1.21932e+00 1.16824e+02 3.014   1.31328e+01  6.91540e-01  0.00000e+00 0.00000e+00 1.87998e+02 3.014   7.11741e+01 3.014   0.9612 
1 1 1 0   28  18 o 4  7.52963e+00 1.37244e+00 9.18374e+01 9.854   8.93163e+00  1.55138e+00  0.00000e+00 0.00000e+00 1.72073e+02 9.854   8.02352e+01 9.854   0.9431 
1 1 1 0   28  19 o 5  6.48200e+00 1.64376e+00 1.08884e+02 91.787  -2.61640e-01 8.38671e+00  0.00000e+00 0.00000e+00 1.16908e+02 91.787  8.02365e+00 91.787  0.9384 
1 1 1 0   28  20 o 16 5.63008e+00 1.69940e+00 8.85386e+01 102.882 -1.38889e+00 6.07321e+00  0.00000e+00 0.00000e+00 1.02631e+02 102.882 1.40926e+01 102.882 0.9158 
1 1 1 0   29  1  o 13 2.90248e+01 4.93609e-01 4.92974e+02 148.067 -6.99899e+00 4.36201e+00  0.00000e+00 0.00000e+00 5.27953e+02 148.067 3.49793e+01 148.067 0.9373 
1 1 1 0   29  2  o 16 3.30395e+01 4.73228e-01 6.02477e+02 140.770 -1.23371e+01 1.00728e+01  0.00000e+00 0.00000e+00 5.97775e+02 140.770 4.70286e+00 320.770 0.9681 
1 1 1 0   29  3  f 0  1.98290e+01 3.24631e-01 3.38981e+02 233.291 -3.05482e+00 -4.09698e+00 0.00000e+00 0.00000e+00 3.27541e+02 233.291 1.14401e+01 53.291  0.8959 
1 1 1 0   29  4  o 10 2.27485e+01 3.58661e-01 3.92976e+02 283.942 1.64074e+00  -6.60923e+00 0.00000e+00 0.00000e+00 3.94953e+02 283.942 1.97700e+00 283.942 0.9233 
1 1 1 0   29  5  o 2  3.01506e+01 4.77517e-01 5.13534e+02 92.587  -6.32567e-01 1.40008e+01  0.00000e+00 0.00000e+00 5.76047e+02 92.587  6.25133e+01 92.587  0.9636 
1 1 1 0   29  6  o 2  3.08657e+01 5.13873e-01 2.69493e+02 340.549 8.65296e+00  -3.05589e+00 0.00000e+00 0.00000e+00 8.22637e+02 340.549 5.53144e+02 340.549 0.9438 
1 1 1 0   29  7  o 13 4.65003e+01 7.25848e-01 9.74830e+02 133.437 -3.95768e+01 4.17976e+01  0.00000e+00 0.00000e+00 7.52525e+02 133.437 2.22305e+02 313.437 0.9913 
1 1 1 0   29  8  o 12 3.33028e+01 5.59777e-01 6.16518e+02 267.195 -1.88618e+00 -3.84992e+01 0.00000e+00 0.00000e+00 6.14614e+02 267.195 1.90374e+00 87.195  0.9869 
1 1 1 0   29  9  o 19 2.69109e+01 5.34035e-01 1.93933e+02 0.440   1.15668e+01  8.88194e-02  0.00000e+00 0.00000e+00 7.68959e+02 0.440   5.75026e+02 0.440   0.9557 
1 1 1 0   29  10 o 19 1.38967e+01 4.86534e-01 1.76108e+02 9.419   7.30361e+00  1.21160e+00  0.00000e+00 0.00000e+00 3.07337e+02 9.419   1.31229e+02 9.419   0.9298 
1 1 1 0   29  11 o 8  2.60893e+01 5.79690e-01 3.38927e+02 58.038  1.82596e+01  2.92645e+01  0.00000e+00 0.00000e+00 6.22351e+02 58.038  2.83424e+02 58.038  0.9854 
1 1 1 0   29  12 o 12 1.51537e+01 9.24122e-01 1.56418e+02 353.100 1.20855e+01  -1.46258e+00 0.00000e+00 0.00000e+00 3.86027e+02 353.100 2.29609e+02 353.100 0.9580 
1 1 1 0   29  13 o 16 7.63643e+00 7.86436e-01 1.07002e+02 154.844 -5.21614e+00 2.44959e+00  0.00000e+00 0.00000e+00 1.52033e+02 154.844 4.50313e+01 154.844 0.9085 
1 1 1 0   29  14 o 3  5.72576e+00 9.22222e-01 1.82461e+02 13.036  9.05803e+00  2.09724e+00  0.00000e+00 0.00000e+00 1.93088e+01 13.036  1.63152e+02 193.036 0.9446 
1 1 1 0   29  15 o 9  9.73503e+00 9.35174e-01 1.31141e+02 235.834 -8.41356e+00 -1.23960e+01 0.00000e+00 0.00000e+00 2.19386e+02 235.834 8.82449e+01 235.834 0.9660 
1 1 1 0   29  16 o 19 6.11076e+00 1.10380e+00 1.55050e+02 13.047  1.10318e+01  2.55645e+00  0.00000e+00 0.00000e+00 6.22098e+01 13.047  9.28400e+01 193.047 0.9548 
1 1 1 0   29  17 o 13 4.71532e+00 1.31292e+00 6.09821e+01 308.345 2.12286e+00  -2.68372e+00 0.00000e+00 0.00000e+00 8.58221e+01 308.345 2.48400e+01 308.345 0.8369 
1 1 1 0   29  18 o 4  1.03850e+01 1.24127e+00 9.31239e+01 137.634 -9.52667e+00 8.68857e+00  0.00000e+00 0.00000e+00 2.77506e+02 137.634 1.84382e+02 137.634 0.9604 
1 1 1 0   29  19 o 14 5.22704e+00 1.52501e+00 6.72245e+01 352.796 4.53679e+00  -5.73413e-01 0.00000e+00 0.00000e+00 1.03986e+02 352.796 3.67612e+01 352.796 0.8824 
1 1 1 0   29  20 o 18 5.25664e+00 1.60759e+00 1.00388e+02 43.142  5.17266e+00  4.84766e+00  0.00000e+00 0.00000e+00 8.01775e+01 43.142  2.02106e+01 223.142 0.9265 
1 1 1 0   30  0  o 10 1.55020e+01 3.89238e-01 3.31465e+02 115.852 -6.34613e-01 1.30972e+00  0.00000e+00 0.00000e+00 8.80255e+00 115.852 3.22662e+02 295.852 0.5849 
1 1 1 0   30  1  o 4  3.88802e+01 6.30321e-01 5.00012e+02 207.716 -1.40497e+01 -7.38139e+00 0.00000e+00 0.00000e+00 9.12268e+02 207.716 4.12256e+02 207.716 0.9680 
1 1 1 0   30  2  o 10 3.11378e+01 4.51466e-01 4.24035e+02 353.140 9.99584e+00  -1.20249e+00 0.00000e+00 0.00000e+00 6.84700e+02 353.140 2.60665e+02 353.140 0.9490 
1 1 1 0   30  3  o 16 4.02542e+01 6.06587e-01 7.03260e+02 173.385 -2.44634e+01 2.83697e+00  0.00000e+00 0.00000e+00 7.75967e+02 173.385 7.27073e+01 173.385 0.9795 
1 1 1 0   30  4  o 6  9.06757e+00 2.46128e-01 2.86643e+02 64.738  9.45335e-01  2.00334e+00  0.00000e+00 0.00000e+00 3.83162e+01 244.738 3.24960e+02 244.738 0.7301 
1 1 1 0   30  5  o 8  7.94099e+00 2.72289e-01 2.77074e+02 242.120 -1.10210e+00 -2.08331e+00 0.00000e+00 0.00000e+00 5.41924e+01 62.120  3.31267e+02 62.120  0.7485 
1 1 1 0   30  6  o 3  2.79404e+01 4.75425e-01 5.42957e+02 209.715 -1.73226e+01 -9.88678e+00 0.00000e+00 0.00000e+00 4.77812e+02 209.715 6.51452e+01 29.715  0.9746 
1 1 1 0   30  7  o 5  3.63623e+01 5.89963e-01 5.33269e+02 124.628 -1.45599e+01 2.10835e+01  0.00000e+00 0.00000e+00 8.02405e+02 124.628 2.69136e+02 124.628 0.9803 
1 1 1 0   30  8  o 10 3.54824e+01 7.25380e-01 3.30392e+02 305.595 1.18499e+01  -1.65551e+01 0.00000e+00 0.00000e+00 9.65502e+02 305.595 6.35109e+02 305.595 0.9751 
1 1 1 0   30  9  o 4  3.69745e+01 7.85188e-01 4.18666e+02 326.310 3.10455e+01  -2.06966e+01 0.00000e+00 0.00000e+00 9.46780e+02 326.310 5.28114e+02 326.310 0.9865 
1 1 1 0   30  10 o 13 1.98350e+01 7.78639e-01 3.60051e+02 234.286 -1.17662e+01 -1.63661e+01 0.00000e+00 0.00000e+00 3.63384e+02 234.286 3.33237e+00 234.286 0.9749 
1 1 1 0   30  11 o 17 4.69753e+01 1.08053e+00 7.28119e+02 251.047 -4.46652e+01 -1.30062e+02 0.00000e+00 0.00000e+00 1.02183e+03 251.047 2.93714e+02 251.047 0.9964 
1 1 1 0   30  12 o 14 1.75409e+01 8.05896e-01 1.99702e+02 10.119  1.98182e+01  3.53680e+00  0.00000e+00 0.00000e+00 4.39179e+02 10.119  2.39477e+02 10.119  0.9748 
1 1 1 0   30  13 o 12 1.29130e+01 6.93074e-01 1.05589e+02 153.788 -8.76266e+00 4.31407e+00  0.00000e+00 0.00000e+00 3.51115e+02 153.788 2.45526e+02 153.788 0.9473 
1 1 1 0   30  14 o 8  2.16014e+01 6.34312e-01 3.55264e+02 101.809 -1.51177e+01 7.23108e+01  0.00000e+00 0.00000e+00 4.45065e+02 101.809 8.98007e+01 101.809 0.9932 
1 1 1 0   30  15 o 5  9.72089e+00 8.18981e-01 2.29351e+02 254.283 -7.40717e+00 -2.63219e+01 0.00000e+00 0.00000e+00 1.26260e+02 254.283 1.03090e+02 74.283  0.9815 
1 1 1 0   30  16 o 1  1.00304e+01 9.25079e-01 2.16606e+02 217.988 -2.19119e+01 -1.71119e+01 0.00000e+00 0.00000e+00 1.50095e+02 217.988 6.65109e+01 37.988  0.9818 
1 1 1 0   30  17 o 19 9.52309e+00 1.12943e+00 1.73341e+02 27.430  1.93315e+01  1.00335e+01  0.00000e+00 0.00000e+00 1.72663e+02 27.430  6.78097e-01 207.430 0.9768 
1 1 1 0   30  18 o 18 4.27135e+00 1.28840e+00 5.02095e+01 133.196 -1.98718e+00 2.11645e+00  0.00000e+00 0.00000e+00 7.71675e+01 133.196 2.69581e+01 133.196 0.8026 
1 1 1 0   30  19 f 0  9.73114e+00 1.72377e+00 1.99232e+02 319.629 1.66153e+01  -1.41261e+01 0.00000e+00 0.00000e+00 1.53564e+02 319.629 4.56679e+01 139.629 0.9768 
1 1 1 0   30  20 o 3  4.31207e+00 1.41421e+00 1.21992e+02 100.868 -1.58885e+00 8.27576e+00  0.00000e+00 0.00000e+00 2.80543e+01 100.868 9.39377e+01 280.868 0.9386 
1 1 1 0   31  1  o 3  1.82104e+01 3.60949e-01 5.86055e+02 92.776  -4.08032e-01 8.41493e+00  0.00000e+00 0.00000e+00 5.53186e+01 92.776  5.30736e+02 272.776 0.9386 
1 1 1 0   31  2  o 4  1.17921e+01 2.50379e-01 3.48902e+02 155.793 -2.77683e+00 1.24833e+00  0.00000e+00 0.00000e+00 1.08944e+01 155.793 3.38007e+02 335.793 0.8132 
1 1 1 0   31  3  o 16 2.90973e+01 4.97064e-01 4.03791e+02 161.851 -9.49255e+00 3.11161e+00  0.00000e+00 0.00000e+00 6.31593e+02 161.851 2.27802e+02 161.851 0.9485 
1 1 1 0   31  4  o 12 2.47412e+01 4.46077e-01 2.13094e+02 132.969 -3.19030e+00 3.42485e+00  0.00000e+00 0.00000e+00 6.08510e+02 132.969 3.95416e+02 132.969 0.8854 
1 1 1 0   31  5  o 16 1.81113e+01 3.39413e-01 2.99316e+02 325.409 4.71897e+00  -3.25429e+00 0.00000e+00 0.00000e+00 3.17292e+02 325.409 1.79767e+01 325.409 0.9080 
1 1 1 0   31  6  o 15 2.58047e+01 4.45355e-01 4.40256e+02 228.186 -9.88094e+00 -1.10460e+01 0.00000e+00 0.00000e+00 4.93753e+02 228.186 5.34973e+01 228.186 0.9657 
1 1 1 0   31  7  o 7  3.79910e+01 6.68519e-01 3.37278e+02 111.697 -6.20616e+00 1.55980e+01  0.00000e+00 0.00000e+00 1.04310e+03 111.697 7.05820e+02 111.697 0.9697 
1 1 1 0   31  8  o 15 1.84024e+01 4.32990e-01 2.27209e+02 143.953 -5.78612e+00 4.21106e+00  0.00000e+00 0.00000e+00 4.11829e+02 143.953 1.84620e+02 143.953 0.9272 
1 1 1 0   31  9  o 8  2.38079e+01 6.61436e-01 1.98264e+02 90.706  -1.40792e-01 1.14259e+01  0.00000e+00 0.00000e+00 6.52961e+02 90.706  4.54697e+02 90.706  0.9552 
1 1 1 0   31  10 o 3  3.47195e+01 7.26587e-01 5.33370e+02 156.764 -4.80517e+01 2.06312e+01  0.00000e+00 0.00000e+00 7.52994e+02 156.764 2.19623e+02 156.764 0.9904 
1 1 1 0   31  11 o 1  1.52618e+01 7.14175e-01 1.12358e+02 328.299 6.15053e+00  -3.79884e+00 0.00000e+00 0.00000e+00 4.17135e+02 328.299 3.04777e+02 328.299 0.9280 
1 1 1 0   31  12 o 19 1.02013e+01 6.63845e-01 1.83817e+02 8.930   1.04554e+01  1.64287e+00  0.00000e+00 0.00000e+00 1.78817e+02 8.930   5.00007e+00 188.930 0.9515 
1 1 1 0   31  13 f 0  9.33390e+00 7.28334e-01 6.01447e+01 154.563 -3.80578e+00 1.81012e+00  0.00000e+00 0.00000e+00 2.43448e+02 154.563 1.83303e+02 154.563 0.8713 
1 1 1 0   31  14 o 8  4.91020e+00 1.11344e+00 1.52777e+02 125.086 -3.60165e+00 5.12724e+00  0.00000e+00 0.00000e+00 1.50437e+01 125.086 1.37734e+02 305.086 0.9163 
1 1 1 0   31  15 o 6  1.42604e+01 7.07003e-01 2.81307e+02 229.930 -3.28881e+01 -3.90973e+01 0.00000e+00 0.00000e+00 2.44910e+02 229.930 3.63977e+01 49.930  0.9902 
1 1 1 0   31  16 o 13 6.51408e+00 1.05012e+00 1.48025e+02 42.300  9.65284e+00  8.78346e+00  0.00000e+00 0.00000e+00 8.50201e+01 42.300  6.30050e+01 222.300 0.9609 
1 1 1 0   31  17 o 12 1.26685e+01 9.83070e-01 2.13024e+02 235.374 -2.35404e+01 -3.40909e+01 0.00000e+00 0.00000e+00 2.52451e+02 235.374 3.94269e+01 235.374 0.9879 
1 1 1 0   31  18 o 7  5.96688e+00 1.41089e+00 8.11400e+01 294.618 2.51762e+00  -5.49451e+00 0.00000e+00 0.00000e+00 1.21276e+02 294.618 4.01363e+01 294.618 0.9130 
1 1 1 0   31  19 o 4  5.78831e+00 1.56196e+00 1.27305e+02 23.811  8.42280e+00  3.71683e+00  0.00000e+00 0.00000e+00 7.54875e+01 23.811  5.18176e+01 203.811 0.9440 
1 1 1 0   31  20 o 18 4.60269e+00 1.48710e+00 3.46400e+01 265.929 -1.82878e-01 -2.56963e+00 0.00000e+00 0.00000e+00 9.72498e+01 265.929 6.26098e+01 265.929 0.7730 
1 1 1 0   32  0  o 12 3.25994e+01 7.72238e-01 5.62259e+02 137.340 -5.14016e+00 4.73655e+00  0.00000e+00 0.00000e+00 5.69671e+02 137.340 7.41179e+00 137.340 0.9254 
1 1 1 0   32  1  o 10 3.65814e+01 5.57944e-01 5.10190e+02 294.307 5.75908e+00  -1.27506e+01 0.00000e+00 0.00000e+00 8.12337e+02 294.307 3.02147e+02 294.307 0.9636 
1 1 1 0   32  2  o 6  3.26869e+01 4.72781e-01 5.59956e+02 224.880 -9.73477e+00 -9.69407e+00 0.00000e+00 0.00000e+00 6.20823e+02 224.880 6.08673e+01 224.880 0.9629 
1 1 1 0   32  3  o 7  2.69541e+01 4.75675e-01 5.27274e+02 344.223 1.05425e+01  -2.97857e+00 0.00000e+00 0.00000e+00 4.36479e+02 344.223 9.07955e+01 164.223 0.9532 
1 1 1 0   32  4  o 6  3.36666e+01 5.26456e-01 5.02015e+02 340.066 1.52445e+01  -5.52874e+00 0.00000e+00 0.00000e+00 7.20995e+02 340.066 2.18981e+02 340.066 0.9687 
1 1 1 0   32  5  o 2  2.85189e+01 4.59636e-01 5.88170e+02 148.561 -1.48983e+01 9.10796e+00  0.00000e+00 0.00000e+00 4.49983e+02 148.561 1.38188e+02 328.561 0.9709 
1 1 1 0   32  6  o 2  3.57317e+01 5.72950e-01 5.56635e+02 342.854 2.24462e+01  -6.92489e+00 0.00000e+00 0.00000e+00 7.53752e+02 342.854 1.97117e+02 342.854 0.9785 
1 1 1 0   32  7  o 19 3.69169e+01 6.03995e-01 6.59055e+02 159.279 -3.07753e+01 1.16420e+01  0.00000e+00 0.00000e+00 7.02846e+02 159.279 4.37914e+01 159.279 0.9847 
1 1 1 0   32  8  o 18 2.00741e+01 4.17879e-01 2.38465e+02 288.127 2.56424e+00  -7.83260e+00 0.00000e+00 0.00000e+00 4.66062e+02 288.127 2.27597e+02 288.127 0.9372 
1 1 1 0   32  9  o 1  2.47260e+01 4.77996e-01 4.77889e+02 224.332 -2.03392e+01 -1.98701e+01 0.00000e+00 0.00000e+00 4.31136e+02 224.332 4.67533e+01 44.332  0.9823 
1 1 1 0   32  10 o 16 2.05274e+01 4.78607e-01 3.82258e+02 254.560 -6.73833e+00 -2.43965e+01 0.00000e+00 0.00000e+00 3.70274e+02 254.560 1.19845e+01 74.560  0.9800 
1 1 1 0   32  11 o 9  3.22510e+01 6.46662e-01 4.21192e+02 196.316 -5.51254e+01 -1.61365e+01 0.00000e+00 0.00000e+00 7.73886e+02 196.316 3.52694e+02 196.316 0.9913 
1 1 1 0   32  12 o 15 1.81443e+01 5.69797e-01 3.94981e+02 136.867 -3.00992e+01 2.81984e+01  0.00000e+00 0.00000e+00 2.74551e+02 136.867 1.20429e+02 316.867 0.9878 
1 1 1 0   32  13 o 5  8.83500e+00 7.25798e-01 1.79849e+02 260.705 -2.08295e+00 -1.27263e+01 0.00000e+00 0.00000e+00 1.36884e+02 260.705 4.29653e+01 80.705  0.9604 
1 1 1 0   32  14 o 19 1.07918e+01 6.99015e-01 1.89958e+02 344.794 2.07012e+01  -5.62677e+00 0.00000e+00 0.00000e+00 2.03044e+02 344.794 1.30855e+01 344.794 0.9764 
1 1 1 0   32  15 o 4  1.27761e+01 7.32211e-01 2.57109e+02 222.116 -2.90456e+01 -2.62591e+01 0.00000e+00 0.00000e+00 2.12858e+02 222.116 4.42509e+01 42.116  0.9871 
1 1 1 0   32  16 o 4  3.98636e+00 1.12337e+00 1.18241e+02 56.330  3.33052e+00  4.99956e+00  0.00000e+00 0.00000e+00 1.71761e+01 56.330  1.01064e+02 236.330 0.9125 
1 1 1 0   32  17 o 7  1.08696e+01 1.10240e+00 2.41935e+02 248.271 -1.39091e+01 -3.49001e+01 0.00000e+00 0.00000e+00 1.56898e+02 248.271 8.50373e+01 68.271  0.9866 
1 1 1 0   32  18 o 2  6.10623e+00 1.50489e+00 1.16211e+02 40.859  6.37773e+00  5.51663e+00  0.00000e+00 0.00000e+00 9.67340e+01 40.859  1.94768e+01 220.859 0.9387 
1 1 1 0   32  19 o 11 4.11763e+00 1.33877e+00 8.43217e+01 337.161 4.73878e+00  -1.99576e+00 0.00000e+00 0.00000e+00 5.26767e+01 337.161 3.16450e+01 157.161 0.8966 
1 1 1 0   32  20 o 17 3.85707e+00 1.31048e+00 7.12079e+01 199.441 -4.81809e+00 -1.70055e+00 0.00000e+00 0.00000e+00 5.68666e+01 199.441 1.43413e+01 19.441  0.8959 
1 1 1 0   33  1  o 18 1.86647e+01 3.36948e-01 2.69899e+02 283.659 9.06730e-01  -3.73119e+00 0.00000e+00 0.00000e+00 3.30246e+02 283.659 6.03463e+01 283.659 0.8571 
1 1 1 0   33  2  o 4  1.22484e+01 2.58940e-01 2.87681e+02 330.142 2.63767e+00  -1.51414e+00 0.00000e+00 0.00000e+00 8.58706e+01 330.142 2.01810e+02 150.142 0.8130 
1 1 1 0   33  3  o 14 3.89241e+01 6.37917e-01 6.97354e+02 44.969  1.64431e+01  1.64252e+01  0.00000e+00 0.00000e+00 7.30818e+02 44.969  3.34643e+01 44.969  0.9782 
1 1 1 0   33  4  o 4  3.04998e+01 4.53258e-01 5.94326e+02 131.288 -1.13089e+01 1.28779e+01  0.00000e+00 0.00000e+00 5.15508e+02 131.288 7.88179e+01 311.288 0.9704 
1 1 1 0   33  5  o 13 4.85575e+01 7.27092e-01 1.06072e+03 125.759 -3.59410e+01 4.99079e+01  0.00000e+00 0.00000e+00 7.44788e+02 125.759 3.15930e+02 305.759 0.9918 
1 1 1 0   33  6  o 7  3.24979e+01 5.83813e-01 3.48875e+02 347.282 1.35455e+01  -3.05708e+00 0.00000e+00 0.00000e+00 8.24318e+02 347.282 4.75443e+02 347.282 0.9633 
1 1 1 0   33  7  o 18 5.68528e+01 8.73337e-01 1.10435e+03 220.258 -7.50340e+01 -6.35382e+01 0.00000e+00 0.00000e+00 1.01458e+03 220.258 8.97732e+01 40.258  0.9949 
1 1 1 0   33  8  o 6  1.76666e+01 4.01372e-01 3.29174e+02 324.335 8.11678e+00  -5.82498e+00 0.00000e+00 0.00000e+00 2.98304e+02 324.335 3.08701e+01 144.335 0.9486 
1 1 1 0   33  9  o 11 2.12580e+01 5.11520e-01 3.84884e+02 269.179 -3.13774e-01 -2.18994e+01 0.00000e+00 0.00000e+00 3.92312e+02 269.179 7.42834e+00 269.179 0.9769 
1 1 1 0   33  10 o 16 3.97290e+01 6.68975e-01 6.88886e+02 98.681  -1.27014e+01 8.31896e+01  0.00000e+00 0.00000e+00 7.88246e+02 98.681  9.93602e+01 98.681  0.9940 
1 1 1 0   33  11 o 18 1.42760e+01 5.39952e-01 2.14665e+02 177.102 -1.34649e+01 6.81722e-01  0.00000e+00 0.00000e+00 2.98770e+02 177.102 8.41044e+01 177.102 0.9622 
1 1 1 0   33  12 f 0  1.36171e+01 5.83664e-01 4.52364e+02 312.700 2.39398e+01  -2.59431e+01 0.00000e+00 0.00000e+00 4.90165e+01 312.700 4.03347e+02 132.700 0.9857 
1 1 1 0   33  13 o 6  1.50549e+01 6.86387e-01 1.60879e+02 150.962 -1.63756e+01 9.09143e+00  0.00000e+00 0.00000e+00 3.85824e+02 150.962 2.24944e+02 150.962 0.9729 
1 1 1 0   33  14 o 9  3.25540e+00 9.58612e-01 9.39365e+01 322.175 2.29413e+00  -1.78113e+00 0.00000e+00 0.00000e+00 3.51058e+00 322.175 9.04260e+01 142.175 0.8027 
1 1 1 0   33  15 o 19 9.48778e+00 8.38642e-01 1.15934e+02 38.843  1.07519e+01  8.65797e+00  0.00000e+00 0.00000e+00 2.24529e+02 38.843  1.08595e+02 38.843  0.9631 
1 1 1 0   33  16 o 2  5.00404e+00 1.25242e+00 8.01530e+01 294.925 2.00626e+00  -4.31721e+00 0.00000e+00 0.00000e+00 8.51708e+01 294.925 5.01784e+00 294.925 0.8875 
1 1 1 0   33  17 o 3  6.90555e+00 1.32474e+00 8.16620e+01 87.180  3.52431e-01  7.15431e+00  0.00000e+00 0.00000e+00 1.56472e+02 87.180  7.48105e+01 87.180  0.9273 
1 1 1 0   33  18 o 15 7.60304e+00 1.48249e+00 7.59182e+01 224.060 -5.05507e+00 -4.89186e+00 0.00000e+00 0.00000e+00 1.85595e+02 224.060 1.09677e+02 224.060 0.9259 
1 1 1 0   33  19 o 10 5.24722e+00 1.54843e+00 6.14190e+01 88.037  1.45127e-01  4.23518e+00  0.00000e+00 0.00000e+00 1.08377e+02 88.037  4.69581e+01 88.037  0.8721 
1 1 1 0   33  20 o 17 3.54895e+00 1.22820e+00 6.51462e+01 215.003 -3.79284e+00 -2.65610e+00 0.00000e+00 0.00000e+00 5.11323e+01 215.003 1.40139e+01 35.003  0.8840 
1 1 1 0   34  0  o 12 7.26440e+00 3.39779e-01 1.60305e+02 203.368 -4.01202e-01 -1.73352e-01 0.00000e+00 0.00000e+00 1.02131e+02 23.368  2.62436e+02 23.368  0.2135 
1 1 1 0   34  1  f 0  2.15395e+01 3.46817e-01 4.82031e+02 146.243 -7.53237e+00 5.03423e+00  0.00000e+00 0.00000e+00 2.79987e+02 146.243 2.02044e+02 326.243 0.9431 
1 1 1 0   34  2  o 2  1.59920e+01 2.93006e-01 2.81137e+02 207.401 -3.11250e+00 -1.61346e+00 0.00000e+00 0.00000e+00 2.23582e+02 207.401 5.75553e+01 27.401  0.8414 
1 1 1 0   34  3  o 8  2.51479e+01 4.93026e-01 2.91036e+02 330.234 5.67925e+00  -3.24807e+00 0.00000e+00 0.00000e+00 5.76692e+02 330.234 2.85656e+02 330.234 0.9200 
1 1 1 0   34  4  o 18 2.98304e+01 4.46201e-01 3.88055e+02 131.199 -6.85975e+00 7.83618e+00  0.00000e+00 0.00000e+00 6.75321e+02 131.199 2.87266e+02 131.199 0.9507 
1 1 1 0   34  5  o 10 2.20377e+01 3.89189e-01 4.56284e+02 235.382 -6.34847e+00 -9.19643e+00 0.00000e+00 0.00000e+00 3.31931e+02 235.382 1.24353e+02 55.382  0.9542 
1 1 1 0   34  6  o 19 3.67103e+01 5.90943e-01 5.36378e+02 324.089 2.07385e+01  -1.50185e+01 0.00000e+00 0.00000e+00 8.12126e+02 324.089 2.75748e+02 324.089 0.9803 
1 1 1 0   34  7  o 14 2.99542e+01 5.16675e-01 5.67947e+02 99.015  -4.12750e+00 2.60158e+01  0.00000e+00 0.00000e+00 5.32566e+02 99.015  3.53811e+01 279.015 0.9808 
1 1 1 0   34  8  o 18 2.80053e+01 6.11278e-01 4.06351e+02 222.914 -1.73574e+01 -1.61377e+01 0.00000e+00 0.00000e+00 6.19823e+02 222.914 2.13472e+02 222.914 0.9787 
1 1 1 0   34  9  o 15 3.98121e+01 6.58815e-01 6.28025e+02 95.080  -5.73757e+00 6.45383e+01  0.00000e+00 0.00000e+00 8.50255e+02 95.080  2.22230e+02 95.080  0.9923 
1 1 1 0   34  10 o 1  1.20281e+01 6.23237e-01 1.28652e+02 144.778 -4.02068e+00 2.83860e+00  0.00000e+00 0.00000e+00 2.72401e+02 144.778 1.43749e+02 144.778 0.8915 
1 1 1 0   34  11 o 7  1.84133e+01 5.09433e-01 2.55497e+02 92.543  -9.63444e-01 2.16966e+01  0.00000e+00 0.00000e+00 4.16675e+02 92.543  1.61178e+02 92.543  0.9767 
1 1 1 0   34  12 o 10 1.95472e+01 5.76669e-01 2.77312e+02 296.724 1.48950e+01  -2.95842e+01 0.00000e+00 0.00000e+00 4.41657e+02 296.724 1.64345e+02 296.724 0.9848 
1 1 1 0   34  13 o 19 6.01704e+00 9.22359e-01 1.51714e+02 192.094 -7.09340e+00 -1.51997e+00 0.00000e+00 0.00000e+00 5.67389e+01 192.094 9.49752e+01 12.094  0.9283 
1 1 1 0   34  14 o 18 1.48748e+01 6.43107e-01 2.24107e+02 129.831 -2.33045e+01 2.79397e+01  0.00000e+00 0.00000e+00 3.22901e+02 129.831 9.87943e+01 129.831 0.9862 
1 1 1 0   34  15 o 15 9.02031e+00 1.05166e+00 1.50790e+02 325.148 1.23310e+01  -8.58699e+00 0.00000e+00 0.00000e+00 1.73898e+02 325.148 2.31075e+01 325.148 0.9661 
1 1 1 0   34  16 o 14 4.13718e+00 1.19176e+00 8.56332e+01 115.060 -1.85038e+00 3.95729e+00  0.00000e+00 0.00000e+00 4.93166e+01 115.060 3.63166e+01 295.060 0.8763 
1 1 1 0   34  17 o 19 6.85099e+00 1.31011e+00 1.35423e+02 137.712 -8.43105e+00 7.66834e+00  0.00000e+00 0.00000e+00 1.07880e+02 137.712 2.75426e+01 317.712 0.9551 
1 1 1 0   34  18 o 15 4.76030e+00 1.36154e+00 7.59315e+01 55.154  2.75901e+00  3.96289e+00  0.00000e+00 0.00000e+00 8.13055e+01 55.154  5.37397e+00 55.154  0.8893 
1 1 1 0   34  19 o 18 6.93176e+00 1.62046e+00 1.08692e+02 268.512 -2.43790e-01 -9.38342e+00 0.00000e+00 0.00000e+00 1.34382e+02 268.512 2.56900e+01 268.512 0.9451 
1 1 1 0   35  1  o 7  2.73015e+01 4.12175e-01 3.19949e+02 144.037 -5.99452e+00 4.34936e+00  0.00000e+00 0.00000e+00 6.32229e+02 144.037 3.12280e+02 144.037 0.9298 
1 1 1 0   35  2  o 8  1.70395e+01 3.05358e-01 2.37094e+02 334.075 2.76584e+00  -1.34452e+00 0.00000e+00 0.00000e+00 2.84015e+02 334.075 4.69208e+01 334.075 0.8154 
1 1 1 0   35  3  o 5  1.33149e+01 3.00601e-01 2.31706e+02 171.435 -2.68255e+00 4.04019e-01  0.00000e+00 0.00000e+00 1.60897e+02 171.435 7.08086e+01 351.435 0.7863 
1 1 1 0   35  4  o 5  2.21518e+01 3.61437e-01 3.94985e+02 214.202 -7.68069e+00 -5.22013e+00 0.00000e+00 0.00000e+00 3.89457e+02 214.202 5.52815e+00 34.202  0.9445 
1 1 1 0   35  5  o 17 5.63054e+01 7.81688e-01 1.00404e+03 356.433 6.14906e+01  -3.83333e+00 0.00000e+00 0.00000e+00 1.08919e+03 356.433 8.51434e+01 356.433 0.9919 
1 1 1 0   35  6  o 4  3.09121e+01 5.79597e-01 4.71830e+02 121.158 -9.75052e+00 1.61266e+01  0.00000e+00 0.00000e+00 6.55263e+02 121.158 1.83433e+02 121.158 0.9731 
1 1 1 0   35  7  o 15 4.08893e+01 6.51268e-01 6.52694e+02 358.076 4.08636e+01  -1.37288e+00 0.00000e+00 0.00000e+00 8.59944e+02 358.076 2.07250e+02 358.076 0.9877 
1 1 1 0   35  8  o 9  2.30109e+01 5.02977e-01 4.13071e+02 231.393 -1.23752e+01 -1.54985e+01 0.00000e+00 0.00000e+00 4.26387e+02 231.393 1.33162e+01 231.393 0.9745 
1 1 1 0   35  9  o 19 2.24670e+01 5.44748e-01 3.31765e+02 7.024   1.92533e+01  2.37203e+00  0.00000e+00 0.00000e+00 4.86936e+02 7.024   1.55171e+02 7.024   0.9739 
1 1 1 0   35  10 o 19 1.50678e+01 4.73778e-01 3.01321e+02 124.138 -8.14919e+00 1.20191e+01  0.00000e+00 0.00000e+00 2.42393e+02 124.138 5.89278e+01 304.138 0.9649 
1 1 1 0   35  11 o 9  1.61431e+01 5.57162e-01 2.46158e+02 269.966 -1.07869e-02 -1.81940e+01 0.00000e+00 0.00000e+00 3.40322e+02 269.966 9.41632e+01 269.966 0.9721 
1 1 1 0   35  12 o 12 1.49890e+01 6.80416e-01 3.51161e+02 232.324 -1.97482e+01 -2.55732e+01 0.00000e+00 0.00000e+00 1.99883e+02 232.324 1.51277e+02 52.324  0.9844 
1 1 1 0   35  13 o 5  1.76830e+01 5.78914e-01 2.51754e+02 39.851  2.93238e+01  2.44757e+01  0.00000e+00 0.00000e+00 3.99433e+02 39.851  1.47679e+02 39.851  0.9868 
1 1 1 0   35  14 o 4  1.36138e+01 6.67398e-01 2.55437e+02 284.808 9.61950e+00  -3.63871e+01 0.00000e+00 0.00000e+00 2.45385e+02 284.808 1.00520e+01 104.808 0.9866 
1 1 1 0   35  15 o 12 8.14274e+00 9.54671e-01 1.71455e+02 132.220 -1.07784e+01 1.18784e+01  0.00000e+00 0.00000e+00 1.22277e+02 132.220 4.91781e+01 312.220 0.9683 
1 1 1 0   35  16 o 19 1.18464e+01 8.60267e-01 2.26881e+02 359.230 3.89656e+01  -5.23396e-01 0.00000e+00 0.00000e+00 2.08326e+02 359.230 1.85541e+01 179.230 0.9871 
1 1 1 0   35  17 o 1  7.46422e+00 1.39214e+00 9.71546e+01 213.849 -7.03221e+00 -4.71635e+00 0.00000e+00 0.00000e+00 1.63427e+02 213.849 6.62726e+01 213.849 0.9389 
1 1 1 0   35  18 o 14 5.11160e+00 1.34919e+00 5.76696e+01 103.902 -9.52808e-01 3.84951e+00  0.00000e+00 0.00000e+00 1.06017e+02 103.902 4.83477e+01 103.902 0.8622 
1 1 1 0   35  19 o 13 4.85502e+00 1.47418e+00 4.32099e+01 191.968 -2.85249e+00 -6.04669e-01 0.00000e+00 0.00000e+00 1.01526e+02 191.968 5.83161e+01 191.968 0.8036 
1 1 1 0   36  0  o 10 1.06441e+01 3.59295e-01 1.46219e+02 32.909  5.07163e-01  3.28207e-01  0.00000e+00 0.00000e+00 3.08187e+01 212.909 1.77037e+02 212.909 0.2891 
1 1 1 0   36  1  o 6  2.94694e+01 4.38381e-01 5.40409e+02 159.308 -1.14166e+01 4.31220e+00  0.00000e+00 0.00000e+00 5.18563e+02 159.308 2.18464e+01 339.308 0.9581 
1 1 1 0   36  2  o 12 1.67063e+01 3.04068e-01 2.65007e+02 256.297 -8.89176e-01 -3.64678e+00 0.00000e+00 0.00000e+00 2.69625e+02 256.297 4.61761e+00 256.297 0.8533 
1 1 1 0   36  3  o 6  2.14779e+01 3.77429e-01 1.53675e+02 17.786  2.98525e+00  9.57638e-01  0.00000e+00 0.00000e+00 5.06304e+02 17.786  3.52629e+02 17.786  0.8195 
1 1 1 0   36  4  o 7  3.30656e+01 4.86962e-01 5.09568e+02 311.896 1.17352e+01  -1.30807e+01 0.00000e+00 0.00000e+00 6.94210e+02 311.896 1.84642e+02 311.896 0.9711 
1 1 1 0   36  5  f 0  3.94838e+01 5.68822e-01 7.82549e+02 74.151  1.09936e+01  3.87248e+01  0.00000e+00 0.00000e+00 6.78735e+02 74.151  1.03814e+02 254.151 0.9875 
1 1 1 0   36  6  o 6  3.82604e+01 6.68802e-01 1.55087e+02 114.400 -3.10449e+00 6.84396e+00  0.00000e+00 0.00000e+00 1.17927e+03 114.400 1.02418e+03 114.400 0.9309 
1 1 1 0   36  7  o 3  5.82573e+01 8.94034e-01 9.33763e+02 331.031 8.79884e+01  -4.87111e+01 0.00000e+00 0.00000e+00 1.23714e+03 331.031 3.03380e+02 331.031 0.9950 
1 1 1 0   36  8  f 0  3.98027e+01 6.47073e-01 5.96226e+02 254.312 -1.38502e+01 -4.93124e+01 0.00000e+00 0.00000e+00 8.79115e+02 254.312 2.82889e+02 254.312 0.9902 
1 1 1 0   36  9  o 2  3.58055e+01 6.12813e-01 6.79281e+02 16.072  6.36596e+01  1.83411e+01  0.00000e+00 0.00000e+00 6.50201e+02 16.072  2.90794e+01 196.072 0.9924 
1 1 1 0   36  10 f 0  1.20522e+01 4.97033e-01 1.10326e+02 51.421  2.73210e+00  3.42497e+00  0.00000e+00 0.00000e+00 2.84783e+02 51.421  1.74457e+02 51.421  0.8767 
1 1 1 0   36  11 f 0  7.90860e+00 6.64900e-01 3.15061e+02 347.744 1.16300e+01  -2.52643e+00 0.00000e+00 0.00000e+00 3.22306e+01 167.744 3.47291e+02 167.744 0.9570 
1 1 1 0   36  12 o 8  2.07585e+01 5.46916e-01 3.36655e+02 218.968 -3.73250e+01 -3.01912e+01 0.00000e+00 0.00000e+00 4.30398e+02 218.968 9.37426e+01 218.968 0.9895 
1 1 1 0   36  13 o 8  1.49095e+01 5.67318e-01 2.92256e+02 311.649 2.52123e+01  -2.83485e+01 0.00000e+00 0.00000e+00 2.56690e+02 311.649 3.55661e+01 131.649 0.9867 
1 1 1 0   36  14 o 10 8.12662e+00 8.44659e-01 1.10054e+02 310.862 5.80430e+00  -6.70957e+00 0.00000e+00 0.00000e+00 1.75306e+02 310.862 6.52513e+01 310.862 0.9418 
1 1 1 0   36  15 o 7  1.50154e+01 7.05907e-01 2.47057e+02 118.788 -2.40621e+01 4.37914e+01  0.00000e+00 0.00000e+00 3.06640e+02 118.788 5.95828e+01 118.788 0.9899 
1 1 1 0   36  16 o 4  6.18888e+00 1.16621e+00 1.40000e+02 237.555 -5.79863e+00 -9.12132e+00 0.00000e+00 0.00000e+00 7.93892e+01 237.555 6.06106e+01 57.555  0.9526 
1 1 1 0   36  17 f 0  7.18619e+00 1.45989e+00 1.24014e+02 339.474 9.90318e+00  -3.70785e+00 0.00000e+00 0.00000e+00 1.30184e+02 339.474 6.17029e+00 339.474 0.9515 
1 1 1 0   36  18 o 1  5.47848e+00 1.39598e+00 5.40143e+01 220.286 -2.97600e+00 -2.52257e+00 0.00000e+00 0.00000e+00 1.20880e+02 220.286 6.68660e+01 220.286 0.8596 
1 1 1 0   36  19 o 5  6.29797e+00 1.73908e+00 5.29936e+01 275.510 3.77640e-01  -3.91449e+00 0.00000e+00 0.00000e+00 1.48131e+02 275.510 9.51373e+01 275.510 0.8609 
1 1 1 0   37  1  o 11 1.32883e+01 2.74737e-01 3.42747e+02 29.712  3.37707e+00  1.92721e+00  0.00000e+00 0.00000e+00 8.53668e+01 29.712  2.57380e+02 209.712 0.8591 
1 1 1 0   37  2  o 16 1.14614e+01 2.68760e-01 8.86061e+01 341.540 8.50533e-01  -2.83917e-01 0.00000e+00 0.00000e+00 8.69969e+01 341.540 1.60915e+00 161.540 0.4086 
1 1 1 0   37  3  o 16 2.08917e+01 3.48038e-01 3.80477e+02 358.146 7.17055e+00  -2.32082e-01 0.00000e+00 0.00000e+00 3.45967e+02 358.146 3.45100e+01 178.146 0.9274 
1 1 1 0   37  4  o 15 1.94788e+01 3.39530e-01 2.36930e+02 61.141  2.68699e+00  4.87565e+00  0.00000e+00 0.00000e+00 4.23906e+02 61.141  1.86975e+02 61.141  0.9051 
1 1 1 0   37  5  o 10 8.64144e+00 2.93854e-01 2.07787e+02 313.791 1.47605e+00  -1.53967e+00 0.00000e+00 0.00000e+00 2.48668e+01 313.791 1.82920e+02 133.791 0.7184 
1 1 1 0   37  6  o 14 4.91331e+01 7.40823e-01 9.13485e+02 196.216 -5.63368e+01 -1.63840e+01 0.00000e+00 0.00000e+00 9.11378e+02 196.216 2.10727e+00 16.216  0.9914 
1 1 1 0   37  7  o 7  6.38948e+01 9.89408e-01 1.01464e+03 303.570 6.13770e+01  -9.24834e+01 0.00000e+00 0.00000e+00 1.36723e+03 303.570 3.52593e+02 303.570 0.9955 
1 1 1 0   37  8  o 16 3.03624e+01 5.39001e-01 4.10950e+02 189.018 -2.73184e+01 -4.33549e+00 0.00000e+00 0.00000e+00 7.04775e+02 189.018 2.93825e+02 189.018 0.9818 
1 1 1 0   37  9  o 7  2.95291e+01 7.54496e-01 3.76851e+02 27.922  2.71048e+01  1.43644e+01  0.00000e+00 0.00000e+00 7.09687e+02 27.922  3.32837e+02 27.922  0.9836 
1 1 1 0   37  10 o 15 2.96370e+01 5.58851e-01 7.56965e+02 272.391 3.31588e+00  -7.94182e+01 0.00000e+00 0.00000e+00 3.44130e+02 272.391 4.12835e+02 92.391  0.9937 
1 1 1 0   37  11 o 11 2.31463e+01 5.27619e-01 3.60373e+02 151.167 -3.45589e+01 1.90246e+01  0.00000e+00 0.00000e+00 4.93448e+02 151.167 1.33074e+02 151.167 0.9872 
1 1 1 0   37  12 o 5  3.87042e+01 7.03071e-01 6.56700e+02 234.790 -1.01383e+02 -1.43669e+02 0.00000e+00 0.00000e+00 7.84340e+02 234.790 1.27640e+02 234.790 0.9972 
1 1 1 0   37  13 o 16 2.92464e+00 8.28703e-01 3.36236e+01 304.784 4.83733e-01  -6.96412e-01 0.00000e+00 0.00000e+00 8.92447e+00 304.784 2.46992e+01 124.784 0.3899 
1 1 1 0   37  14 o 14 3.45621e+00 9.49299e-01 1.34041e+02 47.359  3.16224e+00  3.43400e+00  0.00000e+00 0.00000e+00 2.00036e+01 227.359 1.54044e+02 227.359 0.8851 
1 1 1 0   37  15 o 16 1.22596e+01 9.39318e-01 1.41758e+02 218.572 -1.67771e+01 -1.33797e+01 0.00000e+00 0.00000e+00 3.04097e+02 218.572 1.62339e+02 218.572 0.9764 
1 1 1 0   37  16 o 15 6.75659e+00 1.23515e+00 1.04499e+02 116.538 -3.79105e+00 7.59101e+00  0.00000e+00 0.00000e+00 1.31603e+02 116.538 2.71041e+01 116.538 0.9391 
1 1 1 0   37  17 o 17 3.95950e+00 1.27548e+00 7.83180e+01 247.630 -1.63120e+00 -3.96340e+00 0.00000e+00 0.00000e+00 5.02777e+01 247.630 2.80403e+01 67.630  0.8737 
1 1 1 0   37  18 o 15 3.52662e+00 1.11895e+00 3.72565e+01 250.216 -7.34851e-01 -2.04294e+00 0.00000e+00 0.00000e+00 5.75507e+01 250.216 2.02941e+01 250.216 0.7240 
1 1 1 0   37  19 o 4  4.89320e+00 1.54274e+00 7.51889e+01 63.513  2.28532e+00  4.58623e+00  0.00000e+00 0.00000e+00 8.74660e+01 63.513  1.22771e+01 63.513  0.8962 
1 1 1 0   38  0  o 11 2.52492e+01 5.54281e-01 4.62384e+02 128.966 -3.28371e+00 4.05999e+00  0.00000e+00 0.00000e+00 3.88133e+02 128.966 7.42508e+01 308.966 0.8983 
1 1 1 0   38  1  o 3  2.52250e+01 3.92790e-01 5.67853e+02 69.696  4.40656e+00  1.19099e+01  0.00000e+00 0.00000e+00 3.39994e+02 69.696  2.27860e+02 249.696 0.9598 
1 1 1 0   38  2  o 16 8.11056e+00 2.60431e-01 1.22164e+02 239.677 -4.76989e-01 -8.15505e-01 0.00000e+00 0.00000e+00 7.52736e+00 239.677 1.14637e+02 59.677  0.4265 
1 1 1 0   38  3  o 14 1.57702e+01 3.02326e-01 2.51816e+02 54.744  2.43618e+00  3.44633e+00  0.00000e+00 0.00000e+00 2.63417e+02 54.744  1.16012e+01 54.744  0.8715 
1 1 1 0   38  4  o 13 3.72531e+01 5.39017e-01 8.10356e+02 227.233 -2.27036e+01 -2.45460e+01 0.00000e+00 0.00000e+00 5.64885e+02 227.233 2.45470e+02 47.233  0.9849 
1 1 1 0   38  5  o 12 2.11524e+01 3.65866e-01 4.12711e+02 66.913  4.20925e+00  9.87455e+00  0.00000e+00 0.00000e+00 3.42007e+02 66.913  7.07032e+01 246.913 0.9522 
1 1 1 0   38  6  o 5  1.70361e+01 3.57064e-01 3.62488e+02 327.184 7.05544e+00  -4.54961e+00 0.00000e+00 0.00000e+00 2.36343e+02 327.184 1.26145e+02 147.185 0.9384 
1 1 1 0   38  7  o 19 1.28072e+01 3.96058e-01 1.89906e+02 75.707  1.02785e+00  4.03463e+00  0.00000e+00 0.00000e+00 2.27068e+02 75.707  3.71622e+01 75.707  0.8695 
1 1 1 0   38  8  o 12 1.50860e+01 5.13131e-01 2.09901e+02 8.212   7.67268e+00  1.10729e+00  0.00000e+00 0.00000e+00 3.16922e+02 8.212   1.07021e+02 8.212   0.9331 
1 1 1 0   38  9  o 7  3.15494e+01 5.65554e-01 6.40761e+02 310.944 3.98788e+01  -4.59652e+01 0.00000e+00 0.00000e+00 5.29657e+02 310.944 1.11104e+02 130.944 0.9917 
1 1 1 0   38  10 o 6  8.97982e+00 5.60260e-01 1.33158e+02 79.891  7.22371e-01  4.05156e+00  0.00000e+00 0.00000e+00 1.58177e+02 79.891  2.50186e+01 79.891  0.8678 
1 1 1 0   38  11 o 6  2.13320e+01 5.27962e-01 3.32529e+02 65.628  1.48591e+01  3.27987e+01  0.00000e+00 0.00000e+00 4.53306e+02 65.628  1.20777e+02 65.628  0.9860 
1 1 1 0   38  12 o 13 1.83301e+01 5.49847e-01 3.69109e+02 222.871 -3.71159e+01 -3.44555e+01 0.00000e+00 0.00000e+00 3.08449e+02 222.871 6.06599e+01 42.871  0.9901 
1 1 1 0   38  13 o 13 5.40923e+00 8.92126e-01 6.22982e+01 268.760 -6.16975e-02 -2.85019e+00 0.00000e+00 0.00000e+00 9.88014e+01 268.760 3.65032e+01 268.760 0.7983 
1 1 1 0   38  14 o 14 1.04149e+01 6.99360e-01 1.09416e+02 289.449 3.88614e+00  -1.10051e+01 0.00000e+00 0.00000e+00 2.61778e+02 289.449 1.52362e+02 289.449 0.9561 
1 1 1 0   38  15 o 13 2.55785e+00 8.49017e-01 8.30130e+01 210.388 -2.43201e+00 -1.42620e+00 0.00000e+00 0.00000e+00 7.21539e+00 30.389  9.02283e+01 30.389  0.7957 
1 1 1 0   38  16 o 5  8.95107e+00 1.07413e+00 1.70764e+02 75.044  5.35768e+00  2.00563e+01  0.00000e+00 0.00000e+00 1.54156e+02 75.044  1.66082e+01 255.044 0.9756 
1 1 1 0   38  17 o 14 8.69420e+00 1.32260e+00 1.42140e+02 279.759 2.68254e+00  -1.55971e+01 0.00000e+00 0.00000e+00 1.70638e+02 279.759 2.84982e+01 279.759 0.9679 
1 1 1 0   38  18 f 0  5.98936e+00 1.63740e+00 8.00707e+01 75.076  1.41208e+00  5.29815e+00  0.00000e+00 0.00000e+00 1.20853e+02 75.076  4.07824e+01 75.076  0.9035 
1 1 1 0   38  19 o 16 6.40819e+00 1.66737e+00 1.02037e+02 240.132 -4.19413e+00 -7.30313e+00 0.00000e+00 0.00000e+00 1.21037e+02 240.132 1.90001e+01 240.132 0.9386 
1 1 1 0   39  1  o 3  2.47152e+01 3.88641e-01 4.79807e+02 15.757  1.09147e+01  3.07961e+00  0.00000e+00 0.00000e+00 4.05020e+02 15.757  7.47867e+01 195.756 0.9548 
1 1 1 0   39  2  o 9  1.75370e+01 3.18264e-01 2.24441e+02 235.492 -2.01607e+00 -2.93252e+00 0.00000e+00 0.00000e+00 3.30542e+02 235.492 1.06102e+02 235.492 0.8441 
1 1 1 0   39  3  o 4  1.62382e+01 3.09859e-01 2.47981e+02 215.674 -3.41901e+00 -2.45446e+00 0.00000e+00 0.00000e+00 2.82245e+02 215.674 3.42630e+01 215.674 0.8711 
1 1 1 0   39  4  o 5  2.44216e+01 3.92576e-01 5.21757e+02 222.177 -1.03717e+01 -9.39686e+00 0.00000e+00 0.00000e+00 3.60160e+02 222.177 1.61598e+02 42.177  0.9636 
1 1 1 0   39  5  o 14 1.31723e+01 3.36809e-01 1.81977e+02 198.734 -2.96376e+00 -1.00516e+00 0.00000e+00 0.00000e+00 2.22278e+02 198.734 4.03012e+01 198.734 0.8191 
1 1 1 0   39  6  o 18 2.46985e+01 4.65544e-01 4.60803e+02 116.748 -8.13367e+00 1.61385e+01  0.00000e+00 0.00000e+00 4.38287e+02 116.748 2.25159e+01 296.748 0.9719 
1 1 1 0   39  7  o 12 3.68457e+01 6.05668e-01 5.37805e+02 276.339 3.73965e+00  -3.36638e+01 0.00000e+00 0.00000e+00 8.21150e+02 276.339 2.83345e+02 276.339 0.9851 
1 1 1 0   39  8  o 15 5.19538e+00 5.69613e-01 2.31156e+02 268.610 -7.07577e-02 -2.91707e+00 0.00000e+00 0.00000e+00 7.48932e+01 88.610  3.06049e+02 88.610  0.8037 
1 1 1 0   39  9  o 5  2.99358e+01 5.47925e-01 3.74399e+02 222.523 -2.36656e+01 -2.17027e+01 0.00000e+00 0.00000e+00 7.27703e+02 222.523 3.53304e+02 222.523 0.9843 
1 1 1 0   39  10 o 7  3.23976e+01 5.90472e-01 4.60033e+02 213.619 -4.83266e+01 -3.21315e+01 0.00000e+00 0.00000e+00 7.40539e+02 213.619 2.80505e+02 213.619 0.9913 
1 1 1 0   39  11 o 11 1.32074e+01 5.41930e-01 1.88882e+02 52.967  8.17279e+00  1.08329e+01  0.00000e+00 0.00000e+00 2.85964e+02 52.967  9.70821e+01 52.967  0.9624 
1 1 1 0   39  12 o 3  1.58282e+01 5.42453e-01 3.51049e+02 166.223 -4.02991e+01 9.88153e+00  0.00000e+00 0.00000e+00 2.32663e+02 166.223 1.18386e+02 346.223 0.9879 
1 1 1 0   39  13 o 7  2.12189e+01 9.05150e-01 3.38654e+02 329.279 5.20117e+01  -3.09079e+01 0.00000e+00 0.00000e+00 4.46287e+02 329.279 1.07633e+02 329.279 0.9917 
1 1 1 0   39  14 o 14 1.17074e+01 6.92676e-01 1.98262e+02 194.673 -2.49655e+01 -6.53717e+00 0.00000e+00 0.00000e+00 2.29548e+02 194.673 3.12856e+01 194.673 0.9804 
1 1 1 0   39  15 o 14 1.59315e+01 6.85651e-01 3.09878e+02 97.331  -8.45396e+00 6.57123e+01  0.00000e+00 0.00000e+00 2.78889e+02 97.331  3.09888e+01 277.331 0.9924 
1 1 1 0   39  16 o 7  6.90650e+00 1.20483e+00 8.53466e+01 320.296 5.72004e+00  -4.74959e+00 0.00000e+00 0.00000e+00 1.53634e+02 320.296 6.82873e+01 320.296 0.9301 
1 1 1 0   39  17 o 9  9.10895e+00 1.44065e+00 1.14528e+02 106.118 -3.49360e+00 1.20895e+01  0.00000e+00 0.00000e+00 2.10269e+02 106.118 9.57415e+01 106.118 0.9594 
1 1 1 0   39  18 o 13 5.96207e+00 1.57430e+00 6.49621e+01 180.003 -4.68988e+00 -2.87583e-04 0.00000e+00 0.00000e+00 1.31076e+02 180.003 6.61137e+01 180.003 0.8857 
1 1 1 0   39  19 f 0  4.44338e+00 1.45347e+00 6.61625e+01 70.056  1.53984e+00  4.24364e+00  0.00000e+00 0.00000e+00 7.89664e+01 70.056  1.28039e+01 70.056  0.8808 
1 1 1 0   40  0  o 15 9.27200e+01 1.80612e+00 1.84001e+03 255.179 -2.01032e+01 -7.59759e+01 0.00000e+00 0.00000e+00 1.61399e+03 255.179 2.26029e+02 75.179  0.9936 
1 1 1 0   40  1  o 5  1.81189e+01 3.22265e-01 3.27677e+02 330.980 4.71062e+00  -2.61332e+00 0.00000e+00 0.00000e+00 2.84790e+02 330.980 4.28878e+01 150.980 0.9016 
1 1 1 0   40  2  o 4  3.02776e+01 4.54800e-01 6.40842e+02 27.121  1.83199e+01  9.38336e+00  0.00000e+00 0.00000e+00 4.66238e+02 27.121  1.74604e+02 207.121 0.9754 
1 1 1 0   40  3  o 14 1.10656e+01 2.79745e-01 2.63373e+02 298.985 1.70223e+00  -3.07279e+00 0.00000e+00 0.00000e+00 8.57502e+01 298.985 1.77623e+02 118.985 0.8418 
1 1 1 0   40  4  o 5  2.73390e+01 4.25809e-01 6.60207e+02 228.843 -1.54899e+01 -1.77208e+01 0.00000e+00 0.00000e+00 3.42261e+02 228.843 3.17945e+02 48.843  0.9785 
1 1 1 0   40  5  o 12 3.02259e+01 5.38320e-01 4.91410e+02 209.910 -1.64414e+01 -9.45794e+00 0.00000e+00 0.00000e+00 6.10665e+02 209.910 1.19256e+02 209.910 0.9733 
1 1 1 0   40  6  o 14 3.79463e+01 5.93566e-01 7.46519e+02 54.217  2.55068e+01  3.53881e+01  0.00000e+00 0.00000e+00 6.58185e+02 54.217  8.83336e+01 234.217 0.9885 
1 1 1 0   40  7  o 9  1.81357e+01 4.76395e-01 4.06907e+02 236.408 -8.56942e+00 -1.29017e+01 0.00000e+00 0.00000e+00 2.49710e+02 236.408 1.57197e+02 56.408  0.9672 
1 1 1 0   40  8  o 2  1.02990e+01 7.77111e-01 1.67175e+02 245.783 -1.66819e+00 -3.70896e+00 0.00000e+00 0.00000e+00 1.66571e+02 245.783 6.03830e-01 65.783  0.8660 
1 1 1 0   40  9  f 0  1.75032e+01 5.31522e-01 3.32604e+02 226.092 -1.29972e+01 -1.35024e+01 0.00000e+00 0.00000e+00 3.04281e+02 226.092 2.83226e+01 46.092  0.9729 
1 1 1 0   40  10 o 11 1.61073e+01 4.92107e-01 3.58019e+02 285.045 6.45482e+00  -2.40137e+01 0.00000e+00 0.00000e+00 2.31787e+02 285.045 1.26231e+02 105.045 0.9797 
1 1 1 0   40  11 o 2  1.53241e+01 6.09375e-01 1.62725e+02 33.728  1.22993e+01  8.21141e+00  0.00000e+00 0.00000e+00 3.89968e+02 33.728  2.27243e+02 33.728  0.9656 
1 1 1 0   40  12 o 1  2.18930e+01 8.20389e-01 2.10764e+02 291.450 1.20280e+01  -3.06134e+01 0.00000e+00 0.00000e+00 5.93907e+02 291.450 3.83143e+02 291.450 0.9847 
1 1 1 0   40  13 o 5  8.00434e+00 7.28284e-01 1.02500e+02 345.636 7.39112e+00  -1.89270e+00 0.00000e+00 0.00000e+00 1.75732e+02 345.636 7.32320e+01 345.636 0.9320 
1 1 1 0   40  14 o 6  9.72223e+00 7.41660e-01 1.14999e+02 296.569 5.74275e+00  -1.14837e+01 0.00000e+00 0.00000e+00 2.32915e+02 296.569 1.17916e+02 296.569 0.9602 
1 1 1 0   40  15 o 9  5.86469e+00 1.08529e+00 9.81332e+01 181.609 -6.75821e+00 -1.89865e-01 0.00000e+00 0.00000e+00 1.03368e+02 181.609 5.23480e+00 181.609 0.9228 
1 1 1 0   40  16 o 13 1.13564e+01 9.41613e-01 1.53217e+02 245.800 -9.71638e+00 -2.16195e+01 0.00000e+00 0.00000e+00 2.60221e+02 245.800 1.07004e+02 245.800 0.9787 
1 1 1 0   40  17 o 1  5.36881e+00 1.35510e+00 3.97690e+01 7.083   2.55782e+00  3.17808e-01  0.00000e+00 0.00000e+00 1.14489e+02 7.083   7.47197e+01 7.083   0.7732 
1 1 1 0   40  18 o 3  6.33192e+00 1.60701e+00 7.21975e+01 31.570  4.74749e+00  2.91731e+00  0.00000e+00 0.00000e+00 1.40562e+02 31.570  6.83642e+01 31.570  0.9052 
1 1 1 0   40  19 o 7  9.41473e+00 1.70668e+00 1.64454e+02 166.953 -1.80088e+01 4.17316e+00  0.00000e+00 0.00000e+00 1.75067e+02 166.953 1.06124e+01 166.953 0.9726 
1 1 1 0   41  1  o 1  2.67757e+01 4.41876e-01 1.78069e+02 18.327  4.81587e+00  1.59519e+00  0.00000e+00 0.00000e+00 7.20306e+02 18.327  5.42237e+02 18.327  0.8951 
1 1 1 0   41  2  o 12 4.17140e+01 5.93837e-01 6.80039e+02 63.052  1.33652e+01  2.62897e+01  0.00000e+00 0.00000e+00 8.56765e+02 63.052  1.76726e+02 63.052  0.9829 
1 1 1 0   41  3  o 10 3.84172e+01 5.54882e-01 6.34214e+02 229.444 -1.74985e+01 -2.04478e+01 0.00000e+00 0.00000e+00 7.78533e+02 229.444 1.44319e+02 229.444 0.9812 
1 1 1 0   41  4  o 2  1.64803e+01 3.24751e-01 3.26297e+02 69.206  2.25858e+00  5.94761e+00  0.00000e+00 0.00000e+00 2.40342e+02 69.206  8.59549e+01 249.206 0.9176 
1 1 1 0   41  5  o 6  1.87379e+01 3.50609e-01 2.21938e+02 159.364 -5.15941e+00 1.94296e+00  0.00000e+00 0.00000e+00 4.12615e+02 159.364 1.90677e+02 159.364 0.9041 
1 1 1 0   41  6  o 15 3.49090e+01 6.04918e-01 4.34128e+02 313.007 1.94463e+01  -2.08488e+01 0.00000e+00 0.00000e+00 8.49936e+02 313.007 4.15808e+02 313.007 0.9823 
1 1 1 0   41  7  o 5  1.52726e+01 5.02956e-01 2.64139e+02 282.217 1.78316e+00  -8.23535e+00 0.00000e+00 0.00000e+00 2.72449e+02 282.217 8.31051e+00 282.217 0.9386 
1 1 1 0   41  8  o 7  3.20524e+01 5.66972e-01 5.11909e+02 127.740 -2.67288e+01 3.45330e+01  0.00000e+00 0.00000e+00 6.73482e+02 127.740 1.61573e+02 127.740 0.9885 
1 1 1 0   41  9  o 16 2.96836e+01 5.49231e-01 3.93143e+02 259.769 -6.42953e+00 -3.56226e+01 0.00000e+00 0.00000e+00 7.01416e+02 259.769 3.08272e+02 259.769 0.9861 
1 1 1 0   41  10 o 9  1.95132e+01 4.90428e-01 3.00272e+02 122.608 -1.35446e+01 2.11726e+01  0.00000e+00 0.00000e+00 4.14330e+02 122.608 1.14058e+02 122.608 0.9799 
1 1 1 0   41  11 o 9  1.19871e+01 5.59948e-01 1.07415e+02 184.419 -7.34607e+00 -5.67711e-01 0.00000e+00 0.00000e+00 3.08690e+02 184.419 2.01276e+02 184.419 0.9294 
1 1 1 0   41  12 o 19 2.04515e+01 6.33684e-01 2.68378e+02 163.881 -3.81857e+01 1.10356e+01  0.00000e+00 0.00000e+00 4.85261e+02 163.881 2.16883e+02 163.881 0.9873 
1 1 1 0   41  13 o 9  1.27153e+01 6.13849e-01 1.91840e+02 253.543 -6.67573e+00 -2.25987e+01 0.00000e+00 0.00000e+00 2.72191e+02 253.543 8.03513e+01 253.543 0.9785 
1 1 1 0   41  14 o 7  1.58365e+01 6.37855e-01 2.67103e+02 84.764  4.82688e+00  5.26761e+01  0.00000e+00 0.00000e+00 3.17411e+02 84.764  5.03079e+01 84.764  0.9905 
1 1 1 0   41  15 o 16 8.50765e+00 1.00284e+00 1.72961e+02 286.464 5.35251e+00  -1.81112e+01 0.00000e+00 0.00000e+00 1.35277e+02 286.464 3.76843e+01 106.464 0.9732 
1 1 1 0   41  16 o 3  4.59601e+00 1.17710e+00 4.08395e+01 311.452 1.65488e+00  -1.87366e+00 0.00000e+00 0.00000e+00 8.99328e+01 311.452 4.90933e+01 311.452 0.7650 
1 1 1 0   41  17 o 16 7.32788e+00 1.37902e+00 1.57730e+02 338.838 1.36949e+01  -5.30140e+00 0.00000e+00 0.00000e+00 1.05115e+02 338.838 5.26152e+01 158.838 0.9653 
1 1 1 0   41  18 o 13 4.62653e+00 1.41016e+00 1.04070e+02 101.148 -1.26523e+00 6.42047e+00  0.00000e+00 0.00000e+00 5.39284e+01 101.148 5.01418e+01 281.148 0.9201 
1 1 1 0   41  19 o 9  7.58093e+00 1.64870e+00 8.51119e+01 340.494 7.91177e+00  -2.80263e+00 0.00000e+00 0.00000e+00 1.78641e+02 340.494 9.35289e+01 340.494 0.9384 
1 1 1 0   42  0  f 0  4.58549e+01 9.12719e-01 9.40090e+02 215.188 -1.84767e+01 -1.30282e+01 0.00000e+00 0.00000e+00 7.40229e+02 215.188 1.99861e+02 35.188  0.9776 
1 1 1 0   42  1  o 5  3.15512e+01 4.69588e-01 5.56888e+02 60.060  9.16116e+00  1.59059e+01  0.00000e+00 0.00000e+00 5.93024e+02 60.060  3.61356e+01 60.060  0.9724 
1 1 1 0   42  2  o 16 3.99184e+01 6.14990e-01 6.16903e+02 147.615 -2.48726e+01 1.57757e+01  0.00000e+00 0.00000e+00 8.53546e+02 147.615 2.36644e+02 147.615 0.9829 
1 1 1 0   42  3  o 7  3.39604e+01 5.01654e-01 5.57251e+02 226.981 -1.69408e+01 -1.81546e+01 0.00000e+00 0.00000e+00 6.89434e+02 226.981 1.32182e+02 226.981 0.9797 
1 1 1 0   42  4  f 0  8.06166e+01 1.10234e+00 1.56174e+03 64.151  6.56033e+01  1.35409e+02  0.00000e+00 0.00000e+00 1.44846e+03 64.151  1.13274e+02 244.151 0.9967 
1 1 1 0   42  5  o 1  4.73443e+01 6.70811e-01 8.76336e+02 18.870  5.30634e+01  1.81365e+01  0.00000e+00 0.00000e+00 8.81024e+02 18.870  4.68846e+00 18.870  0.9910 
1 1 1 0   42  6  o 13 5.24155e+01 7.89046e-01 7.25992e+02 53.710  3.90573e+01  5.31897e+01  0.00000e+00 0.00000e+00 1.22160e+03 53.710  4.95608e+02 53.710  0.9924 
1 1 1 0   42  7  o 6  4.19459e+01 6.73054e-01 7.44408e+02 211.885 -5.71633e+01 -3.55605e+01 0.00000e+00 0.00000e+00 8.13784e+02 211.885 6.93759e+01 211.885 0.9925 
1 1 1 0   42  8  o 1  2.11597e+01 4.47513e-01 4.16439e+02 221.874 -1.71533e+01 -1.53770e+01 0.00000e+00 0.00000e+00 3.57761e+02 221.874 5.86781e+01 41.875  0.9780 
1 1 1 0   42  9  o 3  2.19568e+01 5.44639e-01 2.30965e+02 113.875 -6.56049e+00 1.48222e+01  0.00000e+00 0.00000e+00 5.64262e+02 113.875 3.33297e+02 113.875 0.9686 
1 1 1 0   42  10 o 17 1.09007e+01 5.24800e-01 1.84170e+02 171.554 -8.74221e+00 1.29805e+00  0.00000e+00 0.00000e+00 1.99386e+02 171.554 1.52159e+01 171.554 0.9416 
1 1 1 0   42  11 o 8  2.11957e+01 5.27337e-01 4.29003e+02 24.480  4.78344e+01  2.17788e+01  0.00000e+00 0.00000e+00 3.54974e+02 24.480  7.40286e+01 204.480 0.9904 
1 1 1 0   42  12 o 13 1.05975e+01 6.14966e-01 1.80044e+02 327.616 1.23515e+01  -7.83365e+00 0.00000e+00 0.00000e+00 2.01668e+02 327.616 2.16244e+01 327.616 0.9652 
1 1 1 0   42  13 o 12 1.01491e+01 6.62619e-01 8.19207e+01 42.582  5.85126e+00  5.37713e+00  0.00000e+00 0.00000e+00 2.71854e+02 42.582  1.89934e+02 42.582  0.9348 
1 1 1 0   42  14 o 12 6.70330e+00 9.54628e-01 1.19613e+02 288.286 2.92777e+00  -8.86012e+00 0.00000e+00 0.00000e+00 1.16357e+02 288.286 3.25561e+00 108.286 0.9448 
1 1 1 0   42  15 o 3  7.76364e+00 1.02167e+00 1.20216e+02 137.894 -8.61798e+00 7.78863e+00  0.00000e+00 0.00000e+00 1.56059e+02 137.894 3.58430e+01 137.894 0.9559 
1 1 1 0   42  16 f 0  4.72807e+00 1.21615e+00 7.18034e+01 297.196 1.89544e+00  -3.68882e+00 0.00000e+00 0.00000e+00 8.09942e+01 297.196 9.19075e+00 297.196 0.8690 
1 1 1 0   42  17 o 2  6.49298e+00 1.50237e+00 1.66496e+02 134.111 -8.72982e+00 9.00491e+00  0.00000e+00 0.00000e+00 6.49131e+01 134.111 1.01583e+02 314.111 0.9593 
1 1 1 0   42  18 o 10 6.50934e+00 1.50601e+00 1.33507e+02 200.626 -1.02700e+01 -3.86547e+00 0.00000e+00 0.00000e+00 9.67927e+01 200.626 3.67138e+01 20.626  0.9533 
1 1 1 0   42  19 o 11 1.25057e+01 1.27377e+00 1.99038e+02 43.094  3.18789e+01  2.98251e+01  0.00000e+00 0.00000e+00 2.59229e+02 43.094  6.01913e+01 43.094  0.9885 
1 1 1 0   43  1  o 10 5.44625e+01 7.55911e-01 9.48222e+02 223.019 -4.50412e+01 -4.20290e+01 0.00000e+00 0.00000e+00 1.07625e+03 223.019 1.28027e+02 223.019 0.9919 
1 1 1 0   43  2  o 4  3.33834e+01 5.27682e-01 5.20967e+02 7.228   1.90419e+01  2.41502e+00  0.00000e+00 0.00000e+00 6.97001e+02 7.228   1.76034e+02 7.228   0.9736 
1 1 1 0   43  3  o 12 2.07522e+01 3.59501e-01 3.83265e+02 46.414  6.53084e+00  6.86149e+00  0.00000e+00 0.00000e+00 3.52016e+02 46.414  3.12497e+01 226.414 0.9456 
1 1 1 0   43  4  o 5  4.34844e+01 6.21065e-01 6.16311e+02 69.110  1.23418e+01  3.23363e+01  0.00000e+00 0.00000e+00 9.88914e+02 69.110  3.72603e+02 69.110  0.9854 
1 1 1 0   43  5  o 1  1.45988e+01 3.25542e-01 2.75294e+02 144.830 -5.24512e+00 3.69591e+00  0.00000e+00 0.00000e+00 2.26806e+02 144.830 4.84884e+01 324.830 0.9184 
1 1 1 0   43  6  o 10 6.51262e+01 9.62634e-01 1.26465e+03 266.715 -7.88876e+00 -1.37436e+02 0.00000e+00 0.00000e+00 1.16462e+03 266.715 1.00033e+02 86.715  0.9964 
1 1 1 0   43  7  o 12 3.06942e+01 5.34827e-01 3.93742e+02 305.873 1.56960e+01  -2.17050e+01 0.00000e+00 0.00000e+00 7.33256e+02 305.873 3.39513e+02 305.873 0.9812 
1 1 1 0   43  8  o 6  2.43538e+01 4.87753e-01 6.13562e+02 5.294   4.07819e+01  3.77885e+00  0.00000e+00 0.00000e+00 2.86206e+02 5.294   3.27356e+02 185.294 0.9877 
1 1 1 0   43  9  o 12 2.21736e+01 4.85768e-01 3.80588e+02 56.594  1.53563e+01  2.32841e+01  0.00000e+00 0.00000e+00 4.33392e+02 56.594  5.28037e+01 56.594  0.9819 
1 1 1 0   43  10 o 13 3.05947e+01 8.35779e-01 3.08372e+02 144.431 -3.40772e+01 2.43690e+01  0.00000e+00 0.00000e+00 8.21045e+02 144.431 5.12672e+02 144.431 0.9880 
1 1 1 0   43  11 o 8  1.48176e+01 5.16755e-01 2.84322e+02 37.504  2.06068e+01  1.58146e+01  0.00000e+00 0.00000e+00 2.58213e+02 37.504  2.61089e+01 217.504 0.9806 
1 1 1 0   43  12 o 5  9.14378e+00 6.56885e-01 9.45623e+01 139.110 -5.37279e+00 4.65239e+00  0.00000e+00 0.00000e+00 2.21622e+02 139.110 1.27060e+02 139.110 0.9267 
1 1 1 0   43  13 o 15 1.30348e+01 5.96259e-01 1.62917e+02 160.073 -2.14666e+01 7.78239e+00  0.00000e+00 0.00000e+00 3.12327e+02 160.073 1.49410e+02 160.073 0.9779 
1 1 1 0   43  14 o 14 4.79427e+00 1.03052e+00 9.26912e+01 197.020 -4.77644e+00 -1.46211e+00 0.00000e+00 0.00000e+00 6.68552e+01 197.020 2.58359e+01 17.020  0.8933 
1 1 1 0   43  15 o 17 4.11239e+00 9.73099e-01 1.00694e+02 140.572 -4.00772e+00 3.29526e+00  0.00000e+00 0.00000e+00 3.66986e+01 140.572 6.39952e+01 320.572 0.8976 
1 1 1 0   43  16 o 19 8.34849e+00 1.15131e+00 1.07623e+02 214.225 -1.02105e+01 -6.94568e+00 0.00000e+00 0.00000e+00 1.89979e+02 214.225 8.23564e+01 214.225 0.9586 
1 1 1 0   43  17 o 3  3.37688e+00 1.11585e+00 8.78770e+01 28.522  4.05076e+00  2.20138e+00  0.00000e+00 0.00000e+00 2.29541e+01 28.522  6.49229e+01 208.522 0.8835 
1 1 1 0   43  18 o 1  4.43946e+00 1.36050e+00 9.14505e+01 95.255  -5.48334e-01 5.96166e+00  0.00000e+00 0.00000e+00 5.88223e+01 95.255  3.26282e+01 275.255 0.9122 
1 1 1 0   43  19 o 8  9.12250e+00 1.55592e+00 6.01899e+01 329.442 6.68483e+00  -3.94675e+00 0.00000e+00 0.00000e+00 2.55360e+02 329.442 1.95170e+02 329.442 0.9332 
1 1 1 0   44  0  o 1  8.23106e+01 1.59513e+00 1.56811e+03 1.170   7.51083e+01  1.53453e+00  0.00000e+00 0.00000e+00 1.49579e+03 1.170   7.23216e+01 181.170 0.9933 
1 1 1 0   44  1  o 7  8.27981e+00 2.76346e-01 1.10760e+02 62.983  4.62242e-01  9.06543e-01  0.00000e+00 0.00000e+00 2.96631e+01 62.983  8.10972e+01 242.983 0.4526 
1 1 1 0   44  2  o 14 5.42003e+01 8.72808e-01 9.15278e+02 138.283 -4.78931e+01 4.26961e+01  0.00000e+00 0.00000e+00 1.09969e+03 138.283 1.84409e+02 138.283 0.9922 
1 1 1 0   44  3  o 5  3.29051e+01 4.91962e-01 5.10835e+02 354.755 2.05641e+01  -1.88758e+00 0.00000e+00 0.00000e+00 6.91681e+02 354.755 1.80846e+02 354.755 0.9755 
1 1 1 0   44  4  o 18 3.44835e+01 5.13569e-01 6.64426e+02 356.672 2.90732e+01  -1.69058e+00 0.00000e+00 0.00000e+00 6.04803e+02 356.672 5.96230e+01 176.672 0.9827 
1 1 1 0   44  5  o 5  2.63605e+01 4.26743e-01 5.65551e+02 50.029  1.48360e+01  1.76988e+01  0.00000e+00 0.00000e+00 3.99916e+02 50.029  1.65635e+02 230.028 0.9781 
1 1 1 0   44  6  o 17 1.86332e+01 3.86527e-01 3.53555e+02 306.567 6.75377e+00  -9.10501e+00 0.00000e+00 0.00000e+00 3.12426e+02 306.567 4.11293e+01 126.567 0.9548 
1 1 1 0   44  7  o 13 2.93609e+01 5.23738e-01 3.26139e+02 83.198  2.77177e+00  2.32381e+01  0.00000e+00 0.00000e+00 7.48750e+02 83.198  4.22611e+02 83.198  0.9784 
1 1 1 0   44  8  o 11 2.35599e+01 4.77100e-01 4.60465e+02 76.332  7.18203e+00  2.95334e+01  0.00000e+00 0.00000e+00 4.06073e+02 76.332  5.43923e+01 256.332 0.9834 
1 1 1 0   44  9  o 6  2.93209e+01 7.72322e-01 4.23577e+02 157.992 -4.01173e+01 1.62148e+01  0.00000e+00 0.00000e+00 6.59736e+02 157.992 2.36158e+02 157.992 0.9884 
1 1 1 0   44  10 o 12 1.87669e+01 5.01467e-01 3.76319e+02 154.486 -3.09944e+01 1.47931e+01  0.00000e+00 0.00000e+00 3.14521e+02 154.486 6.17979e+01 334.486 0.9853 
1 1 1 0   44  11 o 19 1.59673e+01 7.66866e-01 2.36704e+02 47.330  1.55115e+01  1.68273e+01  0.00000e+00 0.00000e+00 3.46271e+02 47.330  1.09567e+02 47.330  0.9779 
1 1 1 0   44  12 o 2  3.55179e+00 9.19574e-01 9.28607e+01 239.014 -1.24270e+00 -2.06933e+00 0.00000e+00 0.00000e+00 7.22610e+00 239.014 8.56346e+01 59.014  0.7553 
1 1 1 0   44  13 f 0  1.87193e+01 5.79707e-01 1.65688e+02 269.080 -5.27620e-01 -3.28450e+01 0.00000e+00 0.00000e+00 5.21482e+02 269.080 3.55794e+02 269.080 0.9847 
1 1 1 0   44  14 o 17 6.86591e+00 1.00635e+00 8.07709e+01 52.783  3.61546e+00  4.76019e+00  0.00000e+00 0.00000e+00 1.52481e+02 52.783  7.17104e+01 52.783  0.9120 
1 1 1 0   44  15 o 15 6.56256e+00 1.09336e+00 1.43564e+02 76.695  2.86757e+00  1.21256e+01  0.00000e+00 0.00000e+00 9.06608e+01 76.695  5.29029e+01 256.695 0.9590 
1 1 1 0   44  16 o 19 1.57073e+01 9.77119e-01 2.03945e+02 289.365 1.52132e+01  -4.32854e+01 0.00000e+00 0.00000e+00 3.73683e+02 289.365 1.69738e+02 289.365 0.9890 
1 1 1 0   44  17 o 1  4.71692e+00 1.25554e+00 1.14925e+02 153.842 -6.43207e+00 3.15905e+00  0.00000e+00 0.00000e+00 4.75527e+01 153.842 6.73718e+01 333.842 0.9273 
1 1 1 0   44  18 o 5  5.89687e+00 1.49048e+00 9.77297e+01 60.914  3.72688e+00  6.69973e+00  0.00000e+00 0.00000e+00 1.06259e+02 60.914  8.52923e+00 60.914  0.9323 
1 1 1 0   44  19 o 3  4.56771e+00 1.38596e+00 3.06692e+01 137.849 -1.64789e+00 1.49165e+00  0.00000e+00 0.00000e+00 9.31112e+01 137.849 6.24420e+01 137.849 0.7312 
1 1 1 0   45  1  o 4  3.75579e+01 5.43844e-01 7.91295e+02 232.767 -2.35426e+01 -3.09789e+01 0.00000e+00 0.00000e+00 5.97729e+02 232.767 1.93566e+02 52.767  0.9871 
1 1 1 0   45  2  o 1  3.27081e+01 5.62339e-01 6.26905e+02 347.040 2.36425e+01  -5.44107e+00 0.00000e+00 0.00000e+00 5.72969e+02 347.040 5.39358e+01 167.040 0.9792 
1 1 1 0   45  3  o 14 1.79246e+01 3.37889e-01 2.38246e+02 215.995 -4.51167e+00 -3.27732e+00 0.00000e+00 0.00000e+00 3.69562e+02 215.995 1.31316e+02 215.995 0.9052 
1 1 1 0   45  4  o 4  2.49215e+01 4.09262e-01 5.46237e+02 287.371 5.35053e+00  -1.71040e+01 0.00000e+00 0.00000e+00 3.60673e+02 287.371 1.85564e+02 107.371 0.9717 
1 1 1 0   45  5  o 17 3.39667e+01 5.51784e-01 3.67397e+02 32.818  1.97787e+01  1.27551e+01  0.00000e+00 0.00000e+00 8.77023e+02 32.818  5.09627e+02 32.818  0.9785 
1 1 1 0   45  6  o 6  3.45354e+01 5.58801e-01 5.96718e+02 207.189 -3.83054e+01 -1.96768e+01 0.00000e+00 0.00000e+00 6.80781e+02 207.189 8.40625e+01 207.189 0.9883 
1 1 1 0   45  7  o 11 1.78925e+01 4.06972e-01 2.93113e+02 351.381 1.25163e+01  -1.89714e+00 0.00000e+00 0.00000e+00 3.49296e+02 351.381 5.61834e+01 351.381 0.9597 
1 1 1 0   45  8  o 16 3.96324e+01 6.58518e-01 6.40861e+02 131.917 -5.06141e+01 5.63765e+01  0.00000e+00 0.00000e+00 8.31425e+02 131.917 1.90564e+02 131.917 0.9934 
1 1 1 0   45  9  o 18 2.95229e+01 5.52942e-01 5.07867e+02 264.316 -5.11797e+00 -5.14167e+01 0.00000e+00 0.00000e+00 5.84873e+02 264.316 7.70061e+01 264.316 0.9903 
1 1 1 0   45  10 o 12 3.00199e+01 7.14805e-01 4.51151e+02 299.815 3.12169e+01  -5.44737e+01 0.00000e+00 0.00000e+00 6.61279e+02 299.815 2.10128e+02 299.815 0.9920 
1 1 1 0   45  11 o 6  1.96036e+01 6.13595e-01 3.12571e+02 298.441 1.98451e+01  -3.66403e+01 0.00000e+00 0.00000e+00 4.10416e+02 298.441 9.78446e+01 298.441 0.9879 
1 1 1 0   45  12 o 18 6.13822e+00 8.16268e-01 7.78677e+01 349.361 3.82556e+00  -7.18599e-01 0.00000e+00 0.00000e+00 1.18890e+02 349.361 4.10218e+01 349.361 0.8593 
1 1 1 0   45  13 o 11 1.03246e+01 6.52536e-01 1.59927e+02 97.801  -2.43862e+00 1.77989e+01  0.00000e+00 0.00000e+00 2.14066e+02 97.801  5.41395e+01 97.801  0.9718 
1 1 1 0   45  14 f 0  6.92718e+00 9.17002e-01 1.51247e+02 106.915 -3.70425e+00 1.21805e+01  0.00000e+00 0.00000e+00 9.64110e+01 106.915 5.48359e+01 286.915 0.9599 
1 1 1 0   45  15 o 19 4.04354e+00 1.05670e+00 4.77414e+01 51.579  1.58279e+00  1.99550e+00  0.00000e+00 0.00000e+00 6.81234e+01 51.579  2.03820e+01 51.579  0.7700 
1 1 1 0   45  16 o 14 7.56758e+00 1.34727e+00 8.21418e+01 75.958  1.86312e+00  7.44943e+00  0.00000e+00 0.00000e+00 1.80186e+02 75.958  9.80437e+01 75.958  0.9324 
1 1 1 0   45  17 o 5  4.49130e+00 1.24866e+00 5.39050e+01 325.315 2.76396e+00  -1.91278e+00 0.00000e+00 0.00000e+00 8.51311e+01 325.315 3.12261e+01 325.315 0.8335 
1 1 1 0   45  18 o 5  3.43783e+00 1.11277e+00 3.42470e+01 154.776 -1.87921e+00 8.85235e-01  0.00000e+00 0.00000e+00 5.63179e+01 154.776 2.20709e+01 154.776 0.7101 
1 1 1 0   45  19 o 18 8.74634e+00 1.57431e+00 1.43858e+02 249.352 -6.12702e+00 -1.62592e+01 0.00000e+00 0.00000e+00 1.70797e+02 249.352 2.69390e+01 249.352 0.9708 
1 1 1 0   46  0  o 12 6.22144e+01 1.21414e+00 9.98328e+02 332.970 3.25859e+01  -1.66250e+01 0.00000e+00 0.00000e+00 1.30043e+03 332.970 3.02104e+02 332.970 0.9862 
1 1 1 0   46  1  o 2  4.50090e+01 6.36954e-01 8.91603e+02 5.455   4.71968e+01  4.50694e+00  0.00000e+00 0.00000e+00 7.76715e+02 5.455   1.14888e+02 185.455 0.9894 
1 1 1 0   46  2  o 15 1.93545e+01 4.00150e-01 3.52854e+02 100.130 -1.47470e+00 8.25400e+00  0.00000e+00 0.00000e+00 3.27453e+02 100.130 2.54013e+01 280.130 0.9383 
1 1 1 0   46  3  o 3  2.79266e+01 4.71904e-01 2.55019e+02 110.704 -3.21702e+00 8.51176e+00  0.00000e+00 0.00000e+00 7.31689e+02 110.704 4.76670e+02 110.704 0.9433 
1 1 1 0   46  4  o 10 3.26532e+01 7.56842e-01 3.51634e+02 90.112  -3.53772e-02 1.81133e+01  0.00000e+00 0.00000e+00 8.36863e+02 90.112  4.85229e+02 90.112  0.9720 
1 1 1 0   46  5  o 13 8.75383e+00 3.57518e-01 8.04822e+01 78.434  2.48862e-01  1.21600e+00  0.00000e+00 0.00000e+00 9.16832e+01 78.434  1.12010e+01 78.434  0.5254 
1 1 1 0   46  6  o 1  2.91942e+01 4.70294e-01 5.27821e+02 75.796  7.89517e+00  3.11925e+01  0.00000e+00 0.00000e+00 5.47614e+02 75.796  1.97930e+01 75.796  0.9843 
1 1 1 0   46  7  o 11 3.28787e+01 5.63771e-01 5.68383e+02 284.012 1.20661e+01  -4.83525e+01 0.00000e+00 0.00000e+00 6.49162e+02 284.012 8.07793e+01 284.012 0.9899 
1 1 1 0   46  8  o 8  3.21962e+01 5.66844e-01 5.91876e+02 37.294  4.32300e+01  3.29251e+01  0.00000e+00 0.00000e+00 6.00859e+02 37.294  8.98242e+00 37.294  0.9908 
1 1 1 0   46  9  o 8  2.54241e+01 5.96308e-01 3.01141e+02 71.789  9.31332e+00  2.83089e+01  0.00000e+00 0.00000e+00 6.32932e+02 71.789  3.31790e+02 71.789  0.9831 
1 1 1 0   46  10 o 15 2.30349e+01 5.21118e-01 3.92392e+02 35.796  3.72181e+01  2.68382e+01  0.00000e+00 0.00000e+00 4.58543e+02 35.796  6.61509e+01 35.796  0.9890 
1 1 1 0   46  11 o 18 1.84667e+01 6.15120e-01 3.38565e+02 61.798  2.07325e+01  3.86620e+01  0.00000e+00 0.00000e+00 3.42829e+02 61.798  4.26364e+00 61.798  0.9885 
1 1 1 0   46  12 o 19 1.50130e+01 6.09140e-01 2.75439e+02 24.261  3.25200e+01  1.46565e+01  0.00000e+00 0.00000e+00 2.76643e+02 24.261  1.20426e+00 24.261  0.9859 
1 1 1 0   46  13 o 19 4.04351e+00 9.12810e-01 8.23048e+01 116.846 -1.45965e+00 2.88391e+00  0.00000e+00 0.00000e+00 4.21490e+01 116.846 4.01558e+01 296.846 0.8258 
1 1 1 0   46  14 o 17 6.58860e+00 9.96978e-01 1.05014e+02 225.247 -5.50213e+00 -5.54969e+00 0.00000e+00 0.00000e+00 1.24068e+02 225.247 1.90538e+01 225.247 0.9336 
1 1 1 0   46  15 o 6  3.31713e+00 1.02521e+00 8.04290e+01 122.893 -1.95261e+00 3.01905e+00  0.00000e+00 0.00000e+00 2.39800e+01 122.893 5.64490e+01 302.893 0.8459 
1 1 1 0   46  16 o 7  1.32501e+01 1.01136e+00 2.41493e+02 201.298 -4.48315e+01 -1.74775e+01 0.00000e+00 0.00000e+00 2.45904e+02 201.298 4.41086e+00 201.298 0.9896 
1 1 1 0   46  17 o 5  1.43695e+01 1.29421e+00 1.84882e+02 23.192  3.33724e+01  1.42977e+01  0.00000e+00 0.00000e+00 3.41333e+02 23.192  1.56451e+02 23.192  0.9861 
1 1 1 0   46  18 o 16 8.71541e+00 1.42052e+00 1.59138e+02 200.649 -1.79793e+01 -6.77540e+00 0.00000e+00 0.00000e+00 1.55636e+02 200.649 3.50182e+00 20.649  0.9736 
1 1 1 0   46  19 o 12 7.52050e+00 1.62819e+00 1.83611e+02 29.450  1.61488e+01  9.11782e+00  0.00000e+00 0.00000e+00 8.74313e+01 29.450  9.61794e+01 209.450 0.9727 
1 1 1 0   47  1  o 15 6.28726e+01 8.66582e-01 1.04791e+03 8.300   7.89864e+01  1.15222e+01  0.00000e+00 0.00000e+00 1.29242e+03 8.300   2.44512e+02 8.300   0.9937 
1 1 1 0   47  2  o 13 5.27817e+01 8.66155e-01 1.05547e+03 205.395 -6.45450e+01 -3.06408e+01 0.00000e+00 0.00000e+00 9.07602e+02 205.395 1.47868e+02 25.395  0.9930 
1 1 1 0   47  3  o 12 5.03313e+01 7.07734e-01 7.72859e+02 230.805 -3.22145e+01 -3.95060e+01 0.00000e+00 0.00000e+00 1.09345e+03 230.805 3.20589e+02 230.805 0.9901 
1 1 1 0   47  4  o 6  3.71913e+01 6.45267e-01 7.25855e+02 200.654 -3.89066e+01 -1.46658e+01 0.00000e+00 0.00000e+00 6.49801e+02 200.654 7.60543e+01 20.654  0.9879 
1 1 1 0   47  5  o 9  6.20515e+01 8.61835e-01 9.05138e+02 138.989 -7.11720e+01 6.18926e+01  0.00000e+00 0.00000e+00 1.40518e+03 138.989 5.00047e+02 138.989 0.9947 
1 1 1 0   47  6  o 3  3.93293e+01 5.84540e-01 5.70953e+02 356.542 4.84382e+01  -2.92717e+00 0.00000e+00 0.00000e+00 8.85456e+02 356.542 3.14503e+02 356.542 0.9896 
1 1 1 0   47  7  o 3  2.64190e+01 4.91298e-01 4.26288e+02 123.778 -1.63510e+01 2.44448e+01  0.00000e+00 0.00000e+00 5.44938e+02 123.778 1.18650e+02 123.778 0.9828 
1 1 1 0   47  8  o 2  1.72912e+01 4.78144e-01 2.44686e+02 178.992 -1.31825e+01 2.31989e-01  0.00000e+00 0.00000e+00 3.76756e+02 178.992 1.32070e+02 178.992 0.9613 
1 1 1 0   47  9  o 7  1.98053e+01 4.75231e-01 3.34889e+02 0.052   2.86210e+01  2.58674e-02  0.00000e+00 0.00000e+00 3.92135e+02 0.052   5.72458e+01 0.052   0.9824 
1 1 1 0   47  10 o 10 2.74152e+01 5.53006e-01 4.91268e+02 172.939 -7.25209e+01 8.98330e+00  0.00000e+00 0.00000e+00 5.25541e+02 172.939 3.42731e+01 172.939 0.9931 
1 1 1 0   47  11 o 13 4.46077e+00 7.79096e-01 1.42303e+02 319.574 3.46318e+00  -2.95013e+00 0.00000e+00 0.00000e+00 4.49635e+00 319.574 1.37807e+02 139.574 0.8818 
1 1 1 0   47  12 o 12 1.69750e+01 5.63291e-01 2.60287e+02 247.104 -1.57407e+01 -3.72705e+01 0.00000e+00 0.00000e+00 3.64931e+02 247.104 1.04644e+02 247.104 0.9876 
1 1 1 0   47  13 o 15 3.81502e+00 9.02925e-01 4.69586e+01 357.432 1.83337e+00  -8.22202e-02 0.00000e+00 0.00000e+00 4.81233e+01 357.432 1.16472e+00 357.432 0.6688 
1 1 1 0   47  14 o 19 5.72095e+00 1.01066e+00 6.53402e+01 228.919 -2.92464e+00 -3.35487e+00 0.00000e+00 0.00000e+00 1.21881e+02 228.919 5.65412e+01 228.919 0.8789 
1 1 1 0   47  15 o 8  3.26614e+00 1.03229e+00 1.09070e+02 341.112 4.49147e+00  -1.53674e+00 0.00000e+00 0.00000e+00 1.26940e+00 161.112 1.10339e+02 161.112 0.8872 
1 1 1 0   47  16 o 11 7.31582e+00 1.30385e+00 1.19056e+02 353.615 1.06705e+01  -1.19406e+00 0.00000e+00 0.00000e+00 1.39869e+02 353.615 2.08124e+01 353.615 0.9522 
1 1 1 0   47  17 o 16 4.37217e+00 1.27867e+00 1.03775e+02 43.558  4.59084e+00  4.36542e+00  0.00000e+00 0.00000e+00 4.51357e+01 43.558  5.86393e+01 223.558 0.9173 
1 1 1 0   47  18 o 11 4.99099e+00 1.36975e+00 1.17815e+02 190.109 -8.37788e+00 -1.49373e+00 0.00000e+00 0.00000e+00 5.60625e+01 190.109 6.17521e+01 10.109  0.9393 
1 1 1 0   47  19 o 14 5.13033e+00 1.45077e+00 9.03020e+01 151.558 -6.79967e+00 3.68307e+00  0.00000e+00 0.00000e+00 8.70185e+01 151.558 3.28354e+00 331.557 0.9329 
1 1 1 0   48  0  o 5  6.16197e+01 1.20368e+00 1.32312e+03 277.099 6.48513e+00  -5.20749e+01 0.00000e+00 0.00000e+00 9.62746e+02 277.099 3.60378e+02 97.099  0.9904 
1 1 1 0   48  1  o 14 3.63475e+01 5.33174e-01 7.74225e+02 183.841 -3.64175e+01 -2.44532e+00 0.00000e+00 0.00000e+00 5.68348e+02 183.841 2.05877e+02 3.841   0.9862 
1 1 1 0   48  2  o 16 2.44889e+01 4.05248e-01 2.91688e+02 187.468 -9.03394e+00 -1.18422e+00 0.00000e+00 0.00000e+00 5.73536e+02 187.468 2.81848e+02 187.468 0.9434 
1 1 1 0   48  3  o 7  4.53293e+01 6.45971e-01 7.73274e+02 35.807  3.83382e+01  2.76578e+01  0.00000e+00 0.00000e+00 9.06018e+02 35.807  1.32744e+02 35.807  0.9894 
1 1 1 0   48  4  o 17 3.63232e+01 6.41196e-01 6.95316e+02 110.117 -1.63287e+01 4.45788e+01  0.00000e+00 0.00000e+00 6.50108e+02 110.117 4.52075e+01 290.117 0.9894 
1 1 1 0   48  5  o 14 3.81749e+01 5.65772e-01 5.16276e+02 98.184  -4.79702e+00 3.33562e+01  0.00000e+00 0.00000e+00 8.91114e+02 98.184  3.74838e+02 98.184  0.9850 
1 1 1 0   48  6  o 18 3.48740e+01 5.35330e-01 6.72061e+02 235.180 -2.95863e+01 -4.25374e+01 0.00000e+00 0.00000e+00 6.20058e+02 235.180 5.20029e+01 55.180  0.9903 
1 1 1 0   48  7  o 18 1.30560e+01 4.80937e-01 3.36666e+02 71.511  3.82466e+00  1.14377e+01  0.00000e+00 0.00000e+00 1.30913e+02 71.511  2.05753e+02 251.511 0.9576 
1 1 1 0   48  8  o 8  1.75571e+01 4.52278e-01 3.79679e+02 309.027 1.34873e+01  -1.66395e+01 0.00000e+00 0.00000e+00 2.61132e+02 309.027 1.18547e+02 129.027 0.9764 
1 1 1 0   48  9  o 3  1.09918e+01 5.15047e-01 2.41559e+02 53.792  6.70613e+00  9.16000e+00  0.00000e+00 0.00000e+00 1.50594e+02 53.792  9.09653e+01 233.792 0.9549 
1 1 1 0   48  10 o 15 1.25344e+01 7.11244e-01 2.06387e+02 233.709 -8.92962e+00 -1.21602e+01 0.00000e+00 0.00000e+00 2.45867e+02 233.709 3.94800e+01 233.709 0.9663 
1 1 1 0   48  11 o 6  2.17899e+01 5.38622e-01 3.32095e+02 289.228 1.79110e+01  -5.13516e+01 0.00000e+00 0.00000e+00 4.73522e+02 289.228 1.41427e+02 289.228 0.9908 
1 1 1 0   48  12 o 18 6.63265e+00 8.15365e-01 1.00591e+02 27.672  5.09877e+00  2.67369e+00  0.00000e+00 0.00000e+00 1.24092e+02 27.672  2.35010e+01 27.672  0.9084 
1 1 1 0   48  13 o 10 1.07004e+01 7.00372e-01 2.13348e+02 221.339 -1.75432e+01 -1.54331e+01 0.00000e+00 0.00000e+00 1.76743e+02 221.339 3.66052e+01 41.339  0.9784 
1 1 1 0   48  14 o 4  8.63642e+00 9.56611e-01 2.11432e+02 52.844  1.35099e+01  1.78268e+01  0.00000e+00 0.00000e+00 1.02842e+02 52.844  1.08589e+02 232.844 0.9774 
1 1 1 0   48  15 o 13 9.06062e+00 1.17013e+00 1.29089e+02 56.770  7.97364e+00  1.21711e+01  0.00000e+00 0.00000e+00 1.96156e+02 56.770  6.70667e+01 56.770  0.9650 
1 1 1 0   48  16 o 1  8.97129e+00 1.20768e+00 1.81372e+02 170.428 -2.23717e+01 3.77274e+00  0.00000e+00 0.00000e+00 1.44597e+02 170.428 3.67747e+01 350.428 0.9777 
1 1 1 0   48  17 o 19 6.27827e+00 1.39325e+00 1.71654e+02 338.224 1.30765e+01  -5.22396e+00 0.00000e+00 0.00000e+00 5.29961e+01 338.224 1.18658e+02 158.224 0.9638 
1 1 1 0   48  18 o 13 3.61201e+00 1.14981e+00 6.57550e+01 177.804 -4.22722e+00 1.62108e-01  0.00000e+00 0.00000e+00 5.10311e+01 177.804 1.47239e+01 357.804 0.8718 
1 1 1 0   48  19 o 11 4.63203e+00 1.40698e+00 8.59750e+01 36.483  5.46063e+00  4.03816e+00  0.00000e+00 0.00000e+00 7.24243e+01 36.483  1.35507e+01 216.483 0.9231 
1 1 1 0   49  1  o 4  5.59508e+01 7.77828e-01 7.54704e+02 74.074  1.46221e+01  5.12426e+01  0.00000e+00 0.00000e+00 1.32084e+03 74.074  5.66134e+02 74.074  0.9906 
1 1 1 0   49  2  o 3  3.58093e+01 5.28894e-01 3.73156e+02 299.509 8.64346e+00  -1.52720e+01 0.00000e+00 0.00000e+00 9.28958e+02 299.509 5.55802e+02 299.509 0.9711 
1 1 1 0   49  3  o 13 3.81598e+01 5.60170e-01 5.43333e+02 157.942 -3.03412e+01 1.22944e+01  0.00000e+00 0.00000e+00 8.63369e+02 157.942 3.20036e+02 157.942 0.9846 
1 1 1 0   49  4  o 4  1.85883e+01 4.18258e-01 3.36092e+02 77.162  2.44160e+00  1.07139e+01  0.00000e+00 0.00000e+00 3.27245e+02 77.162  8.84728e+00 257.162 0.9534 
1 1 1 0   49  5  o 7  2.14083e+01 3.89279e-01 5.44997e+02 277.975 3.39722e+00  -2.42500e+01 0.00000e+00 0.00000e+00 2.39601e+02 277.975 3.05396e+02 97.975  0.9794 
1 1 1 0   49  6  o 6  2.04580e+01 4.26161e-01 3.33640e+02 165.393 -1.61557e+01 4.21024e+00  0.00000e+00 0.00000e+00 4.08385e+02 165.393 7.47452e+01 165.393 0.9696 
1 1 1 0   49  7  o 14 2.10132e+01 4.48106e-01 2.30815e+02 358.055 1.36046e+01  -4.62006e-01 0.00000e+00 0.00000e+00 5.25517e+02 358.055 2.94702e+02 358.055 0.9625 
1 1 1 0   49  8  o 14 1.88404e+01 5.73026e-01 3.56207e+02 321.854 1.73299e+01  -1.36107e+01 0.00000e+00 0.00000e+00 3.31819e+02 321.854 2.43877e+01 141.854 0.9770 
1 1 1 0   49  9  o 12 2.15318e+01 4.90450e-01 3.96266e+02 236.148 -2.09459e+01 -3.12276e+01 0.00000e+00 0.00000e+00 3.97337e+02 236.148 1.07038e+00 236.148 0.9866 
1 1 1 0   49  10 o 1  1.28704e+01 5.11398e-01 1.43853e+02 196.468 -1.01840e+01 -3.01054e+00 0.00000e+00 0.00000e+00 3.13457e+02 196.468 1.69605e+02 196.468 0.9517 
1 1 1 0   49  11 o 14 1.75610e+01 5.19924e-01 3.31299e+02 20.742  4.01209e+01  1.51944e+01  0.00000e+00 0.00000e+00 3.16254e+02 20.742  1.50452e+01 200.742 0.9883 
1 1 1 0   49  12 o 18 3.14381e+01 7.20958e-01 5.69079e+02 158.886 -1.55406e+02 6.00109e+01  0.00000e+00 0.00000e+00 5.99588e+02 158.886 3.05092e+01 158.886 0.9970 
1 1 1 0   49  13 o 1  6.67390e+00 8.41509e-01 1.31314e+02 138.237 -6.93326e+00 6.19100e+00  0.00000e+00 0.00000e+00 1.03554e+02 138.237 2.77609e+01 318.237 0.9446 
1 1 1 0   49  14 o 7  1.55139e+01 8.68837e-01 3.03624e+02 273.082 3.33176e+00  -6.18754e+01 0.00000e+00 0.00000e+00 2.69224e+02 273.082 3.44008e+01 93.082  0.9919 
1 1 1 0   49  15 f 0  8.42529e+00 1.17922e+00 8.25238e+01 106.411 -2.43085e+00 8.25337e+00  0.00000e+00 0.00000e+00 2.12026e+02 106.411 1.29502e+02 106.411 0.9400 
1 1 1 0   49  16 o 16 4.17621e+00 1.16423e+00 1.76811e+01 243.193 -4.94818e-01 -9.79275e-01 0.00000e+00 0.00000e+00 5.67699e+01 243.193 3.90888e+01 243.193 0.4798 
1 1 1 0   49  17 o 7  8.29808e+00 1.28860e+00 1.57354e+02 29.853  1.60646e+01  9.21985e+00  0.00000e+00 0.00000e+00 1.42243e+02 29.853  1.51106e+01 209.852 0.9726 
1 1 1 0   49  18 o 1  5.23753e+00 1.40959e+00 3.76894e+01 162.406 -2.74731e+00 8.71209e-01  0.00000e+00 0.00000e+00 1.17853e+02 162.406 8.01631e+01 162.406 0.8009 
1 1 1 0   49  19 o 12 5.48392e+00 1.48002e+00 1.16438e+02 189.193 -9.80524e+00 -1.58691e+00 0.00000e+00 0.00000e+00 7.61694e+01 189.193 4.02683e+01 9.193   0.9482 
1 1 1 0   50  0  o 4  8.22365e+01 1.58972e+00 1.33883e+03 165.581 -6.85416e+01 1.76223e+01  0.00000e+00 0.00000e+00 1.71868e+03 165.581 3.79860e+02 165.581 0.9929 
1 1 1 0   50  1  o 1  3.25423e+01 4.91051e-01 5.95146e+02 81.556  3.73682e+00  2.51724e+01  0.00000e+00 0.00000e+00 5.99178e+02 81.556  4.03178e+00 81.556  0.9802 
1 1 1 0   50  2  o 4  2.19479e+01 3.79944e-01 1.61072e+02 156.113 -5.16199e+00 2.28608e+00  0.00000e+00 0.00000e+00 5.83814e+02 156.113 4.22742e+02 156.113 0.9065 
1 1 1 0   50  3  o 6  2.62917e+01 4.27422e-01 3.76321e+02 266.339 -9.73555e-01 -1.52173e+01 0.00000e+00 0.00000e+00 5.75059e+02 266.339 1.98738e+02 266.339 0.9666 
1 1 1 0   50  4  o 10 3.27021e+01 5.78094e-01 5.82854e+02 276.785 3.82897e+00  -3.21795e+01 0.00000e+00 0.00000e+00 6.22042e+02 276.785 3.91883e+01 276.785 0.9844 
1 1 1 0   50  5  o 9  3.07922e+01 4.84958e-01 4.14547e+02 351.489 2.62869e+01  -3.93364e+00 0.00000e+00 0.00000e+00 7.15698e+02 351.489 3.01151e+02 351.489 0.9810 
1 1 1 0   50  6  o 19 3.10016e+01 4.95155e-01 5.53842e+02 97.032  -5.63280e+00 4.56663e+01  0.00000e+00 0.00000e+00 5.93065e+02 97.032  3.92227e+01 97.032  0.9891 
1 1 1 0   50  7  o 14 2.28618e+01 5.09272e-01 2.70545e+02 200.015 -1.75035e+01 -6.37609e+00 0.00000e+00 0.00000e+00 5.60965e+02 200.015 2.90420e+02 200.015 0.9728 
1 1 1 0   50  8  f 0  3.31600e+01 5.86221e-01 4.52049e+02 317.540 3.91104e+01  -3.57872e+01 0.00000e+00 0.00000e+00 7.75455e+02 317.540 3.23405e+02 317.540 0.9905 
1 1 1 0   50  9  o 11 3.58010e+01 6.30729e-01 6.92078e+02 151.091 -9.84912e+01 5.43894e+01  0.00000e+00 0.00000e+00 6.39221e+02 151.091 5.28575e+01 331.091 0.9955 
1 1 1 0   50  10 o 19 9.94081e+00 5.51341e-01 2.66423e+02 32.870  1.36638e+01  8.82946e+00  0.00000e+00 0.00000e+00 9.30827e+01 32.870  1.73340e+02 212.870 0.9688 
1 1 1 0   50  11 f 0  1.69504e+01 5.23234e-01 2.25271e+02 242.070 -1.39110e+01 -2.62403e+01 0.00000e+00 0.00000e+00 3.96356e+02 242.070 1.71085e+02 242.070 0.9830 
1 1 1 0   50  12 o 6  5.40177e+00 8.52650e-01 1.13669e+02 216.435 -4.48517e+00 -3.31097e+00 0.00000e+00 0.00000e+00 6.86216e+01 216.435 4.50477e+01 36.435  0.9052 
1 1 1 0   50  13 o 17 5.50987e+00 9.58558e-01 1.70253e+02 29.695  8.66089e+00  4.93906e+00  0.00000e+00 0.00000e+00 2.44182e+01 29.695  1.45835e+02 209.695 0.9484 
1 1 1 0   50  14 o 14 6.46063e+00 1.19512e+00 6.80133e+01 40.814  3.70483e+00  3.19953e+00  0.00000e+00 0.00000e+00 1.46223e+02 40.814  7.82099e+01 40.814  0.8909 
1 1 1 0   50  15 o 10 1.22040e+01 9.31483e-01 2.24280e+02 59.019  2.05908e+01  3.42942e+01  0.00000e+00 0.00000e+00 2.23858e+02 59.019  4.22455e-01 239.019 0.9874 
1 1 1 0   50  16 o 4  4.57615e+00 1.19189e+00 4.99365e+01 12.578  3.09781e+00  6.91209e-01  0.00000e+00 0.00000e+00 8.98306e+01 12.578  3.98941e+01 12.578  0.8221 
1 1 1 0   50  17 o 15 4.86235e+00 1.32614e+00 8.68654e+01 234.622 -3.49586e+00 -4.92310e+00 0.00000e+00 0.00000e+00 7.78939e+01 234.622 8.97143e+00 54.622  0.9129 
1 1 1 0   50  18 o 19 6.00577e+00 1.43481e+00 1.29151e+02 93.019  -6.20825e-01 1.17724e+01  0.00000e+00 0.00000e+00 8.38556e+01 93.019  4.52952e+01 273.019 0.9566 
1 1 1 0   50  19 o 9  4.31376e+00 1.31516e+00 3.59469e+01 31.905  2.39618e+00  1.49179e+00  0.00000e+00 0.00000e+00 9.12138e+01 31.905  5.52669e+01 31.905  0.7960 
1 1 1 0   51  1  o 6  3.70023e+01 5.44496e-01 4.63634e+02 241.848 -1.28590e+01 -2.40301e+01 0.00000e+00 0.00000e+00 8.96026e+02 241.848 4.32392e+02 241.848 0.9815 
1 1 1 0   51  2  o 7  1.70797e+01 3.42382e-01 3.86810e+02 335.751 9.34760e+00  -4.21059e+00 0.00000e+00 0.00000e+00 2.20541e+02 335.751 1.66269e+02 155.751 0.9499 
1 1 1 0   51  3  o 13 2.50810e+01 4.17800e-01 4.15690e+02 87.948  6.57699e-01  1.83597e+01  0.00000e+00 0.00000e+00 4.97163e+02 87.948  8.14726e+01 87.948  0.9724 
1 1 1 0   51  4  o 15 1.50498e+01 3.69672e-01 1.34673e+02 166.536 -3.38830e+00 8.11200e-01  0.00000e+00 0.00000e+00 3.38552e+02 166.536 2.03879e+02 166.536 0.8403 
1 1 1 0   51  5  o 11 3.71170e+01 5.56655e-01 6.13220e+02 254.338 -1.36081e+01 -4.85357e+01 0.00000e+00 0.00000e+00 7.61527e+02 254.338 1.48307e+02 254.338 0.9900 
1 1 1 0   51  6  o 19 3.04116e+01 4.89464e-01 5.84692e+02 192.247 -4.54057e+01 -9.85610e+00 0.00000e+00 0.00000e+00 5.40355e+02 192.247 4.43365e+01 12.247  0.9892 
1 1 1 0   51  7  f 0  1.30973e+01 4.54549e-01 7.99119e+01 238.466 -1.77106e+00 -2.88622e+00 0.00000e+00 0.00000e+00 3.28896e+02 238.466 2.48984e+02 238.466 0.8349 
1 1 1 0   51  8  o 18 1.16785e+01 4.51573e-01 2.69026e+02 268.188 -3.44015e-01 -1.08729e+01 0.00000e+00 0.00000e+00 1.46791e+02 268.188 1.22235e+02 88.188  0.9529 
1 1 1 0   51  9  o 1  2.41045e+01 5.13758e-01 4.51551e+02 158.827 -4.81430e+01 1.86476e+01  0.00000e+00 0.00000e+00 4.39925e+02 158.827 1.16254e+01 338.827 0.9903 
1 1 1 0   51  10 o 5  1.85257e+01 6.41186e-01 1.78703e+02 298.452 9.74383e+00  -1.79816e+01 0.00000e+00 0.00000e+00 4.95657e+02 298.452 3.16954e+02 298.452 0.9752 
1 1 1 0   51  11 o 4  8.09540e+00 7.38929e-01 1.57754e+02 115.356 -4.18389e+00 8.82878e+00  0.00000e+00 0.00000e+00 1.28319e+02 115.356 2.94351e+01 295.356 0.9474 
1 1 1 0   51  12 o 7  5.01239e+00 9.04286e-01 1.08554e+02 53.147  2.91710e+00  3.89191e+00  0.00000e+00 0.00000e+00 5.77560e+01 53.147  5.07982e+01 233.147 0.8901 
1 1 1 0   51  13 o 15 1.34105e+01 6.36804e-01 2.37639e+02 56.434  2.30373e+01  3.47183e+01  0.00000e+00 0.00000e+00 2.55830e+02 56.434  1.81902e+01 56.434  0.9879 
1 1 1 0   51  14 o 18 1.57038e+01 7.99600e-01 2.58228e+02 237.230 -3.08646e+01 -4.79476e+01 0.00000e+00 0.00000e+00 3.21059e+02 237.230 6.28304e+01 237.230 0.9912 
1 1 1 0   51  15 o 8  8.17000e+00 1.18643e+00 1.21435e+02 51.684  8.15597e+00  1.03212e+01  0.00000e+00 0.00000e+00 1.70567e+02 51.684  4.91317e+01 51.684  0.9612 
1 1 1 0   51  16 f 0  5.22183e+00 1.22913e+00 1.78467e+01 224.596 -9.15833e-01 -9.03019e-01 0.00000e+00 0.00000e+00 8.66429e+01 224.596 6.87962e+01 224.596 0.5387 
1 1 1 0   51  17 o 13 4.24752e+00 1.22802e+00 4.70283e+01 162.909 -2.95846e+00 9.09628e-01  0.00000e+00 0.00000e+00 8.17192e+01 162.909 3.46908e+01 162.909 0.8168 
1 1 1 0   51  18 f 0  2.94276e+00 1.00481e+00 6.19293e+01 62.720  1.86457e+00  3.61568e+00  0.00000e+00 0.00000e+00 3.25535e+01 62.720  2.93758e+01 242.720 0.8661 
1 1 1 0   51  19 o 15 4.93064e+00 1.39086e+00 7.14407e+01 18.256  5.90068e+00  1.94647e+00  0.00000e+00 0.00000e+00 9.57185e+01 18.256  2.42778e+01 18.256  0.9156 
1 1 1 0   52  0  o 13 1.12533e+02 2.17733e+00 1.89975e+03 234.185 -9.29384e+01 -1.28791e+02 0.00000e+00 0.00000e+00 2.29958e+03 234.185 3.99822e+02 234.185 0.9968 
1 1 1 0   52  1  o 5  5.21155e+01 7.30688e-01 8.78929e+02 154.030 -6.30941e+01 3.07315e+01  0.00000e+00 0.00000e+00 1.05798e+03 154.030 1.79050e+02 154.030 0.9928 
1 1 1 0   52  2  o 17 4.93021e+01 6.96492e-01 8.17841e+02 353.107 7.49106e+01  -9.05606e+00 0.00000e+00 0.00000e+00 1.01527e+03 353.107 1.97424e+02 353.107 0.9934 
1 1 1 0   52  3  o 8  3.62182e+01 5.40644e-01 5.63659e+02 195.800 -3.34910e+01 -9.47728e+00 0.00000e+00 0.00000e+00 7.72163e+02 195.800 2.08504e+02 195.800 0.9855 
1 1 1 0   52  4  o 12 4.37140e+01 6.32282e-01 8.42001e+02 307.198 4.61921e+01  -6.08606e+01 0.00000e+00 0.00000e+00 7.82872e+02 307.198 5.91289e+01 127.198 0.9934 
1 1 1 0   52  5  o 12 4.33974e+01 6.33567e-01 6.00279e+02 120.101 -3.17242e+01 5.47242e+01  0.00000e+00 0.00000e+00 1.01016e+03 120.101 4.09876e+02 120.101 0.9921 
1 1 1 0   52  6  o 12 7.57176e+00 4.19970e-01 1.74451e+02 250.257 -1.22819e+00 -3.42206e+00 0.00000e+00 0.00000e+00 6.56162e+01 250.257 1.08834e+02 70.257  0.8479 
1 1 1 0   52  7  o 15 3.10850e+01 5.38882e-01 4.28419e+02 99.153  -6.56978e+00 4.07769e+01  0.00000e+00 0.00000e+00 7.19337e+02 99.153  2.90918e+02 99.153  0.9878 
1 1 1 0   52  8  o 12 2.02426e+01 4.68858e-01 2.89539e+02 33.268  1.92156e+01  1.26070e+01  0.00000e+00 0.00000e+00 4.50112e+02 33.268  1.60572e+02 33.268  0.9780 
1 1 1 0   52  9  o 9  1.95318e+01 4.82797e-01 4.07140e+02 117.406 -1.86625e+01 3.59947e+01  0.00000e+00 0.00000e+00 3.13167e+02 117.406 9.39731e+01 297.406 0.9876 
1 1 1 0   52  10 o 6  2.49828e+01 5.40039e-01 3.62892e+02 96.818  -7.39294e+00 6.18316e+01  0.00000e+00 0.00000e+00 5.61957e+02 96.818  1.99065e+02 96.818  0.9919 
1 1 1 0   52  11 o 18 2.52303e+01 8.63504e-01 3.11928e+02 126.525 -3.77580e+01 5.09800e+01  0.00000e+00 0.00000e+00 6.21624e+02 126.525 3.09696e+02 126.525 0.9921 
1 1 1 0   52  12 o 8  4.29782e+00 8.03493e-01 1.35778e+02 325.643 4.88407e+00  -3.33878e+00 0.00000e+00 0.00000e+00 1.01518e+01 325.643 1.25627e+02 145.643 0.9110 
1 1 1 0   52  13 o 1  3.82300e+00 1.01722e+00 4.43486e+01 153.983 -1.72220e+00 8.40616e-01  0.00000e+00 0.00000e+00 5.29727e+01 153.983 8.62408e+00 153.983 0.6836 
1 1 1 0   52  14 f 0  1.25922e+01 8.48311e-01 2.23694e+02 251.098 -1.22713e+01 -3.58380e+01 0.00000e+00 0.00000e+00 2.38646e+02 251.098 1.49523e+01 251.098 0.9867 
1 1 1 0   52  15 o 10 1.10292e+01 8.28950e-01 1.87033e+02 359.906 3.07563e+01  -5.03846e-02 0.00000e+00 0.00000e+00 2.16288e+02 359.906 2.92556e+01 359.906 0.9836 
1 1 1 0   52  16 o 11 5.05412e+00 1.22866e+00 9.43084e+01 133.138 -4.23910e+00 4.52404e+00  0.00000e+00 0.00000e+00 7.75262e+01 133.138 1.67822e+01 313.138 0.9154 
1 1 1 0   52  17 o 8  3.13653e+00 1.04903e+00 2.31724e+01 102.127 -2.80009e-01 1.30308e+00  0.00000e+00 0.00000e+00 4.10714e+01 102.127 1.78991e+01 102.127 0.5520 
1 1 1 0   52  18 o 12 6.13856e+00 1.39149e+00 9.39912e+01 72.107  2.86580e+00  8.87657e+00  0.00000e+00 0.00000e+00 1.20973e+02 72.107  2.69818e+01 72.107  0.9448 
1 1 1 0   52  19 o 6  3.74858e+00 1.22534e+00 4.33624e+01 272.337 1.42065e-01  -3.48132e+00 0.00000e+00 0.00000e+00 7.32568e+01 272.337 2.98944e+01 272.337 0.8403 
1 1 1 0   53  1  o 18 3.81329e+01 5.99213e-01 5.13212e+02 267.658 -1.50179e+00 -3.67214e+01 0.00000e+00 0.00000e+00 8.94470e+02 267.658 3.81259e+02 267.658 0.9863 
1 1 1 0   53  2  o 7  3.35774e+01 5.08241e-01 4.78070e+02 220.941 -2.12182e+01 -1.84066e+01 0.00000e+00 0.00000e+00 7.55975e+02 220.941 2.77906e+02 220.941 0.9820 
1 1 1 0   53  3  o 4  3.07314e+01 4.79589e-01 4.46254e+02 121.544 -1.23017e+01 2.00400e+01  0.00000e+00 0.00000e+00 6.78954e+02 121.544 2.32701e+02 121.544 0.9785 
1 1 1 0   53  4  o 17 4.97313e+01 7.08183e-01 6.64935e+02 334.126 6.40060e+01  -3.10432e+01 0.00000e+00 0.00000e+00 1.18243e+03 334.126 5.17496e+02 334.126 0.9929 
1 1 1 0   53  5  o 6  3.34970e+01 5.18950e-01 5.99535e+02 140.377 -3.71158e+01 3.07295e+01  0.00000e+00 0.00000e+00 6.40201e+02 140.377 4.06655e+01 140.377 0.9896 
1 1 1 0   53  6  o 10 1.10443e+01 3.79374e-01 1.64767e+02 18.073  4.87007e+00  1.58928e+00  0.00000e+00 0.00000e+00 2.05275e+02 18.073  4.05078e+01 18.073  0.8962 
1 1 1 0   53  7  o 18 1.74687e+01 4.83947e-01 3.02536e+02 122.447 -9.07672e+00 1.42767e+01  0.00000e+00 0.00000e+00 3.30725e+02 122.447 2.81891e+01 122.447 0.9700 
1 1 1 0   53  8  o 9  2.25133e+01 4.82310e-01 4.89054e+02 283.815 1.12887e+01  -4.59077e+01 0.00000e+00 0.00000e+00 3.43009e+02 283.815 1.46045e+02 103.815 0.9894 
1 1 1 0   53  9  o 12 2.16127e+01 4.97957e-01 2.80340e+02 98.347  -4.79973e+00 3.27148e+01  0.00000e+00 0.00000e+00 5.14306e+02 98.347  2.33966e+02 98.347  0.9848 
1 1 1 0   53  10 o 9  1.57892e+01 5.08267e-01 2.19983e+02 165.932 -2.39872e+01 6.01105e+00  0.00000e+00 0.00000e+00 3.57153e+02 165.932 1.37170e+02 165.932 0.9796 
1 1 1 0   53  11 o 9  1.85340e+01 5.99945e-01 2.92309e+02 247.745 -1.77519e+01 -4.33810e+01 0.00000e+00 0.00000e+00 3.91430e+02 247.745 9.91205e+01 247.745 0.9893 
1 1 1 0   53  12 o 5  3.57626e+00 9.29121e-01 7.42947e+01 172.443 -2.63229e+00 3.49225e-01  0.00000e+00 0.00000e+00 2.97733e+01 172.443 4.45214e+01 352.443 0.7809 
1 1 1 0   53  13 o 7  9.00228e+00 9.70582e-01 1.45144e+02 307.582 8.70828e+00  -1.13152e+01 0.00000e+00 0.00000e+00 1.78108e+02 307.582 3.29641e+01 307.582 0.9643 
1 1 1 0   53  14 f 0  6.70452e+00 1.15859e+00 1.07833e+02 318.756 6.23100e+00  -5.46328e+00 0.00000e+00 0.00000e+00 1.26039e+02 318.756 1.82057e+01 318.756 0.9376 
1 1 1 0   53  15 o 2  1.33451e+01 7.83595e-01 2.28408e+02 6.105   5.09294e+01  5.44725e+00  0.00000e+00 0.00000e+00 2.62799e+02 6.105   3.43905e+01 6.105   0.9902 
1 1 1 0   53  16 o 1  7.08948e+00 1.13634e+00 1.25989e+02 175.590 -1.30466e+01 1.00625e+00  0.00000e+00 0.00000e+00 1.27027e+02 175.590 1.03807e+00 175.590 0.9610 
1 1 1 0   53  17 o 3  7.51610e+00 1.39960e+00 9.34154e+01 115.849 -4.19066e+00 8.64996e+00  0.00000e+00 0.00000e+00 1.70502e+02 115.849 7.70863e+01 115.849 0.9465 
1 1 1 0   53  18 o 9  4.38048e+00 1.32249e+00 1.01440e+02 318.506 5.34962e+00  -4.73201e+00 0.00000e+00 0.00000e+00 4.90654e+01 318.506 5.23748e+01 138.506 0.9271 
1 1 1 0   54  0  o 4  3.19993e+01 6.92164e-01 5.79735e+02 186.576 -1.61600e+01 -1.86307e+00 0.00000e+00 0.00000e+00 5.80383e+02 186.576 6.48857e-01 186.576 0.9688 
1 1 1 0   54  1  o 7  3.34535e+01 5.06482e-01 7.32297e+02 300.599 2.18002e+01  -3.68638e+01 0.00000e+00 0.00000e+00 5.04912e+02 300.599 2.27384e+02 120.599 0.9883 
1 1 1 0   54  2  o 8  2.20519e+01 3.88410e-01 2.40328e+02 303.103 4.93446e+00  -7.56860e+00 0.00000e+00 0.00000e+00 5.37731e+02 303.103 2.97402e+02 303.103 0.9429 
1 1 1 0   54  3  o 9  4.68496e+01 6.70563e-01 6.63273e+02 321.751 5.05888e+01  -3.98790e+01 0.00000e+00 0.00000e+00 1.07587e+03 321.751 4.12595e+02 321.751 0.9922 
1 1 1 0   54  4  o 14 2.18006e+01 3.97591e-01 2.66674e+02 156.451 -1.18568e+01 5.16761e+00  0.00000e+00 0.00000e+00 5.16596e+02 156.451 2.49923e+02 156.451 0.9605 
1 1 1 0   54  5  o 8  2.61340e+01 4.44498e-01 4.20287e+02 37.943  2.31880e+01  1.80796e+01  0.00000e+00 0.00000e+00 5.40231e+02 37.943  1.19944e+02 37.943  0.9828 
1 1 1 0   54  6  o 7  1.39691e+01 3.81748e-01 1.89362e+02 287.616 2.42566e+00  -7.63938e+00 0.00000e+00 0.00000e+00 2.99084e+02 287.616 1.09722e+02 287.616 0.9354 
1 1 1 0   54  7  o 9  1.68533e+01 4.23681e-01 3.41459e+02 345.760 1.84422e+01  -4.68017e+00 0.00000e+00 0.00000e+00 2.71528e+02 345.760 6.99310e+01 165.760 0.9734 
1 1 1 0   54  8  o 19 1.54861e+01 4.56839e-01 1.69581e+02 134.940 -8.20410e+00 8.22129e+00  0.00000e+00 0.00000e+00 3.83343e+02 134.940 2.13762e+02 134.940 0.9559 
1 1 1 0   54  9  o 11 1.18055e+01 4.78024e-01 2.06002e+02 349.362 1.43636e+01  -2.69801e+00 0.00000e+00 0.00000e+00 2.19355e+02 349.362 1.33534e+01 349.362 0.9652 
1 1 1 0   54  10 o 16 3.54468e+00 8.21009e-01 1.02962e+02 221.762 -1.92990e+00 -1.72325e+00 0.00000e+00 0.00000e+00 5.78372e-01 41.762  1.03540e+02 41.762  0.7742 
1 1 1 0   54  11 o 13 1.36045e+01 5.92653e-01 1.70349e+02 317.330 1.55063e+01  -1.42939e+01 0.00000e+00 0.00000e+00 3.24727e+02 317.330 1.54377e+02 317.330 0.9760 
1 1 1 0   54  12 o 8  3.09577e+00 8.76727e-01 4.64992e+01 107.598 -4.27504e-01 1.34786e+00  0.00000e+00 0.00000e+00 1.97270e+01 107.598 2.67722e+01 287.598 0.5742 
1 1 1 0   54  13 o 14 1.63434e+01 7.54257e-01 2.25043e+02 14.095  4.61382e+01  1.15851e+01  0.00000e+00 0.00000e+00 3.77008e+02 14.095  1.51965e+02 14.095  0.9894 
1 1 1 0   54  14 o 5  8.49109e+00 9.66913e-01 1.30804e+02 225.137 -1.10610e+01 -1.11138e+01 0.00000e+00 0.00000e+00 1.74822e+02 225.137 4.40175e+01 225.137 0.9676 
1 1 1 0   54  15 o 17 3.56448e+00 9.68797e-01 4.86473e+01 257.295 -5.48508e-01 -2.43295e+00 0.00000e+00 0.00000e+00 5.26144e+01 257.295 3.96718e+00 257.295 0.7643 
1 1 1 0   54  16 o 7  4.17213e+00 1.08269e+00 8.68810e+01 66.361  2.30535e+00  5.26702e+00  0.00000e+00 0.00000e+00 5.38295e+01 66.361  3.30516e+01 246.361 0.9083 
1 1 1 0   54  17 o 10 6.92591e+00 1.39973e+00 1.11446e+02 243.881 -4.62185e+00 -9.42665e+00 0.00000e+00 0.00000e+00 1.32908e+02 243.881 2.14621e+01 243.881 0.9511 
1 1 1 0   54  18 f 0  4.45252e+00 1.34930e+00 2.16351e+01 341.969 1.51953e+00  -4.94642e-01 0.00000e+00 0.00000e+00 8.05658e+01 341.969 5.89308e+01 341.969 0.6194 
1 1 1 0   55  1  o 19 5.50311e+01 7.70738e-01 9.55081e+02 183.083 -8.90772e+01 -4.79778e+00 0.00000e+00 0.00000e+00 1.09244e+03 183.083 1.37356e+02 183.083 0.9944 
1 1 1 0   55  2  o 3  3.00725e+01 4.70936e-01 5.47866e+02 113.491 -1.37813e+01 3.17086e+01  0.00000e+00 0.00000e+00 5.60857e+02 113.491 1.29910e+01 113.491 0.9854 
1 1 1 0   55  3  o 10 3.37198e+01 5.16900e-01 5.74363e+02 286.194 1.17338e+01  -4.04035e+01 0.00000e+00 0.00000e+00 6.71937e+02 286.194 9.75736e+01 286.194 0.9880 
1 1 1 0   55  4  o 6  2.53850e+01 4.33922e-01 3.73908e+02 225.798 -1.61878e+01 -1.66452e+01 0.00000e+00 0.00000e+00 5.54810e+02 225.798 1.80902e+02 225.798 0.9782 
1 1 1 0   55  5  o 10 2.16237e+01 4.11475e-01 2.34577e+02 354.280 1.39122e+01  -1.39348e+00 0.00000e+00 0.00000e+00 5.44451e+02 354.280 3.09874e+02 354.280 0.9635 
1 1 1 0   55  6  o 8  1.05137e+01 5.68507e-01 5.35077e+01 58.241  9.50547e-01  1.53550e+00  0.00000e+00 0.00000e+00 2.07102e+02 58.241  1.53594e+02 58.241  0.6632 
1 1 1 0   55  7  o 5  2.15505e+01 4.53331e-01 3.92750e+02 18.951  2.77747e+01  9.53719e+00  0.00000e+00 0.00000e+00 3.98591e+02 18.951  5.84120e+00 18.951  0.9828 
1 1 1 0   55  8  f 0  1.86300e+01 5.04089e-01 5.94058e+01 313.665 3.51475e+00  -3.68253e+00 0.00000e+00 0.00000e+00 5.63584e+02 313.665 5.04179e+02 313.665 0.8954 
1 1 1 0   55  9  o 2  1.91116e+01 4.85167e-01 3.25562e+02 242.722 -1.65561e+01 -3.21073e+01 0.00000e+00 0.00000e+00 3.77847e+02 242.722 5.22855e+01 242.722 0.9861 
1 1 1 0   55  10 o 11 1.63143e+01 5.48385e-01 2.86014e+02 93.348  -2.00435e+00 3.42671e+01  0.00000e+00 0.00000e+00 3.13641e+02 93.348  2.76270e+01 93.348  0.9853 
1 1 1 0   55  11 o 9  1.18023e+01 6.24881e-01 2.10808e+02 214.354 -1.85429e+01 -1.26747e+01 0.00000e+00 0.00000e+00 2.19272e+02 214.354 8.46370e+00 214.354 0.9775 
1 1 1 0   55  12 o 13 1.48505e+01 7.08313e-01 2.73607e+02 265.677 -3.33382e+00 -4.41067e+01 0.00000e+00 0.00000e+00 2.73341e+02 265.677 2.65265e-01 85.677  0.9886 
1 1 1 0   55  13 o 1  3.77212e+00 1.03145e+00 9.02356e+01 309.918 2.57834e+00  -3.08169e+00 0.00000e+00 0.00000e+00 3.11157e+01 309.918 5.91199e+01 129.918 0.8642 
1 1 1 0   55  14 o 14 1.08417e+01 7.85293e-01 1.76061e+02 195.312 -2.78440e+01 -7.62365e+00 0.00000e+00 0.00000e+00 2.20146e+02 195.312 4.40841e+01 195.312 0.9825 
1 1 1 0   55  15 o 5  1.62320e+01 7.75123e-01 2.85488e+02 282.931 1.77108e+01  -7.71350e+01 0.00000e+00 0.00000e+00 3.13896e+02 282.931 2.84074e+01 282.931 0.9937 
1 1 1 0   55  16 o 5  4.02327e+00 1.10876e+00 7.13821e+01 98.270  -5.96248e-01 4.10202e+00  0.00000e+00 0.00000e+00 5.84021e+01 98.270  1.29800e+01 278.270 0.8689 
1 1 1 0   55  17 o 2  5.28611e+00 1.36576e+00 4.24282e+01 319.067 2.47219e+00  -2.14394e+00 0.00000e+00 0.00000e+00 1.19959e+02 319.067 7.75306e+01 319.067 0.8283 
1 1 1 0   55  18 o 11 3.28327e+00 1.10855e+00 6.67709e+01 333.682 4.03977e+00  -1.99817e+00 0.00000e+00 0.00000e+00 4.03403e+01 333.682 2.64305e+01 153.682 0.8805 
1 1 1 0   56  0  o 2  8.47853e+01 1.64336e+00 1.26091e+03 182.282 -1.07437e+02 -4.28191e+00 0.00000e+00 0.00000e+00 1.89632e+03 182.282 6.35414e+02 182.282 0.9953 
1 1 1 0   56  1  o 13 5.06927e+01 7.17132e-01 5.75954e+02 247.784 -2.28770e+01 -5.60139e+01 0.00000e+00 0.00000e+00 1.30478e+03 247.784 7.28828e+02 247.784 0.9917 
1 1 1 0   56  2  o 17 1.45251e+01 3.44643e-01 2.56173e+02 309.530 4.96168e+00  -6.01267e+00 0.00000e+00 0.00000e+00 2.51027e+02 309.530 5.14678e+00 129.530 0.9335 
1 1 1 0   56  3  o 3  3.92205e+01 5.80166e-01 6.34136e+02 219.773 -4.22155e+01 -3.51385e+01 0.00000e+00 0.00000e+00 8.19376e+02 219.773 1.85240e+02 219.773 0.9909 
1 1 1 0   56  4  o 1  1.61206e+01 3.70395e-01 3.74440e+02 47.326  1.10204e+01  1.19538e+01  0.00000e+00 0.00000e+00 2.09530e+02 47.326  1.64910e+02 227.326 0.9687 
1 1 1 0   56  5  o 18 2.59984e+01 4.50584e-01 4.75845e+02 301.332 1.80709e+01  -2.96836e+01 0.00000e+00 0.00000e+00 4.81985e+02 301.332 6.13963e+00 301.332 0.9855 
1 1 1 0   56  6  o 5  2.23436e+01 4.26607e-01 3.64834e+02 261.948 -3.55953e+00 -2.51611e+01 0.00000e+00 0.00000e+00 4.53576e+02 261.948 8.87415e+01 261.948 0.9801 
1 1 1 0   56  7  o 8  2.42455e+01 4.74636e-01 4.15075e+02 354.450 3.93374e+01  -3.82228e+00 0.00000e+00 0.00000e+00 4.79115e+02 354.450 6.40390e+01 354.450 0.9873 
1 1 1 0   56  8  f 0  1.89690e+01 4.72091e-01 2.79744e+02 152.258 -2.23594e+01 1.17600e+01  0.00000e+00 0.00000e+00 4.14381e+02 152.258 1.34637e+02 152.258 0.9800 
1 1 1 0   56  9  o 11 1.79205e+01 5.37698e-01 3.66227e+02 280.191 7.13184e+00  -3.96725e+01 0.00000e+00 0.00000e+00 2.94213e+02 280.191 7.20139e+01 100.191 0.9875 
1 1 1 0   56  10 o 1  1.05098e+01 5.92381e-01 1.93149e+02 102.270 -3.32120e+00 1.52713e+01  0.00000e+00 0.00000e+00 1.86092e+02 102.270 7.05674e+00 282.270 0.9675 
1 1 1 0   56  11 o 9  1.38160e+01 5.98378e-01 1.80592e+02 334.403 2.15483e+01  -1.03228e+01 0.00000e+00 0.00000e+00 3.23495e+02 334.403 1.42903e+02 334.403 0.9788 
1 1 1 0   56  12 o 4  1.19390e+01 7.69734e-01 2.17767e+02 152.477 -2.50638e+01 1.30599e+01  0.00000e+00 0.00000e+00 2.18997e+02 152.477 1.22995e+00 152.477 0.9821 
1 1 1 0   56  13 o 16 1.18635e+01 8.78076e-01 2.16123e+02 329.471 2.79787e+01  -1.64996e+01 0.00000e+00 0.00000e+00 2.18582e+02 329.471 2.45843e+00 329.471 0.9845 
1 1 1 0   56  14 o 18 4.37759e+00 1.02533e+00 7.86191e+01 317.801 3.40857e+00  -3.09060e+00 0.00000e+00 0.00000e+00 6.51687e+01 317.801 1.34504e+01 137.801 0.8832 
1 1 1 0   56  15 o 19 3.27102e+00 1.00966e+00 1.09653e+02 61.211  2.65365e+00  4.82918e+00  0.00000e+00 0.00000e+00 2.18299e-01 61.211  1.09435e+02 241.211 0.9040 
1 1 1 0   56  16 o 8  3.71754e+00 1.13176e+00 9.21127e+01 132.223 -3.49602e+00 3.85250e+00  0.00000e+00 0.00000e+00 3.17919e+01 132.223 6.03208e+01 312.223 0.8979 
1 1 1 0   56  17 o 18 3.65106e+00 1.14478e+00 6.40615e+01 236.093 -2.24868e+00 -3.34556e+00 0.00000e+00 0.00000e+00 5.30143e+01 236.093 1.10472e+01 56.093  0.8647 
1 1 1 0   56  18 o 1  3.47018e+00 1.14822e+00 9.35084e+01 352.020 6.19307e+00  -8.68134e-01 0.00000e+00 0.00000e+00 2.42587e+01 352.020 6.92496e+01 172.020 0.9161 
1 1 1 0   57  1  o 2  3.13529e+01 4.87083e-01 4.94547e+02 157.718 -2.98866e+01 1.22464e+01  0.00000e+00 0.00000e+00 6.59918e+02 157.718 1.65370e+02 157.718 0.9844 
1 1 1 0   57  2  o 16 1.82279e+01 3.63440e-01 4.07673e+02 168.375 -1.58334e+01 3.25736e+00  0.00000e+00 0.00000e+00 2.52651e+02 168.375 1.55022e+02 348.375 0.9686 
1 1 1 0   57  3  o 14 2.87083e+01 4.64614e-01 5.05270e+02 128.467 -2.20408e+01 2.77416e+01  0.00000e+00 0.00000e+00 5.53053e+02 128.467 4.77829e+01 128.467 0.9858 
1 1 1 0   57  4  o 10 2.11473e+01 4.02446e-01 3.75468e+02 133.274 -1.42661e+01 1.51526e+01  0.00000e+00 0.00000e+00 3.95956e+02 133.274 2.04874e+01 133.274 0.9757 
1 1 1 0   57  5  o 14 2.28287e+01 4.24224e-01 3.76857e+02 358.561 2.60315e+01  -6.53666e-01 0.00000e+00 0.00000e+00 4.59884e+02 358.561 8.30272e+01 358.561 0.9806 
1 1 1 0   57  6  o 1  3.02507e+01 5.00115e-01 5.25968e+02 3.855   5.06763e+01  3.41520e+00  0.00000e+00 0.00000e+00 5.93176e+02 3.855   6.72078e+01 3.855   0.9901 
1 1 1 0   57  7  o 4  1.48890e+01 4.59013e-01 2.52516e+02 138.650 -1.21727e+01 1.07128e+01  0.00000e+00 0.00000e+00 2.86165e+02 138.650 3.36493e+01 138.650 0.9687 
1 1 1 0   57  8  o 18 2.69658e+01 5.36419e-01 3.84910e+02 279.096 8.31853e+00  -5.19562e+01 0.00000e+00 0.00000e+00 6.12204e+02 279.096 2.27295e+02 279.096 0.9905 
1 1 1 0   57  9  o 8  2.49596e+01 5.96829e-01 4.04862e+02 64.413  2.70711e+01  5.65359e+01  0.00000e+00 0.00000e+00 5.19022e+02 64.413  1.14160e+02 64.413  0.9920 
1 1 1 0   57  10 o 5  1.21855e+01 5.77352e-01 1.99049e+02 359.469 2.02264e+01  -1.87471e-01 0.00000e+00 0.00000e+00 2.43997e+02 359.469 4.49483e+01 359.469 0.9750 
1 1 1 0   57  11 o 16 8.08265e+00 7.66867e-01 1.44706e+02 225.631 -7.59934e+00 -7.76870e+00 0.00000e+00 0.00000e+00 1.42309e+02 225.631 2.39709e+00 45.631  0.9528 
1 1 1 0   57  12 o 18 9.89721e+00 7.86645e-01 1.38149e+02 121.773 -8.14430e+00 1.31492e+01  0.00000e+00 0.00000e+00 2.18324e+02 121.773 8.01746e+01 121.773 0.9671 
1 1 1 0   57  13 o 7  1.69493e+01 6.40468e-01 2.89090e+02 32.152  5.95970e+01  3.74603e+01  0.00000e+00 0.00000e+00 3.37161e+02 32.152  4.80709e+01 32.152  0.9929 
1 1 1 0   57  14 o 1  9.36540e+00 8.56823e-01 1.28119e+02 157.981 -1.62085e+01 6.55494e+00  0.00000e+00 0.00000e+00 2.10006e+02 157.981 8.18875e+01 157.981 0.9710 
1 1 1 0   57  15 o 6  3.78058e+00 1.07364e+00 1.15077e+02 268.320 -1.79484e-01 -6.12013e+00 0.00000e+00 0.00000e+00 1.33252e+01 268.320 1.01752e+02 88.320  0.9142 
1 1 1 0   57  16 o 3  3.87565e+00 1.14659e+00 5.53076e+01 345.312 3.15742e+00  -8.27639e-01 0.00000e+00 0.00000e+00 6.37619e+01 345.312 8.45436e+00 345.312 0.8278 
1 1 1 0   57  17 o 14 5.34484e+00 1.38904e+00 9.48723e+01 322.305 5.68537e+00  -4.39333e+00 0.00000e+00 0.00000e+00 8.89427e+01 322.305 5.92962e+00 142.305 0.9275 
1 1 1 0   57  18 o 13 4.50793e+00 1.34674e+00 6.48341e+01 2.788   4.85385e+00  2.36345e-01  0.00000e+00 0.00000e+00 8.37683e+01 2.788   1.89342e+01 2.788   0.8900 
1 1 1 0   58  0  o 1  3.68564e+01 7.78017e-01 4.40703e+02 191.934 -1.71773e+01 -3.63056e+00 0.00000e+00 0.00000e+00 8.97898e+02 191.934 4.57195e+02 191.934 0.9711 
1 1 1 0   58  1  o 10 3.00054e+01 4.73256e-01 4.66229e+02 326.372 2.58789e+01  -1.72123e+01 0.00000e+00 0.00000e+00 6.37754e+02 326.372 1.71525e+02 326.372 0.9838 
1 1 1 0   58  2  o 15 2.50946e+01 4.25144e-01 5.04481e+02 163.452 -2.97689e+01 8.84503e+00  0.00000e+00 0.00000e+00 4.18722e+02 163.452 8.57589e+01 343.452 0.9838 
1 1 1 0   58  3  o 8  2.16113e+01 4.04223e-01 2.86791e+02 344.086 1.60271e+01  -4.56978e+00 0.00000e+00 0.00000e+00 4.96634e+02 344.086 2.09844e+02 344.086 0.9695 
1 1 1 0   58  4  o 6  2.60506e+01 4.47328e-01 4.18114e+02 204.111 -2.72956e+01 -1.22162e+01 0.00000e+00 0.00000e+00 5.39297e+02 204.111 1.21183e+02 204.111 0.9831 
1 1 1 0   58  5  o 11 2.12962e+01 4.15466e-01 2.33978e+02 92.123  -5.98210e-01 1.61375e+01  0.00000e+00 0.00000e+00 5.36854e+02 92.123  3.02876e+02 92.123  0.9685 
1 1 1 0   58  6  o 4  3.77489e+01 6.82268e-01 5.88003e+02 270.293 3.98442e-01  -7.79542e+01 0.00000e+00 0.00000e+00 8.13202e+02 270.293 2.25199e+02 270.293 0.9936 
1 1 1 0   58  7  o 14 3.41754e+01 5.78695e-01 4.94379e+02 202.833 -6.82328e+01 -2.87293e+01 0.00000e+00 0.00000e+00 7.73241e+02 202.833 2.78863e+02 202.833 0.9932 
1 1 1 0   58  8  o 15 9.38992e+00 5.44740e-01 1.51969e+02 108.710 -2.48322e+00 7.33221e+00  0.00000e+00 0.00000e+00 1.75042e+02 108.710 2.30730e+01 108.710 0.9330 
1 1 1 0   58  9  o 10 1.44885e+01 5.31388e-01 2.09390e+02 312.657 1.46132e+01  -1.58599e+01 0.00000e+00 0.00000e+00 3.18464e+02 312.657 1.09074e+02 312.657 0.9765 
1 1 1 0   58  10 o 7  1.50692e+01 7.04036e-01 2.93254e+02 32.492  3.12202e+01  1.98834e+01  0.00000e+00 0.00000e+00 2.60983e+02 32.492  3.22707e+01 212.492 0.9864 
1 1 1 0   58  11 o 16 1.06080e+01 6.98091e-01 2.37722e+02 292.766 1.02203e+01  -2.43535e+01 0.00000e+00 0.00000e+00 1.50004e+02 292.766 8.77182e+01 112.766 0.9809 
1 1 1 0   58  12 o 15 8.13438e+00 1.01171e+00 1.18216e+02 348.848 1.03049e+01  -2.03144e+00 0.00000e+00 0.00000e+00 1.69878e+02 348.848 5.16629e+01 348.848 0.9511 
1 1 1 0   58  13 o 10 2.66189e+00 7.92678e-01 8.88009e+01 179.316 -3.15538e+00 3.76573e-02  0.00000e+00 0.00000e+00 7.49995e+00 359.316 9.63008e+01 359.316 0.8209 
1 1 1 0   58  14 o 3  3.85070e+00 1.05456e+00 3.45490e+01 350.456 1.79963e+00  -3.02577e-01 0.00000e+00 0.00000e+00 6.09116e+01 350.456 2.63625e+01 350.456 0.6668 
1 1 1 0   58  15 o 10 1.37077e+01 8.44282e-01 2.03370e+02 342.678 4.80821e+01  -1.49959e+01 0.00000e+00 0.00000e+00 3.00715e+02 342.678 9.73457e+01 342.678 0.9900 
1 1 1 0   58  16 o 10 4.22882e+00 1.19706e+00 5.94378e+01 145.224 -3.07573e+00 2.13576e+00  0.00000e+00 0.00000e+00 7.44106e+01 145.224 1.49728e+01 145.224 0.8529 
1 1 1 0   58  17 o 14 2.76024e+00 9.47801e-01 3.84914e+01 143.760 -1.77647e+00 1.30206e+00  0.00000e+00 0.00000e+00 3.60420e+01 143.760 2.44948e+00 323.760 0.7284 
1 1 1 0   58  18 o 6  3.18966e+00 1.07651e+00 6.25650e+01 298.619 2.25574e+00  -4.13400e+00 0.00000e+00 0.00000e+00 4.21105e+01 298.619 2.04545e+01 118.619 0.8862 
1 1 1 0   59  1  o 16 3.37714e+01 5.16148e-01 6.03514e+02 93.381  -2.93330e+00 4.96453e+01  0.00000e+00 0.00000e+00 6.46553e+02 93.381  4.30394e+01 93.381  0.9899 
1 1 1 0   59  2  o 5  1.99866e+01 3.83545e-01 3.44580e+02 85.123  1.41173e+00  1.65468e+01  0.00000e+00 0.00000e+00 3.79859e+02 85.123  3.52786e+01 85.123  0.9694 
1 1 1 0   59  3  o 19 1.53034e+01 4.18367e-01 2.67894e+02 329.978 9.29387e+00  -5.37062e+00 0.00000e+00 0.00000e+00 2.76874e+02 329.978 8.97926e+00 329.978 0.9522 
1 1 1 0   59  4  o 7  1.15415e+01 3.71564e-01 1.96802e+02 215.346 -5.63901e+00 -3.99940e+00 0.00000e+00 0.00000e+00 2.02030e+02 215.346 5.22726e+00 215.346 0.9246 
1 1 1 0   59  5  o 15 3.17576e+01 5.12535e-01 5.57554e+02 50.592  3.48797e+01  4.24518e+01  0.00000e+00 0.00000e+00 6.18253e+02 50.592  6.06988e+01 50.592  0.9909 
1 1 1 0   59  6  o 1  3.23184e+01 5.25310e-01 5.14790e+02 285.843 1.56542e+01  -5.51618e+01 0.00000e+00 0.00000e+00 6.81843e+02 285.843 1.67053e+02 285.843 0.9912 
1 1 1 0   59  7  o 7  2.15204e+01 4.57254e-01 3.94801e+02 14.328  3.80474e+01  9.71811e+00  0.00000e+00 0.00000e+00 3.98443e+02 14.328  3.64187e+00 14.328  0.9872 
1 1 1 0   59  8  o 15 1.45628e+01 5.05480e-01 2.86156e+02 87.855  8.97997e-01  2.39731e+01  0.00000e+00 0.00000e+00 2.45900e+02 87.855  4.02559e+01 267.855 0.9789 
1 1 1 0   59  9  o 13 1.36493e+01 5.33744e-01 2.38961e+02 304.931 1.39788e+01  -2.00151e+01 0.00000e+00 0.00000e+00 2.59648e+02 304.931 2.06869e+01 304.931 0.9793 
1 1 1 0   59  10 o 1  5.91194e+00 7.97818e-01 1.25279e+02 23.775  5.61118e+00  2.47192e+00  0.00000e+00 0.00000e+00 7.62457e+01 23.775  4.90328e+01 203.775 0.9144 
1 1 1 0   59  11 o 12 1.02579e+01 7.11487e-01 2.18035e+02 214.702 -1.88187e+01 -1.30319e+01 0.00000e+00 0.00000e+00 1.55698e+02 214.702 6.23371e+01 34.702  0.9779 
1 1 1 0   59  12 o 18 1.58382e+01 7.22796e-01 2.69328e+02 109.719 -1.82357e+01 5.08779e+01  0.00000e+00 0.00000e+00 3.14855e+02 109.719 4.55265e+01 109.719 0.9907 
1 1 1 0   59  13 o 5  4.63632e+00 9.34983e-01 6.71676e+01 282.384 8.84221e-01  -4.02701e+00 0.00000e+00 0.00000e+00 8.25607e+01 282.384 1.53931e+01 282.384 0.8681 
1 1 1 0   59  14 o 2  9.17780e+00 8.85317e-01 1.78603e+02 87.834  8.66662e-01  2.29122e+01  0.00000e+00 0.00000e+00 1.55023e+02 87.834  2.35798e+01 267.834 0.9779 
1 1 1 0   59  15 o 1  3.58267e+00 1.04181e+00 1.02570e+02 309.541 3.55667e+00  -4.30837e+00 0.00000e+00 0.00000e+00 1.79004e+01 309.541 8.46698e+01 129.541 0.9054 
1 1 1 0   59  16 o 10 4.61375e+00 1.24967e+00 1.03598e+02 71.750  2.26047e+00  6.85526e+00  0.00000e+00 0.00000e+00 5.52434e+01 71.750  4.83549e+01 251.750 0.9279 
1 1 1 0   59  17 f 0  4.97395e+00 1.34115e+00 8.17102e+01 281.690 1.26763e+00  -6.12633e+00 0.00000e+00 0.00000e+00 8.71974e+01 281.690 5.48715e+00 281.690 0.9162 
1 1 1 0   59  18 o 16 4.42565e+00 1.32620e+00 6.87554e+01 342.234 5.31262e+00  -1.70217e+00 0.00000e+00 0.00000e+00 7.95872e+01 342.234 1.08317e+01 342.234 0.9053 
1 1 1 0   60  0  o 3  3.43631e+01 7.40182e-01 5.30642e+02 49.482  1.42064e+01  1.66231e+01  0.00000e+00 0.00000e+00 7.24413e+02 49.482  1.93771e+02 49.482  0.9769 
1 1 1 0   60  1  o 14 3.22210e+01 5.01371e-01 6.17202e+02 156.382 -4.36839e+01 1.91015e+01  0.00000e+00 0.00000e+00 5.74755e+02 156.382 4.24469e+01 336.382 0.9895 
1 1 1 0   60  2  o 17 8.55391e+00 3.68694e-01 2.66072e+02 263.835 -6.41976e-01 -5.94384e+00 0.00000e+00 0.00000e+00 2.55735e+01 263.835 2.40499e+02 83.836  0.9120 
1 1 1 0   60  3  o 3  2.38455e+01 4.86342e-01 3.74719e+02 90.405  -1.73031e-01 2.44695e+01  0.00000e+00 0.00000e+00 4.98178e+02 90.405  1.23460e+02 90.405  0.9793 
1 1 1 0   60  4  o 2  2.43374e+01 4.33975e-01 4.99500e+02 118.863 -1.68825e+01 3.06299e+01  0.00000e+00 0.00000e+00 3.96898e+02 118.863 1.02602e+02 298.863 0.9856 
1 1 1 0   60  5  o 10 3.27070e+01 5.24424e-01 3.93323e+02 9.232   4.04638e+01  6.57706e+00  0.00000e+00 0.00000e+00 8.13614e+02 9.232   4.20291e+02 9.232   0.9877 
1 1 1 0   60  6  f 0  3.58301e+01 5.62789e-01 5.43505e+02 3.204   8.34146e+01  4.66955e+00  0.00000e+00 0.00000e+00 7.86623e+02 3.204   2.43118e+02 3.204   0.9940 
1 1 1 0   60  7  o 9  1.94579e+01 4.35149e-01 3.75772e+02 77.581  7.67106e+00  3.48348e+01  0.00000e+00 0.00000e+00 3.40387e+02 77.581  3.53847e+01 257.581 0.9859 
1 1 1 0   60  8  o 14 1.34716e+01 5.14575e-01 2.10335e+02 219.605 -1.26147e+01 -1.04378e+01 0.00000e+00 0.00000e+00 2.76764e+02 219.605 6.64283e+01 219.605 0.9690 
1 1 1 0   60  9  o 12 8.15046e+00 6.18575e-01 1.55904e+02 253.681 -2.64543e+00 -9.03535e+00 0.00000e+00 0.00000e+00 1.31448e+02 253.681 2.44565e+01 73.681  0.9453 
1 1 1 0   60  10 o 16 1.80328e+01 6.25261e-01 2.56667e+02 346.911 4.07543e+01  -9.47539e+00 0.00000e+00 0.00000e+00 4.07414e+02 346.911 1.50747e+02 346.911 0.9880 
1 1 1 0   60  11 o 16 1.29677e+01 6.74948e-01 2.49641e+02 195.368 -3.36934e+01 -9.26062e+00 0.00000e+00 0.00000e+00 2.26449e+02 195.368 2.31919e+01 15.368  0.9856 
1 1 1 0   60  12 o 11 9.80732e+00 6.72765e-01 1.78318e+02 9.058   2.09549e+01  3.34057e+00  0.00000e+00 0.00000e+00 1.78045e+02 9.058   2.72526e-01 189.058 0.9761 
1 1 1 0   60  13 o 12 4.30198e+00 9.64576e-01 7.30337e+01 85.630  3.05552e-01  3.99824e+00  0.00000e+00 0.00000e+00 6.52049e+01 85.630  7.82883e+00 265.630 0.8639 
1 1 1 0   60  14 o 19 6.38634e+00 9.91288e-01 1.19026e+02 223.627 -7.58601e+00 -7.23081e+00 0.00000e+00 0.00000e+00 1.06699e+02 223.627 1.23274e+01 43.627  0.9510 
1 1 1 0   60  15 o 7  4.34605e+00 1.14406e+00 1.16618e+02 313.496 5.07508e+00  -5.34882e+00 0.00000e+00 0.00000e+00 3.33809e+01 313.496 8.32369e+01 133.496 0.9295 
1 1 1 0   60  16 o 10 8.26571e+00 1.20363e+00 1.45226e+02 182.678 -1.85640e+01 -8.68273e-01 0.00000e+00 0.00000e+00 1.53041e+02 182.678 7.81458e+00 182.678 0.9727 
1 1 1 0   60  17 f 0  3.76665e+00 1.19129e+00 2.54460e+01 71.815  5.42739e-01  1.65222e+00  0.00000e+00 0.00000e+00 6.52782e+01 71.815  3.98322e+01 71.815  0.6499 
1 1 1 0   60  18 o 5  4.27412e+00 1.30563e+00 9.23741e+01 336.875 6.67200e+00  -2.84926e+00 0.00000e+00 0.00000e+00 5.45057e+01 336.875 3.78684e+01 156.875 0.9283 
1 1 1 0   61  1  o 4  2.01269e+01 3.86256e-01 2.27486e+02 71.143  3.88090e+00  1.13632e+01  0.00000e+00 0.00000e+00 4.92839e+02 71.143  2.65352e+02 71.143  0.9574 
1 1 1 0   61  2  o 19 1.33107e+01 3.59586e-01 2.24147e+02 274.250 6.09828e-01  -8.20568e+00 0.00000e+00 0.00000e+00 2.42086e+02 274.250 1.79392e+01 274.250 0.9371 
1 1 1 0   61  3  o 2  1.45976e+01 4.20869e-01 2.26788e+02 274.160 7.28405e-01  -1.00153e+01 0.00000e+00 0.00000e+00 2.90832e+02 274.160 6.40439e+01 274.160 0.9488 
1 1 1 0   61  4  o 2  2.57326e+01 4.48628e-01 3.62330e+02 196.699 -2.87722e+01 -8.63140e+00 0.00000e+00 0.00000e+00 5.83002e+02 196.699 2.20671e+02 196.699 0.9832 
1 1 1 0   61  5  o 7  3.27899e+01 5.28284e-01 5.91333e+02 81.840  9.77922e+00  6.82022e+01  0.00000e+00 0.00000e+00 6.24573e+02 81.840  3.32403e+01 81.840  0.9927 
1 1 1 0   61  6  o 18 3.15140e+01 5.20649e-01 4.68868e+02 56.179  3.51481e+01  5.24627e+01  0.00000e+00 0.00000e+00 6.98550e+02 56.179  2.29682e+02 56.179  0.9921 
1 1 1 0   61  7  o 18 3.43955e+01 6.49771e-01 5.69097e+02 292.101 3.68673e+01  -9.07909e+01 0.00000e+00 0.00000e+00 7.08197e+02 292.101 1.39100e+02 292.101 0.9949 
1 1 1 0   61  8  o 7  1.00707e+01 5.50558e-01 2.17665e+02 288.223 4.19332e+00  -1.27366e+01 0.00000e+00 0.00000e+00 1.43771e+02 288.223 7.38938e+01 108.223 0.9620 
1 1 1 0   61  9  o 9  1.29972e+01 5.21290e-01 2.38716e+02 63.445  1.08064e+01  2.16222e+01  0.00000e+00 0.00000e+00 2.35815e+02 63.445  2.90080e+00 243.445 0.9791 
1 1 1 0   61  10 o 13 8.52045e+00 7.09213e-01 1.66573e+02 274.672 1.02317e+00  -1.25196e+01 0.00000e+00 0.00000e+00 1.38055e+02 274.672 2.85172e+01 94.672  0.9593 
1 1 1 0   61  11 o 18 1.15540e+01 6.84637e-01 2.28638e+02 159.332 -2.71092e+01 1.02262e+01  0.00000e+00 0.00000e+00 1.94190e+02 159.332 3.44475e+01 339.332 0.9826 
1 1 1 0   61  12 o 1  1.60075e+01 5.87795e-01 2.79611e+02 74.330  1.65155e+01  5.88727e+01  0.00000e+00 0.00000e+00 3.11269e+02 74.330  3.16580e+01 74.330  0.9918 
1 1 1 0   61  13 o 12 7.69307e+00 8.09326e-01 1.57699e+02 284.991 4.78418e+00  -1.78659e+01 0.00000e+00 0.00000e+00 1.20560e+02 284.991 3.71393e+01 104.991 0.9726 
1 1 1 0   61  14 o 12 6.12467e+00 9.73863e-01 9.09656e+01 189.012 -8.37200e+00 -1.32774e+00 0.00000e+00 0.00000e+00 1.22743e+02 189.012 3.17774e+01 189.012 0.9390 
1 1 1 0   61  15 o 16 3.93788e+00 1.14203e+00 1.70636e+02 339.057 9.27843e+00  -3.55101e+00 0.00000e+00 0.00000e+00 3.20028e+01 159.057 2.02639e+02 159.057 0.9483 
1 1 1 0   61  16 o 12 6.29914e+00 1.30438e+00 9.80085e+01 118.879 -4.37096e+00 7.92482e+00  0.00000e+00 0.00000e+00 1.22320e+02 118.879 2.43120e+01 118.879 0.9430 
1 1 1 0   61  17 o 7  3.75066e+00 1.18624e+00 5.65700e+01 76.428  9.54326e-01  3.95313e+00  0.00000e+00 0.00000e+00 6.37885e+01 76.428  7.21850e+00 76.428  0.8660 
1 1 1 0   61  18 o 8  3.79981e+00 1.21582e+00 5.42223e+01 264.655 -4.05596e-01 -4.33497e+00 0.00000e+00 0.00000e+00 6.89662e+01 264.655 1.47440e+01 264.655 0.8759 
1 1 1 0   62  0  o 15 1.64705e+01 5.12453e-01 3.36721e+02 131.689 -5.08640e+00 5.71098e+00  0.00000e+00 0.00000e+00 2.37094e+02 131.689 9.96273e+01 311.689 0.9321 
1 1 1 0   62  1  o 7  2.22753e+01 4.06420e-01 3.51050e+02 164.249 -2.06928e+01 5.83621e+00  0.00000e+00 0.00000e+00 4.61888e+02 164.249 1.10839e+02 164.249 0.9765 
1 1 1 0   62  2  o 15 2.58075e+01 4.41296e-01 4.19106e+02 83.382  3.49494e+00  3.01245e+01  0.00000e+00 0.00000e+00 5.29319e+02 83.382  1.10213e+02 83.382  0.9834 
1 1 1 0   62  3  o 6  1.05284e+01 4.26869e-01 3.27689e+02 180.960 -9.91368e+00 -1.66116e-01 0.00000e+00 0.00000e+00 4.53136e+01 180.960 2.82376e+02 0.960   0.9481 
1 1 1 0   62  4  o 1  2.38081e+01 4.33985e-01 4.22062e+02 83.058  3.90000e+00  3.20293e+01  0.00000e+00 0.00000e+00 4.53463e+02 83.058  3.14009e+01 83.058  0.9844 
1 1 1 0   62  5  o 8  2.97531e+01 5.31986e-01 5.23570e+02 29.422  4.67077e+01  2.63416e+01  0.00000e+00 0.00000e+00 5.77221e+02 29.422  5.36501e+01 29.422  0.9906 
1 1 1 0   62  6  o 11 1.09425e+01 4.20850e-01 1.81263e+02 281.526 1.75362e+00  -8.59892e+00 0.00000e+00 0.00000e+00 2.03241e+02 281.526 2.19776e+01 281.526 0.9412 
1 1 1 0   62  7  f 0  3.18005e+01 6.19187e-01 4.60155e+02 333.486 7.03910e+01  -3.51166e+01 0.00000e+00 0.00000e+00 7.19077e+02 333.486 2.58923e+02 333.486 0.9936 
1 1 1 0   62  8  o 7  7.76162e+00 6.01944e-01 2.46691e+02 278.030 1.82012e+00  -1.29016e+01 0.00000e+00 0.00000e+00 3.14984e+01 278.030 2.15192e+02 98.030  0.9608 
1 1 1 0   62  9  o 5  7.23862e+00 7.91247e-01 1.62917e+02 201.149 -8.77445e+00 -3.39437e+00 0.00000e+00 0.00000e+00 9.21912e+01 201.149 7.07261e+01 21.149  0.9453 
1 1 1 0   62  10 o 8  7.82910e+00 7.59675e-01 1.68535e+02 22.822  1.11895e+01  4.70864e+00  0.00000e+00 0.00000e+00 1.10907e+02 22.822  5.76283e+01 202.822 0.9579 
1 1 1 0   62  11 o 19 7.78715e+00 7.02685e-01 1.87593e+02 95.150  -1.33985e+00 1.48653e+01  0.00000e+00 0.00000e+00 9.24961e+01 95.150  9.50972e+01 275.150 0.9659 
1 1 1 0   62  12 o 7  1.44530e+01 6.07189e-01 2.39314e+02 326.838 4.03024e+01  -2.63346e+01 0.00000e+00 0.00000e+00 2.92895e+02 326.838 5.35807e+01 326.838 0.9896 
1 1 1 0   62  13 o 13 1.71110e+01 6.46127e-01 3.61803e+02 210.112 -8.51769e+01 -4.93996e+01 0.00000e+00 0.00000e+00 2.71205e+02 210.112 9.05984e+01 30.112  0.9949 
1 1 1 0   62  14 o 11 4.90454e+00 1.10026e+00 1.17624e+02 71.695  2.42856e+00  7.34133e+00  0.00000e+00 0.00000e+00 5.23665e+01 71.695  6.52578e+01 251.695 0.9329 
1 1 1 0   62  15 o 8  9.11228e+00 9.99238e-01 1.33946e+02 9.439   1.91423e+01  3.18235e+00  0.00000e+00 0.00000e+00 1.95467e+02 9.439   6.15216e+01 9.439   0.9739 
1 1 1 0   62  16 o 15 6.48028e+00 1.34395e+00 9.72463e+01 104.766 -2.28790e+00 8.68022e+00  0.00000e+00 0.00000e+00 1.29264e+02 104.766 3.20175e+01 104.766 0.9425 
1 1 1 0   62  17 o 13 6.91359e+00 1.45957e+00 1.17592e+02 348.820 1.21816e+01  -2.40755e+00 0.00000e+00 0.00000e+00 1.27998e+02 348.820 1.04058e+01 348.820 0.9588 
1 1 1 0   62  18 o 5  4.52075e+00 1.33638e+00 7.09965e+01 193.089 -5.79112e+00 -1.34648e+00 0.00000e+00 0.00000e+00 8.15012e+01 193.089 1.05047e+01 193.089 0.9115 
1 1 1 0   63  1  o 8  4.78309e+01 6.88375e-01 8.41196e+02 58.759  6.22666e+01  1.02647e+02  0.00000e+00 0.00000e+00 9.38711e+02 58.759  9.75145e+01 58.759  0.9958 
1 1 1 0   63  2  o 13 2.30887e+01 4.19586e-01 3.79062e+02 235.205 -1.43862e+01 -2.07028e+01 0.00000e+00 0.00000e+00 4.66362e+02 235.205 8.73000e+01 235.205 0.9800 
1 1 1 0   63  3  o 18 2.21120e+01 4.55200e-01 2.51723e+02 8.422   1.71545e+01  2.54003e+00  0.00000e+00 0.00000e+00 5.50183e+02 8.422   2.98459e+02 8.422   0.9707 
1 1 1 0   63  4  o 4  7.75287e+00 4.38883e-01 2.08667e+02 84.958  4.69333e-01  5.31996e+00  0.00000e+00 0.00000e+00 5.21656e+01 84.958  1.56501e+02 264.958 0.9007 
1 1 1 0   63  5  o 14 8.42198e+00 5.15067e-01 1.70853e+02 84.537  5.89452e-01  6.16296e+00  0.00000e+00 0.00000e+00 1.16974e+02 84.537  5.38799e+01 264.537 0.9152 
1 1 1 0   63  6  o 16 1.80386e+01 4.86581e-01 2.01586e+02 113.815 -7.14336e+00 1.61850e+01  0.00000e+00 0.00000e+00 4.52451e+02 113.815 2.50864e+02 113.815 0.9713 
1 1 1 0   63  7  o 14 1.37511e+01 4.89271e-01 2.44079e+02 236.781 -1.05948e+01 -1.61786e+01 0.00000e+00 0.00000e+00 2.55578e+02 236.781 1.14994e+01 236.781 0.9738 
1 1 1 0   63  8  o 18 2.07128e+01 5.49824e-01 3.49544e+02 301.446 2.67057e+01  -4.36714e+01 0.00000e+00 0.00000e+00 4.15391e+02 301.446 6.58465e+01 301.446 0.9902 
1 1 1 0   63  9  f 0  1.99659e+01 6.18611e-01 3.15487e+02 187.761 -5.31995e+01 -7.25044e+00 0.00000e+00 0.00000e+00 4.21824e+02 187.761 1.06338e+02 187.761 0.9906 
1 1 1 0   63  10 o 19 7.44081e+00 7.51686e-01 1.91541e+02 183.761 -1.32780e+01 -8.72804e-01 0.00000e+00 0.00000e+00 7.50421e+01 183.761 1.16499e+02 3.761   0.9617 
1 1 1 0   63  11 o 19 1.11657e+01 6.00741e-01 1.89999e+02 296.697 1.14020e+01  -2.26735e+01 0.00000e+00 0.00000e+00 2.17445e+02 296.697 2.74453e+01 296.697 0.9801 
1 1 1 0   63  12 o 5  5.62579e+00 8.95170e-01 1.40325e+02 218.901 -7.72079e+00 -6.23013e+00 0.00000e+00 0.00000e+00 5.81385e+01 218.901 8.21866e+01 38.901  0.9482 
1 1 1 0   63  13 o 14 7.28752e+00 8.63928e-01 1.18409e+02 162.062 -1.18789e+01 3.84557e+00  0.00000e+00 0.00000e+00 1.41433e+02 162.062 2.30234e+01 162.062 0.9591 
1 1 1 0   63  14 o 6  6.97247e+00 1.04293e+00 1.64726e+02 322.309 1.34354e+01  -1.03808e+01 0.00000e+00 0.00000e+00 8.65301e+01 322.309 7.81956e+01 142.309 0.9701 
1 1 1 0   63  15 o 4  6.86517e+00 1.21018e+00 1.42680e+02 1.667   1.33049e+01  3.87136e-01  0.00000e+00 0.00000e+00 1.02345e+02 1.667   4.03342e+01 181.667 0.9617 
1 1 1 0   63  16 o 15 3.65224e+00 1.07432e+00 1.89769e+02 72.782  3.50080e+00  1.12969e+01  0.00000e+00 0.00000e+00 6.02077e+01 252.782 2.49977e+02 252.782 0.9567 
1 1 1 0   63  17 o 5  3.34755e+00 1.10185e+00 1.10414e+02 162.019 -7.17544e+00 2.32884e+00  0.00000e+00 0.00000e+00 5.04555e+00 162.019 1.05368e+02 342.019 0.9311 
1 1 1 0   63  18 o 18 6.53257e+00 1.59438e+00 1.40618e+02 267.368 -6.12739e-01 -1.33275e+01 0.00000e+00 0.00000e+00 9.18538e+01 267.368 4.87641e+01 87.368  0.9618 
1 1 1 0   64  0  o 14 3.50986e+01 7.62291e-01 5.56793e+02 6.635   2.77854e+01  3.23209e+00  0.00000e+00 0.00000e+00 7.30941e+02 6.635   1.74147e+02 6.635   0.9820 
1 1 1 0   64  1  o 11 2.22237e+01 4.10442e-01 3.89886e+02 207.782 -2.20475e+01 -1.16154e+01 0.00000e+00 0.00000e+00 4.23601e+02 207.782 3.37150e+01 207.782 0.9797 
1 1 1 0   64  2  o 18 1.05932e+01 3.84058e-01 3.39280e+02 178.402 -1.16144e+01 3.24018e-01  0.00000e+00 0.00000e+00 3.90329e+01 178.402 3.00247e+02 358.402 0.9559 
1 1 1 0   64  3  f 0  1.92619e+01 3.99949e-01 3.01985e+02 103.041 -4.21385e+00 1.81921e+01  0.00000e+00 0.00000e+00 3.97962e+02 103.041 9.59766e+01 103.041 0.9728 
1 1 1 0   64  4  o 10 2.27676e+01 4.27722e-01 3.65861e+02 286.027 7.97909e+00  -2.77766e+01 0.00000e+00 0.00000e+00 4.69549e+02 286.027 1.03688e+02 286.027 0.9825 
1 1 1 0   64  5  o 12 8.88517e+00 5.33192e-01 1.02454e+02 278.935 6.02715e-01  -3.83341e+00 0.00000e+00 0.00000e+00 1.82419e+02 278.935 7.99652e+01 278.935 0.8588 
1 1 1 0   64  6  o 7  2.70543e+01 5.58297e-01 4.69346e+02 247.898 -2.24673e+01 -5.53246e+01 0.00000e+00 0.00000e+00 5.31885e+02 247.898 6.25388e+01 247.898 0.9916 
1 1 1 0   64  7  o 12 1.09362e+01 5.14107e-01 2.51205e+02 15.737  1.52654e+01  4.30149e+00  0.00000e+00 0.00000e+00 1.43716e+02 15.737  1.07490e+02 195.737 0.9679 
1 1 1 0   64  8  o 17 1.57076e+01 5.75694e-01 1.85636e+02 153.558 -1.95076e+01 9.70146e+00  0.00000e+00 0.00000e+00 3.86496e+02 153.558 2.00860e+02 153.558 0.9768 
1 1 1 0   64  9  o 11 1.57520e+01 5.87257e-01 2.95062e+02 30.772  3.45948e+01  2.05994e+01  0.00000e+00 0.00000e+00 2.84691e+02 30.772  1.03703e+01 210.772 0.9875 
1 1 1 0   64  10 o 5  8.96002e+00 7.28088e-01 1.73524e+02 64.358  6.97117e+00  1.45229e+01  0.00000e+00 0.00000e+00 1.49698e+02 64.358  2.38252e+01 244.358 0.9684 
1 1 1 0   64  11 o 18 1.20663e+01 5.83953e-01 1.92118e+02 170.564 -2.89945e+01 4.81886e+00  0.00000e+00 0.00000e+00 2.49345e+02 170.564 5.72271e+01 170.564 0.9828 
1 1 1 0   64  12 o 19 6.62888e+00 7.95087e-01 6.83051e+01 24.291  5.31852e+00  2.40035e+00  0.00000e+00 0.00000e+00 1.56021e+02 24.291  8.77157e+01 24.291  0.9097 
1 1 1 0   64  13 o 3  2.72108e+00 8.44699e-01 9.19748e+01 240.490 -1.80643e+00 -3.19155e+00 0.00000e+00 0.00000e+00 6.06388e+00 60.490  9.80386e+01 60.490  0.8494 
1 1 1 0   64  14 o 17 5.12825e+00 1.09173e+00 1.31050e+02 17.595  9.37199e+00  2.97213e+00  0.00000e+00 0.00000e+00 4.94510e+01 17.595  8.15989e+01 197.595 0.9477 
1 1 1 0   64  15 o 9  7.08948e+00 1.10768e+00 1.24297e+02 54.506  7.75975e+00  1.08811e+01  0.00000e+00 0.00000e+00 1.28731e+02 54.506  4.43412e+00 54.506  0.9618 
1 1 1 0   64  16 o 8  7.81310e+00 1.24267e+00 1.28433e+02 164.442 -1.54394e+01 4.29850e+00  0.00000e+00 0.00000e+00 1.52027e+02 164.442 2.35940e+01 164.442 0.9683 
1 1 1 0   64  17 o 5  5.59905e+00 1.44282e+00 6.92381e+01 265.057 -5.09410e-01 -5.89051e+00 0.00000e+00 0.00000e+00 1.19661e+02 265.057 5.04230e+01 265.057 0.9110 
1 1 1 0   64  18 o 17 3.48250e+00 1.15529e+00 3.74278e+01 282.430 6.47324e-01  -2.93694e+00 0.00000e+00 0.00000e+00 6.69975e+01 282.430 2.95697e+01 282.430 0.8105 
1 1 1 0   65  1  o 16 1.81550e+01 3.81508e-01 3.75826e+02 230.500 -1.35675e+01 -1.64586e+01 0.00000e+00 0.00000e+00 2.86266e+02 230.500 8.95594e+01 50.500  0.9763 
1 1 1 0   65  2  o 2  2.48496e+01 4.39810e-01 4.40545e+02 125.608 -2.04575e+01 2.85658e+01  0.00000e+00 0.00000e+00 4.74330e+02 125.608 3.37844e+01 125.608 0.9857 
1 1 1 0   65  3  o 18 1.42697e+01 3.82434e-01 1.54010e+02 86.518  4.78458e-01  7.86428e+00  0.00000e+00 0.00000e+00 3.43843e+02 86.518  1.89834e+02 86.518  0.9342 
1 1 1 0   65  4  o 4  1.75942e+01 3.99941e-01 3.66677e+02 21.412  2.36428e+01  9.27137e+00  0.00000e+00 0.00000e+00 2.77193e+02 21.412  8.94843e+01 201.412 0.9801 
1 1 1 0   65  5  o 5  2.76627e+01 6.13885e-01 4.58278e+02 145.751 -4.77745e+01 3.25274e+01  0.00000e+00 0.00000e+00 5.65343e+02 145.751 1.07065e+02 145.751 0.9913 
1 1 1 0   65  6  o 2  1.64231e+01 4.89732e-01 2.74810e+02 35.053  2.01802e+01  1.41580e+01  0.00000e+00 0.00000e+00 3.25462e+02 35.053  5.06521e+01 35.053  0.9795 
1 1 1 0   65  7  o 1  1.79360e+01 5.11395e-01 3.11638e+02 99.508  -5.79882e+00 3.46235e+01  0.00000e+00 0.00000e+00 3.47788e+02 99.508  3.61498e+01 99.508  0.9857 
1 1 1 0   65  8  o 13 1.32584e+01 5.69667e-01 1.76431e+02 273.862 1.15158e+00  -1.70587e+01 0.00000e+00 0.00000e+00 3.03206e+02 273.862 1.26776e+02 273.862 0.9703 
1 1 1 0   65  9  o 15 1.08138e+01 6.04285e-01 8.05371e+01 59.709  3.98473e+00  6.82161e+00  0.00000e+00 0.00000e+00 2.95988e+02 59.709  2.15451e+02 59.709  0.9344 
1 1 1 0   65  10 o 15 9.22304e+00 5.72764e-01 2.10775e+02 217.271 -1.71535e+01 -1.30540e+01 0.00000e+00 0.00000e+00 1.24650e+02 217.271 8.61245e+01 37.272  0.9765 
1 1 1 0   65  11 o 4  6.66678e+00 7.54412e-01 9.57296e+01 233.525 -4.75231e+00 -6.42836e+00 0.00000e+00 0.00000e+00 1.36317e+02 233.525 4.05873e+01 233.525 0.9352 
1 1 1 0   65  12 o 6  3.25224e+00 9.11955e-01 4.60546e+01 121.109 -9.81655e-01 1.62670e+00  0.00000e+00 0.00000e+00 3.62748e+01 121.109 9.77978e+00 301.109 0.6806 
1 1 1 0   65  13 o 14 7.49833e+00 8.87881e-01 9.17928e+01 206.038 -9.24369e+00 -4.51607e+00 0.00000e+00 0.00000e+00 1.72965e+02 206.038 8.11721e+01 206.038 0.9501 
1 1 1 0   65  14 o 1  3.33591e+00 1.01844e+00 3.50734e+01 186.066 -1.81971e+00 -1.93368e-01 0.00000e+00 0.00000e+00 4.76466e+01 186.066 1.25732e+01 186.066 0.6678 
1 1 1 0   65  15 o 19 9.63809e+00 1.04607e+00 1.51477e+02 287.492 7.12645e+00  -2.26134e+01 0.00000e+00 0.00000e+00 1.98478e+02 287.492 4.70015e+01 287.492 0.9787 
1 1 1 0   65  16 o 10 4.68746e+00 1.27721e+00 1.32525e+02 149.046 -8.32061e+00 4.99052e+00  0.00000e+00 0.00000e+00 3.20051e+01 149.046 1.00520e+02 329.046 0.9470 
1 1 1 0   65  17 o 15 4.91556e+00 1.37091e+00 3.52745e+01 171.415 -2.75408e+00 4.15776e-01  0.00000e+00 0.00000e+00 1.09020e+02 171.415 7.37457e+01 171.415 0.7928 
1 1 1 0   65  18 o 9  4.02981e+00 1.27209e+00 9.37318e+01 243.466 -3.40247e+00 -6.81406e+00 0.00000e+00 0.00000e+00 4.51635e+01 243.466 4.85683e+01 63.466  0.9318 
1 1 1 0   66  0  o 4  2.93511e+01 6.80392e-01 5.30055e+02 189.256 -2.45778e+01 -4.00544e+00 0.00000e+00 0.00000e+00 5.43961e+02 189.256 1.39054e+01 189.256 0.9797 
1 1 1 0   66  1  f 0  6.73343e+00 4.57914e-01 5.29618e+01 183.539 -1.13872e+00 -7.04337e-02 0.00000e+00 0.00000e+00 7.12945e+01 183.539 1.83328e+01 183.539 0.4941 
1 1 1 0   66  2  o 3  2.39258e+01 4.63116e-01 4.33220e+02 236.276 -1.89630e+01 -2.84076e+01 0.00000e+00 0.00000e+00 4.47115e+02 236.276 1.38948e+01 236.276 0.9853 
1 1 1 0   66  3  o 2  1.20021e+01 3.89532e-01 1.24647e+02 103.625 -1.22292e+00 5.04543e+00  0.00000e+00 0.00000e+00 2.77634e+02 103.625 1.52987e+02 103.625 0.8976 
1 1 1 0   66  4  o 18 8.49667e+00 4.34857e-01 1.14459e+02 352.117 4.14303e+00  -5.73662e-01 0.00000e+00 0.00000e+00 1.61560e+02 352.117 4.71005e+01 352.117 0.8702 
1 1 1 0   66  5  o 15 1.19065e+01 5.32344e-01 1.18819e+02 260.310 -1.15165e+00 -6.74483e+00 0.00000e+00 0.00000e+00 2.91652e+02 260.310 1.72833e+02 260.310 0.9237 
1 1 1 0   66  6  o 1  2.04225e+01 5.03492e-01 2.42858e+02 278.338 4.30509e+00  -2.93752e+01 0.00000e+00 0.00000e+00 5.06135e+02 278.338 2.63277e+02 278.338 0.9830 
1 1 1 0   66  7  o 15 1.23932e+01 4.76328e-01 1.70611e+02 321.501 1.14361e+01  -9.09642e+00 0.00000e+00 0.00000e+00 2.75474e+02 321.501 1.04863e+02 321.501 0.9652 
1 1 1 0   66  8  o 9  4.50755e+00 7.90158e-01 1.86901e+02 200.708 -6.29543e+00 -2.37983e+00 0.00000e+00 0.00000e+00 3.19147e+01 20.708  2.18816e+02 20.708  0.9224 
1 1 1 0   66  9  o 13 4.50167e+00 8.82920e-01 5.79797e+01 98.613  -3.30497e-01 2.18207e+00  0.00000e+00 0.00000e+00 6.42880e+01 98.613  6.30823e+00 98.613  0.7290 
1 1 1 0   66  10 f 0  1.02711e+01 5.75083e-01 2.74989e+02 51.598  1.87008e+01  2.35929e+01  0.00000e+00 0.00000e+00 1.01056e+02 51.598  1.73933e+02 231.598 0.9832 
1 1 1 0   66  11 o 18 6.15679e+00 7.99051e-01 3.98524e+01 71.266  9.16854e-01  2.70352e+00  0.00000e+00 0.00000e+00 1.43122e+02 71.266  1.03270e+02 71.266  0.7986 
1 1 1 0   66  12 o 8  2.61502e+00 8.01738e-01 2.31748e+01 265.290 -6.81931e-02 -8.27762e-01 0.00000e+00 0.00000e+00 1.40837e+01 265.290 9.09117e+00 85.290  0.3832 
1 1 1 0   66  13 o 18 3.18212e+00 9.26955e-01 8.35628e+01 44.080  2.61890e+00  2.53615e+00  0.00000e+00 0.00000e+00 1.67472e+01 44.080  6.68156e+01 224.080 0.8484 
1 1 1 0   66  14 o 7  6.66804e+00 1.14173e+00 1.10797e+02 174.591 -1.10763e+01 1.04882e+00  0.00000e+00 0.00000e+00 1.25364e+02 174.591 1.45663e+01 174.591 0.9539 
1 1 1 0   66  15 o 16 1.69443e+01 8.60161e-01 2.10534e+02 357.296 6.56382e+01  -3.10039e+00 0.00000e+00 0.00000e+00 4.13195e+02 357.296 2.02661e+02 357.296 0.9924 
1 1 1 0   66  16 o 14 4.77335e+00 1.25546e+00 6.01423e+01 175.543 -4.50574e+00 3.51178e-01  0.00000e+00 0.00000e+00 9.56837e+01 175.543 3.55414e+01 175.543 0.8809 
1 1 1 0   66  17 o 8  9.05063e+00 1.34887e+00 1.40195e+02 79.145  3.96651e+00  2.06859e+01  0.00000e+00 0.00000e+00 1.86819e+02 79.145  4.66241e+01 79.145  0.9760 
1 1 1 0   66  18 o 11 3.34827e+00 1.13530e+00 3.27489e+01 213.609 -2.22856e+00 -1.48116e+00 0.00000e+00 0.00000e+00 6.41872e+01 213.609 3.14383e+01 213.609 0.7828 
1 1 1 0   67  1  o 11 2.77114e+01 4.66624e-01 3.96883e+02 233.597 -2.32722e+01 -3.15620e+01 0.00000e+00 0.00000e+00 6.24629e+02 233.597 2.27745e+02 233.597 0.9872 
1 1 1 0   67  2  o 6  3.87688e+01 5.87357e-01 7.24969e+02 8.735   9.53147e+01  1.46441e+01  0.00000e+00 0.00000e+00 7.15071e+02 8.735   9.89770e+00 188.735 0.9948 
1 1 1 0   67  3  o 3  1.08675e+01 3.98950e-01 1.52579e+02 16.490  6.89363e+00  2.04069e+00  0.00000e+00 0.00000e+00 2.23754e+02 16.490  7.11750e+01 16.490  0.9276 
1 1 1 0   67  4  o 8  1.69019e+01 4.58189e-01 1.88533e+02 75.925  3.58797e+00  1.43105e+01  0.00000e+00 0.00000e+00 4.20556e+02 75.925  2.32023e+02 75.925  0.9655 
1 1 1 0   67  5  o 12 1.14803e+01 5.34411e-01 2.24769e+02 73.176  3.78454e+00  1.25162e+01  0.00000e+00 0.00000e+00 1.86892e+02 73.176  3.78777e+01 253.176 0.9610 
1 1 1 0   67  6  o 5  2.18932e+01 5.16027e-01 3.40818e+02 350.290 4.24754e+01  -7.26781e+00 0.00000e+00 0.00000e+00 4.66309e+02 350.290 1.25491e+02 350.290 0.9883 
1 1 1 0   67  7  o 12 4.83014e+00 7.60870e-01 9.09353e+01 60.134  1.57255e+00  2.73854e+00  0.00000e+00 0.00000e+00 5.69312e+01 60.134  3.40041e+01 240.134 0.8210 
1 1 1 0   67  8  f 0  1.56475e+01 5.61903e-01 3.98808e+02 99.368  -8.75643e+00 5.30788e+01  0.00000e+00 0.00000e+00 1.78928e+02 99.368  2.19880e+02 279.368 0.9907 
1 1 1 0   67  9  o 19 8.71009e+00 5.69310e-01 1.20671e+02 128.430 -6.36251e+00 8.01897e+00  0.00000e+00 0.00000e+00 1.87505e+02 128.430 6.68341e+01 128.430 0.9498 
1 1 1 0   67  10 o 11 9.36425e+00 5.91443e-01 1.89386e+02 174.619 -1.85584e+01 1.74802e+00  0.00000e+00 0.00000e+00 1.49752e+02 174.619 3.96345e+01 354.619 0.9728 
1 1 1 0   67  11 o 17 4.33801e+00 9.43124e-01 1.15129e+02 5.425   5.73944e+00  5.45065e-01  0.00000e+00 0.00000e+00 3.15079e+01 5.425   8.36211e+01 185.425 0.9086 
1 1 1 0   67  12 o 2  7.74894e+00 8.06959e-01 1.01175e+02 111.679 -4.42078e+00 1.11205e+01  0.00000e+00 0.00000e+00 1.74610e+02 111.679 7.34342e+01 111.679 0.9573 
1 1 1 0   67  13 o 7  3.54213e+00 9.75924e-01 5.82261e+01 242.425 -1.32524e+00 -2.53764e+00 0.00000e+00 0.00000e+00 4.69572e+01 242.425 1.12689e+01 62.425  0.7993 
1 1 1 0   67  14 o 16 4.34017e+00 1.14583e+00 7.26935e+01 324.154 3.71846e+00  -2.68635e+00 0.00000e+00 0.00000e+00 6.95386e+01 324.154 3.15494e+00 144.154 0.8828 
1 1 1 0   67  15 o 12 3.88573e+00 1.11344e+00 6.54666e+01 178.792 -4.21906e+00 8.89322e-02  0.00000e+00 0.00000e+00 6.01227e+01 178.792 5.34389e+00 358.792 0.8715 
1 1 1 0   67  16 f 0  4.39819e+00 1.24761e+00 9.18634e+01 76.220  1.59251e+00  6.49319e+00  0.00000e+00 0.00000e+00 5.83621e+01 76.220  3.35013e+01 256.220 0.9218 
1 1 1 0   67  17 o 11 3.71546e+00 1.14725e+00 1.01388e+02 167.324 -8.11393e+00 1.82500e+00  0.00000e+00 0.00000e+00 2.75840e+01 167.324 7.38042e+01 347.324 0.9378 
1 1 1 0   67  18 o 6  3.06397e+00 1.05541e+00 3.82040e+01 42.379  2.33976e+00  2.13495e+00  0.00000e+00 0.00000e+00 5.48799e+01 42.379  1.66758e+01 42.379  0.8216 
1 1 1 0   68  0  o 19 1.00179e+01 5.43141e-01 3.69838e+02 262.722 -8.15193e-01 -6.38287e+00 0.00000e+00 0.00000e+00 2.62473e+01 82.722  3.96086e+02 82.722  0.9186 
1 1 1 0   68  1  o 6  1.52743e+01 3.80485e-01 2.85035e+02 123.959 -9.61859e+00 1.42819e+01  0.00000e+00 0.00000e+00 2.68413e+02 123.959 1.66218e+01 303.959 0.9705 
1 1 1 0   68  2  o 2  3.02048e+01 5.25751e-01 3.44883e+02 355.522 4.46601e+01  -3.49780e+00 0.00000e+00 0.00000e+00 7.70049e+02 355.522 4.25166e+02 355.522 0.9888 
1 1 1 0   68  3  o 4  9.35769e+00 4.22859e-01 1.28685e+02 72.689  1.59031e+00  5.10245e+00  0.00000e+00 0.00000e+00 1.85950e+02 72.689  5.72647e+01 72.689  0.9008 
1 1 1 0   68  4  f 0  1.02975e+01 4.86356e-01 1.82363e+02 243.151 -4.12189e+00 -8.14275e+00 0.00000e+00 0.00000e+00 1.80209e+02 243.151 2.15334e+00 63.151  0.9435 
1 1 1 0   68  5  o 17 9.85109e+00 5.03679e-01 1.13118e+02 267.568 -2.84122e-01 -6.68909e+00 0.00000e+00 0.00000e+00 2.25721e+02 267.568 1.12604e+02 267.568 0.9220 
1 1 1 0   68  6  o 16 1.89143e+01 4.38956e-01 2.17855e+02 357.458 2.60765e+01  -1.15780e+00 0.00000e+00 0.00000e+00 4.73908e+02 357.458 2.56053e+02 357.458 0.9807 
1 1 1 0   68  7  o 5  3.64559e+01 6.86016e-01 6.74289e+02 183.219 -1.76493e+02 -9.92707e+00 0.00000e+00 0.00000e+00 6.80945e+02 183.219 6.65677e+00 183.219 0.9972 
1 1 1 0   68  8  o 6  8.33554e+00 6.50097e-01 1.03591e+02 0.063   7.38944e+00  8.16552e-03  0.00000e+00 0.00000e+00 1.85162e+02 0.063   8.15709e+01 0.063   0.9296 
1 1 1 0   68  9  o 3  5.63675e+00 7.09846e-01 9.99161e+01 28.220  5.18019e+00  2.77995e+00  0.00000e+00 0.00000e+00 9.12152e+01 28.220  8.70092e+00 208.220 0.9104 
1 1 1 0   68  10 o 3  7.04352e+00 7.34744e-01 1.74178e+02 21.930  1.30945e+01  5.27200e+00  0.00000e+00 0.00000e+00 7.85328e+01 21.930  9.56452e+01 201.930 0.9639 
1 1 1 0   68  11 o 15 9.26182e+00 6.71014e-01 1.81356e+02 172.452 -2.28247e+01 3.02453e+00  0.00000e+00 0.00000e+00 1.55600e+02 172.452 2.57558e+01 352.452 0.9780 
1 1 1 0   68  12 o 11 6.41906e+00 8.54349e-01 1.41863e+02 40.621  1.00643e+01  8.63266e+00  0.00000e+00 0.00000e+00 8.75649e+01 40.621  5.42984e+01 220.621 0.9615 
1 1 1 0   68  13 o 3  4.27616e+00 1.02755e+00 1.30676e+02 100.519 -1.50477e+00 8.10368e+00  0.00000e+00 0.00000e+00 1.81836e+01 100.519 1.12493e+02 280.519 0.9372 
1 1 1 0   68  14 o 1  7.26182e+00 1.06243e+00 8.57660e+01 115.962 -4.23627e+00 8.70023e+00  0.00000e+00 0.00000e+00 1.69413e+02 115.962 8.36467e+01 115.962 0.9468 
1 1 1 0   68  15 o 1  5.13853e+00 1.26041e+00 5.88268e+01 356.065 4.48479e+00  -3.08452e-01 0.00000e+00 0.00000e+00 1.08884e+02 356.065 5.00570e+01 356.065 0.8802 
1 1 1 0   68  16 o 13 2.92028e+00 9.86286e-01 5.03677e+01 292.610 1.20767e+00  -2.89987e+00 0.00000e+00 0.00000e+00 3.83322e+01 292.610 1.20355e+01 112.610 0.8199 
1 1 1 0   68  17 o 16 3.56127e+00 1.15144e+00 9.74496e+01 59.742  3.75647e+00  6.43939e+00  0.00000e+00 0.00000e+00 2.51576e+01 59.742  7.22920e+01 239.742 0.9303 
1 1 1 0   68  18 o 1  4.36737e+00 1.35389e+00 8.51949e+01 200.991 -6.77620e+00 -2.59988e+00 0.00000e+00 0.00000e+00 6.46836e+01 200.991 2.05112e+01 20.991  0.9283 
1 1 1 0   69  1  o 9  3.08462e+01 5.00453e-01 5.38278e+02 36.697  5.72361e+01  4.26579e+01  0.00000e+00 0.00000e+00 6.05052e+02 36.697  6.67742e+01 36.697  0.9930 
1 1 1 0   69  2  o 17 1.99552e+01 4.05306e-01 2.75395e+02 267.277 -1.12342e+00 -2.36211e+01 0.00000e+00 0.00000e+00 4.53499e+02 267.277 1.78104e+02 267.277 0.9786 
1 1 1 0   69  3  o 12 1.04079e+01 4.75773e-01 6.69973e+01 101.797 -6.57219e-01 3.14663e+00  0.00000e+00 0.00000e+00 2.53315e+02 101.797 1.86318e+02 101.797 0.8247 
1 1 1 0   69  4  o 18 1.17648e+01 4.72158e-01 2.24889e+02 58.763  6.99904e+00  1.15400e+01  0.00000e+00 0.00000e+00 1.97476e+02 58.763  2.74133e+01 238.763 0.9622 
1 1 1 0   69  5  o 17 2.02981e+01 4.99017e-01 3.27209e+02 33.402  3.18522e+01  2.10041e+01  0.00000e+00 0.00000e+00 4.19932e+02 33.402  9.27231e+01 33.402  0.9868 
1 1 1 0   69  6  o 4  5.15392e+00 7.07018e-01 1.07391e+02 19.344  3.48721e+00  1.22418e+00  0.00000e+00 0.00000e+00 5.60985e+01 19.344  5.12927e+01 199.344 0.8507 
1 1 1 0   69  7  o 1  6.75983e+00 6.64464e-01 7.46981e+01 163.367 -3.67396e+00 1.09756e+00  0.00000e+00 0.00000e+00 1.41191e+02 163.367 6.64934e+01 163.367 0.8568 
1 1 1 0   69  8  o 6  1.64453e+01 4.92617e-01 3.90206e+02 21.784  5.51907e+01  2.20573e+01  0.00000e+00 0.00000e+00 2.17305e+02 21.784  1.72901e+02 201.784 0.9916 
1 1 1 0   69  9  o 6  5.47825e+00 6.97369e-01 1.09784e+02 78.844  1.19450e+00  6.05730e+00  0.00000e+00 0.00000e+00 7.68655e+01 78.844  3.29182e+01 258.844 0.9150 
1 1 1 0   69  10 o 19 2.63630e+00 7.86820e-01 6.75544e+01 262.161 -2.88960e-01 -2.09886e+00 0.00000e+00 0.00000e+00 2.72474e+00 262.161 6.48297e+01 82.161  0.7163 
1 1 1 0   69  11 o 14 3.19084e+00 8.63216e-01 5.41243e+01 233.227 -1.36298e+00 -1.82370e+00 0.00000e+00 0.00000e+00 3.34991e+01 233.227 2.06252e+01 53.227  0.7384 
1 1 1 0   69  12 o 6  9.65619e+00 7.15686e-01 1.37779e+02 317.546 1.51550e+01  -1.38646e+01 0.00000e+00 0.00000e+00 2.12247e+02 317.546 7.44681e+01 317.546 0.9753 
1 1 1 0   69  13 o 14 2.92464e+00 8.93752e-01 7.85591e+01 220.618 -2.81004e+00 -2.41004e+00 0.00000e+00 0.00000e+00 1.38693e+01 220.618 6.46898e+01 40.618  0.8510 
1 1 1 0   69  14 o 4  3.92206e+00 1.09709e+00 6.33715e+01 79.194  6.98535e-01  3.65970e+00  0.00000e+00 0.00000e+00 6.06341e+01 79.194  2.73743e+00 259.194 0.8521 
1 1 1 0   69  15 o 8  4.24416e+00 1.13968e+00 7.22366e+01 305.101 3.02633e+00  -4.30586e+00 0.00000e+00 0.00000e+00 6.92393e+01 305.101 2.99721e+00 125.101 0.8991 
1 1 1 0   69  16 o 18 3.46964e+00 1.08884e+00 3.55147e+01 108.470 -8.12228e-01 2.43168e+00  0.00000e+00 0.00000e+00 6.36629e+01 108.470 2.81482e+01 108.470 0.7718 
1 1 1 0   69  17 o 2  5.98872e+00 1.50124e+00 8.13744e+01 78.084  1.55743e+00  7.38029e+00  0.00000e+00 0.00000e+00 1.24954e+02 78.084  4.35797e+01 78.084  0.9311 
1 1 1 0   70  0  o 15 3.39624e+01 7.57077e-01 4.54822e+02 178.044 -3.28694e+01 1.12281e+00  0.00000e+00 0.00000e+00 7.93300e+02 178.044 3.38478e+02 178.044 0.9847 
1 1 1 0   70  1  o 17 1.26842e+01 3.87067e-01 3.73234e+02 176.943 -2.10082e+01 1.12175e+00  0.00000e+00 0.00000e+00 8.87596e+01 176.943 2.84474e+02 356.943 0.9759 
1 1 1 0   70  2  o 8  2.50532e+01 4.50345e-01 4.23834e+02 342.114 4.67282e+01  -1.50797e+01 0.00000e+00 0.00000e+00 5.01517e+02 342.114 7.76822e+01 342.114 0.9898 
1 1 1 0   70  3  o 1  2.42777e+01 5.17380e-01 4.40844e+02 183.829 -5.05498e+01 -3.38293e+00 0.00000e+00 0.00000e+00 4.56013e+02 183.829 1.51688e+01 183.829 0.9901 
1 1 1 0   70  4  o 10 1.73536e+01 4.69381e-01 2.94838e+02 207.742 -2.47272e+01 -1.30052e+01 0.00000e+00 0.00000e+00 3.40822e+02 207.742 4.59842e+01 207.742 0.9819 
1 1 1 0   70  5  o 18 2.30814e+01 4.50673e-01 3.88224e+02 13.211  5.41093e+01  1.27018e+01  0.00000e+00 0.00000e+00 4.64781e+02 13.211  7.65569e+01 13.211  0.9910 
1 1 1 0   70  6  o 3  1.82278e+01 5.01417e-01 3.39359e+02 108.664 -1.48849e+01 4.40656e+01  0.00000e+00 0.00000e+00 3.32845e+02 108.664 6.51411e+00 288.664 0.9892 
1 1 1 0   70  7  o 3  1.42246e+01 4.96801e-01 3.96874e+02 154.451 -4.06415e+01 1.94275e+01  0.00000e+00 0.00000e+00 1.27302e+02 154.451 2.69572e+02 334.451 0.9888 
1 1 1 0   70  8  o 11 5.80261e+00 6.82933e-01 1.60560e+02 344.160 7.96935e+00  -2.26114e+00 0.00000e+00 0.00000e+00 4.20825e+01 344.160 1.18477e+02 164.160 0.9375 
1 1 1 0   70  9  o 18 5.79863e+00 7.32880e-01 7.34163e+01 252.078 -1.34348e+00 -4.15412e+00 0.00000e+00 0.00000e+00 1.15751e+02 252.078 4.23342e+01 252.078 0.8763 
1 1 1 0   70  10 o 4  5.17788e+00 7.60061e-01 1.50619e+02 11.724  9.54265e+00  1.98044e+00  0.00000e+00 0.00000e+00 3.18706e+01 11.724  1.18749e+02 191.724 0.9472 
1 1 1 0   70  11 o 6  8.96334e+00 6.46929e-01 1.75249e+02 326.492 1.84310e+01  -1.22031e+01 0.00000e+00 0.00000e+00 1.50417e+02 326.492 2.48314e+01 146.492 0.9771 
1 1 1 0   70  12 o 18 5.21880e+00 9.64637e-01 9.68098e+01 66.952  2.73552e+00  6.42963e+00  0.00000e+00 0.00000e+00 8.26423e+01 66.952  1.41676e+01 246.952 0.9254 
1 1 1 0   70  13 o 4  3.55032e+00 9.93664e-01 7.20247e+01 333.022 3.53297e+00  -1.79845e+00 0.00000e+00 0.00000e+00 4.16243e+01 333.022 3.04004e+01 153.022 0.8621 
1 1 1 0   70  14 o 1  4.20640e+00 1.10964e+00 9.45382e+01 86.102  3.90158e-01  5.72595e+00  0.00000e+00 0.00000e+00 4.71753e+01 86.102  4.73629e+01 266.102 0.9081 
1 1 1 0   70  15 o 15 5.52360e+00 1.23669e+00 9.55241e+01 36.866  6.44550e+00  4.83350e+00  0.00000e+00 0.00000e+00 9.60518e+01 36.866  5.27714e-01 36.866  0.9357 
1 1 1 0   70  16 o 7  4.66374e+00 1.32582e+00 6.87062e+01 292.723 2.11307e+00  -5.04568e+00 0.00000e+00 0.00000e+00 8.72893e+01 292.723 1.85831e+01 292.723 0.9033 
1 1 1 0   70  17 o 9  4.56772e+00 1.32092e+00 1.22372e+02 154.797 -9.51042e+00 4.47581e+00  0.00000e+00 0.00000e+00 3.83540e+01 154.797 8.40185e+01 334.797 0.9512 
1 1 1 0   71  1  o 19 1.56548e+01 3.88251e-01 1.68852e+02 272.756 5.88893e-01  -1.22319e+01 0.00000e+00 0.00000e+00 3.90900e+02 272.756 2.22048e+02 272.756 0.9583 
1 1 1 0   71  2  o 7  7.33013e+00 5.20052e-01 9.77876e+01 63.161  1.53302e+00  3.02972e+00  0.00000e+00 0.00000e+00 1.30699e+02 63.161  3.29114e+01 63.161  0.8355 
1 1 1 0   71  3  o 1  2.05526e+01 4.86132e-01 3.63461e+02 169.314 -3.72621e+01 7.03153e+00  0.00000e+00 0.00000e+00 3.93062e+02 169.314 2.96009e+01 169.314 0.9867 
1 1 1 0   71  4  o 8  1.03533e+01 5.04828e-01 6.34988e+01 133.894 -2.61735e+00 2.72037e+00  0.00000e+00 0.00000e+00 2.66374e+02 133.894 2.02875e+02 133.894 0.8543 
1 1 1 0   71  5  o 16 1.44646e+01 4.70272e-01 1.55516e+02 15.628  1.36325e+01  3.81334e+00  0.00000e+00 0.00000e+00 3.64402e+02 15.628  2.08885e+02 15.628  0.9640 
1 1 1 0   71  6  o 18 7.96266e+00 5.57742e-01 1.17599e+02 207.184 -6.11865e+00 -3.14237e+00 0.00000e+00 0.00000e+00 1.56687e+02 207.184 3.90881e+01 207.184 0.9241 
1 1 1 0   71  7  o 2  1.03989e+01 5.99236e-01 1.74633e+02 357.518 1.54806e+01  -6.71072e-01 0.00000e+00 0.00000e+00 2.00098e+02 357.518 2.54644e+01 357.518 0.9672 
1 1 1 0   71  8  f 0  1.09793e+01 5.10454e-01 2.42178e+02 217.876 -2.06686e+01 -1.60759e+01 0.00000e+00 0.00000e+00 1.58824e+02 217.876 8.33537e+01 37.876  0.9807 
1 1 1 0   71  9  o 7  3.39387e+00 7.59115e-01 5.81809e+01 328.332 1.80021e+00  -1.11046e+00 0.00000e+00 0.00000e+00 3.22456e+01 328.332 2.59352e+01 148.332 0.7158 
1 1 1 0   71  10 o 9  9.26036e+00 6.05065e-01 1.52260e+02 210.456 -1.65440e+01 -9.72798e+00 0.00000e+00 0.00000e+00 1.83135e+02 210.456 3.08747e+01 210.456 0.9736 
1 1 1 0   71  11 o 7  1.04806e+01 6.19754e-01 1.43325e+02 98.968  -3.52108e+00 2.23128e+01  0.00000e+00 0.00000e+00 2.37588e+02 98.968  9.42632e+01 98.968  0.9776 
1 1 1 0   71  12 o 7  4.61523e+00 9.78615e-01 1.28894e+02 232.422 -5.17566e+00 -6.72598e+00 0.00000e+00 0.00000e+00 3.21231e+01 232.422 9.67706e+01 52.422  0.9391 
1 1 1 0   71  13 f 0  8.56629e+00 8.95119e-01 1.07148e+02 213.741 -1.18190e+01 -7.89456e+00 0.00000e+00 0.00000e+00 1.99455e+02 213.741 9.23066e+01 213.741 0.9642 
1 1 1 0   71  14 o 4  7.00967e+00 1.09798e+00 1.20550e+02 86.586  7.80789e-01  1.30895e+01  0.00000e+00 0.00000e+00 1.29332e+02 86.586  8.78186e+00 86.586  0.9611 
1 1 1 0   71  15 o 7  3.38082e+00 1.05051e+00 7.27773e+01 258.991 -8.69828e-01 -4.47117e+00 0.00000e+00 0.00000e+00 3.77191e+01 258.991 3.50581e+01 78.991  0.8819 
1 1 1 0   71  16 o 11 7.09731e+00 1.39434e+00 9.53128e+01 8.239   1.07058e+01  1.55022e+00  0.00000e+00 0.00000e+00 1.55001e+02 8.239   5.96879e+01 8.239   0.9526 
1 1 1 0   71  17 o 17 3.34399e+00 1.10610e+00 1.00576e+02 253.667 -2.27721e+00 -7.77061e+00 0.00000e+00 0.00000e+00 1.51966e+01 253.667 8.53797e+01 73.667  0.9360 
1 1 1 0   72  0  o 13 5.55901e+00 7.42523e-01 6.34077e+01 322.533 6.61685e-01  -5.07121e-01 0.00000e+00 0.00000e+00 1.63071e+01 322.533 4.71007e+01 142.533 0.3844 
1 1 1 0   72  1  o 3  1.71566e+01 3.99384e-01 2.00742e+02 73.491  4.66878e+00  1.57523e+01  0.00000e+00 0.00000e+00 4.19512e+02 73.491  2.18770e+02 73.491  0.9691 
1 1 1 0   72  2  f 0  2.26565e+01 4.98630e-01 3.26384e+02 13.013  3.65636e+01  8.44988e+00  0.00000e+00 0.00000e+00 5.07430e+02 13.013  1.81046e+02 13.013  0.9866 
1 1 1 0   72  3  o 19 1.36576e+01 4.57462e-01 2.00712e+02 248.593 -6.02511e+00 -1.53689e+01 0.00000e+00 0.00000e+00 2.92999e+02 248.593 9.22868e+01 248.593 0.9692 
1 1 1 0   72  4  o 4  1.30103e+01 4.09520e-01 2.57092e+02 23.059  1.91671e+01  8.15912e+00  0.00000e+00 0.00000e+00 2.16259e+02 23.059  4.08333e+01 203.059 0.9757 
1 1 1 0   72  5  f 0  1.40701e+01 4.67006e-01 2.12872e+02 241.426 -1.02466e+01 -1.88140e+01 0.00000e+00 0.00000e+00 2.99255e+02 241.426 8.63836e+01 241.426 0.9764 
1 1 1 0   72  6  o 19 1.35985e+01 5.51619e-01 3.11324e+02 81.561  4.80870e+00  3.24119e+01  0.00000e+00 0.00000e+00 1.87648e+02 81.561  1.23676e+02 261.561 0.9846 
1 1 1 0   72  7  o 5  9.85627e+00 4.72664e-01 1.82090e+02 5.492   1.66157e+01  1.59758e+00  0.00000e+00 0.00000e+00 1.73898e+02 5.492   8.19155e+00 185.492 0.9696 
1 1 1 0   72  8  o 18 7.37870e+00 6.13991e-01 1.40061e+02 106.642 -3.16488e+00 1.05878e+01  0.00000e+00 0.00000e+00 1.21939e+02 106.642 1.81221e+01 286.642 0.9536 
1 1 1 0   72  9  o 12 1.47195e+01 5.21295e-01 2.45936e+02 11.529  4.11414e+01  8.39201e+00  0.00000e+00 0.00000e+00 2.95291e+02 11.529  4.93552e+01 11.529  0.9880 
1 1 1 0   72  10 o 7  2.59042e+00 7.63499e-01 2.94336e+01 249.507 -3.29531e-01 -8.81705e-01 0.00000e+00 0.00000e+00 1.15326e+01 249.507 1.79010e+01 69.507  0.4252 
1 1 1 0   72  11 o 19 3.98483e+00 9.11548e-01 8.86439e+01 54.222  2.65559e+00  3.68501e+00  0.00000e+00 0.00000e+00 4.19281e+01 54.222  4.67158e+01 234.222 0.8816 
1 1 1 0   72  12 o 10 1.29916e+01 6.73278e-01 2.50263e+02 260.186 -9.59856e+00 -5.54883e+01 0.00000e+00 0.00000e+00 2.27988e+02 260.186 2.22745e+01 80.186  0.9911 
1 1 1 0   72  13 o 14 6.44541e+00 1.04232e+00 7.10200e+01 72.102  2.25623e+00  6.98634e+00  0.00000e+00 0.00000e+00 1.51257e+02 72.102  8.02367e+01 72.102  0.9292 
1 1 1 0   72  14 o 17 5.74250e+00 1.15264e+00 4.79241e+01 313.480 2.86962e+00  -3.02609e+00 0.00000e+00 0.00000e+00 1.37300e+02 313.480 8.93761e+01 313.480 0.8698 
1 1 1 0   72  15 o 1  1.69429e+01 8.81524e-01 2.14589e+02 330.480 6.56791e+01  -3.71899e+01 0.00000e+00 0.00000e+00 4.09003e+02 330.480 1.94414e+02 330.480 0.9934 
1 1 1 0   72  16 o 12 5.08533e+00 1.35448e+00 1.15493e+02 96.896  -1.17803e+00 9.74102e+00  0.00000e+00 0.00000e+00 6.28826e+01 96.896  5.26103e+01 276.896 0.9476 
1 1 1 0   72  17 o 14 3.84094e+00 1.21851e+00 6.30147e+01 248.387 -1.93391e+00 -4.88129e+00 0.00000e+00 0.00000e+00 6.46588e+01 248.387 1.64408e+00 248.387 0.8989 
1 1 1 0   73  1  o 5  1.13352e+01 4.64506e-01 1.38432e+02 204.663 -7.80736e+00 -3.58485e+00 0.00000e+00 0.00000e+00 2.58932e+02 204.663 1.20500e+02 204.663 0.9399 
1 1 1 0   73  2  o 7  1.28082e+01 4.57025e-01 1.70332e+02 140.183 -1.00974e+01 8.41806e+00  0.00000e+00 0.00000e+00 2.88811e+02 140.183 1.18479e+02 140.183 0.9612 
1 1 1 0   73  3  o 4  1.30296e+01 4.62356e-01 1.50554e+02 61.108  5.50676e+00  9.97864e+00  0.00000e+00 0.00000e+00 3.13487e+02 61.108  1.62933e+02 61.108  0.9551 
1 1 1 0   73  4  o 9  4.12889e+00 7.72561e-01 7.69980e+01 72.626  5.72052e-01  1.82836e+00  0.00000e+00 0.00000e+00 2.82058e+01 72.626  4.87922e+01 252.626 0.6834 
1 1 1 0   73  5  o 9  9.57238e+00 4.99995e-01 8.85337e+01 245.915 -2.61298e+00 -5.84539e+00 0.00000e+00 0.00000e+00 2.39057e+02 245.915 1.50524e+02 245.915 0.9182 
1 1 1 0   73  6  o 17 6.18958e+00 6.14423e-01 9.21141e+01 195.119 -4.30441e+00 -1.16291e+00 0.00000e+00 0.00000e+00 1.10623e+02 195.119 1.85089e+01 195.119 0.8791 
1 1 1 0   73  7  o 5  1.31385e+01 4.45317e-01 2.01416e+02 311.039 1.61864e+01  -1.85946e+01 0.00000e+00 0.00000e+00 2.77888e+02 311.039 7.64725e+01 311.039 0.9795 
1 1 1 0   73  8  o 6  1.88113e+01 5.10095e-01 4.10712e+02 134.885 -5.84282e+01 5.86637e+01  0.00000e+00 0.00000e+00 2.85335e+02 134.885 1.25377e+02 314.885 0.9939 
1 1 1 0   73  9  o 9  2.17939e+00 6.86336e-01 5.06424e+01 333.339 1.21389e+00  -6.09480e-01 0.00000e+00 0.00000e+00 5.30461e+00 153.339 5.59470e+01 153.339 0.5591 
1 1 1 0   73  10 o 7  8.58274e+00 6.50605e-01 1.38076e+02 223.804 -1.17935e+01 -1.13111e+01 0.00000e+00 0.00000e+00 1.71159e+02 223.804 3.30830e+01 223.804 0.9689 
1 1 1 0   73  11 o 19 4.83513e+00 8.74557e-01 1.56453e+02 252.994 -3.19228e+00 -1.04375e+01 0.00000e+00 0.00000e+00 1.47918e+01 252.994 1.41661e+02 72.994  0.9530 
1 1 1 0   73  12 o 16 9.39925e+00 7.67259e-01 1.33772e+02 226.565 -1.32210e+01 -1.39640e+01 0.00000e+00 0.00000e+00 2.06080e+02 226.565 7.23086e+01 226.565 0.9736 
1 1 1 0   73  13 o 19 3.49376e+00 1.00285e+00 3.54330e+01 114.311 -8.08169e-01 1.78902e+00  0.00000e+00 0.00000e+00 5.42326e+01 114.311 1.87997e+01 114.311 0.6916 
1 1 1 0   73  14 f 0  6.25129e+00 1.22795e+00 7.14127e+01 82.473  8.64511e-01  6.54251e+00  0.00000e+00 0.00000e+00 1.42003e+02 82.473  7.05906e+01 82.473  0.9208 
1 1 1 0   73  15 o 1  5.88606e+00 1.32553e+00 7.93409e+01 49.651  4.52239e+00  5.32337e+00  0.00000e+00 0.00000e+00 1.22431e+02 49.651  4.30897e+01 49.651  0.9254 
1 1 1 0   73  16 o 11 6.18789e+00 1.42107e+00 8.33294e+01 273.249 4.50357e-01  -7.93218e+00 0.00000e+00 0.00000e+00 1.30742e+02 273.249 4.74121e+01 273.249 0.9348 
1 1 1 0   73  17 o 18 4.68986e+00 1.38164e+00 5.69681e+01 158.513 -4.52350e+00 1.78068e+00  0.00000e+00 0.00000e+00 9.73636e+01 158.513 4.03954e+01 158.513 0.8901 
1 1 1 0   74  0  o 14 1.03318e+01 7.37250e-01 7.76055e+01 271.909 7.98329e-02  -2.39507e+00 0.00000e+00 0.00000e+00 2.12617e+02 271.909 1.35011e+02 271.909 0.7532 
1 1 1 0   74  1  f 0  2.41292e+01 5.14983e-01 3.46974e+02 3.479   4.80321e+01  2.92032e+00  0.00000e+00 0.00000e+00 5.43436e+02 3.479   1.96462e+02 3.479   0.9896 
1 1 1 0   74  2  o 2  8.07736e+00 4.98729e-01 1.11769e+02 259.197 -9.79830e-01 -5.13487e+00 0.00000e+00 0.00000e+00 1.58820e+02 259.197 4.70512e+01 259.197 0.8984 
1 1 1 0   74  3  o 19 1.48963e+01 3.99263e-01 2.37187e+02 300.990 1.15680e+01  -1.92602e+01 0.00000e+00 0.00000e+00 3.05677e+02 300.990 6.84902e+01 300.990 0.9775 
1 1 1 0   74  4  o 17 1.44952e+01 4.62707e-01 3.45700e+02 248.966 -1.28665e+01 -3.34597e+01 0.00000e+00 0.00000e+00 1.87008e+02 248.966 1.58691e+02 68.966  0.9860 
1 1 1 0   74  5  o 14 1.54444e+01 4.70867e-01 2.99097e+02 38.733  2.82842e+01  2.26865e+01  0.00000e+00 0.00000e+00 2.68430e+02 38.733  3.06667e+01 218.733 0.9861 
1 1 1 0   74  6  o 13 2.43349e+01 4.74799e-01 4.69013e+02 59.713  5.09147e+01  8.71770e+01  0.00000e+00 0.00000e+00 4.32994e+02 59.713  3.60191e+01 239.713 0.9950 
1 1 1 0   74  7  o 13 6.34038e+00 5.75170e-01 1.22686e+02 170.335 -7.46181e+00 1.27079e+00  0.00000e+00 0.00000e+00 9.72094e+01 170.335 2.54766e+01 350.335 0.9314 
1 1 1 0   74  8  o 1  7.65338e+00 5.73341e-01 2.01865e+02 84.428  1.59999e+00  1.64011e+01  0.00000e+00 0.00000e+00 7.42079e+01 84.428  1.27657e+02 264.428 0.9692 
1 1 1 0   74  9  o 14 2.10140e+01 5.33351e-01 3.42961e+02 333.164 8.62719e+01  -4.36478e+01 0.00000e+00 0.00000e+00 4.34710e+02 333.164 9.17493e+01 333.164 0.9948 
1 1 1 0   74  10 o 16 8.30184e+00 6.62127e-01 1.07354e+02 214.193 -9.96304e+00 -6.76898e+00 0.00000e+00 0.00000e+00 1.88193e+02 214.193 8.08387e+01 214.193 0.9575 
1 1 1 0   74  11 o 8  6.34577e+00 8.03710e-01 9.19887e+01 187.838 -8.59919e+00 -1.18370e+00 0.00000e+00 0.00000e+00 1.29759e+02 187.838 3.77703e+01 187.838 0.9405 
1 1 1 0   74  12 o 6  3.42281e+00 9.67790e-01 5.88792e+01 244.232 -1.26042e+00 -2.61097e+00 0.00000e+00 0.00000e+00 4.30749e+01 244.232 1.58042e+01 64.232  0.8023 
1 1 1 0   74  13 o 19 4.91298e+00 1.03181e+00 3.52245e+01 100.048 -4.77945e-01 2.69738e+00  0.00000e+00 0.00000e+00 1.08536e+02 100.048 7.33117e+01 100.048 0.7887 
1 1 1 0   74  14 o 15 3.97802e+00 1.02875e+00 7.16669e+01 125.026 -2.85421e+00 4.07234e+00  0.00000e+00 0.00000e+00 5.99822e+01 125.026 1.16847e+01 305.026 0.8928 
1 1 1 0   74  15 o 8  1.26242e+01 9.71040e-01 1.94841e+02 284.212 1.23051e+01  -4.85877e+01 0.00000e+00 0.00000e+00 2.68032e+02 284.212 7.31915e+01 284.212 0.9900 
1 1 1 0   74  16 o 8  8.60718e+00 1.38808e+00 1.28813e+02 314.294 1.26817e+01  -1.29984e+01 0.00000e+00 0.00000e+00 1.80772e+02 314.294 5.19587e+01 314.294 0.9721 
1 1 1 0   74  17 o 2  4.42709e+00 1.31625e+00 9.32234e+01 132.212 -5.47693e+00 6.03769e+00  0.00000e+00 0.00000e+00 6.00292e+01 132.212 3.31942e+01 312.212 0.9365 
1 1 1 0   75  1  o 11 8.68290e+00 5.01419e-01 1.57079e+02 345.094 7.61324e+00  -2.02652e+00 0.00000e+00 0.00000e+00 1.45348e+02 345.094 1.17307e+01 165.094 0.9342 
1 1 1 0   75  2  o 2  1.11697e+01 5.51808e-01 1.80126e+02 120.626 -6.26427e+00 1.05814e+01  0.00000e+00 0.00000e+00 2.18974e+02 120.626 3.88482e+01 120.626 0.9584 
1 1 1 0   75  3  o 12 8.01293e+00 5.18512e-01 1.60337e+02 83.056  1.06725e+00  8.76237e+00  0.00000e+00 0.00000e+00 1.20877e+02 83.056  3.94603e+01 263.056 0.9415 
1 1 1 0   75  4  o 13 1.02189e+01 5.39726e-01 1.54511e+02 166.766 -1.15396e+01 2.71380e+00  0.00000e+00 0.00000e+00 2.09876e+02 166.766 5.53653e+01 166.766 0.9568 
1 1 1 0   75  5  o 18 2.17127e+01 5.07821e-01 3.58017e+02 16.531  6.28415e+01  1.86511e+01  0.00000e+00 0.00000e+00 4.44725e+02 16.531  8.67086e+01 16.531  0.9923 
1 1 1 0   75  6  o 6  5.55937e+00 5.86812e-01 1.39634e+02 45.857  4.91820e+00  5.06757e+00  0.00000e+00 0.00000e+00 5.21413e+01 45.857  8.74926e+01 225.857 0.9262 
1 1 1 0   75  7  o 3  1.89586e+01 4.54817e-01 2.89980e+02 220.697 -4.14180e+01 -3.56218e+01 0.00000e+00 0.00000e+00 4.09339e+02 220.697 1.19359e+02 220.697 0.9908 
1 1 1 0   75  8  f 0  2.45080e+01 5.50507e-01 5.14277e+02 40.548  1.01577e+02  8.69016e+01  0.00000e+00 0.00000e+00 3.94299e+02 40.548  1.19978e+02 220.548 0.9963 
1 1 1 0   75  9  o 7  9.03434e+00 5.93053e-01 1.36901e+02 248.806 -5.54450e+00 -1.42987e+01 0.00000e+00 0.00000e+00 1.87963e+02 248.806 5.10619e+01 248.806 0.9668 
1 1 1 0   75  10 o 11 6.88413e+00 7.39055e-01 7.91125e+01 113.950 -3.00538e+00 6.76597e+00  0.00000e+00 0.00000e+00 1.58809e+02 113.950 7.96968e+01 113.950 0.9298 
1 1 1 0   75  11 o 13 6.31090e+00 8.89342e-01 1.29949e+02 105.938 -3.23018e+00 1.13110e+01  0.00000e+00 0.00000e+00 9.42859e+01 105.938 3.56633e+01 285.938 0.9565 
1 1 1 0   75  12 o 5  4.39104e+00 1.03262e+00 7.66397e+01 72.446  1.50863e+00  4.76917e+00  0.00000e+00 0.00000e+00 6.89900e+01 72.446  7.64970e+00 252.446 0.8934 
1 1 1 0   75  13 o 7  9.42593e+00 8.83509e-01 1.28647e+02 230.164 -1.31924e+01 -1.58140e+01 0.00000e+00 0.00000e+00 2.12389e+02 230.164 8.37420e+01 230.164 0.9754 
1 1 1 0   75  14 o 19 3.12341e+00 9.55884e-01 3.86307e+01 296.425 1.00137e+00  -2.01507e+00 0.00000e+00 0.00000e+00 4.64374e+01 296.425 7.80668e+00 296.425 0.7349 
1 1 1 0   75  15 o 14 5.54302e+00 1.33617e+00 5.45509e+01 324.041 3.95474e+00  -2.86891e+00 0.00000e+00 0.00000e+00 1.28262e+02 324.041 7.37113e+01 324.041 0.8907 
1 1 1 0   75  16 f 0  9.90533e+00 1.25379e+00 1.65167e+02 39.063  2.48736e+01  2.01875e+01  0.00000e+00 0.00000e+00 1.95509e+02 39.063  3.03423e+01 39.063  0.9843 
1 1 1 0   75  17 o 16 3.13756e+00 1.06413e+00 2.65414e+01 184.314 -2.22568e+00 -1.67893e-01 0.00000e+00 0.00000e+00 5.83864e+01 184.314 3.18450e+01 184.314 0.7324 
1 1 1 0   76  0  o 18 2.35994e+01 9.26757e-01 3.87370e+02 92.806  -1.37752e+00 2.81091e+01  0.00000e+00 0.00000e+00 4.76575e+02 92.806  8.92055e+01 92.806  0.9821 
1 1 1 0   76  1  o 8  7.71899e+00 6.74243e-01 4.92064e+01 99.601  -3.88392e-01 2.29597e+00  0.00000e+00 0.00000e+00 1.65152e+02 99.601  1.15946e+02 99.601  0.7450 
1 1 1 0   76  2  o 3  1.01809e+01 4.18185e-01 1.35624e+02 250.048 -3.27758e+00 -9.02870e+00 0.00000e+00 0.00000e+00 2.23512e+02 250.048 8.78881e+01 250.048 0.9464 
1 1 1 0   76  3  o 15 1.63066e+01 4.72072e-01 2.98062e+02 235.790 -2.06047e+01 -3.03075e+01 0.00000e+00 0.00000e+00 3.01284e+02 235.790 3.22236e+00 235.790 0.9863 
1 1 1 0   76  4  o 4  5.93822e+00 6.76178e-01 9.09445e+01 201.186 -3.81843e+00 -1.48001e+00 0.00000e+00 0.00000e+00 1.00899e+02 201.186 9.95499e+00 201.186 0.8671 
1 1 1 0   76  5  o 4  5.69315e+00 5.34930e-01 3.19146e+01 318.385 1.17364e+00  -1.04256e+00 0.00000e+00 0.00000e+00 9.80640e+01 318.385 6.61494e+01 318.385 0.6129 
1 1 1 0   76  6  o 18 1.14411e+01 4.33258e-01 2.66842e+02 62.354  1.32055e+01  2.52108e+01  0.00000e+00 0.00000e+00 1.51628e+02 62.354  1.15215e+02 242.354 0.9823 
1 1 1 0   76  7  o 14 7.01800e+00 5.12206e-01 1.65926e+02 188.705 -1.23403e+01 -1.88954e+00 0.00000e+00 0.00000e+00 8.46020e+01 188.705 8.13244e+01 8.705   0.9591 
1 1 1 0   76  8  o 13 6.45663e+00 6.67361e-01 7.36120e+01 5.477   5.55232e+00  5.32398e-01  0.00000e+00 0.00000e+00 1.43843e+02 5.477   7.02314e+01 5.477   0.9053 
1 1 1 0   76  9  o 19 7.14053e+00 6.77125e-01 1.45690e+02 348.117 1.29386e+01  -2.72253e+00 0.00000e+00 0.00000e+00 1.09583e+02 348.117 3.61068e+01 168.117 0.9614 
1 1 1 0   76  10 o 4  7.92797e+00 6.79609e-01 1.45391e+02 221.185 -1.24519e+01 -1.08949e+01 0.00000e+00 0.00000e+00 1.40191e+02 221.185 5.19995e+00 41.185  0.9693 
1 1 1 0   76  11 o 11 1.37730e+01 6.19352e-01 2.75296e+02 9.156   6.29653e+01  1.01480e+01  0.00000e+00 0.00000e+00 2.32199e+02 9.156   4.30976e+01 189.156 0.9921 
1 1 1 0   76  12 o 7  4.38317e+00 9.44710e-01 1.32352e+02 155.547 -7.97922e+00 3.62840e+00  0.00000e+00 0.00000e+00 2.07409e+01 155.547 1.11611e+02 335.547 0.9411 
1 1 1 0   76  13 o 10 3.58579e+00 1.02203e+00 7.24621e+01 108.400 -1.24516e+00 3.74316e+00  0.00000e+00 0.00000e+00 4.20820e+01 108.400 3.03801e+01 288.400 0.8614 
1 1 1 0   76  14 o 6  6.16753e+00 1.12915e+00 4.91170e+01 319.152 3.79395e+00  -3.28037e+00 0.00000e+00 0.00000e+00 1.55134e+02 319.152 1.06017e+02 319.152 0.8937 
1 1 1 0   76  15 o 10 3.58443e+00 1.10868e+00 3.35422e+01 198.005 -2.33826e+00 -7.59976e-01 0.00000e+00 0.00000e+00 6.73673e+01 198.005 3.38250e+01 198.005 0.7604 
1 1 1 0   76  16 o 6  3.76556e+00 1.18014e+00 2.68504e+01 335.730 1.89433e+00  -8.54130e-01 0.00000e+00 0.00000e+00 7.20596e+01 335.730 4.52091e+01 335.730 0.7102 
1 1 1 0   76  17 o 2  4.29404e+00 1.31760e+00 5.06264e+01 139.710 -3.35048e+00 2.84037e+00  0.00000e+00 0.00000e+00 8.85332e+01 139.710 3.79068e+01 139.710 0.8771 
1 1 1 0   77  1  o 1  1.87081e+01 6.00007e-01 3.58731e+02 193.246 -4.58750e+01 -1.07988e+01 0.00000e+00 0.00000e+00 3.31050e+02 193.246 2.76812e+01 13.246  0.9893 
1 1 1 0   77  2  o 15 1.74291e+01 4.77394e-01 2.68197e+02 3.426   3.51653e+01  2.10509e+00  0.00000e+00 0.00000e+00 3.72007e+02 3.426   1.03810e+02 3.426   0.9857 
1 1 1 0   77  3  o 10 7.32997e+00 5.24966e-01 2.33571e+02 86.957  6.69609e-01  1.25968e+01  0.00000e+00 0.00000e+00 2.84771e+01 86.957  2.05094e+02 266.957 0.9595 
1 1 1 0   77  4  o 9  1.75309e+01 5.27500e-01 3.38575e+02 269.817 -1.50703e-01 -4.71611e+01 0.00000e+00 0.00000e+00 3.07508e+02 269.817 3.10671e+01 89.817  0.9893 
1 1 1 0   77  5  o 17 1.05452e+01 4.20051e-01 1.95302e+02 353.629 1.92018e+01  -2.14385e+00 0.00000e+00 0.00000e+00 1.87110e+02 353.629 8.19152e+00 173.629 0.9738 
1 1 1 0   77  6  o 9  1.90461e+01 4.52713e-01 3.16979e+02 327.544 5.06670e+01  -3.22240e+01 0.00000e+00 0.00000e+00 3.86144e+02 327.544 6.91652e+01 327.544 0.9916 
1 1 1 0   77  7  o 5  9.00653e+00 4.81795e-01 2.00754e+02 312.351 1.32536e+01  -1.45395e+01 0.00000e+00 0.00000e+00 1.25779e+02 312.351 7.49750e+01 132.351 0.9742 
1 1 1 0   77  8  o 13 4.12969e+00 8.04800e-01 7.62220e+01 41.073  2.92726e+00  2.55118e+00  0.00000e+00 0.00000e+00 5.57085e+01 41.073  2.05135e+01 221.073 0.8589 
1 1 1 0   77  9  o 19 8.65599e+00 6.07184e-01 7.65502e+01 296.357 4.11344e+00  -8.30218e+00 0.00000e+00 0.00000e+00 2.27358e+02 296.357 1.50808e+02 296.357 0.9444 
1 1 1 0   77  10 o 6  2.15560e+00 6.99910e-01 1.72783e+01 356.084 5.93775e-01  -4.06456e-02 0.00000e+00 0.00000e+00 5.55924e+00 356.084 1.17191e+01 176.084 0.2851 
1 1 1 0   77  11 o 16 3.97540e+00 9.65925e-01 7.93139e+01 31.909  4.01436e+00  2.49955e+00  0.00000e+00 0.00000e+00 5.15738e+01 31.909  2.77401e+01 211.909 0.8867 
1 1 1 0   77  12 o 3  8.31781e+00 8.19182e-01 2.24907e+02 225.450 -2.40366e+01 -2.44171e+01 0.00000e+00 0.00000e+00 7.91933e+01 225.450 1.45714e+02 45.450  0.9853 
1 1 1 0   77  13 o 13 3.15456e+00 9.62996e-01 7.63327e+01 9.059   4.00740e+00  6.38940e-01  0.00000e+00 0.00000e+00 2.49237e+01 9.059   5.14090e+01 189.059 0.8657 
1 1 1 0   77  14 o 12 8.45983e+00 1.08789e+00 8.61179e+01 231.185 -8.23283e+00 -1.02340e+01 0.00000e+00 0.00000e+00 2.15114e+02 231.185 1.28996e+02 231.185 0.9611 
1 1 1 0   77  15 o 5  4.57923e+00 1.18171e+00 6.37569e+01 75.196  1.34018e+00  5.07086e+00  0.00000e+00 0.00000e+00 8.85804e+01 75.196  2.48236e+01 75.196  0.8988 
1 1 1 0   77  16 o 1  6.75345e+00 1.39725e+00 1.04513e+02 318.312 9.24751e+00  -8.23588e+00 0.00000e+00 0.00000e+00 1.34916e+02 318.312 3.04034e+01 318.312 0.9587 
1 1 1 0   77  17 o 10 3.14130e+00 1.06436e+00 7.58557e+01 107.708 -2.01302e+00 6.30476e+00  0.00000e+00 0.00000e+00 3.10224e+01 107.708 4.48333e+01 287.707 0.9210 
1 1 1 0   78  0  o 18 9.67416e+00 9.73902e-01 1.48319e+02 73.151  1.51283e+00  4.99527e+00  0.00000e+00 0.00000e+00 1.75469e+02 73.151  2.71502e+01 73.151  0.8982 
1 1 1 0   78  1  o 4  1.10422e+01 5.45832e-01 2.09712e+02 296.597 7.78010e+00  -1.55383e+01 0.00000e+00 0.00000e+00 1.89705e+02 296.597 2.00079e+01 116.597 0.9708 
1 1 1 0   78  2  o 16 4.58729e+00 8.21685e-01 1.12569e+02 125.385 -2.08888e+00 2.94099e+00  0.00000e+00 0.00000e+00 3.21078e+01 125.385 8.04611e+01 305.385 0.8465 
1 1 1 0   78  3  o 2  2.75740e+01 5.58990e-01 3.73250e+02 304.805 4.92253e+01  -7.08141e+01 0.00000e+00 0.00000e+00 6.47941e+02 304.805 2.74691e+02 304.805 0.9942 
1 1 1 0   78  4  o 15 1.04333e+01 4.79563e-01 1.23857e+02 167.180 -1.09742e+01 2.49729e+00  0.00000e+00 0.00000e+00 2.47027e+02 167.180 1.23169e+02 167.180 0.9545 
1 1 1 0   78  5  o 5  1.48495e+01 4.19048e-01 3.15540e+02 61.892  2.06446e+01  3.86510e+01  0.00000e+00 0.00000e+00 2.31004e+02 61.892  8.45358e+01 241.892 0.9885 
1 1 1 0   78  6  o 14 1.42644e+01 4.61414e-01 1.96708e+02 322.937 2.47320e+01  -1.86792e+01 0.00000e+00 0.00000e+00 3.25582e+02 322.937 1.28874e+02 322.937 0.9837 
1 1 1 0   78  7  o 13 9.36039e+00 4.90201e-01 1.70235e+02 277.231 2.15486e+00  -1.69843e+01 0.00000e+00 0.00000e+00 1.67695e+02 277.231 2.54036e+00 97.231  0.9703 
1 1 1 0   78  8  o 19 1.56155e+01 5.06458e-01 3.52233e+02 180.917 -7.41774e+01 -1.18780e+00 0.00000e+00 0.00000e+00 2.24557e+02 180.917 1.27676e+02 0.917   0.9932 
1 1 1 0   78  9  o 3  7.69798e+00 6.63819e-01 1.37286e+02 352.209 1.41383e+01  -1.93451e+00 0.00000e+00 0.00000e+00 1.38628e+02 352.209 1.34210e+00 352.209 0.9643 
1 1 1 0   78  10 f 0  1.08638e+01 6.01077e-01 1.64717e+02 105.161 -7.61603e+00 2.81066e+01  0.00000e+00 0.00000e+00 2.31855e+02 105.161 6.71383e+01 105.161 0.9827 
1 1 1 0   78  11 o 8  7.54215e+00 8.19737e-01 8.11797e+01 301.296 5.24834e+00  -8.63319e+00 0.00000e+00 0.00000e+00 1.84574e+02 301.296 1.03394e+02 301.296 0.9491 
1 1 1 0   78  12 o 1  5.41837e+00 8.76030e-01 6.54767e+01 101.555 -1.18539e+00 5.79806e+00  0.00000e+00 0.00000e+00 1.17656e+02 101.555 5.21796e+01 101.555 0.9111 
1 1 1 0   78  13 o 2  3.69439e+00 1.04091e+00 5.25865e+01 229.604 -2.07749e+00 -2.44135e+00 0.00000e+00 0.00000e+00 6.02745e+01 229.604 7.68794e+00 229.604 0.8241 
1 1 1 0   78  14 o 7  5.56933e+00 1.17537e+00 7.96942e+01 200.692 -6.99667e+00 -2.64267e+00 0.00000e+00 0.00000e+00 1.12256e+02 200.692 3.25615e+01 200.692 0.9305 
1 1 1 0   78  15 o 5  4.43574e+00 1.23614e+00 1.00236e+02 9.005   7.94551e+00  1.25918e+00  0.00000e+00 0.00000e+00 5.33437e+01 9.005   4.68923e+01 189.005 0.9356 
1 1 1 0   78  16 o 3  3.72128e+00 1.12087e+00 8.86232e+01 194.965 -7.56085e+00 -2.02102e+00 0.00000e+00 0.00000e+00 3.98402e+01 194.965 4.87830e+01 14.965  0.9337 
1 1 1 0   79  1  o 7  1.04401e+01 5.81150e-01 2.64091e+02 118.443 -1.01312e+01 1.87039e+01  0.00000e+00 0.00000e+00 1.15571e+02 118.443 1.48520e+02 298.443 0.9762 
1 1 1 0   79  2  f 0  8.76485e+00 6.42486e-01 1.00365e+02 33.408  6.05869e+00  3.99619e+00  0.00000e+00 0.00000e+00 2.02708e+02 33.408  1.02343e+02 33.408  0.9283 
1 1 1 0   79  3  o 3  1.35289e+01 7.38647e-01 2.30891e+02 290.666 9.15709e+00  -2.42775e+01 0.00000e+00 0.00000e+00 2.63159e+02 290.666 3.22684e+01 290.666 0.9805 
1 1 1 0   79  4  o 19 1.99532e+01 4.67176e-01 2.76196e+02 76.278  1.21590e+01  4.97963e+01  0.00000e+00 0.00000e+00 4.59482e+02 76.278  1.83286e+02 76.278  0.9902 
1 1 1 0   79  5  f 0  1.03009e+01 4.31825e-01 2.54573e+02 333.210 2.33811e+01  -1.18054e+01 0.00000e+00 0.00000e+00 1.21485e+02 333.210 1.33088e+02 153.210 0.9807 
1 1 1 0   79  6  o 10 6.82341e+00 6.06777e-01 9.55671e+01 32.009  6.07930e+00  3.80006e+00  0.00000e+00 0.00000e+00 1.39908e+02 32.009  4.43408e+01 32.009  0.9274 
1 1 1 0   79  7  o 18 6.35953e+00 5.65501e-01 1.50016e+02 274.292 8.61641e-01  -1.14817e+01 0.00000e+00 0.00000e+00 7.60253e+01 274.292 7.39904e+01 94.292  0.9555 
1 1 1 0   79  8  o 7  1.38460e+01 5.01935e-01 2.43111e+02 98.704  -7.12591e+00 4.65451e+01  0.00000e+00 0.00000e+00 2.66195e+02 98.704  2.30842e+01 98.704  0.9893 
1 1 1 0   79  9  o 3  1.60829e+01 5.43289e-01 2.81891e+02 317.341 5.14691e+01  -4.74258e+01 0.00000e+00 0.00000e+00 3.11484e+02 317.341 2.95930e+01 317.341 0.9928 
1 1 1 0   79  10 o 6  2.51961e+00 7.24476e-01 6.07870e+01 256.141 -5.66985e-01 -2.29810e+00 0.00000e+00 0.00000e+00 9.37010e+00 256.141 5.14169e+01 76.141  0.7497 
1 1 1 0   79  11 o 7  5.04080e+00 9.13738e-01 7.67239e+01 18.980  5.83300e+00  2.00623e+00  0.00000e+00 0.00000e+00 9.44480e+01 18.980  1.77240e+01 18.980  0.9149 
1 1 1 0   79  12 o 4  4.54075e+00 1.05484e+00 1.25465e+02 293.476 3.26463e+00  -7.51662e+00 0.00000e+00 0.00000e+00 3.23131e+01 293.476 9.31518e+01 113.476 0.9368 
1 1 1 0   79  13 o 6  3.62060e+00 1.04855e+00 6.21714e+01 309.484 2.48234e+00  -3.01299e+00 0.00000e+00 0.00000e+00 5.31902e+01 309.484 8.98121e+00 129.484 0.8597 
1 1 1 0   79  14 o 7  6.95889e+00 1.12950e+00 8.47698e+01 98.208  -1.45359e+00 1.00776e+01  0.00000e+00 0.00000e+00 1.59922e+02 98.208  7.51526e+01 98.208  0.9495 
1 1 1 0   79  15 o 5  3.22310e+00 1.03531e+00 3.17584e+01 304.148 1.21494e+00  -1.79122e+00 0.00000e+00 0.00000e+00 5.44586e+01 304.148 2.27002e+01 304.148 0.7230 
1 1 1 0   79  16 o 9  2.70417e+00 9.36762e-01 3.86432e+01 319.403 2.27496e+00  -1.94968e+00 0.00000e+00 0.00000e+00 4.22896e+01 319.403 3.64642e+00 319.403 0.8097 
1 1 1 0   80  0  o 9  2.59953e+01 9.41237e-01 4.80817e+02 188.194 -5.07188e+01 -7.30307e+00 0.00000e+00 0.00000e+00 4.77889e+02 188.194 2.92827e+00 8.194   0.9902 
1 1 1 0   80  1  o 8  1.16981e+01 5.79096e-01 2.30524e+02 58.683  1.16667e+01  1.91751e+01  0.00000e+00 0.00000e+00 1.95341e+02 58.683  3.51823e+01 238.683 0.9775 
1 1 1 0   80  2  o 9  2.32266e+01 6.45365e-01 3.74824e+02 301.622 3.86862e+01  -6.28293e+01 0.00000e+00 0.00000e+00 4.84269e+02 301.622 1.09445e+02 301.622 0.9932 
1 1 1 0   80  3  o 13 2.32266e+01 5.96286e-01 3.86235e+02 7.864   7.67285e+01  1.05974e+01  0.00000e+00 0.00000e+00 4.73004e+02 7.864   8.67685e+01 7.864   0.9935 
1 1 1 0   80  4  o 14 1.07730e+01 4.29402e-01 1.75722e+02 319.788 1.34852e+01  -1.14008e+01 0.00000e+00 0.00000e+00 2.13800e+02 319.788 3.80776e+01 319.788 0.9713 
1 1 1 0   80  5  o 13 2.02648e+01 4.44997e-01 3.85153e+02 207.244 -6.90132e+01 -3.55354e+01 0.00000e+00 0.00000e+00 3.64165e+02 207.244 2.09880e+01 27.244  0.9935 
1 1 1 0   80  6  o 6  1.02732e+01 5.26142e-01 2.42261e+02 1.592   2.83883e+01  7.88991e-01  0.00000e+00 0.00000e+00 1.33155e+02 1.592   1.09106e+02 181.592 0.9822 
1 1 1 0   80  7  f 0  3.66624e+00 7.11402e-01 4.23667e+01 174.854 -1.88573e+00 1.69810e-01  0.00000e+00 0.00000e+00 5.02748e+01 174.854 7.90811e+00 174.854 0.6795 
1 1 1 0   80  8  o 13 2.13152e+00 6.61738e-01 8.72646e+01 287.518 7.64601e-01  -2.42235e+00 0.00000e+00 0.00000e+00 2.63104e+01 107.518 1.13575e+02 107.518 0.7693 
1 1 1 0   80  9  o 14 4.99103e+00 8.49877e-01 1.00762e+02 181.186 -6.74456e+00 -1.39585e-01 0.00000e+00 0.00000e+00 7.03146e+01 181.186 3.04472e+01 1.186   0.9226 
1 1 1 0   80  10 o 18 3.82412e+00 8.86582e-01 1.02049e+02 347.393 5.69493e+00  -1.27372e+00 0.00000e+00 0.00000e+00 2.71285e+01 347.393 7.49203e+01 167.393 0.9097 
1 1 1 0   80  11 o 9  8.57691e+00 7.37416e-01 1.16856e+02 291.866 6.47361e+00  -1.61316e+01 0.00000e+00 0.00000e+00 1.92119e+02 291.866 7.52626e+01 291.866 0.9708 
1 1 1 0   80  12 o 1  1.24534e+01 7.32352e-01 2.34561e+02 150.434 -4.67573e+01 2.65247e+01  0.00000e+00 0.00000e+00 2.22919e+02 150.434 1.16424e+01 330.434 0.9907 
1 1 1 0   80  13 o 17 5.76391e+00 1.12150e+00 1.08927e+02 332.323 9.09730e+00  -4.77160e+00 0.00000e+00 0.00000e+00 9.39684e+01 332.323 1.49583e+01 152.323 0.9500 
1 1 1 0   80  14 o 10 5.44005e+00 1.24617e+00 7.15963e+01 164.768 -6.22435e+00 1.69481e+00  0.00000e+00 0.00000e+00 1.13464e+02 164.768 4.18675e+01 164.768 0.9188 
1 1 1 0   80  15 o 9  5.08230e+00 1.24745e+00 5.88995e+01 305.011 3.10129e+00  -4.42731e+00 0.00000e+00 0.00000e+00 1.10673e+02 305.011 5.17737e+01 305.011 0.9020 
1 1 1 0   80  16 o 12 4.29931e+00 1.27215e+00 8.05315e+01 34.419  5.75837e+00  3.94569e+00  0.00000e+00 0.00000e+00 6.64833e+01 34.419  1.40483e+01 214.419 0.9253 
1 1 1 0   81  1  o 14 1.84170e+01 4.86429e-01 3.36213e+02 276.818 6.39418e+00  -5.34788e+01 0.00000e+00 0.00000e+00 3.43164e+02 276.818 6.95127e+00 276.818 0.9907 
1 1 1 0   81  2  o 4  1.71171e+01 6.94054e-01 2.83759e+02 32.464  3.65457e+01  2.32501e+01  0.00000e+00 0.00000e+00 3.46151e+02 32.464  6.23917e+01 32.464  0.9884 
1 1 1 0   81  3  o 14 1.25632e+01 4.88991e-01 1.71144e+02 97.703  -2.66435e+00 1.96985e+01  0.00000e+00 0.00000e+00 2.84622e+02 97.703  1.13478e+02 97.703  0.9745 
1 1 1 0   81  4  o 15 2.17320e+01 5.36048e-01 3.75575e+02 240.997 -3.87619e+01 -6.99206e+01 0.00000e+00 0.00000e+00 4.28188e+02 240.997 5.26130e+01 240.997 0.9937 
1 1 1 0   81  5  o 10 8.68610e+00 4.65669e-01 1.06962e+02 8.313   9.93532e+00  1.45172e+00  0.00000e+00 0.00000e+00 1.99692e+02 8.313   9.27301e+01 8.313   0.9488 
1 1 1 0   81  6  o 18 1.25409e+01 5.14418e-01 1.88236e+02 0.598   2.74521e+01  2.86656e-01  0.00000e+00 0.00000e+00 2.69660e+02 0.598   8.14234e+01 0.598   0.9816 
1 1 1 0   81  7  f 0  9.25285e+00 4.91529e-01 1.27340e+02 33.304  1.33294e+01  8.75702e+00  0.00000e+00 0.00000e+00 2.05726e+02 33.304  7.83864e+01 33.304  0.9681 
1 1 1 0   81  8  o 15 5.08427e+00 7.61918e-01 1.03565e+02 275.388 6.78933e-01  -7.19906e+00 0.00000e+00 0.00000e+00 7.17884e+01 275.388 3.17764e+01 95.388  0.9280 
1 1 1 0   81  9  o 8  5.23999e+00 8.03228e-01 8.05103e+01 283.504 1.50400e+00  -6.26254e+00 0.00000e+00 0.00000e+00 9.83053e+01 283.504 1.77949e+01 283.504 0.9187 
1 1 1 0   81  10 o 13 9.86659e+00 6.47918e-01 2.09999e+02 148.183 -3.08271e+01 1.91264e+01  0.00000e+00 0.00000e+00 1.51198e+02 148.183 5.88005e+01 328.183 0.9861 
1 1 1 0   81  11 o 18 3.44561e+00 8.39908e-01 2.61425e+01 242.898 -6.53272e-01 -1.27648e+00 0.00000e+00 0.00000e+00 4.79189e+01 242.898 2.17764e+01 242.898 0.5794 
1 1 1 0   81  12 o 5  9.42752e+00 8.18324e-01 1.20495e+02 274.203 1.41319e+00  -1.92305e+01 0.00000e+00 0.00000e+00 2.19829e+02 274.203 9.93342e+01 274.203 0.9737 
1 1 1 0   81  13 o 4  4.56427e+00 1.13523e+00 1.10749e+02 346.324 8.45355e+00  -2.05695e+00 0.00000e+00 0.00000e+00 4.82985e+01 346.324 6.24509e+01 166.324 0.9406 
1 1 1 0   81  14 o 6  7.28396e+00 1.23364e+00 9.20811e+01 232.323 -7.34116e+00 -9.50618e+00 0.00000e+00 0.00000e+00 1.66052e+02 232.323 7.39711e+01 232.323 0.9574 
1 1 1 0   81  15 o 16 2.78661e+00 9.39327e-01 5.27141e+01 327.811 3.33335e+00  -2.09825e+00 0.00000e+00 0.00000e+00 3.60283e+01 327.811 1.66858e+01 147.811 0.8611 
1 1 1 0   81  16 o 17 3.22735e+00 1.08287e+00 5.43741e+00 157.184 -4.01323e-01 1.68830e-01  0.00000e+00 0.00000e+00 1.99243e+01 157.184 1.44869e+01 157.184 0.2127 
1 1 1 0   82  0  o 1  1.09631e+01 7.94760e-01 2.66045e+02 68.246  4.94838e+00  1.24004e+01  0.00000e+00 0.00000e+00 1.26501e+02 68.246  1.39544e+02 248.246 0.9618 
1 1 1 0   82  1  o 15 4.69580e+00 7.74610e-01 7.14704e+01 77.760  6.20467e-01  2.86017e+00  0.00000e+00 0.00000e+00 6.91520e+01 77.760  2.31841e+00 257.760 0.8044 
1 1 1 0   82  2  o 8  6.01294e+00 6.18466e-01 1.41448e+02 91.530  -2.04857e-01 7.66943e+00  0.00000e+00 0.00000e+00 6.72359e+01 91.530  7.42120e+01 271.530 0.9323 
1 1 1 0   82  3  o 8  6.58308e+00 5.90775e-01 1.23923e+02 285.043 2.02582e+00  -7.53780e+00 0.00000e+00 0.00000e+00 1.04808e+02 285.043 1.91146e+01 105.043 0.9336 
1 1 1 0   82  4  o 9  1.41586e+01 5.01277e-01 1.96671e+02 98.793  -4.66289e+00 3.01455e+01  0.00000e+00 0.00000e+00 3.21469e+02 98.793  1.24798e+02 98.793  0.9835 
1 1 1 0   82  5  o 6  6.45937e+00 6.29145e-01 8.70283e+01 230.272 -3.77914e+00 -4.54749e+00 0.00000e+00 0.00000e+00 1.31872e+02 230.272 4.48435e+01 230.272 0.9110 
1 1 1 0   82  6  o 1  1.77534e+01 5.22071e-01 4.36899e+02 323.402 7.57709e+01  -5.62689e+01 0.00000e+00 0.00000e+00 2.19801e+02 323.402 2.17098e+02 143.402 0.9947 
1 1 1 0   82  7  o 13 1.03529e+01 4.76711e-01 2.53547e+02 106.537 -1.05150e+01 3.54151e+01  0.00000e+00 0.00000e+00 1.26056e+02 106.537 1.27491e+02 286.537 0.9864 
1 1 1 0   82  8  o 2  4.41264e+00 7.86039e-01 8.18172e+01 320.758 3.73629e+00  -3.05185e+00 0.00000e+00 0.00000e+00 6.39626e+01 320.758 1.78546e+01 140.758 0.8891 
1 1 1 0   82  9  o 13 9.04408e+00 6.15770e-01 1.42054e+02 301.743 1.09277e+01  -1.76637e+01 0.00000e+00 0.00000e+00 1.85625e+02 301.743 4.35708e+01 301.743 0.9756 
1 1 1 0   82  10 o 13 1.44931e+01 5.84474e-01 2.10722e+02 196.300 -4.81934e+01 -1.40930e+01 0.00000e+00 0.00000e+00 3.21809e+02 196.300 1.11087e+02 196.300 0.9900 
1 1 1 0   82  11 o 9  7.98940e+00 8.22454e-01 1.22051e+02 299.107 8.65909e+00  -1.55531e+01 0.00000e+00 0.00000e+00 1.65838e+02 299.107 4.37865e+01 299.107 0.9715 
1 1 1 0   82  12 o 1  7.17520e+00 9.70441e-01 1.14703e+02 133.682 -9.53472e+00 9.98392e+00  0.00000e+00 0.00000e+00 1.41426e+02 133.682 2.67227e+01 133.682 0.9631 
1 1 1 0   82  13 o 9  7.50743e+00 1.07453e+00 1.72731e+02 203.328 -2.03129e+01 -8.75991e+00 0.00000e+00 0.00000e+00 9.89622e+01 203.328 7.37686e+01 23.328  0.9771 
1 1 1 0   82  14 o 10 3.46291e+00 1.05473e+00 4.45841e+01 302.188 1.75860e+00  -2.79385e+00 0.00000e+00 0.00000e+00 6.17810e+01 302.188 1.71969e+01 302.188 0.8300 
1 1 1 0   82  15 o 2  5.94615e+00 1.37515e+00 9.38545e+01 62.680  4.36158e+00  8.44299e+00  0.00000e+00 0.00000e+00 1.14086e+02 62.680  2.02310e+01 62.680  0.9458 
1 1 1 0   83  1  o 1  1.20166e+01 5.02960e-01 1.85576e+02 31.610  1.74971e+01  1.07684e+01  0.00000e+00 0.00000e+00 2.50646e+02 31.610  6.50700e+01 31.610  0.9754 
1 1 1 0   83  2  o 15 1.17394e+01 4.57402e-01 2.35659e+02 107.340 -8.08776e+00 2.59034e+01  0.00000e+00 0.00000e+00 1.93104e+02 107.340 4.25548e+01 287.340 0.9814 
1 1 1 0   83  3  o 5  7.06909e+00 5.60353e-01 1.16878e+02 321.259 6.27762e+00  -5.03668e+00 0.00000e+00 0.00000e+00 1.29234e+02 321.259 1.23564e+01 321.259 0.9356 
1 1 1 0   83  4  o 8  1.77271e+01 5.08449e-01 2.84764e+02 126.564 -3.37999e+01 4.55713e+01  0.00000e+00 0.00000e+00 3.68881e+02 126.564 8.41166e+01 126.564 0.9911 
1 1 1 0   83  5  o 3  1.00050e+01 5.64565e-01 1.33032e+02 267.567 -5.96616e-01 -1.40401e+01 0.00000e+00 0.00000e+00 2.25577e+02 267.567 9.25447e+01 267.567 0.9637 
1 1 1 0   83  6  o 5  1.14480e+01 5.00330e-01 2.32160e+02 104.897 -9.25350e+00 3.47834e+01  0.00000e+00 0.00000e+00 1.87515e+02 104.897 4.46447e+01 284.897 0.9860 
1 1 1 0   83  7  o 5  1.03751e+01 4.80095e-01 2.15619e+02 334.979 2.92051e+01  -1.36316e+01 0.00000e+00 0.00000e+00 1.63936e+02 334.979 5.16828e+01 154.979 0.9844 
1 1 1 0   83  8  o 5  1.32926e+01 5.23243e-01 2.10194e+02 242.254 -1.96628e+01 -3.73784e+01 0.00000e+00 0.00000e+00 2.77711e+02 242.254 6.75167e+01 242.254 0.9881 
1 1 1 0   83  9  o 12 4.61888e+00 8.83230e-01 6.78394e+01 119.816 -2.24081e+00 3.91013e+00  0.00000e+00 0.00000e+00 8.31631e+01 119.816 1.53237e+01 119.816 0.8805 
1 1 1 0   83  10 o 17 3.57079e+00 9.18179e-01 6.37825e+01 49.755  2.16954e+00  2.56324e+00  0.00000e+00 0.00000e+00 4.66347e+01 49.755  1.71478e+01 229.755 0.8333 
1 1 1 0   83  11 o 16 1.56971e+01 6.47296e-01 2.29038e+02 17.245  6.57156e+01  2.03988e+01  0.00000e+00 0.00000e+00 3.48809e+02 17.245  1.19771e+02 17.245  0.9927 
1 1 1 0   83  12 o 2  1.21530e+01 7.52278e-01 2.12997e+02 193.906 -4.92322e+01 -1.21889e+01 0.00000e+00 0.00000e+00 2.32894e+02 193.906 1.98961e+01 193.906 0.9901 
1 1 1 0   83  13 o 1  5.97694e+00 1.15121e+00 9.92975e+01 346.022 9.82801e+00  -2.44639e+00 0.00000e+00 0.00000e+00 1.10792e+02 346.022 1.14948e+01 346.022 0.9493 
1 1 1 0   83  14 o 11 5.58121e+00 1.25559e+00 6.76322e+01 288.470 2.02543e+00  -6.06394e+00 0.00000e+00 0.00000e+00 1.21943e+02 288.470 5.43105e+01 288.470 0.9181 
1 1 1 0   83  15 o 17 3.88311e+00 1.19380e+00 6.18642e+01 297.874 2.42324e+00  -4.58183e+00 0.00000e+00 0.00000e+00 6.69578e+01 297.874 5.09367e+00 297.874 0.8975 
1 1 1 0   84  0  o 2  6.76534e+00 9.10416e-01 2.07197e+02 111.518 -2.46141e+00 6.24281e+00  0.00000e+00 0.00000e+00 2.49543e+01 111.518 1.82243e+02 291.518 0.9222 
1 1 1 0   84  1  o 8  1.44345e+01 4.78206e-01 1.82232e+02 78.136  5.35058e+00  2.54701e+01  0.00000e+00 0.00000e+00 3.44461e+02 78.136  1.62229e+02 78.136  0.9806 
1 1 1 0   84  2  o 8  8.38857e+00 5.18495e-01 1.13698e+02 31.991  7.94204e+00  4.96093e+00  0.00000e+00 0.00000e+00 1.81248e+02 31.991  6.75505e+01 31.991  0.9450 
1 1 1 0   84  3  o 1  1.01911e+01 4.69397e-01 1.82821e+02 256.359 -4.74643e+00 -1.95588e+01 0.00000e+00 0.00000e+00 1.86761e+02 256.359 3.94007e+00 256.359 0.9748 
1 1 1 0   84  4  o 7  1.66630e+01 5.21004e-01 3.08755e+02 275.701 5.83356e+00  -5.84304e+01 0.00000e+00 0.00000e+00 3.05701e+02 275.701 3.05448e+00 95.701  0.9914 
1 1 1 0   84  5  o 6  7.59350e+00 6.00516e-01 1.05068e+02 91.314  -2.18372e-01 9.51998e+00  0.00000e+00 0.00000e+00 1.62019e+02 91.314  5.69503e+01 91.314  0.9459 
1 1 1 0   84  6  o 10 1.59621e+01 5.40165e-01 2.38314e+02 220.094 -3.65672e+01 -3.07864e+01 0.00000e+00 0.00000e+00 3.48772e+02 220.094 1.10458e+02 220.094 0.9895 
1 1 1 0   84  7  o 8  1.47523e+01 4.76321e-01 2.17617e+02 320.278 3.72519e+01  -3.09508e+01 0.00000e+00 0.00000e+00 3.24831e+02 320.278 1.07214e+02 320.278 0.9896 
1 1 1 0   84  8  o 10 8.68174e+00 6.09843e-01 1.08855e+02 170.380 -1.54276e+01 2.61483e+00  0.00000e+00 0.00000e+00 2.03097e+02 170.380 9.42413e+01 170.380 0.9675 
1 1 1 0   84  9  o 9  5.35054e+00 8.13859e-01 9.86579e+01 90.360  -5.13122e-02 8.16318e+00  0.00000e+00 0.00000e+00 8.73574e+01 90.360  1.13005e+01 270.360 0.9366 
1 1 1 0   84  10 o 7  1.46782e+01 6.05907e-01 2.60788e+02 93.819  -4.68891e+00 7.02383e+01  0.00000e+00 0.00000e+00 2.79865e+02 93.819  1.90768e+01 93.819  0.9929 
1 1 1 0   84  11 o 15 1.29870e+01 7.32559e-01 2.72213e+02 205.253 -5.97831e+01 -2.81994e+01 0.00000e+00 0.00000e+00 2.05618e+02 205.253 6.65954e+01 25.253  0.9924 
1 1 1 0   84  12 o 3  4.58326e+00 1.12888e+00 6.57052e+01 352.024 4.89441e+00  -6.85788e-01 0.00000e+00 0.00000e+00 8.57626e+01 352.024 2.00574e+01 352.024 0.8920 
1 1 1 0   84  13 o 12 1.06060e+01 9.10214e-01 1.50274e+02 83.334  3.68593e+00  3.15390e+01  0.00000e+00 0.00000e+00 2.36129e+02 83.334  8.58555e+01 83.334  0.9841 
1 1 1 0   84  14 o 3  3.51475e+00 1.08847e+00 5.52229e+01 32.469  3.34373e+00  2.12763e+00  0.00000e+00 0.00000e+00 5.68573e+01 32.469  1.63441e+00 32.469  0.8621 
1 1 1 0   84  15 o 15 5.39231e+00 1.23505e+00 6.72098e+01 290.900 2.74494e+00  -7.18824e+00 0.00000e+00 0.00000e+00 1.18631e+02 290.900 5.14216e+01 290.900 0.9326 
1 1 1 0   85  1  o 19 1.05042e+01 4.71851e-01 1.32516e+02 214.732 -1.25916e+01 -8.72926e+00 0.00000e+00 0.00000e+00 2.45286e+02 214.732 1.12770e+02 214.732 0.9668 
1 1 1 0   85  2  o 15 2.01104e+01 5.05356e-01 3.19635e+02 244.078 -3.01292e+01 -6.19893e+01 0.00000e+00 0.00000e+00 4.22995e+02 244.078 1.03360e+02 244.078 0.9927 
1 1 1 0   85  3  o 8  7.70197e+00 5.25152e-01 1.76184e+02 293.374 5.79886e+00  -1.34171e+01 0.00000e+00 0.00000e+00 1.00295e+02 293.374 7.58892e+01 113.374 0.9652 
1 1 1 0   85  4  o 15 1.39725e+01 5.26459e-01 2.04016e+02 87.861  1.23280e+00  3.30007e+01  0.00000e+00 0.00000e+00 3.07622e+02 87.861  1.03606e+02 87.861  0.9847 
1 1 1 0   85  5  o 13 1.05768e+01 5.46212e-01 1.36047e+02 356.105 1.92142e+01  -1.30828e+00 0.00000e+00 0.00000e+00 2.46793e+02 356.105 1.10746e+02 356.105 0.9737 
1 1 1 0   85  6  o 16 9.94253e+00 5.74948e-01 1.66223e+02 136.841 -1.57827e+01 1.47999e+01  0.00000e+00 0.00000e+00 1.94621e+02 136.841 2.83987e+01 136.841 0.9766 
1 1 1 0   85  7  o 12 3.84044e+00 8.91120e-01 6.52270e+01 358.101 3.20291e+00  -1.06187e-01 0.00000e+00 0.00000e+00 5.23337e+01 358.101 1.28933e+01 178.101 0.8240 
1 1 1 0   85  8  o 7  4.33089e+00 8.30001e-01 7.39131e+01 85.048  4.09023e-01  4.72097e+00  0.00000e+00 0.00000e+00 6.87150e+01 85.048  5.19818e+00 265.048 0.8869 
1 1 1 0   85  9  o 2  1.22604e+01 6.36019e-01 1.73462e+02 85.986  2.61551e+00  3.72707e+01  0.00000e+00 0.00000e+00 2.75404e+02 85.986  1.01942e+02 85.986  0.9865 
1 1 1 0   85  10 o 8  8.87316e+00 7.29639e-01 1.61570e+02 279.334 3.90042e+00  -2.37301e+01 0.00000e+00 0.00000e+00 1.60615e+02 279.334 9.54219e-01 99.334  0.9790 
1 1 1 0   85  11 f 0  6.16539e+00 9.95839e-01 1.17194e+02 4.567   1.20513e+01  9.62656e-01  0.00000e+00 0.00000e+00 1.01665e+02 4.567   1.55292e+01 184.567 0.9577 
1 1 1 0   85  12 o 8  5.61569e+00 1.06422e+00 9.75713e+01 191.602 -9.31388e+00 -1.91228e+00 0.00000e+00 0.00000e+00 9.91701e+01 191.602 1.59882e+00 191.602 0.9459 
1 1 1 0   85  13 o 19 4.25354e+00 1.05264e+00 9.91872e+01 62.817  3.69229e+00  7.18954e+00  0.00000e+00 0.00000e+00 4.81546e+01 62.817  5.10325e+01 242.817 0.9359 
1 1 1 0   85  14 o 16 4.39073e+00 1.23283e+00 6.64662e+01 239.537 -2.65878e+00 -4.52041e+00 0.00000e+00 0.00000e+00 7.94681e+01 239.537 1.30019e+01 239.537 0.8988 
1 1 1 0   85  15 o 14 4.41240e+00 1.21316e+00 1.04069e+02 214.743 -8.22833e+00 -5.70677e+00 0.00000e+00 0.00000e+00 5.05932e+01 214.743 5.34761e+01 34.743  0.9487 
1 1 1 0   86  0  o 18 8.32224e+00 6.45431e-01 1.43934e+02 58.442  3.55988e+00  5.79607e+00  0.00000e+00 0.00000e+00 1.41849e+02 58.442  2.08508e+00 238.442 0.9233 
1 1 1 0   86  1  o 4  6.76917e+00 5.50671e-01 1.30748e+02 66.767  3.88365e+00  9.04667e+00  0.00000e+00 0.00000e+00 1.07868e+02 66.767  2.28798e+01 246.767 0.9478 
1 1 1 0   86  2  o 13 1.42984e+01 4.77796e-01 2.74438e+02 54.905  2.45233e+01  3.49000e+01  0.00000e+00 0.00000e+00 2.51045e+02 54.905  2.33931e+01 234.905 0.9882 
1 1 1 0   86  3  o 6  1.26135e+01 4.84207e-01 1.53436e+02 261.464 -3.08354e+00 -2.05444e+01 0.00000e+00 0.00000e+00 3.04157e+02 261.464 1.50721e+02 261.464 0.9756 
1 1 1 0   86  4  o 5  5.43608e+00 6.80862e-01 5.80399e+01 33.151  3.25400e+00  2.12542e+00  0.00000e+00 0.00000e+00 1.15561e+02 33.151  5.75214e+01 33.151  0.8590 
1 1 1 0   86  5  o 3  1.11395e+01 5.48712e-01 1.68896e+02 230.368 -1.50491e+01 -1.81709e+01 0.00000e+00 0.00000e+00 2.36244e+02 230.368 6.73485e+01 230.368 0.9786 
1 1 1 0   86  6  o 18 7.67469e+00 6.43375e-01 1.71100e+02 169.980 -1.78493e+01 3.15377e+00  0.00000e+00 0.00000e+00 1.06061e+02 169.980 6.50386e+01 349.980 0.9720 
1 1 1 0   86  7  o 5  8.85882e+00 6.36173e-01 1.51310e+02 126.726 -1.16775e+01 1.56515e+01  0.00000e+00 0.00000e+00 1.69157e+02 126.726 1.78472e+01 126.726 0.9740 
1 1 1 0   86  8  o 15 1.31210e+01 6.31532e-01 2.57591e+02 24.138  4.94221e+01  2.21473e+01  0.00000e+00 0.00000e+00 2.24966e+02 24.138  3.26254e+01 204.138 0.9907 
1 1 1 0   86  9  o 10 1.20110e+01 5.91216e-01 2.46383e+02 194.177 -5.24556e+01 -1.32508e+01 0.00000e+00 0.00000e+00 1.95117e+02 194.177 5.12653e+01 14.177  0.9907 
1 1 1 0   86  10 o 1  1.20029e+01 6.49661e-01 2.46955e+02 334.707 5.35185e+01  -2.52900e+01 0.00000e+00 0.00000e+00 1.94348e+02 334.707 5.26076e+01 154.707 0.9915 
1 1 1 0   86  11 o 4  9.74600e+00 7.85994e-01 2.09578e+02 94.913  -3.19912e+00 3.72200e+01  0.00000e+00 0.00000e+00 1.46714e+02 94.913  6.28640e+01 274.913 0.9865 
1 1 1 0   86  12 o 6  3.69000e+00 1.04046e+00 2.04318e+01 242.876 -6.05092e-01 -1.18126e+00 0.00000e+00 0.00000e+00 5.47814e+01 242.876 3.43496e+01 242.876 0.5504 
1 1 1 0   86  13 o 16 3.43688e+00 1.04822e+00 9.00158e+01 111.920 -2.34851e+00 5.83608e+00  0.00000e+00 0.00000e+00 2.65591e+01 111.920 6.34568e+01 291.920 0.9167 
1 1 1 0   86  14 o 8  3.66342e+00 1.12033e+00 4.61639e+01 295.491 1.49626e+00  -3.13817e+00 0.00000e+00 0.00000e+00 6.75927e+01 295.491 2.14288e+01 295.491 0.8399 
1 1 1 0   86  15 o 11 3.53662e+00 1.12817e+00 9.11963e+01 211.715 -6.34798e+00 -3.92288e+00 0.00000e+00 0.00000e+00 3.03470e+01 211.715 6.08494e+01 31.715  0.9304 
1 1 1 0   87  1  o 18 1.09926e+01 4.30238e-01 1.60926e+02 75.399  5.17765e+00  1.98761e+01  0.00000e+00 0.00000e+00 2.37750e+02 75.399  7.68236e+01 75.399  0.9753 
1 1 1 0   87  2  o 8  6.59164e+00 5.73129e-01 1.24990e+02 200.527 -8.12484e+00 -3.04206e+00 0.00000e+00 0.00000e+00 1.05504e+02 200.527 1.94854e+01 20.527  0.9405 
1 1 1 0   87  3  o 8  5.89943e+00 6.07377e-01 1.93798e+02 279.070 2.14638e+00  -1.34457e+01 0.00000e+00 0.00000e+00 1.73011e+01 279.070 1.76497e+02 99.070  0.9625 
1 1 1 0   87  4  o 10 1.53676e+01 4.92515e-01 3.27217e+02 118.070 -3.20350e+01 6.00714e+01  0.00000e+00 0.00000e+00 2.39747e+02 118.070 8.74695e+01 298.070 0.9926 
1 1 1 0   87  5  o 2  1.34067e+01 4.80867e-01 1.92091e+02 17.824  3.28923e+01  1.05759e+01  0.00000e+00 0.00000e+00 2.98800e+02 17.824  1.06709e+02 17.824  0.9854 
1 1 1 0   87  6  o 3  7.49002e+00 6.87372e-01 9.07159e+01 105.948 -2.49582e+00 8.73379e+00  0.00000e+00 0.00000e+00 1.71705e+02 105.948 8.09895e+01 105.948 0.9432 
1 1 1 0   87  7  o 3  1.48228e+01 5.84108e-01 2.27020e+02 14.709  5.43655e+01  1.42714e+01  0.00000e+00 0.00000e+00 3.18432e+02 14.709  9.14124e+01 14.709  0.9911 
1 1 1 0   87  8  o 15 7.61720e+00 8.43135e-01 1.53103e+02 264.147 -1.81478e+00 -1.77027e+01 0.00000e+00 0.00000e+00 1.21531e+02 264.147 3.15720e+01 84.147  0.9715 
1 1 1 0   87  9  o 16 6.21556e+00 8.23609e-01 6.96491e+01 334.974 6.55015e+00  -3.05806e+00 0.00000e+00 0.00000e+00 1.44309e+02 334.974 7.46602e+01 334.974 0.9280 
1 1 1 0   87  10 o 18 3.24536e+00 9.20042e-01 7.30737e+01 129.601 -2.51099e+00 3.03518e+00  0.00000e+00 0.00000e+00 3.05326e+01 129.601 4.25410e+01 309.601 0.8611 
1 1 1 0   87  11 o 6  9.66379e+00 7.83791e-01 1.45211e+02 250.377 -8.92811e+00 -2.50415e+01 0.00000e+00 0.00000e+00 2.06017e+02 250.377 6.08066e+01 250.377 0.9810 
1 1 1 0   87  12 o 6  5.68320e+00 1.13536e+00 9.09981e+01 129.094 -5.67972e+00 6.99026e+00  0.00000e+00 0.00000e+00 1.07358e+02 129.094 1.63599e+01 129.094 0.9427 
1 1 1 0   87  13 o 7  3.80000e+00 1.10267e+00 5.37687e+01 251.249 -1.34945e+00 -3.97517e+00 0.00000e+00 0.00000e+00 6.86355e+01 251.249 1.48668e+01 251.249 0.8707 
1 1 1 0   87  14 o 12 2.96376e+00 9.68804e-01 3.30104e+01 265.141 -2.10403e-01 -2.47497e+00 0.00000e+00 0.00000e+00 5.06026e+01 265.141 1.75923e+01 265.141 0.7632 
1 1 1 0   87  15 o 17 5.41391e+00 1.38286e+00 6.38445e+01 177.539 -6.39743e+00 2.74932e-01  0.00000e+00 0.00000e+00 1.19741e+02 177.539 5.58965e+01 177.539 0.9182 
1 1 1 0   88  0  o 12 1.10609e+01 6.00413e-01 1.86174e+02 58.968  6.27661e+00  1.04329e+01  0.00000e+00 0.00000e+00 2.07767e+02 58.968  2.15927e+01 58.968  0.9580 
1 1 1 0   88  1  o 9  8.05941e+00 4.71670e-01 1.63959e+02 37.113  1.23336e+01  9.33235e+00  0.00000e+00 0.00000e+00 1.25800e+02 37.113  3.81591e+01 217.113 0.9671 
1 1 1 0   88  2  o 7  1.31266e+01 4.50076e-01 2.02719e+02 67.922  1.23593e+01  3.04712e+01  0.00000e+00 0.00000e+00 2.77747e+02 67.922  7.50284e+01 67.922  0.9847 
1 1 1 0   88  3  o 8  1.05616e+01 4.92436e-01 1.88784e+02 257.218 -5.98446e+00 -2.63784e+01 0.00000e+00 0.00000e+00 1.96428e+02 257.218 7.64387e+00 257.218 0.9813 
1 1 1 0   88  4  o 17 7.61868e+00 5.53604e-01 9.19173e+01 183.843 -9.63768e+00 -6.47442e-01 0.00000e+00 0.00000e+00 1.76100e+02 183.843 8.41830e+01 183.843 0.9467 
1 1 1 0   88  5  o 1  7.28859e+00 5.86816e-01 1.00288e+02 254.122 -2.81032e+00 -9.88010e+00 0.00000e+00 0.00000e+00 1.56933e+02 254.122 5.66446e+01 254.122 0.9500 
1 1 1 0   88  6  o 13 1.09993e+01 5.95624e-01 1.64566e+02 214.601 -2.25683e+01 -1.55694e+01 0.00000e+00 0.00000e+00 2.36381e+02 214.601 7.18143e+01 214.601 0.9816 
1 1 1 0   88  7  o 7  8.66904e+00 7.23549e-01 2.20822e+02 325.651 2.44808e+01  -1.67302e+01 0.00000e+00 0.00000e+00 9.55075e+01 325.651 1.25315e+02 145.651 0.9830 
1 1 1 0   88  8  o 15 8.77904e+00 8.15217e-01 1.25502e+02 249.285 -6.31346e+00 -1.66953e+01 0.00000e+00 0.00000e+00 1.90975e+02 249.285 6.54738e+01 249.285 0.9716 
1 1 1 0   88  9  o 13 1.20888e+01 8.07693e-01 2.11973e+02 112.339 -1.66821e+01 4.05956e+01  0.00000e+00 0.00000e+00 2.31199e+02 112.339 1.92260e+01 112.339 0.9885 
1 1 1 0   88  10 f 0  7.60294e+00 8.04557e-01 8.72242e+01 125.131 -6.86667e+00 9.75904e+00  0.00000e+00 0.00000e+00 1.82486e+02 125.131 9.52621e+01 125.131 0.9571 
1 1 1 0   88  11 o 16 6.27011e+00 9.94496e-01 1.07320e+02 341.165 1.09627e+01  -3.73957e+00 0.00000e+00 0.00000e+00 1.14657e+02 341.165 7.33704e+00 341.165 0.9558 
1 1 1 0   88  12 o 5  9.23513e+00 9.04821e-01 1.21136e+02 48.298  1.52046e+01  1.70642e+01  0.00000e+00 0.00000e+00 2.13124e+02 48.298  9.19889e+01 48.298  0.9779 
1 1 1 0   88  13 o 19 5.06657e+00 1.15802e+00 6.60594e+01 186.272 -6.08380e+00 -6.68620e-01 0.00000e+00 0.00000e+00 1.05249e+02 186.272 3.91895e+01 186.272 0.9142 
1 1 1 0   88  14 f 0  4.58241e+00 1.21745e+00 1.11704e+02 88.295  3.02415e-01  1.01616e+01  0.00000e+00 0.00000e+00 4.90795e+01 88.295  6.26247e+01 268.295 0.9495 
1 1 1 0   89  1  o 3  1.12410e+01 4.32469e-01 2.20870e+02 300.691 1.66428e+01  -2.80397e+01 0.00000e+00 0.00000e+00 1.90461e+02 300.691 3.04086e+01 120.691 0.9845 
1 1 1 0   89  2  o 15 6.79382e+00 5.20593e-01 1.61077e+02 328.164 1.25031e+01  -7.76323e+00 0.00000e+00 0.00000e+00 8.26670e+01 328.164 7.84104e+01 148.164 0.9654 
1 1 1 0   89  3  o 7  2.08125e+01 5.19235e-01 3.15914e+02 211.620 -7.06849e+01 -4.35195e+01 0.00000e+00 0.00000e+00 4.52753e+02 211.620 1.36839e+02 211.620 0.9940 
1 1 1 0   89  4  o 18 6.99316e+00 5.88221e-01 1.82940e+02 4.365   1.78283e+01  1.36073e+00  0.00000e+00 0.00000e+00 6.94795e+01 4.365   1.13460e+02 184.365 0.9716 
1 1 1 0   89  5  o 13 4.95192e+00 7.38365e-01 7.43698e+01 40.983  3.65003e+00  3.17099e+00  0.00000e+00 0.00000e+00 8.92026e+01 40.983  1.48328e+01 40.983  0.8894 
1 1 1 0   89  6  o 10 6.93308e+00 7.21819e-01 1.27497e+02 193.430 -1.36127e+01 -3.25057e+00 0.00000e+00 0.00000e+00 1.20533e+02 193.430 6.96427e+00 13.430  0.9636 
1 1 1 0   89  7  o 13 3.38291e+00 8.59417e-01 3.47108e+01 322.030 1.34543e+00  -1.05005e+00 0.00000e+00 0.00000e+00 4.60448e+01 322.030 1.13340e+01 322.030 0.6432 
1 1 1 0   89  8  o 1  6.03778e+00 9.59692e-01 6.80312e+01 348.538 6.16623e+00  -1.25027e+00 0.00000e+00 0.00000e+00 1.37276e+02 348.538 6.92449e+01 348.538 0.9167 
1 1 1 0   89  9  o 17 3.20046e+00 9.81396e-01 3.38607e+01 97.336  -2.20787e-01 1.71502e+00  0.00000e+00 0.00000e+00 4.30183e+01 97.336  9.15761e+00 97.336  0.6479 
1 1 1 0   89  10 o 13 5.47212e+00 1.21151e+00 2.55292e+01 190.158 -1.86691e+00 -3.34498e-01 0.00000e+00 0.00000e+00 1.12361e+02 190.158 8.68316e+01 190.158 0.6800 
1 1 1 0   89  11 o 17 6.89549e+00 9.46567e-01 1.23117e+02 125.433 -9.04325e+00 1.27095e+01  0.00000e+00 0.00000e+00 1.23901e+02 125.433 7.83478e-01 125.433 0.9674 
1 1 1 0   89  12 o 17 4.94032e+00 9.19777e-01 6.33900e+01 180.934 -6.25820e+00 -1.02063e-01 0.00000e+00 0.00000e+00 1.04105e+02 180.934 4.07151e+01 180.934 0.9162 
1 1 1 0   89  13 o 17 4.52263e+00 1.13497e+00 4.66019e+01 15.313  3.99407e+00  1.09363e+00  0.00000e+00 0.00000e+00 9.86764e+01 15.313  5.20745e+01 15.313  0.8687 
1 1 1 0   89  14 o 9  5.18079e+00 1.28782e+00 6.94811e+01 136.270 -5.25248e+00 5.02458e+00  0.00000e+00 0.00000e+00 1.08225e+02 136.270 3.87443e+01 136.270 0.9284 
1 1 1 0   90  0  o 11 1.71579e+01 6.20008e-01 3.42021e+02 29.080  3.51385e+01  1.95422e+01  0.00000e+00 0.00000e+00 2.87563e+02 29.080  5.44580e+01 209.080 0.9875 
1 1 1 0   90  1  o 12 8.04548e+00 4.74066e-01 1.25381e+02 355.183 1.28500e+01  -1.08287e+00 0.00000e+00 0.00000e+00 1.61732e+02 355.183 3.63508e+01 355.183 0.9604 
1 1 1 0   90  2  o 2  5.37383e+00 5.81559e-01 1.25858e+02 278.356 1.34551e+00  -9.16051e+00 0.00000e+00 0.00000e+00 6.26895e+01 278.356 6.31682e+01 98.356  0.9443 
1 1 1 0   90  3  o 3  6.66599e+00 5.32155e-01 1.64321e+02 169.785 -1.53340e+01 2.76312e+00  0.00000e+00 0.00000e+00 7.52253e+01 169.785 8.90961e+01 349.785 0.9674 
1 1 1 0   90  4  o 7  1.09467e+01 5.10501e-01 1.86665e+02 47.228  2.07317e+01  2.24102e+01  0.00000e+00 0.00000e+00 2.13183e+02 47.228  2.65175e+01 47.228  0.9835 
1 1 1 0   90  5  o 10 1.17732e+01 6.74783e-01 2.80218e+02 322.893 3.78489e+01  -2.86320e+01 0.00000e+00 0.00000e+00 1.52292e+02 322.893 1.27926e+02 142.893 0.9894 
1 1 1 0   90  6  o 8  1.22857e+01 5.28621e-01 2.21947e+02 189.221 -4.48983e+01 -7.28923e+00 0.00000e+00 0.00000e+00 2.29027e+02 189.221 7.07917e+00 189.221 0.9889 
1 1 1 0   90  7  o 2  5.23413e+00 7.69228e-01 9.52765e+01 291.822 2.72888e+00  -6.81501e+00 0.00000e+00 0.00000e+00 8.51668e+01 291.822 1.01096e+01 111.822 0.9292 
1 1 1 0   90  8  o 4  4.90264e+00 1.03179e+00 4.74306e+01 215.114 -2.83711e+00 -1.99501e+00 0.00000e+00 0.00000e+00 1.05194e+02 215.114 5.77631e+01 215.114 0.8394 
1 1 1 0   90  9  o 13 7.67020e+00 1.01070e+00 1.17568e+02 122.299 -7.60574e+00 1.20314e+01  0.00000e+00 0.00000e+00 1.56564e+02 122.299 3.89965e+01 122.299 0.9642 
1 1 1 0   90  10 f 0  1.11214e+01 9.48174e-01 1.81617e+02 53.760  2.03047e+01  2.77019e+01  0.00000e+00 0.00000e+00 2.24335e+02 53.760  4.27185e+01 53.760  0.9853 
1 1 1 0   90  11 o 7  1.34919e+01 9.37201e-01 2.32664e+02 245.814 -2.42674e+01 -5.40325e+01 0.00000e+00 0.00000e+00 2.62590e+02 245.814 2.99260e+01 245.814 0.9915 
1 1 1 0   90  12 o 3  6.65714e+00 1.14375e+00 1.35529e+02 7.236   1.60093e+01  2.03268e+00  0.00000e+00 0.00000e+00 1.02997e+02 7.236   3.25318e+01 187.236 0.9685 
1 1 1 0   90  13 o 5  3.18703e+00 9.91613e-01 7.76230e+01 140.579 -4.27401e+00 3.51331e+00  0.00000e+00 0.00000e+00 2.89325e+01 140.579 4.86905e+01 320.579 0.9044 
1 1 1 0   90  14 o 13 7.09178e+00 1.34625e+00 1.18609e+02 2.915   1.61186e+01  8.20806e-01  0.00000e+00 0.00000e+00 1.35088e+02 2.915   1.64792e+01 2.915   0.9685 
1 1 1 0   91  1  o 7  1.12660e+01 4.35498e-01 1.37556e+02 337.602 1.94466e+01  -8.01444e+00 0.00000e+00 0.00000e+00 2.70880e+02 337.602 1.33324e+02 337.602 0.9759 
1 1 1 0   91  2  o 6  1.09636e+01 4.49528e-01 1.97988e+02 210.675 -2.71184e+01 -1.60857e+01 0.00000e+00 0.00000e+00 2.02740e+02 210.675 4.75194e+00 210.675 0.9840 
1 1 1 0   91  3  o 18 7.79323e+00 5.03217e-01 1.39780e+02 288.552 5.19290e+00  -1.54735e+01 0.00000e+00 0.00000e+00 1.40641e+02 288.552 8.61175e-01 288.552 0.9689 
1 1 1 0   91  4  o 6  1.05041e+01 4.85544e-01 2.23864e+02 285.124 9.04393e+00  -3.34620e+01 0.00000e+00 0.00000e+00 1.60495e+02 285.124 6.33694e+01 105.124 0.9855 
1 1 1 0   91  5  o 16 8.60026e+00 7.19969e-01 1.28467e+02 145.214 -1.43745e+01 9.98518e+00  0.00000e+00 0.00000e+00 1.81524e+02 145.214 5.30566e+01 145.214 0.9710 
1 1 1 0   91  6  o 18 3.45804e+00 7.75536e-01 6.02415e+01 68.393  1.15916e+00  2.92659e+00  0.00000e+00 0.00000e+00 4.50270e+01 68.393  1.52144e+01 248.393 0.8203 
1 1 1 0   91  7  o 9  1.18409e+01 5.62608e-01 1.71039e+02 174.344 -3.34360e+01 3.31118e+00  0.00000e+00 0.00000e+00 2.61596e+02 174.344 9.05571e+01 174.344 0.9850 
1 1 1 0   91  8  o 10 5.29138e+00 1.01094e+00 5.71728e+01 275.115 4.13446e-01  -4.61847e+00 0.00000e+00 0.00000e+00 1.16300e+02 275.115 5.91270e+01 275.115 0.8842 
1 1 1 0   91  9  o 7  4.05833e+00 1.07336e+00 7.53962e+01 108.381 -1.48811e+00 4.47830e+00  0.00000e+00 0.00000e+00 5.79154e+01 108.381 1.74809e+01 288.381 0.8864 
1 1 1 0   91  10 o 1  8.21684e+00 1.10655e+00 1.26176e+02 280.058 2.86299e+00  -1.61414e+01 0.00000e+00 0.00000e+00 1.68709e+02 280.058 4.25336e+01 280.058 0.9690 
1 1 1 0   91  11 o 8  4.55245e+00 1.16933e+00 6.97319e+01 311.760 3.59252e+00  -4.02370e+00 0.00000e+00 0.00000e+00 8.22154e+01 311.760 1.24835e+01 311.760 0.9018 
1 1 1 0   91  12 f 0  4.49365e+00 1.12464e+00 9.81572e+01 182.993 -8.61069e+00 -4.50222e-01 0.00000e+00 0.00000e+00 5.80880e+01 182.993 4.00692e+01 2.993   0.9401 
1 1 1 0   91  13 o 16 4.88797e+00 1.20603e+00 7.55649e+01 156.962 -7.10549e+00 3.02165e+00  0.00000e+00 0.00000e+00 9.29440e+01 156.962 1.73791e+01 156.962 0.9328 
1 1 1 0   91  14 o 7  8.26988e+00 1.28226e+00 1.30894e+02 45.877  1.50567e+01  1.55251e+01  0.00000e+00 0.00000e+00 1.67345e+02 45.877  3.64512e+01 45.877  0.9766 
1 1 1 0   92  0  o 19 2.23726e+01 6.72641e-01 4.02451e+02 1.609   6.53322e+01  1.83542e+00  0.00000e+00 0.00000e+00 4.22086e+02 1.609   1.96348e+01 1.609   0.9923 
1 1 1 0   92  1  o 2  7.37138e+00 4.87104e-01 1.35828e+02 205.692 -1.30515e+01 -6.27908e+00 0.00000e+00 0.00000e+00 1.28310e+02 205.692 7.51841e+00 25.692  0.9648 
1 1 1 0   92  2  o 8  1.05983e+01 4.63572e-01 1.90521e+02 247.935 -1.14810e+01 -2.83236e+01 0.00000e+00 0.00000e+00 1.96557e+02 247.935 6.03591e+00 247.935 0.9835 
1 1 1 0   92  3  o 2  7.76800e+00 5.18000e-01 1.09063e+02 120.298 -6.25102e+00 1.06983e+01  0.00000e+00 0.00000e+00 1.67465e+02 120.298 5.84027e+01 120.298 0.9588 
1 1 1 0   92  4  o 8  4.19146e+00 7.05652e-01 6.36611e+01 185.504 -3.71102e+00 -3.57596e-01 0.00000e+00 0.00000e+00 6.89352e+01 185.504 5.27413e+00 185.504 0.8522 
1 1 1 0   92  5  f 0  1.38511e+01 7.50530e-01 1.80620e+02 171.432 -3.79163e+01 5.71241e+00  0.00000e+00 0.00000e+00 3.26667e+02 171.432 1.46047e+02 171.432 0.9869 
1 1 1 0   92  6  o 1  7.56388e+00 6.28456e-01 1.78808e+02 68.005  8.48499e+00  2.10066e+01  0.00000e+00 0.00000e+00 9.55401e+01 68.005  8.32682e+01 248.005 0.9777 
1 1 1 0   92  7  o 5  5.26570e+00 7.83580e-01 8.80806e+01 97.608  -9.66613e-01 7.23629e+00  0.00000e+00 0.00000e+00 9.32798e+01 97.608  5.19926e+00 97.608  0.9287 
1 1 1 0   92  8  o 2  8.03141e+00 7.31919e-01 1.55765e+02 100.140 -4.22592e+00 2.36287e+01  0.00000e+00 0.00000e+00 1.35670e+02 100.140 2.00949e+01 280.140 0.9789 
1 1 1 0   92  9  o 18 6.17789e+00 1.13981e+00 1.13706e+02 147.444 -9.04836e+00 5.77689e+00  0.00000e+00 0.00000e+00 1.04237e+02 147.444 9.46890e+00 327.444 0.9522 
1 1 1 0   92  10 f 0  4.32665e+00 1.20953e+00 4.45881e+01 256.807 -6.83206e-01 -2.91442e+00 0.00000e+00 0.00000e+00 8.50947e+01 256.807 4.05066e+01 256.807 0.8095 
1 1 1 0   92  11 o 6  1.02263e+01 1.11128e+00 1.56825e+02 149.641 -2.44318e+01 1.43104e+01  0.00000e+00 0.00000e+00 2.14835e+02 149.641 5.80100e+01 149.641 0.9822 
1 1 1 0   92  12 o 13 5.04291e+00 1.27804e+00 6.42470e+01 289.465 1.91852e+00  -5.42823e+00 0.00000e+00 0.00000e+00 1.05146e+02 289.465 4.08991e+01 289.465 0.9084 
1 1 1 0   92  13 o 14 3.10233e+00 1.00173e+00 3.73983e+01 231.188 -1.71946e+00 -2.13765e+00 0.00000e+00 0.00000e+00 5.30500e+01 231.188 1.56517e+01 231.188 0.7891 
1 1 1 0   92  14 o 15 2.78768e+00 9.35276e-01 2.83415e+01 327.548 1.91559e+00  -1.21811e+00 0.00000e+00 0.00000e+00 4.75589e+01 327.548 1.92175e+01 327.548 0.7375 
1 1 1 0   93  1  o 5  7.96530e+00 4.87066e-01 1.74232e+02 215.101 -1.61288e+01 -1.13361e+01 0.00000e+00 0.00000e+00 1.13913e+02 215.101 6.03192e+01 35.101  0.9743 
1 1 1 0   93  2  o 19 1.58369e+01 4.43175e-01 2.13658e+02 73.061  1.46934e+01  4.82445e+01  0.00000e+00 0.00000e+00 3.68444e+02 73.061  1.54786e+02 73.061  0.9900 
1 1 1 0   93  3  o 16 9.00766e+00 4.83244e-01 1.61562e+02 206.194 -1.99460e+01 -9.81222e+00 0.00000e+00 0.00000e+00 1.65195e+02 206.194 3.63308e+00 206.194 0.9772 
1 1 1 0   93  4  o 6  6.10973e+00 5.89090e-01 6.56197e+01 288.323 2.04631e+00  -6.17900e+00 0.00000e+00 0.00000e+00 1.42898e+02 288.323 7.72780e+01 288.323 0.9196 
1 1 1 0   93  5  o 19 7.56530e+00 6.44324e-01 1.56901e+02 165.151 -1.82818e+01 4.84701e+00  0.00000e+00 0.00000e+00 1.16264e+02 165.151 4.06375e+01 345.151 0.9732 
1 1 1 0   93  6  o 9  5.08152e+00 7.67196e-01 1.10471e+02 76.818  2.12114e+00  9.05606e+00  0.00000e+00 0.00000e+00 6.75616e+01 76.818  4.29092e+01 256.818 0.9446 
1 1 1 0   93  7  o 18 5.76827e+00 7.98438e-01 8.83607e+01 254.423 -2.30515e+00 -8.26865e+00 0.00000e+00 0.00000e+00 1.12625e+02 254.423 2.42648e+01 254.423 0.9398 
1 1 1 0   93  8  o 1  3.28608e+00 7.81874e-01 3.53682e+01 18.589  1.97516e+00  6.64305e-01  0.00000e+00 0.00000e+00 5.12239e+01 18.589  1.58557e+01 18.589  0.7111 
1 1 1 0   93  9  o 19 3.03841e+00 9.08845e-01 8.13294e+01 86.063  2.89900e-01  4.21248e+00  0.00000e+00 0.00000e+00 1.67552e+01 86.063  6.45743e+01 266.063 0.8716 
1 1 1 0   93  10 o 4  3.49451e+00 1.07548e+00 3.80190e+01 219.118 -1.77365e+00 -1.44233e+00 0.00000e+00 0.00000e+00 5.76513e+01 219.118 1.96323e+01 219.118 0.7396 
1 1 1 0   93  11 o 10 3.75734e+00 1.11249e+00 4.94504e+01 24.838  2.94363e+00  1.36252e+00  0.00000e+00 0.00000e+00 6.54310e+01 24.838  1.59807e+01 24.838  0.8265 
1 1 1 0   93  12 o 4  6.75951e+00 1.41659e+00 5.39846e+01 60.269  2.82280e+00  4.94267e+00  0.00000e+00 0.00000e+00 1.72731e+02 60.269  1.18746e+02 60.269  0.9073 
1 1 1 0   93  13 o 15 3.16638e+00 1.04247e+00 2.52862e+01 305.079 1.14799e+00  -1.63472e+00 0.00000e+00 0.00000e+00 5.62811e+01 305.079 3.09949e+01 305.079 0.6974 
1 1 1 0   93  14 o 19 9.13675e+00 1.29046e+00 1.79976e+02 12.261  3.19739e+01  6.94875e+00  0.00000e+00 0.00000e+00 1.52057e+02 12.261  2.79197e+01 192.261 0.9846 
1 1 1 0   94  0  o 16 3.26680e+00 7.81766e-01 6.81145e+01 194.852 -1.65293e+00 -4.38342e-01 0.00000e+00 0.00000e+00 9.97400e+00 194.852 5.81405e+01 14.852  0.6439 
1 1 1 0   94  1  o 5  5.97425e+00 5.65679e-01 9.71047e+01 299.199 4.32923e+00  -7.74663e+00 0.00000e+00 0.00000e+00 1.11763e+02 299.199 1.46580e+01 299.199 0.9418 
1 1 1 0   94  2  o 13 6.53886e+00 5.66711e-01 1.69492e+02 94.036  -1.16186e+00 1.64659e+01  0.00000e+00 0.00000e+00 6.57373e+01 94.036  1.03754e+02 274.036 0.9692 
1 1 1 0   94  3  o 18 9.76283e+00 4.96496e-01 1.55608e+02 267.494 -1.14271e+00 -2.61071e+01 0.00000e+00 0.00000e+00 1.99698e+02 267.494 4.40900e+01 267.494 0.9807 
1 1 1 0   94  4  o 18 8.63907e+00 5.23136e-01 1.30613e+02 359.265 1.86677e+01  -2.39350e-01 0.00000e+00 0.00000e+00 1.81214e+02 359.265 5.06011e+01 359.265 0.9728 
1 1 1 0   94  5  o 16 1.27107e+01 5.37885e-01 2.67527e+02 74.054  1.61687e+01  5.65887e+01  0.00000e+00 0.00000e+00 1.99924e+02 74.054  6.76033e+01 254.054 0.9915 
1 1 1 0   94  6  o 14 2.42974e+00 7.36017e-01 5.34280e+01 69.553  7.77833e-01  2.08634e+00  0.00000e+00 0.00000e+00 1.24938e+01 69.553  4.09341e+01 249.553 0.7317 
1 1 1 0   94  7  o 5  9.47467e+00 7.15202e-01 1.54007e+02 323.352 1.97619e+01  -1.47023e+01 0.00000e+00 0.00000e+00 1.89971e+02 323.352 3.59636e+01 323.352 0.9795 
1 1 1 0   94  8  o 17 4.76565e+00 7.72265e-01 5.96846e+01 12.151  5.09529e+00  1.09706e+00  0.00000e+00 0.00000e+00 9.88802e+01 12.151  3.91956e+01 12.151  0.8981 
1 1 1 0   94  9  o 14 8.25764e+00 8.55308e-01 1.06647e+02 84.480  1.54123e+00  1.59475e+01  0.00000e+00 0.00000e+00 1.89425e+02 84.480  8.27781e+01 84.480  0.9683 
1 1 1 0   94  10 o 2  1.11011e+01 8.41482e-01 1.65437e+02 274.221 2.70664e+00  -3.66723e+01 0.00000e+00 0.00000e+00 2.39764e+02 274.221 7.43273e+01 274.221 0.9863 
1 1 1 0   94  11 o 17 8.40854e+00 1.17709e+00 1.45461e+02 185.038 -2.12455e+01 -1.87284e+00 0.00000e+00 0.00000e+00 1.58140e+02 185.038 1.26789e+01 185.038 0.9763 
1 1 1 0   94  12 o 17 5.85820e+00 1.44443e+00 1.01463e+02 70.818  2.95578e+00  8.49625e+00  0.00000e+00 0.00000e+00 1.02631e+02 70.818  1.16816e+00 70.818  0.9427 
1 1 1 0   94  13 o 8  4.58256e+00 1.39411e+00 8.24390e+01 209.170 -6.01757e+00 -3.35901e+00 0.00000e+00 0.00000e+00 7.39832e+01 209.170 8.45582e+00 29.170  0.9243 
1 1 1 0   95  1  o 12 1.43282e+01 4.53208e-01 2.81974e+02 106.692 -2.02468e+01 6.75183e+01  0.00000e+00 0.00000e+00 2.45965e+02 106.692 3.60095e+01 286.692 0.9929 
1 1 1 0   95  2  o 11 4.29072e+00 7.02323e-01 9.67858e+01 238.991 -3.32678e+00 -5.53472e+00 0.00000e+00 0.00000e+00 4.95217e+01 238.991 4.72641e+01 58.991  0.9189 
1 1 1 0   95  3  f 0  6.94146e+00 5.55993e-01 1.00068e+02 231.174 -7.13269e+00 -8.86305e+00 0.00000e+00 0.00000e+00 1.45875e+02 231.174 4.58069e+01 231.174 0.9550 
1 1 1 0   95  4  o 7  9.79673e+00 4.98309e-01 1.48984e+02 8.896   2.41588e+01  3.78164e+00  0.00000e+00 0.00000e+00 2.06899e+02 8.896   5.79151e+01 8.896   0.9793 
1 1 1 0   95  5  o 14 9.29935e+00 5.39942e-01 2.11130e+02 80.845  5.22430e+00  3.24165e+01  0.00000e+00 0.00000e+00 1.28426e+02 80.845  8.27039e+01 260.845 0.9847 
1 1 1 0   95  6  o 13 7.13693e+00 6.08186e-01 1.15516e+02 214.373 -1.25165e+01 -8.56156e+00 0.00000e+00 0.00000e+00 1.40176e+02 214.373 2.46594e+01 214.373 0.9664 
1 1 1 0   95  7  o 15 9.78533e+00 7.47863e-01 1.37509e+02 51.706  1.48811e+01  1.88471e+01  0.00000e+00 0.00000e+00 2.17463e+02 51.706  7.99542e+01 51.706  0.9790 
1 1 1 0   95  8  o 18 6.42991e+00 8.89991e-01 1.68859e+02 293.959 7.86290e+00  -1.76941e+01 0.00000e+00 0.00000e+00 6.30638e+01 293.959 1.05795e+02 113.959 0.9738 
1 1 1 0   95  9  o 15 3.48906e+00 9.30645e-01 5.72679e+01 147.599 -3.16225e+00 2.00691e+00  0.00000e+00 0.00000e+00 5.29040e+01 147.599 4.36397e+00 327.599 0.8530 
1 1 1 0   95  10 o 2  7.65122e+00 9.72831e-01 1.34999e+02 79.750  3.56617e+00  1.97209e+01  0.00000e+00 0.00000e+00 1.40926e+02 79.750  5.92634e+00 79.750  0.9747 
1 1 1 0   95  11 o 15 3.97386e+00 1.05297e+00 2.66808e+01 292.674 8.76437e-01  -2.09789e+00 0.00000e+00 0.00000e+00 8.17484e+01 292.674 5.50676e+01 292.674 0.7380 
1 1 1 0   95  12 o 16 4.09209e+00 1.19059e+00 7.20409e+01 307.878 3.50605e+00  -4.50731e+00 0.00000e+00 0.00000e+00 6.51863e+01 307.878 6.85465e+00 127.878 0.9076 
1 1 1 0   95  13 o 14 3.39540e+00 1.12420e+00 3.31628e+01 120.829 -1.37306e+00 2.30071e+00  0.00000e+00 0.00000e+00 6.50145e+01 120.829 3.18517e+01 120.829 0.7832 
1 1 1 0   96  0  o 1  2.42984e+01 7.04096e-01 3.62153e+02 132.109 -4.93015e+01 5.45449e+01  0.00000e+00 0.00000e+00 5.33205e+02 132.109 1.71051e+02 132.109 0.9932 
1 1 1 0   96  1  f 0  1.53748e+01 4.93467e-01 1.98425e+02 268.974 -9.21277e-01 -5.14274e+01 0.00000e+00 0.00000e+00 3.66417e+02 268.974 1.67992e+02 268.974 0.9902 
1 1 1 0   96  2  o 2  4.86721e+00 6.39514e-01 8.09491e+01 208.110 -5.52002e+00 -2.94860e+00 0.00000e+00 0.00000e+00 8.44783e+01 208.110 3.52920e+00 208.110 0.9162 
1 1 1 0   96  3  o 7  4.64722e+00 6.85314e-01 7.39938e+01 126.201 -3.18666e+00 4.35386e+00  0.00000e+00 0.00000e+00 8.14535e+01 126.201 7.45963e+00 126.201 0.9018 
1 1 1 0   96  4  o 7  1.23740e+01 4.81480e-01 1.96524e+02 336.859 3.64223e+01  -1.55663e+01 0.00000e+00 0.00000e+00 2.56519e+02 336.859 5.99952e+01 336.859 0.9873 
1 1 1 0   96  5  o 15 7.92211e+00 6.21583e-01 1.20067e+02 146.810 -1.34216e+01 8.77949e+00  0.00000e+00 0.00000e+00 1.64323e+02 146.810 4.42554e+01 146.810 0.9683 
1 1 1 0   96  6  o 13 1.14156e+01 5.39085e-01 2.31470e+02 20.751  4.48465e+01  1.69915e+01  0.00000e+00 0.00000e+00 1.87167e+02 20.751  4.43036e+01 200.751 0.9895 
1 1 1 0   96  7  o 19 6.77601e+00 8.49480e-01 1.53901e+02 188.649 -1.65657e+01 -2.51974e+00 0.00000e+00 0.00000e+00 8.95138e+01 188.649 6.43877e+01 8.649   0.9697 
1 1 1 0   96  8  o 1  6.42702e+00 8.93644e-01 1.44883e+02 188.049 -1.58787e+01 -2.24534e+00 0.00000e+00 0.00000e+00 8.55609e+01 188.049 5.93217e+01 8.049   0.9683 
1 1 1 0   96  9  o 15 3.46549e+00 9.72992e-01 1.80964e+01 293.605 4.63395e-01  -1.06042e+00 0.00000e+00 0.00000e+00 4.59476e+01 293.605 2.78513e+01 293.605 0.4993 
1 1 1 0   96  10 o 9  3.74761e+00 1.03890e+00 6.83398e+01 186.059 -4.64657e+00 -4.93244e-01 0.00000e+00 0.00000e+00 5.43643e+01 186.059 1.39755e+01 6.059   0.8852 
1 1 1 0   96  11 o 9  3.78380e+00 1.06290e+00 8.15324e+01 87.047  3.13340e-01  6.07371e+00  0.00000e+00 0.00000e+00 4.62519e+01 87.047  3.52805e+01 267.047 0.9136 
1 1 1 0   96  12 f 0  4.77283e+00 1.32938e+00 9.69216e+01 14.116  8.20252e+00  2.06272e+00  0.00000e+00 0.00000e+00 6.86046e+01 14.116  2.83169e+01 194.116 0.9389 
1 1 1 0   96  13 o 10 4.46499e+00 1.36544e+00 5.93356e+01 351.659 5.08506e+00  -7.45502e-01 0.00000e+00 0.00000e+00 8.84156e+01 351.659 2.90800e+01 351.659 0.8965 
1 1 1 0   97  1  o 8  3.28459e+00 7.18220e-01 4.19978e+01 55.026  1.22327e+00  1.74869e+00  0.00000e+00 0.00000e+00 4.55486e+01 55.026  3.55077e+00 55.026  0.7186 
1 1 1 0   97  2  o 4  9.01849e+00 5.07184e-01 1.54264e+02 133.096 -1.58768e+01 1.69688e+01  0.00000e+00 0.00000e+00 1.72930e+02 133.096 1.86658e+01 133.096 0.9782 
1 1 1 0   97  3  o 13 6.47221e+00 6.07702e-01 8.29742e+01 31.286  7.18227e+00  4.36442e+00  0.00000e+00 0.00000e+00 1.42259e+02 31.286  5.92851e+01 31.286  0.9385 
1 1 1 0   97  4  o 8  7.12546e+00 5.75485e-01 1.38495e+02 10.150  1.78819e+01  3.20132e+00  0.00000e+00 0.00000e+00 1.18296e+02 10.150  2.01990e+01 190.150 0.9721 
1 1 1 0   97  5  f 0  2.78698e+00 7.45696e-01 6.66435e+01 136.924 -2.34411e+00 2.19176e+00  0.00000e+00 0.00000e+00 1.85061e+01 136.924 4.81374e+01 316.924 0.8243 
1 1 1 0   97  6  o 4  8.62348e+00 5.84093e-01 1.20360e+02 274.912 1.82906e+00  -2.12838e+01 0.00000e+00 0.00000e+00 1.91578e+02 274.912 7.12181e+01 274.912 0.9763 
1 1 1 0   97  7  o 16 4.20364e+00 9.61431e-01 1.03169e+02 142.056 -5.55581e+00 4.33187e+00  0.00000e+00 0.00000e+00 4.10025e+01 142.056 6.21665e+01 322.056 0.9260 
1 1 1 0   97  8  o 18 1.32133e+01 6.20406e-01 1.96214e+02 69.743  1.88221e+01  5.10011e+01  0.00000e+00 0.00000e+00 2.88414e+02 69.743  9.21995e+01 69.743  0.9908 
1 1 1 0   97  9  o 12 5.03829e+00 1.02848e+00 6.84759e+01 335.859 5.58414e+00  -2.50273e+00 0.00000e+00 0.00000e+00 1.01942e+02 335.859 3.34662e+01 335.859 0.9142 
1 1 1 0   97  10 o 10 8.30237e+00 1.08231e+00 9.26326e+01 15.043  1.39149e+01  3.73976e+00  0.00000e+00 0.00000e+00 2.03525e+02 15.043  1.10892e+02 15.043  0.9646 
1 1 1 0   97  11 o 4  6.04467e+00 1.21447e+00 1.31361e+02 357.686 1.46080e+01  -5.90158e-01 0.00000e+00 0.00000e+00 8.42392e+01 357.686 4.71219e+01 177.687 0.9652 
1 1 1 0   97  12 o 3  4.08662e+00 1.11468e+00 6.42935e+01 152.667 -5.43591e+00 2.80969e+00  0.00000e+00 0.00000e+00 7.36686e+01 152.667 9.37508e+00 152.667 0.9142 
1 1 1 0   97  13 o 15 3.31855e+00 1.11961e+00 5.99160e+01 358.521 5.02895e+00  -1.29830e-01 0.00000e+00 0.00000e+00 4.95715e+01 358.521 1.03446e+01 178.521 0.8941 
1 1 1 0   98  0  o 8  8.61485e+00 7.17054e-01 1.20341e+02 218.202 -7.12646e+00 -5.60845e+00 0.00000e+00 0.00000e+00 1.80950e+02 218.202 6.06093e+01 218.202 0.9431 
1 1 1 0   98  1  o 18 7.84453e+00 5.24174e-01 7.37697e+01 14.048  9.75762e+00  2.44151e+00  0.00000e+00 0.00000e+00 2.02250e+02 14.048  1.28480e+02 14.048  0.9489 
1 1 1 0   98  2  o 4  5.96678e+00 6.36946e-01 3.51404e+01 315.282 2.30499e+00  -2.28240e+00 0.00000e+00 0.00000e+00 1.47711e+02 315.282 1.12570e+02 315.282 0.8265 
1 1 1 0   98  3  o 3  1.08620e+01 4.96239e-01 1.49597e+02 38.029  2.16582e+01  1.69387e+01  0.00000e+00 0.00000e+00 2.45684e+02 38.029  9.60866e+01 38.029  0.9816 
1 1 1 0   98  4  o 12 6.13453e+00 6.22453e-01 1.04100e+02 218.449 -9.17854e+00 -7.28757e+00 0.00000e+00 0.00000e+00 1.13341e+02 218.449 9.24140e+00 218.449 0.9563 
1 1 1 0   98  5  o 2  1.01642e+01 5.40937e-01 1.22405e+02 251.989 -6.96769e+00 -2.14309e+01 0.00000e+00 0.00000e+00 2.45763e+02 251.989 1.23359e+02 251.989 0.9776 
1 1 1 0   98  6  o 16 7.88103e+00 6.37742e-01 1.43910e+02 233.660 -1.29029e+01 -1.75394e+01 0.00000e+00 0.00000e+00 1.41228e+02 233.660 2.68226e+00 53.660  0.9768 
1 1 1 0   98  7  o 6  3.58969e+00 8.95090e-01 3.92889e+01 34.837  1.88415e+00  1.31132e+00  0.00000e+00 0.00000e+00 5.91742e+01 34.837  1.98853e+01 34.837  0.7408 
1 1 1 0   98  8  f 0  5.43038e+00 9.70670e-01 8.66693e+01 193.529 -8.34829e+00 -2.00870e+00 0.00000e+00 0.00000e+00 1.02213e+02 193.529 1.55437e+01 193.529 0.9398 
1 1 1 0   98  9  o 4  3.47397e+00 9.77366e-01 9.66847e+01 106.365 -1.84504e+00 6.28320e+00  0.00000e+00 0.00000e+00 2.15532e+01 106.365 7.51315e+01 286.365 0.9201 
1 1 1 0   98  10 o 14 3.75446e+00 1.05064e+00 6.88662e+01 206.189 -4.70646e+00 -2.31476e+00 0.00000e+00 0.00000e+00 5.58810e+01 206.189 1.29852e+01 26.189  0.8988 
1 1 1 0   98  11 o 4  7.67027e+00 1.03381e+00 9.73228e+01 323.866 1.27428e+01  -9.30382e+00 0.00000e+00 0.00000e+00 1.76923e+02 323.866 7.96003e+01 323.866 0.9678 
1 1 1 0   98  12 o 13 3.72578e+00 1.10148e+00 6.95779e+01 236.687 -3.44592e+00 -5.24341e+00 0.00000e+00 0.00000e+00 5.64781e+01 236.687 1.30999e+01 56.687  0.9164 
1 1 1 0   98  13 o 12 3.73125e+00 1.15542e+00 6.81698e+01 8.822   5.97255e+00  9.26920e-01  0.00000e+00 0.00000e+00 5.75093e+01 8.822   1.06605e+01 188.822 0.9130 
1 1 1 0   99  1  o 13 8.89256e+00 5.02906e-01 1.34468e+02 257.961 -4.21876e+00 -1.97808e+01 0.00000e+00 0.00000e+00 1.86930e+02 257.961 5.24614e+01 257.961 0.9750 
1 1 1 0   99  2  o 4  1.52290e+01 4.75197e-01 2.51422e+02 38.143  5.74769e+01  4.51377e+01  0.00000e+00 0.00000e+00 3.09202e+02 38.143  5.77798e+01 38.143  0.9931 
1 1 1 0   99  3  o 17 2.63623e+00 6.72845e-01 5.49592e+01 121.473 -1.35877e+00 2.21970e+00  0.00000e+00 0.00000e+00 2.08298e+01 121.473 3.41294e+01 301.472 0.7757 
1 1 1 0   99  4  o 14 9.05769e+00 5.23074e-01 1.66193e+02 285.340 7.74902e+00  -2.82489e+01 0.00000e+00 0.00000e+00 1.63649e+02 285.340 2.54408e+00 105.340 0.9828 
1 1 1 0   99  5  o 12 9.79575e+00 5.41953e-01 1.81764e+02 37.288  2.76977e+01  2.10909e+01  0.00000e+00 0.00000e+00 1.75856e+02 37.288  5.90795e+00 217.288 0.9855 
1 1 1 0   99  6  o 15 4.91016e+00 8.33954e-01 6.85609e+01 184.315 -5.85850e+00 -4.42083e-01 0.00000e+00 0.00000e+00 9.69713e+01 184.315 2.84104e+01 184.315 0.9104 
1 1 1 0   99  7  o 11 3.89780e+00 9.21685e-01 6.56981e+01 259.911 -7.85897e-01 -4.41698e+00 0.00000e+00 0.00000e+00 6.12602e+01 259.911 4.43788e+00 79.911  0.8799 
1 1 1 0   99  8  o 17 9.39038e+00 7.26339e-01 1.93133e+02 6.618   3.87445e+01  4.49512e+00  0.00000e+00 0.00000e+00 1.49823e+02 6.618   4.33099e+01 186.618 0.9871 
1 1 1 0   99  9  o 7  4.77283e+00 1.05091e+00 9.18699e+01 235.698 -4.47210e+00 -6.55542e+00 0.00000e+00 0.00000e+00 7.31030e+01 235.698 1.87669e+01 55.698  0.9347 
1 1 1 0   99  10 o 13 2.90087e+00 9.10250e-01 1.40852e+01 95.589  -9.62383e-02 9.83488e-01  0.00000e+00 0.00000e+00 3.33229e+01 95.589  1.92377e+01 95.589  0.4422 
1 1 1 0   99  11 o 19 4.01230e+00 1.10420e+00 7.12590e+01 263.450 -7.49949e-01 -6.53187e+00 0.00000e+00 0.00000e+00 6.51475e+01 263.450 6.11158e+00 83.450  0.9205 
1 1 1 0   99  12 o 13 2.89126e+00 9.34253e-01 3.53621e+01 274.094 2.09770e-01  -2.93059e+00 0.00000e+00 0.00000e+00 5.05748e+01 274.094 1.52127e+01 274.094 0.8053 
1 1 1 0   100 0  o 12 1.28318e+01 6.69768e-01 1.45871e+02 251.586 -5.25059e+00 -1.57708e+01 0.00000e+00 0.00000e+00 3.15163e+02 251.586 1.69293e+02 251.586 0.9694 
1 1 1 0   100 1  o 18 5.24325e+00 6.94107e-01 8.37716e+01 19.654  6.76712e+00  2.41691e+00  0.00000e+00 0.00000e+00 9.64684e+01 19.654  1.26967e+01 19.654  0.9276 
1 1 1 0   100 2  o 17 4.95464e+00 6.94494e-01 7.76797e+01 48.206  4.55816e+00  5.09911e+00  0.00000e+00 0.00000e+00 9.19153e+01 48.206  1.42355e+01 48.206  0.9237 
1 1 1 0   100 3  o 11 5.64964e+00 6.95967e-01 7.35946e+01 80.151  1.28683e+00  7.41200e+00  0.00000e+00 0.00000e+00 1.21278e+02 80.151  4.76837e+01 80.151  0.9309 
1 1 1 0   100 4  o 7  6.02535e+00 6.57415e-01 9.68524e+01 218.249 -9.12310e+00 -7.19186e+00 0.00000e+00 0.00000e+00 1.16514e+02 218.249 1.96620e+01 218.249 0.9559 
1 1 1 0   100 5  o 4  9.80914e+00 5.61656e-01 1.65672e+02 57.435  1.59715e+01  2.50073e+01  0.00000e+00 0.00000e+00 1.91419e+02 57.435  2.57470e+01 57.435  0.9830 
1 1 1 0   100 6  o 14 8.19315e+00 6.17246e-01 1.10876e+02 251.876 -5.26835e+00 -1.60961e+01 0.00000e+00 0.00000e+00 1.83348e+02 251.876 7.24719e+01 251.876 0.9700 
1 1 1 0   100 7  o 13 1.23956e+01 5.70959e-01 1.90842e+02 186.473 -5.13123e+01 -5.82211e+00 0.00000e+00 0.00000e+00 2.63411e+02 186.473 7.25687e+01 186.473 0.9903 
1 1 1 0   100 8  o 12 4.67807e+00 9.88635e-01 9.92321e+01 14.187  8.14007e+00  2.05773e+00  0.00000e+00 0.00000e+00 6.31493e+01 14.187  3.60829e+01 194.187 0.9384 
1 1 1 0   100 9  o 18 9.33978e+00 8.23109e-01 1.49712e+02 75.999  7.64787e+00  3.06708e+01  0.00000e+00 0.00000e+00 1.90075e+02 75.999  4.03629e+01 75.999  0.9841 
1 1 1 0   100 10 o 7  3.75531e+00 9.60478e-01 8.15965e+01 106.909 -2.04181e+00 6.71675e+00  0.00000e+00 0.00000e+00 4.68559e+01 106.909 3.47406e+01 286.909 0.9258 
1 1 1 0   100 11 f 0  3.17727e+00 9.72599e-01 4.90846e+01 281.318 7.42101e-01  -3.70780e+00 0.00000e+00 0.00000e+00 5.11724e+01 281.318 2.08778e+00 281.318 0.8546 
1 1 1 0   100 12 o 13 3.64881e+00 1.09461e+00 4.61786e+01 95.968  -4.46380e-01 4.27007e+00  0.00000e+00 0.00000e+00 7.14847e+01 95.968  2.53061e+01 95.968  0.8739 
1 1 1 0   101 1  o 13 7.34859e+00 5.76939e-01 1.72669e+02 202.532 -2.17844e+01 -9.03765e+00 0.00000e+00 0.00000e+00 9.37633e+01 202.532 7.89059e+01 22.532  0.9786 
1 1 1 0   101 2  o 6  8.03911e+00 5.57239e-01 1.44594e+02 280.359 3.77079e+00  -2.06279e+01 0.00000e+00 0.00000e+00 1.46040e+02 280.359 1.44618e+00 280.359 0.9759 
1 1 1 0   101 3  o 16 1.11373e+01 5.59124e-01 2.19424e+02 111.280 -1.75133e+01 4.49665e+01  0.00000e+00 0.00000e+00 1.88819e+02 111.280 3.06044e+01 291.280 0.9896 
1 1 1 0   101 4  o 10 9.24455e+00 5.35968e-01 1.27781e+02 228.270 -1.57785e+01 -1.76909e+01 0.00000e+00 0.00000e+00 2.07276e+02 228.270 7.94952e+01 228.270 0.9787 
1 1 1 0   101 5  o 12 5.51143e+00 7.36938e-01 8.27307e+01 206.767 -7.46311e+00 -3.76444e+00 0.00000e+00 0.00000e+00 1.08695e+02 206.767 2.59640e+01 206.767 0.9381 
1 1 1 0   101 6  f 0  3.23074e+00 8.58402e-01 3.10027e+01 54.795  1.05028e+00  1.48860e+00  0.00000e+00 0.00000e+00 4.86603e+01 54.795  1.76576e+01 54.795  0.6662 
1 1 1 0   101 7  o 11 7.29568e+00 7.34300e-01 1.31959e+02 87.425  9.03955e-01  2.01040e+01  0.00000e+00 0.00000e+00 1.31159e+02 87.425  7.99329e-01 267.425 0.9748 
1 1 1 0   101 8  o 3  2.83543e+00 8.69062e-01 2.96908e+01 256.987 -3.94508e-01 -1.70701e+00 0.00000e+00 0.00000e+00 3.87299e+01 256.987 9.03911e+00 256.987 0.6525 
1 1 1 0   101 9  o 10 2.65691e+00 8.49591e-01 1.37353e+01 131.724 -5.75092e-01 6.44923e-01  0.00000e+00 0.00000e+00 2.51684e+01 131.724 1.14331e+01 131.724 0.3962 
1 1 1 0   101 10 o 8  4.05164e+00 1.07377e+00 3.68674e+01 305.589 1.78149e+00  -2.48933e+00 0.00000e+00 0.00000e+00 8.50176e+01 305.589 4.81502e+01 305.589 0.8144 
1 1 1 0   101 11 o 6  2.77215e+00 8.98744e-01 4.12512e+01 285.763 8.88859e-01  -3.14894e+00 0.00000e+00 0.00000e+00 4.35056e+01 285.763 2.25442e+00 285.763 0.8282 
1 1 1 0   101 12 o 4  5.37095e+00 1.27797e+00 1.34042e+02 154.174 -1.39285e+01 6.74111e+00  0.00000e+00 0.00000e+00 5.75739e+01 154.174 7.64677e+01 334.174 0.9671 
1 1 1 0   102 0  o 7  2.29936e+01 7.19994e-01 2.77329e+02 254.956 -1.51522e+01 -5.63773e+01 0.00000e+00 0.00000e+00 5.67055e+02 254.956 2.89727e+02 254.956 0.9914 
1 1 1 0   102 1  o 18 7.71256e+00 5.58825e-01 1.11992e+02 33.919  1.41758e+01  9.53253e+00  0.00000e+00 0.00000e+00 1.65191e+02 33.919  5.31988e+01 33.919  0.9703 
1 1 1 0   102 2  o 7  9.65234e+00 5.26702e-01 1.10919e+02 125.115 -1.29929e+01 1.84767e+01  0.00000e+00 0.00000e+00 2.38567e+02 125.115 1.27648e+02 125.115 0.9776 
1 1 1 0   102 3  o 5  7.51828e+00 5.83199e-01 9.54946e+01 129.661 -9.02241e+00 1.08827e+01  0.00000e+00 0.00000e+00 1.72880e+02 129.661 7.73851e+01 129.661 0.9640 
1 1 1 0   102 4  o 12 6.75327e+00 6.45900e-01 1.08749e+02 311.012 9.38700e+00  -1.07937e+01 0.00000e+00 0.00000e+00 1.32374e+02 311.012 2.36242e+01 311.012 0.9644 
1 1 1 0   102 5  o 19 6.18518e+00 7.08245e-01 1.03757e+02 348.254 1.19665e+01  -2.48807e+00 0.00000e+00 0.00000e+00 1.15600e+02 348.254 1.18423e+01 348.254 0.9582 
1 1 1 0   102 6  o 1  6.29073e+00 7.48140e-01 7.28813e+01 55.043  5.24055e+00  7.49622e+00  0.00000e+00 0.00000e+00 1.46760e+02 55.043  7.38789e+01 55.043  0.9436 
1 1 1 0   102 7  o 18 6.62094e+00 8.64913e-01 8.43196e+01 278.468 1.62374e+00  -1.09059e+01 0.00000e+00 0.00000e+00 1.49178e+02 278.468 6.48587e+01 278.468 0.9535 
1 1 1 0   102 8  o 18 8.02888e+00 8.42782e-01 1.16112e+02 167.900 -1.89684e+01 4.06663e+00  0.00000e+00 0.00000e+00 1.72952e+02 167.900 5.68401e+01 167.900 0.9739 
1 1 1 0   102 9  o 10 3.38665e+00 9.63419e-01 2.49507e+01 199.815 -1.84057e+00 -6.63194e-01 0.00000e+00 0.00000e+00 6.14532e+01 199.815 3.65025e+01 199.815 0.6905 
1 1 1 0   102 10 o 1  4.17088e+00 1.08018e+00 7.38083e+01 10.441  6.44434e+00  1.18752e+00  0.00000e+00 0.00000e+00 6.79197e+01 10.441  5.88859e+00 190.441 0.9202 
1 1 1 0   102 11 o 4  3.93459e+00 1.06848e+00 2.63673e+01 161.368 -2.28940e+00 7.71908e-01  0.00000e+00 0.00000e+00 8.33410e+01 161.368 5.69736e+01 161.368 0.7555 
1 1 1 0   102 12 o 11 2.94711e+00 9.49454e-01 6.59376e+01 135.033 -4.03289e+00 4.02824e+00  0.00000e+00 0.00000e+00 3.26869e+01 135.033 3.32507e+01 315.033 0.9074 
1 1 1 0   103 1  o 8  4.76917e+00 7.49384e-01 1.31908e+02 106.901 -3.25543e+00 1.07144e+01  0.00000e+00 0.00000e+00 3.66131e+01 106.901 9.52948e+01 286.901 0.9542 
1 1 1 0   103 2  o 3  7.32452e+00 5.59733e-01 1.39093e+02 77.389  4.41687e+00  1.97426e+01  0.00000e+00 0.00000e+00 1.25317e+02 77.389  1.37764e+01 257.389 0.9750 
1 1 1 0   103 3  o 5  3.30646e+00 7.67946e-01 2.25763e+01 155.539 -1.24644e+00 5.67011e-01  0.00000e+00 0.00000e+00 4.62333e+01 155.539 2.36570e+01 155.539 0.5621 
1 1 1 0   103 4  o 2  3.98683e+00 8.37143e-01 4.57004e+01 103.289 -7.03642e-01 2.97909e+00  0.00000e+00 0.00000e+00 7.44751e+01 103.289 2.87747e+01 103.289 0.8144 
1 1 1 0   103 5  o 17 4.57819e+00 7.52076e-01 6.31756e+01 155.104 -5.05403e+00 2.34556e+00  0.00000e+00 0.00000e+00 9.01605e+01 155.104 2.69849e+01 155.104 0.9051 
1 1 1 0   103 6  o 6  3.34392e+00 8.70875e-01 1.12874e+02 144.990 -5.95744e+00 4.17297e+00  0.00000e+00 0.00000e+00 1.96937e+00 144.990 1.10905e+02 324.990 0.9285 
1 1 1 0   103 7  o 12 1.17691e+01 7.71297e-01 1.22201e+02 266.897 -1.74428e+00 -3.21816e+01 0.00000e+00 0.00000e+00 3.06159e+02 266.897 1.83958e+02 266.897 0.9844 
1 1 1 0   103 8  o 4  2.78234e+00 8.75348e-01 4.03070e+01 123.293 -1.34216e+00 2.04375e+00  0.00000e+00 0.00000e+00 3.77300e+01 123.293 2.57705e+00 303.293 0.7589 
1 1 1 0   103 9  o 4  3.15485e+00 9.02246e-01 4.28599e+01 169.848 -3.19548e+00 5.72202e-01  0.00000e+00 0.00000e+00 5.34781e+01 169.848 1.06182e+01 169.848 0.8267 
1 1 1 0   103 10 o 19 3.53716e+00 9.98035e-01 4.80740e+01 225.112 -2.96678e+00 -2.97837e+00 0.00000e+00 0.00000e+00 6.56554e+01 225.112 1.75814e+01 225.112 0.8709 
1 1 1 0   103 11 o 13 3.73827e+00 1.04393e+00 8.24046e+01 195.850 -7.36932e+00 -2.09228e+00 0.00000e+00 0.00000e+00 4.61705e+01 195.850 3.62341e+01 15.850  0.9322 
1 1 1 0   103 12 o 5  2.94152e+00 9.46470e-01 6.66845e+01 33.694  5.36390e+00  3.57653e+00  0.00000e+00 0.00000e+00 3.29570e+01 33.694  3.37275e+01 213.694 0.9188 
1 1 1 0   104 0  o 13 1.24360e+01 6.99117e-01 1.19951e+02 14.284  1.35079e+01  3.43912e+00  0.00000e+00 0.00000e+00 3.23600e+02 14.284  2.03649e+02 14.284  0.9634 
1 1 1 0   104 1  o 6  3.82070e+00 7.64184e-01 5.31285e+01 131.377 -2.46915e+00 2.80298e+00  0.00000e+00 0.00000e+00 6.74511e+01 131.377 1.43226e+01 131.377 0.8525 
1 1 1 0   104 2  o 11 5.86144e+00 6.80082e-01 1.42553e+02 176.179 -1.57302e+01 1.05056e+00  0.00000e+00 0.00000e+00 6.74144e+01 176.179 7.51389e+01 356.179 0.9677 
1 1 1 0   104 3  o 2  7.92708e+00 5.90426e-01 1.06592e+02 261.098 -2.46804e+00 -1.57563e+01 0.00000e+00 0.00000e+00 1.77438e+02 261.098 7.08452e+01 261.098 0.9681 
1 1 1 0   104 4  o 15 6.05543e+00 7.10930e-01 7.37126e+01 6.736   8.58574e+00  1.01407e+00  0.00000e+00 0.00000e+00 1.36964e+02 6.736   6.32518e+01 6.736   0.9403 
1 1 1 0   104 5  o 12 4.68101e+00 8.43425e-01 1.11537e+02 179.575 -1.03342e+01 7.67177e-02  0.00000e+00 0.00000e+00 5.30194e+01 179.575 5.85175e+01 359.575 0.9503 
1 1 1 0   104 6  o 1  4.18958e+00 9.11510e-01 1.15279e+02 304.662 5.26557e+00  -7.61526e+00 0.00000e+00 0.00000e+00 3.10271e+01 304.662 8.42520e+01 124.662 0.9443 
1 1 1 0   104 7  o 8  3.82443e+00 9.80479e-01 6.64792e+01 192.557 -4.71649e+00 -1.05058e+00 0.00000e+00 0.00000e+00 5.92463e+01 192.557 7.23289e+00 12.557  0.8893 
1 1 1 0   104 8  o 8  6.94555e+00 8.97941e-01 1.34411e+02 101.763 -4.45857e+00 2.14112e+01  0.00000e+00 0.00000e+00 1.16275e+02 101.763 1.81360e+01 281.763 0.9769 
1 1 1 0   104 9  o 11 2.55918e+00 8.29582e-01 3.01000e+01 315.996 1.37730e+00  -1.33024e+00 0.00000e+00 0.00000e+00 3.44746e+01 315.996 4.37458e+00 315.996 0.6833 
1 1 1 0   104 10 o 4  3.72766e+00 9.32807e-01 4.46562e+01 36.957  3.68769e+00  2.77451e+00  0.00000e+00 0.00000e+00 7.69095e+01 36.957  3.22533e+01 36.957  0.8836 
1 1 1 0   104 11 o 5  3.39557e+00 9.78444e-01 4.85880e+01 183.960 -4.53293e+00 -3.13815e-01 0.00000e+00 0.00000e+00 6.18252e+01 183.960 1.32372e+01 183.960 0.8816 
1 1 1 0   105 1  o 18 7.28204e+00 6.43946e-01 1.07542e+02 163.057 -1.52529e+01 4.64676e+00  0.00000e+00 0.00000e+00 1.53364e+02 163.057 4.58222e+01 163.057 0.9681 
1 1 1 0   105 2  o 13 8.14221e+00 5.76375e-01 1.11251e+02 294.840 7.21130e+00  -1.55783e+01 0.00000e+00 0.00000e+00 1.81141e+02 294.840 6.98896e+01 294.840 0.9704 
1 1 1 0   105 3  o 18 7.86460e+00 5.85405e-01 1.22967e+02 346.912 1.93810e+01  -4.50575e+00 0.00000e+00 0.00000e+00 1.60611e+02 346.912 3.76436e+01 346.912 0.9745 
1 1 1 0   105 4  o 10 1.02306e+01 5.62598e-01 1.68034e+02 142.836 -3.00312e+01 2.27655e+01  0.00000e+00 0.00000e+00 2.05357e+02 142.836 3.73233e+01 142.836 0.9866 
1 1 1 0   105 5  o 6  4.80467e+00 8.52323e-01 1.03296e+02 79.994  1.71885e+00  9.74166e+00  0.00000e+00 0.00000e+00 6.51520e+01 79.994  3.81440e+01 259.993 0.9480 
1 1 1 0   105 6  o 9  3.27728e+00 9.03968e-01 6.01801e+01 357.255 4.04183e+00  -1.93772e-01 0.00000e+00 0.00000e+00 4.46559e+01 357.255 1.55242e+01 177.255 0.8653 
1 1 1 0   105 7  o 1  1.10374e+01 7.06783e-01 1.59956e+02 196.601 -4.13006e+01 -1.23134e+01 0.00000e+00 0.00000e+00 2.43165e+02 196.601 8.32095e+01 196.601 0.9883 
1 1 1 0   105 8  o 1  3.47037e+00 9.53652e-01 3.41957e+01 181.000 -2.54273e+00 -4.43975e-02 0.00000e+00 0.00000e+00 6.44574e+01 181.000 3.02617e+01 181.000 0.7696 
1 1 1 0   105 9  o 15 5.58899e+00 1.05624e+00 9.18570e+01 250.954 -3.63784e+00 -1.05374e+01 0.00000e+00 0.00000e+00 1.04994e+02 250.954 1.31373e+01 250.954 0.9540 
1 1 1 0   105 10 o 8  3.04204e+00 9.40907e-01 5.96925e+01 61.719  2.43869e+00  4.53273e+00  0.00000e+00 0.00000e+00 4.09528e+01 61.719  1.87397e+01 241.719 0.8967 
1 1 1 0   105 11 o 14 2.60496e+00 8.38207e-01 4.40238e+01 81.366  5.29805e-01  3.48932e+00  0.00000e+00 0.00000e+00 3.69123e+01 81.366  7.11145e+00 261.366 0.8426 
1 1 1 0   106 0  o 4  2.57265e+00 7.97186e-01 1.83352e+01 356.089 4.78489e-01  -3.27087e-02 0.00000e+00 0.00000e+00 3.85843e+00 356.089 1.44768e+01 176.089 0.2332 
1 1 1 0   106 1  o 9  5.92974e+00 7.08234e-01 7.71138e+01 91.133  -1.75626e-01 8.88062e+00  0.00000e+00 0.00000e+00 1.29528e+02 91.133  5.24144e+01 91.133  0.9419 
1 1 1 0   106 2  o 17 8.50549e+00 5.82320e-01 9.64780e+01 323.598 1.38567e+01  -1.02169e+01 0.00000e+00 0.00000e+00 2.08899e+02 323.598 1.12421e+02 323.598 0.9705 
1 1 1 0   106 3  o 11 7.49538e+00 6.07141e-01 1.37944e+02 56.841  1.21437e+01  1.85867e+01  0.00000e+00 0.00000e+00 1.32984e+02 56.841  4.96034e+00 236.841 0.9772 
1 1 1 0   106 4  o 14 5.23125e+00 7.66865e-01 1.06370e+02 290.328 3.96621e+00  -1.07059e+01 0.00000e+00 0.00000e+00 7.84097e+01 290.328 2.79602e+01 110.328 0.9551 
1 1 1 0   106 5  o 17 8.35110e+00 6.32893e-01 1.08052e+02 105.892 -5.53597e+00 1.94442e+01  0.00000e+00 0.00000e+00 1.92959e+02 105.892 8.49071e+01 105.892 0.9749 
1 1 1 0   106 6  o 1  3.81915e+00 9.75914e-01 8.61399e+01 185.989 -6.23642e+00 -6.54293e-01 0.00000e+00 0.00000e+00 4.32050e+01 185.989 4.29348e+01 5.989   0.9164 
1 1 1 0   106 7  o 5  2.81181e+00 8.50160e-01 3.94371e+01 169.994 -2.65761e+00 4.68881e-01  0.00000e+00 0.00000e+00 4.21057e+01 169.994 2.66862e+00 169.994 0.7850 
1 1 1 0   106 8  o 15 4.70572e+00 1.03529e+00 7.15577e+01 141.456 -5.61695e+00 4.47498e+00  0.00000e+00 0.00000e+00 8.96122e+01 141.456 1.80545e+01 141.456 0.9275 
1 1 1 0   106 9  o 8  4.94670e+00 1.06344e+00 3.72580e+01 357.463 4.12526e+00  -1.82761e-01 0.00000e+00 0.00000e+00 1.21271e+02 357.463 8.40130e+01 357.463 0.8683 
1 1 1 0   106 10 o 17 6.29330e+00 1.07749e+00 1.33279e+02 93.975  -1.40113e+00 2.01633e+01  0.00000e+00 0.00000e+00 9.30392e+01 93.975  4.02395e+01 273.975 0.9749 
1 1 1 0   106 11 o 1  3.18902e+00 9.81325e-01 4.70454e+01 196.525 -4.37875e+00 -1.29915e+00 0.00000e+00 0.00000e+00 5.66710e+01 196.525 9.62559e+00 196.525 0.8823 
1 1 1 0   107 1  o 5  1.01265e+01 5.39823e-01 1.70416e+02 113.898 -1.51813e+01 3.42622e+01  0.00000e+00 0.00000e+00 1.99102e+02 113.898 2.86866e+01 113.898 0.9866 
1 1 1 0   107 2  o 17 3.83142e+00 8.08935e-01 6.24013e+01 297.865 2.15191e+00  -4.07029e+00 0.00000e+00 0.00000e+00 6.27643e+01 297.865 3.62949e-01 297.865 0.8833 
1 1 1 0   107 3  o 2  6.43909e+00 6.81391e-01 7.55945e+01 317.684 7.75042e+00  -7.05625e+00 0.00000e+00 0.00000e+00 1.50850e+02 317.684 7.52555e+01 317.684 0.9510 
1 1 1 0   107 4  o 19 6.99447e+00 6.65386e-01 1.07188e+02 120.243 -8.39228e+00 1.43947e+01  0.00000e+00 0.00000e+00 1.43515e+02 120.243 3.63267e+01 120.243 0.9695 
1 1 1 0   107 5  f 0  5.19591e+00 8.42006e-01 1.21893e+01 88.075  4.50530e-02  1.34057e+00  0.00000e+00 0.00000e+00 9.42765e+01 88.075  8.20872e+01 88.075  0.5544 
1 1 1 0   107 6  o 15 5.33675e+00 9.58738e-01 1.15319e+02 222.355 -9.33206e+00 -8.50792e+00 0.00000e+00 0.00000e+00 7.38844e+01 222.355 4.14351e+01 42.355  0.9596 
1 1 1 0   107 7  o 1  4.01944e+00 9.58388e-01 7.41137e+01 279.067 1.09063e+00  -6.83444e+00 0.00000e+00 0.00000e+00 6.31481e+01 279.067 1.09655e+01 99.067  0.9246 
1 1 1 0   107 8  o 7  3.37850e+00 9.48826e-01 4.71585e+01 97.103  -4.55919e-01 3.65898e+00  0.00000e+00 0.00000e+00 5.88938e+01 97.103  1.17353e+01 97.103  0.8503 
1 1 1 0   107 9  o 7  8.64095e+00 8.46436e-01 1.22393e+02 106.871 -9.22941e+00 3.04337e+01  0.00000e+00 0.00000e+00 1.91377e+02 106.871 6.89834e+01 106.871 0.9842 
1 1 1 0   107 10 o 1  8.20667e+00 1.02031e+00 1.33960e+02 262.517 -3.93548e+00 -2.99624e+01 0.00000e+00 0.00000e+00 1.63614e+02 262.517 2.96542e+01 262.517 0.9833 
1 1 1 0   108 0  f 0  2.05499e+01 7.38512e-01 2.40045e+02 65.158  2.43887e+01  5.26796e+01  0.00000e+00 0.00000e+00 5.13262e+02 65.158  2.73217e+02 65.158  0.9913 
1 1 1 0   108 1  o 7  6.60963e+00 6.79680e-01 9.18546e+01 243.885 -5.76596e+00 -1.17618e+01 0.00000e+00 0.00000e+00 1.43022e+02 243.885 5.11672e+01 243.885 0.9610 
1 1 1 0   108 2  o 13 5.05181e+00 7.54797e-01 9.75843e+01 215.178 -8.52846e+00 -6.01132e+00 0.00000e+00 0.00000e+00 8.00057e+01 215.178 1.75786e+01 35.178  0.9508 
1 1 1 0   108 3  o 18 4.23479e+00 8.68380e-01 5.47498e+01 283.721 1.08381e+00  -4.43882e+00 0.00000e+00 0.00000e+00 8.33774e+01 283.721 2.86276e+01 283.721 0.8823 
1 1 1 0   108 4  o 8  7.93617e+00 6.50542e-01 8.45347e+01 246.484 -6.45484e+00 -1.48340e+01 0.00000e+00 0.00000e+00 1.99565e+02 246.484 1.15030e+02 246.484 0.9686 
1 1 1 0   108 5  o 11 5.17480e+00 7.69404e-01 7.89621e+01 264.926 -7.97332e-01 -8.98028e+00 0.00000e+00 0.00000e+00 1.01304e+02 264.926 2.23415e+01 264.926 0.9428 
1 1 1 0   108 6  o 9  4.40796e+00 9.35878e-01 7.10587e+01 27.846  6.30365e+00  3.33000e+00  0.00000e+00 0.00000e+00 7.98624e+01 27.846  8.80368e+00 27.846  0.9269 
1 1 1 0   108 7  o 15 5.94027e+00 9.75485e-01 7.06654e+01 117.063 -4.28039e+00 8.37788e+00  0.00000e+00 0.00000e+00 1.36655e+02 117.063 6.59892e+01 117.063 0.9453 
1 1 1 0   108 8  o 16 2.80555e+00 8.65752e-01 2.79999e+01 131.194 -1.48459e+00 1.69617e+00  0.00000e+00 0.00000e+00 4.81414e+01 131.194 2.01415e+01 131.194 0.7354 
1 1 1 0   108 9  o 5  2.74250e+00 8.67147e-01 1.15537e+01 310.615 5.77034e-01  -6.72887e-01 0.00000e+00 0.00000e+00 2.93859e+01 310.615 1.78322e+01 310.615 0.4047 
1 1 1 0   108 10 f 0  2.80875e+00 9.00514e-01 1.02065e+02 342.647 7.93794e+00  -2.48052e+00 0.00000e+00 0.00000e+00 4.96209e+00 162.646 1.07027e+02 162.646 0.9378 
1 1 1 0   109 1  o 11 7.28358e+00 6.35335e-01 1.10936e+02 318.855 1.45739e+01  -1.27338e+01 0.00000e+00 0.00000e+00 1.51251e+02 318.855 4.03149e+01 318.855 0.9738 
1 1 1 0   109 2  o 12 1.17356e+01 5.31497e-01 2.41332e+02 70.788  2.21342e+01  6.35170e+01  0.00000e+00 0.00000e+00 1.89201e+02 70.788  5.21312e+01 250.788 0.9925 
1 1 1 0   109 3  o 5  2.94871e+00 7.90424e-01 7.44535e+01 299.630 2.40184e+00  -4.22279e+00 0.00000e+00 0.00000e+00 2.25306e+01 299.630 5.19228e+01 119.630 0.8900 
1 1 1 0   109 4  o 2  4.94758e+00 8.05136e-01 6.93264e+01 132.616 -4.95575e+00 5.38628e+00  0.00000e+00 0.00000e+00 1.00487e+02 132.616 3.11601e+01 132.616 0.9289 
1 1 1 0   109 5  o 11 3.32871e+00 7.89646e-01 4.08128e+01 259.915 -5.49655e-01 -3.09040e+00 0.00000e+00 0.00000e+00 5.99806e+01 259.915 1.91677e+01 259.915 0.8198 
1 1 1 0   109 6  o 16 2.93110e+00 8.61667e-01 8.56447e+01 18.145  5.99193e+00  1.96371e+00  0.00000e+00 0.00000e+00 1.35894e+01 18.145  7.20553e+01 198.145 0.9169 
1 1 1 0   109 7  o 2  3.56288e+00 9.28643e-01 5.47681e+01 163.805 -4.30751e+00 1.25106e+00  0.00000e+00 0.00000e+00 6.09476e+01 163.805 6.17954e+00 163.805 0.8799 
1 1 1 0   109 8  o 8  8.83051e+00 8.09528e-01 1.13264e+02 260.826 -4.54880e+00 -2.81667e+01 0.00000e+00 0.00000e+00 2.06768e+02 260.826 9.35042e+01 260.826 0.9823 
1 1 1 0   109 9  o 7  2.70867e+00 8.45427e-01 2.83882e+01 83.711  2.52967e-01  2.29528e+00  0.00000e+00 0.00000e+00 4.57789e+01 83.711  1.73907e+01 83.711  0.7425 
1 1 1 0   109 10 o 2  1.98976e+00 6.91165e-01 1.82745e+01 175.242 -1.48272e+00 1.23416e-01  0.00000e+00 0.00000e+00 2.52184e+01 175.242 6.94397e+00 175.242 0.5931 
1 1 1 0   110 0  o 9  1.16932e+01 7.41654e-01 1.35830e+02 342.748 1.78786e+01  -5.55199e+00 0.00000e+00 0.00000e+00 2.84590e+02 342.748 1.48760e+02 342.748 0.9729 
1 1 1 0   110 1  o 13 6.11309e+00 7.08507e-01 1.11516e+02 130.133 -1.02458e+01 1.21528e+01  0.00000e+00 0.00000e+00 1.07162e+02 130.133 4.35435e+00 310.133 0.9680 
1 1 1 0   110 2  o 1  8.74720e+00 6.01489e-01 1.35608e+02 170.267 -2.86605e+01 4.91606e+00  0.00000e+00 0.00000e+00 1.82000e+02 170.267 4.63918e+01 170.267 0.9827 
1 1 1 0   110 3  o 7  5.60291e+00 7.51224e-01 9.53290e+01 335.115 1.06936e+01  -4.96036e+00 0.00000e+00 0.00000e+00 1.02686e+02 335.115 7.35690e+00 335.115 0.9566 
1 1 1 0   110 4  o 10 3.61037e+00 8.65221e-01 6.79072e+01 204.441 -4.89405e+00 -2.22427e+00 0.00000e+00 0.00000e+00 5.23038e+01 204.441 1.56034e+01 24.441  0.9014 
1 1 1 0   110 5  o 13 3.66776e+00 9.12035e-01 3.18174e+01 206.566 -2.51195e+00 -1.25601e+00 0.00000e+00 0.00000e+00 7.58248e+01 206.566 4.40074e+01 206.566 0.7948 
1 1 1 0   110 6  o 15 4.33064e+00 8.63573e-01 1.12157e+02 15.621  1.14520e+01  3.20206e+00  0.00000e+00 0.00000e+00 4.08293e+01 15.621  7.13281e+01 195.621 0.9570 
1 1 1 0   110 7  o 6  4.47028e+00 9.82836e-01 5.43590e+01 150.718 -5.45980e+00 3.06162e+00  0.00000e+00 0.00000e+00 9.67729e+01 150.718 4.24138e+01 150.718 0.9162 
1 1 1 0   110 8  o 8  2.89683e+00 9.12667e-01 4.34132e+01 171.628 -3.42079e+00 5.03448e-01  0.00000e+00 0.00000e+00 4.62136e+01 171.628 2.80042e+00 171.628 0.8389 
1 1 1 0   110 9  o 14 3.12301e+00 9.57079e-01 9.15069e+01 214.961 -6.58649e+00 -4.60529e+00 0.00000e+00 0.00000e+00 1.61987e+01 214.961 7.53082e+01 34.961  0.9355 
1 1 1 0   110 10 o 5  3.97459e+00 1.08976e+00 8.53693e+01 309.285 5.86925e+00  -7.17474e+00 0.00000e+00 0.00000e+00 5.29245e+01 309.285 3.24448e+01 129.285 0.9444 
1 1 1 0   111 1  o 15 4.25166e+00 8.31325e-01 3.88771e+01 258.382 -7.13140e-01 -3.46870e+00 0.00000e+00 0.00000e+00 9.35674e+01 258.382 5.46903e+01 258.382 0.8432 
1 1 1 0   111 2  o 8  6.66670e+00 6.79049e-01 1.27134e+02 329.327 1.69932e+01  -1.00791e+01 0.00000e+00 0.00000e+00 1.12814e+02 329.327 1.43199e+01 149.327 0.9744 
1 1 1 0   111 3  o 17 4.60293e+00 8.55029e-01 9.54626e+01 47.190  6.59425e+00  7.11871e+00  0.00000e+00 0.00000e+00 6.55275e+01 47.190  2.99351e+01 227.190 0.9470 
1 1 1 0   111 4  o 14 4.25740e+00 9.02144e-01 4.46918e+01 347.126 4.33225e+00  -9.90107e-01 0.00000e+00 0.00000e+00 9.34412e+01 347.126 4.87494e+01 347.126 0.8787 
1 1 1 0   111 5  o 17 4.14374e+00 8.47087e-01 3.80962e+01 35.862  2.96179e+00  2.14097e+00  0.00000e+00 0.00000e+00 9.17422e+01 35.862  5.36460e+01 35.862  0.8488 
1 1 1 0   111 6  o 2  3.52942e+00 9.26696e-01 7.74449e+01 222.636 -4.73910e+00 -4.36337e+00 0.00000e+00 0.00000e+00 4.22161e+01 222.636 3.52288e+01 42.636  0.9187 
1 1 1 0   111 7  f 0  5.49568e+00 9.76929e-01 7.50045e+01 26.438  8.90788e+00  4.42933e+00  0.00000e+00 0.00000e+00 1.17248e+02 26.438  4.22436e+01 26.438  0.9483 
1 1 1 0   111 8  o 3  4.52308e+00 1.08421e+00 9.19427e+01 234.406 -5.99581e+00 -8.37670e+00 0.00000e+00 0.00000e+00 6.65174e+01 234.406 2.54253e+01 54.406  0.9501 
1 1 1 0   111 9  o 10 3.45671e+00 9.84035e-01 4.69040e+01 242.314 -2.01344e+00 -3.83728e+00 0.00000e+00 0.00000e+00 6.45898e+01 242.314 1.76858e+01 242.314 0.8752 
1 1 1 0   112 0  o 12 7.30609e+00 9.62768e-01 1.02753e+02 344.393 8.97667e+00  -2.50750e+00 0.00000e+00 0.00000e+00 1.52166e+02 344.393 4.94131e+01 344.393 0.9447 
1 1 1 0   112 1  o 15 3.89313e+00 8.29095e-01 6.48542e+01 162.622 -5.42169e+00 1.69678e+00  0.00000e+00 0.00000e+00 6.55678e+01 162.622 7.13609e-01 162.622 0.9071 
1 1 1 0   112 2  o 1  6.76877e+00 7.12562e-01 1.01370e+02 126.738 -9.97525e+00 1.33644e+01  0.00000e+00 0.00000e+00 1.40974e+02 126.738 3.96043e+01 126.738 0.9695 
1 1 1 0   112 3  o 19 3.91432e+00 8.87101e-01 3.88915e+01 166.142 -3.49245e+00 8.61547e-01  0.00000e+00 0.00000e+00 8.33811e+01 166.142 4.44896e+01 166.142 0.8460 
1 1 1 0   112 4  f 0  3.59042e+00 8.67941e-01 4.64271e+01 290.376 1.32555e+00  -3.56882e+00 0.00000e+00 0.00000e+00 6.69824e+01 290.376 2.05553e+01 290.376 0.8557 
1 1 1 0   112 5  o 11 8.18580e+00 7.35238e-01 1.38781e+02 128.777 -1.97712e+01 2.46106e+01  0.00000e+00 0.00000e+00 1.58488e+02 128.777 1.97076e+01 128.777 0.9840 
1 1 1 0   112 6  o 18 9.29128e+00 6.69290e-01 1.61327e+02 269.160 -7.50097e-01 -5.11801e+01 0.00000e+00 0.00000e+00 1.78083e+02 269.160 1.67557e+01 269.160 0.9902 
1 1 1 0   112 7  f 0  4.12571e+00 1.01152e+00 9.66519e+01 92.293  -4.00362e-01 9.99671e+00  0.00000e+00 0.00000e+00 4.76771e+01 92.293  4.89748e+01 272.293 0.9486 
1 1 1 0   112 8  o 3  3.33413e+00 9.80929e-01 2.61666e+01 258.480 -4.99292e-01 -2.44974e+00 0.00000e+00 0.00000e+00 6.78511e+01 258.480 4.16845e+01 258.480 0.7650 
1 1 1 0   112 9  o 12 2.48261e+00 8.05778e-01 5.47082e+01 79.087  9.49223e-01  4.92327e+00  0.00000e+00 0.00000e+00 2.70326e+01 79.087  2.76756e+01 259.087 0.8937 
1 1 1 0   113 1  o 18 8.36757e+00 6.13327e-01 1.20534e+02 108.631 -9.28258e+00 2.75340e+01  0.00000e+00 0.00000e+00 1.83034e+02 108.631 6.25003e+01 108.631 0.9826 
1 1 1 0   113 2  o 14 4.80815e+00 7.00888e-01 5.88594e+01 231.303 -5.01639e+00 -6.26211e+00 0.00000e+00 0.00000e+00 1.07181e+02 231.303 4.83219e+01 231.303 0.9354 
1 1 1 0   113 3  o 19 2.98909e+00 8.22471e-01 5.37994e+01 295.081 1.60879e+00  -3.43741e+00 0.00000e+00 0.00000e+00 4.05511e+01 295.081 1.32482e+01 115.081 0.8552 
1 1 1 0   113 4  o 1  3.92303e+00 8.81983e-01 4.47816e+01 3.979   4.22514e+00  2.93910e-01  0.00000e+00 0.00000e+00 8.14598e+01 3.979   3.66782e+01 3.979   0.8720 
1 1 1 0   113 5  o 19 4.58729e+00 9.44479e-01 7.52328e+01 145.879 -6.81870e+00 4.62016e+00  0.00000e+00 0.00000e+00 8.33731e+01 145.879 8.14028e+00 145.879 0.9372 
1 1 1 0   113 6  f 0  3.10438e+00 8.65861e-01 3.59345e+01 128.278 -1.87789e+00 2.37974e+00  0.00000e+00 0.00000e+00 5.70650e+01 128.278 2.11305e+01 128.278 0.8123 
1 1 1 0   113 7  o 9  2.16678e+00 7.11322e-01 4.75914e+01 346.536 3.58034e+00  -8.57193e-01 0.00000e+00 0.00000e+00 2.03113e+01 346.536 2.72801e+01 166.536 0.8501 
1 1 1 0   113 8  o 6  2.37308e+00 8.06131e-01 3.63714e+01 73.343  8.70904e-01  2.91077e+00  0.00000e+00 0.00000e+00 3.47024e+01 73.343  1.66908e+00 253.343 0.8128 
1 1 1 0   113 9  o 10 2.83995e+00 8.72472e-01 2.62511e+01 151.931 -2.21491e+00 1.18110e+00  0.00000e+00 0.00000e+00 5.38791e+01 151.931 2.76281e+01 151.931 0.7661 
1 1 1 0   114 0  o 5  8.40228e+00 8.94911e-01 1.29134e+02 199.578 -1.52670e+01 -5.42971e+00 0.00000e+00 0.00000e+00 1.71265e+02 199.578 4.21314e+01 199.578 0.9686 
1 1 1 0   114 1  o 1  4.68337e+00 8.41561e-01 9.47939e+01 76.605  2.62438e+00  1.10203e+01  0.00000e+00 0.00000e+00 7.02478e+01 76.605  2.45461e+01 256.605 0.9548 
1 1 1 0   114 2  o 9  4.55190e+00 8.17094e-01 5.12617e+01 203.550 -5.49701e+00 -2.39589e+00 0.00000e+00 0.00000e+00 1.01995e+02 203.550 5.07337e+01 203.550 0.9123 
1 1 1 0   114 3  o 15 2.09763e+00 6.80913e-01 7.63151e+01 12.061  4.38658e+00  9.37307e-01  0.00000e+00 0.00000e+00 8.20866e+00 192.061 8.45238e+01 192.061 0.8799 
1 1 1 0   114 4  o 5  3.07056e+00 8.48384e-01 4.21395e+01 136.860 -2.36574e+00 2.21690e+00  0.00000e+00 0.00000e+00 5.14744e+01 136.860 9.33491e+00 136.860 0.8264 
1 1 1 0   114 5  f 0  7.98866e+00 7.29210e-01 1.05350e+02 198.448 -2.50300e+01 -8.34957e+00 0.00000e+00 0.00000e+00 1.83646e+02 198.448 7.82957e+01 198.448 0.9809 
1 1 1 0   114 6  o 6  3.05548e+00 8.63103e-01 4.29592e+01 60.584  1.97417e+00  3.50128e+00  0.00000e+00 0.00000e+00 5.44032e+01 60.584  1.14440e+01 60.584  0.8643 
1 1 1 0   114 7  o 10 6.53873e+00 9.62143e-01 1.27374e+02 141.531 -1.77065e+01 1.40685e+01  0.00000e+00 0.00000e+00 1.08218e+02 141.531 1.91559e+01 321.532 0.9776 
1 1 1 0   114 8  o 11 3.18718e+00 9.62665e-01 6.49168e+01 29.999  5.47987e+00  3.16363e+00  0.00000e+00 0.00000e+00 4.27662e+01 29.999  2.21505e+01 209.999 0.9172 
1 1 1 0   115 1  o 8  4.55535e+00 8.82544e-01 9.41061e+01 10.291  1.01688e+01  1.84630e+00  0.00000e+00 0.00000e+00 6.56219e+01 10.291  2.84842e+01 190.291 0.9503 
1 1 1 0   115 2  o 10 2.97099e+00 7.23373e-01 5.83982e+01 190.582 -4.77910e+00 -8.92810e-01 0.00000e+00 0.00000e+00 3.91637e+01 190.582 1.92345e+01 10.582  0.8901 
1 1 1 0   115 3  o 8  9.65008e+00 6.10227e-01 1.37314e+02 222.998 -2.89206e+01 -2.69666e+01 0.00000e+00 0.00000e+00 2.14129e+02 222.998 7.68152e+01 222.998 0.9873 
1 1 1 0   115 4  o 1  7.89083e+00 6.82299e-01 1.24193e+02 63.074  1.44868e+01  2.85226e+01  0.00000e+00 0.00000e+00 1.62236e+02 63.074  3.80428e+01 63.074  0.9842 
1 1 1 0   115 5  f 0  6.21324e+00 8.48064e-01 6.78203e+01 158.534 -1.17728e+01 4.62937e+00  0.00000e+00 0.00000e+00 1.52012e+02 158.534 8.41921e+01 158.534 0.9596 
1 1 1 0   115 6  o 4  5.19303e+00 9.54763e-01 9.04183e+01 223.542 -9.58383e+00 -9.10797e+00 0.00000e+00 0.00000e+00 9.35975e+01 223.542 3.17927e+00 223.542 0.9614 
1 1 1 0   115 7  o 2  3.64815e+00 9.81774e-01 6.38744e+01 64.267  2.95980e+00  6.14086e+00  0.00000e+00 0.00000e+00 6.02427e+01 64.267  3.63168e+00 244.267 0.9234 
1 1 1 0   115 8  o 13 3.05230e+00 8.99334e-01 2.98207e+01 353.425 3.05298e+00  -3.51911e-01 0.00000e+00 0.00000e+00 6.18176e+01 353.425 3.19969e+01 353.425 0.8153 
1 1 1 0   116 0  o 8  4.00006e+00 9.95230e-01 3.91374e+01 59.253  1.08862e+00  1.83003e+00  0.00000e+00 0.00000e+00 6.67892e+01 59.253  2.76518e+01 59.253  0.7179 
1 1 1 0   116 1  o 12 3.84510e+00 8.39990e-01 6.58899e+01 298.330 3.03345e+00  -5.62656e+00 0.00000e+00 0.00000e+00 6.43155e+01 298.330 1.57444e+00 118.330 0.9181 
1 1 1 0   116 2  o 18 3.59576e+00 8.76047e-01 5.59904e+01 71.576  1.60581e+00  4.82037e+00  0.00000e+00 0.00000e+00 6.27332e+01 71.576  6.74278e+00 71.576  0.8952 
1 1 1 0   116 3  o 14 5.64792e+00 8.65754e-01 1.00250e+02 206.662 -1.41034e+01 -7.08150e+00 0.00000e+00 0.00000e+00 1.01314e+02 206.662 1.06345e+00 206.662 0.9678 
1 1 1 0   116 4  o 5  6.96788e+00 7.57388e-01 1.26311e+02 63.762  1.15830e+01  2.35005e+01  0.00000e+00 0.00000e+00 1.25633e+02 63.762  6.77954e-01 243.762 0.9807 
1 1 1 0   116 5  o 2  5.44851e+00 8.90053e-01 7.71401e+01 355.011 1.14696e+01  -1.00115e+00 0.00000e+00 0.00000e+00 1.14753e+02 355.011 3.76131e+01 355.011 0.9555 
1 1 1 0   116 6  o 18 4.69143e+00 9.61539e-01 5.31445e+01 123.419 -4.01323e+00 6.08191e+00  0.00000e+00 0.00000e+00 1.07374e+02 123.419 5.42293e+01 123.419 0.9286 
1 1 1 0   116 7  o 7  3.33690e+00 9.39638e-01 7.75283e+01 48.279  5.39986e+00  6.05627e+00  0.00000e+00 0.00000e+00 3.75309e+01 48.279  3.99974e+01 228.279 0.9362 
1 1 1 0   116 8  o 9  3.50182e+00 9.95934e-01 7.43468e+01 326.768 6.66546e+00  -4.36713e+00 0.00000e+00 0.00000e+00 4.61874e+01 326.768 2.81594e+01 146.768 0.9350 
1 1 1 0   117 1  o 19 1.84275e+00 6.01665e-01 4.17294e+01 238.839 -1.38552e+00 -2.29129e+00 0.00000e+00 0.00000e+00 1.14753e+01 238.839 3.02540e+01 58.839  0.7830 
1 1 1 0   117 2  o 11 3.84927e+00 8.66923e-01 6.17894e+01 142.249 -4.99489e+00 3.86757e+00  0.00000e+00 0.00000e+00 6.83574e+01 142.249 6.56799e+00 142.249 0.9170 
1 1 1 0   117 3  o 5  3.88460e+00 7.75814e-01 5.12287e+01 147.532 -5.39470e+00 3.43260e+00  0.00000e+00 0.00000e+00 8.02441e+01 147.532 2.90154e+01 147.532 0.9181 
1 1 1 0   117 4  o 3  6.77125e+00 7.64577e-01 1.17674e+02 306.893 1.60844e+01  -2.14279e+01 0.00000e+00 0.00000e+00 1.27189e+02 306.893 9.51454e+00 306.893 0.9812 
1 1 1 0   117 5  o 1  3.15175e+00 8.81791e-01 6.13266e+01 114.522 -2.35607e+00 5.16457e+00  0.00000e+00 0.00000e+00 4.40067e+01 114.522 1.73199e+01 294.522 0.9070 
1 1 1 0   117 6  o 10 4.04884e+00 9.67961e-01 5.24308e+01 149.043 -4.94810e+00 2.96811e+00  0.00000e+00 0.00000e+00 8.30786e+01 149.043 3.06479e+01 149.043 0.9086 
1 1 1 0   117 7  o 16 2.19717e+00 7.37741e-01 2.77657e+01 69.517  8.62815e-01  2.30984e+00  0.00000e+00 0.00000e+00 3.38158e+01 69.517  6.05012e+00 69.517  0.7612 
1 1 1 0   117 8  o 2  2.03200e+00 6.98460e-01 3.18794e+01 350.806 2.91738e+00  -4.72203e-01 0.00000e+00 0.00000e+00 2.84428e+01 350.806 3.43658e+00 170.806 0.8066 
1 1 1 0   118 0  o 12 2.59924e+00 8.11963e-01 6.63256e+01 306.717 1.77282e+00  -2.37691e+00 0.00000e+00 0.00000e+00 1.10341e+01 306.717 5.52916e+01 126.717 0.8074 
1 1 1 0   118 1  o 10 3.05064e+00 8.40438e-01 6.56153e+01 23.614  5.08972e+00  2.22513e+00  0.00000e+00 0.00000e+00 3.61352e+01 23.614  2.94802e+01 203.614 0.9048 
1 1 1 0   118 2  o 14 1.92913e+00 6.44295e-01 4.73090e+01 135.430 -2.27189e+00 2.23805e+00  0.00000e+00 0.00000e+00 1.12135e+01 135.430 3.60955e+01 315.430 0.8230 
1 1 1 0   118 3  o 14 2.58064e+00 7.84632e-01 7.59390e+01 354.556 6.43413e+00  -6.13136e-01 0.00000e+00 0.00000e+00 1.14616e+01 354.556 6.44774e+01 174.556 0.9190 
1 1 1 0   118 4  o 6  3.38921e+00 8.91601e-01 2.90980e+01 181.860 -2.83491e+00 -9.20410e-02 0.00000e+00 0.00000e+00 7.04426e+01 181.860 4.13447e+01 181.860 0.7971 
1 1 1 0   118 5  o 12 7.46286e+00 8.14150e-01 1.33579e+02 337.273 2.97276e+01  -1.24520e+01 0.00000e+00 0.00000e+00 1.37014e+02 337.273 3.43454e+00 337.273 0.9844 
1 1 1 0   118 6  o 6  3.92472e+00 9.55052e-01 6.75331e+01 106.158 -2.31195e+00 7.97977e+00  0.00000e+00 0.00000e+00 6.79854e+01 106.158 4.52284e-01 106.158 0.9377 
1 1 1 0   118 7  o 3  2.15760e+00 7.24862e-01 3.70033e+01 37.049  2.64595e+00  1.99744e+00  0.00000e+00 0.00000e+00 2.89787e+01 37.049  8.02456e+00 217.049 0.8308 
1 1 1 0   119 1  o 4  2.09124e+00 6.71765e-01 2.00133e+01 156.101 -1.40255e+00 6.21487e-01  0.00000e+00 0.00000e+00 2.65662e+01 156.101 6.55298e+00 156.101 0.6044 
1 1 1 0   119 2  o 17 6.09622e+00 7.81236e-01 1.00480e+02 131.059 -1.21232e+01 1.39171e+01  0.00000e+00 0.00000e+00 1.17971e+02 131.059 1.74907e+01 131.059 0.9725 
1 1 1 0   119 3  o 7  3.87678e+00 8.36161e-01 4.30136e+01 245.409 -2.10184e+00 -4.59269e+00 0.00000e+00 0.00000e+00 8.47488e+01 245.409 4.17352e+01 245.409 0.8945 
1 1 1 0   119 4  o 11 3.68627e+00 8.98714e-01 5.53574e+01 325.330 5.00029e+00  -3.45844e+00 0.00000e+00 0.00000e+00 6.86848e+01 325.330 1.33274e+01 325.330 0.9136 
1 1 1 0   119 5  o 10 5.06190e+00 8.95109e-01 6.38161e+01 165.844 -9.71676e+00 2.45077e+00  0.00000e+00 0.00000e+00 1.13017e+02 165.844 4.92008e+01 165.844 0.9487 
1 1 1 0   119 6  o 6  2.35012e+00 7.55150e-01 2.32804e+01 77.063  4.85065e-01  2.11163e+00  0.00000e+00 0.00000e+00 3.92934e+01 77.063  1.60130e+01 77.063  0.7233 
1 1 1 0   119 7  o 18 3.13822e+00 9.21949e-01 4.10941e+01 189.886 -4.44520e+00 -7.74696e-01 0.00000e+00 0.00000e+00 6.06017e+01 189.886 1.95076e+01 189.886 0.8807 
1 1 1 0   120 0  o 8  5.93146e+00 1.03423e+00 7.19156e+01 316.487 5.16339e+00  -4.90205e+00 0.00000e+00 0.00000e+00 1.30608e+02 316.487 5.86920e+01 316.487 0.9268 
1 1 1 0   120 1  o 14 2.89972e+00 8.32414e-01 4.04059e+01 6.006   3.54273e+00  3.72720e-01  0.00000e+00 0.00000e+00 4.97804e+01 6.006   9.37450e+00 6.006   0.8443 
1 1 1 0   120 2  o 11 2.97966e+00 8.30256e-01 2.23718e+01 93.483  -1.24782e-01 2.04993e+00  0.00000e+00 0.00000e+00 5.51586e+01 93.483  3.27868e+01 93.483  0.7064 
1 1 1 0   120 3  o 9  6.70504e+00 7.83382e-01 1.20081e+02 241.679 -1.27306e+01 -2.36227e+01 0.00000e+00 0.00000e+00 1.22211e+02 241.679 2.13036e+00 241.679 0.9812 
1 1 1 0   120 4  o 7  5.15167e+00 8.77772e-01 9.95095e+01 270.584 1.65218e-01  -1.62015e+01 0.00000e+00 0.00000e+00 8.42287e+01 270.584 1.52808e+01 90.584  0.9686 
1 1 1 0   120 5  o 18 9.20886e+00 7.29986e-01 1.44635e+02 85.291  4.60435e+00  5.58949e+01  0.00000e+00 0.00000e+00 1.91313e+02 85.291  4.66779e+01 85.291  0.9910 
1 1 1 0   120 6  o 10 5.26938e+00 9.68723e-01 9.08073e+01 305.278 9.02664e+00  -1.27593e+01 0.00000e+00 0.00000e+00 9.67873e+01 305.278 5.97996e+00 305.278 0.9675 
1 1 1 0   121 1  o 12 3.31690e+00 8.46419e-01 3.83000e+01 232.983 -2.39852e+00 -3.18103e+00 0.00000e+00 0.00000e+00 6.71004e+01 232.983 2.88004e+01 232.983 0.8629 
1 1 1 0   121 2  o 16 4.14604e+00 8.39908e-01 6.15617e+01 45.115  6.12280e+00  6.14736e+00  0.00000e+00 0.00000e+00 8.20164e+01 45.115  2.04547e+01 45.115  0.9405 
1 1 1 0   121 3  o 7  2.92220e+00 7.85501e-01 4.44980e+01 84.135  4.60961e-01  4.48715e+00  0.00000e+00 0.00000e+00 5.02464e+01 84.135  5.74834e+00 84.135  0.8806 
1 1 1 0   121 4  o 19 3.32336e+00 8.52167e-01 6.15670e+01 291.113 2.58377e+00  -6.69136e+00 0.00000e+00 0.00000e+00 5.18819e+01 291.113 9.68506e+00 111.113 0.9274 
1 1 1 0   121 5  o 17 2.77551e+00 8.29826e-01 5.63074e+01 79.287  1.07344e+00  5.67392e+00  0.00000e+00 0.00000e+00 3.65030e+01 79.287  1.98043e+01 259.287 0.9087 
1 1 1 0   121 6  o 16 3.15818e+00 8.73017e-01 5.64198e+01 340.702 5.93461e+00  -2.07806e+00 0.00000e+00 0.00000e+00 5.00697e+01 340.702 6.35019e+00 160.702 0.9166 
1 1 1 0   122 0  o 19 5.34018e+00 1.08346e+00 6.51938e+01 172.952 -5.68463e+00 7.02770e-01  0.00000e+00 0.00000e+00 1.13297e+02 172.952 4.81037e+01 172.952 0.9079 
1 1 1 0   122 1  o 11 5.79581e+00 8.11998e-01 6.56052e+01 343.637 1.23256e+01  -3.61902e+00 0.00000e+00 0.00000e+00 1.39276e+02 343.637 7.36710e+01 343.637 0.9603 
1 1 1 0   122 2  o 19 2.14869e+00 7.02053e-01 4.19639e+01 162.192 -3.47494e+00 1.11623e+00  0.00000e+00 0.00000e+00 2.51514e+01 162.192 1.68125e+01 342.192 0.8486 
1 1 1 0   122 3  f 0  4.73826e+00 9.24012e-01 7.29388e+01 147.076 -9.78591e+00 6.33651e+00  0.00000e+00 0.00000e+00 9.37937e+01 147.076 2.08550e+01 147.076 0.9561 
1 1 1 0   122 4  o 16 3.90639e+00 9.20716e-01 5.98122e+01 210.993 -6.39379e+00 -3.84066e+00 0.00000e+00 0.00000e+00 7.39133e+01 210.993 1.41011e+01 210.993 0.9303 
1 1 1 0   122 5  o 18 5.01754e+00 8.72346e-01 1.06785e+02 356.210 1.98557e+01  -1.31514e+00 0.00000e+00 0.00000e+00 7.30926e+01 356.210 3.36920e+01 176.211 0.9745 
1 1 1 0   122 6  o 16 2.99291e+00 8.96619e-01 5.31819e+01 225.426 -4.07562e+00 -4.13673e+00 0.00000e+00 0.00000e+00 4.68914e+01 225.426 6.29047e+00 45.426  0.9093 
1 1 1 0   123 1  o 2  2.80390e+00 8.18485e-01 4.59537e+01 101.854 -1.00806e+00 4.80261e+00  0.00000e+00 0.00000e+00 4.60041e+01 101.854 5.03975e-02 101.854 0.8912 
1 1 1 0   123 2  o 16 2.42439e+00 7.47487e-01 2.96770e+01 42.400  2.12379e+00  1.93929e+00  0.00000e+00 0.00000e+00 4.17261e+01 42.400  1.20491e+01 42.400  0.8004 
1 1 1 0   123 3  o 10 3.48751e+00 8.87651e-01 4.83660e+01 246.532 -2.32584e+00 -5.35724e+00 0.00000e+00 0.00000e+00 6.83728e+01 246.532 2.00068e+01 246.532 0.9098 
1 1 1 0   123 4  o 2  3.82629e+00 9.40323e-01 8.31509e+01 224.587 -7.70288e+00 -7.59264e+00 0.00000e+00 0.00000e+00 5.09218e+01 224.587 3.22291e+01 44.587  0.9526 
1 1 1 0   123 5  o 1  2.46650e+00 7.66537e-01 2.22728e+01 310.255 1.61144e+00  -1.90315e+00 0.00000e+00 0.00000e+00 4.70525e+01 310.255 2.47797e+01 310.255 0.7643 
1 1 1 0   124 0  o 6  3.35971e+00 9.58551e-01 1.56342e+01 101.207 -2.11152e-01 1.06573e+00  0.00000e+00 0.00000e+00 4.32232e+01 101.207 2.75890e+01 101.207 0.4762 
1 1 1 0   124 1  f 0  3.06112e+00 8.31611e-01 1.03635e+01 301.965 6.19592e-01  -9.92920e-01 0.00000e+00 0.00000e+00 4.63388e+01 301.965 3.59753e+01 301.965 0.5035 
1 1 1 0   124 2  o 10 2.28647e+00 7.01856e-01 2.86971e+01 243.554 -1.30478e+00 -2.62321e+00 0.00000e+00 0.00000e+00 3.89808e+01 243.554 1.02837e+01 243.554 0.8047 
1 1 1 0   124 3  o 18 2.52725e+00 7.87383e-01 4.88884e+01 16.084  4.88048e+00  1.40721e+00  0.00000e+00 0.00000e+00 3.43200e+01 16.084  1.45684e+01 196.084 0.8952 
1 1 1 0   124 4  o 1  2.45854e+00 7.71076e-01 4.75821e+01 44.053  3.52490e+00  3.41022e+00  0.00000e+00 0.00000e+00 3.29789e+01 44.053  1.46032e+01 224.053 0.8911 
1 1 1 0   124 5  o 4  1.67896e+00 5.88601e-01 3.48577e+01 260.834 -5.20779e-01 -3.22767e+00 0.00000e+00 0.00000e+00 1.62526e+01 260.834 1.86051e+01 80.834  0.8281 
1 1 1 0   125 1  o 2  5.89143e+00 8.23732e-01 8.90207e+01 61.310  9.81890e+00  1.79420e+01  0.00000e+00 0.00000e+00 1.22277e+02 61.310  3.32559e+01 61.310  0.9752 
1 1 1 0   125 2  o 1  5.27733e+00 8.86743e-01 7.90600e+01 322.219 1.14635e+01  -8.88586e+00 0.00000e+00 0.00000e+00 1.08186e+02 322.219 2.91263e+01 322.219 0.9649 
1 1 1 0   125 3  o 4  5.63675e+00 8.88939e-01 9.41651e+01 95.390  -1.81584e+00 1.92449e+01  0.00000e+00 0.00000e+00 1.07647e+02 95.390  1.34815e+01 95.390  0.9738 
1 1 1 0   125 4  o 2  2.80676e+00 8.36286e-01 4.68582e+01 242.815 -2.57556e+00 -5.01467e+00 0.00000e+00 0.00000e+00 4.66511e+01 242.815 2.07191e-01 62.815  0.9063 
1 1 1 0   125 5  o 15 3.70058e+00 9.31560e-01 5.97549e+01 201.806 -7.11901e+00 -2.84828e+00 0.00000e+00 0.00000e+00 6.70313e+01 201.806 7.27645e+00 201.806 0.9323 
1 1 1 0   126 0  o 4  3.67128e+00 1.00492e+00 5.94858e+01 20.739  4.59954e+00  1.74164e+00  0.00000e+00 0.00000e+00 6.08351e+01 20.739  1.34932e+00 20.739  0.8915 
1 1 1 0   126 1  o 7  3.33819e+00 8.76955e-01 7.23165e+01 274.374 6.80096e-01  -8.89239e+00 0.00000e+00 0.00000e+00 4.33058e+01 274.374 2.90107e+01 94.373  0.9421 
1 1 1 0   126 2  o 14 2.18598e+00 7.01244e-01 1.19320e+01 118.848 -5.80998e-01 1.05475e+00  0.00000e+00 0.00000e+00 2.93770e+01 118.848 1.74450e+01 118.848 0.5141 
1 1 1 0   126 3  o 15 2.71142e+00 8.06725e-01 2.70587e+01 302.625 1.76219e+00  -2.75275e+00 0.00000e+00 0.00000e+00 5.54595e+01 302.625 2.84008e+01 302.625 0.8280 
1 1 1 0   126 4  o 8  2.38033e+00 7.64084e-01 5.47213e+01 295.963 2.41611e+00  -4.96183e+00 0.00000e+00 0.00000e+00 2.43649e+01 295.963 3.03564e+01 115.963 0.9042 
1 1 1 0   127 1  o 18 2.60384e+00 7.51028e-01 3.75418e+01 244.465 -2.02079e+00 -4.22996e+00 0.00000e+00 0.00000e+00 4.72033e+01 244.465 9.66147e+00 244.465 0.8856 
1 1 1 0   127 2  o 5  1.86328e+00 6.23953e-01 3.49659e+01 6.844   4.16904e+00  5.00372e-01  0.00000e+00 0.00000e+00 2.46550e+01 6.844   1.03108e+01 186.844 0.8708 
1 1 1 0   127 3  o 8  2.92746e+00 8.47351e-01 6.15983e+01 342.892 6.60729e+00  -2.03372e+00 0.00000e+00 0.00000e+00 3.78453e+01 342.892 2.37530e+01 162.892 0.9245 
1 1 1 0   127 4  o 1  2.69321e+00 8.26086e-01 4.30684e+01 144.747 -4.34771e+00 3.07304e+00  0.00000e+00 0.00000e+00 4.60085e+01 144.747 2.94007e+00 144.747 0.9004 
1 1 1 0   128 0  o 12 4.07816e+00 1.00950e+00 6.17015e+01 268.711 -1.27319e-01 -5.65616e+00 0.00000e+00 0.00000e+00 7.41441e+01 268.711 1.24426e+01 268.711 0.9067 
1 1 1 0   128 1  o 12 2.59770e+00 7.95350e-01 6.20837e+01 215.602 -5.34873e+00 -3.82965e+00 0.00000e+00 0.00000e+00 2.57625e+01 215.602 3.63213e+01 35.602  0.9205 
1 1 1 0   128 2  o 6  2.80205e+00 7.73398e-01 5.41594e+01 295.799 3.29294e+00  -6.81219e+00 0.00000e+00 0.00000e+00 4.17064e+01 295.799 1.24530e+01 115.799 0.9314 
1 1 1 0   128 3  o 11 2.64656e+00 8.04160e-01 4.46282e+01 60.031  2.79076e+00  4.83970e+00  0.00000e+00 0.00000e+00 4.33824e+01 60.031  1.24583e+00 240.031 0.9054 
1 1 1 0   128 4  o 11 2.98309e+00 8.69658e-01 5.30358e+01 197.434 -4.87632e+00 -1.53130e+00 0.00000e+00 0.00000e+00 4.51018e+01 197.434 7.93395e+00 17.434  0.8959 
1 1 1 0   129 2  o 1  2.55557e+00 7.66924e-01 2.15488e+01 296.428 1.14309e+00  -2.29986e+00 0.00000e+00 0.00000e+00 5.09195e+01 296.428 2.93707e+01 296.428 0.7722 
1 1 1 0   129 3  o 1  3.37470e+00 9.25119e-01 7.91982e+01 136.332 -5.89166e+00 5.62389e+00  0.00000e+00 0.00000e+00 3.68302e+01 136.332 4.23679e+01 316.332 0.9364 
1 1 1 1   0   2  o 16 1.13120e+01 3.64683e-01 9.15745e+02 180.000 -8.82797e-01 0.00000e+00  0.00000e+00 0.00000e+00 6.14888e+02 0.000   1.53063e+03 0.000   0.7078 
1 1 1 1   0   3  o 4  2.97982e+01 7.25125e-01 6.52064e+02 180.000 -2.74396e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.58253e+02 180.000 1.93811e+02 0.000   0.9918 
1 1 1 1   0   4  o 7  5.37020e+01 1.26676e+00 1.03188e+03 0.000   1.26398e+01  0.00000e+00  0.00000e+00 0.00000e+00 9.85394e+02 0.000   4.64840e+01 180.000 1.0000 
1 1 1 1   0   5  o 10 1.91203e+01 4.75968e-01 1.16343e+02 0.000   6.54526e-01  0.00000e+00  0.00000e+00 0.00000e+00 2.96337e+02 0.000   1.79994e+02 0.000   0.5747 
1 1 1 1   0   6  o 18 1.79141e+01 4.74757e-01 3.33690e+02 0.000   2.59625e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.31447e+02 0.000   2.24322e+00 180.000 0.9889 
1 1 1 1   0   7  o 3  3.78112e+01 8.50855e-01 6.21211e+02 180.000 -1.06546e+01 0.00000e+00  0.00000e+00 0.00000e+00 7.97876e+02 180.000 1.76665e+02 180.000 1.0000 
1 1 1 1   0   8  o 19 1.12510e+01 5.94013e-01 6.72368e+01 180.000 -4.94468e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.25975e+02 180.000 5.87379e+01 180.000 0.4578 
1 1 1 1   0   9  o 3  2.77984e+01 7.63404e-01 5.60925e+02 180.000 -1.23946e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.81438e+02 180.000 7.94869e+01 0.000   1.0000 
1 1 1 1   0   10 o 1  3.97949e+01 1.02459e+00 6.76690e+02 180.000 -2.78384e+01 0.00000e+00  0.00000e+00 0.00000e+00 8.14701e+02 180.000 1.38011e+02 180.000 1.0000 
1 1 1 1   0   11 o 1  3.00349e+01 8.69174e-01 5.93995e+02 0.000   2.48859e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.30944e+02 0.000   6.30509e+01 180.000 1.0000 
1 1 1 1   0   12 o 3  3.73821e+01 1.04882e+00 6.28610e+02 0.000   3.98149e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.70590e+02 0.000   1.41980e+02 0.000   1.0000 
1 1 1 1   0   13 o 11 6.99181e+00 1.53934e+00 1.30691e+02 180.000 -2.48685e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.27227e+02 180.000 3.46457e+00 0.000   0.9863 
1 1 1 1   0   14 o 7  7.09552e+00 1.91970e+00 1.76750e+02 0.000   3.98013e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.82470e+01 0.000   8.85032e+01 180.000 0.9993 
1 1 1 1   0   15 o 19 8.39208e+00 1.87460e+00 1.99902e+02 0.000   7.04089e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.13471e+02 0.000   8.64306e+01 180.000 1.0000 
1 1 1 1   0   16 o 3  2.24643e+01 1.19994e+00 2.40265e+02 0.000   3.37684e+01  0.00000e+00  0.00000e+00 0.00000e+00 5.97826e+02 0.000   3.57561e+02 0.000   1.0000 
1 1 1 1   0   17 o 12 3.30839e+00 2.06460e+00 1.19428e+02 180.000 -2.09481e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.00798e-01 180.000 1.19227e+02 0.000   0.9701 
1 1 1 1   0   18 o 5  3.56914e+00 2.27114e+00 2.84091e+01 0.000   5.19697e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.50419e+01 0.000   6.63286e+00 0.000   0.4775 
1 1 1 1   0   19 o 19 2.41111e+00 1.73801e+00 1.39441e+01 180.000 -2.48363e-01 0.00000e+00  0.00000e+00 0.00000e+00 7.88111e+00 180.000 6.06298e+00 0.000   0.2434 
1 1 1 1   0   20 o 6  7.10098e+00 3.73408e+00 8.00116e+01 180.000 -1.80821e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.69980e+02 180.000 8.99679e+01 180.000 0.9476 
1 1 1 1   1   2  o 9  2.16012e+01 4.02105e-01 5.70935e+02 241.136 -1.00885e+00 -1.83027e+00 0.00000e+00 0.00000e+00 6.96681e+00 241.136 5.63968e+02 61.136  0.7120 
1 1 1 1   1   3  o 12 3.45909e+01 5.57216e-01 2.64825e+02 122.921 -1.40220e+00 2.16572e+00  0.00000e+00 0.00000e+00 7.40325e+02 122.921 4.75500e+02 122.921 0.7734 
1 1 1 1   1   4  o 12 3.31958e+01 5.42053e-01 7.35856e+02 359.761 1.11771e+01  -4.67051e-02 0.00000e+00 0.00000e+00 4.53956e+02 359.761 2.81900e+02 179.761 0.9542 
1 1 1 1   1   5  o 14 1.75803e+01 3.29332e-01 5.90990e+01 202.584 -5.64122e-01 -2.34642e-01 0.00000e+00 0.00000e+00 1.33733e+02 202.584 7.46340e+01 202.584 0.2921 
1 1 1 1   1   6  o 15 8.97617e+00 2.68183e-01 1.60532e+02 46.648  8.59459e-01  9.10378e-01  0.00000e+00 0.00000e+00 1.76034e+01 46.648  1.42929e+02 226.648 0.5286 
1 1 1 1   1   7  o 1  3.36694e+01 5.70973e-01 5.19089e+02 50.048  1.01855e+01  1.21595e+01  0.00000e+00 0.00000e+00 7.04045e+02 50.048  1.84957e+02 50.048  0.9679 
1 1 1 1   1   8  o 11 2.02134e+01 4.06046e-01 4.51716e+02 64.959  5.05298e+00  1.08161e+01  0.00000e+00 0.00000e+00 2.74102e+02 64.959  1.77615e+02 244.959 0.9572 
1 1 1 1   1   9  o 14 1.98153e+01 4.46903e-01 3.66206e+02 234.243 -6.75886e+00 -9.38632e+00 0.00000e+00 0.00000e+00 3.43928e+02 234.243 2.22775e+01 54.243  0.9557 
1 1 1 1   1   10 o 17 3.27899e+01 6.72194e-01 4.85150e+02 179.793 -3.29819e+01 1.19106e-01  0.00000e+00 0.00000e+00 7.24938e+02 179.793 2.39788e+02 179.793 0.9847 
1 1 1 1   1   11 f 0  2.33714e+01 5.47301e-01 3.68589e+02 316.824 1.75970e+01  -1.65110e+01 0.00000e+00 0.00000e+00 4.88439e+02 316.824 1.19850e+02 316.824 0.9791 
1 1 1 1   1   12 o 11 1.93279e+01 6.82563e-01 3.00914e+02 64.657  9.64072e+00  2.03557e+01  0.00000e+00 0.00000e+00 4.06276e+02 64.657  1.05362e+02 64.657  0.9775 
1 1 1 1   1   13 o 6  6.49354e+00 1.03108e+00 6.76224e+01 199.746 -2.27767e+00 -8.17578e-01 0.00000e+00 0.00000e+00 1.15991e+02 199.746 4.83690e+01 199.746 0.7560 
1 1 1 1   1   14 o 17 8.22064e+00 1.03085e+00 1.73521e+02 66.095  4.04268e+00  9.12084e+00  0.00000e+00 0.00000e+00 1.17881e+02 66.095  5.56401e+01 246.095 0.9485 
1 1 1 1   1   15 o 2  1.48061e+01 8.04693e-01 2.39928e+02 236.227 -2.00648e+01 -3.00035e+01 0.00000e+00 0.00000e+00 3.05242e+02 236.227 6.53147e+01 236.227 0.9860 
1 1 1 1   1   16 o 14 1.04268e+01 1.10683e+00 1.73736e+02 120.874 -1.04047e+01 1.74029e+01  0.00000e+00 0.00000e+00 2.05547e+02 120.874 3.18109e+01 120.874 0.9750 
1 1 1 1   1   17 o 14 1.16560e+01 1.30604e+00 1.82302e+02 261.579 -3.60271e+00 -2.43348e+01 0.00000e+00 0.00000e+00 2.43214e+02 261.579 6.09120e+01 261.579 0.9795 
1 1 1 1   1   18 o 10 5.58673e+00 1.52524e+00 7.48998e+01 201.224 -4.20095e+00 -1.63149e+00 0.00000e+00 0.00000e+00 1.08260e+02 201.224 3.33606e+01 201.224 0.8805 
1 1 1 1   1   19 o 4  4.64192e+00 1.50421e+00 7.59176e+01 342.286 4.11006e+00  -1.31280e+00 0.00000e+00 0.00000e+00 7.50812e+01 342.286 8.36406e-01 162.286 0.8746 
1 1 1 1   1   20 o 12 5.45914e+00 1.69228e+00 1.47696e+02 94.191  -7.29286e-01 9.95183e+00  0.00000e+00 0.00000e+00 4.46628e+01 94.191  1.03034e+02 274.191 0.9485 
1 1 1 1   2   2  o 12 2.21303e+01 3.87497e-01 1.16198e+02 135.095 -6.87844e-01 6.85561e-01  0.00000e+00 0.00000e+00 2.46413e+02 135.095 1.30215e+02 135.095 0.4361 
1 1 1 1   2   3  o 12 2.68945e+01 4.67681e-01 6.01281e+02 202.665 -4.17276e+00 -1.74251e+00 0.00000e+00 0.00000e+00 2.88891e+02 202.665 3.12391e+02 22.665  0.8810 
1 1 1 1   2   4  o 15 2.61093e+01 4.38792e-01 2.01323e+02 232.232 -1.46841e+00 -1.89524e+00 0.00000e+00 0.00000e+00 5.37565e+02 232.232 3.36241e+02 232.232 0.7534 
1 1 1 1   2   5  o 8  1.12595e+01 2.60390e-01 1.44685e+02 144.192 -7.75517e-01 5.59492e-01  0.00000e+00 0.00000e+00 3.74302e+01 144.192 1.07255e+02 324.192 0.4307 
1 1 1 1   2   6  o 19 1.50048e+01 3.16471e-01 2.57798e+02 114.495 -1.39111e+00 3.05315e+00  0.00000e+00 0.00000e+00 2.11556e+02 114.495 4.62421e+01 294.495 0.8332 
1 1 1 1   2   7  o 10 1.59135e+01 3.43629e-01 4.00281e+02 199.628 -5.46069e+00 -1.94753e+00 0.00000e+00 0.00000e+00 1.42670e+02 199.628 2.57610e+02 19.629  0.9091 
1 1 1 1   2   8  o 18 2.46461e+01 4.59289e-01 4.36366e+02 108.378 -4.42663e+00 1.33239e+01  0.00000e+00 0.00000e+00 4.54672e+02 108.378 1.83060e+01 108.378 0.9637 
1 1 1 1   2   9  o 7  3.41201e+01 6.00788e-01 3.15345e+02 8.613   1.68703e+01  2.55524e+00  0.00000e+00 0.00000e+00 9.25981e+02 8.613   6.10636e+02 8.613   0.9702 
1 1 1 1   2   10 o 10 1.63809e+01 4.49633e-01 3.11128e+02 75.333  2.70118e+00  1.03206e+01  0.00000e+00 0.00000e+00 2.73255e+02 75.333  3.78731e+01 255.333 0.9519 
1 1 1 1   2   11 f 0  1.19239e+01 5.70948e-01 2.75161e+02 64.477  3.95389e+00  8.28089e+00  0.00000e+00 0.00000e+00 1.46354e+02 64.477  1.28808e+02 244.477 0.9438 
1 1 1 1   2   12 o 14 3.16499e+01 6.72240e-01 3.97410e+02 273.976 3.38015e+00  -4.86347e+01 0.00000e+00 0.00000e+00 7.75014e+02 273.976 3.77604e+02 273.976 0.9897 
1 1 1 1   2   13 o 12 7.19268e+00 1.07582e+00 1.59479e+02 22.164  5.79745e+00  2.36166e+00  0.00000e+00 0.00000e+00 8.70049e+01 22.164  7.24744e+01 202.164 0.9162 
1 1 1 1   2   14 f 0  9.20896e+00 9.10634e-01 1.48946e+02 158.144 -9.18290e+00 3.68335e+00  0.00000e+00 0.00000e+00 1.77335e+02 158.144 2.83886e+01 158.144 0.9480 
1 1 1 1   2   15 o 8  2.18877e+01 8.26333e-01 3.06577e+02 304.007 3.78751e+01  -5.61383e+01 0.00000e+00 0.00000e+00 5.04684e+02 304.007 1.98107e+02 304.007 0.9926 
1 1 1 1   2   16 o 17 1.74644e+01 8.89021e-01 3.14800e+02 222.703 -4.97319e+01 -4.58965e+01 0.00000e+00 0.00000e+00 3.31921e+02 222.703 1.71216e+01 222.703 0.9926 
1 1 1 1   2   17 o 19 6.74444e+00 1.40900e+00 1.12308e+02 105.316 -2.18445e+00 7.97605e+00  0.00000e+00 0.00000e+00 1.23340e+02 105.316 1.10320e+01 105.316 0.9374 
1 1 1 1   2   18 o 2  6.35907e+00 1.57228e+00 2.02465e+01 24.050  1.23025e+00  5.49021e-01  0.00000e+00 0.00000e+00 1.11403e+02 24.050  9.11568e+01 24.050  0.5560 
1 1 1 1   2   19 o 6  6.18301e+00 1.72515e+00 9.07168e+01 61.418  2.82625e+00  5.18749e+00  0.00000e+00 0.00000e+00 1.18755e+02 61.418  2.80381e+01 61.418  0.9109 
1 1 1 1   2   20 o 1  4.67299e+00 1.51588e+00 7.85461e+01 97.177  -6.52317e-01 5.18067e+00  0.00000e+00 0.00000e+00 7.73957e+01 97.177  1.15035e+00 277.176 0.8983 
1 1 1 1   3   2  o 15 1.80801e+01 3.28202e-01 2.83657e+02 46.860  1.29022e+00  1.37684e+00  0.00000e+00 0.00000e+00 1.77143e+02 46.860  1.06514e+02 226.860 0.6783 
1 1 1 1   3   3  o 8  3.41528e+01 5.79204e-01 8.51616e+02 97.921  -1.53241e+00 1.10137e+01  0.00000e+00 0.00000e+00 3.72383e+02 97.921  4.79233e+02 277.921 0.9539 
1 1 1 1   3   4  o 19 2.22240e+01 4.02988e-01 4.79788e+02 86.263  3.14921e-01  4.82197e+00  0.00000e+00 0.00000e+00 2.62649e+02 86.263  2.17139e+02 266.263 0.8893 
1 1 1 1   3   5  o 19 2.60201e+01 4.43713e-01 3.26418e+02 223.879 -3.57528e+00 -3.43802e+00 0.00000e+00 0.00000e+00 5.45668e+02 223.879 2.19250e+02 223.879 0.8924 
1 1 1 1   3   6  o 17 3.23778e+01 5.44476e-01 7.68327e+02 159.622 -2.01207e+01 7.47402e+00  0.00000e+00 0.00000e+00 4.18594e+02 159.622 3.49732e+02 339.622 0.9764 
1 1 1 1   3   7  o 8  1.08617e+01 3.16439e-01 2.28791e+02 218.042 -1.77981e+00 -1.39266e+00 0.00000e+00 0.00000e+00 7.13001e+01 218.042 1.57491e+02 38.042  0.7362 
1 1 1 1   3   8  o 13 2.21786e+01 4.30433e-01 4.78922e+02 244.819 -5.89971e+00 -1.25483e+01 0.00000e+00 0.00000e+00 3.22514e+02 244.819 1.56408e+02 64.819  0.9632 
1 1 1 1   3   9  o 10 3.20397e+01 5.98039e-01 5.83315e+02 78.360  5.97719e+00  2.90154e+01  0.00000e+00 0.00000e+00 5.97617e+02 78.360  1.43021e+01 78.360  0.9830 
1 1 1 1   3   10 f 0  5.39123e+01 1.00320e+00 7.27942e+02 331.646 7.00617e+01  -3.78094e+01 0.00000e+00 0.00000e+00 1.27977e+03 331.646 5.51832e+02 331.646 0.9937 
1 1 1 1   3   11 o 4  3.39137e+01 6.44650e-01 6.22278e+02 271.023 1.04838e+00  -5.87243e+01 0.00000e+00 0.00000e+00 6.37065e+02 271.023 1.47870e+01 271.023 0.9915 
1 1 1 1   3   12 o 9  1.20367e+01 6.31649e-01 2.43717e+02 99.085  -1.80189e+00 1.12683e+01  0.00000e+00 0.00000e+00 1.86592e+02 99.085  5.71250e+01 279.085 0.9551 
1 1 1 1   3   13 o 7  1.68121e+01 6.27974e-01 2.94872e+02 213.798 -2.43752e+01 -1.63166e+01 0.00000e+00 0.00000e+00 3.23124e+02 213.798 2.82517e+01 213.798 0.9828 
1 1 1 1   3   14 o 12 1.19657e+01 7.59786e-01 2.15829e+02 324.268 1.56507e+01  -1.12596e+01 0.00000e+00 0.00000e+00 2.19606e+02 324.268 3.77720e+00 324.268 0.9737 
1 1 1 1   3   15 f 0  4.34356e+00 1.17696e+00 1.70417e+02 124.867 -3.77088e+00 5.41203e+00  0.00000e+00 0.00000e+00 2.10807e+01 304.867 1.91497e+02 304.867 0.9207 
1 1 1 1   3   16 o 6  6.04956e+00 1.36232e+00 8.81054e+01 85.486  4.14846e-01  5.25430e+00  0.00000e+00 0.00000e+00 1.14861e+02 85.486  2.67552e+01 85.486  0.8993 
1 1 1 1   3   17 o 6  4.26319e+00 1.26381e+00 1.04691e+02 356.269 5.27888e+00  -3.44209e-01 0.00000e+00 0.00000e+00 3.82666e+01 356.269 6.64245e+01 176.269 0.8997 
1 1 1 1   3   18 o 2  1.05079e+01 1.48434e+00 1.98886e+02 105.930 -6.33315e+00 2.21880e+01  0.00000e+00 0.00000e+00 1.83780e+02 105.930 1.51067e+01 285.930 0.9781 
1 1 1 1   3   19 o 2  5.65924e+00 1.69040e+00 1.22304e+02 342.733 7.12633e+00  -2.21517e+00 0.00000e+00 0.00000e+00 7.35194e+01 342.733 4.87841e+01 162.733 0.9304 
1 1 1 1   3   20 o 5  4.75401e+00 1.55598e+00 5.59083e+01 274.520 2.88588e-01  -3.65028e+00 0.00000e+00 0.00000e+00 9.40544e+01 274.520 3.81461e+01 274.520 0.8491 
1 1 1 1   4   2  o 4  1.79655e+01 3.26896e-01 1.11886e+02 95.210  -6.48040e-02 7.10689e-01  0.00000e+00 0.00000e+00 1.14844e+02 95.210  2.95816e+00 95.210  0.3359 
1 1 1 1   4   3  o 4  1.51746e+01 2.95358e-01 7.27742e+02 175.972 -4.14683e+00 2.91995e-01  0.00000e+00 0.00000e+00 2.32144e+02 355.972 9.59886e+02 355.972 0.8693 
1 1 1 1   4   4  o 19 6.31924e+01 1.05540e+00 1.31469e+03 272.729 1.76181e+00  -3.69642e+01 0.00000e+00 0.00000e+00 1.02674e+03 272.729 2.87951e+02 92.729  0.9864 
1 1 1 1   4   5  o 10 2.59715e+01 4.45046e-01 3.24316e+02 220.836 -3.70249e+00 -3.19995e+00 0.00000e+00 0.00000e+00 5.44581e+02 220.836 2.20265e+02 220.836 0.8909 
1 1 1 1   4   6  o 6  3.27906e+01 5.49746e-01 5.10830e+02 239.693 -7.27169e+00 -1.24405e+01 0.00000e+00 0.00000e+00 6.76727e+02 239.693 1.65897e+02 239.693 0.9647 
1 1 1 1   4   7  o 9  2.09691e+01 3.99846e-01 3.34101e+02 131.510 -4.21145e+00 4.75850e+00  0.00000e+00 0.00000e+00 3.87976e+02 131.510 5.38747e+01 131.510 0.9175 
1 1 1 1   4   8  o 3  2.20334e+01 5.02612e-01 2.85632e+02 85.284  6.73705e-01  8.16679e+00  0.00000e+00 0.00000e+00 4.88727e+02 85.284  2.03095e+02 85.284  0.9368 
1 1 1 1   4   9  o 3  1.82546e+01 4.10850e-01 5.16577e+02 40.537  1.14154e+01  9.76258e+00  0.00000e+00 0.00000e+00 1.44712e+02 40.537  3.71865e+02 220.537 0.9661 
1 1 1 1   4   10 o 3  5.00949e+01 8.92420e-01 8.88094e+02 322.648 7.22897e+01  -5.51729e+01 0.00000e+00 0.00000e+00 9.78919e+02 322.648 9.08245e+01 322.648 0.9945 
1 1 1 1   4   11 o 3  1.25985e+01 6.51145e-01 2.77063e+02 177.720 -9.69934e+00 3.86153e-01  0.00000e+00 0.00000e+00 1.69786e+02 177.720 1.07278e+02 357.720 0.9470 
1 1 1 1   4   12 o 2  1.99124e+01 7.00431e-01 3.04807e+02 162.835 -2.24014e+01 6.91936e+00  0.00000e+00 0.00000e+00 4.24417e+02 162.835 1.19610e+02 162.835 0.9784 
1 1 1 1   4   13 o 15 1.17178e+01 7.03096e-01 2.13786e+02 310.416 9.50153e+00  -1.11578e+01 0.00000e+00 0.00000e+00 2.09251e+02 310.416 4.53517e+00 130.416 0.9653 
1 1 1 1   4   14 o 13 7.49376e+00 1.03985e+00 1.43447e+02 264.167 -7.61775e-01 -7.45739e+00 0.00000e+00 0.00000e+00 1.17201e+02 264.167 2.62467e+01 84.167  0.9307 
1 1 1 1   4   15 o 6  4.40278e+00 1.16937e+00 3.79522e+01 298.413 7.10464e-01  -1.31327e+00 0.00000e+00 0.00000e+00 5.97741e+01 298.413 2.18218e+01 298.413 0.5944 
1 1 1 1   4   16 o 12 3.91150e+00 1.13428e+00 1.62667e+02 63.378  3.14978e+00  6.28393e+00  0.00000e+00 0.00000e+00 2.75605e+01 243.378 1.90228e+02 243.378 0.9259 
1 1 1 1   4   17 f 0  1.11713e+01 1.24593e+00 1.83291e+02 15.935  2.35675e+01  6.72885e+00  0.00000e+00 0.00000e+00 2.24487e+02 15.935  4.11959e+01 15.935  0.9794 
1 1 1 1   4   18 o 16 5.58309e+00 1.57459e+00 1.29742e+02 92.902  -3.83170e-01 7.55750e+00  0.00000e+00 0.00000e+00 6.38643e+01 92.902  6.58772e+01 272.902 0.9314 
1 1 1 1   4   19 o 12 6.17178e+00 1.74200e+00 1.49468e+02 275.638 9.43565e-01  -9.55770e+00 0.00000e+00 0.00000e+00 6.77724e+01 275.638 8.16954e+01 95.638  0.9464 
1 1 1 1   4   20 o 2  8.36847e+00 1.99474e+00 8.80790e+01 46.950  4.95580e+00  5.30509e+00  0.00000e+00 0.00000e+00 2.00520e+02 46.950  1.12441e+02 46.950  0.9283 
1 1 1 1   5   2  o 2  3.75168e+01 6.30778e-01 9.81495e+02 189.200 -1.23297e+01 -1.99695e+00 0.00000e+00 0.00000e+00 3.70484e+02 189.200 6.11012e+02 9.200   0.9591 
1 1 1 1   5   3  o 11 2.28689e+01 4.07236e-01 6.01365e+02 32.121  4.28843e+00  2.69229e+00  0.00000e+00 0.00000e+00 1.67453e+02 32.121  4.33913e+02 212.121 0.8948 
1 1 1 1   5   4  o 3  2.75322e+01 4.84378e-01 5.29142e+02 192.208 -6.31545e+00 -1.36640e+00 0.00000e+00 0.00000e+00 4.21261e+02 192.208 1.07881e+02 12.208  0.9190 
1 1 1 1   5   5  o 5  2.80620e+01 4.98382e-01 4.14134e+02 131.918 -4.47900e+00 4.98878e+00  0.00000e+00 0.00000e+00 5.57588e+02 131.918 1.43455e+02 131.918 0.9221 
1 1 1 1   5   6  o 9  3.32231e+01 5.58199e-01 8.33119e+02 305.271 1.36976e+01  -1.93665e+01 0.00000e+00 0.00000e+00 3.87593e+02 305.271 4.45525e+02 125.271 0.9787 
1 1 1 1   5   7  o 1  1.48488e+01 3.33386e-01 4.06993e+02 193.425 -5.32542e+00 -1.27115e+00 0.00000e+00 0.00000e+00 9.64132e+01 193.425 3.10580e+02 13.425  0.9033 
1 1 1 1   5   8  o 8  3.34225e+01 6.78585e-01 1.60769e+02 128.051 -3.92647e+00 5.01636e+00  0.00000e+00 0.00000e+00 9.89921e+02 128.051 8.29152e+02 128.051 0.9178 
1 1 1 1   5   9  o 2  3.70135e+01 6.39458e-01 6.27788e+02 6.347   3.64896e+01  4.05854e+00  0.00000e+00 0.00000e+00 7.41035e+02 6.347   1.13247e+02 6.347   0.9863 
1 1 1 1   5   10 o 12 2.25346e+01 4.91854e-01 6.13080e+02 309.032 1.81600e+01  -2.24005e+01 0.00000e+00 0.00000e+00 2.16646e+02 309.032 3.96434e+02 129.032 0.9825 
1 1 1 1   5   11 o 9  2.62217e+01 5.63218e-01 4.82519e+02 149.036 -3.03268e+01 1.81961e+01  0.00000e+00 0.00000e+00 4.85582e+02 149.036 3.06297e+00 149.036 0.9858 
1 1 1 1   5   12 o 11 4.09835e+01 7.65654e-01 6.32827e+02 30.881  8.53566e+01  5.10469e+01  0.00000e+00 0.00000e+00 8.93386e+02 30.881  2.60559e+02 30.881  0.9950 
1 1 1 1   5   13 o 18 5.55491e+00 1.08138e+00 8.05038e+01 136.799 -1.77522e+00 1.66710e+00  0.00000e+00 0.00000e+00 7.69308e+01 136.799 3.57303e+00 316.799 0.7578 
1 1 1 1   5   14 o 9  6.39973e+00 1.07208e+00 7.65440e+01 206.702 -3.02397e+00 -1.52106e+00 0.00000e+00 0.00000e+00 1.23130e+02 206.702 4.65863e+01 206.702 0.8349 
1 1 1 1   5   15 o 11 1.18797e+01 8.75642e-01 1.94610e+02 79.241  4.28493e+00  2.25495e+01  0.00000e+00 0.00000e+00 2.39209e+02 79.241  4.45997e+01 79.241  0.9780 
1 1 1 1   5   16 o 12 8.00123e+00 1.21990e+00 1.07749e+02 257.446 -1.98732e+00 -8.92414e+00 0.00000e+00 0.00000e+00 1.73918e+02 257.446 6.61683e+01 257.446 0.9436 
1 1 1 1   5   17 o 8  7.47675e+00 1.38940e+00 4.15022e+01 259.072 -6.49274e-01 -3.36272e+00 0.00000e+00 0.00000e+00 1.91760e+02 259.072 1.50257e+02 259.072 0.8371 
1 1 1 1   5   18 o 13 6.02243e+00 1.53179e+00 1.08612e+02 338.997 6.92331e+00  -2.65801e+00 0.00000e+00 0.00000e+00 9.98981e+01 338.997 8.71388e+00 158.997 0.9299 
1 1 1 1   5   19 o 2  7.66874e+00 1.66107e+00 1.10262e+02 171.100 -9.44425e+00 1.47888e+00  0.00000e+00 0.00000e+00 1.59592e+02 171.100 4.93298e+01 171.100 0.9462 
1 1 1 1   5   20 o 14 3.80050e+00 1.31986e+00 5.13871e+01 291.397 1.18773e+00  -3.03117e+00 0.00000e+00 0.00000e+00 6.54054e+01 291.397 1.40183e+01 291.397 0.8272 
1 1 1 1   6   2  o 18 1.39177e+01 2.73918e-01 2.07960e+02 191.310 -9.17155e-01 -1.83439e-01 0.00000e+00 0.00000e+00 1.32407e+01 191.310 1.94720e+02 11.310  0.4230 
1 1 1 1   6   3  f 0  1.76318e+01 3.31887e-01 2.77945e+02 290.062 6.03578e-01  -1.65272e+00 0.00000e+00 0.00000e+00 1.55302e+02 290.062 1.22644e+02 110.062 0.6541 
1 1 1 1   6   4  o 16 3.26973e+01 5.64755e-01 4.71142e+02 103.039 -1.81421e+00 7.83391e+00  0.00000e+00 0.00000e+00 6.77925e+02 103.039 2.06783e+02 103.039 0.9356 
1 1 1 1   6   5  o 9  1.62959e+01 3.52524e-01 3.25192e+02 230.531 -1.93076e+00 -2.34479e+00 0.00000e+00 0.00000e+00 1.72162e+02 230.531 1.53029e+02 50.531  0.8127 
1 1 1 1   6   6  o 19 2.09611e+01 3.89380e-01 4.48316e+02 90.096  -1.34075e-02 8.03894e+00  0.00000e+00 0.00000e+00 2.87907e+02 90.096  1.60409e+02 270.095 0.9356 
1 1 1 1   6   7  o 6  3.80730e+01 6.36539e-01 5.54328e+02 349.019 1.86317e+01  -3.61526e+00 0.00000e+00 0.00000e+00 8.36348e+02 349.019 2.82020e+02 349.019 0.9733 
1 1 1 1   6   8  o 7  2.15045e+01 4.24452e-01 5.33328e+02 317.902 1.01367e+01  -9.15846e+00 0.00000e+00 0.00000e+00 2.43266e+02 317.902 2.90062e+02 137.902 0.9627 
1 1 1 1   6   9  o 7  1.81739e+01 4.15627e-01 4.88420e+02 107.049 -4.13609e+00 1.34877e+01  0.00000e+00 0.00000e+00 1.68403e+02 107.049 3.20017e+02 287.048 0.9639 
1 1 1 1   6   10 o 13 2.54322e+01 5.18996e-01 3.89264e+02 231.536 -1.28311e+01 -1.61516e+01 0.00000e+00 0.00000e+00 5.40413e+02 231.536 1.51148e+02 231.536 0.9755 
1 1 1 1   6   11 o 16 1.15384e+01 5.43950e-01 2.46065e+02 177.869 -7.93543e+00 2.95283e-01  0.00000e+00 0.00000e+00 1.57874e+02 177.869 8.81914e+01 357.869 0.9347 
1 1 1 1   6   12 o 9  8.03872e+00 8.25433e-01 1.92211e+02 108.101 -1.82750e+00 5.59087e+00  0.00000e+00 0.00000e+00 8.17281e+01 108.101 1.10483e+02 288.101 0.9105 
1 1 1 1   6   13 o 7  1.49282e+01 6.47112e-01 3.07530e+02 297.743 1.25948e+01  -2.39458e+01 0.00000e+00 0.00000e+00 2.40377e+02 297.743 6.71539e+01 117.743 0.9813 
1 1 1 1   6   14 o 13 2.05853e+01 6.70044e-01 2.73852e+02 45.911  3.23021e+01  3.33462e+01  0.00000e+00 0.00000e+00 4.87117e+02 45.911  2.13265e+02 45.911  0.9892 
1 1 1 1   6   15 o 8  6.73372e+00 1.25025e+00 1.55508e+02 290.877 3.22724e+00  -8.46159e+00 0.00000e+00 0.00000e+00 8.16107e+01 290.877 7.38968e+01 110.877 0.9431 
1 1 1 1   6   16 o 18 1.14258e+01 1.03978e+00 2.23889e+02 270.693 3.56989e-01  -2.94942e+01 0.00000e+00 0.00000e+00 1.95071e+02 270.693 2.88182e+01 90.693  0.9829 
1 1 1 1   6   17 o 18 8.41688e+00 1.30446e+00 7.54469e+01 180.502 -7.31696e+00 -6.41395e-02 0.00000e+00 0.00000e+00 2.15950e+02 180.502 1.40503e+02 180.502 0.9289 
1 1 1 1   6   18 o 16 5.44074e+00 1.52554e+00 7.21222e+01 245.240 -1.87044e+00 -4.05553e+00 0.00000e+00 0.00000e+00 1.06000e+02 245.240 3.38778e+01 245.240 0.8793 
1 1 1 1   6   19 o 18 8.81249e+00 1.80121e+00 1.53250e+02 92.090  -5.05084e-01 1.38435e+01  0.00000e+00 0.00000e+00 1.62434e+02 92.090  9.18418e+00 92.090  0.9632 
1 1 1 1   6   20 o 8  6.33517e+00 1.77819e+00 6.17009e+01 288.032 1.40090e+00  -4.30325e+00 0.00000e+00 0.00000e+00 1.45651e+02 288.032 8.39506e+01 288.032 0.8811 
1 1 1 1   7   2  o 5  3.73128e+01 6.30859e-01 7.55280e+02 285.498 2.29665e+00  -8.28275e+00 0.00000e+00 0.00000e+00 5.62380e+02 285.498 1.92900e+02 105.498 0.9399 
1 1 1 1   7   3  o 11 3.64428e+01 6.20783e-01 7.80742e+02 112.000 -3.71038e+00 9.18355e+00  0.00000e+00 0.00000e+00 5.17277e+02 112.000 2.63465e+02 292.000 0.9481 
1 1 1 1   7   4  o 5  4.60116e+01 7.77179e-01 7.64515e+02 331.140 1.57821e+01  -8.69785e+00 0.00000e+00 0.00000e+00 9.15096e+02 331.140 1.50582e+02 331.140 0.9718 
1 1 1 1   7   5  o 6  2.00147e+01 3.83105e-01 4.38465e+02 124.090 -2.79321e+00 4.12711e+00  0.00000e+00 0.00000e+00 2.32720e+02 124.090 2.05744e+02 304.090 0.8930 
1 1 1 1   7   6  o 12 8.30984e+00 2.83481e-01 3.27983e+02 92.624  -1.06334e-01 2.31992e+00  0.00000e+00 0.00000e+00 9.58150e+01 272.624 4.23798e+02 272.624 0.7442 
1 1 1 1   7   7  o 9  3.00651e+01 5.22403e-01 3.92838e+02 260.416 -1.76737e+00 -1.04669e+01 0.00000e+00 0.00000e+00 6.80919e+02 260.416 2.88081e+02 260.416 0.9517 
1 1 1 1   7   8  o 19 2.79840e+01 5.38081e-01 2.91964e+02 166.611 -9.42763e+00 2.24407e+00  0.00000e+00 0.00000e+00 7.02056e+02 166.611 4.10092e+02 166.611 0.9469 
1 1 1 1   7   9  o 8  3.58119e+01 6.25785e-01 8.70879e+02 95.709  -4.89245e+00 4.89361e+01  0.00000e+00 0.00000e+00 4.58156e+02 95.709  4.12723e+02 275.709 0.9898 
1 1 1 1   7   10 o 19 1.54951e+01 4.63488e-01 2.14461e+02 295.716 3.00854e+00  -6.24689e+00 0.00000e+00 0.00000e+00 3.22534e+02 295.716 1.08072e+02 295.716 0.9248 
1 1 1 1   7   11 o 13 3.61225e+01 6.75420e-01 6.07411e+02 150.699 -5.30373e+01 2.97638e+01  0.00000e+00 0.00000e+00 7.34275e+02 150.699 1.26864e+02 150.699 0.9917 
1 1 1 1   7   12 o 8  2.46484e+01 5.97485e-01 4.76198e+02 261.034 -7.12348e+00 -4.51520e+01 0.00000e+00 0.00000e+00 4.36171e+02 261.034 4.00272e+01 81.035  0.9890 
1 1 1 1   7   13 o 12 3.00164e+01 8.68737e-01 3.90123e+02 155.817 -6.06731e+01 2.72454e+01  0.00000e+00 0.00000e+00 7.24018e+02 155.817 3.33895e+02 155.817 0.9925 
1 1 1 1   7   14 o 18 7.18427e+00 1.07838e+00 5.09982e+01 45.954  1.88905e+00  1.95304e+00  0.00000e+00 0.00000e+00 1.60213e+02 45.954  1.09215e+02 45.954  0.7867 
1 1 1 1   7   15 o 9  7.72918e+00 1.09765e+00 1.33377e+02 329.074 8.00493e+00  -4.79584e+00 0.00000e+00 0.00000e+00 1.39291e+02 329.074 5.91396e+00 329.074 0.9448 
1 1 1 1   7   16 o 9  2.13303e+01 8.65342e-01 3.08933e+02 310.156 5.27541e+01  -6.25227e+01 0.00000e+00 0.00000e+00 4.81922e+02 310.156 1.72989e+02 310.156 0.9939 
1 1 1 1   7   17 o 11 1.58926e+01 1.05712e+00 2.95476e+02 146.768 -5.17392e+01 3.38980e+01  0.00000e+00 0.00000e+00 2.92019e+02 146.768 3.45734e+00 326.768 0.9919 
1 1 1 1   7   18 o 5  5.79796e+00 1.55492e+00 9.23462e+01 30.661  5.14226e+00  3.04847e+00  0.00000e+00 0.00000e+00 1.04524e+02 30.661  1.21778e+01 30.661  0.9120 
1 1 1 1   7   19 o 15 3.85992e+00 1.29838e+00 7.91060e+01 148.630 -3.80457e+00 2.31962e+00  0.00000e+00 0.00000e+00 4.70788e+01 148.630 3.20272e+01 328.630 0.8790 
1 1 1 1   7   20 o 4  4.49978e+00 1.47274e+00 6.86378e+01 343.924 4.36815e+00  -1.25880e+00 0.00000e+00 0.00000e+00 7.87375e+01 343.924 1.00997e+01 343.924 0.8817 
1 1 1 1   8   1  o 13 3.43015e+01 5.79597e-01 3.89335e+02 165.793 -2.75288e+00 6.96952e-01  0.00000e+00 0.00000e+00 6.38381e+02 165.793 2.49047e+02 165.793 0.7974 
1 1 1 1   8   2  o 11 1.18020e+01 2.51798e-01 3.71875e+02 52.631  7.66494e-01  1.00364e+00  0.00000e+00 0.00000e+00 1.36055e+02 232.631 5.07930e+02 232.631 0.5318 
1 1 1 1   8   3  o 14 3.20781e+01 5.52814e-01 9.42194e+02 267.923 -3.69570e-01 -1.01882e+01 0.00000e+00 0.00000e+00 2.02176e+02 267.923 7.40017e+02 87.923  0.9496 
1 1 1 1   8   4  o 4  2.55114e+01 4.56928e-01 3.20934e+02 226.854 -2.82804e+00 -3.01720e+00 0.00000e+00 0.00000e+00 5.11321e+02 226.854 1.90388e+02 226.854 0.8685 
1 1 1 1   8   5  f 0  3.09615e+01 5.43903e-01 3.60892e+02 247.328 -2.41723e+00 -5.78642e+00 0.00000e+00 0.00000e+00 7.04547e+02 247.328 3.43655e+02 247.328 0.9164 
1 1 1 1   8   6  o 2  7.91906e+00 2.85566e-01 1.40625e+02 77.862  1.98369e-01  9.22345e-01  0.00000e+00 0.00000e+00 1.39832e+01 257.862 1.54608e+02 257.862 0.4260 
1 1 1 1   8   7  o 11 2.41807e+01 4.46653e-01 3.42892e+02 249.465 -2.60898e+00 -6.96498e+00 0.00000e+00 0.00000e+00 5.01138e+02 249.465 1.58246e+02 249.465 0.9301 
1 1 1 1   8   8  o 16 2.72654e+01 5.84597e-01 2.03240e+02 263.630 -7.26950e-01 -6.51148e+00 0.00000e+00 0.00000e+00 7.37879e+02 263.630 5.34639e+02 263.630 0.9202 
1 1 1 1   8   9  o 6  3.61600e+01 6.96076e-01 5.97267e+02 74.776  8.90469e+00  3.27213e+01  0.00000e+00 0.00000e+00 7.38372e+02 74.776  1.41105e+02 74.776  0.9851 
1 1 1 1   8   10 o 8  2.95779e+01 5.69233e-01 5.37049e+02 142.143 -2.72246e+01 2.11609e+01  0.00000e+00 0.00000e+00 5.55152e+02 142.143 1.81032e+01 142.143 0.9854 
1 1 1 1   8   11 o 19 4.94975e+01 8.52808e-01 8.57965e+02 291.561 4.60560e+01  -1.16558e+02 0.00000e+00 0.00000e+00 9.88363e+02 291.561 1.30399e+02 291.561 0.9960 
1 1 1 1   8   12 o 14 1.30237e+01 6.22837e-01 1.97709e+02 94.196  -7.31513e-01 9.97113e+00  0.00000e+00 0.00000e+00 2.64662e+02 94.196  6.69535e+01 94.196  0.9486 
1 1 1 1   8   13 f 0  1.75386e+01 6.30177e-01 3.36484e+02 266.570 -2.00538e+00 -3.34608e+01 0.00000e+00 0.00000e+00 3.09587e+02 266.570 2.68967e+01 86.570  0.9850 
1 1 1 1   8   14 o 4  1.67895e+01 7.00581e-01 3.42418e+02 3.745   4.68797e+01  3.06839e+00  0.00000e+00 0.00000e+00 2.78291e+02 3.745   6.41271e+01 183.745 0.9893 
1 1 1 1   8   15 o 14 1.22270e+01 8.53216e-01 2.53047e+02 292.176 1.14923e+01  -2.81951e+01 0.00000e+00 0.00000e+00 1.95927e+02 292.176 5.71195e+01 112.176 0.9834 
1 1 1 1   8   16 o 14 7.82226e+00 1.28079e+00 2.29828e+02 169.150 -1.81626e+01 3.48119e+00  0.00000e+00 0.00000e+00 5.39746e+01 169.150 1.75854e+02 349.150 0.9726 
1 1 1 1   8   17 o 3  8.69153e+00 1.39099e+00 2.03925e+02 179.788 -1.94408e+01 7.18910e-02  0.00000e+00 0.00000e+00 1.11550e+02 179.788 9.23747e+01 359.788 0.9739 
1 1 1 1   8   18 o 3  6.34708e+00 1.61193e+00 7.53536e+01 347.824 5.02984e+00  -1.08529e+00 0.00000e+00 0.00000e+00 1.36528e+02 347.824 6.11741e+01 347.824 0.8967 
1 1 1 1   8   19 o 14 5.88296e+00 1.62777e+00 7.62659e+01 23.130  4.77185e+00  2.03834e+00  0.00000e+00 0.00000e+00 1.20113e+02 23.130  4.38466e+01 23.130  0.8976 
1 1 1 1   8   20 o 18 4.33761e+00 1.45508e+00 6.85293e+01 67.698  1.72618e+00  4.20840e+00  0.00000e+00 0.00000e+00 7.35444e+01 67.698  5.01505e+00 67.698  0.8817 
1 1 1 1   9   1  o 6  2.52234e+01 4.37005e-01 3.88305e+02 236.045 -1.03931e+00 -1.54345e+00 0.00000e+00 0.00000e+00 2.50005e+02 236.045 1.38299e+02 56.045  0.6735 
1 1 1 1   9   2  o 17 1.35933e+01 3.53840e-01 1.80865e+02 123.591 -3.67331e-01 5.53056e-01  0.00000e+00 0.00000e+00 2.00307e+01 303.591 2.00896e+02 303.591 0.3149 
1 1 1 1   9   3  o 1  3.51288e+01 6.01390e-01 6.11166e+02 149.919 -6.05137e+00 3.50523e+00  0.00000e+00 0.00000e+00 6.10128e+02 149.919 1.03856e+00 329.919 0.9255 
1 1 1 1   9   4  o 3  1.31489e+01 2.91360e-01 1.64361e+02 284.713 2.72155e-01  -1.03643e+00 0.00000e+00 0.00000e+00 6.83386e+01 284.713 9.60228e+01 104.713 0.4712 
1 1 1 1   9   5  f 0  2.17619e+01 4.11199e-01 3.11790e+02 303.021 2.05471e+00  -3.16148e+00 0.00000e+00 0.00000e+00 3.86153e+02 303.021 7.43627e+01 303.021 0.8541 
1 1 1 1   9   6  o 10 1.96315e+01 4.15528e-01 1.22499e+02 208.105 -1.65407e+00 -8.83391e-01 0.00000e+00 0.00000e+00 3.75821e+02 208.105 2.53322e+02 208.105 0.6762 
1 1 1 1   9   7  o 3  2.23763e+01 5.02608e-01 4.06049e+02 317.142 7.10642e+00  -6.59402e+00 0.00000e+00 0.00000e+00 3.89095e+02 317.142 1.69541e+01 137.142 0.9469 
1 1 1 1   9   8  o 9  2.75977e+01 5.56620e-01 4.72558e+02 193.436 -1.49745e+01 -3.57733e+00 0.00000e+00 0.00000e+00 5.28453e+02 193.436 5.58945e+01 193.436 0.9670 
1 1 1 1   9   9  o 14 3.39260e+01 7.61973e-01 4.46137e+02 45.053  1.64041e+01  1.64345e+01  0.00000e+00 0.00000e+00 7.98154e+02 45.053  3.52017e+02 45.053  0.9782 
1 1 1 1   9   10 o 10 2.06990e+01 4.79608e-01 4.28306e+02 8.339   1.90936e+01  2.79882e+00  0.00000e+00 0.00000e+00 3.26970e+02 8.339   1.01337e+02 188.339 0.9737 
1 1 1 1   9   11 o 18 2.30512e+01 5.45233e-01 3.66270e+02 169.674 -2.50834e+01 4.57024e+00  0.00000e+00 0.00000e+00 4.79901e+02 169.674 1.13631e+02 169.674 0.9802 
1 1 1 1   9   12 o 6  1.68397e+01 6.95335e-01 3.22002e+02 68.143  7.77798e+00  1.93904e+01  0.00000e+00 0.00000e+00 2.92960e+02 68.143  2.90418e+01 248.143 0.9758 
1 1 1 1   9   13 o 4  2.59894e+01 6.51679e-01 4.54305e+02 150.668 -5.82435e+01 3.27270e+01  0.00000e+00 0.00000e+00 5.10356e+02 150.668 5.60508e+01 150.668 0.9925 
1 1 1 1   9   14 o 10 6.03626e+00 1.13593e+00 1.57311e+02 336.896 6.35620e+00  -2.71166e+00 0.00000e+00 0.00000e+00 5.12316e+01 336.896 1.06080e+02 156.896 0.9245 
1 1 1 1   9   15 o 8  7.61436e+00 1.19211e+00 9.63289e+01 194.461 -6.19693e+00 -1.59814e+00 0.00000e+00 0.00000e+00 1.64703e+02 194.461 6.83744e+01 194.461 0.9182 
1 1 1 1   9   16 o 17 9.75452e+00 1.19200e+00 1.77832e+02 256.177 -4.30141e+00 -1.74818e+01 0.00000e+00 0.00000e+00 1.75792e+02 256.177 2.03959e+00 76.177  0.9718 
1 1 1 1   9   17 o 5  1.30171e+01 1.15533e+00 1.87621e+02 75.869  7.45217e+00  2.96008e+01  0.00000e+00 0.00000e+00 2.89481e+02 75.869  1.01859e+02 75.869  0.9835 
1 1 1 1   9   18 o 5  5.55607e+00 1.48144e+00 9.20575e+01 212.417 -5.05241e+00 -3.20847e+00 0.00000e+00 0.00000e+00 9.66143e+01 212.417 4.55687e+00 212.417 0.9121 
1 1 1 1   9   19 o 5  3.62412e+00 1.23726e+00 8.33306e+01 62.210  2.14368e+00  4.06754e+00  0.00000e+00 0.00000e+00 3.56953e+01 62.210  4.76352e+01 242.210 0.8831 
1 1 1 1   9   20 o 3  4.66403e+00 1.52409e+00 6.67681e+01 277.277 5.70121e-01  -4.46498e+00 0.00000e+00 0.00000e+00 8.57549e+01 277.277 1.89869e+01 277.277 0.8804 
1 1 1 1   10  0  o 2  3.72266e+00 2.06099e-01 3.57919e+01 244.568 -1.21916e-02 -2.56387e-02 0.00000e+00 0.00000e+00 3.38067e+01 64.568  6.95986e+01 64.568  0.0142 
1 1 1 1   10  1  f 0  1.42325e+01 2.77397e-01 2.93198e+02 0.598   7.09544e-01  7.40742e-03  0.00000e+00 0.00000e+00 1.14495e+02 180.598 4.07693e+02 180.598 0.3342 
1 1 1 1   10  2  o 16 2.95193e+01 5.10882e-01 6.19674e+02 326.714 5.18630e+00  -3.40493e+00 0.00000e+00 0.00000e+00 3.95557e+02 326.714 2.24117e+02 146.714 0.9154 
1 1 1 1   10  3  o 13 3.04365e+01 5.29579e-01 6.43583e+02 22.174  8.84457e+00  3.60475e+00  0.00000e+00 0.00000e+00 4.38158e+02 22.174  2.05425e+02 202.174 0.9461 
1 1 1 1   10  4  o 19 1.67894e+01 3.37608e-01 2.95608e+02 102.099 -5.04865e-01 2.35515e+00  0.00000e+00 0.00000e+00 1.80291e+02 102.099 1.15316e+02 282.099 0.7547 
1 1 1 1   10  5  o 5  2.56093e+01 4.69501e-01 6.54389e+02 231.589 -8.44404e+00 -1.06497e+01 0.00000e+00 0.00000e+00 2.71165e+02 231.589 3.83224e+02 51.590  0.9625 
1 1 1 1   10  6  o 8  6.63498e+00 3.12162e-01 7.83928e+01 198.965 -3.81355e-01 -1.31051e-01 0.00000e+00 0.00000e+00 2.91683e+01 18.965  1.07561e+02 18.965  0.1976 
1 1 1 1   10  7  o 18 3.21220e+01 6.59133e-01 6.33578e+02 299.572 1.06369e+01  -1.87457e+01 0.00000e+00 0.00000e+00 5.43518e+02 299.572 9.00598e+01 119.572 0.9765 
1 1 1 1   10  8  o 15 2.79309e+01 5.12775e-01 6.53625e+02 212.252 -1.82009e+01 -1.14848e+01 0.00000e+00 0.00000e+00 3.69425e+02 212.252 2.84200e+02 32.252  0.9765 
1 1 1 1   10  9  o 16 3.13305e+01 5.71412e-01 7.62377e+02 195.513 -3.55090e+01 -9.85608e+00 0.00000e+00 0.00000e+00 3.96220e+02 195.513 3.66157e+02 15.513  0.9863 
1 1 1 1   10  10 o 12 2.33483e+01 5.09668e-01 4.62607e+02 7.494   2.32543e+01  3.05884e+00  0.00000e+00 0.00000e+00 3.93436e+02 7.494   6.91706e+01 187.494 0.9784 
1 1 1 1   10  11 o 13 1.07139e+01 5.77085e-01 1.58408e+02 185.192 -5.08795e+00 -4.62314e-01 0.00000e+00 0.00000e+00 2.01032e+02 185.192 4.26247e+01 185.192 0.8958 
1 1 1 1   10  12 o 19 1.46710e+01 5.83470e-01 2.06971e+02 109.660 -4.38009e+00 1.22603e+01  0.00000e+00 0.00000e+00 3.20555e+02 109.660 1.13584e+02 109.660 0.9608 
1 1 1 1   10  13 o 3  1.83792e+01 6.33341e-01 3.95030e+02 62.479  1.90103e+01  3.64861e+01  0.00000e+00 0.00000e+00 2.83899e+02 62.479  1.11130e+02 242.479 0.9878 
1 1 1 1   10  14 o 1  3.84237e+00 1.09300e+00 1.67511e+02 346.154 4.60411e+00  -1.13481e+00 0.00000e+00 0.00000e+00 4.01493e+01 166.154 2.07660e+02 166.154 0.8870 
1 1 1 1   10  15 o 10 1.25590e+01 8.48652e-01 1.84058e+02 165.696 -2.20492e+01 5.62202e+00  0.00000e+00 0.00000e+00 2.74430e+02 165.696 9.03714e+01 165.696 0.9778 
1 1 1 1   10  16 o 10 6.24358e+00 1.24723e+00 1.23475e+02 222.393 -5.75654e+00 -5.25522e+00 0.00000e+00 0.00000e+00 9.39286e+01 222.393 2.95467e+01 42.393  0.9335 
1 1 1 1   10  17 o 11 4.52382e+00 1.33128e+00 5.27156e+01 236.081 -1.50897e+00 -2.24394e+00 0.00000e+00 0.00000e+00 7.97079e+01 236.081 2.69923e+01 236.081 0.7855 
1 1 1 1   10  18 o 7  4.57619e+00 1.36900e+00 1.07868e+02 163.192 -5.94232e+00 1.79496e+00  0.00000e+00 0.00000e+00 4.80942e+01 163.192 5.97739e+01 343.192 0.9155 
1 1 1 1   10  19 o 4  3.93717e+00 1.29269e+00 6.28619e+01 30.454  3.12312e+00  1.83628e+00  0.00000e+00 0.00000e+00 6.11914e+01 30.454  1.67054e+00 210.454 0.8473 
1 1 1 1   10  20 o 16 5.46367e+00 1.70212e+00 6.89858e+01 22.911  4.34703e+00  1.83720e+00  0.00000e+00 0.00000e+00 1.10915e+02 22.911  4.19290e+01 22.911  0.8864 
1 1 1 1   11  0  o 13 1.74785e+01 3.23915e-01 3.45966e+02 205.815 -1.01003e+00 -4.88599e-01 0.00000e+00 0.00000e+00 2.55415e+01 25.815  3.71508e+02 25.815  0.4880 
1 1 1 1   11  1  o 10 3.37860e+01 5.73532e-01 5.38340e+02 25.851  5.65041e+00  2.73769e+00  0.00000e+00 0.00000e+00 6.25008e+02 25.851  8.66680e+01 25.851  0.9165 
1 1 1 1   11  2  o 2  8.45793e+00 2.69421e-01 4.75383e+02 220.931 -9.65522e-01 -8.37283e-01 0.00000e+00 0.00000e+00 3.04979e+02 40.931  7.80361e+02 40.931  0.5363 
1 1 1 1   11  3  o 17 1.83223e+01 3.52248e-01 2.41392e+02 341.332 1.96888e+00  -6.65213e-01 0.00000e+00 0.00000e+00 2.47423e+02 341.332 6.03185e+00 341.332 0.7102 
1 1 1 1   11  4  o 12 1.57067e+01 3.27415e-01 2.42330e+02 275.607 2.47992e-01  -2.52607e+00 0.00000e+00 0.00000e+00 2.11365e+02 275.607 3.09652e+01 95.607  0.7691 
1 1 1 1   11  5  o 9  5.74256e+00 2.93532e-01 1.68903e+02 207.207 -6.91913e-01 -3.55707e-01 0.00000e+00 0.00000e+00 9.07909e+01 27.207  2.59694e+02 27.207  0.3623 
1 1 1 1   11  6  o 3  8.77264e+00 3.11983e-01 2.86674e+02 99.989  -3.35714e-01 1.90607e+00  0.00000e+00 0.00000e+00 6.04803e+01 279.989 3.47154e+02 279.989 0.6869 
1 1 1 1   11  7  o 16 1.87886e+01 4.81858e-01 1.28428e+02 267.584 -1.07690e-01 -2.55290e+00 0.00000e+00 0.00000e+00 4.15061e+02 267.584 2.86633e+02 267.584 0.7709 
1 1 1 1   11  8  o 13 1.79466e+01 4.94703e-01 3.16096e+02 327.595 5.89248e+00  -3.74014e+00 0.00000e+00 0.00000e+00 3.06778e+02 327.595 9.31781e+00 147.595 0.9253 
1 1 1 1   11  9  o 16 3.30771e+01 5.94589e-01 4.04264e+02 236.056 -1.14897e+01 -1.70700e+01 0.00000e+00 0.00000e+00 8.05311e+02 236.056 4.01047e+02 236.056 0.9754 
1 1 1 1   11  10 o 18 2.71643e+01 7.41572e-01 2.90680e+02 84.538  1.61093e+00  1.68481e+01  0.00000e+00 0.00000e+00 6.96643e+02 84.538  4.05963e+02 84.538  0.9700 
1 1 1 1   11  11 o 16 2.50975e+01 5.62517e-01 2.70916e+02 153.747 -1.83503e+01 9.05052e+00  0.00000e+00 0.00000e+00 6.45679e+02 153.747 3.74763e+02 153.747 0.9752 
1 1 1 1   11  12 o 13 2.22693e+01 9.90709e-01 4.32027e+02 60.162  1.94993e+01  3.39952e+01  0.00000e+00 0.00000e+00 3.90664e+02 60.162  4.13634e+01 240.162 0.9872 
1 1 1 1   11  13 o 5  1.56520e+01 6.58684e-01 2.45677e+02 156.609 -1.99076e+01 8.61121e+00  0.00000e+00 0.00000e+00 3.25996e+02 156.609 8.03192e+01 156.609 0.9767 
1 1 1 1   11  14 o 4  7.59731e+00 1.34559e+00 2.16934e+02 245.723 -4.39690e+00 -9.74843e+00 0.00000e+00 0.00000e+00 5.33373e+01 245.723 1.63596e+02 65.723  0.9520 
1 1 1 1   11  15 o 5  5.89104e+00 1.18797e+00 9.02077e+01 310.030 2.98373e+00  -3.55208e+00 0.00000e+00 0.00000e+00 1.04284e+02 310.030 1.40765e+01 310.030 0.8843 
1 1 1 1   11  16 o 3  1.28555e+01 1.03536e+00 2.98385e+02 256.814 -9.73014e+00 -4.15294e+01 0.00000e+00 0.00000e+00 1.75491e+02 256.814 1.22894e+02 76.814  0.9882 
1 1 1 1   11  17 o 14 5.17862e+00 1.29905e+00 6.62571e+01 311.212 2.62279e+00  -2.99469e+00 0.00000e+00 0.00000e+00 1.00246e+02 311.212 3.39890e+01 311.212 0.8628 
1 1 1 1   11  18 o 4  5.30335e+00 1.46962e+00 6.33595e+01 5.633   4.06666e+00  4.01114e-01  0.00000e+00 0.00000e+00 1.07765e+02 5.633   4.44051e+01 5.633   0.8668 
1 1 1 1   11  19 o 8  4.69513e+00 1.42840e+00 1.00509e+02 90.216  -2.35802e-02 6.24820e+00  0.00000e+00 0.00000e+00 5.94296e+01 90.216  4.10796e+01 270.216 0.9161 
1 1 1 1   11  20 o 3  3.75831e+00 1.30559e+00 7.59932e+01 154.433 -4.46245e+00 2.13490e+00  0.00000e+00 0.00000e+00 4.85470e+01 154.433 2.74463e+01 334.433 0.8921 
1 1 1 1   12  0  o 13 1.81248e+01 3.26397e-01 4.31674e+02 15.681  2.78157e+00  7.80880e-01  0.00000e+00 0.00000e+00 1.14052e+02 15.681  3.17622e+02 195.681 0.8014 
1 1 1 1   12  1  o 6  2.24414e+01 4.00195e-01 6.43271e+02 172.013 -4.45105e+00 6.24518e-01  0.00000e+00 0.00000e+00 9.88131e+01 172.013 5.44458e+02 352.013 0.8802 
1 1 1 1   12  2  o 16 1.54795e+01 3.66243e-01 2.82285e+02 221.676 -9.70435e-01 -8.63898e-01 0.00000e+00 0.00000e+00 3.31657e+01 221.676 2.49119e+02 41.676  0.5425 
1 1 1 1   12  3  f 0  1.46548e+01 3.42240e-01 1.77904e+02 180.773 -1.17743e+00 -1.58925e-02 0.00000e+00 0.00000e+00 1.00514e+02 180.773 7.73907e+01 0.773   0.5058 
1 1 1 1   12  4  o 1  1.89940e+01 4.55051e-01 2.85915e+02 356.282 3.52568e+00  -2.29074e-01 0.00000e+00 0.00000e+00 3.15311e+02 356.282 2.93966e+01 356.282 0.8428 
1 1 1 1   12  5  o 6  1.08078e+01 2.94967e-01 4.08086e+02 147.250 -2.93454e+00 1.88757e+00  0.00000e+00 0.00000e+00 6.69868e+01 327.250 4.75073e+02 327.250 0.8405 
1 1 1 1   12  6  o 7  1.08636e+01 3.13301e-01 2.49189e+02 320.569 1.59663e+00  -1.31292e+00 0.00000e+00 0.00000e+00 3.97245e+01 320.569 2.09464e+02 140.569 0.7085 
1 1 1 1   12  7  o 18 1.48413e+01 3.84985e-01 2.60478e+02 230.360 -2.60452e+00 -3.14383e+00 0.00000e+00 0.00000e+00 2.22142e+02 230.360 3.83364e+01 50.360  0.8666 
1 1 1 1   12  8  o 18 4.75095e+01 8.29512e-01 9.15481e+02 226.874 -3.61145e+01 -3.85574e+01 0.00000e+00 0.00000e+00 8.49549e+02 226.874 6.59319e+01 46.874  0.9905 
1 1 1 1   12  9  o 12 2.00693e+01 4.62563e-01 2.75878e+02 42.602  6.28415e+00  5.77894e+00  0.00000e+00 0.00000e+00 4.30973e+02 42.602  1.55096e+02 42.602  0.9395 
1 1 1 1   12  10 o 16 2.44695e+01 5.19987e-01 5.44746e+02 69.739  1.02559e+01  2.77831e+01  0.00000e+00 0.00000e+00 3.56499e+02 69.739  1.88247e+02 249.739 0.9830 
1 1 1 1   12  11 o 13 1.80767e+01 5.35364e-01 3.23289e+02 111.991 -6.29157e+00 1.55792e+01  0.00000e+00 0.00000e+00 3.33166e+02 111.991 9.87719e+00 111.991 0.9698 
1 1 1 1   12  12 o 15 1.68726e+01 5.90528e-01 2.11501e+02 17.427  1.45537e+01  4.56847e+00  0.00000e+00 0.00000e+00 3.98847e+02 17.427  1.87346e+02 17.427  0.9666 
1 1 1 1   12  13 o 12 2.59961e+00 8.54232e-01 2.44296e+01 330.536 3.05184e-01  -1.72414e-01 0.00000e+00 0.00000e+00 7.64851e+00 150.536 3.20781e+01 150.536 0.1726 
1 1 1 1   12  14 o 6  3.48738e+00 1.01637e+00 5.95488e+01 109.867 -5.05127e-01 1.39792e+00  0.00000e+00 0.00000e+00 1.76917e+01 109.867 4.18571e+01 289.867 0.5927 
1 1 1 1   12  15 f 0  2.69549e+00 9.03479e-01 1.12495e+02 303.822 1.70374e+00  -2.54291e+00 0.00000e+00 0.00000e+00 3.05400e+01 123.822 1.43036e+02 123.822 0.8144 
1 1 1 1   12  16 o 10 1.17613e+01 1.02944e+00 1.80346e+02 258.408 -4.74875e+00 -2.31511e+01 0.00000e+00 0.00000e+00 2.48973e+02 258.408 6.86272e+01 258.408 0.9786 
1 1 1 1   12  17 o 14 3.56877e+00 1.12288e+00 6.42188e+01 269.283 -3.66599e-02 -2.92753e+00 0.00000e+00 0.00000e+00 4.27699e+01 269.283 2.14489e+01 89.283  0.8045 
1 1 1 1   12  18 o 5  5.92827e+00 1.53715e+00 1.07373e+02 28.086  6.52758e+00  3.48333e+00  0.00000e+00 0.00000e+00 9.78058e+01 28.086  9.56725e+00 208.086 0.9297 
1 1 1 1   12  19 o 13 6.81351e+00 1.70825e+00 5.17483e+01 104.457 -9.58093e-01 3.71612e+00  0.00000e+00 0.00000e+00 1.65378e+02 104.457 1.13630e+02 104.457 0.8570 
1 1 1 1   12  20 o 10 5.65489e+00 1.70650e+00 1.17957e+02 217.255 -6.63860e+00 -5.04911e+00 0.00000e+00 0.00000e+00 7.90544e+01 217.255 3.89030e+01 37.255  0.9380 
1 1 1 1   13  0  o 8  1.64880e+01 3.20511e-01 3.71238e+02 50.550  1.27191e+00  1.54571e+00  0.00000e+00 0.00000e+00 6.11542e+01 50.550  3.10084e+02 230.550 0.6981 
1 1 1 1   13  1  o 18 2.20235e+01 3.94695e-01 4.67866e+02 154.901 -2.62863e+00 1.23127e+00  0.00000e+00 0.00000e+00 1.96130e+02 154.901 2.71737e+02 334.901 0.8025 
1 1 1 1   13  2  o 6  3.91217e+01 8.01720e-01 4.82096e+02 173.566 -5.20301e+00 5.86761e-01  0.00000e+00 0.00000e+00 8.38511e+02 173.566 3.56416e+02 173.566 0.8986 
1 1 1 1   13  3  o 17 3.87330e+01 6.61543e-01 7.28789e+02 98.192  -1.74019e+00 1.20879e+01  0.00000e+00 0.00000e+00 6.65199e+02 98.192  6.35900e+01 278.192 0.9581 
1 1 1 1   13  4  o 1  2.77698e+01 4.97968e-01 3.57216e+02 68.010  2.35739e+00  5.83764e+00  0.00000e+00 0.00000e+00 5.98840e+02 68.010  2.41624e+02 68.010  0.9167 
1 1 1 1   13  5  o 14 1.72665e+01 3.62330e-01 2.14258e+02 37.507  2.25479e+00  1.73062e+00  0.00000e+00 0.00000e+00 3.02839e+02 37.507  8.85807e+01 37.507  0.7976 
1 1 1 1   13  6  o 3  1.09345e+01 3.22616e-01 2.23135e+02 224.554 -1.49937e+00 -1.47623e+00 0.00000e+00 0.00000e+00 6.99767e+01 224.554 1.53159e+02 44.554  0.7142 
1 1 1 1   13  7  o 14 2.17315e+01 4.69437e-01 3.37731e+02 323.183 6.15517e+00  -4.60756e+00 0.00000e+00 0.00000e+00 4.22642e+02 323.183 8.49115e+01 323.183 0.9325 
1 1 1 1   13  8  o 10 1.02085e+01 4.00174e-01 2.17055e+02 100.725 -5.05533e-01 2.66908e+00  0.00000e+00 0.00000e+00 8.41340e+01 100.725 1.32921e+02 280.725 0.7866 
1 1 1 1   13  9  o 3  3.64167e+01 6.43683e-01 8.31677e+02 116.250 -2.52133e+01 5.11270e+01  0.00000e+00 0.00000e+00 5.21505e+02 116.250 3.10171e+02 296.250 0.9912 
1 1 1 1   13  10 o 7  1.76468e+01 4.86588e-01 3.89302e+02 227.182 -1.03743e+01 -1.11961e+01 0.00000e+00 0.00000e+00 2.49852e+02 227.182 1.39449e+02 47.182  0.9667 
1 1 1 1   13  11 o 9  1.06879e+01 5.84454e-01 2.97005e+02 311.245 5.98999e+00  -6.83149e+00 0.00000e+00 0.00000e+00 8.05009e+01 311.245 2.16504e+02 131.245 0.9432 
1 1 1 1   13  12 o 16 8.10502e+00 1.25888e+00 7.67307e+01 139.162 -1.82801e+00 1.58001e+00  0.00000e+00 0.00000e+00 1.52431e+02 139.162 7.57000e+01 139.162 0.7556 
1 1 1 1   13  13 o 18 4.31842e+00 1.08767e+00 4.45943e+01 67.469  3.88746e-01  9.37068e-01  0.00000e+00 0.00000e+00 2.83160e+01 67.469  1.62783e+01 247.469 0.4515 
1 1 1 1   13  14 o 14 1.91075e+01 6.87624e-01 4.46572e+02 209.210 -5.75603e+01 -3.21829e+01 0.00000e+00 0.00000e+00 2.61938e+02 209.210 1.84634e+02 29.210  0.9924 
1 1 1 1   13  15 o 13 1.44860e+01 8.40632e-01 3.16167e+02 306.228 2.78808e+01  -3.80555e+01 0.00000e+00 0.00000e+00 2.18875e+02 306.228 9.72918e+01 126.228 0.9893 
1 1 1 1   13  16 o 8  4.30660e+00 1.18953e+00 1.22060e+02 304.240 3.24361e+00  -4.76571e+00 0.00000e+00 0.00000e+00 2.38812e+01 304.240 9.81789e+01 124.240 0.9085 
1 1 1 1   13  17 o 13 8.96319e+00 1.26015e+00 1.64002e+02 83.088  2.09555e+00  1.72874e+01  0.00000e+00 0.00000e+00 1.60258e+02 83.088  3.74392e+00 263.088 0.9708 
1 1 1 1   13  18 o 11 6.56915e+00 1.54343e+00 1.15469e+02 110.810 -3.11831e+00 8.20489e+00  0.00000e+00 0.00000e+00 1.14683e+02 110.810 7.85447e-01 290.810 0.9412 
1 1 1 1   13  19 o 1  3.61253e+00 1.22804e+00 6.45516e+01 71.809  1.10822e+00  3.37240e+00  0.00000e+00 0.00000e+00 4.87768e+01 71.809  1.57748e+01 251.809 0.8437 
1 1 1 1   14  0  o 8  1.16634e+01 2.11734e-01 1.24204e+02 158.985 -3.94783e-01 1.51662e-01  0.00000e+00 0.00000e+00 3.35655e+01 338.985 1.57769e+02 338.985 0.2069 
1 1 1 1   14  1  o 9  1.37064e+01 2.61669e-01 6.94846e+02 153.054 -2.91731e+00 1.48297e+00  0.00000e+00 0.00000e+00 2.68360e+02 333.054 9.63206e+02 333.054 0.8283 
1 1 1 1   14  2  o 8  2.71392e+01 5.83755e-01 3.97644e+02 240.136 -1.93965e+00 -3.37808e+00 0.00000e+00 0.00000e+00 4.78471e+02 240.136 8.08273e+01 240.136 0.8594 
1 1 1 1   14  3  o 8  1.79644e+01 3.91822e-01 3.19169e+01 19.974  2.58055e-01  9.37939e-02  0.00000e+00 0.00000e+00 5.98552e+01 19.974  2.79382e+01 19.974  0.1360 
1 1 1 1   14  4  o 19 2.84776e+01 5.09281e-01 2.67950e+02 272.801 2.30818e-01  -4.71726e+00 0.00000e+00 0.00000e+00 6.80153e+02 272.801 4.12203e+02 272.801 0.8865 
1 1 1 1   14  5  o 6  7.56736e+00 2.90235e-01 6.20014e+01 261.143 -5.47264e-02 -3.51184e-01 0.00000e+00 0.00000e+00 1.22912e+01 81.143  7.42926e+01 81.143  0.1750 
1 1 1 1   14  6  o 19 2.39167e+01 4.61102e-01 2.55868e+02 264.172 -5.30445e-01 -5.19669e+00 0.00000e+00 0.00000e+00 5.50550e+02 264.172 2.94682e+02 264.172 0.8983 
1 1 1 1   14  7  o 10 1.19566e+01 3.54008e-01 2.43479e+02 132.910 -2.06977e+00 2.22653e+00  0.00000e+00 0.00000e+00 1.21202e+02 132.910 1.22277e+02 312.910 0.8129 
1 1 1 1   14  8  o 14 1.71435e+01 5.18219e-01 3.94826e+02 239.211 -4.52018e+00 -7.58608e+00 0.00000e+00 0.00000e+00 2.10561e+02 239.211 1.84265e+02 59.211  0.9416 
1 1 1 1   14  9  o 17 9.63460e+00 4.76152e-01 4.55027e+02 346.194 8.04692e+00  -1.97746e+00 0.00000e+00 0.00000e+00 1.16404e+02 166.194 5.71431e+02 166.194 0.9376 
1 1 1 1   14  10 o 9  1.75744e+01 5.37813e-01 2.06876e+02 233.290 -4.81102e+00 -6.45224e+00 0.00000e+00 0.00000e+00 4.09204e+02 233.290 2.02328e+02 233.290 0.9356 
1 1 1 1   14  11 o 13 2.83571e+01 9.63578e-01 3.98250e+02 28.709  2.74423e+01  1.50297e+01  0.00000e+00 0.00000e+00 6.46457e+02 28.709  2.48208e+02 28.709  0.9839 
1 1 1 1   14  12 o 18 1.25708e+01 6.60993e-01 3.12049e+02 217.868 -1.30959e+01 -1.01833e+01 0.00000e+00 0.00000e+00 1.43941e+02 217.868 1.68108e+02 37.868  0.9694 
1 1 1 1   14  13 o 15 1.59175e+01 6.56308e-01 2.39791e+02 239.211 -1.11048e+01 -1.86365e+01 0.00000e+00 0.00000e+00 3.41522e+02 239.211 1.01732e+02 239.211 0.9767 
1 1 1 1   14  14 o 13 2.54517e+01 7.13205e-01 4.13706e+02 109.116 -2.64813e+01 7.64042e+01  0.00000e+00 0.00000e+00 5.31351e+02 109.116 1.17645e+02 109.116 0.9938 
1 1 1 1   14  15 o 19 5.05907e+00 1.26941e+00 5.96499e+01 174.391 -2.63353e+00 2.58633e-01  0.00000e+00 0.00000e+00 8.76644e+01 174.391 2.80145e+01 174.391 0.7800 
1 1 1 1   14  16 o 14 9.91955e+00 1.16973e+00 9.85745e+01 153.753 -9.70472e+00 4.78525e+00  0.00000e+00 0.00000e+00 2.53868e+02 153.753 1.55293e+02 153.753 0.9526 
1 1 1 1   14  17 o 10 7.16039e+00 1.40934e+00 1.47961e+02 15.536  1.11100e+01  3.08855e+00  0.00000e+00 0.00000e+00 1.07002e+02 15.536  4.09595e+01 195.536 0.9556 
1 1 1 1   14  18 f 0  4.66926e+00 1.40409e+00 6.50264e+01 309.789 2.36473e+00  -2.83939e+00 0.00000e+00 0.00000e+00 8.28269e+01 309.789 1.78005e+01 309.789 0.8507 
1 1 1 1   14  19 f 0  9.54291e+00 1.65178e+00 1.21981e+02 310.024 8.58469e+00  -1.02220e+01 0.00000e+00 0.00000e+00 2.19290e+02 310.024 9.73097e+01 310.024 0.9618 
1 1 1 1   15  0  o 18 2.05909e+01 3.13713e-01 6.52452e+02 120.467 -2.39736e+00 4.07524e+00  0.00000e+00 0.00000e+00 3.33831e+01 120.467 6.19069e+02 300.467 0.8867 
1 1 1 1   15  1  o 17 2.41970e+01 3.99411e-01 6.72913e+02 310.178 3.29333e+00  -3.90016e+00 0.00000e+00 0.00000e+00 1.41296e+02 310.178 5.31617e+02 130.178 0.8958 
1 1 1 1   15  2  o 3  3.82591e+01 6.99530e-01 7.17543e+02 328.977 7.95967e+00  -4.78705e+00 0.00000e+00 0.00000e+00 6.39878e+02 328.977 7.76650e+01 148.977 0.9445 
1 1 1 1   15  3  o 3  3.47405e+01 6.01417e-01 5.04447e+02 174.147 -7.99872e+00 8.19943e-01  0.00000e+00 0.00000e+00 7.16315e+02 174.147 2.11868e+02 174.147 0.9356 
1 1 1 1   15  4  o 18 1.42096e+01 3.17100e-01 2.49147e+02 102.994 -6.43881e-01 2.79026e+00  0.00000e+00 0.00000e+00 1.77403e+02 102.994 7.17442e+01 282.994 0.7994 
1 1 1 1   15  5  o 14 6.93665e+00 3.05687e-01 1.14907e+02 42.863  4.35843e-01  4.04491e-01  0.00000e+00 0.00000e+00 4.07111e+01 222.863 1.55618e+02 222.863 0.2849 
1 1 1 1   15  6  o 14 1.92245e+01 4.85964e-01 1.63196e+02 70.573  8.82669e-01  2.50276e+00  0.00000e+00 0.00000e+00 4.00149e+02 70.573  2.36953e+02 70.573  0.7807 
1 1 1 1   15  7  o 9  1.31952e+01 3.58813e-01 2.98878e+02 68.787  1.48223e+00  3.81891e+00  0.00000e+00 0.00000e+00 1.30417e+02 68.787  1.68462e+02 248.787 0.8671 
1 1 1 1   15  8  o 19 1.28162e+01 3.96433e-01 8.89701e+01 93.158  -8.19249e-02 1.48504e+00  0.00000e+00 0.00000e+00 1.96046e+02 93.158  1.07076e+02 93.158  0.5930 
1 1 1 1   15  9  o 11 2.70986e+01 5.48638e-01 4.78364e+02 268.517 -6.30968e-01 -2.43672e+01 0.00000e+00 0.00000e+00 5.16386e+02 268.517 3.80217e+01 268.517 0.9793 
1 1 1 1   15  10 o 10 2.63882e+01 1.07911e+00 3.66240e+02 247.685 -8.63580e+00 -2.10409e+01 0.00000e+00 0.00000e+00 6.00421e+02 247.685 2.34181e+02 247.685 0.9778 
1 1 1 1   15  11 o 19 2.21939e+01 5.60194e-01 4.11788e+02 49.075  1.71034e+01  1.97272e+01  0.00000e+00 0.00000e+00 4.03143e+02 49.075  8.64498e+00 229.075 0.9807 
1 1 1 1   15  12 o 12 2.61460e+01 6.27248e-01 4.23070e+02 203.910 -4.28474e+01 -1.89959e+01 0.00000e+00 0.00000e+00 5.44771e+02 203.910 1.21700e+02 203.910 0.9893 
1 1 1 1   15  13 o 3  5.20089e+00 1.16824e+00 7.64564e+01 108.637 -6.96617e-01 2.06557e+00  0.00000e+00 0.00000e+00 6.45725e+01 108.637 1.18839e+01 288.637 0.7252 
1 1 1 1   15  14 o 17 8.89544e+00 9.91117e-01 1.03759e+02 218.491 -5.63150e+00 -4.47808e+00 0.00000e+00 0.00000e+00 2.04544e+02 218.491 1.00785e+02 218.491 0.9276 
1 1 1 1   15  15 o 3  1.39420e+01 8.52175e-01 2.66708e+02 272.243 1.44371e+00  -3.68582e+01 0.00000e+00 0.00000e+00 2.46643e+02 272.243 2.00656e+01 92.243  0.9864 
1 1 1 1   15  16 o 7  4.73046e+00 1.17734e+00 1.25493e+02 55.030  3.74888e+00  5.35984e+00  0.00000e+00 0.00000e+00 3.68249e+01 55.030  8.86678e+01 235.029 0.9200 
1 1 1 1   15  17 f 0  1.06725e+01 1.16339e+00 2.21353e+02 344.469 2.84547e+01  -7.90803e+00 0.00000e+00 0.00000e+00 1.69514e+02 344.469 5.18390e+01 164.469 0.9829 
1 1 1 1   15  18 o 18 6.88658e+00 1.50195e+00 9.32588e+01 325.343 6.03761e+00  -4.17395e+00 0.00000e+00 0.00000e+00 1.44910e+02 325.343 5.16509e+01 325.343 0.9291 
1 1 1 1   15  19 o 14 8.02088e+00 1.65724e+00 3.69338e+01 133.347 -2.32198e+00 2.46001e+00  0.00000e+00 0.00000e+00 2.12007e+02 133.347 1.75074e+02 133.347 0.8347 
1 1 1 1   16  0  o 3  2.53213e+01 4.00011e-01 5.75234e+02 90.707  -5.71999e-02 4.63640e+00  0.00000e+00 0.00000e+00 2.65790e+02 90.707  3.09444e+02 270.707 0.8842 
1 1 1 1   16  1  o 14 2.17469e+01 3.42835e-01 2.57638e+02 50.617  1.02225e+00  1.24525e+00  0.00000e+00 0.00000e+00 2.50813e+02 50.617  6.82531e+00 230.617 0.6224 
1 1 1 1   16  2  o 19 2.24661e+01 4.11925e-01 5.10837e+02 247.050 -2.21347e+00 -5.22721e+00 0.00000e+00 0.00000e+00 2.54567e+02 247.050 2.56271e+02 67.050  0.9070 
1 1 1 1   16  3  o 19 3.80181e+01 6.54613e-01 7.40696e+02 133.761 -8.57446e+00 8.95354e+00  0.00000e+00 0.00000e+00 6.28311e+02 133.761 1.12385e+02 313.761 0.9588 
1 1 1 1   16  4  o 13 3.30772e+01 5.81333e-01 7.14918e+02 94.011  -1.29946e+00 1.85313e+01  0.00000e+00 0.00000e+00 4.93255e+02 94.011  2.21663e+02 274.011 0.9727 
1 1 1 1   16  5  o 17 7.27343e+00 3.03906e-01 3.70121e+02 336.346 1.89709e+00  -8.30964e-01 0.00000e+00 0.00000e+00 1.76490e+02 156.346 5.46611e+02 156.346 0.7091 
1 1 1 1   16  6  o 1  2.59131e+01 4.92185e-01 6.09158e+02 90.116  -2.84173e-02 1.40600e+01  0.00000e+00 0.00000e+00 3.28138e+02 90.116  2.81020e+02 270.116 0.9638 
1 1 1 1   16  7  o 10 2.76186e+01 5.26615e-01 5.60692e+02 46.955  1.27214e+01  1.36204e+01  0.00000e+00 0.00000e+00 4.47299e+02 46.955  1.13393e+02 226.955 0.9728 
1 1 1 1   16  8  o 7  2.95604e+01 5.65513e-01 5.59514e+02 299.532 1.05596e+01  -1.86401e+01 0.00000e+00 0.00000e+00 5.22871e+02 299.532 3.66434e+01 119.532 0.9764 
1 1 1 1   16  9  f 0  3.08365e+01 7.19684e-01 8.21240e+02 34.336  3.64517e+01  2.48996e+01  0.00000e+00 0.00000e+00 3.21467e+02 34.336  4.99773e+02 214.336 0.9886 
1 1 1 1   16  10 o 3  3.38644e+01 6.38832e-01 6.49471e+02 81.266  8.11471e+00  5.28226e+01  0.00000e+00 0.00000e+00 6.07293e+02 81.266  4.21784e+01 261.266 0.9906 
1 1 1 1   16  11 f 0  1.00505e+01 1.44147e+00 2.65837e+02 215.757 -6.30289e+00 -4.53867e+00 0.00000e+00 0.00000e+00 8.53317e+01 215.757 1.80505e+02 35.757  0.9332 
1 1 1 1   16  12 o 18 8.53562e+00 8.41632e-01 1.53974e+02 117.973 -2.62664e+00 4.94558e+00  0.00000e+00 0.00000e+00 1.35267e+02 117.973 1.87069e+01 297.973 0.9057 
1 1 1 1   16  13 o 1  3.44860e+01 7.31433e-01 5.85358e+02 119.836 -6.00870e+01 1.04765e+02  0.00000e+00 0.00000e+00 6.98704e+02 119.836 1.13346e+02 119.836 0.9959 
1 1 1 1   16  14 o 10 2.12780e+01 6.98906e-01 4.01982e+02 49.647  4.64589e+01  5.46806e+01  0.00000e+00 0.00000e+00 3.87406e+02 49.647  1.45764e+01 229.647 0.9930 
1 1 1 1   16  15 o 1  1.21975e+01 9.05092e-01 2.32275e+02 75.892  6.72889e+00  2.67723e+01  0.00000e+00 0.00000e+00 2.14714e+02 75.892  1.75615e+01 255.892 0.9817 
1 1 1 1   16  16 o 1  7.49257e+00 1.17544e+00 9.73810e+01 314.093 5.62854e+00  -5.80969e+00 0.00000e+00 0.00000e+00 1.64162e+02 314.093 6.67809e+01 314.093 0.9360 
1 1 1 1   16  17 o 3  7.49293e+00 1.35442e+00 1.16420e+02 304.250 5.51534e+00  -8.10046e+00 0.00000e+00 0.00000e+00 1.48104e+02 304.250 3.16833e+01 304.250 0.9475 
1 1 1 1   16  18 o 14 3.80881e+00 1.23449e+00 8.13632e+01 341.186 3.96842e+00  -1.35201e+00 0.00000e+00 0.00000e+00 4.20477e+01 341.186 3.93155e+01 161.186 0.8705 
1 1 1 1   16  19 o 18 5.42448e+00 1.57720e+00 8.13422e+01 200.245 -4.99994e+00 -1.84407e+00 0.00000e+00 0.00000e+00 1.00270e+02 200.245 1.89280e+01 200.245 0.9005 
1 1 1 1   17  0  o 18 2.23319e+01 3.91881e-01 3.60888e+02 187.458 -2.31643e+00 -3.03219e-01 0.00000e+00 0.00000e+00 2.64821e+02 187.458 9.60671e+01 7.458   0.7459 
1 1 1 1   17  1  o 15 3.11766e+01 4.51173e-01 6.65184e+02 285.313 2.00925e+00  -7.33777e+00 0.00000e+00 0.00000e+00 4.25949e+02 285.313 2.39235e+02 105.314 0.9318 
1 1 1 1   17  2  o 6  1.86274e+01 3.59540e-01 2.66470e+02 140.933 -1.79485e+00 1.45693e+00  0.00000e+00 0.00000e+00 2.53277e+02 140.933 1.31929e+01 320.933 0.7429 
1 1 1 1   17  3  o 7  4.16998e+01 7.14813e-01 7.21123e+02 25.701  1.36693e+01  6.57886e+00  0.00000e+00 0.00000e+00 7.92418e+02 25.701  7.12953e+01 25.701  0.9665 
1 1 1 1   17  4  o 1  1.88643e+01 3.78601e-01 4.04603e+02 115.293 -2.50370e+00 5.29835e+00  0.00000e+00 0.00000e+00 2.40078e+02 115.293 1.64525e+02 295.293 0.9101 
1 1 1 1   17  5  o 14 1.20162e+01 3.78498e-01 3.82896e+02 265.967 -2.44956e-01 -3.47392e+00 0.00000e+00 0.00000e+00 3.89353e+00 85.967  3.86790e+02 85.967  0.8402 
1 1 1 1   17  6  o 6  2.85680e+01 5.31246e-01 4.98825e+02 46.654  8.62781e+00  9.14075e+00  0.00000e+00 0.00000e+00 5.29741e+02 46.654  3.09165e+01 46.654  0.9594 
1 1 1 1   17  7  o 4  1.86812e+01 6.75638e-01 1.83275e+02 345.981 3.95973e+00  -9.88634e-01 0.00000e+00 0.00000e+00 4.24061e+02 345.981 2.40786e+02 345.981 0.8666 
1 1 1 1   17  8  o 9  5.40639e+01 9.37734e-01 1.17714e+03 204.639 -7.29602e+01 -3.34635e+01 0.00000e+00 0.00000e+00 8.37606e+02 204.639 3.39531e+02 24.639  0.9938 
1 1 1 1   17  9  o 6  2.42366e+01 5.20606e-01 4.74663e+02 300.346 1.01858e+01  -1.73989e+01 0.00000e+00 0.00000e+00 4.10959e+02 300.346 6.37038e+01 120.346 0.9749 
1 1 1 1   17  10 o 12 3.57682e+01 9.74400e-01 4.35372e+02 18.378  3.49764e+01  1.16203e+01  0.00000e+00 0.00000e+00 8.86273e+02 18.378  4.50902e+02 18.378  0.9863 
1 1 1 1   17  11 o 4  8.29970e+00 7.18054e-01 1.88293e+02 212.885 -4.16192e+00 -2.69091e+00 0.00000e+00 0.00000e+00 8.89949e+01 212.885 9.92978e+01 32.885  0.8924 
1 1 1 1   17  12 o 9  4.03588e+01 7.76057e-01 5.63964e+02 110.325 -3.39229e+01 9.15806e+01  0.00000e+00 0.00000e+00 9.38303e+02 110.325 3.74339e+02 110.325 0.9949 
1 1 1 1   17  13 f 0  7.91038e+00 9.71196e-01 2.42188e+02 13.310  1.06511e+01  2.51982e+00  0.00000e+00 0.00000e+00 3.97112e+01 13.310  2.02476e+02 193.310 0.9532 
1 1 1 1   17  14 o 14 9.04213e+00 1.40750e+00 1.75271e+02 11.091  1.06906e+01  2.09563e+00  0.00000e+00 0.00000e+00 1.46630e+02 11.091  2.86412e+01 191.091 0.9529 
1 1 1 1   17  15 o 14 4.13938e+00 1.16459e+00 9.03420e+01 346.299 3.22227e+00  -7.85567e-01 0.00000e+00 0.00000e+00 3.80434e+01 346.299 5.22986e+01 166.299 0.8309 
1 1 1 1   17  16 o 6  4.82623e+00 1.23390e+00 4.66524e+01 258.855 -4.68618e-01 -2.37863e+00 0.00000e+00 0.00000e+00 8.95080e+01 258.855 4.28557e+01 258.855 0.7565 
1 1 1 1   17  17 o 8  4.15950e+00 1.25067e+00 3.32803e+01 70.088  5.80369e-01  1.60223e+00  0.00000e+00 0.00000e+00 6.63178e+01 70.088  3.30375e+01 70.088  0.6427 
1 1 1 1   17  18 o 15 4.28917e+00 1.34497e+00 5.72564e+01 235.067 -1.80478e+00 -2.58389e+00 0.00000e+00 0.00000e+00 7.37429e+01 235.067 1.64865e+01 235.067 0.8206 
1 1 1 1   17  19 o 18 5.33145e+00 1.53797e+00 6.24848e+01 341.893 4.05942e+00  -1.32740e+00 0.00000e+00 0.00000e+00 1.10592e+02 341.893 4.81074e+01 341.893 0.8732 
1 1 1 1   18  0  o 12 3.03081e+01 4.94375e-01 5.18476e+02 123.497 -3.18893e+00 4.81848e+00  0.00000e+00 0.00000e+00 5.16034e+02 123.497 2.44278e+00 303.497 0.9088 
1 1 1 1   18  1  o 13 1.59913e+01 2.70316e-01 1.94509e+02 140.686 -8.17333e-01 6.69306e-01  0.00000e+00 0.00000e+00 8.53997e+01 140.686 1.09109e+02 320.686 0.4660 
1 1 1 1   18  2  o 13 3.25071e+01 5.22969e-01 4.87860e+02 64.042  3.04541e+00  6.25564e+00  0.00000e+00 0.00000e+00 6.41549e+02 64.042  1.53689e+02 64.042  0.9251 
1 1 1 1   18  3  o 2  2.02984e+01 3.92256e-01 5.32438e+02 311.036 3.45142e+00  -3.96532e+00 0.00000e+00 0.00000e+00 1.52872e+02 311.036 3.79566e+02 131.036 0.8990 
1 1 1 1   18  4  o 18 2.02798e+01 3.98698e-01 1.94727e+02 234.294 -1.32217e+00 -1.83961e+00 0.00000e+00 0.00000e+00 3.66383e+02 234.294 1.71657e+02 234.294 0.7369 
1 1 1 1   18  5  o 17 1.63325e+01 3.62186e-01 1.29466e+02 294.417 6.51481e-01  -1.43503e+00 0.00000e+00 0.00000e+00 2.47202e+02 294.417 1.17736e+02 294.417 0.6144 
1 1 1 1   18  6  o 13 2.43917e+01 4.74357e-01 5.19389e+02 147.313 -1.02651e+01 6.58686e+00  0.00000e+00 0.00000e+00 3.57606e+02 147.313 1.61783e+02 327.313 0.9581 
1 1 1 1   18  7  f 0  7.59619e+00 4.42148e-01 1.90361e+02 293.985 7.00827e-01  -1.57515e+00 0.00000e+00 0.00000e+00 6.03467e+00 113.985 1.96395e+02 113.985 0.6468 
1 1 1 1   18  8  o 5  3.09604e+01 5.90051e-01 6.68211e+02 93.034  -1.39336e+00 2.62923e+01  0.00000e+00 0.00000e+00 4.70495e+02 93.034  1.97716e+02 273.033 0.9808 
1 1 1 1   18  9  o 2  4.18364e+01 7.59575e-01 6.11452e+02 297.623 2.01093e+01  -3.84277e+01 0.00000e+00 0.00000e+00 9.38415e+02 297.623 3.26963e+02 297.623 0.9884 
1 1 1 1   18  10 o 6  1.34453e+01 7.90820e-01 1.85904e+02 208.943 -5.18009e+00 -2.86464e+00 0.00000e+00 0.00000e+00 2.72980e+02 208.943 8.70758e+01 208.943 0.9111 
1 1 1 1   18  11 f 0  3.39248e+01 6.72316e-01 5.12016e+02 206.741 -4.77708e+01 -2.40693e+01 0.00000e+00 0.00000e+00 7.46126e+02 206.741 2.34110e+02 206.741 0.9906 
1 1 1 1   18  12 o 17 6.19421e+00 1.03942e+00 3.92884e+01 57.861  5.34141e-01  8.50223e-01  0.00000e+00 0.00000e+00 6.44948e+01 57.861  2.52065e+01 57.861  0.4478 
1 1 1 1   18  13 o 14 1.59947e+01 6.71104e-01 3.13694e+02 338.440 2.87371e+01  -1.13548e+01 0.00000e+00 0.00000e+00 2.74526e+02 338.440 3.91684e+01 158.440 0.9837 
1 1 1 1   18  14 o 16 9.07062e+00 9.40180e-01 1.12807e+02 245.105 -3.44205e+00 -7.41688e+00 0.00000e+00 0.00000e+00 2.04588e+02 245.105 9.17812e+01 245.105 0.9367 
1 1 1 1   18  15 o 14 2.16819e+01 7.19204e-01 2.83248e+02 261.617 -9.74006e+00 -6.60952e+01 0.00000e+00 0.00000e+00 5.19949e+02 261.617 2.36701e+02 261.617 0.9925 
1 1 1 1   18  16 o 8  1.18774e+01 9.64194e-01 2.82329e+02 144.319 -3.44357e+01 2.47271e+01  0.00000e+00 0.00000e+00 1.55337e+02 144.319 1.26992e+02 324.319 0.9881 
1 1 1 1   18  17 o 13 4.89192e+00 1.41363e+00 1.08579e+02 14.248  5.76056e+00  1.46282e+00  0.00000e+00 0.00000e+00 5.75356e+01 14.248  5.10437e+01 194.248 0.9115 
1 1 1 1   18  18 o 3  7.99921e+00 1.54545e+00 1.33317e+02 110.401 -4.18865e+00 1.12625e+01  0.00000e+00 0.00000e+00 1.51718e+02 110.401 1.84014e+01 110.401 0.9574 
1 1 1 1   18  19 o 12 6.85375e+00 1.81106e+00 1.23210e+02 280.968 1.69051e+00  -8.72268e+00 0.00000e+00 0.00000e+00 1.16788e+02 280.968 6.42251e+00 100.968 0.9419 
1 1 1 1   19  0  o 9  2.76407e+01 4.66180e-01 7.32698e+02 199.004 -6.48523e+00 -2.23349e+00 0.00000e+00 0.00000e+00 2.26451e+02 199.004 5.06247e+02 19.004  0.9239 
1 1 1 1   19  1  o 16 2.96423e+01 4.33869e-01 2.02637e+02 54.357  1.71311e+00  2.38909e+00  0.00000e+00 0.00000e+00 6.94066e+02 54.357  4.91429e+02 54.357  0.8054 
1 1 1 1   19  2  o 16 1.49870e+01 2.86092e-01 3.99502e+01 308.486 1.78021e-01  -2.23918e-01 0.00000e+00 0.00000e+00 3.97427e+01 308.486 2.07473e-01 128.486 0.1416 
1 1 1 1   19  3  o 11 2.38836e+01 4.43756e-01 4.64118e+02 245.048 -3.07160e+00 -6.60139e+00 0.00000e+00 0.00000e+00 3.68673e+02 245.048 9.54450e+01 65.048  0.9285 
1 1 1 1   19  4  o 13 2.38842e+01 4.49239e-01 5.10578e+02 211.568 -5.80893e+00 -3.56915e+00 0.00000e+00 0.00000e+00 3.17511e+02 211.568 1.93067e+02 31.568  0.9234 
1 1 1 1   19  5  o 6  7.97816e+00 3.51424e-01 1.60374e+02 244.071 -4.84274e-01 -9.96039e-01 0.00000e+00 0.00000e+00 1.56700e+01 64.071  1.76044e+02 64.071  0.4832 
1 1 1 1   19  6  o 16 1.45027e+01 3.62085e-01 3.59920e+02 271.857 1.61580e-01  -4.98413e+00 0.00000e+00 0.00000e+00 1.26111e+02 271.857 2.33809e+02 91.857  0.8931 
1 1 1 1   19  7  o 1  1.06345e+01 3.63970e-01 1.49317e+02 155.299 -1.59795e+00 7.35023e-01  0.00000e+00 0.00000e+00 1.11552e+02 155.299 3.77654e+01 335.299 0.6539 
1 1 1 1   19  8  o 3  3.09679e+01 8.50080e-01 4.12076e+02 324.025 1.35239e+01  -9.81648e+00 0.00000e+00 0.00000e+00 7.13818e+02 324.025 3.01743e+02 324.025 0.9696 
1 1 1 1   19  9  o 18 4.14559e+01 7.55143e-01 8.83279e+02 145.869 -5.12376e+01 3.47309e+01  0.00000e+00 0.00000e+00 6.57829e+02 145.869 2.25451e+02 325.869 0.9919 
1 1 1 1   19  10 o 2  5.74347e+00 8.28203e-01 1.12274e+02 303.880 8.47630e-01  -1.26235e+00 0.00000e+00 0.00000e+00 1.70616e+01 303.880 9.52123e+01 123.880 0.6012 
1 1 1 1   19  11 o 14 1.12500e+01 9.63467e-01 2.33704e+02 226.770 -5.38750e+00 -5.73103e+00 0.00000e+00 0.00000e+00 1.59689e+02 226.770 7.40151e+01 46.770  0.9341 
1 1 1 1   19  12 o 16 2.80992e+01 6.58296e-01 5.26786e+02 349.340 6.61497e+01  -1.24511e+01 0.00000e+00 0.00000e+00 5.16598e+02 349.340 1.01874e+01 169.340 0.9925 
1 1 1 1   19  13 o 14 5.65615e+00 1.00711e+00 1.92677e+02 76.384  1.48138e+00  6.11573e+00  0.00000e+00 0.00000e+00 1.15437e+00 76.384  1.91523e+02 256.384 0.9167 
1 1 1 1   19  14 o 9  7.82709e+00 1.31540e+00 1.39190e+02 269.462 -7.24131e-02 -7.71994e+00 0.00000e+00 0.00000e+00 1.33537e+02 269.462 5.65258e+00 89.463  0.9328 
1 1 1 1   19  15 o 6  6.72178e+00 1.32363e+00 9.98225e+01 213.076 -4.88626e+00 -3.18236e+00 0.00000e+00 0.00000e+00 1.28390e+02 213.076 2.85671e+01 213.076 0.9097 
1 1 1 1   19  16 o 9  9.68848e+00 1.12350e+00 1.60765e+02 148.665 -1.55872e+01 9.49016e+00  0.00000e+00 0.00000e+00 1.90469e+02 148.665 2.97042e+01 148.665 0.9722 
1 1 1 1   19  17 o 9  9.05717e+00 1.24643e+00 2.12468e+02 287.777 7.24107e+00  -2.25847e+01 0.00000e+00 0.00000e+00 1.17749e+02 287.777 9.47192e+01 107.777 0.9787 
1 1 1 1   19  18 o 5  4.22471e+00 1.32843e+00 4.27353e+01 173.345 -2.20160e+00 2.56869e-01  0.00000e+00 0.00000e+00 7.20862e+01 173.345 2.93509e+01 173.345 0.7303 
1 1 1 1   19  19 o 4  4.85651e+00 1.50853e+00 8.84303e+01 235.636 -3.17212e+00 -4.63897e+00 0.00000e+00 0.00000e+00 7.51398e+01 235.636 1.32905e+01 55.636  0.9060 
1 1 1 1   20  0  o 12 3.65303e+01 5.94336e-01 5.14221e+02 51.284  5.71037e+00  7.12357e+00  0.00000e+00 0.00000e+00 7.80236e+02 51.284  2.66016e+02 51.284  0.9435 
1 1 1 1   20  1  o 1  2.45362e+01 3.72102e-01 8.23688e+02 324.555 7.51748e+00  -5.35121e+00 0.00000e+00 0.00000e+00 4.63354e+01 324.555 7.77352e+02 144.555 0.9442 
1 1 1 1   20  2  o 18 1.65002e+01 3.26047e-01 2.92366e+02 346.969 2.12642e+00  -4.92121e-01 0.00000e+00 0.00000e+00 1.57253e+02 346.969 1.35114e+02 166.969 0.7256 
1 1 1 1   20  3  o 17 2.52974e+01 4.65894e-01 5.37910e+02 37.545  6.82018e+00  5.24184e+00  0.00000e+00 0.00000e+00 3.54956e+02 37.545  1.82955e+02 217.545 0.9399 
1 1 1 1   20  4  o 8  1.23557e+01 3.11811e-01 3.83364e+02 334.348 3.44710e+00  -1.65540e+00 0.00000e+00 0.00000e+00 1.38996e+01 334.348 3.69464e+02 154.348 0.8564 
1 1 1 1   20  5  o 15 1.82637e+01 3.88295e-01 9.74955e+01 228.128 -1.01235e+00 -1.12940e+00 0.00000e+00 0.00000e+00 3.13980e+02 228.128 2.16485e+02 228.128 0.6002 
1 1 1 1   20  6  o 2  8.21148e+00 3.51662e-01 3.30208e+01 271.842 8.25068e-03  -2.56534e-01 0.00000e+00 0.00000e+00 6.19969e+00 271.842 2.68211e+01 91.842  0.1273 
1 1 1 1   20  7  o 2  2.61996e+01 7.34690e-01 4.17321e+02 109.944 -4.07368e+00 1.12266e+01  0.00000e+00 0.00000e+00 5.23344e+02 109.944 1.06023e+02 109.944 0.9572 
1 1 1 1   20  8  o 18 2.23665e+01 5.86892e-01 2.73257e+02 353.853 8.00061e+00  -8.61652e-01 0.00000e+00 0.00000e+00 5.11382e+02 353.853 2.38125e+02 353.853 0.9356 
1 1 1 1   20  9  o 4  4.37260e+01 8.42571e-01 9.25345e+02 191.527 -6.65077e+01 -1.35641e+01 0.00000e+00 0.00000e+00 7.01242e+02 191.527 2.24104e+02 11.527  0.9926 
1 1 1 1   20  10 o 2  1.89596e+01 7.66803e-01 2.37412e+02 79.632  2.13635e+00  1.16767e+01  0.00000e+00 0.00000e+00 4.42142e+02 79.632  2.04731e+02 79.632  0.9569 
1 1 1 1   20  11 o 8  3.91162e+01 7.65070e-01 7.39759e+02 42.583  6.70749e+01  6.16408e+01  0.00000e+00 0.00000e+00 7.16454e+02 42.583  2.33058e+01 222.582 0.9945 
1 1 1 1   20  12 o 9  3.47803e+01 7.20562e-01 5.26310e+02 79.393  1.51787e+01  8.10514e+01  0.00000e+00 0.00000e+00 7.66874e+02 79.393  2.40564e+02 79.393  0.9939 
1 1 1 1   20  13 o 15 1.19691e+01 9.67168e-01 1.25329e+02 324.701 7.78637e+00  -5.51292e+00 0.00000e+00 0.00000e+00 2.97960e+02 324.701 1.72631e+02 324.701 0.9460 
1 1 1 1   20  14 o 1  7.16508e+00 1.18098e+00 9.96329e+01 62.243  2.57717e+00  4.89703e+00  0.00000e+00 0.00000e+00 1.42429e+02 62.243  4.27962e+01 62.243  0.9044 
1 1 1 1   20  15 o 7  8.28999e+00 9.98199e-01 1.87928e+02 250.724 -4.81021e+00 -1.37541e+01 0.00000e+00 0.00000e+00 1.10650e+02 250.724 7.72780e+01 70.724  0.9651 
1 1 1 1   20  16 o 16 6.71249e+00 1.33496e+00 1.30865e+02 93.338  -5.37890e-01 9.22147e+00  0.00000e+00 0.00000e+00 1.05462e+02 93.338  2.54025e+01 273.338 0.9442 
1 1 1 1   20  17 o 3  1.65826e+01 9.50171e-01 2.32970e+02 143.059 -4.19645e+01 3.15543e+01  0.00000e+00 0.00000e+00 3.78841e+02 143.059 1.45871e+02 143.059 0.9904 
1 1 1 1   20  18 o 1  1.51854e+01 1.22550e+00 2.50272e+02 53.830  2.92686e+01  4.00346e+01  0.00000e+00 0.00000e+00 3.09093e+02 53.830  5.88211e+01 53.830  0.9899 
1 1 1 1   20  19 o 12 4.63228e+00 1.45696e+00 2.47151e+01 192.086 -1.47143e+00 -3.15078e-01 0.00000e+00 0.00000e+00 7.81379e+01 192.086 5.34228e+01 192.086 0.5973 
1 1 1 1   21  0  o 10 3.89838e+01 5.82661e-01 6.77389e+02 221.269 -8.97219e+00 -7.87369e+00 0.00000e+00 0.00000e+00 7.23870e+02 221.269 4.64812e+01 221.269 0.9572 
1 1 1 1   21  1  o 11 3.47221e+01 4.99800e-01 8.97015e+02 160.732 -1.44408e+01 5.04819e+00  0.00000e+00 0.00000e+00 3.63577e+02 160.732 5.33437e+02 340.731 0.9667 
1 1 1 1   21  2  o 8  3.96751e+01 6.06521e-01 6.78924e+02 18.694  1.30594e+01  4.41871e+00  0.00000e+00 0.00000e+00 7.55868e+02 18.694  7.69448e+01 18.694  0.9630 
1 1 1 1   21  3  o 9  1.59958e+01 3.29961e-01 1.77532e+02 66.534  9.22760e-01  2.12563e+00  0.00000e+00 0.00000e+00 2.69063e+02 66.534  9.15308e+01 66.534  0.7436 
1 1 1 1   21  4  o 4  3.04366e+01 5.48166e-01 5.43888e+02 267.956 -4.63614e-01 -1.29911e+01 0.00000e+00 0.00000e+00 5.53877e+02 267.956 9.98938e+00 267.956 0.9607 
1 1 1 1   21  5  o 16 6.19939e+00 3.37215e-01 2.04868e+02 292.006 3.70447e-01  -9.16615e-01 0.00000e+00 0.00000e+00 1.01942e+02 112.006 3.06810e+02 112.006 0.4424 
1 1 1 1   21  6  o 10 1.58889e+01 3.80888e-01 2.31852e+02 63.912  1.46679e+00  2.99568e+00  0.00000e+00 0.00000e+00 2.64184e+02 63.912  3.23315e+01 63.912  0.8320 
1 1 1 1   21  7  o 10 3.38930e+01 6.22377e-01 9.41149e+02 12.052  4.07818e+01  8.70713e+00  0.00000e+00 0.00000e+00 3.14780e+02 12.052  6.26369e+02 192.052 0.9879 
1 1 1 1   21  8  o 12 3.51302e+01 9.73787e-01 3.05494e+02 319.884 1.09827e+01  -9.25373e+00 0.00000e+00 0.00000e+00 9.64908e+02 319.884 6.59414e+02 319.884 0.9645 
1 1 1 1   21  9  o 15 2.74163e+01 5.73192e-01 5.13616e+02 351.667 2.38597e+01  -3.49494e+00 0.00000e+00 0.00000e+00 4.92262e+02 351.667 2.13535e+01 171.667 0.9790 
1 1 1 1   21  10 o 16 3.15255e+01 6.37831e-01 5.34650e+02 158.071 -4.15224e+01 1.67166e+01  0.00000e+00 0.00000e+00 6.32851e+02 158.071 9.82011e+01 158.071 0.9888 
1 1 1 1   21  11 o 14 8.74551e+00 9.06588e-01 2.06942e+02 38.161  4.40756e+00  3.46356e+00  0.00000e+00 0.00000e+00 8.95678e+01 38.161  1.17374e+02 218.161 0.9058 
1 1 1 1   21  12 o 1  1.24655e+01 1.09916e+00 1.51119e+02 232.146 -5.17982e+00 -6.66484e+00 0.00000e+00 0.00000e+00 2.86618e+02 232.146 1.35499e+02 232.146 0.9388 
1 1 1 1   21  13 o 17 1.40674e+01 7.39407e-01 3.08297e+02 232.617 -1.75256e+01 -2.29368e+01 0.00000e+00 0.00000e+00 2.08351e+02 232.617 9.99460e+01 52.617  0.9825 
1 1 1 1   21  14 o 19 2.17950e+01 6.73473e-01 3.52872e+02 305.673 4.01789e+01  -5.59699e+01 0.00000e+00 0.00000e+00 4.55254e+02 305.673 1.02383e+02 305.673 0.9927 
1 1 1 1   21  15 o 4  1.07192e+01 8.61325e-01 1.45259e+02 76.138  3.64620e+00  1.47751e+01  0.00000e+00 0.00000e+00 2.41397e+02 76.138  9.61378e+01 76.138  0.9666 
1 1 1 1   21  16 o 10 9.20377e+00 1.44998e+00 7.47306e+01 32.185  5.55002e+00  3.49294e+00  0.00000e+00 0.00000e+00 2.41062e+02 32.185  1.66331e+02 32.185  0.9202 
1 1 1 1   21  17 o 11 8.36244e+00 1.27023e+00 7.63878e+01 345.730 7.12532e+00  -1.81220e+00 0.00000e+00 0.00000e+00 2.13073e+02 345.730 1.36685e+02 345.730 0.9293 
1 1 1 1   21  18 o 12 4.71964e+00 1.40188e+00 5.13117e+01 336.179 2.77439e+00  -1.22487e+00 0.00000e+00 0.00000e+00 9.13593e+01 336.179 4.00476e+01 336.179 0.8124 
1 1 1 1   21  19 o 5  4.10875e+00 1.33559e+00 1.25682e+02 354.452 7.35976e+00  -7.14899e-01 0.00000e+00 0.00000e+00 1.63040e+01 354.452 1.09378e+02 174.452 0.9297 
1 1 1 1   22  0  o 3  2.02203e+01 3.12248e-01 2.52552e+02 238.728 -1.29026e+00 -2.12441e+00 0.00000e+00 0.00000e+00 3.27112e+02 238.728 7.45606e+01 238.728 0.7634 
1 1 1 1   22  1  o 8  3.75555e+01 5.37437e-01 6.43867e+02 309.245 7.05720e+00  -8.63896e+00 0.00000e+00 0.00000e+00 7.01635e+02 309.245 5.77671e+01 309.245 0.9541 
1 1 1 1   22  2  o 13 3.05666e+01 4.83585e-01 6.18230e+02 299.197 4.49522e+00  -8.04437e+00 0.00000e+00 0.00000e+00 4.65355e+02 299.197 1.52875e+02 119.197 0.9441 
1 1 1 1   22  3  o 7  2.07749e+01 3.61613e-01 3.27026e+02 338.561 4.97652e+00  -1.95415e+00 0.00000e+00 0.00000e+00 3.75640e+02 338.561 4.86140e+01 338.561 0.9008 
1 1 1 1   22  4  o 12 1.56486e+01 3.71020e-01 4.64402e+02 137.934 -4.08750e+00 3.68893e+00  0.00000e+00 0.00000e+00 6.66007e+01 137.934 3.97801e+02 317.934 0.9039 
1 1 1 1   22  5  o 15 4.58047e+00 3.72708e-01 2.49241e+02 97.861  -1.19673e-01 8.66810e-01  0.00000e+00 0.00000e+00 1.80415e+02 277.861 4.29656e+02 277.861 0.4004 
1 1 1 1   22  6  f 0  2.65245e+01 5.11356e-01 6.01809e+02 136.787 -1.04161e+01 9.78581e+00  0.00000e+00 0.00000e+00 3.57900e+02 136.787 2.43908e+02 316.787 0.9644 
1 1 1 1   22  7  o 14 2.27009e+01 4.75460e-01 5.59308e+02 291.870 6.17084e+00  -1.53739e+01 0.00000e+00 0.00000e+00 2.66001e+02 291.870 2.93306e+02 111.870 0.9693 
1 1 1 1   22  8  o 4  2.15310e+01 4.77480e-01 4.05621e+02 82.712  1.50414e+00  1.17610e+01  0.00000e+00 0.00000e+00 3.66756e+02 82.712  3.88642e+01 262.712 0.9569 
1 1 1 1   22  9  o 3  2.17903e+01 5.13768e-01 4.10165e+02 227.504 -1.03437e+01 -1.12898e+01 0.00000e+00 0.00000e+00 3.79237e+02 227.504 3.09286e+01 47.504  0.9668 
1 1 1 1   22  10 o 16 1.54976e+01 8.02930e-01 1.32396e+02 84.698  4.86608e-01  5.24367e+00  0.00000e+00 0.00000e+00 3.89523e+02 84.698  2.57127e+02 84.698  0.8992 
1 1 1 1   22  11 o 1  2.30111e+01 6.11574e-01 4.07711e+02 262.465 -4.03963e+00 -3.05386e+01 0.00000e+00 0.00000e+00 4.39487e+02 262.465 3.17756e+01 262.465 0.9836 
1 1 1 1   22  12 o 5  1.15794e+01 7.19377e-01 2.69510e+02 297.544 6.85226e+00  -1.31383e+01 0.00000e+00 0.00000e+00 1.48733e+02 297.544 1.20778e+02 117.544 0.9656 
1 1 1 1   22  13 o 11 8.06067e+00 8.47465e-01 1.41942e+02 226.756 -5.27547e+00 -5.60925e+00 0.00000e+00 0.00000e+00 1.39042e+02 226.756 2.90051e+00 46.756  0.9326 
1 1 1 1   22  14 o 10 1.36208e+01 7.47535e-01 1.63828e+02 8.142   1.94376e+01  2.78109e+00  0.00000e+00 0.00000e+00 3.31758e+02 8.142   1.67930e+02 8.142   0.9742 
1 1 1 1   22  15 o 19 5.04977e+00 1.15511e+00 1.22086e+02 337.715 5.39454e+00  -2.21085e+00 0.00000e+00 0.00000e+00 4.93266e+01 337.715 7.27594e+01 157.715 0.9096 
1 1 1 1   22  16 o 14 1.76959e+01 8.18405e-01 3.23620e+02 54.142  4.28619e+01  5.93023e+01  0.00000e+00 0.00000e+00 3.31611e+02 54.142  7.99040e+00 54.142  0.9931 
1 1 1 1   22  17 o 12 1.37119e+01 1.02796e+00 1.47366e+02 47.813  1.97031e+01  2.17395e+01  0.00000e+00 0.00000e+00 3.54578e+02 47.813  2.07213e+02 47.813  0.9828 
1 1 1 1   22  18 o 19 4.98128e+00 1.44080e+00 7.91779e+01 30.768  4.13426e+00  2.46139e+00  0.00000e+00 0.00000e+00 8.55619e+01 30.768  6.38400e+00 30.768  0.8888 
1 1 1 1   22  19 o 6  4.74279e+00 1.49718e+00 5.02116e+01 299.263 1.47874e+00  -2.63902e+00 0.00000e+00 0.00000e+00 9.28968e+01 299.263 4.26852e+01 299.263 0.8118 
1 1 1 1   23  0  o 10 2.37814e+01 3.54996e-01 4.15189e+02 348.363 4.41368e+00  -9.08972e-01 0.00000e+00 0.00000e+00 3.71088e+02 348.363 4.41011e+01 168.363 0.8805 
1 1 1 1   23  1  o 1  3.64954e+01 5.51144e-01 7.70200e+02 300.559 7.42306e+00  -1.25724e+01 0.00000e+00 0.00000e+00 5.52392e+02 300.559 2.17808e+02 120.559 0.9651 
1 1 1 1   23  2  o 2  3.20161e+01 4.71060e-01 7.50119e+02 144.475 -1.27693e+01 9.11652e+00  0.00000e+00 0.00000e+00 4.13049e+02 144.475 3.37070e+02 324.475 0.9676 
1 1 1 1   23  3  o 16 1.65463e+01 3.78799e-01 2.97933e+02 173.319 -2.85285e+00 3.34196e-01  0.00000e+00 0.00000e+00 1.99085e+02 173.319 9.88484e+01 353.319 0.8001 
1 1 1 1   23  4  o 18 1.07353e+01 3.73442e-01 9.57227e+01 112.223 -2.87663e-01 7.04087e-01  0.00000e+00 0.00000e+00 4.74144e+01 112.223 4.83082e+01 292.223 0.3552 
1 1 1 1   23  5  o 12 1.52733e+01 3.61237e-01 2.28534e+02 200.351 -2.81464e+00 -1.04399e+00 0.00000e+00 0.00000e+00 2.35816e+02 200.351 7.28156e+00 200.351 0.8101 
1 1 1 1   23  6  o 12 2.90362e+01 5.47633e-01 4.03596e+02 33.518  1.03478e+01  6.85378e+00  0.00000e+00 0.00000e+00 6.40908e+02 33.518  2.37312e+02 33.518  0.9588 
1 1 1 1   23  7  o 17 2.80619e+01 5.42569e-01 5.79001e+02 285.342 5.09766e+00  -1.85798e+01 0.00000e+00 0.00000e+00 4.45736e+02 285.342 1.33265e+02 105.342 0.9737 
1 1 1 1   23  8  o 18 3.98771e+01 7.72039e-01 7.83299e+02 29.016  4.30920e+01  2.39019e+01  0.00000e+00 0.00000e+00 6.96365e+02 29.016  8.69338e+01 209.016 0.9898 
1 1 1 1   23  9  o 16 4.24855e+01 7.76091e-01 7.41907e+02 226.425 -4.49303e+01 -4.72229e+01 0.00000e+00 0.00000e+00 8.37767e+02 226.425 9.58602e+01 226.425 0.9923 
1 1 1 1   23  10 o 10 1.02308e+01 6.21186e-01 3.50353e+02 346.056 9.02698e+00  -2.24134e+00 0.00000e+00 0.00000e+00 1.15646e+01 346.056 3.38788e+02 166.056 0.9446 
1 1 1 1   23  11 o 15 2.29949e+01 8.04108e-01 3.99572e+02 123.000 -1.61228e+01 2.48268e+01  0.00000e+00 0.00000e+00 4.46400e+02 123.000 4.68283e+01 123.000 0.9830 
1 1 1 1   23  12 o 8  2.17305e+01 6.97674e-01 3.78452e+02 300.041 1.91639e+01  -3.31382e+01 0.00000e+00 0.00000e+00 4.23636e+02 300.041 4.51840e+01 300.041 0.9869 
1 1 1 1   23  13 o 9  1.99932e+01 7.02657e-01 3.21676e+02 104.248 -1.09438e+01 4.30973e+01  0.00000e+00 0.00000e+00 4.17129e+02 104.248 9.54530e+01 104.248 0.9887 
1 1 1 1   23  14 o 11 7.13339e+00 9.74903e-01 3.76173e+01 321.355 1.73041e+00  -1.38357e+00 0.00000e+00 0.00000e+00 1.56905e+02 321.355 1.19287e+02 321.355 0.7302 
1 1 1 1   23  15 o 18 5.31739e+00 1.04388e+00 1.16877e+02 324.613 5.00138e+00  -3.55253e+00 0.00000e+00 0.00000e+00 6.45552e+01 324.613 5.23218e+01 144.613 0.9144 
1 1 1 1   23  16 f 0  6.20636e+00 1.28266e+00 1.28080e+02 84.646  7.90658e-01  8.43637e+00  0.00000e+00 0.00000e+00 8.91821e+01 84.646  3.88978e+01 264.646 0.9390 
1 1 1 1   23  17 o 12 3.38763e+00 1.11739e+00 7.76082e+01 257.225 -8.01801e-01 -3.53639e+00 0.00000e+00 0.00000e+00 2.93133e+01 257.225 4.82949e+01 77.225  0.8474 
1 1 1 1   23  18 o 6  7.01193e+00 1.57065e+00 1.11720e+02 316.596 6.31829e+00  -5.97565e+00 0.00000e+00 0.00000e+00 1.33676e+02 316.596 2.19551e+01 316.596 0.9406 
1 1 1 1   23  19 o 7  4.20307e+00 1.38957e+00 1.04319e+02 43.642  4.34602e+00  4.14471e+00  0.00000e+00 0.00000e+00 3.82146e+01 43.642  6.61044e+01 223.642 0.9124 
1 1 1 1   24  0  o 15 2.65586e+01 3.88711e-01 4.99537e+02 243.530 -3.03518e+00 -6.09570e+00 0.00000e+00 0.00000e+00 4.21211e+02 243.530 7.83258e+01 63.530  0.9233 
1 1 1 1   24  1  o 18 2.31502e+01 4.10581e-01 3.65572e+02 235.258 -2.37310e+00 -3.42178e+00 0.00000e+00 0.00000e+00 3.90263e+02 235.258 2.46910e+01 235.258 0.8695 
1 1 1 1   24  2  o 10 1.74617e+01 3.02610e-01 4.51537e+02 171.749 -4.88025e+00 7.07697e-01  0.00000e+00 0.00000e+00 1.33106e+02 171.749 3.18431e+02 351.749 0.8918 
1 1 1 1   24  3  o 3  1.49596e+01 3.04524e-01 2.95250e+02 173.875 -2.47678e+00 2.65771e-01  0.00000e+00 0.00000e+00 1.33819e+02 173.875 1.61431e+02 353.875 0.7640 
1 1 1 1   24  4  o 11 2.66193e+01 4.78000e-01 4.90221e+02 252.638 -2.94739e+00 -9.42731e+00 0.00000e+00 0.00000e+00 4.56909e+02 252.638 3.33118e+01 72.638  0.9479 
1 1 1 1   24  5  o 13 1.07503e+01 3.12109e-01 1.20564e+02 317.552 8.11209e-01  -7.41983e-01 0.00000e+00 0.00000e+00 7.32722e+01 317.552 4.72920e+01 137.552 0.4805 
1 1 1 1   24  6  o 7  3.73662e+01 7.14510e-01 6.08128e+02 310.591 1.54567e+01  -1.80390e+01 0.00000e+00 0.00000e+00 7.63823e+02 310.591 1.55695e+02 310.591 0.9787 
1 1 1 1   24  7  o 1  3.91576e+01 7.05505e-01 8.14160e+02 223.142 -2.72898e+01 -2.55748e+01 0.00000e+00 0.00000e+00 6.34533e+02 223.142 1.79627e+02 43.142  0.9865 
1 1 1 1   24  8  o 17 1.71581e+01 4.43025e-01 3.59806e+02 75.488  2.45731e+00  9.49345e+00  0.00000e+00 0.00000e+00 2.49641e+02 75.488  1.10166e+02 255.488 0.9476 
1 1 1 1   24  9  o 18 2.01290e+01 7.33377e-01 3.29554e+02 210.155 -1.18730e+01 -6.89766e+00 0.00000e+00 0.00000e+00 3.96628e+02 210.155 6.70738e+01 210.155 0.9629 
1 1 1 1   24  10 o 7  2.41920e+01 5.67318e-01 4.69079e+02 239.278 -1.58744e+01 -2.67127e+01 0.00000e+00 0.00000e+00 4.22150e+02 239.278 4.69296e+01 59.278  0.9838 
1 1 1 1   24  11 o 4  1.64774e+01 5.61935e-01 3.20369e+02 253.019 -5.48069e+00 -1.79478e+01 0.00000e+00 0.00000e+00 2.79632e+02 253.019 4.07380e+01 73.019  0.9730 
1 1 1 1   24  12 o 8  1.92735e+01 8.86751e-01 2.53176e+02 348.489 2.16346e+01  -4.40589e+00 0.00000e+00 0.00000e+00 4.51138e+02 348.489 1.97961e+02 348.489 0.9771 
1 1 1 1   24  13 o 16 1.18117e+01 7.08488e-01 2.37085e+02 163.388 -1.95468e+01 5.83157e+00  0.00000e+00 0.00000e+00 1.93395e+02 163.388 4.36900e+01 343.388 0.9752 
1 1 1 1   24  14 o 3  1.57177e+01 6.71570e-01 2.90368e+02 142.353 -3.23192e+01 2.49313e+01  0.00000e+00 0.00000e+00 2.89352e+02 142.353 1.01622e+00 322.353 0.9877 
1 1 1 1   24  15 o 15 3.29244e+00 1.01347e+00 1.09677e+02 8.239   3.72722e+00  5.39696e-01  0.00000e+00 0.00000e+00 4.77901e+00 188.239 1.14456e+02 188.239 0.8539 
1 1 1 1   24  16 o 17 8.33216e+00 1.12450e+00 9.16010e+01 226.243 -6.08090e+00 -6.35062e+00 0.00000e+00 0.00000e+00 2.00772e+02 226.243 1.09171e+02 226.243 0.9413 
1 1 1 1   24  17 o 1  3.45070e+00 1.12107e+00 5.59928e+01 355.822 2.48254e+00  -1.81351e-01 0.00000e+00 0.00000e+00 4.21661e+01 355.822 1.38267e+01 175.822 0.7638 
1 1 1 1   24  18 o 16 6.80792e+00 1.27315e+00 9.57480e+01 68.879  3.15699e+00  8.17279e+00  0.00000e+00 0.00000e+00 1.42608e+02 68.879  4.68599e+01 68.879  0.9411 
1 1 1 1   24  19 o 4  6.37127e+00 1.75013e+00 9.43395e+01 251.493 -2.11163e+00 -6.30830e+00 0.00000e+00 0.00000e+00 1.23835e+02 251.493 2.94960e+01 251.493 0.9214 
1 1 1 1   25  0  f 0  2.02213e+01 3.17980e-01 3.14908e+02 341.697 2.93427e+00  -9.70571e-01 0.00000e+00 0.00000e+00 3.04949e+02 341.697 9.95906e+00 161.697 0.8165 
1 1 1 1   25  1  o 12 6.59479e+00 2.46456e-01 1.12072e+02 60.138  2.41752e-01  4.21060e-01  0.00000e+00 0.00000e+00 5.36684e+01 240.138 1.65740e+02 240.138 0.2359 
1 1 1 1   25  2  o 14 1.59507e+01 3.07436e-01 2.76321e+02 80.041  6.11077e-01  3.48003e+00  0.00000e+00 0.00000e+00 2.28388e+02 80.041  4.79329e+01 260.041 0.8428 
1 1 1 1   25  3  o 18 2.04875e+01 3.92880e-01 2.95479e+02 273.607 3.07482e-01  -4.87720e+00 0.00000e+00 0.00000e+00 3.89527e+02 273.607 9.40473e+01 273.607 0.8907 
1 1 1 1   25  4  o 13 3.17412e+01 5.10573e-01 6.30637e+02 349.720 1.45819e+01  -2.64476e+00 0.00000e+00 0.00000e+00 5.19751e+02 349.720 1.10886e+02 169.720 0.9656 
1 1 1 1   25  5  f 0  1.45501e+01 3.44420e-01 2.66833e+02 345.378 3.33785e+00  -8.70806e-01 0.00000e+00 0.00000e+00 1.90920e+02 345.378 7.59130e+01 165.378 0.8384 
1 1 1 1   25  6  o 15 4.29014e+01 7.29291e-01 6.19079e+02 336.754 2.52209e+01  -1.08337e+01 0.00000e+00 0.00000e+00 9.60651e+02 336.754 3.41572e+02 336.754 0.9816 
1 1 1 1   25  7  o 7  1.30072e+01 3.82503e-01 3.46762e+02 50.378  3.53627e+00  4.27135e+00  0.00000e+00 0.00000e+00 9.44901e+01 50.378  2.52272e+02 230.378 0.9047 
1 1 1 1   25  8  o 7  8.37965e+00 5.05205e-01 2.10486e+02 77.812  5.76509e-01  2.66920e+00  0.00000e+00 0.00000e+00 3.69979e+01 77.812  1.73488e+02 257.812 0.7879 
1 1 1 1   25  9  o 8  2.30133e+01 6.42591e-01 3.45164e+02 49.382  1.07238e+01  1.25037e+01  0.00000e+00 0.00000e+00 4.90438e+02 49.382  1.45274e+02 49.382  0.9692 
1 1 1 1   25  10 o 4  2.23818e+01 5.28737e-01 5.22648e+02 208.300 -2.82061e+01 -1.51872e+01 0.00000e+00 0.00000e+00 3.02250e+02 208.300 2.20398e+02 28.300  0.9843 
1 1 1 1   25  11 o 9  6.27792e+00 9.07392e-01 1.12924e+02 1.098   2.43073e+00  4.65870e-02  0.00000e+00 0.00000e+00 6.49917e+01 1.098   4.79322e+01 181.098 0.7573 
1 1 1 1   25  12 o 11 1.86381e+01 6.89021e-01 3.34147e+02 190.871 -3.05149e+01 -5.86052e+00 0.00000e+00 0.00000e+00 3.51563e+02 190.871 1.74156e+01 190.871 0.9838 
1 1 1 1   25  13 o 8  1.97744e+01 6.22731e-01 2.99960e+02 302.359 2.34379e+01  -3.69909e+01 0.00000e+00 0.00000e+00 4.30532e+02 302.359 1.30572e+02 302.359 0.9885 
1 1 1 1   25  14 o 6  1.03891e+01 7.93928e-01 1.73671e+02 354.983 1.55866e+01  -1.36839e+00 0.00000e+00 0.00000e+00 2.01662e+02 354.983 2.79911e+01 354.983 0.9675 
1 1 1 1   25  15 o 5  5.19189e+00 1.21098e+00 8.30666e+01 298.678 1.98599e+00  -3.63077e+00 0.00000e+00 0.00000e+00 8.51959e+01 298.678 2.12924e+00 298.678 0.8686 
1 1 1 1   25  16 o 10 5.58390e+00 1.28905e+00 1.40418e+02 299.133 4.23512e+00  -7.59870e+00 0.00000e+00 0.00000e+00 5.53701e+01 299.133 8.50478e+01 119.133 0.9406 
1 1 1 1   25  17 o 4  5.62513e+00 1.26802e+00 1.14570e+02 27.783  7.32040e+00  3.85682e+00  0.00000e+00 0.00000e+00 8.18095e+01 27.783  3.27602e+01 207.783 0.9375 
1 1 1 1   25  18 o 19 4.52249e+00 1.39412e+00 1.66297e+01 260.276 -1.64261e-01 -9.58575e-01 0.00000e+00 0.00000e+00 5.68215e+01 260.276 4.01918e+01 260.276 0.4366 
1 1 1 1   25  19 o 17 5.05690e+00 1.55807e+00 1.33195e+02 160.638 -8.04509e+00 2.82707e+00  0.00000e+00 0.00000e+00 4.33346e+01 160.638 8.98606e+01 340.638 0.9394 
1 1 1 1   26  0  o 1  9.07976e+00 2.32451e-01 3.64875e+02 176.039 -2.13918e+00 1.48136e-01  0.00000e+00 0.00000e+00 1.19414e+02 356.039 4.84289e+02 356.039 0.7201 
1 1 1 1   26  1  o 4  1.04756e+01 2.69010e-01 1.79078e+02 204.408 -1.06817e+00 -4.84722e-01 0.00000e+00 0.00000e+00 1.92672e+01 204.408 1.59811e+02 24.408  0.5043 
1 1 1 1   26  2  o 13 1.47091e+01 3.25860e-01 3.65551e+02 89.933  4.85458e-03  4.13762e+00  0.00000e+00 0.00000e+00 1.14080e+02 89.933  2.51470e+02 269.933 0.8686 
1 1 1 1   26  3  o 17 1.48011e+01 3.30510e-01 1.96870e+02 79.228  4.26734e-01  2.24291e+00  0.00000e+00 0.00000e+00 2.13811e+02 79.228  1.69408e+01 79.228  0.7392 
1 1 1 1   26  4  o 19 8.15015e+00 2.98284e-01 2.37944e+02 194.969 -1.60593e+00 -4.29375e-01 0.00000e+00 0.00000e+00 4.40902e+01 14.969  2.82034e+02 14.969  0.6338 
1 1 1 1   26  5  o 15 3.73743e+01 6.41560e-01 7.86932e+02 335.688 2.33802e+01  -1.05626e+01 0.00000e+00 0.00000e+00 5.87764e+02 335.688 1.99168e+02 155.688 0.9803 
1 1 1 1   26  6  o 1  3.47992e+01 6.09063e-01 7.63178e+02 188.198 -3.15466e+01 -4.54487e+00 0.00000e+00 0.00000e+00 5.21478e+02 188.198 2.41700e+02 8.198   0.9842 
1 1 1 1   26  7  o 1  1.27001e+01 4.68229e-01 1.86567e+02 311.976 2.06955e+00  -2.30041e+00 0.00000e+00 0.00000e+00 2.02361e+02 311.976 1.57940e+01 311.976 0.8167 
1 1 1 1   26  8  o 15 1.93159e+01 4.95548e-01 2.97063e+02 2.751   8.83620e+00  4.24591e-01  0.00000e+00 0.00000e+00 3.84667e+02 2.751   8.76039e+01 2.751   0.9417 
1 1 1 1   26  9  o 10 2.07935e+01 4.83541e-01 2.97770e+02 145.856 -1.11580e+01 7.56717e+00  0.00000e+00 0.00000e+00 4.51734e+02 145.856 1.53964e+02 145.856 0.9622 
1 1 1 1   26  10 o 2  3.93877e+01 7.20210e-01 8.92910e+02 250.355 -3.27264e+01 -9.16796e+01 0.00000e+00 0.00000e+00 5.74257e+02 250.355 3.18653e+02 70.355  0.9949 
1 1 1 1   26  11 o 14 1.06023e+01 8.82640e-01 1.68704e+02 162.012 -5.69504e+00 1.84906e+00  0.00000e+00 0.00000e+00 1.93186e+02 162.012 2.44826e+01 162.012 0.9122 
1 1 1 1   26  12 o 7  2.82585e+01 6.47342e-01 4.75101e+02 138.676 -5.04125e+01 4.43250e+01  0.00000e+00 0.00000e+00 5.73722e+02 138.676 9.86212e+01 138.676 0.9925 
1 1 1 1   26  13 o 2  1.04829e+01 7.79380e-01 1.96833e+02 41.242  1.11823e+01  9.80395e+00  0.00000e+00 0.00000e+00 1.81482e+02 41.242  1.53513e+01 221.242 0.9658 
1 1 1 1   26  14 o 3  5.77729e+00 1.04146e+00 9.99066e+01 6.331   4.86644e+00  5.39953e-01  0.00000e+00 0.00000e+00 9.22791e+01 6.331   7.62753e+00 186.331 0.8909 
1 1 1 1   26  15 o 6  8.19441e+00 1.05030e+00 1.69930e+02 310.399 9.71420e+00  -1.14146e+01 0.00000e+00 0.00000e+00 1.25398e+02 310.399 4.45312e+01 130.399 0.9660 
1 1 1 1   26  16 o 18 4.53526e+00 1.24761e+00 7.52866e+01 1.567   3.79886e+00  1.03951e-01  0.00000e+00 0.00000e+00 6.93097e+01 1.567   5.97691e+00 181.567 0.8554 
1 1 1 1   26  17 o 12 4.21426e+00 1.27510e+00 6.28554e+01 169.745 -3.32925e+00 6.02337e-01  0.00000e+00 0.00000e+00 6.81423e+01 169.745 5.28693e+00 169.745 0.8348 
1 1 1 1   26  18 o 1  6.84076e+00 1.50857e+00 1.41616e+02 325.399 9.54158e+00  -6.58259e+00 0.00000e+00 0.00000e+00 1.01616e+02 325.399 3.99997e+01 145.399 0.9558 
1 1 1 1   26  19 o 19 5.52801e+00 1.68188e+00 9.19039e+01 253.836 -1.63518e+00 -5.64155e+00 0.00000e+00 0.00000e+00 9.50929e+01 253.836 3.18906e+00 253.836 0.9104 
1 1 1 1   27  0  o 9  1.46665e+01 3.26850e-01 3.62968e+02 122.839 -1.77699e+00 2.75325e+00  0.00000e+00 0.00000e+00 9.31981e+01 122.839 2.69770e+02 302.839 0.8285 
1 1 1 1   27  1  o 14 1.20773e+01 2.83489e-01 1.55914e+02 88.328  4.38895e-02  1.50355e+00  0.00000e+00 0.00000e+00 1.14826e+02 88.328  4.10880e+01 268.328 0.5972 
1 1 1 1   27  2  o 8  3.89294e+01 5.62836e-01 7.61119e+02 235.364 -9.53918e+00 -1.38095e+01 0.00000e+00 0.00000e+00 6.55964e+02 235.364 1.05155e+02 55.364  0.9697 
1 1 1 1   27  3  o 13 1.55226e+01 3.73151e-01 4.57315e+02 349.699 5.23923e+00  -9.52222e-01 0.00000e+00 0.00000e+00 6.72767e+01 349.699 3.90038e+02 169.699 0.9004 
1 1 1 1   27  4  o 17 1.10162e+01 3.10064e-01 9.31547e+01 195.261 -7.71292e-01 -2.10442e-01 0.00000e+00 0.00000e+00 6.01636e+01 195.261 3.29911e+01 15.261  0.3709 
1 1 1 1   27  5  o 12 1.29685e+01 3.36161e-01 2.69536e+02 186.995 -3.30326e+00 -4.05294e-01 0.00000e+00 0.00000e+00 1.35074e+02 186.995 1.34463e+02 6.995   0.8316 
1 1 1 1   27  6  o 1  1.62988e+01 3.78896e-01 3.71950e+02 146.810 -6.06600e+00 3.96789e+00  0.00000e+00 0.00000e+00 1.95476e+02 146.810 1.76474e+02 326.810 0.9282 
1 1 1 1   27  7  o 19 1.85564e+01 5.30236e-01 5.11466e+02 337.986 1.14132e+01  -4.61457e+00 0.00000e+00 0.00000e+00 1.55389e+02 337.986 3.56077e+02 157.986 0.9585 
1 1 1 1   27  8  o 14 5.77198e+01 9.65705e-01 9.79755e+02 270.707 1.28814e+00  -1.04347e+02 0.00000e+00 0.00000e+00 1.17306e+03 270.707 1.93305e+02 270.707 0.9952 
1 1 1 1   27  9  o 1  1.04862e+01 6.45308e-01 1.88327e+02 39.235  3.29527e+00  2.69090e+00  0.00000e+00 0.00000e+00 1.54454e+02 39.235  3.38722e+01 219.235 0.8726 
1 1 1 1   27  10 o 4  7.97831e+00 8.75266e-01 2.08086e+02 115.240 -2.08479e+00 4.42248e+00  0.00000e+00 0.00000e+00 5.79842e+01 115.240 1.50102e+02 295.240 0.8907 
1 1 1 1   27  11 o 17 1.63693e+01 7.54782e-01 3.16126e+02 145.339 -1.44043e+01 9.95955e+00  0.00000e+00 0.00000e+00 2.78610e+02 145.339 3.75159e+01 325.339 0.9710 
1 1 1 1   27  12 o 16 4.34640e+01 8.20834e-01 7.41575e+02 13.558  1.64068e+02  3.95663e+01  0.00000e+00 0.00000e+00 8.78818e+02 13.558  1.37242e+02 13.558  0.9970 
1 1 1 1   27  13 o 13 1.36539e+01 7.19831e-01 2.10480e+02 194.152 -1.99496e+01 -5.03016e+00 0.00000e+00 0.00000e+00 2.87144e+02 194.152 7.66632e+01 194.152 0.9754 
1 1 1 1   27  14 o 15 9.28448e+00 8.16546e-01 1.07785e+02 288.968 2.98892e+00  -8.69639e+00 0.00000e+00 0.00000e+00 2.19430e+02 288.968 1.11645e+02 288.968 0.9440 
1 1 1 1   27  15 o 16 1.30512e+01 8.23279e-01 2.81436e+02 257.003 -1.01388e+01 -4.39274e+01 0.00000e+00 0.00000e+00 2.00001e+02 257.003 8.14342e+01 77.003  0.9888 
1 1 1 1   27  16 o 7  7.04331e+00 1.29698e+00 9.89368e+01 15.534  7.27678e+00  2.02274e+00  0.00000e+00 0.00000e+00 1.45518e+02 15.534  4.65815e+01 15.534  0.9312 
1 1 1 1   27  17 o 16 5.48315e+00 1.35998e+00 6.24875e+01 271.839 1.27345e-01  -3.96587e+00 0.00000e+00 0.00000e+00 1.13557e+02 271.839 5.10692e+01 271.839 0.8623 
1 1 1 1   27  18 o 10 3.63951e+00 1.18590e+00 2.74921e+01 65.231  5.78314e-01  1.25338e+00  0.00000e+00 0.00000e+00 4.90138e+01 65.231  2.15217e+01 65.231  0.5651 
1 1 1 1   27  19 o 1  4.21066e+00 1.41152e+00 6.43620e+01 9.125   3.78664e+00  6.08236e-01  0.00000e+00 0.00000e+00 6.96953e+01 9.125   5.33326e+00 9.125   0.8569 
1 1 1 1   28  0  o 3  2.38986e+01 3.63445e-01 5.11562e+02 354.403 9.56306e+00  -9.37159e-01 0.00000e+00 0.00000e+00 3.37452e+02 354.403 1.74110e+02 174.403 0.9464 
1 1 1 1   28  1  o 9  1.31120e+01 3.03411e-01 2.43812e+02 23.485  1.71875e+00  7.46799e-01  0.00000e+00 0.00000e+00 8.88782e+01 23.485  1.54934e+02 203.485 0.6760 
1 1 1 1   28  2  o 13 2.25961e+01 3.65324e-01 6.28533e+02 190.111 -1.13181e+01 -2.01839e+00 0.00000e+00 0.00000e+00 1.81830e+02 190.111 4.46704e+02 10.111  0.9555 
1 1 1 1   28  3  o 10 5.11960e+00 3.37674e-01 5.26802e+01 129.285 -1.30580e-01 1.59620e-01  0.00000e+00 0.00000e+00 3.29725e+01 309.285 8.56528e+01 309.285 0.1026 
1 1 1 1   28  4  o 2  1.92871e+01 3.63397e-01 5.99061e+02 212.847 -7.41453e+00 -4.78690e+00 0.00000e+00 0.00000e+00 8.23359e+01 212.847 5.16725e+02 32.847  0.9415 
1 1 1 1   28  5  o 19 2.82026e+01 4.75136e-01 6.21405e+02 157.707 -1.46934e+01 6.02404e+00  0.00000e+00 0.00000e+00 4.02743e+02 157.707 2.18662e+02 337.707 0.9680 
1 1 1 1   28  6  o 1  1.04796e+01 3.48051e-01 2.78736e+02 29.835  2.80430e+00  1.60828e+00  0.00000e+00 0.00000e+00 4.58333e+01 29.835  2.32902e+02 209.834 0.8258 
1 1 1 1   28  7  o 12 3.55434e+01 6.32643e-01 6.94826e+02 203.035 -2.89426e+01 -1.23061e+01 0.00000e+00 0.00000e+00 6.16356e+02 203.035 7.84703e+01 23.035  0.9840 
1 1 1 1   28  8  o 10 3.96957e+01 6.99256e-01 6.36843e+02 358.632 4.41443e+01  -1.05417e+00 0.00000e+00 0.00000e+00 8.33804e+02 358.632 1.96962e+02 358.632 0.9886 
1 1 1 1   28  9  o 13 1.15681e+01 4.74300e-01 2.80937e+02 125.851 -4.22806e+00 5.85139e+00  0.00000e+00 0.00000e+00 1.21127e+02 125.851 1.59810e+02 305.851 0.9279 
1 1 1 1   28  10 o 9  3.41943e+01 6.57471e-01 6.26810e+02 292.500 2.45265e+01  -5.92118e+01 0.00000e+00 0.00000e+00 6.43284e+02 292.500 1.64738e+01 292.500 0.9922 
1 1 1 1   28  11 o 14 4.40830e+01 8.08296e-01 7.14799e+02 238.524 -6.26983e+01 -1.02409e+02 0.00000e+00 0.00000e+00 9.27649e+02 238.524 2.12850e+02 238.524 0.9958 
1 1 1 1   28  12 o 10 6.09501e+00 1.11285e+00 2.27059e+02 122.628 -4.04069e+00 6.31154e+00  0.00000e+00 0.00000e+00 1.49704e+01 302.628 2.42029e+02 302.628 0.9307 
1 1 1 1   28  13 o 2  8.90774e+00 9.94290e-01 2.13980e+02 247.734 -4.85265e+00 -1.18521e+01 0.00000e+00 0.00000e+00 1.05564e+02 247.734 1.08416e+02 67.734  0.9601 
1 1 1 1   28  14 o 16 8.02941e+00 8.70648e-01 1.81238e+02 192.125 -1.28560e+01 -2.76198e+00 0.00000e+00 0.00000e+00 1.06891e+02 192.125 7.43473e+01 12.125  0.9612 
1 1 1 1   28  15 o 11 2.98932e+00 9.33812e-01 7.69253e+01 337.371 2.49105e+00  -1.03838e+00 0.00000e+00 0.00000e+00 1.06066e+01 337.371 6.63187e+01 157.372 0.7850 
1 1 1 1   28  16 o 16 3.74667e+00 1.13051e+00 8.00347e+01 251.296 -1.11874e+00 -3.30434e+00 0.00000e+00 0.00000e+00 3.73248e+01 251.296 4.27098e+01 71.296  0.8405 
1 1 1 1   28  17 o 19 1.12188e+01 1.15870e+00 1.42804e+02 307.031 1.25310e+01  -1.66107e+01 0.00000e+00 0.00000e+00 2.64727e+02 307.031 1.21922e+02 307.031 0.9757 
1 1 1 1   28  18 f 0  5.45745e+00 1.43801e+00 1.10323e+02 70.549  2.46192e+00  6.97112e+00  0.00000e+00 0.00000e+00 7.83832e+01 70.549  3.19402e+01 250.549 0.9297 
1 1 1 1   28  19 o 17 5.90351e+00 1.70988e+00 7.37408e+01 149.087 -4.24260e+00 2.54040e+00  0.00000e+00 0.00000e+00 1.21923e+02 149.087 4.81825e+01 149.087 0.8921 
1 1 1 1   29  0  o 13 2.71851e+01 4.03075e-01 5.89339e+02 25.961  8.30911e+00  4.04555e+00  0.00000e+00 0.00000e+00 3.74111e+02 25.961  2.15227e+02 205.961 0.9442 
1 1 1 1   29  1  o 17 2.40909e+01 3.69193e-01 3.43830e+02 169.476 -4.58270e+00 8.51336e-01  0.00000e+00 0.00000e+00 4.56296e+02 169.476 1.12466e+02 169.476 0.8849 
1 1 1 1   29  2  o 15 2.59813e+01 3.95618e-01 2.77021e+02 205.813 -5.06700e+00 -2.45088e+00 0.00000e+00 0.00000e+00 6.06605e+02 205.813 3.29584e+02 205.813 0.9062 
1 1 1 1   29  3  o 15 2.08945e+01 4.47405e-01 4.41769e+02 220.965 -5.18736e+00 -4.50370e+00 0.00000e+00 0.00000e+00 2.82791e+02 220.965 1.58978e+02 40.965  0.9240 
1 1 1 1   29  4  o 17 1.39762e+01 3.13158e-01 2.77946e+02 142.376 -2.62902e+00 2.02634e+00  0.00000e+00 0.00000e+00 1.57871e+02 142.376 1.20075e+02 322.376 0.8311 
1 1 1 1   29  5  o 5  3.03759e+01 5.03107e-01 4.55908e+02 182.761 -1.23750e+01 -5.96738e-01 0.00000e+00 0.00000e+00 6.36556e+02 182.761 1.80648e+02 182.761 0.9588 
1 1 1 1   29  6  o 12 1.95685e+01 4.15824e-01 3.82914e+02 290.031 3.38055e+00  -9.27227e+00 0.00000e+00 0.00000e+00 3.12687e+02 290.031 7.02271e+01 110.031 0.9479 
1 1 1 1   29  7  o 7  3.33048e+01 6.01851e-01 6.44057e+02 48.817  1.86576e+01  2.13251e+01  0.00000e+00 0.00000e+00 5.82227e+02 48.817  6.18304e+01 228.817 0.9822 
1 1 1 1   29  8  o 18 2.03354e+01 4.65142e-01 3.14515e+02 268.164 -3.59460e-01 -1.12126e+01 0.00000e+00 0.00000e+00 4.12694e+02 268.164 9.81791e+01 268.164 0.9543 
1 1 1 1   29  9  o 8  2.75824e+01 5.56580e-01 3.78291e+02 180.595 -2.54945e+01 -2.64627e-01 0.00000e+00 0.00000e+00 6.34314e+02 180.595 2.56024e+02 180.595 0.9802 
1 1 1 1   29  10 o 15 3.55463e+01 6.78105e-01 5.52515e+02 354.915 5.56185e+01  -4.94952e+00 0.00000e+00 0.00000e+00 7.66148e+02 354.915 2.13632e+02 354.915 0.9910 
1 1 1 1   29  11 o 3  2.97256e+01 6.36112e-01 6.07568e+02 198.080 -7.31846e+01 -2.38928e+01 0.00000e+00 0.00000e+00 4.97257e+02 198.080 1.10312e+02 18.080  0.9935 
1 1 1 1   29  12 o 10 1.23123e+01 7.50865e-01 1.95260e+02 314.295 9.73251e+00  -9.97482e+00 0.00000e+00 0.00000e+00 2.48217e+02 314.295 5.29576e+01 314.295 0.9634 
1 1 1 1   29  13 o 16 1.63243e+01 6.73293e-01 2.63021e+02 29.127  2.85145e+01  1.58889e+01  0.00000e+00 0.00000e+00 3.37430e+02 29.127  7.44093e+01 29.127  0.9846 
1 1 1 1   29  14 o 14 5.80634e+00 1.14269e+00 5.12081e+01 41.008  1.85735e+00  1.61503e+00  0.00000e+00 0.00000e+00 1.13679e+02 41.008  6.24713e+01 41.008  0.7607 
1 1 1 1   29  15 o 1  1.31207e+01 9.00416e-01 1.35379e+02 229.962 -1.35653e+01 -1.61449e+01 0.00000e+00 0.00000e+00 3.42257e+02 229.962 2.06878e+02 229.962 0.9760 
1 1 1 1   29  16 o 14 3.56835e+00 1.10776e+00 4.09421e+01 180.679 -1.91822e+00 -2.27485e-02 0.00000e+00 0.00000e+00 4.99985e+01 180.679 9.05638e+00 180.679 0.6839 
1 1 1 1   29  17 o 5  3.86198e+00 1.17996e+00 8.31647e+01 98.744  -6.68601e-01 4.34712e+00  0.00000e+00 0.00000e+00 4.29650e+01 98.744  4.01997e+01 278.744 0.8773 
1 1 1 1   29  18 o 13 3.47080e+00 1.18065e+00 4.62102e+01 177.347 -2.32222e+00 1.07605e-01  0.00000e+00 0.00000e+00 4.98912e+01 177.347 3.68096e+00 177.347 0.7445 
1 1 1 1   29  19 o 17 5.19413e+00 1.60722e+00 5.17872e+01 319.988 2.49093e+00  -2.09102e+00 0.00000e+00 0.00000e+00 1.07798e+02 319.988 5.60109e+01 319.988 0.8270 
1 1 1 1   30  0  o 4  2.84618e+01 4.19680e-01 4.04955e+02 10.904  9.27032e+00  1.78587e+00  0.00000e+00 0.00000e+00 6.04957e+02 10.904  2.00002e+02 10.904  0.9455 
1 1 1 1   30  1  o 16 1.67638e+01 2.94813e-01 2.55082e+02 181.923 -3.42664e+00 -1.15055e-01 0.00000e+00 0.00000e+00 2.71700e+02 181.923 1.66179e+01 181.923 0.8373 
1 1 1 1   30  2  o 2  7.49924e+00 2.46548e-01 1.95427e+02 30.810  9.41276e-01  5.61337e-01  0.00000e+00 0.00000e+00 6.05196e+01 210.810 2.55947e+02 210.810 0.4794 
1 1 1 1   30  3  o 16 2.10234e+01 4.51247e-01 3.90754e+02 218.291 -5.52156e+00 -4.35931e+00 0.00000e+00 0.00000e+00 3.39693e+02 218.291 5.10609e+01 38.291  0.9259 
1 1 1 1   30  4  o 3  3.55076e+01 5.65681e-01 7.49311e+02 23.154  2.17504e+01  9.30136e+00  0.00000e+00 0.00000e+00 5.54388e+02 23.154  1.94924e+02 203.154 0.9786 
1 1 1 1   30  5  o 18 2.45116e+01 4.33590e-01 2.80695e+02 168.403 -7.12859e+00 1.46284e+00  0.00000e+00 0.00000e+00 5.72976e+02 168.403 2.92281e+02 168.403 0.9285 
1 1 1 1   30  6  o 15 3.54353e+00 6.00465e-01 2.59888e+01 301.154 6.19532e-02  -1.02481e-01 0.00000e+00 0.00000e+00 1.80470e+01 121.154 4.40357e+01 121.154 0.0598 
1 1 1 1   30  7  f 0  1.91306e+01 4.79762e-01 3.63480e+02 45.452  6.42673e+00  6.52884e+00  0.00000e+00 0.00000e+00 3.13272e+02 45.452  5.02075e+01 225.452 0.9437 
1 1 1 1   30  8  o 5  2.15490e+01 4.80811e-01 5.11125e+02 233.395 -1.12247e+01 -1.51113e+01 0.00000e+00 0.00000e+00 2.74545e+02 233.395 2.36579e+02 53.395  0.9731 
1 1 1 1   30  9  f 0  3.43470e+01 6.42849e-01 6.12589e+02 322.061 4.02099e+01  -3.13468e+01 0.00000e+00 0.00000e+00 6.61061e+02 322.061 4.84719e+01 322.061 0.9901 
1 1 1 1   30  10 o 3  1.83400e+01 5.25533e-01 3.49668e+02 83.800  2.23508e+00  2.05733e+01  0.00000e+00 0.00000e+00 3.20016e+02 83.800  2.96527e+01 263.800 0.9755 
1 1 1 1   30  11 f 0  7.46709e+00 8.09826e-01 5.76789e+01 352.719 1.77979e+00  -2.27387e-01 0.00000e+00 0.00000e+00 1.26937e+02 352.719 6.92581e+01 352.719 0.6609 
1 1 1 1   30  12 o 11 1.62900e+01 6.18566e-01 3.59940e+02 119.558 -1.64152e+01 2.89449e+01  0.00000e+00 0.00000e+00 2.39815e+02 119.558 1.20125e+02 299.558 0.9849 
1 1 1 1   30  13 o 16 1.57050e+01 6.92531e-01 2.86219e+02 344.171 3.54316e+01  -1.00455e+01 0.00000e+00 0.00000e+00 2.92444e+02 344.171 6.22453e+00 344.171 0.9863 
1 1 1 1   30  14 o 17 7.35083e+00 1.00331e+00 1.86083e+02 215.852 -1.05520e+01 -7.62502e+00 0.00000e+00 0.00000e+00 7.75437e+01 215.852 1.08540e+02 35.852  0.9608 
1 1 1 1   30  15 o 13 8.34082e+00 1.03474e+00 1.19155e+02 292.236 4.01161e+00  -9.81235e+00 0.00000e+00 0.00000e+00 1.76863e+02 292.236 5.77085e+01 292.236 0.9516 
1 1 1 1   30  16 o 8  5.50736e+00 1.29343e+00 9.21308e+01 337.350 5.54057e+00  -2.31194e+00 0.00000e+00 0.00000e+00 9.51096e+01 337.350 2.97886e+00 337.350 0.9124 
1 1 1 1   30  17 o 5  5.18901e+00 1.33429e+00 4.94708e+01 148.838 -2.72996e+00 1.65083e+00  0.00000e+00 0.00000e+00 1.09528e+02 148.838 6.00571e+01 148.838 0.8231 
1 1 1 1   30  18 o 9  1.41239e+01 1.75017e+00 2.09530e+02 331.414 2.62549e+01  -1.43064e+01 0.00000e+00 0.00000e+00 3.06841e+02 331.414 9.73113e+01 331.414 0.9831 
1 1 1 1   30  19 o 10 5.34198e+00 1.61234e+00 9.31039e+01 61.757  2.85258e+00  5.31043e+00  0.00000e+00 0.00000e+00 8.80290e+01 61.757  5.07482e+00 241.757 0.9128 
1 1 1 1   31  0  o 3  1.38044e+01 2.66586e-01 2.00795e+02 190.393 -2.15402e+00 -3.95084e-01 0.00000e+00 0.00000e+00 1.75624e+02 190.393 2.51703e+01 10.394  0.7266 
1 1 1 1   31  1  o 13 1.91067e+01 3.19242e-01 1.97356e+02 141.752 -2.25898e+00 1.78071e+00  0.00000e+00 0.00000e+00 3.76564e+02 141.752 1.79208e+02 141.752 0.8004 
1 1 1 1   31  2  o 15 5.88216e+00 2.52835e-01 1.96432e+02 210.541 -7.56429e-01 -4.46301e-01 0.00000e+00 0.00000e+00 1.07786e+02 30.541  3.04218e+02 30.541  0.4016 
1 1 1 1   31  3  o 5  2.22972e+01 4.01356e-01 5.31384e+02 146.780 -7.69845e+00 5.04150e+00  0.00000e+00 0.00000e+00 2.58377e+02 146.780 2.73006e+02 326.780 0.9440 
1 1 1 1   31  4  o 4  2.38983e+01 4.18685e-01 4.08387e+02 34.456  7.05505e+00  4.84089e+00  0.00000e+00 0.00000e+00 4.34004e+02 34.456  2.56167e+01 34.456  0.9396 
1 1 1 1   31  5  o 1  6.82966e+00 3.63610e-01 2.35486e+02 302.819 9.10660e-01  -1.41202e+00 0.00000e+00 0.00000e+00 7.21559e+01 122.819 3.07642e+02 122.819 0.6376 
1 1 1 1   31  6  o 5  4.05237e+01 6.46392e-01 9.49647e+02 62.196  2.11791e+01  4.01638e+01  0.00000e+00 0.00000e+00 5.52955e+02 62.196  3.96692e+02 242.196 0.9889 
1 1 1 1   31  7  o 1  4.83352e+01 8.21812e-01 1.10216e+03 209.921 -6.19837e+01 -3.56720e+01 0.00000e+00 0.00000e+00 6.96799e+02 209.921 4.05364e+02 29.921  0.9930 
1 1 1 1   31  8  o 1  1.49301e+01 5.72147e-01 3.33149e+02 26.162  7.65092e+00  3.75848e+00  0.00000e+00 0.00000e+00 1.92305e+02 26.162  1.40843e+02 206.162 0.9394 
1 1 1 1   31  9  f 0  3.46455e+01 7.16340e-01 5.07956e+02 103.449 -9.72586e+00 4.06709e+01  0.00000e+00 0.00000e+00 7.73835e+02 103.449 2.65879e+02 103.449 0.9880 
1 1 1 1   31  10 o 7  4.24152e+01 7.69385e-01 7.75347e+02 155.392 -9.43598e+01 4.32170e+01  0.00000e+00 0.00000e+00 8.04487e+02 155.392 2.91398e+01 155.392 0.9952 
1 1 1 1   31  11 o 9  1.82647e+01 5.84670e-01 2.99362e+02 320.968 1.80629e+01  -1.46436e+01 0.00000e+00 0.00000e+00 3.68976e+02 320.968 6.96142e+01 320.968 0.9783 
1 1 1 1   31  12 o 3  8.12637e+00 8.63050e-01 1.80530e+02 183.815 -8.05839e+00 -5.37363e-01 0.00000e+00 0.00000e+00 1.03756e+02 183.815 7.67740e+01 3.815   0.9359 
1 1 1 1   31  13 o 5  1.75321e+01 6.33839e-01 3.28757e+02 300.981 2.45280e+01  -4.08524e+01 0.00000e+00 0.00000e+00 3.19217e+02 300.981 9.54049e+00 120.981 0.9895 
1 1 1 1   31  14 o 17 5.69003e+00 1.18874e+00 1.02692e+02 131.721 -3.44580e+00 3.86460e+00  0.00000e+00 0.00000e+00 8.78814e+01 131.721 1.48110e+01 311.721 0.8973 
1 1 1 1   31  15 o 2  1.41295e+01 8.38099e-01 2.67638e+02 29.387  3.78680e+01  2.13259e+01  0.00000e+00 0.00000e+00 2.53189e+02 29.387  1.44483e+01 209.387 0.9884 
1 1 1 1   31  16 o 12 4.80408e+00 1.24733e+00 7.13126e+01 28.027  3.60190e+00  1.91737e+00  0.00000e+00 0.00000e+00 8.37935e+01 28.027  1.24810e+01 28.027  0.8665 
1 1 1 1   31  17 o 2  3.68489e+00 1.18834e+00 1.43236e+02 166.935 -6.97575e+00 1.61886e+00  0.00000e+00 0.00000e+00 1.60484e+01 346.935 1.59285e+02 346.935 0.9273 
1 1 1 1   31  18 o 6  3.48983e+00 1.19020e+00 2.06221e+01 55.136  6.09440e-01  8.74768e-01  0.00000e+00 0.00000e+00 4.02818e+01 55.136  1.96597e+01 55.136  0.4693 
1 1 1 1   31  19 o 11 5.91728e+00 1.73296e+00 9.23075e+01 101.380 -1.23459e+00 6.13395e+00  0.00000e+00 0.00000e+00 1.09059e+02 101.380 1.67516e+01 101.380 0.9162 
1 1 1 1   32  0  o 10 4.46578e+01 6.22514e-01 7.90985e+02 281.640 5.33674e+00  -2.59071e+01 0.00000e+00 0.00000e+00 8.52757e+02 281.640 6.17720e+01 281.640 0.9809 
1 1 1 1   32  1  o 19 2.03031e+01 3.33566e-01 2.43187e+02 102.750 -8.04262e-01 3.55423e+00  0.00000e+00 0.00000e+00 4.03086e+02 102.750 1.59900e+02 102.750 0.8483 
1 1 1 1   32  2  o 5  1.75524e+01 3.11340e-01 2.93564e+02 261.711 -6.47530e-01 -4.44455e+00 0.00000e+00 0.00000e+00 2.86062e+02 261.711 7.50231e+00 81.711  0.8801 
1 1 1 1   32  3  o 19 2.42768e+01 3.95265e-01 6.50491e+02 39.235  1.05860e+01  8.64437e+00  0.00000e+00 0.00000e+00 2.26344e+02 39.235  4.24147e+02 219.235 0.9627 
1 1 1 1   32  4  o 9  1.28026e+01 3.16862e-01 2.48903e+02 304.175 1.70229e+00  -2.50720e+00 0.00000e+00 0.00000e+00 1.41159e+02 304.175 1.07744e+02 124.175 0.8122 
1 1 1 1   32  5  o 3  8.67568e+00 3.18426e-01 2.49246e+02 84.292  2.59888e-01  2.59995e+00  0.00000e+00 0.00000e+00 3.47487e+00 84.292  2.45771e+02 264.292 0.7767 
1 1 1 1   32  6  o 18 3.56605e+01 5.82940e-01 4.79157e+02 92.123  -7.76328e-01 2.09382e+01  0.00000e+00 0.00000e+00 8.25505e+02 92.123  3.46348e+02 92.123  0.9758 
1 1 1 1   32  7  o 5  3.36316e+01 6.10657e-01 6.47155e+02 71.909  1.07136e+01  3.27957e+01  0.00000e+00 0.00000e+00 5.94892e+02 71.909  5.22627e+01 251.909 0.9854 
1 1 1 1   32  8  o 11 3.03032e+01 5.80828e-01 6.31788e+02 339.084 3.05623e+01  -1.16807e+01 0.00000e+00 0.00000e+00 4.85961e+02 339.084 1.45828e+02 159.084 0.9846 
1 1 1 1   32  9  o 6  6.56657e+00 7.34178e-01 9.34025e+01 189.882 -1.59558e+00 -2.77948e-01 0.00000e+00 0.00000e+00 6.01118e+01 189.882 3.32908e+01 9.882   0.6243 
1 1 1 1   32  10 o 10 2.26891e+01 6.21068e-01 5.37821e+02 228.134 -2.51301e+01 -2.80417e+01 0.00000e+00 0.00000e+00 2.99952e+02 228.134 2.37870e+02 48.134  0.9866 
1 1 1 1   32  11 o 5  1.39704e+01 5.83237e-01 2.85945e+02 308.046 1.07867e+01  -1.37837e+01 0.00000e+00 0.00000e+00 2.21421e+02 308.046 6.45248e+01 128.046 0.9710 
1 1 1 1   32  12 o 18 4.69164e+00 1.06317e+00 1.53567e+02 221.808 -3.01550e+00 -2.69691e+00 0.00000e+00 0.00000e+00 1.83669e+00 41.808  1.55404e+02 41.808  0.8653 
1 1 1 1   32  13 o 10 2.31665e+01 6.54998e-01 4.73007e+02 78.878  1.64389e+01  8.36209e+01  0.00000e+00 0.00000e+00 3.87173e+02 78.878  8.58347e+01 258.878 0.9941 
1 1 1 1   32  14 o 2  3.70710e+00 1.04570e+00 9.70470e+01 240.376 -1.63775e+00 -2.88019e+00 0.00000e+00 0.00000e+00 1.78846e+01 240.376 7.91623e+01 60.376  0.8307 
1 1 1 1   32  15 o 6  7.55962e+00 1.05703e+00 1.22097e+02 32.680  8.88681e+00  5.70091e+00  0.00000e+00 0.00000e+00 1.46094e+02 32.680  2.39967e+01 32.680  0.9514 
1 1 1 1   32  16 o 3  5.89330e+00 1.34334e+00 1.14504e+02 122.127 -4.06940e+00 6.48043e+00  0.00000e+00 0.00000e+00 9.01589e+01 122.127 2.43454e+01 302.127 0.9322 
1 1 1 1   32  17 o 4  9.01844e+00 1.42750e+00 1.09871e+02 89.585  8.53248e-02  1.17919e+01  0.00000e+00 0.00000e+00 2.11225e+02 89.585  1.01354e+02 89.585  0.9566 
1 1 1 1   32  18 o 16 7.52757e+00 1.73631e+00 1.49818e+02 253.429 -3.30516e+00 -1.11076e+01 0.00000e+00 0.00000e+00 1.17703e+02 253.429 3.21152e+01 73.429  0.9558 
1 1 1 1   32  19 o 8  5.64778e+00 1.71112e+00 3.60623e+01 213.933 -1.96573e+00 -1.32255e+00 0.00000e+00 0.00000e+00 1.21257e+02 213.933 8.51946e+01 213.933 0.7500 
1 1 1 1   33  0  o 18 2.63175e+01 3.98128e-01 5.42485e+02 175.876 -1.08469e+01 7.82139e-01  0.00000e+00 0.00000e+00 3.98402e+02 175.876 1.44083e+02 355.876 0.9529 
1 1 1 1   33  1  o 2  1.49916e+01 2.84332e-01 2.18029e+02 336.071 2.24114e+00  -9.94504e-01 0.00000e+00 0.00000e+00 2.09279e+02 336.071 8.75016e+00 156.071 0.7597 
1 1 1 1   33  2  o 14 2.09012e+00 3.99755e-01 1.56219e+02 101.661 -5.59811e-02 2.71241e-01  0.00000e+00 0.00000e+00 1.45462e+02 281.661 3.01681e+02 281.661 0.1372 
1 1 1 1   33  3  o 19 1.16587e+01 2.82144e-01 2.68055e+02 121.987 -1.40564e+00 2.25064e+00  0.00000e+00 0.00000e+00 7.34069e+01 121.987 1.94649e+02 301.987 0.7807 
1 1 1 1   33  4  o 3  1.65991e+01 3.43995e-01 3.75541e+02 110.467 -1.97182e+00 5.28306e+00  0.00000e+00 0.00000e+00 1.88759e+02 110.467 1.86783e+02 290.467 0.9064 
1 1 1 1   33  5  o 4  2.18057e+01 4.06056e-01 5.86059e+02 86.614  9.01040e-01  1.52271e+01  0.00000e+00 0.00000e+00 2.04364e+02 86.614  3.81695e+02 266.614 0.9666 
1 1 1 1   33  6  o 12 1.07901e+01 3.47780e-01 2.71353e+02 252.324 -1.16405e+00 -3.65269e+00 0.00000e+00 0.00000e+00 7.52264e+01 252.324 1.96127e+02 72.324  0.8568 
1 1 1 1   33  7  o 11 4.48600e+01 7.12993e-01 8.12547e+02 84.579  5.40000e+00  5.69059e+01  0.00000e+00 0.00000e+00 8.53802e+02 84.579  4.12545e+01 84.579  0.9912 
1 1 1 1   33  8  f 0  1.29084e+01 4.48543e-01 5.13150e+02 232.354 -8.48687e+00 -1.10023e+01 0.00000e+00 0.00000e+00 4.73489e+01 52.354  5.60499e+02 52.354  0.9633 
1 1 1 1   33  9  o 7  4.63780e+00 7.42767e-01 2.01467e+02 175.135 -2.39975e+00 2.04251e-01  0.00000e+00 0.00000e+00 7.04245e+01 355.135 2.71892e+02 355.135 0.7547 
1 1 1 1   33  10 o 19 1.02116e+01 6.21402e-01 2.06674e+02 2.499   6.70713e+00  2.92727e-01  0.00000e+00 0.00000e+00 1.45721e+02 2.499   6.09523e+01 182.499 0.9222 
1 1 1 1   33  11 o 3  9.85157e+00 6.54355e-01 1.56318e+02 205.444 -6.32655e+00 -3.01006e+00 0.00000e+00 0.00000e+00 1.84705e+02 205.444 2.83863e+01 205.444 0.9256 
1 1 1 1   33  12 o 14 2.96309e+01 6.70260e-01 3.74411e+02 65.945  2.72623e+01  6.10739e+01  0.00000e+00 0.00000e+00 7.24698e+02 65.945  3.50288e+02 65.945  0.9925 
1 1 1 1   33  13 o 2  3.05255e+00 9.15108e-01 1.48204e+02 327.613 3.04098e+00  -1.92890e+00 0.00000e+00 0.00000e+00 5.17325e+01 147.613 1.99936e+02 147.613 0.8462 
1 1 1 1   33  14 o 12 5.83719e+00 1.10658e+00 8.72422e+01 316.211 3.44335e+00  -3.30075e+00 0.00000e+00 0.00000e+00 1.06137e+02 316.211 1.88948e+01 316.211 0.8878 
1 1 1 1   33  15 o 18 6.80293e+00 1.00263e+00 1.43229e+02 48.496  7.28218e+00  8.22999e+00  0.00000e+00 0.00000e+00 9.85926e+01 48.496  4.46363e+01 228.496 0.9534 
1 1 1 1   33  16 o 11 8.14626e+00 1.23842e+00 8.99773e+01 186.544 -8.70325e+00 -9.98360e-01 0.00000e+00 0.00000e+00 1.95603e+02 186.544 1.05626e+02 186.544 0.9411 
1 1 1 1   33  17 o 18 3.81965e+00 1.21040e+00 9.62951e+01 306.268 2.83379e+00  -3.86231e+00 0.00000e+00 0.00000e+00 2.99766e+01 306.268 6.63185e+01 126.268 0.8883 
1 1 1 1   33  18 o 17 3.64118e+00 1.22648e+00 4.90159e+01 119.987 -1.30381e+00 2.25949e+00  0.00000e+00 0.00000e+00 5.60752e+01 119.987 7.05926e+00 119.987 0.7763 
1 1 1 1   33  19 f 0  4.94926e+00 1.62878e+00 6.78210e+01 10.884  4.07753e+00  7.84014e-01  0.00000e+00 0.00000e+00 9.19268e+01 10.884  2.41059e+01 10.884  0.8691 
1 1 1 1   34  0  f 0  1.68355e+01 2.99140e-01 2.62154e+02 324.782 3.14784e+00  -2.22204e+00 0.00000e+00 0.00000e+00 2.79537e+02 324.782 1.73833e+01 324.782 0.8576 
1 1 1 1   34  1  f 0  6.27156e+00 2.49121e-01 2.05637e+02 309.798 7.10293e-01  -8.52584e-01 0.00000e+00 0.00000e+00 9.17772e+01 129.798 2.97414e+02 129.798 0.4839 
1 1 1 1   34  2  f 0  2.07409e+01 3.45318e-01 3.37211e+02 324.199 4.35857e+00  -3.14360e+00 0.00000e+00 0.00000e+00 3.64161e+02 324.199 2.69503e+01 324.199 0.9014 
1 1 1 1   34  3  f 0  1.03008e+01 3.04253e-01 3.65585e+02 158.282 -3.09654e+00 1.23337e+00  0.00000e+00 0.00000e+00 4.41485e+01 338.282 4.09733e+02 338.282 0.8319 
1 1 1 1   34  4  o 6  1.64484e+01 3.45151e-01 3.32662e+02 72.724  1.73231e+00  5.57003e+00  0.00000e+00 0.00000e+00 2.28517e+02 72.724  1.04145e+02 252.724 0.9097 
1 1 1 1   34  5  o 2  4.39684e+01 6.89112e-01 8.42183e+02 6.654   4.02935e+01  4.70054e+00  0.00000e+00 0.00000e+00 7.86002e+02 6.654   5.61816e+01 186.654 0.9876 
1 1 1 1   34  6  o 5  5.96838e+01 9.14491e-01 1.00300e+03 212.946 -6.42193e+01 -4.16191e+01 0.00000e+00 0.00000e+00 1.21957e+03 212.946 2.16564e+02 212.946 0.9934 
1 1 1 1   34  7  o 12 2.35587e+01 4.62224e-01 3.80033e+02 336.417 1.26594e+01  -5.52632e+00 0.00000e+00 0.00000e+00 4.70164e+02 336.417 9.01313e+01 336.417 0.9631 
1 1 1 1   34  8  o 3  1.54384e+01 4.55498e-01 2.67932e+02 355.659 8.62672e+00  -6.54888e-01 0.00000e+00 0.00000e+00 2.75802e+02 355.659 7.86942e+00 355.659 0.9403 
1 1 1 1   34  9  o 10 6.13856e+00 7.11058e-01 6.08370e+01 171.729 -9.52547e-01 1.38468e-01  0.00000e+00 0.00000e+00 3.86646e+01 171.729 2.21724e+01 351.729 0.4330 
1 1 1 1   34  10 o 9  4.88895e+01 8.64657e-01 8.93442e+02 79.047  2.66305e+01  1.37598e+02  0.00000e+00 0.00000e+00 9.29346e+02 79.047  3.59043e+01 79.047  0.9964 
1 1 1 1   34  11 o 12 1.81750e+01 5.72991e-01 2.91336e+02 221.857 -1.80284e+01 -1.61518e+01 0.00000e+00 0.00000e+00 3.74128e+02 221.857 8.27921e+01 221.857 0.9791 
1 1 1 1   34  12 o 19 2.42440e+01 7.03340e-01 3.61869e+02 356.597 5.35600e+01  -3.18481e+00 0.00000e+00 0.00000e+00 5.35654e+02 356.597 1.73785e+02 356.597 0.9906 
1 1 1 1   34  13 o 18 1.66937e+01 6.46405e-01 3.77144e+02 246.189 -2.18472e+01 -4.95091e+01 0.00000e+00 0.00000e+00 2.40466e+02 246.189 1.36677e+02 66.189  0.9907 
1 1 1 1   34  14 f 0  1.51998e+01 7.23729e-01 1.76932e+02 114.960 -1.16898e+01 2.51148e+01  0.00000e+00 0.00000e+00 3.79902e+02 114.960 2.02970e+02 114.960 0.9818 
1 1 1 1   34  15 o 1  3.22007e+00 1.02814e+00 5.04109e+01 270.128 4.28169e-03  -1.92037e+00 0.00000e+00 0.00000e+00 3.17354e+01 270.128 1.86755e+01 90.128  0.6843 
1 1 1 1   34  16 o 2  5.11188e+00 1.28698e+00 1.43498e+02 272.357 3.50550e-01  -8.51784e+00 0.00000e+00 0.00000e+00 3.53691e+01 272.357 1.08129e+02 92.357  0.9394 
1 1 1 1   34  17 o 9  5.01264e+00 1.38428e+00 5.65791e+01 114.903 -1.48866e+00 3.20662e+00  0.00000e+00 0.00000e+00 1.00655e+02 114.903 4.40761e+01 114.903 0.8429 
1 1 1 1   34  18 o 13 4.14224e+00 1.35911e+00 7.39524e+01 336.245 3.79283e+00  -1.66926e+00 0.00000e+00 0.00000e+00 5.98353e+01 336.245 1.41171e+01 156.245 0.8688 
1 1 1 1   34  19 o 14 5.92408e+00 1.86540e+00 1.45035e+02 185.201 -9.16857e+00 -8.34600e-01 0.00000e+00 0.00000e+00 6.26337e+01 185.201 8.24018e+01 5.201   0.9440 
1 1 1 1   35  0  o 7  2.77871e+01 4.17780e-01 5.45771e+02 219.270 -9.95381e+00 -8.13840e+00 0.00000e+00 0.00000e+00 4.55221e+02 219.270 9.05506e+01 39.270  0.9603 
1 1 1 1   35  1  o 18 9.82899e+00 2.76423e-01 2.82375e+02 23.121  1.98358e+00  8.46946e-01  0.00000e+00 0.00000e+00 1.61876e+01 203.121 2.98563e+02 203.121 0.7219 
1 1 1 1   35  2  o 9  9.54355e+00 2.64805e-01 2.01578e+02 227.813 -1.10603e+00 -1.22035e+00 0.00000e+00 0.00000e+00 2.41113e+01 227.813 1.77467e+02 47.813  0.6304 
1 1 1 1   35  3  o 16 7.56369e+00 2.92752e-01 1.81083e+02 313.503 9.02397e-01  -9.50837e-01 0.00000e+00 0.00000e+00 2.62450e+01 133.503 2.07328e+02 133.503 0.5458 
1 1 1 1   35  4  o 16 3.19391e+01 5.31793e-01 7.41094e+02 49.150  1.62035e+01  1.87386e+01  0.00000e+00 0.00000e+00 4.32229e+02 49.150  3.08865e+02 229.150 0.9796 
1 1 1 1   35  5  o 9  2.78404e+01 4.82591e-01 7.33745e+02 157.217 -2.46582e+01 1.03569e+01  0.00000e+00 0.00000e+00 2.90353e+02 157.217 4.43393e+02 337.217 0.9811 
1 1 1 1   35  6  o 18 5.12428e+01 7.93613e-01 8.95860e+02 305.166 3.33974e+01  -4.74033e+01 0.00000e+00 0.00000e+00 1.00815e+03 305.166 1.12289e+02 305.166 0.9913 
1 1 1 1   35  7  o 4  2.13870e+01 4.38126e-01 3.61684e+02 100.132 -2.57290e+00 1.43972e+01  0.00000e+00 0.00000e+00 4.11741e+02 100.132 5.00565e+01 100.132 0.9652 
1 1 1 1   35  8  o 16 4.72749e+01 7.56810e-01 9.17527e+02 62.048  4.36421e+01  8.22454e+01  0.00000e+00 0.00000e+00 8.43490e+02 62.048  7.40376e+01 242.048 0.9946 
1 1 1 1   35  9  f 0  2.27341e+01 5.34224e-01 5.10132e+02 258.373 -6.39907e+00 -3.10996e+01 0.00000e+00 0.00000e+00 3.27392e+02 258.373 1.82740e+02 78.373  0.9841 
1 1 1 1   35  10 f 0  1.87872e+01 5.45645e-01 2.24261e+02 75.252  3.52401e+00  1.33874e+01  0.00000e+00 0.00000e+00 4.52761e+02 75.252  2.28500e+02 75.252  0.9632 
1 1 1 1   35  11 o 6  8.06147e+00 7.96379e-01 2.29582e+02 268.926 -1.62960e-01 -8.69113e+00 0.00000e+00 0.00000e+00 5.39406e+01 268.926 1.75642e+02 88.926  0.9406 
1 1 1 1   35  12 o 17 5.60582e+00 9.94149e-01 1.20386e+02 27.594  3.77466e+00  1.97288e+00  0.00000e+00 0.00000e+00 6.24397e+01 27.594  5.79465e+01 207.594 0.8728 
1 1 1 1   35  13 o 10 3.79918e+00 1.03242e+00 5.74705e+01 3.368   1.69286e+00  9.96254e-02  0.00000e+00 0.00000e+00 3.34538e+01 3.368   2.40167e+01 183.368 0.6409 
1 1 1 1   35  14 o 8  8.98001e+00 9.10933e-01 1.95345e+02 297.836 8.38208e+00  -1.58741e+01 0.00000e+00 0.00000e+00 1.30233e+02 297.836 6.51119e+01 117.836 0.9717 
1 1 1 1   35  15 o 16 3.91352e+00 1.03089e+00 7.41222e+01 141.799 -2.68902e+00 2.11616e+00  0.00000e+00 0.00000e+00 4.79770e+01 141.799 2.61452e+01 321.798 0.8369 
1 1 1 1   35  16 o 11 9.85202e+00 1.24583e+00 1.27048e+02 80.241  2.53287e+00  1.47267e+01  0.00000e+00 0.00000e+00 2.27393e+02 80.241  1.00345e+02 80.241  0.9659 
1 1 1 1   35  17 o 7  6.38222e+00 1.47468e+00 3.44406e+01 226.573 -1.83165e+00 -1.93509e+00 0.00000e+00 0.00000e+00 1.51210e+02 226.573 1.16770e+02 226.573 0.7818 
1 1 1 1   35  18 o 15 3.94482e+00 1.32575e+00 8.78114e+01 210.958 -4.25217e+00 -2.55067e+00 0.00000e+00 0.00000e+00 4.30450e+01 210.958 4.47663e+01 30.958  0.8924 
1 1 1 1   35  19 o 15 4.43004e+00 1.51950e+00 1.05102e+02 349.724 6.50113e+00  -1.17866e+00 0.00000e+00 0.00000e+00 4.63707e+01 349.724 5.87308e+01 169.724 0.9209 
1 1 1 1   36  0  o 6  2.36106e+01 3.71653e-01 4.90500e+02 179.151 -8.88071e+00 1.31596e-01  0.00000e+00 0.00000e+00 3.43673e+02 179.151 1.46827e+02 359.151 0.9419 
1 1 1 1   36  1  o 12 1.71060e+01 3.07674e-01 5.14404e+02 104.633 -1.91953e+00 7.35188e+00  0.00000e+00 0.00000e+00 8.33956e+01 104.633 4.31008e+02 284.633 0.9317 
1 1 1 1   36  2  o 7  1.67078e+01 3.10679e-01 4.02911e+02 157.357 -5.53320e+00 2.30807e+00  0.00000e+00 0.00000e+00 1.68800e+02 157.357 2.34110e+02 337.357 0.9123 
1 1 1 1   36  3  o 2  1.82742e+01 3.55318e-01 2.71839e+02 237.381 -2.43236e+00 -3.80059e+00 0.00000e+00 0.00000e+00 3.31749e+02 237.381 5.99100e+01 237.381 0.8807 
1 1 1 1   36  4  o 8  1.46550e+01 3.62936e-01 3.22370e+02 309.844 3.13631e+00  -3.75838e+00 0.00000e+00 0.00000e+00 1.67196e+02 309.844 1.55174e+02 129.844 0.8909 
1 1 1 1   36  5  o 1  6.87753e+01 1.04311e+00 1.27533e+03 326.675 8.54031e+01  -5.61530e+01 0.00000e+00 0.00000e+00 1.29032e+03 326.675 1.49926e+01 326.675 0.9951 
1 1 1 1   36  6  o 9  1.31602e+01 4.28298e-01 2.56460e+02 27.614  3.95195e+00  2.06722e+00  0.00000e+00 0.00000e+00 1.77145e+02 27.614  7.93160e+01 207.614 0.8791 
1 1 1 1   36  7  o 11 1.76042e+01 4.10860e-01 2.40221e+02 151.196 -6.52217e+00 3.58619e+00  0.00000e+00 0.00000e+00 3.73253e+02 151.196 1.33033e+02 151.196 0.9302 
1 1 1 1   36  8  o 9  2.79838e+01 5.24441e-01 4.22497e+02 307.749 1.60690e+01  -2.07540e+01 0.00000e+00 0.00000e+00 6.05293e+02 307.749 1.82796e+02 307.749 0.9808 
1 1 1 1   36  9  o 7  2.11301e+01 5.24065e-01 2.80038e+02 319.122 1.25309e+01  -1.08463e+01 0.00000e+00 0.00000e+00 4.86628e+02 319.122 2.06589e+02 319.122 0.9693 
1 1 1 1   36  10 o 9  2.13490e+01 6.94122e-01 2.71470e+02 79.425  3.72823e+00  1.99694e+01  0.00000e+00 0.00000e+00 5.07293e+02 79.425  2.35823e+02 79.425  0.9751 
1 1 1 1   36  11 o 9  1.51236e+01 5.74961e-01 3.17373e+02 100.208 -4.00519e+00 2.22421e+01  0.00000e+00 0.00000e+00 2.35411e+02 100.208 8.19615e+01 280.208 0.9776 
1 1 1 1   36  12 o 11 4.44051e+00 1.04722e+00 8.73122e+01 262.785 -3.12584e-01 -2.46913e+00 0.00000e+00 0.00000e+00 3.94073e+01 262.785 4.79049e+01 82.785  0.7638 
1 1 1 1   36  13 o 4  1.41997e+01 6.86279e-01 2.16295e+02 40.714  2.07932e+01  1.78940e+01  0.00000e+00 0.00000e+00 3.04112e+02 40.714  8.78178e+01 40.714  0.9816 
1 1 1 1   36  14 o 7  8.27236e+00 9.80886e-01 1.18979e+02 119.709 -4.85923e+00 8.51592e+00  0.00000e+00 0.00000e+00 1.73448e+02 119.709 5.44690e+01 119.709 0.9475 
1 1 1 1   36  15 o 11 5.67827e+00 1.17981e+00 1.00526e+02 102.433 -1.35828e+00 6.16070e+00  0.00000e+00 0.00000e+00 9.35444e+01 102.433 6.98209e+00 282.433 0.9169 
1 1 1 1   36  16 o 14 8.19806e+00 1.34185e+00 1.56542e+02 60.334  7.18787e+00  1.26189e+01  0.00000e+00 0.00000e+00 1.38059e+02 60.334  1.84832e+01 240.334 0.9649 
1 1 1 1   36  17 o 6  4.37238e+00 1.31570e+00 7.63333e+01 181.506 -4.48945e+00 -1.18037e-01 0.00000e+00 0.00000e+00 6.68328e+01 181.506 9.50053e+00 1.506   0.8801 
1 1 1 1   36  18 o 1  7.32859e+00 1.93446e+00 1.68506e+02 233.861 -6.79709e+00 -9.30769e+00 0.00000e+00 0.00000e+00 9.17786e+01 233.861 7.67269e+01 53.861  0.9556 
1 1 1 1   36  19 o 2  4.38315e+00 1.49065e+00 9.77319e+01 146.847 -5.33065e+00 3.48201e+00  0.00000e+00 0.00000e+00 5.16089e+01 146.847 4.61231e+01 326.847 0.9177 
1 1 1 1   37  0  o 11 7.88852e+00 2.53011e-01 1.98744e+02 337.438 1.23629e+00  -5.13644e-01 0.00000e+00 0.00000e+00 3.49316e+01 157.439 2.33676e+02 157.439 0.5537 
1 1 1 1   37  1  o 12 4.13831e+01 5.87015e-01 8.65731e+02 280.218 5.34534e+00  -2.96551e+01 0.00000e+00 0.00000e+00 6.60425e+02 280.218 2.05306e+02 100.218 0.9833 
1 1 1 1   37  2  o 8  2.04317e+00 4.34614e-01 4.75838e+01 180.344 -9.33140e-02 -5.60643e-04 0.00000e+00 0.00000e+00 4.40124e+01 0.344   9.15963e+01 0.344   0.0466 
1 1 1 1   37  3  o 12 9.00026e+00 2.80302e-01 2.23280e+02 157.764 -1.98982e+00 8.13482e-01  0.00000e+00 0.00000e+00 2.00276e+01 157.764 2.03252e+02 337.764 0.7209 
1 1 1 1   37  4  o 5  5.23245e+01 8.05939e-01 9.53119e+02 310.894 3.86076e+01  -4.45785e+01 0.00000e+00 0.00000e+00 9.92015e+02 310.894 3.88962e+01 310.894 0.9915 
1 1 1 1   37  5  o 17 1.20494e+01 3.69679e-01 8.75555e+01 313.801 9.00346e-01  -9.38828e-01 0.00000e+00 0.00000e+00 1.57652e+02 313.801 7.00962e+01 313.801 0.5429 
1 1 1 1   37  6  f 0  1.68630e+01 3.81569e-01 4.37972e+02 244.684 -4.29930e+00 -9.08858e+00 0.00000e+00 0.00000e+00 1.61649e+02 244.684 2.76323e+02 64.684  0.9489 
1 1 1 1   37  7  o 2  2.27175e+01 4.53218e-01 3.09376e+02 86.215  7.94119e-01  1.20044e+01  0.00000e+00 0.00000e+00 5.05458e+02 86.215  1.96083e+02 86.215  0.9575 
1 1 1 1   37  8  o 15 2.33787e+01 4.86872e-01 4.44477e+02 150.302 -1.99909e+01 1.14015e+01  0.00000e+00 0.00000e+00 4.11699e+02 150.302 3.27784e+01 330.302 0.9780 
1 1 1 1   37  9  o 5  2.47602e+01 5.27485e-01 4.37847e+02 261.306 -4.94813e+00 -3.23586e+01 0.00000e+00 0.00000e+00 4.74583e+02 261.306 3.67358e+01 261.306 0.9846 
1 1 1 1   37  10 o 15 2.44570e+01 5.78815e-01 3.76440e+02 142.816 -2.52239e+01 1.91347e+01  0.00000e+00 0.00000e+00 5.23849e+02 142.816 1.47409e+02 142.816 0.9841 
1 1 1 1   37  11 o 10 1.85226e+01 6.24625e-01 3.48280e+02 35.964  2.62343e+01  1.90351e+01  0.00000e+00 0.00000e+00 3.33404e+02 35.964  1.48755e+01 215.964 0.9845 
1 1 1 1   37  12 o 18 1.72897e+01 6.08320e-01 3.21264e+02 26.991  3.67074e+01  1.86961e+01  0.00000e+00 0.00000e+00 3.16780e+02 26.991  4.48452e+00 206.991 0.9878 
1 1 1 1   37  13 o 8  1.57934e+01 6.72715e-01 2.42560e+02 343.539 3.28660e+01  -9.71109e+00 0.00000e+00 0.00000e+00 3.38380e+02 343.539 9.58204e+01 343.539 0.9853 
1 1 1 1   37  14 o 8  8.82754e+00 9.10162e-01 1.28875e+02 122.625 -5.89927e+00 9.21546e+00  0.00000e+00 0.00000e+00 1.84992e+02 122.625 5.61164e+01 122.625 0.9531 
1 1 1 1   37  15 o 3  9.70568e+00 1.00847e+00 1.62295e+02 37.108  1.55422e+01  1.17579e+01  0.00000e+00 0.00000e+00 1.90044e+02 37.108  2.77493e+01 37.108  0.9740 
1 1 1 1   37  16 f 0  4.10126e+00 1.22420e+00 8.06048e+01 269.471 -3.81202e-02 -4.12877e+00 0.00000e+00 0.00000e+00 5.20040e+01 269.471 2.86008e+01 89.471  0.8683 
1 1 1 1   37  17 o 4  7.78371e+00 1.62796e+00 1.21802e+02 127.131 -6.03216e+00 7.96689e+00  0.00000e+00 0.00000e+00 1.52871e+02 127.131 3.10693e+01 127.131 0.9486 
1 1 1 1   37  18 o 7  5.37472e+00 1.64770e+00 7.21851e+01 222.730 -3.23303e+00 -2.98650e+00 0.00000e+00 0.00000e+00 1.03061e+02 222.730 3.08761e+01 222.730 0.8774 
1 1 1 1   37  19 o 8  4.66603e+00 1.57401e+00 4.90458e+01 317.612 2.34485e+00  -2.14027e+00 0.00000e+00 0.00000e+00 9.33590e+01 317.612 4.43132e+01 317.612 0.8221 
1 1 1 1   38  0  o 3  9.02402e+00 2.59381e-01 3.61865e+02 262.615 -3.72660e-01 -2.87526e+00 0.00000e+00 0.00000e+00 9.03653e+01 82.615  4.52230e+02 82.615  0.8023 
1 1 1 1   38  1  o 17 1.20629e+01 2.73742e-01 9.95881e+01 17.580  1.00692e+00  3.19033e-01  0.00000e+00 0.00000e+00 1.11212e+02 17.580  1.16235e+01 17.580  0.4660 
1 1 1 1   38  2  o 5  1.71929e+01 3.40103e-01 4.57483e+02 84.322  7.09344e-01  7.13463e+00  0.00000e+00 0.00000e+00 1.40441e+02 84.322  3.17041e+02 264.322 0.9274 
1 1 1 1   38  3  o 7  1.59040e+01 3.17673e-01 1.59232e+02 307.003 1.60609e+00  -2.13108e+00 0.00000e+00 0.00000e+00 3.07195e+02 307.003 1.47963e+02 307.003 0.7821 
1 1 1 1   38  4  o 12 1.48198e+01 3.80769e-01 2.81887e+02 12.824  4.49341e+00  1.02289e+00  0.00000e+00 0.00000e+00 2.08940e+02 12.824  7.29470e+01 192.824 0.8834 
1 1 1 1   38  5  o 15 2.25498e+01 4.25803e-01 3.35066e+02 136.774 -7.19547e+00 6.76318e+00  0.00000e+00 0.00000e+00 4.66113e+02 136.774 1.31047e+02 136.774 0.9479 
1 1 1 1   38  6  o 12 2.41416e+01 4.52013e-01 3.91068e+02 197.273 -1.43549e+01 -4.46364e+00 0.00000e+00 0.00000e+00 4.82894e+02 197.273 9.18255e+01 197.273 0.9661 
1 1 1 1   38  7  o 17 1.39208e+01 4.78392e-01 2.90819e+02 242.642 -3.19736e+00 -6.17956e+00 0.00000e+00 0.00000e+00 1.91531e+02 242.642 9.92873e+01 62.642  0.9251 
1 1 1 1   38  8  o 12 2.64497e+01 5.07675e-01 3.81729e+02 138.150 -1.83489e+01 1.64348e+01  0.00000e+00 0.00000e+00 5.88259e+02 138.150 2.06530e+02 138.150 0.9795 
1 1 1 1   38  9  o 18 2.39409e+01 5.15026e-01 3.14022e+02 188.950 -2.13345e+01 -3.36009e+00 0.00000e+00 0.00000e+00 5.60925e+02 188.950 2.46904e+02 188.950 0.9766 
1 1 1 1   38  10 o 6  2.11146e+01 5.60190e-01 2.84952e+02 52.907  1.41742e+01  1.87462e+01  0.00000e+00 0.00000e+00 4.87803e+02 52.907  2.02851e+02 52.907  0.9785 
1 1 1 1   38  11 o 2  1.60289e+01 5.93256e-01 2.41671e+02 280.848 3.94412e+00  -2.05821e+01 0.00000e+00 0.00000e+00 3.43020e+02 280.848 1.01349e+02 280.848 0.9758 
1 1 1 1   38  12 o 10 1.26745e+01 6.48444e-01 1.87473e+02 350.440 1.73359e+01  -2.91970e+00 0.00000e+00 0.00000e+00 2.72319e+02 350.440 8.48459e+01 350.440 0.9711 
1 1 1 1   38  13 o 16 3.63195e+00 9.55869e-01 8.25400e+01 323.813 2.00781e+00  -1.46877e+00 0.00000e+00 0.00000e+00 2.09923e+01 323.813 6.15478e+01 143.813 0.7637 
1 1 1 1   38  14 o 13 8.09292e+00 9.94878e-01 1.31329e+02 94.361  -8.12712e-01 1.06570e+01  0.00000e+00 0.00000e+00 1.56043e+02 94.361  2.47135e+01 94.361  0.9520 
1 1 1 1   38  15 o 6  1.66750e+01 8.79705e-01 2.65355e+02 165.458 -5.34239e+01 1.38581e+01  0.00000e+00 0.00000e+00 3.50428e+02 165.458 8.50731e+01 165.458 0.9909 
1 1 1 1   38  16 o 12 4.84127e+00 1.32511e+00 1.36876e+02 359.295 7.40604e+00  -9.11627e-02 0.00000e+00 0.00000e+00 3.07312e+01 359.295 1.06145e+02 179.295 0.9298 
1 1 1 1   38  17 o 14 6.86419e+00 1.62820e+00 8.31606e+01 91.138  -1.21019e-01 6.09478e+00  0.00000e+00 0.00000e+00 1.50170e+02 91.138  6.70093e+01 91.138  0.9138 
1 1 1 1   38  18 o 13 6.79469e+00 1.87911e+00 1.24714e+02 183.245 -8.27894e+00 -4.69404e-01 0.00000e+00 0.00000e+00 1.12022e+02 183.245 1.26923e+01 3.245   0.9376 
1 1 1 1   38  19 o 15 8.12618e+00 1.85134e+00 9.65430e+01 198.744 -8.29408e+00 -2.81444e+00 0.00000e+00 0.00000e+00 1.87313e+02 198.744 9.07703e+01 198.744 0.9411 
1 1 1 1   39  0  o 3  1.08019e+01 2.82987e-01 1.64300e+02 217.666 -1.34531e+00 -1.03851e+00 0.00000e+00 0.00000e+00 9.56326e+01 217.666 6.86679e+01 37.666  0.6417 
1 1 1 1   39  1  o 11 2.19674e+01 3.61320e-01 3.00723e+02 343.067 5.99368e+00  -1.82481e+00 0.00000e+00 0.00000e+00 4.54071e+02 343.067 1.53349e+02 343.067 0.9163 
1 1 1 1   39  2  o 7  9.67853e+00 3.24647e-01 2.17737e+02 169.900 -1.85979e+00 3.31289e-01  0.00000e+00 0.00000e+00 2.85671e+01 169.900 1.89170e+02 349.900 0.6787 
1 1 1 1   39  3  o 1  4.28700e+01 6.12590e-01 8.30136e+02 215.128 -3.00203e+01 -2.11202e+01 0.00000e+00 0.00000e+00 7.55116e+02 215.128 7.50195e+01 35.128  0.9863 
1 1 1 1   39  4  o 5  1.22524e+01 3.91942e-01 1.58198e+02 130.627 -1.65398e+00 1.92788e+00  0.00000e+00 0.00000e+00 1.95133e+02 130.627 3.69347e+01 130.627 0.7693 
1 1 1 1   39  5  o 17 1.08797e+01 3.39306e-01 2.89630e+02 111.638 -1.50954e+00 3.80535e+00  0.00000e+00 0.00000e+00 6.38953e+01 111.638 2.25735e+02 291.638 0.8670 
1 1 1 1   39  6  o 14 3.80013e+01 6.18836e-01 5.95186e+02 299.497 1.71727e+01  -3.03559e+01 0.00000e+00 0.00000e+00 8.08009e+02 299.497 2.12823e+02 299.497 0.9856 
1 1 1 1   39  7  o 8  5.89257e+01 9.09213e-01 9.50465e+02 101.017 -2.19802e+01 1.12898e+02  0.00000e+00 0.00000e+00 1.24684e+03 101.017 2.96380e+02 101.017 0.9956 
1 1 1 1   39  8  o 2  2.45473e+01 4.94395e-01 5.50488e+02 9.337   3.20362e+01  5.26752e+00  0.00000e+00 0.00000e+00 3.54222e+02 9.337   1.96266e+02 189.337 0.9845 
1 1 1 1   39  9  o 17 3.67476e+01 6.99708e-01 6.33081e+02 140.802 -5.73788e+01 4.67934e+01  0.00000e+00 0.00000e+00 7.32662e+02 140.802 9.95817e+01 140.802 0.9932 
1 1 1 1   39  10 o 8  7.14775e+00 7.50020e-01 2.06664e+02 280.263 1.10710e+00  -6.11422e+00 0.00000e+00 0.00000e+00 3.80803e+01 280.263 1.68584e+02 100.263 0.9156 
1 1 1 1   39  11 o 4  1.22140e+01 6.50532e-01 1.85904e+02 179.016 -1.33941e+01 2.30063e-01  0.00000e+00 0.00000e+00 2.53228e+02 179.016 6.73236e+01 179.016 0.9619 
1 1 1 1   39  12 f 0  1.07674e+01 7.04764e-01 2.33236e+02 344.772 1.76948e+01  -4.81671e+00 0.00000e+00 0.00000e+00 1.57822e+02 344.772 7.54137e+01 164.772 0.9723 
1 1 1 1   39  13 o 17 4.06653e+00 1.06300e+00 1.13405e+02 77.466  8.43159e-01  3.79257e+00  0.00000e+00 0.00000e+00 1.69691e+01 77.466  9.64356e+01 257.466 0.8590 
1 1 1 1   39  14 o 14 5.03661e+00 1.02818e+00 1.47160e+02 115.659 -3.32510e+00 6.92164e+00  0.00000e+00 0.00000e+00 2.79861e+01 115.659 1.19173e+02 295.659 0.9324 
1 1 1 1   39  15 o 16 1.55642e+01 8.95248e-01 2.42186e+02 202.670 -4.45270e+01 -1.85986e+01 0.00000e+00 0.00000e+00 3.31752e+02 202.670 8.95661e+01 202.670 0.9896 
1 1 1 1   39  16 o 8  1.47900e+01 1.05014e+00 1.95484e+02 76.345  9.78934e+00  4.02942e+01  0.00000e+00 0.00000e+00 3.48467e+02 76.345  1.52983e+02 76.345  0.9879 
1 1 1 1   39  17 o 8  4.52447e+00 1.45755e+00 6.60307e+01 335.084 3.07079e+00  -1.42646e+00 0.00000e+00 0.00000e+00 7.44716e+01 335.084 8.44088e+00 335.084 0.8349 
1 1 1 1   39  18 o 16 4.32283e+00 1.44447e+00 1.18449e+02 94.425  -5.42035e-01 7.00497e+00  0.00000e+00 0.00000e+00 3.02541e+01 94.425  8.81952e+01 274.425 0.9258 
1 1 1 1   39  19 o 18 5.09057e+00 1.60006e+00 6.35144e+01 333.879 3.75669e+00  -1.84207e+00 0.00000e+00 0.00000e+00 1.00907e+02 333.879 3.73930e+01 333.879 0.8702 
1 1 1 1   40  0  o 5  7.51613e+00 2.81806e-01 2.74352e+02 147.677 -1.58180e+00 1.00086e+00  0.00000e+00 0.00000e+00 8.39703e+01 327.677 3.58322e+02 327.677 0.6756 
1 1 1 1   40  1  o 15 1.99502e+01 3.41630e-01 3.21352e+02 284.114 1.40713e+00  -5.59609e+00 0.00000e+00 0.00000e+00 3.58328e+02 284.114 3.69762e+01 284.114 0.9086 
1 1 1 1   40  2  o 16 1.81362e+01 3.80705e-01 2.64883e+02 121.004 -2.60838e+00 4.34033e+00  0.00000e+00 0.00000e+00 3.43584e+02 121.004 7.87012e+01 121.004 0.8948 
1 1 1 1   40  3  o 8  2.25551e+01 3.78642e-01 4.08323e+02 76.729  2.52618e+00  1.07108e+01  0.00000e+00 0.00000e+00 3.97845e+02 76.729  1.04779e+01 256.729 0.9534 
1 1 1 1   40  4  o 7  3.92695e+01 5.88421e-01 6.87112e+02 53.361  1.90340e+01  2.55928e+01  0.00000e+00 0.00000e+00 7.61521e+02 53.361  7.44089e+01 53.361  0.9842 
1 1 1 1   40  5  o 3  1.51098e+01 3.60137e-01 2.63956e+02 229.893 -3.27659e+00 -3.89019e+00 0.00000e+00 0.00000e+00 2.42998e+02 229.893 2.09585e+01 49.894  0.8953 
1 1 1 1   40  6  o 15 2.42541e+01 4.56054e-01 3.57590e+02 294.711 6.87575e+00  -1.49416e+01 0.00000e+00 0.00000e+00 5.22949e+02 294.711 1.65359e+02 294.711 0.9691 
1 1 1 1   40  7  o 5  9.88654e+00 4.18957e-01 1.44336e+02 341.620 2.84167e+00  -9.44165e-01 0.00000e+00 0.00000e+00 1.55397e+02 341.620 1.10615e+01 341.620 0.8096 
1 1 1 1   40  8  o 19 1.13389e+01 4.58946e-01 2.55332e+02 38.916  6.03555e+00  4.87289e+00  0.00000e+00 0.00000e+00 1.40730e+02 38.916  1.14602e+02 218.916 0.9331 
1 1 1 1   40  9  o 2  1.42297e+01 5.48182e-01 3.18404e+02 140.680 -1.08840e+01 8.91490e+00  0.00000e+00 0.00000e+00 1.94717e+02 140.680 1.23686e+02 320.680 0.9638 
1 1 1 1   40  10 o 2  1.18865e+01 5.76622e-01 1.63011e+02 57.134  4.48133e+00  6.93601e+00  0.00000e+00 0.00000e+00 2.53628e+02 57.134  9.06171e+01 57.134  0.9373 
1 1 1 1   40  11 f 0  2.65378e+01 5.90304e-01 4.54262e+02 189.124 -6.78994e+01 -1.09044e+01 0.00000e+00 0.00000e+00 5.30282e+02 189.124 7.60202e+01 189.124 0.9927 
1 1 1 1   40  12 o 18 1.16448e+01 6.69653e-01 2.67704e+02 235.015 -1.28677e+01 -1.83874e+01 0.00000e+00 0.00000e+00 1.57399e+02 235.015 1.10306e+02 55.015  0.9775 
1 1 1 1   40  13 o 19 8.34853e+00 8.97539e-01 2.09310e+02 54.224  9.16422e+00  1.27178e+01  0.00000e+00 0.00000e+00 9.21540e+01 54.224  1.17156e+02 234.224 0.9676 
1 1 1 1   40  14 o 8  5.71998e+00 1.05644e+00 1.24756e+02 208.278 -6.74551e+00 -3.62875e+00 0.00000e+00 0.00000e+00 7.40944e+01 208.278 5.06614e+01 28.278  0.9322 
1 1 1 1   40  15 o 1  2.89981e+00 9.59719e-01 7.56383e+01 277.922 3.96028e-01  -2.84612e+00 0.00000e+00 0.00000e+00 1.08185e+01 277.922 6.48197e+01 97.922  0.8002 
1 1 1 1   40  16 o 2  8.40214e+00 1.38679e+00 7.80891e+01 23.618  6.68019e+00  2.92107e+00  0.00000e+00 0.00000e+00 2.12371e+02 23.618  1.34281e+02 23.618  0.9286 
1 1 1 1   40  17 o 17 6.80761e+00 1.76572e+00 1.58519e+02 39.820  8.17806e+00  6.81847e+00  0.00000e+00 0.00000e+00 8.24572e+01 39.820  7.60613e+01 219.820 0.9518 
1 1 1 1   40  18 o 15 4.90640e+00 1.58180e+00 3.15053e+01 182.394 -1.85727e+00 -7.76574e-02 0.00000e+00 0.00000e+00 9.12039e+01 182.394 5.96986e+01 182.394 0.6732 
1 1 1 1   40  19 o 1  9.32234e+00 1.99531e+00 1.65461e+02 92.092  -5.61092e-01 1.53589e+01  0.00000e+00 0.00000e+00 1.69051e+02 92.092  3.59075e+00 92.092  0.9669 
1 1 1 1   41  0  o 1  4.15126e+01 5.90575e-01 1.03740e+03 202.472 -4.22163e+01 -1.74623e+01 0.00000e+00 0.00000e+00 5.01779e+02 202.472 5.35621e+02 22.472  0.9890 
1 1 1 1   41  1  o 6  2.93560e+01 4.44718e-01 6.17776e+02 52.839  1.15746e+01  1.52708e+01  0.00000e+00 0.00000e+00 4.53675e+02 52.839  1.64101e+02 232.839 0.9735 
1 1 1 1   41  2  o 12 6.58195e+00 3.68878e-01 2.58772e+02 78.960  3.38116e-01  1.73294e+00  0.00000e+00 0.00000e+00 9.70844e+01 258.960 3.55856e+02 258.960 0.6553 
1 1 1 1   41  3  o 17 1.78892e+01 3.36942e-01 3.24404e+02 250.132 -2.17356e+00 -6.01495e+00 0.00000e+00 0.00000e+00 2.91239e+02 250.132 3.31649e+01 70.132  0.9181 
1 1 1 1   41  4  o 10 2.38674e+01 4.12976e-01 4.40392e+02 65.027  5.45239e+00  1.17071e+01  0.00000e+00 0.00000e+00 4.18740e+02 65.027  2.16518e+01 245.027 0.9605 
1 1 1 1   41  5  o 16 1.53850e+01 3.94149e-01 1.52144e+02 254.735 -8.12283e-01 -2.97636e+00 0.00000e+00 0.00000e+00 3.18300e+02 254.735 1.66156e+02 254.735 0.8161 
1 1 1 1   41  6  o 7  2.71449e+01 4.87292e-01 5.48888e+02 13.991  2.54521e+01  6.34172e+00  0.00000e+00 0.00000e+00 4.48327e+02 13.991  1.00560e+02 193.991 0.9807 
1 1 1 1   41  7  o 14 1.22234e+01 4.74551e-01 1.41486e+02 258.661 -7.08605e-01 -3.53371e+00 0.00000e+00 0.00000e+00 2.45890e+02 258.661 1.04404e+02 258.661 0.8464 
1 1 1 1   41  8  o 12 1.27686e+01 4.50927e-01 1.77600e+02 245.142 -2.49433e+00 -5.38397e+00 0.00000e+00 0.00000e+00 2.57932e+02 245.142 8.03319e+01 245.142 0.9113 
1 1 1 1   41  9  o 9  5.20731e+00 7.59460e-01 2.25471e+02 199.564 -3.48202e+00 -1.23739e+00 0.00000e+00 0.00000e+00 5.97476e+01 19.564  2.85218e+02 19.564  0.8507 
1 1 1 1   41  10 o 7  6.31307e+00 8.29490e-01 7.61309e+01 93.123  -1.11597e-01 2.04506e+00  0.00000e+00 0.00000e+00 9.04066e+01 93.123  1.42757e+01 93.123  0.7055 
1 1 1 1   41  11 o 16 1.53191e+01 5.65411e-01 2.18301e+02 250.051 -6.56995e+00 -1.81013e+01 0.00000e+00 0.00000e+00 3.39080e+02 250.051 1.20779e+02 250.051 0.9737 
1 1 1 1   41  12 o 15 2.30289e+01 6.03581e-01 4.53277e+02 341.554 7.60989e+01  -2.53825e+01 0.00000e+00 0.00000e+00 4.01324e+02 341.554 5.19528e+01 161.554 0.9937 
1 1 1 1   41  13 o 9  1.11374e+01 7.48396e-01 1.73319e+02 311.641 1.20050e+01  -1.35020e+01 0.00000e+00 0.00000e+00 2.30617e+02 311.641 5.72982e+01 311.641 0.9719 
1 1 1 1   41  14 f 0  4.07225e+00 1.11265e+00 1.27382e+02 127.731 -3.45055e+00 4.45948e+00  0.00000e+00 0.00000e+00 1.02409e+01 127.731 1.17141e+02 307.731 0.9064 
1 1 1 1   41  15 o 2  1.05523e+01 1.06009e+00 2.04706e+02 13.951  2.56206e+01  6.36476e+00  0.00000e+00 0.00000e+00 1.80906e+02 13.951  2.37997e+01 193.951 0.9809 
1 1 1 1   41  16 o 8  9.62795e+00 1.36954e+00 1.49824e+02 8.192   1.72258e+01  2.47973e+00  0.00000e+00 0.00000e+00 1.98093e+02 8.192   4.82687e+01 8.192   0.9708 
1 1 1 1   41  17 o 8  7.26965e+00 1.76101e+00 1.77698e+02 59.754  6.38453e+00  1.09497e+01  0.00000e+00 0.00000e+00 8.17367e+01 59.754  9.59614e+01 239.754 0.9597 
1 1 1 1   41  18 o 8  6.50789e+00 1.59678e+00 1.47948e+02 3.412   1.13785e+01  6.78492e-01  0.00000e+00 0.00000e+00 8.29436e+01 3.412   6.50042e+01 183.412 0.9551 
1 1 1 1   41  19 o 12 5.61068e+00 1.66903e+00 1.42660e+02 219.096 -7.89967e+00 -6.41904e+00 0.00000e+00 0.00000e+00 5.50292e+01 219.096 8.76303e+01 39.096  0.9495 
1 1 1 1   42  0  o 5  3.16087e+01 4.70611e-01 6.17363e+02 212.947 -1.71081e+01 -1.10875e+01 0.00000e+00 0.00000e+00 5.38074e+02 212.947 7.92896e+01 32.947  0.9752 
1 1 1 1   42  1  o 9  8.31350e+00 2.72731e-01 3.98001e+02 25.382  3.11149e+00  1.47627e+00  0.00000e+00 0.00000e+00 1.36809e+02 205.382 5.34809e+02 205.382 0.8381 
1 1 1 1   42  2  o 5  2.55357e+01 4.71199e-01 5.42368e+02 331.242 1.44785e+01  -7.94576e+00 0.00000e+00 0.00000e+00 3.85368e+02 331.242 1.57000e+02 151.242 0.9692 
1 1 1 1   42  3  f 0  9.49428e+00 2.94594e-01 1.12853e+02 9.590   1.38349e+00  2.33751e-01  0.00000e+00 0.00000e+00 9.04224e+01 9.590   2.24310e+01 189.590 0.5712 
1 1 1 1   42  4  o 13 2.09692e+01 4.17911e-01 3.35589e+02 296.209 4.04958e+00  -8.22640e+00 0.00000e+00 0.00000e+00 4.06024e+02 296.209 7.04344e+01 296.209 0.9438 
1 1 1 1   42  5  o 16 2.72483e+01 4.83889e-01 5.04745e+02 48.372  1.23632e+01  1.39114e+01  0.00000e+00 0.00000e+00 4.88285e+02 48.372  1.64608e+01 228.372 0.9728 
1 1 1 1   42  6  o 5  6.13231e+00 5.45545e-01 1.66648e+02 219.162 -1.35465e+00 -1.10332e+00 0.00000e+00 0.00000e+00 1.70004e+01 39.162  1.83648e+02 39.162  0.6516 
1 1 1 1   42  7  o 8  2.14567e+01 4.47293e-01 4.23640e+02 183.411 -1.96972e+01 -1.17396e+00 0.00000e+00 0.00000e+00 3.59072e+02 183.411 6.45683e+01 3.411   0.9743 
1 1 1 1   42  8  o 5  2.58938e+01 5.08041e-01 4.03319e+02 104.547 -7.19099e+00 2.77126e+01  0.00000e+00 0.00000e+00 5.48668e+02 104.547 1.45349e+02 104.547 0.9824 
1 1 1 1   42  9  o 3  8.90883e+00 5.82122e-01 3.10379e+02 266.556 -5.46171e-01 -9.07605e+00 0.00000e+00 0.00000e+00 3.97237e+00 266.556 3.06407e+02 86.556  0.9433 
1 1 1 1   42  10 o 9  7.27120e+00 7.57418e-01 2.55411e+02 98.846  -1.28280e+00 8.24220e+00  0.00000e+00 0.00000e+00 4.23683e-01 278.846 2.55835e+02 278.846 0.9380 
1 1 1 1   42  11 o 15 1.11715e+01 7.13400e-01 1.50289e+02 38.678  7.86861e+00  6.29901e+00  0.00000e+00 0.00000e+00 2.45842e+02 38.678  9.55530e+01 38.678  0.9490 
1 1 1 1   42  12 o 10 5.53532e+00 9.73361e-01 1.73932e+02 9.215   7.24241e+00  1.17501e+00  0.00000e+00 0.00000e+00 1.81012e+01 9.215   1.55831e+02 189.215 0.9291 
1 1 1 1   42  13 o 4  5.05835e+00 1.06913e+00 7.64773e+01 215.265 -2.93411e+00 -2.07479e+00 0.00000e+00 0.00000e+00 8.31658e+01 215.265 6.68850e+00 215.265 0.8458 
1 1 1 1   42  14 o 8  6.70603e+00 1.12643e+00 6.56942e+01 143.243 -3.80365e+00 2.84108e+00  0.00000e+00 0.00000e+00 1.56119e+02 143.243 9.04244e+01 143.243 0.8872 
1 1 1 1   42  15 o 17 9.54182e+00 1.11304e+00 1.13661e+02 257.745 -2.70104e+00 -1.24348e+01 0.00000e+00 0.00000e+00 2.27519e+02 257.745 1.13857e+02 257.745 0.9599 
1 1 1 1   42  16 o 11 4.16310e+00 1.34949e+00 8.26300e+01 157.363 -3.70027e+00 1.54305e+00  0.00000e+00 0.00000e+00 5.12190e+01 157.363 3.14109e+01 337.363 0.8639 
1 1 1 1   42  17 o 3  9.62189e+00 1.83048e+00 1.26726e+02 14.991  1.13779e+01  3.04678e+00  0.00000e+00 0.00000e+00 2.15490e+02 14.991  8.87640e+01 14.991  0.9566 
1 1 1 1   42  18 o 5  5.27893e+00 1.56325e+00 7.80324e+01 164.324 -5.02980e+00 1.41154e+00  0.00000e+00 0.00000e+00 9.81104e+01 164.324 2.00780e+01 164.324 0.8983 
1 1 1 1   42  19 o 16 4.50715e+00 1.47113e+00 6.23613e+01 296.623 1.90782e+00  -3.80601e+00 0.00000e+00 0.00000e+00 8.35851e+01 296.623 2.12239e+01 296.623 0.8727 
1 1 1 1   43  0  o 10 4.75403e+01 6.67663e-01 8.96566e+02 3.071   5.09185e+01  2.73172e+00  0.00000e+00 0.00000e+00 8.67748e+02 3.071   2.88175e+01 183.071 0.9901 
1 1 1 1   43  1  o 13 2.00380e+01 3.47618e-01 3.44463e+02 354.725 8.23337e+00  -7.60078e-01 0.00000e+00 0.00000e+00 3.59594e+02 354.725 1.51314e+01 354.725 0.9374 
1 1 1 1   43  2  o 16 2.97646e+01 4.94292e-01 6.57689e+02 162.722 -2.05284e+01 6.38509e+00  0.00000e+00 0.00000e+00 4.31618e+02 162.722 2.26071e+02 342.722 0.9765 
1 1 1 1   43  3  o 12 3.08890e+01 4.73340e-01 6.15550e+02 329.384 1.93343e+01  -1.14413e+01 0.00000e+00 0.00000e+00 5.15969e+02 329.384 9.95810e+01 149.384 0.9775 
1 1 1 1   43  4  o 4  3.96425e+00 5.61797e-01 1.88954e+02 349.238 9.38052e-01  -1.78293e-01 0.00000e+00 0.00000e+00 1.25060e+02 169.238 3.14014e+02 169.238 0.4302 
1 1 1 1   43  5  o 4  3.44484e+01 5.71767e-01 5.34518e+02 11.556  2.84607e+01  5.81955e+00  0.00000e+00 0.00000e+00 7.33518e+02 11.556  1.99000e+02 11.556  0.9826 
1 1 1 1   43  6  o 16 6.27938e+01 9.61520e-01 9.48614e+02 178.320 -1.00117e+02 2.93691e+00  0.00000e+00 0.00000e+00 1.39119e+03 178.320 4.42579e+02 178.320 0.9950 
1 1 1 1   43  7  o 5  1.71453e+01 4.64839e-01 3.32198e+02 19.843  1.18729e+01  4.28464e+00  0.00000e+00 0.00000e+00 2.83676e+02 19.843  4.85219e+01 199.843 0.9595 
1 1 1 1   43  8  o 4  2.00389e+01 4.67335e-01 4.32946e+02 98.911  -3.77248e+00 2.40597e+01  0.00000e+00 0.00000e+00 3.01352e+02 98.911  1.31593e+02 278.911 0.9792 
1 1 1 1   43  9  f 0  1.16729e+01 5.79572e-01 4.05308e+02 20.446  1.57337e+01  5.86569e+00  0.00000e+00 0.00000e+00 1.80772e+01 20.446  3.87231e+02 200.446 0.9698 
1 1 1 1   43  10 o 19 1.33599e+01 5.50402e-01 2.92509e+02 18.230  1.79839e+01  5.92313e+00  0.00000e+00 0.00000e+00 1.93540e+02 18.230  9.89688e+01 198.230 0.9732 
1 1 1 1   43  11 o 14 6.47980e+00 8.35737e-01 6.53729e+01 119.284 -1.24019e+00 2.21148e+00  0.00000e+00 0.00000e+00 1.20741e+02 119.284 5.53680e+01 119.284 0.7688 
1 1 1 1   43  12 o 8  2.16118e+01 6.00132e-01 4.09046e+02 171.876 -6.86427e+01 9.79843e+00  0.00000e+00 0.00000e+00 3.91987e+02 171.876 1.70587e+01 351.876 0.9928 
1 1 1 1   43  13 o 11 9.79532e+00 7.60415e-01 1.47572e+02 330.863 1.27685e+01  -7.11779e+00 0.00000e+00 0.00000e+00 2.05141e+02 330.863 5.75693e+01 330.863 0.9652 
1 1 1 1   43  14 o 2  1.03353e+01 9.52220e-01 1.94801e+02 37.584  1.75771e+01  1.35284e+01  0.00000e+00 0.00000e+00 1.81695e+02 37.584  1.31058e+01 217.584 0.9772 
1 1 1 1   43  15 o 15 3.40723e+00 1.10625e+00 7.74209e+01 101.989 -7.19815e-01 3.38962e+00  0.00000e+00 0.00000e+00 2.90897e+01 101.989 4.83312e+01 281.989 0.8393 
1 1 1 1   43  16 o 8  5.75369e+00 1.57299e+00 1.45052e+02 13.255  8.72442e+00  2.05507e+00  0.00000e+00 0.00000e+00 5.67381e+01 13.255  8.83143e+01 193.255 0.9424 
1 1 1 1   43  17 o 1  4.03348e+00 1.35679e+00 6.47821e+01 10.270  3.19066e+00  5.78140e-01  0.00000e+00 0.00000e+00 5.91451e+01 10.270  5.63697e+00 190.270 0.8264 
1 1 1 1   43  18 o 7  8.29679e+00 1.71895e+00 1.33668e+02 319.059 9.43185e+00  -8.18182e+00 0.00000e+00 0.00000e+00 1.61858e+02 319.059 2.81908e+01 319.059 0.9591 
1 1 1 1   43  19 o 17 3.97527e+00 1.33538e+00 1.08554e+02 214.251 -5.89491e+00 -4.01381e+00 0.00000e+00 0.00000e+00 2.81532e+01 214.251 8.04008e+01 34.251  0.9270 
1 1 1 1   44  0  o 7  4.92785e+00 3.09638e-01 9.31154e+01 330.767 4.44157e-01  -2.48568e-01 0.00000e+00 0.00000e+00 4.75751e+01 150.767 1.40690e+02 150.767 0.2466 
1 1 1 1   44  1  o 13 4.21735e+01 6.01536e-01 8.25629e+02 241.428 -1.82753e+01 -3.35579e+01 0.00000e+00 0.00000e+00 7.34095e+02 241.428 9.15341e+01 61.428  0.9868 
1 1 1 1   44  2  o 2  2.07858e+01 3.63426e-01 5.68966e+02 122.896 -8.39081e+00 1.29722e+01  0.00000e+00 0.00000e+00 1.84339e+02 122.896 3.84627e+02 302.896 0.9671 
1 1 1 1   44  3  o 11 2.56182e+01 4.16074e-01 4.19989e+02 173.296 -1.30848e+01 1.53793e+00  0.00000e+00 0.00000e+00 5.02770e+02 173.296 8.27814e+01 173.296 0.9613 
1 1 1 1   44  4  o 11 2.07297e+01 4.55781e-01 4.41351e+02 329.373 1.03971e+01  -6.15551e+00 0.00000e+00 0.00000e+00 3.02410e+02 329.373 1.38941e+02 149.373 0.9577 
1 1 1 1   44  5  o 11 4.30578e+01 6.84671e-01 7.34511e+02 176.864 -4.83058e+01 2.64680e+00  0.00000e+00 0.00000e+00 8.61497e+02 176.864 1.26986e+02 176.864 0.9896 
1 1 1 1   44  6  o 15 2.84502e+01 5.11001e-01 3.91141e+02 89.775  9.18216e-02  2.33591e+01  0.00000e+00 0.00000e+00 6.51109e+02 89.775  2.59969e+02 89.775  0.9784 
1 1 1 1   44  7  o 11 2.60190e+01 5.35843e-01 5.86091e+02 247.146 -1.44165e+01 -3.42060e+01 0.00000e+00 0.00000e+00 3.74625e+02 247.146 2.11467e+02 67.146  0.9864 
1 1 1 1   44  8  o 3  3.95290e+01 6.64714e-01 5.20161e+02 83.531  6.91887e+00  6.10238e+01  0.00000e+00 0.00000e+00 9.46752e+02 83.531  4.26590e+02 83.531  0.9918 
1 1 1 1   44  9  o 3  1.96253e+01 5.06817e-01 3.99723e+02 114.623 -1.13139e+01 2.46857e+01  0.00000e+00 0.00000e+00 3.20575e+02 114.623 7.91477e+01 294.623 0.9814 
1 1 1 1   44  10 o 16 2.27274e+01 5.42648e-01 3.27053e+02 354.270 3.49863e+01  -3.51036e+00 0.00000e+00 0.00000e+00 5.10274e+02 354.270 1.83222e+02 354.270 0.9857 
1 1 1 1   44  11 o 10 9.80406e+00 6.74504e-01 1.96469e+02 330.527 1.13020e+01  -6.38733e+00 0.00000e+00 0.00000e+00 1.55362e+02 330.527 4.11072e+01 150.527 0.9607 
1 1 1 1   44  12 o 10 1.62470e+01 5.98391e-01 1.70651e+02 329.849 2.04992e+01  -1.19074e+01 0.00000e+00 0.00000e+00 4.22921e+02 329.849 2.52269e+02 329.849 0.9787 
1 1 1 1   44  13 o 19 7.91201e+00 9.93497e-01 1.61576e+02 306.626 7.45358e+00  -1.00269e+01 0.00000e+00 0.00000e+00 1.21499e+02 306.626 4.00779e+01 126.626 0.9591 
1 1 1 1   44  14 o 10 3.94288e+00 1.07784e+00 2.83171e+01 223.613 -9.16065e-01 -8.72757e-01 0.00000e+00 0.00000e+00 4.99474e+01 223.613 2.16303e+01 223.613 0.5325 
1 1 1 1   44  15 o 2  4.37174e+00 1.22030e+00 4.87973e+01 137.775 -1.90989e+00 1.73330e+00  0.00000e+00 0.00000e+00 7.71139e+01 137.775 2.83166e+01 137.775 0.7733 
1 1 1 1   44  16 o 18 4.56182e+00 1.37948e+00 9.78634e+01 219.277 -4.17732e+00 -3.41626e+00 0.00000e+00 0.00000e+00 5.52132e+01 219.277 4.26503e+01 39.277  0.9018 
1 1 1 1   44  17 o 9  8.00756e+00 1.53813e+00 1.06408e+02 278.826 1.50216e+00  -9.67409e+00 0.00000e+00 0.00000e+00 1.75617e+02 278.826 6.92089e+01 278.826 0.9475 
1 1 1 1   44  18 o 1  5.40400e+00 1.58135e+00 1.20148e+02 122.074 -4.30240e+00 6.86564e+00  0.00000e+00 0.00000e+00 6.77012e+01 122.074 5.24471e+01 302.074 0.9361 
1 1 1 1   44  19 o 4  3.36298e+00 1.16627e+00 4.95544e+01 358.819 3.22156e+00  -6.64049e-02 0.00000e+00 0.00000e+00 5.33818e+01 358.819 3.82732e+00 358.819 0.8252 
1 1 1 1   45  0  o 4  2.19914e+01 3.70465e-01 3.61926e+02 227.671 -7.04497e+00 -7.73433e+00 0.00000e+00 0.00000e+00 4.21708e+02 227.671 5.97821e+01 227.671 0.9509 
1 1 1 1   45  1  f 0  2.34266e+01 3.84264e-01 5.14162e+02 326.963 1.32035e+01  -8.58672e+00 0.00000e+00 0.00000e+00 3.35351e+02 326.963 1.78810e+02 146.963 0.9677 
1 1 1 1   45  2  o 10 1.41366e+01 3.12553e-01 1.27634e+02 355.959 2.12875e+00  -1.50391e-01 0.00000e+00 0.00000e+00 2.53018e+02 355.959 1.25384e+02 355.959 0.7186 
1 1 1 1   45  3  o 19 3.20801e+01 4.88587e-01 5.46097e+02 8.629   2.24547e+01  3.40743e+00  0.00000e+00 0.00000e+00 6.29067e+02 8.629   8.29696e+01 8.629   0.9777 
1 1 1 1   45  4  o 12 4.27268e+01 7.43073e-01 7.76716e+02 151.747 -3.93312e+01 2.11363e+01  0.00000e+00 0.00000e+00 8.05803e+02 151.747 2.90862e+01 151.747 0.9887 
1 1 1 1   45  5  o 15 1.59391e+01 3.93251e-01 3.20934e+02 312.246 6.49163e+00  -7.14761e+00 0.00000e+00 0.00000e+00 2.44193e+02 312.246 7.67404e+01 132.246 0.9467 
1 1 1 1   45  6  o 7  1.65984e+01 4.04813e-01 3.18855e+02 105.437 -2.95534e+00 1.07024e+01  0.00000e+00 0.00000e+00 2.73909e+02 105.437 4.49461e+01 285.437 0.9538 
1 1 1 1   45  7  o 11 3.24125e+00 7.80411e-01 1.24003e+02 261.252 -1.60962e-01 -1.04608e+00 0.00000e+00 0.00000e+00 6.73884e+01 81.252  1.91392e+02 81.252  0.4667 
1 1 1 1   45  8  f 0  2.13398e+01 4.92374e-01 3.52878e+02 38.903  1.68135e+01  1.35683e+01  0.00000e+00 0.00000e+00 4.26767e+02 38.903  7.38888e+01 38.903  0.9766 
1 1 1 1   45  9  o 18 1.40778e+01 5.18318e-01 3.11007e+02 347.627 1.67769e+01  -3.68031e+00 0.00000e+00 0.00000e+00 1.99846e+02 347.627 1.11161e+02 167.627 0.9704 
1 1 1 1   45  10 o 18 2.16303e+01 5.44954e-01 3.69377e+02 251.833 -1.26345e+01 -3.85024e+01 0.00000e+00 0.00000e+00 4.28976e+02 251.833 5.95992e+01 251.833 0.9876 
1 1 1 1   45  11 o 15 1.15550e+01 6.08043e-01 1.74434e+02 208.846 -1.24143e+01 -6.83769e+00 0.00000e+00 0.00000e+00 2.41635e+02 208.846 6.72018e+01 208.846 0.9640 
1 1 1 1   45  12 o 6  6.29308e+00 8.89134e-01 9.60830e+01 236.477 -2.70048e+00 -4.07636e+00 0.00000e+00 0.00000e+00 1.13152e+02 236.477 1.70688e+01 236.477 0.8908 
1 1 1 1   45  13 o 4  3.82472e+00 1.03713e+00 1.08546e+02 129.406 -2.45328e+00 2.98609e+00  0.00000e+00 0.00000e+00 1.38689e+01 129.406 9.46775e+01 309.406 0.8581 
1 1 1 1   45  14 o 13 4.89741e+00 1.25028e+00 8.37217e+01 249.424 -1.45393e+00 -3.87314e+00 0.00000e+00 0.00000e+00 7.48177e+01 249.424 8.90398e+00 69.424  0.8686 
1 1 1 1   45  15 o 7  4.27374e+00 1.28066e+00 5.99326e+01 338.387 2.79649e+00  -1.10794e+00 0.00000e+00 0.00000e+00 6.90667e+01 338.387 9.13408e+00 338.387 0.8106 
1 1 1 1   45  16 o 4  5.56914e+00 1.50479e+00 8.63046e+01 1.614   5.44807e+00  1.53480e-01  0.00000e+00 0.00000e+00 1.00767e+02 1.614   1.44625e+01 1.614   0.9029 
1 1 1 1   45  17 o 18 6.91896e+00 1.47118e+00 1.23855e+02 275.385 9.77342e-01  -1.03688e+01 0.00000e+00 0.00000e+00 1.20635e+02 275.385 3.22001e+00 95.385  0.9507 
1 1 1 1   45  18 o 3  4.62054e+00 1.41928e+00 2.58110e+01 319.414 1.25530e+00  -1.07541e+00 0.00000e+00 0.00000e+00 8.25700e+01 319.414 5.67590e+01 319.414 0.6317 
1 1 1 1   45  19 o 5  4.08226e+00 1.35802e+00 5.20394e+01 52.155  2.18893e+00  2.81740e+00  0.00000e+00 0.00000e+00 7.58363e+01 52.155  2.37969e+01 52.155  0.8446 
1 1 1 1   46  0  o 2  2.93841e+01 4.51458e-01 4.12043e+02 91.515  -3.79861e-01 1.43646e+01  0.00000e+00 0.00000e+00 6.49881e+02 91.515  2.37837e+02 91.515  0.9646 
1 1 1 1   46  1  o 7  3.02038e+01 4.61430e-01 5.67987e+02 240.557 -9.95871e+00 -1.76431e+01 0.00000e+00 0.00000e+00 5.35395e+02 240.557 3.25925e+01 60.557  0.9750 
1 1 1 1   46  2  o 11 1.49905e+01 3.20211e-01 4.33185e+02 21.926  7.37387e+00  2.96814e+00  0.00000e+00 0.00000e+00 9.18317e+01 21.926  3.41353e+02 201.926 0.9348 
1 1 1 1   46  3  o 9  2.19363e+01 3.81039e-01 4.89848e+02 1.854   1.36878e+01  4.43154e-01  0.00000e+00 0.00000e+00 3.01329e+02 1.854   1.88518e+02 181.854 0.9628 
1 1 1 1   46  4  o 15 1.86763e+01 4.67241e-01 1.50405e+02 145.799 -3.68526e+00 2.50461e+00  0.00000e+00 0.00000e+00 4.64493e+02 145.799 3.14088e+02 145.799 0.8790 
1 1 1 1   46  5  o 7  1.42014e+01 4.50497e-01 3.76803e+02 90.163  -2.61149e-02 9.17552e+00  0.00000e+00 0.00000e+00 1.25115e+02 90.163  2.51688e+02 270.163 0.9438 
1 1 1 1   46  6  f 0  2.82219e+01 5.11270e-01 4.76512e+02 319.324 2.21687e+01  -1.90523e+01 0.00000e+00 0.00000e+00 5.61755e+02 319.324 8.52436e+01 319.324 0.9827 
1 1 1 1   46  7  o 18 2.69569e+01 5.07701e-01 5.99739e+02 34.246  3.49226e+01  2.37742e+01  0.00000e+00 0.00000e+00 3.97032e+02 34.246  2.02707e+02 214.246 0.9881 
1 1 1 1   46  8  o 15 2.09457e+01 4.83329e-01 2.37215e+02 134.049 -1.11294e+01 1.15052e+01  0.00000e+00 0.00000e+00 5.21406e+02 134.049 2.84190e+02 134.049 0.9682 
1 1 1 1   46  9  o 9  3.30931e+01 6.12795e-01 6.17047e+02 5.151   8.68597e+01  7.83023e+00  0.00000e+00 0.00000e+00 6.13143e+02 5.151   3.90414e+00 185.151 0.9943 
1 1 1 1   46  10 o 7  2.45564e+01 5.56867e-01 3.25137e+02 193.788 -4.21125e+01 -1.03343e+01 0.00000e+00 0.00000e+00 5.81853e+02 193.788 2.56716e+02 193.788 0.9884 
1 1 1 1   46  11 o 11 7.10623e+00 7.77110e-01 1.78046e+02 311.784 6.05110e+00  -6.77156e+00 0.00000e+00 0.00000e+00 7.22740e+01 311.784 1.05772e+02 131.784 0.9432 
1 1 1 1   46  12 o 17 1.31928e+01 6.44815e-01 2.28979e+02 236.361 -1.50662e+01 -2.26432e+01 0.00000e+00 0.00000e+00 2.54255e+02 236.361 2.52758e+01 236.361 0.9814 
1 1 1 1   46  13 f 0  4.70282e+00 1.11152e+00 1.33407e+02 345.130 5.75353e+00  -1.52761e+00 0.00000e+00 0.00000e+00 2.64798e+01 345.130 1.06927e+02 165.131 0.9116 
1 1 1 1   46  14 f 0  5.33958e+00 1.20202e+00 2.49998e+02 163.472 -1.39338e+01 4.13489e+00  0.00000e+00 0.00000e+00 5.79912e+01 343.471 3.07990e+02 343.471 0.9650 
1 1 1 1   46  15 o 3  7.06243e+00 1.49806e+00 2.06351e+02 298.649 7.20608e+00  -1.31898e+01 0.00000e+00 0.00000e+00 4.77030e+01 298.649 1.58648e+02 118.649 0.9661 
1 1 1 1   46  16 o 6  5.59631e+00 1.51377e+00 1.49319e+02 4.469   9.04343e+00  7.06862e-01  0.00000e+00 0.00000e+00 4.70273e+01 4.469   1.02292e+02 184.469 0.9432 
1 1 1 1   46  17 o 9  1.07204e+01 1.32096e+00 1.59487e+02 199.741 -2.18430e+01 -7.83842e+00 0.00000e+00 0.00000e+00 2.30243e+02 199.741 7.07550e+01 199.741 0.9782 
1 1 1 1   46  18 o 16 6.38034e+00 1.66253e+00 1.38460e+02 93.242  -5.83682e-01 1.03036e+01  0.00000e+00 0.00000e+00 8.66261e+01 93.242  5.18341e+01 273.242 0.9502 
1 1 1 1   46  19 o 5  3.13235e+00 1.09750e+00 4.22563e+01 4.093   3.05278e+00  2.18431e-01  0.00000e+00 0.00000e+00 5.23429e+01 4.093   1.00866e+01 4.093   0.8144 
1 1 1 1   47  0  o 15 6.51197e+01 8.96792e-01 1.28858e+03 138.411 -7.59506e+01 6.74064e+01  0.00000e+00 0.00000e+00 1.13894e+03 138.411 1.49644e+02 318.411 0.9951 
1 1 1 1   47  1  o 18 3.71449e+01 5.43498e-01 7.63196e+02 300.378 1.74824e+01  -2.98242e+01 0.00000e+00 0.00000e+00 6.08095e+02 300.378 1.55101e+02 120.378 0.9854 
1 1 1 1   47  2  o 19 2.27340e+01 3.87041e-01 3.43046e+02 110.825 -3.55856e+00 9.35590e+00  0.00000e+00 0.00000e+00 4.64869e+02 110.825 1.21822e+02 110.825 0.9487 
1 1 1 1   47  3  o 10 2.81323e+01 4.47563e-01 4.43653e+02 96.364  -1.88489e+00 1.68995e+01  0.00000e+00 0.00000e+00 5.78631e+02 96.364  1.34978e+02 96.364  0.9701 
1 1 1 1   47  4  o 14 2.87810e+01 5.37080e-01 4.58895e+02 7.426   2.01639e+01  2.62823e+00  0.00000e+00 0.00000e+00 5.92124e+02 7.426   1.33230e+02 7.426   0.9751 
1 1 1 1   47  5  o 7  3.90537e+01 6.90018e-01 5.73234e+02 282.654 8.36015e+00  -3.72375e+01 0.00000e+00 0.00000e+00 8.69719e+02 282.654 2.96484e+02 282.654 0.9868 
1 1 1 1   47  6  o 15 7.86298e+00 4.90434e-01 2.26886e+02 331.109 3.46804e+00  -1.91372e+00 0.00000e+00 0.00000e+00 2.68172e+01 331.109 2.00069e+02 151.109 0.8620 
1 1 1 1   47  7  o 13 1.23256e+01 4.27868e-01 2.09831e+02 359.768 7.12659e+00  -2.87888e-02 0.00000e+00 0.00000e+00 2.17658e+02 359.768 7.82686e+00 359.768 0.9269 
1 1 1 1   47  8  o 1  2.49982e+01 5.13665e-01 4.39362e+02 224.559 -2.42645e+01 -2.38935e+01 0.00000e+00 0.00000e+00 4.81783e+02 224.559 4.24207e+01 224.559 0.9852 
1 1 1 1   47  9  o 3  2.39688e+01 5.47334e-01 3.41879e+02 308.698 2.18840e+01  -2.73171e+01 0.00000e+00 0.00000e+00 5.41269e+02 308.698 1.99390e+02 308.698 0.9856 
1 1 1 1   47  10 o 5  1.83790e+01 5.29647e-01 3.86003e+02 79.025  8.08632e+00  4.16990e+01  0.00000e+00 0.00000e+00 2.92568e+02 79.025  9.34346e+01 259.025 0.9882 
1 1 1 1   47  11 o 1  1.06534e+01 6.54204e-01 2.11346e+02 232.595 -1.00949e+01 -1.32013e+01 0.00000e+00 0.00000e+00 1.74304e+02 232.595 3.70420e+01 52.595  0.9694 
1 1 1 1   47  12 o 17 3.05462e+01 7.36226e-01 5.44216e+02 96.315  -1.61093e+01 1.45575e+02  0.00000e+00 0.00000e+00 5.91759e+02 96.315  4.75433e+01 96.315  0.9966 
1 1 1 1   47  13 o 13 1.23849e+01 7.60699e-01 2.27606e+02 239.373 -1.44662e+01 -2.44351e+01 0.00000e+00 0.00000e+00 2.26014e+02 239.373 1.59199e+00 59.373  0.9822 
1 1 1 1   47  14 o 19 9.36363e+00 1.18613e+00 1.46316e+02 141.925 -1.18831e+01 9.30921e+00  0.00000e+00 0.00000e+00 1.90812e+02 141.925 4.44955e+01 141.925 0.9663 
1 1 1 1   47  15 o 7  1.04046e+01 1.26958e+00 2.14853e+02 54.094  1.54453e+01  2.13319e+01  0.00000e+00 0.00000e+00 1.65071e+02 54.094  4.97825e+01 234.094 0.9808 
1 1 1 1   47  16 o 7  8.23934e+00 1.31636e+00 1.43243e+02 287.413 4.59776e+00  -1.46601e+01 0.00000e+00 0.00000e+00 1.53071e+02 287.413 9.82748e+00 287.413 0.9669 
1 1 1 1   47  17 o 19 6.51439e+00 1.59402e+00 1.78065e+02 134.515 -9.27422e+00 9.43270e+00  0.00000e+00 0.00000e+00 5.46654e+01 134.515 1.23400e+02 314.515 0.9614 
1 1 1 1   47  18 o 11 5.30067e+00 1.52519e+00 8.86989e+01 321.898 4.94677e+00  -3.87901e+00 0.00000e+00 0.00000e+00 9.16535e+01 321.898 2.95454e+00 321.898 0.9166 
1 1 1 1   47  19 o 17 4.08047e+00 1.30679e+00 6.79407e+01 135.143 -3.66460e+00 3.64637e+00  0.00000e+00 0.00000e+00 6.78062e+01 135.143 1.34458e-01 315.143 0.8972 
1 1 1 1   48  0  o 14 3.16210e+01 4.78510e-01 7.78369e+02 134.955 -2.25878e+01 2.26230e+01  0.00000e+00 0.00000e+00 3.87414e+02 134.955 3.90955e+02 314.955 0.9842 
1 1 1 1   48  1  o 14 3.37665e+01 5.04474e-01 6.31967e+02 62.551  1.25986e+01  2.42547e+01  0.00000e+00 0.00000e+00 6.09509e+02 62.551  2.24583e+01 242.551 0.9815 
1 1 1 1   48  2  o 19 2.28681e+01 3.89486e-01 4.79044e+02 284.820 3.71273e+00  -1.40326e+01 0.00000e+00 0.00000e+00 3.47458e+02 284.820 1.31587e+02 104.820 0.9649 
1 1 1 1   48  3  o 3  1.64085e+01 3.70070e-01 2.01350e+02 242.714 -2.41798e+00 -4.68755e+00 0.00000e+00 0.00000e+00 3.51349e+02 242.714 1.49999e+02 242.714 0.8994 
1 1 1 1   48  4  o 17 5.75834e+01 8.07737e-01 1.13570e+03 10.770  1.19263e+02  2.26867e+01  0.00000e+00 0.00000e+00 1.01165e+03 10.770  1.24049e+02 190.770 0.9959 
1 1 1 1   48  5  o 2  3.46451e+01 5.81635e-01 6.55542e+02 187.111 -4.71081e+01 -5.87662e+00 0.00000e+00 0.00000e+00 6.27729e+02 187.111 2.78128e+01 7.111   0.9894 
1 1 1 1   48  6  o 16 3.46611e+01 5.87970e-01 7.92416e+02 291.548 2.45581e+01  -6.21920e+01 0.00000e+00 0.00000e+00 4.95066e+02 291.548 2.97350e+02 111.548 0.9925 
1 1 1 1   48  7  o 1  2.38772e+01 4.84416e-01 3.04237e+02 358.547 2.03883e+01  -5.17005e-01 0.00000e+00 0.00000e+00 5.66884e+02 358.547 2.62647e+02 358.547 0.9752 
1 1 1 1   48  8  o 18 1.12232e+01 5.14307e-01 2.22078e+02 152.714 -7.31694e+00 3.77432e+00  0.00000e+00 0.00000e+00 1.71253e+02 152.714 5.08247e+01 332.714 0.9371 
1 1 1 1   48  9  o 10 1.73407e+01 5.00411e-01 2.57408e+02 350.866 1.94389e+01  -3.12538e+00 0.00000e+00 0.00000e+00 3.74085e+02 350.866 1.16677e+02 350.866 0.9743 
1 1 1 1   48  10 f 0  9.54062e+00 7.42438e-01 2.33301e+02 333.897 1.11383e+01  -5.45722e+00 0.00000e+00 0.00000e+00 1.08440e+02 333.897 1.24861e+02 153.898 0.9588 
1 1 1 1   48  11 o 18 1.04484e+01 6.41983e-01 2.60517e+02 95.690  -1.95461e+00 1.96172e+01  0.00000e+00 0.00000e+00 1.19560e+02 95.690  1.40957e+02 275.690 0.9743 
1 1 1 1   48  12 f 0  3.05204e+00 9.33457e-01 1.54674e+02 196.400 -3.97784e+00 -1.17071e+00 0.00000e+00 0.00000e+00 5.57234e+01 16.400  2.10397e+02 16.400  0.8689 
1 1 1 1   48  13 o 17 3.75788e+00 9.83646e-01 6.17608e+01 19.647  2.20674e+00  7.87837e-01  0.00000e+00 0.00000e+00 4.28745e+01 19.647  1.88863e+01 199.647 0.7468 
1 1 1 1   48  14 o 9  4.62755e+00 1.26335e+00 1.20906e+02 15.035  5.89614e+00  1.58371e+00  0.00000e+00 0.00000e+00 3.66617e+01 15.035  8.42446e+01 195.035 0.9140 
1 1 1 1   48  15 o 14 6.13752e+00 1.35554e+00 1.18934e+02 220.764 -6.20463e+00 -5.34882e+00 0.00000e+00 0.00000e+00 9.50921e+01 220.764 2.38419e+01 40.764  0.9368 
1 1 1 1   48  16 o 4  3.92581e+00 1.14108e+00 4.92461e+01 31.469  2.48720e+00  1.52229e+00  0.00000e+00 0.00000e+00 6.80782e+01 31.469  1.88321e+01 31.469  0.8036 
1 1 1 1   48  17 o 3  1.03916e+01 1.34941e+00 1.35455e+02 94.668  -1.55909e+00 1.90925e+01  0.00000e+00 0.00000e+00 2.40418e+02 94.668  1.04963e+02 94.668  0.9735 
1 1 1 1   48  18 o 5  4.94921e+00 1.50077e+00 5.86455e+01 60.995  1.99617e+00  3.60050e+00  0.00000e+00 0.00000e+00 1.00777e+02 60.995  4.21316e+01 60.995  0.8679 
1 1 1 1   48  19 o 3  4.03020e+00 1.32980e+00 8.49581e+01 240.578 -2.97736e+00 -5.27932e+00 0.00000e+00 0.00000e+00 5.15079e+01 240.578 3.34502e+01 60.578  0.9133 
1 1 1 1   49  0  o 4  4.72298e+01 6.68081e-01 8.08051e+02 42.972  3.53748e+01  3.29551e+01  0.00000e+00 0.00000e+00 9.42454e+02 42.972  1.34402e+02 42.972  0.9896 
1 1 1 1   49  1  o 7  2.91053e+01 4.52280e-01 5.55154e+02 86.332  1.36796e+00  2.13418e+01  0.00000e+00 0.00000e+00 5.09138e+02 86.332  4.60164e+01 266.332 0.9763 
1 1 1 1   49  2  o 4  4.72593e+01 6.71124e-01 8.29354e+02 221.580 -3.95853e+01 -3.51204e+01 0.00000e+00 0.00000e+00 9.23771e+02 221.580 9.44168e+01 221.580 0.9905 
1 1 1 1   49  3  o 17 6.25614e+00 4.07121e-01 1.74756e+02 1.744   1.69338e+00  5.15589e-02  0.00000e+00 0.00000e+00 2.46804e+01 181.744 1.99436e+02 181.744 0.6406 
1 1 1 1   49  4  o 7  3.48755e+01 5.69484e-01 5.95561e+02 313.964 2.51425e+01  -2.60685e+01 0.00000e+00 0.00000e+00 6.92046e+02 313.964 9.64845e+01 313.964 0.9861 
1 1 1 1   49  5  o 14 1.17714e+01 3.95383e-01 1.73407e+02 347.376 4.17334e+00  -9.34659e-01 0.00000e+00 0.00000e+00 2.11427e+02 347.376 3.80201e+01 347.376 0.8734 
1 1 1 1   49  6  o 13 2.75449e+01 5.09760e-01 5.31621e+02 113.135 -1.38180e+01 3.23415e+01  0.00000e+00 0.00000e+00 4.84370e+02 113.135 4.72516e+01 293.135 0.9857 
1 1 1 1   49  7  o 9  4.19862e+01 6.91557e-01 6.75376e+02 233.096 -5.07907e+01 -6.76380e+01 0.00000e+00 0.00000e+00 8.85909e+02 233.096 2.10532e+02 233.096 0.9941 
1 1 1 1   49  8  f 0  1.66827e+01 5.19455e-01 1.39642e+02 70.157  2.81681e+00  7.80580e+00  0.00000e+00 0.00000e+00 4.45264e+02 70.157  3.05622e+02 70.157  0.9377 
1 1 1 1   49  9  o 9  2.24027e+01 5.17167e-01 4.06763e+02 132.580 -2.83692e+01 3.08733e+01  0.00000e+00 0.00000e+00 4.20470e+02 132.580 1.37063e+01 132.580 0.9880 
1 1 1 1   49  10 o 17 2.07409e+01 5.37526e-01 3.91032e+02 355.055 4.65792e+01  -4.03009e+00 0.00000e+00 0.00000e+00 3.75387e+02 355.055 1.56456e+01 175.055 0.9892 
1 1 1 1   49  11 o 15 1.06317e+01 6.43876e-01 3.23447e+02 127.015 -1.57995e+01 2.09556e+01  0.00000e+00 0.00000e+00 6.58124e+01 127.015 2.57635e+02 307.014 0.9808 
1 1 1 1   49  12 o 2  1.82720e+01 6.72088e-01 2.53096e+02 15.624  4.24516e+01  1.18721e+01  0.00000e+00 0.00000e+00 4.20794e+02 15.624  1.67698e+02 15.624  0.9886 
1 1 1 1   49  13 o 1  4.83801e+00 1.08523e+00 1.39263e+02 168.681 -6.68386e+00 1.33782e+00  0.00000e+00 0.00000e+00 2.72843e+01 168.681 1.11979e+02 348.681 0.9234 
1 1 1 1   49  14 o 16 1.15689e+01 1.02460e+00 1.55605e+02 172.865 -2.09164e+01 2.61837e+00  0.00000e+00 0.00000e+00 2.64990e+02 172.865 1.09384e+02 172.865 0.9760 
1 1 1 1   49  15 o 10 5.38972e+00 1.39601e+00 7.69812e+01 67.305  1.80853e+00  4.32447e+00  0.00000e+00 0.00000e+00 1.00668e+02 67.305  2.36865e+01 67.305  0.8856 
1 1 1 1   49  16 o 5  8.28535e+00 1.32545e+00 1.07845e+02 103.949 -2.75320e+00 1.10842e+01  0.00000e+00 0.00000e+00 1.86433e+02 103.949 7.85884e+01 103.949 0.9552 
1 1 1 1   49  17 o 12 4.56979e+00 1.31005e+00 4.17415e+01 189.062 -2.72332e+00 -4.34366e-01 0.00000e+00 0.00000e+00 9.24311e+01 189.062 5.06896e+01 189.062 0.7903 
1 1 1 1   49  18 o 14 4.25198e+00 1.37561e+00 3.83569e+01 339.654 2.43771e+00  -9.03975e-01 0.00000e+00 0.00000e+00 8.40040e+01 339.654 4.56471e+01 339.654 0.7754 
1 1 1 1   50  0  o 1  2.27668e+01 3.87442e-01 5.19723e+02 275.540 1.50443e+00  -1.55109e+01 0.00000e+00 0.00000e+00 3.05019e+02 275.540 2.14704e+02 95.540  0.9674 
1 1 1 1   50  1  o 19 6.79783e+00 3.29196e-01 1.45346e+02 93.971  -9.31874e-02 1.34237e+00  0.00000e+00 0.00000e+00 3.91296e+00 273.971 1.49259e+02 273.971 0.5556 
1 1 1 1   50  2  o 17 3.47821e+01 5.20755e-01 5.61862e+02 304.855 1.76948e+01  -2.54073e+01 0.00000e+00 0.00000e+00 7.19391e+02 304.855 1.57529e+02 304.855 0.9837 
1 1 1 1   50  3  o 19 4.72641e+01 6.74368e-01 7.82690e+02 352.516 6.87338e+01  -9.02922e+00 0.00000e+00 0.00000e+00 9.74166e+02 352.516 1.91476e+02 352.516 0.9928 
1 1 1 1   50  4  o 19 2.70052e+01 4.46367e-01 4.98422e+02 92.505  -1.01181e+00 2.31238e+01  0.00000e+00 0.00000e+00 4.90449e+02 92.505  7.97274e+00 272.505 0.9782 
1 1 1 1   50  5  o 9  2.41879e+01 4.65472e-01 3.63219e+02 311.897 1.27489e+01  -1.42104e+01 0.00000e+00 0.00000e+00 5.18018e+02 311.897 1.54799e+02 311.897 0.9734 
1 1 1 1   50  6  o 10 5.33155e+01 8.36090e-01 8.83781e+02 204.571 -1.12008e+02 -5.12134e+01 0.00000e+00 0.00000e+00 1.10294e+03 204.571 2.19163e+02 204.571 0.9959 
1 1 1 1   50  7  o 11 3.62266e+01 6.20199e-01 6.58012e+02 329.292 5.83626e+01  -3.46643e+01 0.00000e+00 0.00000e+00 6.86931e+02 329.292 2.89193e+01 329.292 0.9926 
1 1 1 1   50  8  o 15 1.26176e+01 5.02043e-01 1.12702e+02 320.815 3.81217e+00  -3.10742e+00 0.00000e+00 0.00000e+00 3.07823e+02 320.815 1.95121e+02 320.815 0.8915 
1 1 1 1   50  9  o 15 1.61509e+01 5.01853e-01 1.90423e+02 2.084   1.49301e+01  5.43167e-01  0.00000e+00 0.00000e+00 3.92555e+02 2.084   2.02132e+02 2.084   0.9659 
1 1 1 1   50  10 o 13 7.61101e+00 6.68765e-01 1.72704e+02 238.001 -4.19641e+00 -6.71588e+00 0.00000e+00 0.00000e+00 9.29515e+01 238.001 7.97524e+01 58.001  0.9345 
1 1 1 1   50  11 o 2  1.18423e+01 6.66805e-01 2.59065e+02 232.005 -1.54954e+01 -1.98371e+01 0.00000e+00 0.00000e+00 1.74091e+02 232.005 8.49737e+01 52.005  0.9799 
1 1 1 1   50  12 o 11 5.77643e+00 9.93526e-01 8.75498e+01 130.650 -2.86690e+00 3.33895e+00  0.00000e+00 0.00000e+00 1.01491e+02 130.650 1.39411e+01 130.650 0.8773 
1 1 1 1   50  13 o 1  4.25408e+00 1.13336e+00 6.20689e+01 87.789  1.05692e-01  2.73715e+00  0.00000e+00 0.00000e+00 6.29928e+01 87.789  9.23886e-01 87.789  0.7887 
1 1 1 1   50  14 o 15 6.36545e+00 1.32878e+00 6.62083e+01 203.205 -4.20839e+00 -1.80414e+00 0.00000e+00 0.00000e+00 1.43042e+02 203.205 7.68336e+01 203.205 0.8826 
1 1 1 1   50  15 o 14 1.32929e+01 8.39252e-01 1.86238e+02 49.591  2.57549e+01  3.02518e+01  0.00000e+00 0.00000e+00 3.02175e+02 49.591  1.15938e+02 49.591  0.9873 
1 1 1 1   50  16 o 3  5.24531e+00 1.22185e+00 5.88607e+01 354.505 4.26162e+00  -4.09998e-01 0.00000e+00 0.00000e+00 1.11496e+02 354.505 5.26352e+01 354.505 0.8735 
1 1 1 1   50  17 o 8  3.86719e+00 1.25014e+00 1.07538e+02 171.123 -6.26785e+00 9.78918e-01  0.00000e+00 0.00000e+00 2.42392e+01 171.123 8.32986e+01 351.123 0.9174 
1 1 1 1   50  18 o 7  5.57385e+00 1.50754e+00 6.14872e+01 84.731  4.61214e-01  5.00161e+00  0.00000e+00 0.00000e+00 1.23394e+02 84.731  6.19064e+01 84.731  0.8939 
1 1 1 1   51  0  o 6  5.41132e+01 7.55822e-01 1.04090e+03 357.080 8.86503e+01  -4.52112e+00 0.00000e+00 0.00000e+00 9.73793e+02 357.080 6.71096e+01 177.080 0.9944 
1 1 1 1   51  1  o 1  2.26439e+01 3.89500e-01 5.02408e+02 200.113 -1.69810e+01 -6.21848e+00 0.00000e+00 0.00000e+00 3.21662e+02 200.113 1.80745e+02 20.113  0.9719 
1 1 1 1   51  2  o 15 2.90848e+01 4.58034e-01 2.97104e+02 32.416  1.12516e+01  7.14480e+00  0.00000e+00 0.00000e+00 7.50181e+02 32.416  4.53076e+02 32.416  0.9617 
1 1 1 1   51  3  o 10 3.50234e+01 5.28893e-01 6.82323e+02 189.680 -4.12200e+01 -7.03108e+00 0.00000e+00 0.00000e+00 6.13069e+02 189.680 6.92537e+01 9.680   0.9880 
1 1 1 1   51  4  o 8  9.66693e+00 3.74290e-01 2.10345e+02 285.559 1.14827e+00  -4.12394e+00 0.00000e+00 0.00000e+00 1.05725e+02 285.559 1.04620e+02 105.559 0.8735 
1 1 1 1   51  5  o 7  2.47698e+01 4.51946e-01 4.71559e+02 176.222 -2.58573e+01 1.70766e+00  0.00000e+00 0.00000e+00 4.37301e+02 176.222 3.42578e+01 356.221 0.9805 
1 1 1 1   51  6  o 18 2.33812e+01 4.75080e-01 3.13648e+02 204.089 -1.74772e+01 -7.81390e+00 0.00000e+00 0.00000e+00 5.37895e+02 204.089 2.24247e+02 204.089 0.9735 
1 1 1 1   51  7  o 7  3.13767e+01 5.67786e-01 5.60160e+02 1.975   5.62616e+01  1.94002e+00  0.00000e+00 0.00000e+00 6.02770e+02 1.975   4.26097e+01 1.975   0.9911 
1 1 1 1   51  8  o 17 2.42045e+01 5.17129e-01 4.26313e+02 71.581  1.27678e+01  3.83398e+01  0.00000e+00 0.00000e+00 4.67222e+02 71.581  4.09088e+01 71.581  0.9875 
1 1 1 1   51  9  o 7  1.99057e+01 5.05473e-01 3.99099e+02 348.520 3.68225e+01  -7.47805e+00 0.00000e+00 0.00000e+00 3.34685e+02 348.520 6.44134e+01 168.520 0.9866 
1 1 1 1   51  10 o 17 9.40315e+00 6.19101e-01 1.78313e+02 183.133 -1.13861e+01 -6.23286e-01 0.00000e+00 0.00000e+00 1.57064e+02 183.133 2.12495e+01 3.133   0.9551 
1 1 1 1   51  11 o 9  4.63954e+00 1.01595e+00 7.20753e+01 163.951 -2.48674e+00 7.15337e-01  0.00000e+00 0.00000e+00 6.19790e+01 163.951 1.00963e+01 343.951 0.7742 
1 1 1 1   51  12 o 9  4.75701e+00 1.02667e+00 8.18432e+01 321.651 2.87659e+00  -2.27582e+00 0.00000e+00 0.00000e+00 6.88600e+01 321.651 1.29832e+01 141.651 0.8494 
1 1 1 1   51  13 o 13 6.77104e+00 1.10586e+00 1.68188e+02 281.127 2.39091e+00  -1.21562e+01 0.00000e+00 0.00000e+00 7.37555e+01 281.127 9.44320e+01 101.127 0.9588 
1 1 1 1   51  14 o 18 6.62905e+00 1.28120e+00 1.36782e+02 145.621 -8.18099e+00 5.59724e+00  0.00000e+00 0.00000e+00 9.72800e+01 145.621 3.95020e+01 325.621 0.9481 
1 1 1 1   51  15 o 11 4.76259e+00 1.21581e+00 5.11520e+01 43.652  2.15637e+00  2.05719e+00  0.00000e+00 0.00000e+00 9.21247e+01 43.652  4.09726e+01 43.652  0.8085 
1 1 1 1   51  16 o 7  1.13128e+01 1.05406e+00 1.61201e+02 146.868 -2.19876e+01 1.43511e+01  0.00000e+00 0.00000e+00 2.51262e+02 146.868 9.00617e+01 146.868 0.9808 
1 1 1 1   51  17 o 14 5.75811e+00 1.53248e+00 5.22399e+01 6.854   3.84373e+00  4.62001e-01  0.00000e+00 0.00000e+00 1.31327e+02 6.854   7.90868e+01 6.854   0.8584 
1 1 1 1   51  18 o 18 4.76288e+00 1.38596e+00 3.10613e+01 244.433 -1.03668e+00 -2.16692e+00 0.00000e+00 0.00000e+00 1.02161e+02 244.433 7.10998e+01 244.433 0.7539 
1 1 1 1   52  0  o 5  4.51367e+01 6.44706e-01 7.15986e+02 181.091 -4.96778e+01 -9.46207e-01 0.00000e+00 0.00000e+00 9.56721e+02 181.091 2.40735e+02 181.091 0.9899 
1 1 1 1   52  1  o 13 2.37138e+01 4.00568e-01 3.59727e+02 289.836 4.46940e+00  -1.23899e+01 0.00000e+00 0.00000e+00 4.93667e+02 289.836 1.33941e+02 289.836 0.9613 
1 1 1 1   52  2  f 0  2.51010e+01 4.20548e-01 5.85613e+02 265.130 -2.35288e+00 -2.76143e+01 0.00000e+00 0.00000e+00 3.36953e+02 265.130 2.48661e+02 85.130  0.9818 
1 1 1 1   52  3  o 1  1.47253e+01 3.76279e-01 2.65984e+02 129.499 -4.25271e+00 5.15916e+00  0.00000e+00 0.00000e+00 2.42130e+02 129.499 2.38538e+01 309.499 0.9218 
1 1 1 1   52  4  o 5  1.54203e+01 3.62283e-01 5.13202e+02 249.528 -5.79900e+00 -1.55335e+01 0.00000e+00 0.00000e+00 4.62207e+01 249.528 4.66981e+02 69.528  0.9694 
1 1 1 1   52  5  o 11 2.29226e+01 4.37613e-01 2.95244e+02 125.465 -9.59775e+00 1.34728e+01  0.00000e+00 0.00000e+00 5.36095e+02 125.465 2.40852e+02 125.465 0.9693 
1 1 1 1   52  6  o 7  2.15919e+01 4.63132e-01 3.72292e+02 109.171 -7.42384e+00 2.13527e+01  0.00000e+00 0.00000e+00 4.17287e+02 109.171 4.49947e+01 109.171 0.9776 
1 1 1 1   52  7  o 10 1.13230e+01 5.25315e-01 1.58721e+02 57.682  3.07727e+00  4.86446e+00  0.00000e+00 0.00000e+00 2.25883e+02 57.682  6.71625e+01 57.682  0.9084 
1 1 1 1   52  8  o 11 1.92591e+01 4.87246e-01 2.81622e+02 275.486 2.23344e+00  -2.32531e+01 0.00000e+00 0.00000e+00 4.22633e+02 275.486 1.41011e+02 275.486 0.9784 
1 1 1 1   52  9  o 5  4.59709e+00 8.83244e-01 1.27833e+02 265.950 -2.15273e-01 -3.04069e+00 0.00000e+00 0.00000e+00 1.18764e+01 265.950 1.15956e+02 85.950  0.8135 
1 1 1 1   52  10 o 3  1.75633e+01 5.92931e-01 3.76324e+02 163.841 -4.47189e+01 1.29572e+01  0.00000e+00 0.00000e+00 2.72376e+02 163.841 1.03948e+02 343.841 0.9892 
1 1 1 1   52  11 o 5  2.08247e+01 6.30637e-01 3.70191e+02 289.323 2.19699e+01  -6.26539e+01 0.00000e+00 0.00000e+00 4.01024e+02 289.323 3.08329e+01 289.323 0.9924 
1 1 1 1   52  12 o 7  4.67723e+00 9.78310e-01 1.07765e+02 49.946  3.05539e+00  3.63428e+00  0.00000e+00 0.00000e+00 4.69784e+01 49.946  6.07862e+01 229.946 0.8872 
1 1 1 1   52  13 o 16 6.44159e+00 1.17993e+00 1.58012e+02 265.248 -8.44772e-01 -1.01612e+01 0.00000e+00 0.00000e+00 6.99345e+01 265.248 8.80775e+01 85.248  0.9496 
1 1 1 1   52  14 o 9  1.10687e+01 1.04380e+00 1.77149e+02 56.540  1.31058e+01  1.98310e+01  0.00000e+00 0.00000e+00 2.26227e+02 56.540  4.90783e+01 56.540  0.9787 
1 1 1 1   52  15 o 3  9.39088e+00 1.04833e+00 1.79983e+02 274.552 1.95834e+00  -2.45994e+01 0.00000e+00 0.00000e+00 1.62236e+02 274.552 1.77478e+01 94.552  0.9795 
1 1 1 1   52  16 o 16 7.77799e+00 1.39370e+00 7.29799e+01 358.943 7.06425e+00  -1.30302e-01 0.00000e+00 0.00000e+00 1.94806e+02 358.943 1.21826e+02 358.943 0.9263 
1 1 1 1   52  17 o 6  7.09367e+00 1.35585e+00 1.47779e+02 162.641 -1.41296e+01 4.41694e+00  0.00000e+00 0.00000e+00 1.06576e+02 162.641 4.12031e+01 342.641 0.9656 
1 1 1 1   52  18 o 4  4.02321e+00 1.31801e+00 1.17532e+02 328.746 6.51928e+00  -3.95654e+00 0.00000e+00 0.00000e+00 2.15505e+01 328.746 9.59816e+01 148.747 0.9319 
1 1 1 1   53  0  o 18 3.97449e+01 5.78829e-01 6.86208e+02 188.975 -5.06379e+01 -7.99801e+00 0.00000e+00 0.00000e+00 7.86939e+02 188.975 1.00731e+02 188.975 0.9902 
1 1 1 1   53  1  o 11 5.59076e+01 7.80956e-01 8.69694e+02 276.296 9.89611e+00  -8.96994e+01 0.00000e+00 0.00000e+00 1.21143e+03 276.296 3.41736e+02 276.296 0.9944 
1 1 1 1   53  2  o 4  5.18747e+01 7.32256e-01 8.44503e+02 78.948  1.42259e+01  7.28308e+01  0.00000e+00 0.00000e+00 1.08406e+03 78.948  2.39557e+02 78.948  0.9932 
1 1 1 1   53  3  o 15 1.43878e+01 3.50888e-01 2.09283e+02 249.849 -2.18786e+00 -5.96209e+00 0.00000e+00 0.00000e+00 2.84768e+02 249.849 7.54849e+01 249.849 0.9175 
1 1 1 1   53  4  o 7  1.60587e+01 3.68698e-01 3.55651e+02 100.283 -2.21977e+00 1.22353e+01  0.00000e+00 0.00000e+00 2.20569e+02 100.283 1.35082e+02 280.283 0.9589 
1 1 1 1   53  5  o 5  2.63917e+01 4.73458e-01 3.39396e+02 101.775 -4.90118e+00 2.35119e+01  0.00000e+00 0.00000e+00 6.27166e+02 101.775 2.87770e+02 101.775 0.9790 
1 1 1 1   53  6  o 7  9.79025e+00 4.63292e-01 1.89010e+02 222.637 -4.12264e+00 -3.79589e+00 0.00000e+00 0.00000e+00 1.42628e+02 222.637 4.63818e+01 42.637  0.9057 
1 1 1 1   53  7  o 12 3.52468e+01 6.14122e-01 5.20077e+02 268.017 -2.07808e+00 -6.00053e+01 0.00000e+00 0.00000e+00 7.86657e+02 268.017 2.66580e+02 268.017 0.9916 
1 1 1 1   53  8  o 12 2.07044e+01 4.91971e-01 3.62048e+02 86.654  1.87134e+00  3.20074e+01  0.00000e+00 0.00000e+00 3.99530e+02 86.654  3.74820e+01 86.654  0.9843 
1 1 1 1   53  9  o 17 2.53499e+01 5.46849e-01 3.94088e+02 200.287 -5.59913e+01 -2.06974e+01 0.00000e+00 0.00000e+00 5.44843e+02 200.287 1.50755e+02 200.287 0.9916 
1 1 1 1   53  10 o 2  2.29418e+01 6.66595e-01 3.37473e+02 4.423   5.65437e+01  4.37328e+00  0.00000e+00 0.00000e+00 5.11423e+02 4.423   1.73950e+02 4.423   0.9911 
1 1 1 1   53  11 o 1  1.31413e+01 6.30325e-01 1.86327e+02 199.789 -2.08394e+01 -7.49814e+00 0.00000e+00 0.00000e+00 2.92781e+02 199.789 1.06454e+02 199.789 0.9772 
1 1 1 1   53  12 o 1  5.63394e+00 1.06751e+00 1.35670e+02 239.333 -3.58972e+00 -6.05379e+00 0.00000e+00 0.00000e+00 5.88411e+01 239.333 7.68288e+01 59.333  0.9260 
1 1 1 1   53  13 o 10 8.91459e+00 1.04907e+00 1.31223e+02 161.614 -1.27385e+01 4.23404e+00  0.00000e+00 0.00000e+00 1.88302e+02 161.614 5.70786e+01 161.614 0.9620 
1 1 1 1   53  14 o 6  3.04331e+00 9.57498e-01 1.85969e+01 291.667 2.96575e-01  -7.46527e-01 0.00000e+00 0.00000e+00 2.35943e+01 291.667 4.99741e+00 291.667 0.3724 
1 1 1 1   53  15 o 3  1.09282e+01 1.01370e+00 1.49879e+02 157.094 -2.12081e+01 8.96112e+00  0.00000e+00 0.00000e+00 2.47701e+02 157.094 9.78221e+01 157.094 0.9780 
1 1 1 1   53  16 o 9  7.00004e+00 1.37270e+00 8.30792e+01 93.580  -4.76278e-01 7.61160e+00  0.00000e+00 0.00000e+00 1.59363e+02 93.580  7.62833e+01 93.580  0.9319 
1 1 1 1   53  17 o 14 8.66005e+00 1.43688e+00 2.21363e+02 302.325 1.35815e+01  -2.14633e+01 0.00000e+00 0.00000e+00 9.37761e+01 302.325 1.27587e+02 122.325 0.9801 
1 1 1 1   53  18 o 9  4.54190e+00 1.40404e+00 3.12968e+01 194.510 -2.18134e+00 -5.64530e-01 0.00000e+00 0.00000e+00 9.25663e+01 194.510 6.12694e+01 194.510 0.7353 
1 1 1 1   54  0  o 7  1.88712e+01 3.60912e-01 3.43170e+02 109.439 -3.78375e+00 1.07213e+01  0.00000e+00 0.00000e+00 3.31298e+02 109.439 1.18720e+01 289.439 0.9550 
1 1 1 1   54  1  o 3  3.65638e+01 5.43886e-01 5.43473e+02 43.470  2.45980e+01  2.33185e+01  0.00000e+00 0.00000e+00 8.04653e+02 43.470  2.61181e+02 43.470  0.9851 
1 1 1 1   54  2  o 6  4.19148e+01 6.10290e-01 6.92024e+02 143.855 -4.00026e+01 2.92189e+01  0.00000e+00 0.00000e+00 8.60722e+02 143.855 1.68698e+02 143.855 0.9899 
1 1 1 1   54  3  o 15 5.54933e+01 9.15232e-01 9.82235e+02 301.979 5.88971e+01  -9.43314e+01 0.00000e+00 0.00000e+00 1.08501e+03 301.979 1.02771e+02 301.979 0.9955 
1 1 1 1   54  4  o 19 1.58772e+01 3.68477e-01 2.86295e+02 40.564  8.50172e+00  7.27763e+00  0.00000e+00 0.00000e+00 2.80544e+02 40.564  5.75090e+00 220.564 0.9542 
1 1 1 1   54  5  o 2  2.77564e+01 4.86612e-01 5.27083e+02 318.424 2.85875e+01  -2.53599e+01 0.00000e+00 0.00000e+00 4.97482e+02 318.424 2.96015e+01 138.424 0.9868 
1 1 1 1   54  6  o 15 2.34496e+01 4.87014e-01 4.45016e+02 91.336  -6.98494e-01 2.99389e+01  0.00000e+00 0.00000e+00 4.17101e+02 91.336  2.79149e+01 271.336 0.9832 
1 1 1 1   54  7  o 8  1.97366e+01 5.09559e-01 3.17839e+02 143.572 -1.79514e+01 1.32484e+01  0.00000e+00 0.00000e+00 4.03209e+02 143.572 8.53694e+01 143.572 0.9773 
1 1 1 1   54  8  o 19 1.84350e+01 4.81268e-01 1.56385e+02 15.102  1.28638e+01  3.47150e+00  0.00000e+00 0.00000e+00 5.06069e+02 15.102  3.49684e+02 15.102  0.9617 
1 1 1 1   54  9  o 14 1.47088e+01 5.12375e-01 2.13658e+02 173.491 -1.79289e+01 2.04559e+00  0.00000e+00 0.00000e+00 3.20233e+02 173.491 1.06575e+02 173.491 0.9719 
1 1 1 1   54  10 o 17 1.32381e+01 6.05377e-01 2.51497e+02 62.394  1.14668e+01  2.19283e+01  0.00000e+00 0.00000e+00 2.32557e+02 62.394  1.89401e+01 242.394 0.9796 
1 1 1 1   54  11 o 14 3.41694e+00 9.44582e-01 5.74405e+01 244.700 -6.98365e-01 -1.47742e+00 0.00000e+00 0.00000e+00 2.25578e+01 244.700 3.48827e+01 64.700  0.6276 
1 1 1 1   54  12 o 7  7.75949e+00 1.01598e+00 1.30177e+02 97.628  -1.31927e+00 9.85085e+00  0.00000e+00 0.00000e+00 1.44136e+02 97.628  1.39592e+01 97.628  0.9483 
1 1 1 1   54  13 o 12 4.72849e+00 1.19675e+00 8.29615e+01 282.729 8.93424e-01  -3.95500e+00 0.00000e+00 0.00000e+00 6.95139e+01 282.729 1.34477e+01 102.729 0.8656 
1 1 1 1   54  14 o 7  9.63572e+00 8.99782e-01 1.77358e+02 80.033  4.24676e+00  2.41651e+01  0.00000e+00 0.00000e+00 1.73935e+02 80.033  3.42248e+00 260.033 0.9794 
1 1 1 1   54  15 o 17 7.99413e+00 1.12813e+00 1.80827e+02 185.241 -2.03135e+01 -1.86343e+00 0.00000e+00 0.00000e+00 1.09114e+02 185.241 7.17132e+01 5.241   0.9752 
1 1 1 1   54  16 o 10 9.10334e+00 1.25004e+00 1.48932e+02 253.399 -5.13445e+00 -1.72216e+01 0.00000e+00 0.00000e+00 1.79787e+02 253.399 3.08555e+01 253.399 0.9718 
1 1 1 1   54  17 f 0  4.06295e+00 1.26353e+00 6.62412e+01 317.866 3.14073e+00  -2.84127e+00 0.00000e+00 0.00000e+00 6.52805e+01 317.866 9.60691e-01 137.866 0.8720 
1 1 1 1   54  18 o 5  3.86517e+00 1.28432e+00 9.43761e+01 108.968 -2.10081e+00 6.11213e+00  0.00000e+00 0.00000e+00 3.73526e+01 108.968 5.70234e+01 288.968 0.9190 
1 1 1 1   55  0  o 19 4.10851e+01 5.98330e-01 6.10046e+02 307.818 2.62827e+01  -3.38619e+01 0.00000e+00 0.00000e+00 9.09354e+02 307.818 2.99308e+02 307.818 0.9883 
1 1 1 1   55  1  o 7  3.88408e+01 5.72462e-01 7.28225e+02 37.918  3.81450e+01  2.97144e+01  0.00000e+00 0.00000e+00 7.10139e+02 37.918  1.80853e+01 217.918 0.9896 
1 1 1 1   55  2  o 18 2.73146e+01 4.47759e-01 4.73877e+02 299.096 1.31851e+01  -2.36931e+01 0.00000e+00 0.00000e+00 5.29191e+02 299.096 5.53136e+01 299.096 0.9814 
1 1 1 1   55  3  o 1  1.85213e+01 4.80749e-01 1.64938e+02 200.232 -6.21994e+00 -2.29242e+00 0.00000e+00 0.00000e+00 4.73389e+02 200.232 3.08451e+02 200.232 0.9211 
1 1 1 1   55  4  o 6  1.21783e+01 3.71060e-01 1.94004e+02 338.847 5.32419e+00  -2.06006e+00 0.00000e+00 0.00000e+00 2.19469e+02 338.847 2.54648e+01 338.847 0.9076 
1 1 1 1   55  5  o 4  1.38686e+01 4.05600e-01 1.53925e+02 271.760 1.80447e-01  -5.87145e+00 0.00000e+00 0.00000e+00 3.18264e+02 271.760 1.64339e+02 271.760 0.9104 
1 1 1 1   55  6  o 19 2.27716e+01 4.78019e-01 3.14065e+02 125.581 -1.33958e+01 1.87238e+01  0.00000e+00 0.00000e+00 5.18639e+02 125.581 2.04574e+02 125.581 0.9780 
1 1 1 1   55  7  o 15 6.11999e+00 6.36993e-01 2.20954e+02 173.603 -4.59180e+00 5.14840e-01  0.00000e+00 0.00000e+00 1.88022e+01 353.603 2.39756e+02 353.603 0.8838 
1 1 1 1   55  8  o 11 6.07301e+00 6.84983e-01 1.71427e+02 112.741 -1.91811e+00 4.57620e+00  0.00000e+00 0.00000e+00 3.10673e+01 112.741 1.40360e+02 292.741 0.8925 
1 1 1 1   55  9  o 1  7.23657e+00 7.58572e-01 8.77020e+01 220.885 -2.68084e+00 -2.32099e+00 0.00000e+00 0.00000e+00 1.40227e+02 220.885 5.25245e+01 220.885 0.8435 
1 1 1 1   55  10 o 3  1.42209e+01 6.06139e-01 2.96539e+02 234.571 -1.88104e+01 -2.64407e+01 0.00000e+00 0.00000e+00 2.25966e+02 234.571 7.05736e+01 54.571  0.9845 
1 1 1 1   55  11 o 1  5.05322e+00 9.44389e-01 1.17543e+02 180.904 -5.20013e+00 -8.20467e-02 0.00000e+00 0.00000e+00 5.16834e+01 180.904 6.58595e+01 0.904   0.8978 
1 1 1 1   55  12 o 8  1.04960e+01 9.38123e-01 2.07873e+02 311.523 1.37776e+01  -1.55603e+01 0.00000e+00 0.00000e+00 1.73831e+02 311.523 3.40415e+01 131.523 0.9756 
1 1 1 1   55  13 o 15 8.63818e+00 9.95722e-01 2.41901e+02 106.780 -7.27049e+00 2.41109e+01  0.00000e+00 0.00000e+00 7.33968e+01 106.780 1.68504e+02 286.780 0.9799 
1 1 1 1   55  14 o 3  1.08294e+01 8.63800e-01 1.70544e+02 315.853 1.91870e+01  -1.86242e+01 0.00000e+00 0.00000e+00 2.24899e+02 315.853 5.43550e+01 315.853 0.9811 
1 1 1 1   55  15 o 15 6.23655e+00 1.23377e+00 3.62157e+01 8.622   3.00132e+00  4.55094e-01  0.00000e+00 0.00000e+00 1.52238e+02 8.622   1.16022e+02 8.622   0.8126 
1 1 1 1   55  16 o 11 7.92641e+00 1.37873e+00 1.25622e+02 160.198 -1.19416e+01 4.29967e+00  0.00000e+00 0.00000e+00 1.57020e+02 160.198 3.13984e+01 160.198 0.9598 
1 1 1 1   55  17 o 9  6.97440e+00 1.43359e+00 1.19412e+02 310.117 7.47111e+00  -8.86675e+00 0.00000e+00 0.00000e+00 1.28031e+02 310.117 8.61918e+00 310.117 0.9559 
1 1 1 1   55  18 o 2  6.81978e+00 1.69716e+00 1.27739e+02 161.129 -1.01965e+01 3.48528e+00  0.00000e+00 0.00000e+00 1.13098e+02 161.129 1.46410e+01 341.129 0.9524 
1 1 1 1   56  0  o 13 7.46790e+01 1.02705e+00 1.37447e+03 23.422  1.91197e+02  8.28243e+01  0.00000e+00 0.00000e+00 1.41295e+03 23.422  3.84759e+01 23.422  0.9976 
1 1 1 1   56  1  o 1  3.10343e+01 4.84485e-01 5.16849e+02 208.103 -2.95743e+01 -1.57933e+01 0.00000e+00 0.00000e+00 6.26867e+02 208.103 1.10018e+02 208.103 0.9850 
1 1 1 1   56  2  o 14 1.61416e+01 3.55467e-01 3.48617e+02 331.533 1.08145e+01  -5.86373e+00 0.00000e+00 0.00000e+00 2.30208e+02 331.533 1.18410e+02 151.533 0.9585 
1 1 1 1   56  3  o 1  8.39898e+00 4.43292e-01 1.21957e+02 65.659  9.35738e-01  2.06850e+00  0.00000e+00 0.00000e+00 1.09774e+02 65.659  1.21831e+01 245.659 0.7375 
1 1 1 1   56  4  f 0  3.87173e+01 5.83607e-01 6.60274e+02 187.424 -6.74429e+01 -8.78835e+00 0.00000e+00 0.00000e+00 7.77181e+02 187.424 1.16907e+02 187.424 0.9926 
1 1 1 1   56  5  o 7  1.12203e+01 4.24584e-01 3.31386e+02 249.080 -4.03432e+00 -1.05541e+01 0.00000e+00 0.00000e+00 6.91658e+01 249.080 2.62220e+02 69.081  0.9547 
1 1 1 1   56  6  o 15 2.19654e+01 4.74412e-01 4.99252e+02 335.851 3.21108e+01  -1.43965e+01 0.00000e+00 0.00000e+00 3.10130e+02 335.851 1.89122e+02 155.851 0.9857 
1 1 1 1   56  7  o 12 2.37834e+01 5.00716e-01 3.49846e+02 183.115 -3.58318e+01 -1.94983e+00 0.00000e+00 0.00000e+00 5.26463e+02 183.115 1.76617e+02 183.115 0.9860 
1 1 1 1   56  8  o 1  1.92231e+01 4.97166e-01 3.84917e+02 239.294 -1.78880e+01 -3.01199e+01 0.00000e+00 0.00000e+00 3.22823e+02 239.294 6.20948e+01 59.294  0.9856 
1 1 1 1   56  9  o 7  1.62675e+01 5.60441e-01 2.96422e+02 77.734  6.40078e+00  2.94417e+01  0.00000e+00 0.00000e+00 3.00780e+02 77.734  4.35788e+00 77.734  0.9833 
1 1 1 1   56  10 o 4  7.23331e+00 7.64102e-01 1.13134e+02 77.046  1.47575e+00  6.41578e+00  0.00000e+00 0.00000e+00 1.35344e+02 77.046  2.22097e+01 77.046  0.9206 
1 1 1 1   56  11 o 14 9.77350e+00 8.31350e-01 2.03449e+02 179.092 -1.81718e+01 2.87869e-01  0.00000e+00 0.00000e+00 1.50867e+02 179.092 5.25814e+01 359.092 0.9721 
1 1 1 1   56  12 o 5  1.89511e+01 7.82060e-01 3.76335e+02 44.475  5.77340e+01  5.66859e+01  0.00000e+00 0.00000e+00 3.25574e+02 44.475  5.07609e+01 224.475 0.9938 
1 1 1 1   56  13 o 6  9.76666e+00 7.83960e-01 1.64396e+02 300.735 1.11884e+01  -1.88174e+01 0.00000e+00 0.00000e+00 1.90927e+02 300.735 2.65305e+01 300.735 0.9769 
1 1 1 1   56  14 o 10 8.69616e+00 9.55382e-01 1.19640e+02 315.844 1.03833e+01  -1.00817e+01 0.00000e+00 0.00000e+00 1.92580e+02 315.844 7.29404e+01 315.844 0.9648 
1 1 1 1   56  15 o 15 5.03997e+00 1.25217e+00 1.03505e+02 215.997 -5.36096e+00 -3.89455e+00 0.00000e+00 0.00000e+00 6.91038e+01 215.997 3.44013e+01 35.997  0.9211 
1 1 1 1   56  16 f 0  8.51430e+00 1.31812e+00 1.57955e+02 127.986 -1.12629e+01 1.44233e+01  0.00000e+00 0.00000e+00 1.49565e+02 127.986 8.38975e+00 307.986 0.9723 
1 1 1 1   56  17 o 3  4.78844e+00 1.40624e+00 2.68993e+01 351.778 1.78397e+00  -2.57782e-01 0.00000e+00 0.00000e+00 9.08360e+01 351.778 6.39368e+01 351.778 0.6625 
1 1 1 1   56  18 o 3  3.81017e+00 1.26494e+00 5.06859e+01 272.368 1.42011e-01  -3.43421e+00 0.00000e+00 0.00000e+00 6.76521e+01 272.368 1.69661e+01 272.368 0.8378 
1 1 1 1   57  0  o 2  3.79570e+01 5.62829e-01 5.81093e+02 174.853 -4.56220e+01 4.10918e+00  0.00000e+00 0.00000e+00 8.23272e+02 174.853 2.42179e+02 174.853 0.9890 
1 1 1 1   57  1  o 12 2.91781e+01 4.66264e-01 4.52443e+02 356.674 2.86778e+01  -1.66670e+00 0.00000e+00 0.00000e+00 6.19934e+02 356.674 1.67491e+02 356.674 0.9824 
1 1 1 1   57  2  o 1  1.79419e+01 3.71582e-01 3.85355e+02 150.614 -1.34201e+01 7.55744e+00  0.00000e+00 0.00000e+00 2.63647e+02 150.614 1.21708e+02 330.614 0.9670 
1 1 1 1   57  3  o 12 1.19361e+01 4.53509e-01 1.54079e+02 243.615 -1.96874e+00 -3.96863e+00 0.00000e+00 0.00000e+00 2.38016e+02 243.615 8.39368e+01 243.615 0.8782 
1 1 1 1   57  4  o 3  1.79547e+01 4.15656e-01 3.76063e+02 246.106 -7.15453e+00 -1.61498e+01 0.00000e+00 0.00000e+00 2.76098e+02 246.106 9.99650e+01 66.106  0.9713 
1 1 1 1   57  5  o 10 2.95570e+01 5.14044e-01 4.61966e+02 42.803  2.87379e+01  2.66145e+01  0.00000e+00 0.00000e+00 6.28924e+02 42.803  1.66958e+02 42.803  0.9872 
1 1 1 1   57  6  o 7  8.18856e+00 5.91679e-01 9.72750e+01 55.373  1.48285e+00  2.14738e+00  0.00000e+00 0.00000e+00 1.40359e+02 55.373  4.30837e+01 55.373  0.7764 
1 1 1 1   57  7  o 15 1.98436e+01 4.78184e-01 3.74670e+02 148.421 -2.71725e+01 1.67029e+01  0.00000e+00 0.00000e+00 3.55048e+02 148.421 1.96217e+01 328.421 0.9842 
1 1 1 1   57  8  o 16 2.61091e+01 6.10640e-01 5.40524e+02 59.646  3.85011e+01  6.57451e+01  0.00000e+00 0.00000e+00 4.28188e+02 59.646  1.12336e+02 239.646 0.9934 
1 1 1 1   57  9  o 18 4.30819e+00 9.40620e-01 1.40771e+02 218.056 -3.04722e+00 -2.38558e+00 0.00000e+00 0.00000e+00 2.72831e+00 38.056  1.43499e+02 38.056  0.8583 
1 1 1 1   57  10 o 5  2.30959e+00 7.46747e-01 1.32795e+02 330.133 2.02681e+00  -1.16390e+00 0.00000e+00 0.00000e+00 6.85047e+01 150.133 2.01299e+02 150.133 0.7461 
1 1 1 1   57  11 o 4  1.11475e+01 7.70873e-01 1.38196e+02 105.092 -3.72530e+00 1.38143e+01  0.00000e+00 0.00000e+00 2.62669e+02 105.092 1.24473e+02 105.092 0.9644 
1 1 1 1   57  12 o 11 8.68443e+00 1.00087e+00 1.50843e+02 336.427 1.31862e+01  -5.75346e+00 0.00000e+00 0.00000e+00 1.61309e+02 336.427 1.04663e+01 336.427 0.9646 
1 1 1 1   57  13 o 18 6.21449e+00 1.08236e+00 7.69873e+01 281.673 1.10430e+00  -5.34527e+00 0.00000e+00 0.00000e+00 1.31977e+02 281.673 5.49893e+01 281.673 0.9030 
1 1 1 1   57  14 f 0  4.13333e+00 1.13462e+00 1.36532e+02 283.000 1.60845e+00  -6.96711e+00 0.00000e+00 0.00000e+00 6.05692e+00 283.000 1.30476e+02 103.000 0.9272 
1 1 1 1   57  15 o 17 2.56698e+00 8.72214e-01 4.02894e+01 67.957  6.59771e-01  1.62946e+00  0.00000e+00 0.00000e+00 2.20970e+01 67.957  1.81924e+01 247.957 0.6537 
1 1 1 1   57  16 o 10 4.99434e+00 1.30710e+00 7.62377e+01 83.567  5.90782e-01  5.23959e+00  0.00000e+00 0.00000e+00 9.05905e+01 83.567  1.43528e+01 83.567  0.8993 
1 1 1 1   57  17 o 19 5.82273e+00 1.52023e+00 4.05131e+01 201.980 -2.93918e+00 -1.18630e+00 0.00000e+00 0.00000e+00 1.37039e+02 201.980 9.65254e+01 201.980 0.8218 
1 1 1 1   57  18 o 10 4.09392e+00 1.32283e+00 6.50694e+01 74.841  1.30627e+00  4.82152e+00  0.00000e+00 0.00000e+00 7.04875e+01 74.841  5.41812e+00 74.841  0.8933 
1 1 1 1   58  0  o 10 2.64748e+01 4.37586e-01 3.21708e+02 138.480 -1.41883e+01 1.25615e+01  0.00000e+00 0.00000e+00 6.42049e+02 138.480 3.20341e+02 138.480 0.9732 
1 1 1 1   58  1  o 16 1.98152e+01 3.80455e-01 2.96830e+02 47.787  8.79261e+00  9.69246e+00  0.00000e+00 0.00000e+00 4.15429e+02 47.787  1.18599e+02 47.787  0.9610 
1 1 1 1   58  2  o 17 1.46817e+01 3.60393e-01 2.40560e+02 215.225 -7.07743e+00 -4.99717e+00 0.00000e+00 0.00000e+00 2.75829e+02 215.225 3.52693e+01 215.225 0.9404 
1 1 1 1   58  3  o 5  7.73582e+00 4.69325e-01 2.38454e+02 12.243  4.82395e+00  1.04675e+00  0.00000e+00 0.00000e+00 1.95691e+01 12.243  2.18885e+02 192.243 0.8919 
1 1 1 1   58  4  o 19 1.41702e+01 4.13352e-01 1.92455e+02 36.472  6.17436e+00  4.56405e+00  0.00000e+00 0.00000e+00 3.01571e+02 36.472  1.09117e+02 36.472  0.9324 
1 1 1 1   58  5  o 1  2.36565e+01 5.42230e-01 4.20380e+02 340.799 3.01326e+01  -1.04936e+01 0.00000e+00 0.00000e+00 4.49990e+02 340.799 2.96109e+01 340.799 0.9842 
1 1 1 1   58  6  o 17 9.76239e+00 5.01738e-01 1.12341e+02 158.517 -3.62418e+00 1.42639e+00  0.00000e+00 0.00000e+00 2.01180e+02 158.517 8.88392e+01 158.517 0.8594 
1 1 1 1   58  7  o 11 1.93965e+01 4.75915e-01 3.76365e+02 258.879 -6.20958e+00 -3.15900e+01 0.00000e+00 0.00000e+00 3.36907e+02 258.879 3.94584e+01 78.879  0.9843 
1 1 1 1   58  8  o 4  2.74261e+01 6.25918e-01 3.74826e+02 174.497 -6.04711e+01 5.82632e+00  0.00000e+00 0.00000e+00 6.40870e+02 174.497 2.66044e+02 174.497 0.9917 
1 1 1 1   58  9  o 4  1.50311e+01 5.69795e-01 3.13116e+02 222.312 -2.45465e+01 -2.23452e+01 0.00000e+00 0.00000e+00 2.39398e+02 222.312 7.37187e+01 42.312  0.9848 
1 1 1 1   58  10 o 9  7.66907e+00 8.68735e-01 1.50368e+02 76.820  2.14200e+00  9.14682e+00  0.00000e+00 0.00000e+00 1.20038e+02 76.820  3.03305e+01 256.820 0.9452 
1 1 1 1   58  11 o 1  1.10622e+01 7.68147e-01 2.42925e+02 82.854  3.37300e+00  2.69048e+01  0.00000e+00 0.00000e+00 1.61817e+02 82.854  8.11076e+01 262.854 0.9814 
1 1 1 1   58  12 o 19 1.05193e+01 8.34456e-01 2.51127e+02 260.798 -5.15245e+00 -3.18055e+01 0.00000e+00 0.00000e+00 1.34665e+02 260.798 1.16461e+02 80.798  0.9844 
1 1 1 1   58  13 o 17 3.79389e+00 1.04139e+00 7.81816e+01 314.164 2.60344e+00  -2.68057e+00 0.00000e+00 0.00000e+00 4.22431e+01 314.164 3.59385e+01 134.164 0.8526 
1 1 1 1   58  14 o 4  8.33305e+00 1.03381e+00 1.36630e+02 197.905 -1.41216e+01 -4.56261e+00 0.00000e+00 0.00000e+00 1.62736e+02 197.905 2.61057e+01 197.905 0.9657 
1 1 1 1   58  15 o 3  3.15195e+00 1.02604e+00 5.15202e+01 326.891 2.08868e+00  -1.36204e+00 0.00000e+00 0.00000e+00 3.80220e+01 326.891 1.34982e+01 146.891 0.7643 
1 1 1 1   58  16 o 4  3.38374e+00 1.10822e+00 8.30139e+01 352.367 4.45544e+00  -5.97097e-01 0.00000e+00 0.00000e+00 2.75897e+01 352.367 5.54242e+01 172.367 0.8802 
1 1 1 1   58  17 o 1  5.39322e+00 1.48865e+00 1.00515e+02 102.167 -1.57159e+00 7.28951e+00  0.00000e+00 0.00000e+00 8.56287e+01 102.167 1.48868e+01 282.167 0.9303 
1 1 1 1   58  18 o 8  3.91289e+00 1.28180e+00 1.46323e+01 68.621  3.98277e-01  1.01736e+00  0.00000e+00 0.00000e+00 5.47189e+01 68.621  4.00866e+01 68.621  0.4782 
1 1 1 1   59  0  o 16 1.18700e+01 3.48875e-01 1.51685e+02 168.819 -4.33899e+00 8.57628e-01  0.00000e+00 0.00000e+00 2.38077e+02 168.819 8.63914e+01 168.819 0.8780 
1 1 1 1   59  1  o 5  1.27087e+01 3.50700e-01 2.42862e+02 52.492  4.60611e+00  6.00101e+00  0.00000e+00 0.00000e+00 1.99787e+02 52.492  4.30748e+01 232.492 0.9313 
1 1 1 1   59  2  o 6  1.21891e+01 3.54520e-01 1.89803e+02 282.135 1.31043e+00  -6.09466e+00 0.00000e+00 0.00000e+00 2.27663e+02 282.135 3.78602e+01 282.135 0.9158 
1 1 1 1   59  3  o 16 1.84898e+01 4.20249e-01 1.20597e+02 52.049  3.77978e+00  4.84643e+00  0.00000e+00 0.00000e+00 5.11707e+02 52.049  3.91110e+02 52.049  0.9146 
1 1 1 1   59  4  o 7  2.70335e+01 4.64264e-01 3.93922e+02 80.600  5.25605e+00  3.17493e+01  0.00000e+00 0.00000e+00 6.00905e+02 80.600  2.06983e+02 80.600  0.9843 
1 1 1 1   59  5  o 3  2.77244e+01 6.30011e-01 4.13404e+02 117.789 -1.69779e+01 3.22162e+01  0.00000e+00 0.00000e+00 6.08509e+02 117.789 1.95105e+02 117.789 0.9862 
1 1 1 1   59  6  o 8  1.84604e+01 4.57252e-01 3.79202e+02 301.838 1.45294e+01  -2.33987e+01 0.00000e+00 0.00000e+00 2.97938e+02 301.838 8.12647e+01 121.838 0.9817 
1 1 1 1   59  7  o 19 1.04540e+01 5.19066e-01 1.79058e+02 40.862  6.87462e+00  5.94698e+00  0.00000e+00 0.00000e+00 1.89270e+02 40.862  1.02111e+01 40.862  0.9433 
1 1 1 1   59  8  o 13 1.29868e+01 5.51357e-01 1.30369e+02 272.384 4.01948e-01  -9.65666e+00 0.00000e+00 0.00000e+00 3.28696e+02 272.384 1.98328e+02 272.384 0.9468 
1 1 1 1   59  9  o 18 2.65070e+01 6.30937e-01 4.99672e+02 251.969 -3.03753e+01 -9.33114e+01 0.00000e+00 0.00000e+00 4.84479e+02 251.969 1.51926e+01 71.969  0.9949 
1 1 1 1   59  10 o 13 1.00098e+01 7.68032e-01 1.71118e+02 341.543 1.42289e+01  -4.74911e+00 0.00000e+00 0.00000e+00 1.89563e+02 341.543 1.84450e+01 341.543 0.9661 
1 1 1 1   59  11 o 15 7.53696e+00 8.97186e-01 1.92694e+02 54.684  8.47981e+00  1.19693e+01  0.00000e+00 0.00000e+00 7.85018e+01 54.684  1.14192e+02 234.684 0.9653 
1 1 1 1   59  12 o 12 1.29202e+01 6.51869e-01 1.50880e+02 287.044 6.98627e+00  -2.27891e+01 0.00000e+00 0.00000e+00 3.20207e+02 287.044 1.69327e+02 287.044 0.9788 
1 1 1 1   59  13 o 11 8.42994e+00 8.74160e-01 1.63202e+02 121.877 -9.66360e+00 1.55392e+01  0.00000e+00 0.00000e+00 1.41899e+02 121.877 2.13037e+01 301.877 0.9723 
1 1 1 1   59  14 o 10 1.22239e+01 8.58411e-01 2.12989e+02 288.171 1.28865e+01  -3.92618e+01 0.00000e+00 0.00000e+00 2.36147e+02 288.171 2.31582e+01 288.171 0.9878 
1 1 1 1   59  15 o 18 3.69478e+00 1.12181e+00 2.83658e+01 42.007  1.14939e+00  1.03517e+00  0.00000e+00 0.00000e+00 5.50508e+01 42.007  2.66850e+01 42.007  0.6075 
1 1 1 1   59  16 o 14 6.61506e+00 1.44742e+00 9.01038e+01 99.619  -1.30086e+00 7.67584e+00  0.00000e+00 0.00000e+00 1.39149e+02 99.619  4.90452e+01 99.619  0.9334 
1 1 1 1   59  17 o 16 3.48908e+00 1.15881e+00 6.83325e+01 90.275  -2.13497e-02 4.44111e+00  0.00000e+00 0.00000e+00 4.53767e+01 90.275  2.29558e+01 270.275 0.8786 
1 1 1 1   59  18 o 18 5.08471e+00 1.46171e+00 1.15692e+02 93.113  -5.04643e-01 9.27820e+00  0.00000e+00 0.00000e+00 6.22799e+01 93.113  5.34117e+01 273.113 0.9446 
1 1 1 1   60  0  o 14 2.86020e+01 4.62232e-01 6.69510e+02 20.006  4.32161e+01  1.57349e+01  0.00000e+00 0.00000e+00 3.88268e+02 20.006  2.81243e+02 200.006 0.9891 
1 1 1 1   60  1  o 16 1.69878e+01 3.64870e-01 3.44771e+02 148.302 -1.34083e+01 8.28057e+00  0.00000e+00 0.00000e+00 2.69936e+02 148.302 7.48347e+01 328.302 0.9677 
1 1 1 1   60  2  o 1  2.44534e+01 4.29121e-01 3.57729e+02 25.479  2.06692e+01  9.84938e+00  0.00000e+00 0.00000e+00 5.36385e+02 25.479  1.78657e+02 25.479  0.9779 
1 1 1 1   60  3  o 2  3.42481e+01 5.33167e-01 5.19465e+02 202.331 -4.60299e+01 -1.89078e+01 0.00000e+00 0.00000e+00 7.47990e+02 202.331 2.28525e+02 202.331 0.9899 
1 1 1 1   60  4  o 2  4.67343e+01 6.82984e-01 7.17795e+02 321.650 8.37827e+01  -6.62875e+01 0.00000e+00 0.00000e+00 1.02090e+03 321.650 3.03104e+02 321.650 0.9953 
1 1 1 1   60  5  o 9  2.55750e+01 5.73997e-01 3.16052e+02 266.580 -1.58145e+00 -2.64664e+01 0.00000e+00 0.00000e+00 6.21497e+02 266.580 3.05445e+02 266.580 0.9810 
1 1 1 1   60  6  o 9  8.98571e+00 5.30608e-01 1.46819e+02 292.123 2.13149e+00  -5.24322e+00 0.00000e+00 0.00000e+00 1.57570e+02 292.123 1.07504e+01 292.123 0.9067 
1 1 1 1   60  7  o 8  1.76254e+01 5.27541e-01 4.21560e+02 179.561 -3.51049e+01 2.69197e-01  0.00000e+00 0.00000e+00 2.27235e+02 179.561 1.94324e+02 359.561 0.9857 
1 1 1 1   60  8  o 10 9.31527e+00 6.13924e-01 1.87058e+02 13.361  1.03154e+01  2.45008e+00  0.00000e+00 0.00000e+00 1.43855e+02 13.361  4.32029e+01 193.361 0.9516 
1 1 1 1   60  9  o 7  4.75150e+00 9.24506e-01 1.93994e+02 76.750  1.44193e+00  6.12360e+00  0.00000e+00 0.00000e+00 3.14798e+01 256.750 2.25474e+02 256.750 0.9167 
1 1 1 1   60  10 o 7  5.93917e+00 9.46731e-01 5.24125e+01 26.226  2.32208e+00  1.14389e+00  0.00000e+00 0.00000e+00 1.19083e+02 26.226  6.66703e+01 26.226  0.7743 
1 1 1 1   60  11 o 16 3.75172e+00 9.96242e-01 1.22455e+02 316.756 3.15572e+00  -2.96797e+00 0.00000e+00 0.00000e+00 8.19056e-02 136.756 1.22537e+02 136.756 0.8752 
1 1 1 1   60  12 o 11 1.69715e+01 6.41652e-01 3.07106e+02 204.415 -6.38581e+01 -2.89875e+01 0.00000e+00 0.00000e+00 3.20479e+02 204.415 1.33726e+01 204.415 0.9928 
1 1 1 1   60  13 o 18 1.12098e+01 7.47965e-01 1.92561e+02 223.531 -2.15279e+01 -2.04511e+01 0.00000e+00 0.00000e+00 2.17564e+02 223.531 2.50035e+01 223.531 0.9830 
1 1 1 1   60  14 o 15 9.13590e+00 1.01954e+00 1.40037e+02 296.491 8.47229e+00  -1.69993e+01 0.00000e+00 0.00000e+00 1.90650e+02 296.491 5.06128e+01 296.491 0.9733 
1 1 1 1   60  15 o 12 5.00774e+00 1.24698e+00 1.14665e+02 303.298 4.36341e+00  -6.64323e+00 0.00000e+00 0.00000e+00 5.92776e+01 303.298 5.53876e+01 123.298 0.9348 
1 1 1 1   60  16 o 2  4.06434e+00 1.20792e+00 6.10987e+01 44.434  2.78407e+00  2.72964e+00  0.00000e+00 0.00000e+00 6.85902e+01 44.434  7.49145e+00 44.434  0.8595 
1 1 1 1   60  17 o 9  4.78796e+00 1.40484e+00 6.35781e+01 35.543  3.95264e+00  2.82391e+00  0.00000e+00 0.00000e+00 9.44608e+01 35.543  3.08828e+01 35.543  0.8900 
1 1 1 1   60  18 o 18 3.98317e+00 1.29157e+00 5.86445e+01 157.564 -4.24673e+00 1.75350e+00  0.00000e+00 0.00000e+00 7.16720e+01 157.564 1.30275e+01 157.564 0.8830 
1 1 1 1   61  0  o 4  2.52783e+01 4.29945e-01 4.50528e+02 20.152  2.79927e+01  1.02728e+01  0.00000e+00 0.00000e+00 4.78521e+02 20.152  2.79929e+01 20.152  0.9831 
1 1 1 1   61  1  o 3  1.93000e+01 3.83140e-01 3.74774e+02 300.938 9.74285e+00  -1.62547e+01 0.00000e+00 0.00000e+00 3.27465e+02 300.938 4.73098e+01 120.938 0.9732 
1 1 1 1   61  2  o 18 1.15278e+01 4.38543e-01 9.17971e+01 26.662  2.59578e+00  1.30339e+00  0.00000e+00 0.00000e+00 2.54119e+02 26.662  1.62322e+02 26.662  0.8027 
1 1 1 1   61  3  o 10 3.35681e+01 5.26153e-01 6.71776e+02 321.247 5.29109e+01  -4.24695e+01 0.00000e+00 0.00000e+00 5.73701e+02 321.247 9.80746e+01 141.247 0.9926 
1 1 1 1   61  4  o 5  1.49504e+01 3.94258e-01 3.96432e+02 309.610 1.17983e+01  -1.42567e+01 0.00000e+00 0.00000e+00 1.46998e+02 309.610 2.49434e+02 129.610 0.9726 
1 1 1 1   61  5  o 15 4.68507e+01 8.35106e-01 6.62923e+02 170.955 -1.05758e+02 1.68353e+01  0.00000e+00 0.00000e+00 1.07942e+03 170.955 4.16501e+02 170.955 0.9953 
1 1 1 1   61  6  o 5  1.84671e+01 4.61602e-01 3.63023e+02 78.414  5.95979e+00  2.90698e+01  0.00000e+00 0.00000e+00 3.15056e+02 78.414  4.79674e+01 258.414 0.9830 
1 1 1 1   61  7  o 12 3.74046e+01 7.39438e-01 6.01046e+02 9.808   1.17560e+02  2.03233e+01  0.00000e+00 0.00000e+00 7.89769e+02 9.808   1.88723e+02 9.808   0.9958 
1 1 1 1   61  8  o 2  1.45613e+01 5.35085e-01 3.00951e+02 206.156 -2.46051e+01 -1.20838e+01 0.00000e+00 0.00000e+00 2.32532e+02 206.156 6.84186e+01 26.156  0.9816 
1 1 1 1   61  9  o 3  1.58344e+01 6.24994e-01 2.48717e+02 342.878 3.12089e+01  -9.61433e+00 0.00000e+00 0.00000e+00 3.32891e+02 342.878 8.41748e+01 342.878 0.9846 
1 1 1 1   61  10 o 19 1.85028e+01 6.56322e-01 2.32271e+02 204.139 -3.70925e+01 -1.66224e+01 0.00000e+00 0.00000e+00 4.49086e+02 204.139 2.16815e+02 204.139 0.9876 
1 1 1 1   61  11 o 19 6.45966e+00 8.41076e-01 1.41728e+02 231.755 -5.57512e+00 -7.07323e+00 0.00000e+00 0.00000e+00 8.51976e+01 231.755 5.65306e+01 51.755  0.9427 
1 1 1 1   61  12 o 7  9.59433e+00 7.52519e-01 1.78694e+02 217.208 -1.69291e+01 -1.28538e+01 0.00000e+00 0.00000e+00 1.70082e+02 217.208 8.61225e+00 37.208  0.9762 
1 1 1 1   61  13 o 18 4.22692e+00 1.02580e+00 5.01601e+01 271.998 9.90852e-02  -2.84019e+00 0.00000e+00 0.00000e+00 7.52941e+01 271.998 2.51341e+01 271.998 0.7976 
1 1 1 1   61  14 o 19 3.30504e+00 1.03129e+00 9.19679e+01 6.109   4.20916e+00  4.50484e-01  0.00000e+00 0.00000e+00 1.51843e+01 6.109   7.67837e+01 186.109 0.8719 
1 1 1 1   61  15 o 6  6.70672e+00 1.33911e+00 1.05967e+02 348.301 8.96720e+00  -1.85676e+00 0.00000e+00 0.00000e+00 1.29173e+02 348.301 2.32061e+01 348.301 0.9437 
1 1 1 1   61  16 o 16 4.34022e+00 1.26693e+00 7.35110e+01 82.000  6.68353e-01  4.75535e+00  0.00000e+00 0.00000e+00 6.96393e+01 82.000  3.87179e+00 262.000 0.8886 
1 1 1 1   61  17 o 16 4.42885e+00 1.36507e+00 6.69014e+01 315.951 3.51880e+00  -3.40387e+00 0.00000e+00 0.00000e+00 7.94128e+01 315.951 1.25114e+01 315.951 0.8909 
1 1 1 1   62  0  o 7  2.25031e+01 4.08841e-01 4.01882e+02 57.471  1.33707e+01  2.09640e+01  0.00000e+00 0.00000e+00 4.22168e+02 57.471  2.02864e+01 57.471  0.9797 
1 1 1 1   62  1  o 2  1.54640e+01 3.96329e-01 1.51663e+02 131.745 -4.40022e+00 4.93093e+00  0.00000e+00 0.00000e+00 3.80640e+02 131.745 2.28977e+02 131.745 0.9209 
1 1 1 1   62  2  o 16 8.67725e+00 4.00068e-01 1.85672e+02 138.741 -3.67665e+00 3.22536e+00  0.00000e+00 0.00000e+00 1.03240e+02 138.741 8.24320e+01 318.741 0.8908 
1 1 1 1   62  3  o 12 2.68899e+01 4.60850e-01 5.05660e+02 150.781 -3.83304e+01 2.14392e+01  0.00000e+00 0.00000e+00 4.87791e+02 150.781 1.78691e+01 330.780 0.9885 
1 1 1 1   62  4  o 14 3.31653e+01 5.30475e-01 5.28514e+02 220.295 -4.40834e+01 -3.73782e+01 0.00000e+00 0.00000e+00 6.99996e+02 220.295 1.71481e+02 220.295 0.9913 
1 1 1 1   62  5  o 3  2.19444e+01 5.37598e-01 3.84297e+02 334.521 2.97596e+01  -1.41811e+01 0.00000e+00 0.00000e+00 4.22966e+02 334.521 3.86690e+01 334.521 0.9847 
1 1 1 1   62  6  o 4  7.12659e+00 6.46271e-01 9.28597e+01 250.585 -9.98486e-01 -2.83294e+00 0.00000e+00 0.00000e+00 1.22796e+02 250.585 2.99365e+01 250.585 0.8103 
1 1 1 1   62  7  o 2  8.02120e+00 6.24964e-01 2.70087e+02 167.543 -1.25005e+01 2.76135e+00  0.00000e+00 0.00000e+00 1.74275e+01 167.543 2.52660e+02 347.543 0.9601 
1 1 1 1   62  8  o 13 4.84472e+00 8.48128e-01 7.18685e+01 343.278 2.24047e+00  -6.73114e-01 0.00000e+00 0.00000e+00 6.30657e+01 343.278 8.80283e+00 163.278 0.7463 
1 1 1 1   62  9  o 3  1.33081e+01 6.34657e-01 1.60049e+02 12.126  1.62312e+01  3.48729e+00  0.00000e+00 0.00000e+00 3.21155e+02 12.126  1.61106e+02 12.126  0.9694 
1 1 1 1   62  10 o 18 3.06243e+00 8.85726e-01 3.23583e+01 327.333 7.49709e-01  -4.80687e-01 0.00000e+00 0.00000e+00 1.40251e+01 327.333 1.83332e+01 147.333 0.4063 
1 1 1 1   62  11 o 12 9.98056e+00 6.56785e-01 2.16064e+02 307.007 1.45632e+01  -1.93210e+01 0.00000e+00 0.00000e+00 1.48019e+02 307.007 6.80447e+01 127.007 0.9791 
1 1 1 1   62  12 o 18 1.28612e+01 6.64489e-01 1.81477e+02 138.772 -2.41178e+01 2.11342e+01  0.00000e+00 0.00000e+00 2.89854e+02 138.772 1.08377e+02 138.772 0.9843 
1 1 1 1   62  13 o 3  5.35122e+00 1.05586e+00 1.19571e+02 236.288 -4.70657e+00 -7.05412e+00 0.00000e+00 0.00000e+00 6.73894e+01 236.288 5.21820e+01 56.288  0.9390 
1 1 1 1   62  14 f 0  6.51836e+00 1.11206e+00 1.74316e+02 227.342 -1.09450e+01 -1.18785e+01 0.00000e+00 0.00000e+00 6.03897e+01 227.342 1.13926e+02 47.342  0.9685 
1 1 1 1   62  15 o 3  3.63990e+00 1.12354e+00 3.74609e+01 310.177 1.35828e+00  -1.60864e+00 0.00000e+00 0.00000e+00 5.91218e+01 310.177 2.16609e+01 310.177 0.7143 
1 1 1 1   62  16 o 12 8.02075e+00 1.37428e+00 8.80789e+01 321.433 7.65193e+00  -6.10118e+00 0.00000e+00 0.00000e+00 1.93940e+02 321.433 1.05861e+02 321.433 0.9474 
1 1 1 1   62  17 o 11 3.89231e+00 1.23727e+00 7.85866e+01 202.585 -5.14923e+00 -2.14184e+00 0.00000e+00 0.00000e+00 5.20489e+01 202.585 2.65377e+01 22.585  0.9052 
1 1 1 1   63  0  o 8  1.50795e+01 4.28310e-01 1.82154e+02 137.231 -6.11631e+00 5.65759e+00  0.00000e+00 0.00000e+00 3.46416e+02 137.231 1.64262e+02 137.231 0.9379 
1 1 1 1   63  1  o 13 1.07828e+01 3.67659e-01 3.26473e+02 271.478 2.75629e-01  -1.06805e+01 0.00000e+00 0.00000e+00 5.71635e+01 271.478 2.69309e+02 91.478  0.9520 
1 1 1 1   63  2  o 18 1.90889e+01 3.94544e-01 4.74961e+02 327.058 2.18920e+01  -1.41851e+01 0.00000e+00 0.00000e+00 2.24600e+02 327.058 2.50361e+02 147.058 0.9806 
1 1 1 1   63  3  o 10 7.45211e+00 4.57244e-01 1.49767e+02 161.254 -3.28551e+00 1.11505e+00  0.00000e+00 0.00000e+00 8.40004e+01 161.254 6.57668e+01 341.254 0.8395 
1 1 1 1   63  4  o 13 7.97150e+00 4.60516e-01 9.96098e+01 124.713 -1.61313e+00 2.32851e+00  0.00000e+00 0.00000e+00 1.37695e+02 124.713 3.80851e+01 124.713 0.7968 
1 1 1 1   63  5  o 19 3.09190e+00 7.46226e-01 5.61101e+01 197.260 -6.94730e-01 -2.15854e-01 0.00000e+00 0.00000e+00 1.66565e+01 17.260  7.27666e+01 17.260  0.3416 
1 1 1 1   63  6  f 0  1.11547e+01 5.23143e-01 2.04635e+02 234.327 -6.30810e+00 -8.78742e+00 0.00000e+00 0.00000e+00 1.92141e+02 234.327 1.24935e+01 54.327  0.9526 
1 1 1 1   63  7  o 14 8.85010e+00 5.93938e-01 1.72246e+02 141.861 -6.87610e+00 5.39916e+00  0.00000e+00 0.00000e+00 1.38593e+02 141.861 3.36530e+01 321.861 0.9409 
1 1 1 1   63  8  o 4  1.74717e+01 5.92459e-01 3.22693e+02 345.441 4.04530e+01  -1.05064e+01 0.00000e+00 0.00000e+00 3.21355e+02 345.441 1.33806e+00 165.441 0.9880 
1 1 1 1   63  9  o 9  1.31115e+01 6.12615e-01 2.43860e+02 218.274 -2.16958e+01 -1.71183e+01 0.00000e+00 0.00000e+00 2.36187e+02 218.274 7.67259e+00 38.274  0.9817 
1 1 1 1   63  10 o 8  1.54507e+01 6.69707e-01 3.30541e+02 183.403 -5.37881e+01 -3.19890e+00 0.00000e+00 0.00000e+00 2.39990e+02 183.403 9.05512e+01 3.404   0.9907 
1 1 1 1   63  11 o 18 3.29046e+00 8.89785e-01 5.11265e+01 106.790 -5.57699e-01 1.84837e+00  0.00000e+00 0.00000e+00 3.29654e+01 106.790 1.81611e+01 286.790 0.6861 
1 1 1 1   63  12 o 19 6.66505e+00 8.85312e-01 9.71286e+01 225.915 -5.88293e+00 -6.07392e+00 0.00000e+00 0.00000e+00 1.35818e+02 225.915 3.86893e+01 225.915 0.9389 
1 1 1 1   63  13 o 8  9.70075e+00 8.17543e-01 1.68700e+02 27.473  2.15705e+01  1.12158e+01  0.00000e+00 0.00000e+00 1.84662e+02 27.473  1.59615e+01 27.473  0.9792 
1 1 1 1   63  14 o 15 3.01040e+00 9.50482e-01 8.70863e+01 5.581   4.14597e+00  4.05116e-01  0.00000e+00 0.00000e+00 1.02204e+01 5.581   7.68659e+01 185.581 0.8696 
1 1 1 1   63  15 o 8  3.44566e+00 1.08588e+00 6.16136e+01 56.897  1.78415e+00  2.73656e+00  0.00000e+00 0.00000e+00 4.43347e+01 56.897  1.72789e+01 236.897 0.8279 
1 1 1 1   63  16 o 12 4.01726e+00 1.20963e+00 7.03757e+01 353.731 4.60114e+00  -5.05419e-01 0.00000e+00 0.00000e+00 6.13943e+01 353.731 8.98146e+00 173.731 0.8840 
1 1 1 1   63  17 o 13 5.36729e+00 1.44719e+00 2.77860e+01 278.108 3.19721e-01  -2.24413e+00 0.00000e+00 0.00000e+00 1.18862e+02 278.108 9.10760e+01 278.108 0.7371 
1 1 1 1   64  0  o 11 8.64542e+00 4.18570e-01 1.75171e+02 298.673 2.08930e+00  -3.82041e+00 0.00000e+00 0.00000e+00 1.07780e+02 298.673 6.73912e+01 118.673 0.8759 
1 1 1 1   64  1  o 5  1.23630e+01 3.70928e-01 2.64721e+02 59.363  5.41369e+00  9.14041e+00  0.00000e+00 0.00000e+00 1.74928e+02 59.363  8.97926e+01 239.362 0.9517 
1 1 1 1   64  2  o 18 1.01991e+01 3.97227e-01 1.93751e+02 0.876   6.17160e+00  9.43792e-02  0.00000e+00 0.00000e+00 1.54923e+02 0.876   3.88280e+01 180.876 0.9150 
1 1 1 1   64  3  o 13 2.85258e+01 4.81294e-01 4.57965e+02 30.592  3.71389e+01  2.19571e+01  0.00000e+00 0.00000e+00 5.95342e+02 30.592  1.37377e+02 30.592  0.9883 
1 1 1 1   64  4  o 17 1.23347e+01 3.97509e-01 2.09076e+02 106.664 -2.56492e+00 8.56880e+00  0.00000e+00 0.00000e+00 2.25098e+02 106.664 1.60217e+01 106.664 0.9423 
1 1 1 1   64  5  o 17 1.34344e+01 4.45735e-01 3.36820e+02 299.936 9.99535e+00  -1.73571e+01 0.00000e+00 0.00000e+00 1.52198e+02 299.936 1.84623e+02 119.936 0.9747 
1 1 1 1   64  6  o 12 2.16225e+01 5.49269e-01 4.31949e+02 53.391  2.81709e+01  3.79195e+01  0.00000e+00 0.00000e+00 3.66715e+02 53.391  6.52345e+01 233.391 0.9894 
1 1 1 1   64  7  o 8  4.29628e+00 7.56587e-01 1.02502e+02 32.205  2.21592e+00  1.39569e+00  0.00000e+00 0.00000e+00 2.21346e+01 32.205  8.03673e+01 212.204 0.7773 
1 1 1 1   64  8  o 7  1.29041e+01 5.94971e-01 2.80490e+02 118.871 -1.27657e+01 2.31528e+01  0.00000e+00 0.00000e+00 1.91704e+02 118.871 8.87852e+01 298.871 0.9809 
1 1 1 1   64  9  o 6  7.26386e+00 7.83456e-01 1.71312e+02 193.188 -1.05632e+01 -2.47525e+00 0.00000e+00 0.00000e+00 8.67353e+01 193.188 8.45768e+01 13.188  0.9527 
1 1 1 1   64  10 o 16 8.16018e+00 6.61616e-01 1.53421e+02 297.777 6.04703e+00  -1.14802e+01 0.00000e+00 0.00000e+00 1.38720e+02 297.777 1.47012e+01 117.777 0.9607 
1 1 1 1   64  11 o 9  1.01686e+01 6.66186e-01 1.43782e+02 256.569 -4.39303e+00 -1.83966e+01 0.00000e+00 0.00000e+00 2.24792e+02 256.569 8.10108e+01 256.569 0.9732 
1 1 1 1   64  12 o 2  3.64463e+00 9.47920e-01 8.59225e+01 18.154  3.72135e+00  1.22023e+00  0.00000e+00 0.00000e+00 3.07695e+01 18.154  5.51531e+01 198.154 0.8602 
1 1 1 1   64  13 o 11 8.79755e+00 8.87715e-01 1.16300e+02 53.116  8.82060e+00  1.17547e+01  0.00000e+00 0.00000e+00 1.99571e+02 53.116  8.32713e+01 53.116  0.9654 
1 1 1 1   64  14 f 0  5.48706e+00 1.17886e+00 8.98066e+01 129.893 -4.18686e+00 5.00874e+00  0.00000e+00 0.00000e+00 9.77705e+01 129.893 7.96383e+00 129.893 0.9199 
1 1 1 1   64  15 o 19 8.65680e+00 1.20545e+00 1.85728e+02 264.661 -2.16411e+00 -2.31586e+01 0.00000e+00 0.00000e+00 1.28733e+02 264.661 5.69948e+01 84.661  0.9783 
1 1 1 1   64  16 o 7  8.18292e+00 1.33502e+00 1.00104e+02 249.806 -4.23373e+00 -1.15107e+01 0.00000e+00 0.00000e+00 1.90821e+02 249.806 9.07170e+01 249.806 0.9583 
1 1 1 1   64  17 o 9  7.01941e+00 1.57674e+00 8.84128e+01 134.920 -5.96382e+00 5.98040e+00  0.00000e+00 0.00000e+00 1.55821e+02 134.920 6.74086e+01 134.920 0.9388 
1 1 1 1   65  0  o 16 1.02245e+01 3.83000e-01 2.34085e+02 112.872 -2.90815e+00 6.89396e+00  0.00000e+00 0.00000e+00 1.21367e+02 112.872 1.12718e+02 292.872 0.9306 
1 1 1 1   65  1  o 10 1.40397e+01 3.75256e-01 1.52877e+02 212.363 -5.65925e+00 -3.58634e+00 0.00000e+00 0.00000e+00 3.30740e+02 212.363 1.77864e+02 212.363 0.9220 
1 1 1 1   65  2  o 18 3.54700e+01 5.49254e-01 6.75668e+02 17.722  7.26312e+01  2.32100e+01  0.00000e+00 0.00000e+00 6.40695e+02 17.722  3.49731e+01 197.722 0.9934 
1 1 1 1   65  3  o 19 1.63778e+01 3.96513e-01 3.39447e+02 150.585 -1.73072e+01 9.75824e+00  0.00000e+00 0.00000e+00 2.56722e+02 150.585 8.27251e+01 330.585 0.9745 
1 1 1 1   65  4  o 19 1.35201e+01 4.04027e-01 2.98460e+02 88.405  4.86930e-01  1.74824e+01  0.00000e+00 0.00000e+00 1.91823e+02 88.405  1.06636e+02 268.405 0.9710 
1 1 1 1   65  5  o 12 1.63029e+01 4.81862e-01 2.95418e+02 3.451   2.21309e+01  1.33462e+00  0.00000e+00 0.00000e+00 2.99416e+02 3.451   3.99834e+00 3.451   0.9772 
1 1 1 1   65  6  o 2  1.02857e+01 5.52923e-01 2.07842e+02 328.877 1.09330e+01  -6.60115e+00 0.00000e+00 0.00000e+00 1.60745e+02 328.877 4.70971e+01 148.877 0.9600 
1 1 1 1   65  7  o 18 1.07419e+01 4.93964e-01 2.18912e+02 43.314  1.18412e+01  1.11639e+01  0.00000e+00 0.00000e+00 1.69394e+02 43.314  4.95183e+01 223.314 0.9688 
1 1 1 1   65  8  o 14 1.74035e+01 5.95932e-01 3.31605e+02 137.912 -3.29364e+01 2.97475e+01  0.00000e+00 0.00000e+00 3.10164e+02 137.912 2.14413e+01 317.912 0.9887 
1 1 1 1   65  9  o 18 5.33871e+00 8.79364e-01 1.45729e+02 83.553  7.40864e-01  6.55643e+00  0.00000e+00 0.00000e+00 3.75288e+01 83.553  1.08200e+02 263.553 0.9208 
1 1 1 1   65  10 o 10 1.28120e+01 6.15686e-01 1.61338e+02 144.656 -1.78403e+01 1.26524e+01  0.00000e+00 0.00000e+00 3.04997e+02 144.656 1.43659e+02 144.656 0.9769 
1 1 1 1   65  11 f 0  7.09601e+00 7.93273e-01 1.55900e+02 259.129 -2.43655e+00 -1.26871e+01 0.00000e+00 0.00000e+00 9.78985e+01 259.129 5.80019e+01 79.129  0.9605 
1 1 1 1   65  12 o 1  3.39610e+00 9.00181e-01 7.22942e+01 32.099  2.79639e+00  1.75413e+00  0.00000e+00 0.00000e+00 3.26006e+01 32.099  3.96936e+01 212.099 0.8300 
1 1 1 1   65  13 o 9  4.85779e+00 8.76075e-01 6.77801e+01 280.340 8.30837e-01  -4.55366e+00 0.00000e+00 0.00000e+00 9.19087e+01 280.340 2.41286e+01 280.340 0.8840 
1 1 1 1   65  14 o 1  4.65593e+00 1.16108e+00 1.10231e+02 288.062 2.36868e+00  -7.26338e+00 0.00000e+00 0.00000e+00 5.10151e+01 288.062 5.92159e+01 108.062 0.9320 
1 1 1 1   65  15 o 19 2.90114e+00 9.62691e-01 5.49187e+01 53.866  1.62866e+00  2.23065e+00  0.00000e+00 0.00000e+00 3.02478e+01 53.866  2.46709e+01 233.866 0.7907 
1 1 1 1   65  16 o 6  3.89777e+00 1.23313e+00 5.36697e+01 263.854 -3.58642e-01 -3.33071e+00 0.00000e+00 0.00000e+00 6.67433e+01 263.854 1.30736e+01 263.854 0.8329 
1 1 1 1   65  17 o 9  5.89351e+00 1.54582e+00 8.64687e+01 171.492 -7.11981e+00 1.06513e+00  0.00000e+00 0.00000e+00 1.16131e+02 171.492 2.96627e+01 171.492 0.9277 
1 1 1 1   66  0  f 0  8.92690e+00 3.97185e-01 1.82512e+02 223.796 -3.77440e+00 -3.61906e+00 0.00000e+00 0.00000e+00 1.17067e+02 223.796 6.54450e+01 43.796  0.8984 
1 1 1 1   66  1  o 14 2.06548e+01 4.05357e-01 2.96117e+02 12.099  1.98318e+01  4.25138e+00  0.00000e+00 0.00000e+00 4.56135e+02 12.099  1.60019e+02 12.099  0.9750 
1 1 1 1   66  2  o 4  1.42476e+01 3.81726e-01 2.78504e+02 45.216  1.00151e+01  1.00910e+01  0.00000e+00 0.00000e+00 2.34590e+02 45.216  4.39141e+01 225.216 0.9642 
1 1 1 1   66  3  o 7  2.41423e+00 6.75940e-01 5.92440e+01 172.870 -5.48032e-01 6.85528e-02  0.00000e+00 0.00000e+00 3.52486e+01 352.870 9.44926e+01 352.870 0.2661 
1 1 1 1   66  4  o 1  2.24266e+01 4.41801e-01 4.39173e+02 337.093 4.02198e+01  -1.69951e+01 0.00000e+00 0.00000e+00 3.88599e+02 337.093 5.05740e+01 157.093 0.9885 
1 1 1 1   66  5  o 3  2.31386e+01 5.22796e-01 4.45728e+02 353.523 4.84612e+01  -5.50137e+00 0.00000e+00 0.00000e+00 4.09173e+02 353.523 3.65552e+01 173.523 0.9897 
1 1 1 1   66  6  o 1  3.37548e+01 6.48473e-01 5.88882e+02 249.235 -3.97674e+01 -1.04884e+02 0.00000e+00 0.00000e+00 6.65241e+02 249.235 7.63589e+01 249.235 0.9955 
1 1 1 1   66  7  o 4  1.26102e+01 5.80651e-01 2.49620e+02 108.110 -6.89490e+00 2.10828e+01  0.00000e+00 0.00000e+00 2.10101e+02 108.110 3.95197e+01 288.110 0.9772 
1 1 1 1   66  8  o 16 1.20848e+01 6.03295e-01 2.13752e+02 32.613  1.70758e+01  1.09259e+01  0.00000e+00 0.00000e+00 2.25650e+02 32.613  1.18972e+01 32.613  0.9750 
1 1 1 1   66  9  o 7  9.69749e+00 5.69131e-01 2.27960e+02 65.689  8.76179e+00  1.93952e+01  0.00000e+00 0.00000e+00 1.24907e+02 65.689  1.03053e+02 245.689 0.9762 
1 1 1 1   66  10 o 15 2.59410e+00 7.63567e-01 8.58697e+01 167.037 -2.32408e+00 5.34986e-01  0.00000e+00 0.00000e+00 1.32090e+01 347.037 9.90787e+01 347.037 0.7519 
1 1 1 1   66  11 o 3  1.54077e+01 5.92261e-01 3.03921e+02 66.813  2.51710e+01  5.87644e+01  0.00000e+00 0.00000e+00 2.65224e+02 66.813  3.86966e+01 246.813 0.9921 
1 1 1 1   66  12 o 7  3.49742e+00 9.49627e-01 8.02885e+01 17.477  3.38956e+00  1.06724e+00  0.00000e+00 0.00000e+00 2.95202e+01 17.477  5.07682e+01 197.477 0.8439 
1 1 1 1   66  13 o 7  9.32632e+00 8.28905e-01 1.68131e+02 350.264 2.48814e+01  -4.26926e+00 0.00000e+00 0.00000e+00 1.71681e+02 350.264 3.55024e+00 350.264 0.9800 
1 1 1 1   66  14 o 6  6.50433e+00 1.15303e+00 8.25808e+01 109.814 -2.63817e+00 7.32203e+00  0.00000e+00 0.00000e+00 1.42954e+02 109.814 6.03731e+01 109.814 0.9334 
1 1 1 1   66  15 o 13 1.09219e+01 1.06747e+00 1.78367e+02 185.841 -3.18466e+01 -3.25813e+00 0.00000e+00 0.00000e+00 2.20663e+02 185.841 4.22960e+01 185.841 0.9843 
1 1 1 1   66  16 o 7  4.63414e+00 1.32676e+00 4.33802e+01 168.452 -3.06476e+00 6.26217e-01  0.00000e+00 0.00000e+00 9.73773e+01 168.452 5.39971e+01 168.452 0.8190 
1 1 1 1   66  17 o 5  4.43860e+00 1.33323e+00 3.86692e+01 26.941  2.84253e+00  1.44468e+00  0.00000e+00 0.00000e+00 9.66744e+01 26.941  5.80052e+01 26.941  0.8230 
1 1 1 1   67  0  o 11 1.42699e+01 3.76250e-01 2.25906e+02 285.022 2.99469e+00  -1.11588e+01 0.00000e+00 0.00000e+00 2.83405e+02 285.022 5.74992e+01 285.022 0.9557 
1 1 1 1   67  1  o 3  1.84534e+01 3.94587e-01 2.32937e+02 89.022  2.62155e-01  1.53574e+01  0.00000e+00 0.00000e+00 4.33401e+02 89.022  2.00465e+02 89.022  0.9669 
1 1 1 1   67  2  o 2  1.46375e+01 4.22334e-01 2.20833e+02 15.889  1.22679e+01  3.49210e+00  0.00000e+00 0.00000e+00 3.03910e+02 15.889  8.30767e+01 15.889  0.9600 
1 1 1 1   67  3  o 6  1.68083e+01 4.07300e-01 2.59619e+02 134.900 -1.33180e+01 1.33647e+01  0.00000e+00 0.00000e+00 3.51138e+02 134.900 9.15186e+01 134.900 0.9731 
1 1 1 1   67  4  o 15 1.72120e+01 4.74433e-01 2.54688e+02 217.852 -1.59649e+01 -1.24068e+01 0.00000e+00 0.00000e+00 3.71801e+02 217.852 1.17112e+02 217.852 0.9749 
1 1 1 1   67  5  o 19 1.34937e+01 4.88602e-01 3.74477e+02 314.323 1.93204e+01  -1.97823e+01 0.00000e+00 0.00000e+00 1.19979e+02 314.323 2.54499e+02 134.323 0.9817 
1 1 1 1   67  6  o 5  1.77491e+01 5.11059e-01 3.76659e+02 77.234  9.10785e+00  4.01995e+01  0.00000e+00 0.00000e+00 2.77545e+02 77.234  9.91145e+01 257.234 0.9878 
1 1 1 1   67  7  o 5  1.66125e+01 5.72616e-01 3.72585e+02 289.182 1.52172e+01  -4.37417e+01 0.00000e+00 0.00000e+00 2.40344e+02 289.182 1.32241e+02 109.182 0.9891 
1 1 1 1   67  8  o 1  6.46311e+00 7.76748e-01 1.23955e+02 98.492  -9.72604e-01 6.51410e+00  0.00000e+00 0.00000e+00 9.78881e+01 98.492  2.60670e+01 278.492 0.9206 
1 1 1 1   67  9  o 17 5.23060e+00 7.68803e-01 1.42418e+02 213.046 -5.80734e+00 -3.77793e+00 0.00000e+00 0.00000e+00 3.78364e+01 213.046 1.04582e+02 33.046  0.9247 
1 1 1 1   67  10 o 5  8.42254e+00 6.55553e-01 2.02014e+02 4.845   1.90386e+01  1.61389e+00  0.00000e+00 0.00000e+00 1.03377e+02 4.845   9.86364e+01 184.845 0.9735 
1 1 1 1   67  11 o 19 3.48491e+00 8.92759e-01 3.46483e+01 158.065 -1.40379e+00 5.65311e-01  0.00000e+00 0.00000e+00 4.31100e+01 158.065 8.46172e+00 158.065 0.5994 
1 1 1 1   67  12 o 18 4.22450e+00 1.00947e+00 1.10120e+02 295.473 2.70516e+00  -5.67825e+00 0.00000e+00 0.00000e+00 3.39301e+01 295.473 7.61902e+01 115.473 0.9166 
1 1 1 1   67  13 o 17 5.12970e+00 1.00447e+00 1.19317e+02 145.594 -7.55500e+00 5.17421e+00  0.00000e+00 0.00000e+00 6.06351e+01 145.594 5.86815e+01 325.594 0.9437 
1 1 1 1   67  14 o 1  4.77662e+00 1.16799e+00 1.40200e+02 249.916 -3.10198e+00 -8.48413e+00 0.00000e+00 0.00000e+00 2.70933e+01 249.916 1.13106e+02 69.916  0.9429 
1 1 1 1   67  15 o 5  4.58626e+00 1.28057e+00 1.04978e+02 120.574 -3.59409e+00 6.08347e+00  0.00000e+00 0.00000e+00 5.26787e+01 120.574 5.22989e+01 300.574 0.9263 
1 1 1 1   67  16 o 14 3.84872e+00 1.20561e+00 5.61997e+01 299.366 1.90441e+00  -3.38445e+00 0.00000e+00 0.00000e+00 6.63685e+01 299.366 1.01688e+01 299.366 0.8589 
1 1 1 1   67  17 o 12 5.17064e+00 1.44484e+00 4.17809e+01 233.832 -2.10239e+00 -2.87592e+00 0.00000e+00 0.00000e+00 1.19932e+02 233.832 7.81515e+01 233.832 0.8443 
1 1 1 1   68  0  o 6  1.81507e+01 3.90399e-01 2.94296e+02 327.031 1.77160e+01  -1.14912e+01 0.00000e+00 0.00000e+00 3.67183e+02 327.031 7.28864e+01 327.031 0.9760 
1 1 1 1   68  1  o 15 1.77842e+01 3.91551e-01 2.09663e+02 71.818  4.59125e+00  1.39791e+01  0.00000e+00 0.00000e+00 4.31408e+02 71.818  2.21745e+02 71.818  0.9654 
1 1 1 1   68  2  f 0  1.32181e+01 3.87284e-01 3.78484e+02 20.683  2.02919e+01  7.66060e+00  0.00000e+00 0.00000e+00 1.03529e+02 20.683  2.74955e+02 200.683 0.9767 
1 1 1 1   68  3  o 4  1.06290e+01 4.11284e-01 1.74864e+02 312.588 5.57645e+00  -6.06686e+00 0.00000e+00 0.00000e+00 1.97030e+02 312.588 2.21665e+01 312.588 0.9372 
1 1 1 1   68  4  o 8  1.96583e+01 4.90855e-01 3.14034e+02 38.421  2.29637e+01  1.82143e+01  0.00000e+00 0.00000e+00 4.07117e+02 38.421  9.30825e+01 38.421  0.9828 
1 1 1 1   68  5  f 0  2.14092e+01 5.13695e-01 4.94523e+02 302.806 3.43482e+01  -5.32852e+01 0.00000e+00 0.00000e+00 2.98099e+02 302.806 1.96424e+02 122.806 0.9921 
1 1 1 1   68  6  o 18 1.91165e+01 5.55272e-01 3.05764e+02 200.912 -3.40440e+01 -1.30084e+01 0.00000e+00 0.00000e+00 3.97559e+02 200.912 9.17942e+01 200.912 0.9862 
1 1 1 1   68  7  o 7  5.48608e+00 7.85207e-01 1.65038e+02 92.461  -2.73483e-01 6.36422e+00  0.00000e+00 0.00000e+00 2.27299e+01 92.461  1.42308e+02 272.461 0.9178 
1 1 1 1   68  8  o 15 8.82697e+00 6.60165e-01 1.40013e+02 272.730 5.28860e-01  -1.10889e+01 0.00000e+00 0.00000e+00 1.73849e+02 272.730 3.38357e+01 272.730 0.9538 
1 1 1 1   68  9  o 17 1.21302e+01 5.26233e-01 2.46806e+02 39.279  2.52544e+01  2.06550e+01  0.00000e+00 0.00000e+00 1.98186e+02 39.279  4.86197e+01 219.279 0.9846 
1 1 1 1   68  10 o 16 1.03188e+01 5.88486e-01 1.49962e+02 280.161 3.46290e+00  -1.93217e+01 0.00000e+00 0.00000e+00 2.24389e+02 280.161 7.44273e+01 280.161 0.9742 
1 1 1 1   68  11 o 7  1.08804e+01 6.73607e-01 1.35673e+02 85.831  1.46812e+00  2.01415e+01  0.00000e+00 0.00000e+00 2.59113e+02 85.831  1.23440e+02 85.831  0.9749 
1 1 1 1   68  12 o 17 6.54423e+00 9.43977e-01 9.13477e+01 222.567 -6.17689e+00 -5.67348e+00 0.00000e+00 0.00000e+00 1.37044e+02 222.567 4.56962e+01 222.567 0.9383 
1 1 1 1   68  13 o 14 8.24597e+00 9.42858e-01 1.34927e+02 309.757 1.11782e+01  -1.34369e+01 0.00000e+00 0.00000e+00 1.62643e+02 309.757 2.77168e+01 309.757 0.9710 
1 1 1 1   68  14 o 2  5.98469e+00 1.19824e+00 7.61355e+01 84.024  6.68666e-01  6.38731e+00  0.00000e+00 0.00000e+00 1.27994e+02 84.024  5.18588e+01 84.024  0.9185 
1 1 1 1   68  15 o 7  1.01516e+01 1.06019e+00 1.67460e+02 37.011  2.47027e+01  1.86220e+01  0.00000e+00 0.00000e+00 2.03081e+02 37.011  3.56209e+01 37.011  0.9837 
1 1 1 1   68  16 o 6  4.44594e+00 1.27175e+00 7.04049e+01 263.475 -6.16686e-01 -5.39165e+00 0.00000e+00 0.00000e+00 7.83320e+01 263.475 7.92708e+00 263.475 0.9024 
1 1 1 1   68  17 o 12 3.92671e+00 1.26345e+00 1.03470e+02 109.224 -2.55148e+00 7.31703e+00  0.00000e+00 0.00000e+00 3.22231e+01 109.224 7.12469e+01 289.224 0.9330 
1 1 1 1   69  0  o 9  1.15079e+01 3.93074e-01 1.67827e+02 154.483 -7.55219e+00 3.60495e+00  0.00000e+00 0.00000e+00 2.35235e+02 154.483 6.74086e+01 154.483 0.9382 
1 1 1 1   69  1  o 6  1.48354e+01 3.86558e-01 6.67584e+01 318.344 3.19841e+00  -2.84530e+00 0.00000e+00 0.00000e+00 4.17027e+02 318.344 3.50269e+02 318.344 0.8735 
1 1 1 1   69  2  o 10 8.16657e+00 4.42763e-01 9.37450e+01 48.977  2.22534e+00  2.55793e+00  0.00000e+00 0.00000e+00 1.60866e+02 48.977  6.71208e+01 48.977  0.8352 
1 1 1 1   69  3  o 5  9.51904e+00 4.99192e-01 1.59364e+02 149.697 -6.36931e+00 3.72233e+00  0.00000e+00 0.00000e+00 1.70903e+02 149.697 1.15394e+01 149.697 0.9295 
1 1 1 1   69  4  o 10 1.46248e+01 5.24344e-01 1.43353e+02 30.483  9.14603e+00  5.38385e+00  0.00000e+00 0.00000e+00 3.76055e+02 30.483  2.32702e+02 30.483  0.9517 
1 1 1 1   69  5  o 1  4.22655e+00 8.14055e-01 2.22838e+02 147.436 -4.40110e+00 2.81072e+00  0.00000e+00 0.00000e+00 8.11803e+01 327.436 3.04018e+02 327.436 0.8983 
1 1 1 1   69  6  o 14 8.55134e+00 6.31203e-01 8.10466e+01 223.623 -3.50809e+00 -3.34337e+00 0.00000e+00 0.00000e+00 2.02732e+02 223.623 1.21685e+02 223.623 0.8897 
1 1 1 1   69  7  f 0  1.13014e+01 5.89152e-01 2.06280e+02 223.172 -1.41763e+01 -1.32992e+01 0.00000e+00 0.00000e+00 2.04126e+02 223.172 2.15455e+00 43.172  0.9739 
1 1 1 1   69  8  o 19 3.50273e+00 8.12807e-01 5.03093e+00 287.350 4.53762e-02  -1.45236e-01 0.00000e+00 0.00000e+00 4.87268e+00 287.350 1.58253e-01 107.350 0.0759 
1 1 1 1   69  9  o 18 5.30189e+00 7.62450e-01 1.92060e+02 273.711 6.94552e-01  -1.07086e+01 0.00000e+00 0.00000e+00 3.98878e+00 93.711  1.96049e+02 93.711  0.9522 
1 1 1 1   69  10 o 2  2.02986e+01 5.57143e-01 3.45575e+02 121.260 -4.86481e+01 8.01366e+01  0.00000e+00 0.00000e+00 4.06159e+02 121.260 6.05840e+01 121.260 0.9947 
1 1 1 1   69  11 o 4  1.36065e+01 6.10304e-01 2.91377e+02 219.183 -4.22247e+01 -3.44172e+01 0.00000e+00 0.00000e+00 2.10262e+02 219.183 8.11152e+01 39.183  0.9908 
1 1 1 1   69  12 f 0  7.58216e+00 8.96427e-01 9.28504e+01 260.941 -1.58729e+00 -9.95552e+00 0.00000e+00 0.00000e+00 1.74728e+02 260.941 8.18776e+01 260.941 0.9490 
1 1 1 1   69  13 o 14 3.08981e+00 9.39666e-01 3.53793e+01 38.567  1.33819e+00  1.06702e+00  0.00000e+00 0.00000e+00 3.85889e+01 38.567  3.20966e+00 38.567  0.6442 
1 1 1 1   69  14 o 18 5.54389e+00 1.20134e+00 8.91069e+01 122.460 -3.89211e+00 6.11889e+00  0.00000e+00 0.00000e+00 1.01967e+02 122.460 1.28597e+01 122.460 0.9282 
1 1 1 1   69  15 o 7  5.77466e+00 1.35227e+00 9.48353e+01 155.504 -7.05301e+00 3.21367e+00  0.00000e+00 0.00000e+00 1.05056e+02 155.504 1.02209e+01 155.504 0.9331 
1 1 1 1   69  16 o 5  3.40611e+00 1.05420e+00 8.16558e+01 204.694 -5.42621e+00 -2.49513e+00 0.00000e+00 0.00000e+00 3.34726e+01 204.694 4.81831e+01 24.694  0.9119 
1 1 1 1   69  17 o 15 4.44418e+00 1.37544e+00 7.92241e+01 204.448 -5.82716e+00 -2.64917e+00 0.00000e+00 0.00000e+00 7.18739e+01 204.448 7.35023e+00 24.448  0.9182 
1 1 1 1   70  0  o 17 1.17176e+01 3.90727e-01 2.15677e+02 18.986  1.06183e+01  3.65316e+00  0.00000e+00 0.00000e+00 2.01728e+02 18.986  1.39497e+01 198.985 0.9544 
1 1 1 1   70  1  o 3  1.86976e+01 4.00989e-01 3.09266e+02 283.776 6.10430e+00  -2.48967e+01 0.00000e+00 0.00000e+00 3.74874e+02 283.776 6.56080e+01 283.776 0.9803 
1 1 1 1   70  2  o 16 2.05824e+01 4.18122e-01 3.41824e+02 330.655 2.83682e+01  -1.59485e+01 0.00000e+00 0.00000e+00 4.14480e+02 330.655 7.26560e+01 330.655 0.9845 
1 1 1 1   70  3  o 6  7.60594e+00 5.49714e-01 8.96099e+01 27.819  2.83807e+00  1.49754e+00  0.00000e+00 0.00000e+00 1.44370e+02 27.819  5.47602e+01 27.819  0.8243 
1 1 1 1   70  4  o 3  1.58250e+01 5.35510e-01 2.39181e+02 354.022 2.24954e+01  -2.35544e+00 0.00000e+00 0.00000e+00 3.38085e+02 354.022 9.89037e+01 354.022 0.9776 
1 1 1 1   70  5  o 2  2.05996e+01 5.15917e-01 4.08896e+02 196.927 -4.95065e+01 -1.50666e+01 0.00000e+00 0.00000e+00 3.52087e+02 196.927 5.68091e+01 16.927  0.9903 
1 1 1 1   70  6  o 8  3.19976e+00 8.14431e-01 1.01875e+02 30.322  2.01133e+00  1.17636e+00  0.00000e+00 0.00000e+00 1.29547e+01 210.322 1.14830e+02 210.322 0.7452 
1 1 1 1   70  7  o 13 9.09812e+00 6.31380e-01 2.03575e+02 166.438 -1.53224e+01 3.69613e+00  0.00000e+00 0.00000e+00 1.24656e+02 166.438 7.89197e+01 346.438 0.9677 
1 1 1 1   70  8  o 2  1.63955e+01 5.02213e-01 2.52848e+02 326.636 3.37590e+01  -2.22297e+01 0.00000e+00 0.00000e+00 3.50508e+02 326.636 9.76606e+01 326.636 0.9876 
1 1 1 1   70  9  o 14 1.95731e+01 5.32103e-01 3.27393e+02 138.219 -5.45082e+01 4.87042e+01  0.00000e+00 0.00000e+00 3.96624e+02 138.219 6.92307e+01 138.219 0.9931 
1 1 1 1   70  10 o 4  3.20344e+00 8.22114e-01 6.75849e+01 126.293 -1.48105e+00 2.01673e+00  0.00000e+00 0.00000e+00 2.36695e+01 126.293 4.39155e+01 306.293 0.7652 
1 1 1 1   70  11 o 2  7.13809e+00 8.11699e-01 1.25291e+02 334.429 1.12843e+01  -5.39937e+00 0.00000e+00 0.00000e+00 1.29426e+02 334.429 4.13519e+00 334.429 0.9592 
1 1 1 1   70  12 o 9  4.63536e+00 9.72064e-01 1.57195e+02 192.027 -9.82103e+00 -2.09229e+00 0.00000e+00 0.00000e+00 6.32205e+00 192.027 1.50873e+02 12.027  0.9488 
1 1 1 1   70  13 o 17 4.07488e+00 1.00143e+00 1.99104e+01 155.233 -1.08005e+00 4.98307e-01  0.00000e+00 0.00000e+00 5.72237e+01 155.233 3.73133e+01 155.233 0.5095 
1 1 1 1   70  14 o 10 5.09907e+00 1.22331e+00 4.80227e+01 327.684 2.91897e+00  -1.84643e+00 0.00000e+00 0.00000e+00 1.10729e+02 327.684 6.27065e+01 327.684 0.8387 
1 1 1 1   70  15 o 4  1.01223e+01 1.17568e+00 1.77909e+02 288.482 9.65480e+00  -2.88860e+01 0.00000e+00 0.00000e+00 1.91327e+02 288.482 1.34187e+01 288.482 0.9834 
1 1 1 1   70  16 o 13 5.43824e+00 1.38933e+00 8.71800e+01 75.159  1.95070e+00  7.36190e+00  0.00000e+00 0.00000e+00 1.00611e+02 75.159  1.34305e+01 75.159  0.9318 
1 1 1 1   70  17 o 6  5.49365e+00 1.51809e+00 9.60275e+01 245.979 -3.49014e+00 -7.83121e+00 0.00000e+00 0.00000e+00 9.51015e+01 245.979 9.26078e-01 65.979  0.9397 
1 1 1 1   71  0  o 19 2.67098e+01 4.62983e-01 3.80445e+02 338.168 4.34655e+01  -1.74132e+01 0.00000e+00 0.00000e+00 6.05600e+02 338.168 2.25154e+02 338.168 0.9893 
1 1 1 1   71  1  o 13 1.10640e+01 4.00754e-01 3.24730e+02 166.534 -1.71142e+01 4.09810e+00  0.00000e+00 0.00000e+00 7.62485e+01 166.534 2.48481e+02 346.534 0.9712 
1 1 1 1   71  2  o 13 1.47379e+01 4.57064e-01 2.70150e+02 195.821 -1.82056e+01 -5.15882e+00 0.00000e+00 0.00000e+00 2.65076e+02 195.821 5.07478e+00 15.821  0.9732 
1 1 1 1   71  3  o 9  1.66560e+01 4.68731e-01 3.58230e+02 94.123  -2.34708e+00 3.25628e+01  0.00000e+00 0.00000e+00 2.53642e+02 94.123  1.04588e+02 274.123 0.9846 
1 1 1 1   71  4  o 16 1.05905e+01 5.57529e-01 2.71930e+02 11.413  1.62468e+01  3.27979e+00  0.00000e+00 0.00000e+00 1.11042e+02 11.413  1.60887e+02 191.413 0.9693 
1 1 1 1   71  5  o 6  1.47175e+01 5.45885e-01 2.41341e+02 24.623  2.21366e+01  1.01456e+01  0.00000e+00 0.00000e+00 2.96179e+02 24.623  5.48378e+01 24.623  0.9792 
1 1 1 1   71  6  o 7  1.65051e+01 5.42488e-01 2.36603e+02 155.184 -2.60336e+01 1.20381e+01  0.00000e+00 0.00000e+00 3.67974e+02 155.184 1.31371e+02 155.184 0.9824 
1 1 1 1   71  7  o 16 8.81391e+00 5.79728e-01 1.89214e+02 30.166  1.25125e+01  7.27251e+00  0.00000e+00 0.00000e+00 1.27740e+02 30.166  6.14740e+01 210.166 0.9648 
1 1 1 1   71  8  o 6  1.74891e+01 5.04583e-01 2.83289e+02 112.493 -1.87093e+01 4.51840e+01  0.00000e+00 0.00000e+00 3.61599e+02 112.493 7.83095e+01 112.493 0.9897 
1 1 1 1   71  9  o 7  9.40146e+00 5.63749e-01 2.10690e+02 154.083 -1.88341e+01 9.15232e+00  0.00000e+00 0.00000e+00 1.30945e+02 154.083 7.97459e+01 334.083 0.9758 
1 1 1 1   71  10 o 13 1.23963e+01 5.84947e-01 1.55564e+02 5.498   2.62458e+01  2.52621e+00  0.00000e+00 0.00000e+00 2.96974e+02 5.498   1.41410e+02 5.498   0.9808 
1 1 1 1   71  11 o 5  6.55905e+00 8.56619e-01 1.11456e+02 150.955 -8.55643e+00 4.75162e+00  0.00000e+00 0.00000e+00 1.19695e+02 150.955 8.23849e+00 150.955 0.9474 
1 1 1 1   71  12 o 15 5.66818e+00 9.68284e-01 7.39882e+01 316.928 4.12097e+00  -3.85260e+00 0.00000e+00 0.00000e+00 1.16987e+02 316.928 4.29985e+01 316.928 0.9064 
1 1 1 1   71  13 o 15 9.05254e+00 9.07686e-01 1.76765e+02 119.722 -1.32143e+01 2.31463e+01  0.00000e+00 0.00000e+00 1.53121e+02 119.722 2.36434e+01 299.722 0.9811 
1 1 1 1   71  14 o 18 7.72377e+00 1.15106e+00 1.44713e+02 292.208 6.41750e+00  -1.57192e+01 0.00000e+00 0.00000e+00 1.33385e+02 292.208 1.13281e+01 112.208 0.9701 
1 1 1 1   71  15 o 12 9.24957e+00 1.17514e+00 7.42968e+01 53.601  6.87767e+00  9.32903e+00  0.00000e+00 0.00000e+00 2.53568e+02 53.601  1.79272e+02 53.601  0.9558 
1 1 1 1   71  16 o 5  5.99622e+00 1.46535e+00 7.82889e+01 65.559  2.90822e+00  6.39910e+00  0.00000e+00 0.00000e+00 1.27403e+02 65.559  4.91140e+01 65.559  0.9259 
1 1 1 1   71  17 o 3  3.14156e+00 1.05043e+00 4.84425e+01 143.187 -3.12195e+00 2.33663e+00  0.00000e+00 0.00000e+00 5.15094e+01 143.187 3.06691e+00 143.187 0.8595 
1 1 1 1   72  0  o 3  1.71626e+01 3.97315e-01 3.41667e+02 189.108 -2.76271e+01 -4.42922e+00 0.00000e+00 0.00000e+00 2.87125e+02 189.108 5.45429e+01 9.108   0.9820 
1 1 1 1   72  1  o 12 1.87119e+00 5.93086e-01 7.52718e+01 48.417  4.71552e-01  5.31446e-01  0.00000e+00 0.00000e+00 5.19141e+01 228.417 1.27186e+02 228.417 0.3346 
1 1 1 1   72  2  o 10 1.20333e+01 4.64955e-01 2.07408e+02 103.677 -3.23296e+00 1.32855e+01  0.00000e+00 0.00000e+00 2.24795e+02 103.677 1.73869e+01 103.677 0.9627 
1 1 1 1   72  3  o 16 2.23685e+01 5.06927e-01 4.19233e+02 26.242  4.83850e+01  2.38522e+01  0.00000e+00 0.00000e+00 4.07441e+02 26.242  1.17914e+01 206.242 0.9907 
1 1 1 1   72  4  o 5  1.76638e+01 4.96110e-01 3.51300e+02 14.648  3.69739e+01  9.66391e+00  0.00000e+00 0.00000e+00 2.98847e+02 14.648  5.24525e+01 194.648 0.9868 
1 1 1 1   72  5  o 12 8.66634e+00 5.30832e-01 1.21198e+02 216.657 -6.31325e+00 -4.69840e+00 0.00000e+00 0.00000e+00 1.80673e+02 216.657 5.94755e+01 216.657 0.9341 
1 1 1 1   72  6  o 17 1.50040e+01 5.45885e-01 2.52712e+02 141.592 -2.49516e+01 1.97824e+01  0.00000e+00 0.00000e+00 2.97756e+02 141.592 4.50440e+01 141.592 0.9842 
1 1 1 1   72  7  o 14 7.54638e+00 5.62419e-01 1.28943e+02 201.119 -8.30089e+00 -3.20625e+00 0.00000e+00 0.00000e+00 1.35966e+02 201.119 7.02299e+00 201.119 0.9420 
1 1 1 1   72  8  o 9  9.21617e+00 5.52453e-01 1.37811e+02 37.214  1.07763e+01  8.18382e+00  0.00000e+00 0.00000e+00 1.92546e+02 37.214  5.47351e+01 37.214  0.9623 
1 1 1 1   72  9  o 14 9.35127e+00 5.63454e-01 1.19316e+02 259.651 -2.41997e+00 -1.32515e+01 0.00000e+00 0.00000e+00 2.15663e+02 259.651 9.63468e+01 259.651 0.9621 
1 1 1 1   72  10 o 11 9.06130e+00 6.21232e-01 1.58712e+02 272.476 8.60499e-01  -1.98990e+01 0.00000e+00 0.00000e+00 1.69896e+02 272.476 1.11842e+01 272.476 0.9746 
1 1 1 1   72  11 o 13 1.16449e+01 6.61390e-01 2.18936e+02 140.390 -3.19026e+01 2.64016e+01  0.00000e+00 0.00000e+00 2.08865e+02 140.390 1.00712e+01 320.390 0.9879 
1 1 1 1   72  12 o 11 4.25025e+00 9.72399e-01 1.17386e+02 152.816 -6.17463e+00 3.17115e+00  0.00000e+00 0.00000e+00 2.87051e+01 152.816 8.86809e+01 332.816 0.9249 
1 1 1 1   72  13 o 2  3.73813e+00 1.01653e+00 9.34504e+01 315.974 3.87437e+00  -3.74487e+00 0.00000e+00 0.00000e+00 3.17246e+01 315.974 6.17258e+01 135.974 0.9017 
1 1 1 1   72  14 o 6  6.22455e+00 1.26626e+00 1.53681e+02 300.883 6.98427e+00  -1.16778e+01 0.00000e+00 0.00000e+00 6.86452e+01 300.883 8.50361e+01 120.883 0.9625 
1 1 1 1   72  15 o 19 3.24801e+00 1.05452e+00 1.78160e+01 58.266  5.49170e-01  8.87994e-01  0.00000e+00 0.00000e+00 3.77964e+01 58.266  1.99804e+01 58.266  0.4618 
1 1 1 1   72  16 o 2  5.81889e+00 1.44365e+00 1.11112e+02 237.945 -5.19428e+00 -8.29471e+00 0.00000e+00 0.00000e+00 9.31116e+01 237.945 1.80003e+01 57.945  0.9474 
1 1 1 1   72  17 o 13 5.20299e+00 1.47224e+00 8.41706e+01 165.514 -7.04781e+00 1.82085e+00  0.00000e+00 0.00000e+00 9.46171e+01 165.514 1.04464e+01 165.514 0.9285 
1 1 1 1   73  0  o 5  1.54424e+01 3.95979e-01 2.18922e+02 119.976 -9.30459e+00 1.61319e+01  0.00000e+00 0.00000e+00 3.41439e+02 119.976 1.22516e+02 119.976 0.9728 
1 1 1 1   73  1  o 12 2.38150e+01 5.13241e-01 4.60053e+02 216.409 -4.79619e+01 -3.53722e+01 0.00000e+00 0.00000e+00 4.20836e+02 216.409 3.92172e+01 36.409  0.9916 
1 1 1 1   73  2  o 12 2.67263e+00 7.38126e-01 1.26867e+02 236.681 -1.07965e+00 -1.64243e+00 0.00000e+00 0.00000e+00 5.78769e+01 56.681  1.84744e+02 56.681  0.6920 
1 1 1 1   73  3  o 6  2.10349e+01 5.02623e-01 2.94247e+02 347.429 3.48986e+01  -7.78234e+00 0.00000e+00 0.00000e+00 4.79245e+02 347.429 1.84997e+02 347.429 0.9859 
1 1 1 1   73  4  o 18 6.55771e+00 6.82977e-01 2.00822e+02 257.268 -1.94771e+00 -8.62035e+00 0.00000e+00 0.00000e+00 2.94376e+01 257.268 1.71384e+02 77.268  0.9416 
1 1 1 1   73  5  o 4  1.24500e+01 5.06636e-01 2.28420e+02 119.956 -1.07015e+01 1.85683e+01  0.00000e+00 0.00000e+00 2.24777e+02 119.956 3.64268e+00 299.956 0.9764 
1 1 1 1   73  6  o 19 1.16452e+01 4.93407e-01 2.11860e+02 171.385 -2.12676e+01 3.22215e+00  0.00000e+00 0.00000e+00 2.11953e+02 171.385 9.31613e-02 171.385 0.9765 
1 1 1 1   73  7  o 13 7.20684e+00 5.74124e-01 1.14060e+02 348.772 7.76537e+00  -1.54147e+00 0.00000e+00 0.00000e+00 1.36869e+02 348.772 2.28084e+01 348.772 0.9345 
1 1 1 1   73  8  o 4  1.14827e+01 5.22967e-01 2.68473e+02 149.153 -2.96582e+01 1.77127e+01  0.00000e+00 0.00000e+00 1.52928e+02 149.153 1.15545e+02 329.153 0.9854 
1 1 1 1   73  9  o 8  6.35948e+00 6.75971e-01 1.15311e+02 8.778   9.35217e+00  1.44414e+00  0.00000e+00 0.00000e+00 1.08534e+02 8.778   6.77702e+00 188.778 0.9456 
1 1 1 1   73  10 o 8  1.48008e+01 5.74462e-01 2.13708e+02 152.305 -4.11344e+01 2.15915e+01  0.00000e+00 0.00000e+00 3.30981e+02 152.305 1.17273e+02 152.305 0.9892 
1 1 1 1   73  11 o 9  3.92464e+00 9.52894e-01 2.31862e+01 89.152  1.88094e-02  1.27152e+00  0.00000e+00 0.00000e+00 5.47986e+01 89.152  3.16124e+01 89.152  0.5344 
1 1 1 1   73  12 o 19 5.98744e+00 9.62238e-01 9.95420e+01 15.597  8.78204e+00  2.45153e+00  0.00000e+00 0.00000e+00 1.10354e+02 15.597  1.08119e+01 15.597  0.9435 
1 1 1 1   73  13 o 4  3.31331e+00 9.89928e-01 3.79905e+00 337.955 1.74214e-01  -7.05476e-02 0.00000e+00 0.00000e+00 7.71173e+00 337.955 3.91268e+00 337.955 0.0936 
1 1 1 1   73  14 o 3  5.22375e+00 1.21763e+00 1.04094e+02 226.403 -5.78678e+00 -6.07742e+00 0.00000e+00 0.00000e+00 7.77692e+01 226.403 2.63252e+01 46.403  0.9384 
1 1 1 1   73  15 o 14 5.83784e+00 1.30987e+00 1.16431e+02 83.477  1.21739e+00  1.06475e+01  0.00000e+00 0.00000e+00 8.96177e+01 83.477  2.68134e+01 263.477 0.9521 
1 1 1 1   73  16 o 13 5.75428e+00 1.43712e+00 1.11713e+02 307.897 6.20979e+00  -7.97769e+00 0.00000e+00 0.00000e+00 9.05710e+01 307.897 2.11423e+01 127.897 0.9492 
1 1 1 1   73  17 o 6  3.64239e+00 1.18993e+00 4.81838e+01 183.259 -4.04558e+00 -2.30359e-01 0.00000e+00 0.00000e+00 6.84589e+01 183.259 2.02751e+01 183.259 0.8655 
1 1 1 1   74  0  f 0  1.48326e+01 4.67102e-01 1.87694e+02 193.454 -1.56426e+01 -3.74210e+00 0.00000e+00 0.00000e+00 3.48008e+02 193.454 1.60315e+02 193.454 0.9684 
1 1 1 1   74  1  o 15 1.29053e+01 4.72642e-01 1.23723e+02 225.267 -6.47605e+00 -6.53674e+00 0.00000e+00 0.00000e+00 3.30628e+02 225.267 2.06905e+02 225.267 0.9440 
1 1 1 1   74  2  f 0  1.92736e+01 4.84983e-01 2.95846e+02 188.057 -3.26931e+01 -4.62806e+00 0.00000e+00 0.00000e+00 4.11969e+02 188.057 1.16122e+02 188.057 0.9847 
1 1 1 1   74  3  o 2  3.09124e+01 5.22049e-01 5.11322e+02 326.272 8.23362e+01  -5.49705e+01 0.00000e+00 0.00000e+00 6.35553e+02 326.272 1.24231e+02 326.272 0.9949 
1 1 1 1   74  4  o 14 2.92434e+00 7.06982e-01 6.10590e+01 189.945 -1.27849e+00 -2.24168e-01 0.00000e+00 0.00000e+00 1.95574e+00 9.945   6.30147e+01 9.945   0.5421 
1 1 1 1   74  5  o 7  8.24738e+00 5.52330e-01 1.19219e+02 193.160 -7.41172e+00 -1.73289e+00 0.00000e+00 0.00000e+00 1.67227e+02 193.160 4.80080e+01 193.160 0.9318 
1 1 1 1   74  6  o 15 8.13939e+00 6.35999e-01 1.64729e+02 22.104  1.06528e+01  4.32645e+00  0.00000e+00 0.00000e+00 1.25067e+02 22.104  3.96616e+01 202.104 0.9555 
1 1 1 1   74  7  o 6  2.23272e+01 5.15364e-01 3.81384e+02 70.757  2.76019e+01  7.90725e+01  0.00000e+00 0.00000e+00 4.45326e+02 70.757  6.39424e+01 70.757  0.9940 
1 1 1 1   74  8  o 13 8.29343e+00 5.73959e-01 1.51179e+02 307.111 8.53490e+00  -1.12805e+01 0.00000e+00 0.00000e+00 1.46499e+02 307.111 4.68097e+00 127.111 0.9640 
1 1 1 1   74  9  o 11 5.70370e+00 7.37548e-01 8.46331e+01 278.795 9.29006e-01  -6.00464e+00 0.00000e+00 0.00000e+00 1.09283e+02 278.795 2.46501e+01 278.795 0.9135 
1 1 1 1   74  10 o 8  1.22004e+01 6.01405e-01 1.67450e+02 205.400 -2.63785e+01 -1.25256e+01 0.00000e+00 0.00000e+00 2.78522e+02 205.400 1.11072e+02 205.400 0.9827 
1 1 1 1   74  11 o 9  2.82209e+00 8.67913e-01 7.86030e+01 112.120 -1.21265e+00 2.98336e+00  0.00000e+00 0.00000e+00 7.95154e+00 112.120 7.06514e+01 292.120 0.8250 
1 1 1 1   74  12 o 13 4.46620e+00 1.01103e+00 4.80620e+01 90.444  -2.51366e-02 3.24195e+00  0.00000e+00 0.00000e+00 8.90523e+01 90.444  4.09903e+01 90.444  0.8264 
1 1 1 1   74  13 o 6  2.28472e+00 7.81694e-01 5.59740e+01 265.678 -1.73235e-01 -2.29208e+00 0.00000e+00 0.00000e+00 6.89073e+00 265.678 4.90833e+01 85.678  0.7412 
1 1 1 1   74  14 o 11 4.65458e+00 1.20242e+00 8.92205e+01 303.976 3.66005e+00  -5.43123e+00 0.00000e+00 0.00000e+00 6.96443e+01 303.976 1.95762e+01 123.976 0.9201 
1 1 1 1   74  15 o 12 4.65808e+00 1.28634e+00 8.43646e+01 214.254 -5.46602e+00 -3.72220e+00 0.00000e+00 0.00000e+00 7.46254e+01 214.254 9.73917e+00 34.254  0.9209 
1 1 1 1   74  16 o 2  4.71552e+00 1.34789e+00 2.52035e+01 257.079 -4.86791e-01 -2.12197e+00 0.00000e+00 0.00000e+00 1.01356e+02 257.079 7.61523e+01 257.079 0.7248 
1 1 1 1   74  17 o 16 3.06559e+00 1.05732e+00 2.59782e+01 342.240 2.04852e+00  -6.56110e-01 0.00000e+00 0.00000e+00 5.57955e+01 342.240 2.98173e+01 342.240 0.7211 
1 1 1 1   75  0  o 11 2.96937e+00 8.15404e-01 8.94018e+01 223.737 -1.06079e+00 -1.01503e+00 0.00000e+00 0.00000e+00 2.42790e+01 43.737  1.13681e+02 43.737  0.5882 
1 1 1 1   75  1  o 10 1.59564e+01 5.84806e-01 2.39150e+02 122.743 -1.25980e+01 1.95910e+01  0.00000e+00 0.00000e+00 3.42918e+02 122.743 1.03767e+02 122.743 0.9783 
1 1 1 1   75  2  o 15 3.13206e+01 6.00411e-01 5.39151e+02 264.701 -9.67276e+00 -1.04299e+02 0.00000e+00 0.00000e+00 6.23085e+02 264.701 8.39342e+01 264.701 0.9952 
1 1 1 1   75  3  o 3  5.39236e+00 6.68328e-01 1.35192e+02 137.949 -3.76071e+00 3.39218e+00  0.00000e+00 0.00000e+00 4.47089e+01 137.949 9.04829e+01 317.949 0.8949 
1 1 1 1   75  4  o 3  1.12873e+01 4.93368e-01 8.11286e+01 346.879 6.61281e+00  -1.54144e+00 0.00000e+00 0.00000e+00 3.07261e+02 346.879 2.26132e+02 346.879 0.9231 
1 1 1 1   75  5  o 10 1.59978e+01 4.95915e-01 3.05153e+02 306.275 2.30330e+01  -3.13843e+01 0.00000e+00 0.00000e+00 2.83326e+02 306.275 2.18275e+01 126.275 0.9871 
1 1 1 1   75  6  o 13 1.30671e+01 5.59455e-01 2.37092e+02 56.546  1.56124e+01  2.36286e+01  0.00000e+00 0.00000e+00 2.41057e+02 56.546  3.96414e+00 56.546  0.9822 
1 1 1 1   75  7  o 10 6.65816e+00 6.24917e-01 1.84635e+02 120.662 -6.68050e+00 1.12683e+01  0.00000e+00 0.00000e+00 5.36703e+01 120.662 1.30964e+02 300.662 0.9610 
1 1 1 1   75  8  o 6  1.00442e+01 5.38825e-01 1.91070e+02 204.048 -2.02717e+01 -9.04586e+00 0.00000e+00 0.00000e+00 1.74323e+02 204.048 1.67471e+01 24.048  0.9772 
1 1 1 1   75  9  o 10 5.90239e+00 7.40849e-01 6.36387e+01 354.502 4.85868e+00  -4.67628e-01 0.00000e+00 0.00000e+00 1.31946e+02 354.502 6.83075e+01 354.502 0.8906 
1 1 1 1   75  10 o 12 2.56373e+00 7.76489e-01 7.05931e+01 151.558 -2.25590e+00 1.22191e+00  0.00000e+00 0.00000e+00 3.00592e+00 151.558 6.75872e+01 331.558 0.7719 
1 1 1 1   75  11 o 1  1.01766e+01 7.00514e-01 1.83022e+02 75.890  7.08162e+00  2.81721e+01  0.00000e+00 0.00000e+00 1.88640e+02 75.890  5.61833e+00 75.890  0.9826 
1 1 1 1   75  12 o 14 6.49011e+00 9.98606e-01 1.11101e+02 286.295 3.12724e+00  -1.06978e+01 0.00000e+00 0.00000e+00 1.18872e+02 286.295 7.77062e+00 286.295 0.9540 
1 1 1 1   75  13 o 17 4.45489e+00 1.15138e+00 1.28368e+02 179.881 -8.67146e+00 1.80014e-02  0.00000e+00 0.00000e+00 2.71272e+01 179.881 1.01241e+02 359.881 0.9404 
1 1 1 1   75  14 o 12 2.90868e+00 9.53096e-01 2.36204e+01 249.226 -4.55340e-01 -1.20034e+00 0.00000e+00 0.00000e+00 3.44117e+01 249.226 1.07912e+01 249.226 0.5380 
1 1 1 1   75  15 o 16 1.00609e+01 1.15960e+00 1.79396e+02 13.432  3.33503e+01  7.96458e+00  0.00000e+00 0.00000e+00 1.87929e+02 13.432  8.53278e+00 13.432  0.9853 
1 1 1 1   75  16 o 3  4.56818e+00 1.34331e+00 1.05131e+02 148.929 -7.20065e+00 4.33867e+00  0.00000e+00 0.00000e+00 5.35850e+01 148.929 5.15463e+01 328.929 0.9385 
1 1 1 1   75  17 o 9  3.19314e+00 1.09161e+00 6.09023e+01 293.465 1.96486e+00  -4.52643e+00 0.00000e+00 0.00000e+00 4.44234e+01 293.465 1.64789e+01 113.465 0.8918 
1 1 1 1   76  0  o 8  1.04633e+01 6.11426e-01 1.57280e+02 341.483 9.65666e+00  -3.23429e+00 0.00000e+00 0.00000e+00 2.13114e+02 341.483 5.58339e+01 341.483 0.9496 
1 1 1 1   76  1  f 0  2.04644e+01 6.15027e-01 2.93949e+02 77.248  9.02483e+00  3.98772e+01  0.00000e+00 0.00000e+00 4.59582e+02 77.248  1.65633e+02 77.248  0.9877 
1 1 1 1   76  2  o 12 1.29143e+01 4.51474e-01 2.88912e+02 265.424 -2.13600e+00 -2.66872e+01 0.00000e+00 0.00000e+00 1.83436e+02 265.424 1.05476e+02 85.424  0.9811 
1 1 1 1   76  3  o 1  3.03908e+00 7.31014e-01 1.66859e+02 217.596 -2.92038e+00 -2.24869e+00 0.00000e+00 0.00000e+00 7.05427e+01 37.596  2.37401e+02 37.596  0.8503 
1 1 1 1   76  4  o 17 1.24860e+01 4.88911e-01 1.92848e+02 28.860  1.64734e+01  9.07881e+00  0.00000e+00 0.00000e+00 2.59932e+02 28.860  6.70838e+01 28.860  0.9730 
1 1 1 1   76  5  o 1  1.22186e+01 4.27696e-01 1.81150e+02 158.022 -1.82837e+01 7.37885e+00  0.00000e+00 0.00000e+00 2.62402e+02 158.022 8.12520e+01 158.022 0.9743 
1 1 1 1   76  6  o 7  6.38801e+00 7.01729e-01 1.59378e+02 181.828 -9.51057e+00 -3.03563e-01 0.00000e+00 0.00000e+00 6.56893e+01 181.828 9.36888e+01 1.828   0.9459 
1 1 1 1   76  7  o 19 1.10802e+01 5.07599e-01 1.57124e+02 341.584 1.85850e+01  -6.18829e+00 0.00000e+00 0.00000e+00 2.44770e+02 341.584 8.76460e+01 341.584 0.9741 
1 1 1 1   76  8  o 7  6.81341e+00 6.39844e-01 1.50503e+02 236.258 -7.11598e+00 -1.06529e+01 0.00000e+00 0.00000e+00 9.29781e+01 236.258 5.75253e+01 56.258  0.9601 
1 1 1 1   76  9  o 11 7.07536e+00 6.66757e-01 1.22159e+02 43.471  8.55960e+00  8.11464e+00  0.00000e+00 0.00000e+00 1.29636e+02 43.471  7.47689e+00 43.471  0.9566 
1 1 1 1   76  10 f 0  5.49610e+00 8.61141e-01 9.96195e+01 323.417 5.77787e+00  -4.28830e+00 0.00000e+00 0.00000e+00 8.99479e+01 323.417 9.67159e+00 143.417 0.9277 
1 1 1 1   76  11 o 12 5.51690e+00 9.22499e-01 6.45154e+01 178.369 -4.89070e+00 1.39271e-01  0.00000e+00 0.00000e+00 1.18107e+02 178.369 5.35916e+01 178.369 0.8908 
1 1 1 1   76  12 o 13 3.94468e+00 1.01342e+00 8.29697e+01 7.667   5.08996e+00  6.85236e-01  0.00000e+00 0.00000e+00 4.83435e+01 7.667   3.46262e+01 187.667 0.8964 
1 1 1 1   76  13 o 3  1.01789e+01 8.98127e-01 1.55170e+02 180.356 -2.71727e+01 -1.68757e-01 0.00000e+00 0.00000e+00 2.15525e+02 180.356 6.03555e+01 180.356 0.9814 
1 1 1 1   76  14 o 1  8.76020e+00 1.19840e+00 8.32336e+01 54.510  6.63225e+00  9.30160e+00  0.00000e+00 0.00000e+00 2.27021e+02 54.510  1.43787e+02 54.510  0.9552 
1 1 1 1   76  15 o 18 4.81504e+00 1.30233e+00 1.20073e+02 260.218 -1.71057e+00 -9.92137e+00 0.00000e+00 0.00000e+00 4.92044e+01 260.218 7.08687e+01 80.218  0.9490 
1 1 1 1   76  16 o 2  5.51951e+00 1.43791e+00 9.77738e+01 68.077  3.46029e+00  8.59789e+00  0.00000e+00 0.00000e+00 9.51638e+01 68.077  2.61007e+00 248.077 0.9444 
1 1 1 1   77  0  o 1  5.17089e+00 8.41359e-01 4.86305e+01 77.676  3.60516e-01  1.65021e+00  0.00000e+00 0.00000e+00 7.46264e+01 77.676  2.59959e+01 77.676  0.6395 
1 1 1 1   77  1  o 10 1.39391e+01 5.92545e-01 1.99542e+02 281.835 4.00569e+00  -1.91154e+01 0.00000e+00 0.00000e+00 3.06522e+02 281.835 1.06980e+02 281.835 0.9741 
1 1 1 1   77  2  o 5  2.81587e+01 7.08309e-01 5.41380e+02 185.957 -1.10723e+02 -1.15541e+01 0.00000e+00 0.00000e+00 5.03387e+02 185.957 3.79926e+01 5.957   0.9955 
1 1 1 1   77  3  o 13 3.19817e+01 6.19178e-01 5.05770e+02 89.448  1.13019e+00  1.17214e+02  0.00000e+00 0.00000e+00 6.80979e+02 89.448  1.75209e+02 89.448  0.9957 
1 1 1 1   77  4  o 16 4.70264e+00 7.25591e-01 1.63995e+02 198.458 -5.59592e+00 -1.86782e+00 0.00000e+00 0.00000e+00 4.41050e+00 18.458  1.68406e+02 18.458  0.9108 
1 1 1 1   77  5  o 6  5.89463e+00 5.63484e-01 8.61831e+01 257.901 -9.74036e-01 -4.54381e+00 0.00000e+00 0.00000e+00 1.08037e+02 257.901 2.18538e+01 257.901 0.8845 
1 1 1 1   77  6  o 7  1.72991e+01 5.93222e-01 3.52969e+02 300.611 3.01492e+01  -5.09572e+01 0.00000e+00 0.00000e+00 2.85790e+02 300.611 6.71792e+01 120.611 0.9915 
1 1 1 1   77  7  o 18 6.01176e+00 6.46308e-01 6.40770e+01 136.838 -3.11438e+00 2.92068e+00  0.00000e+00 0.00000e+00 1.31332e+02 136.838 6.72550e+01 136.838 0.8731 
1 1 1 1   77  8  o 4  4.38148e+00 8.08111e-01 9.43092e+01 36.293  4.09810e+00  3.00955e+00  0.00000e+00 0.00000e+00 5.16620e+01 36.293  4.26471e+01 216.293 0.8953 
1 1 1 1   77  9  o 6  8.25437e+00 6.27288e-01 1.47691e+02 175.603 -1.75467e+01 1.34929e+00  0.00000e+00 0.00000e+00 1.50464e+02 175.603 2.77317e+00 175.603 0.9712 
1 1 1 1   77  10 o 2  9.47966e+00 6.50613e-01 1.75889e+02 355.762 2.64113e+01  -1.95686e+00 0.00000e+00 0.00000e+00 1.69784e+02 355.762 6.10524e+00 175.763 0.9809 
1 1 1 1   77  11 o 14 3.09251e+00 9.04302e-01 6.84861e+01 50.519  1.93665e+00  2.35090e+00  0.00000e+00 0.00000e+00 2.49563e+01 50.519  4.35298e+01 230.519 0.8133 
1 1 1 1   77  12 o 5  1.01366e+01 7.93511e-01 1.51495e+02 210.189 -2.31748e+01 -1.34820e+01 0.00000e+00 0.00000e+00 2.17755e+02 210.189 6.62600e+01 210.189 0.9812 
1 1 1 1   77  13 o 17 6.98089e+00 1.14818e+00 9.89866e+01 176.965 -1.04938e+01 5.56417e-01  0.00000e+00 0.00000e+00 1.47353e+02 176.965 4.83660e+01 176.965 0.9512 
1 1 1 1   77  14 o 4  8.21129e+00 1.19500e+00 1.34021e+02 54.678  1.05197e+01  1.48456e+01  0.00000e+00 0.00000e+00 1.61889e+02 54.678  2.78688e+01 54.678  0.9721 
1 1 1 1   77  15 o 9  5.41503e+00 1.36189e+00 3.85644e+01 297.099 1.56243e+00  -3.05341e+00 0.00000e+00 0.00000e+00 1.29383e+02 297.099 9.08189e+01 297.099 0.8374 
1 1 1 1   77  16 o 2  5.56595e+00 1.43492e+00 1.04800e+02 50.993  6.44557e+00  7.95753e+00  0.00000e+00 0.00000e+00 9.08409e+01 50.993  1.39590e+01 230.993 0.9498 
1 1 1 1   78  0  o 4  8.18728e+00 6.70357e-01 1.69203e+02 109.952 -3.47402e+00 9.56982e+00  0.00000e+00 0.00000e+00 1.20495e+02 109.952 4.87087e+01 289.952 0.9495 
1 1 1 1   78  1  o 13 2.01214e+01 5.05551e-01 3.85384e+02 252.263 -1.78127e+01 -5.56914e+01 0.00000e+00 0.00000e+00 3.57993e+02 252.263 2.73904e+01 72.263  0.9914 
1 1 1 1   78  2  o 12 8.20093e+00 6.81547e-01 2.22479e+02 228.777 -8.62114e+00 -9.84002e+00 0.00000e+00 0.00000e+00 7.11873e+01 228.777 1.51292e+02 48.777  0.9610 
1 1 1 1   78  3  o 16 7.47414e+00 7.13245e-01 1.78345e+02 245.921 -4.41315e+00 -9.87545e+00 0.00000e+00 0.00000e+00 8.69273e+01 245.921 9.14179e+01 65.921  0.9526 
1 1 1 1   78  4  o 15 9.72898e+00 4.42722e-01 1.98870e+02 267.531 -7.40031e-01 -1.71665e+01 0.00000e+00 0.00000e+00 1.52845e+02 267.531 4.60256e+01 87.532  0.9704 
1 1 1 1   78  5  o 11 1.90924e+01 4.41037e-01 3.01177e+02 252.653 -1.59602e+01 -5.10956e+01 0.00000e+00 0.00000e+00 4.03213e+02 252.653 1.02036e+02 252.653 0.9906 
1 1 1 1   78  6  o 15 1.69860e+01 5.18129e-01 2.49534e+02 121.729 -2.39114e+01 3.86718e+01  0.00000e+00 0.00000e+00 3.75901e+02 121.729 1.26367e+02 121.729 0.9889 
1 1 1 1   78  7  o 3  7.18924e+00 6.02141e-01 1.04415e+02 287.969 2.42410e+00  -7.47421e+00 0.00000e+00 0.00000e+00 1.45504e+02 287.969 4.10889e+01 287.969 0.9340 
1 1 1 1   78  8  o 14 9.35385e+00 5.69834e-01 1.55206e+02 148.620 -1.54737e+01 9.43786e+00  0.00000e+00 0.00000e+00 1.83049e+02 148.620 2.78434e+01 148.620 0.9720 
1 1 1 1   78  9  o 7  5.65102e+00 7.71872e-01 9.96578e+01 129.639 -4.83336e+00 5.83449e+00  0.00000e+00 0.00000e+00 9.60751e+01 129.639 3.58267e+00 309.639 0.9315 
1 1 1 1   78  10 o 12 3.43089e+00 9.21324e-01 6.56666e+01 241.404 -1.51811e+00 -2.78493e+00 0.00000e+00 0.00000e+00 3.91382e+01 241.404 2.65284e+01 61.404  0.8219 
1 1 1 1   78  11 o 11 7.70243e+00 8.32375e-01 1.74058e+02 229.754 -1.33446e+01 -1.57655e+01 0.00000e+00 0.00000e+00 1.05021e+02 229.754 6.90363e+01 49.754  0.9755 
1 1 1 1   78  12 o 13 8.06141e+00 9.23845e-01 1.48116e+02 19.920  1.86194e+01  6.74752e+00  0.00000e+00 0.00000e+00 1.43457e+02 19.920  4.65944e+00 199.920 0.9744 
1 1 1 1   78  13 o 16 3.78994e+00 1.10490e+00 5.01828e+01 249.124 -1.08782e+00 -2.85235e+00 0.00000e+00 0.00000e+00 6.42190e+01 249.124 1.40361e+01 249.124 0.8138 
1 1 1 1   78  14 o 9  5.03642e+00 1.22934e+00 8.73377e+01 58.100  3.70162e+00  5.94685e+00  0.00000e+00 0.00000e+00 8.54349e+01 58.100  1.90277e+00 238.100 0.9256 
1 1 1 1   78  15 o 5  3.53429e+00 1.11682e+00 7.59231e+01 248.704 -1.98887e+00 -5.10225e+00 0.00000e+00 0.00000e+00 4.23093e+01 248.704 3.36138e+01 68.704  0.9034 
1 1 1 1   78  16 o 7  4.97353e+00 1.39979e+00 1.07899e+02 101.319 -1.92004e+00 9.59247e+00  0.00000e+00 0.00000e+00 6.64360e+01 101.319 4.14625e+01 281.319 0.9474 
1 1 1 1   79  0  o 7  1.45480e+01 5.31458e-01 2.68191e+02 309.932 1.94781e+01  -2.32690e+01 0.00000e+00 0.00000e+00 2.64806e+02 309.932 3.38490e+00 129.932 0.9834 
1 1 1 1   79  1  o 12 7.32093e+00 7.26374e-01 1.73405e+02 297.327 4.37155e+00  -8.45999e+00 0.00000e+00 0.00000e+00 8.46030e+01 297.327 8.88018e+01 117.327 0.9459 
1 1 1 1   79  2  o 16 8.70642e+00 6.47679e-01 2.19684e+02 308.011 9.69049e+00  -1.23982e+01 0.00000e+00 0.00000e+00 9.41891e+01 308.011 1.25495e+02 128.011 0.9677 
1 1 1 1   79  3  o 6  1.69916e+01 6.23038e-01 2.34084e+02 83.049  4.09159e+00  3.35597e+01  0.00000e+00 0.00000e+00 3.89429e+02 83.049  1.55344e+02 83.049  0.9851 
1 1 1 1   79  4  o 18 7.85184e+00 4.96127e-01 9.19903e+01 325.009 5.47465e+00  -3.83216e+00 0.00000e+00 0.00000e+00 1.77578e+02 325.009 8.55872e+01 325.009 0.9218 
1 1 1 1   79  5  o 17 1.12926e+01 4.34512e-01 1.79995e+02 256.836 -4.61658e+00 -1.97395e+01 0.00000e+00 0.00000e+00 2.29983e+02 256.836 4.99880e+01 256.836 0.9750 
1 1 1 1   79  6  o 1  1.30124e+01 4.76804e-01 2.56110e+02 0.137   3.76754e+01  9.03954e-02  0.00000e+00 0.00000e+00 2.21794e+02 0.137   3.43160e+01 180.137 0.9866 
1 1 1 1   79  7  o 16 2.21755e+00 6.83458e-01 9.18059e+01 71.023  7.72169e-01  2.24542e+00  0.00000e+00 0.00000e+00 2.98665e+01 251.023 1.21672e+02 251.023 0.7506 
1 1 1 1   79  8  o 18 1.91949e+01 5.37311e-01 2.73356e+02 301.095 3.58972e+01  -5.95196e+01 0.00000e+00 0.00000e+00 4.35453e+02 301.095 1.62097e+02 301.095 0.9928 
1 1 1 1   79  9  o 13 1.25085e+01 5.68816e-01 2.02834e+02 98.736  -5.89417e+00 3.83589e+01  0.00000e+00 0.00000e+00 2.56171e+02 98.736  5.33368e+01 98.736  0.9870 
1 1 1 1   79  10 o 13 1.12108e+01 6.50045e-01 1.73047e+02 263.243 -3.63738e+00 -3.07005e+01 0.00000e+00 0.00000e+00 2.36726e+02 263.243 6.36781e+01 263.243 0.9837 
1 1 1 1   79  11 o 5  4.49793e+00 1.02180e+00 7.96634e+01 1.020   5.36293e+00  9.54845e-02  0.00000e+00 0.00000e+00 7.08632e+01 1.020   8.80021e+00 181.020 0.9012 
1 1 1 1   79  12 o 5  8.94568e+00 8.74752e-01 1.25442e+02 279.296 3.14217e+00  -1.91960e+01 0.00000e+00 0.00000e+00 1.97888e+02 279.296 7.24457e+01 279.296 0.9739 
1 1 1 1   79  13 o 3  5.55877e+00 1.18252e+00 7.69649e+01 257.412 -1.46551e+00 -6.56286e+00 0.00000e+00 0.00000e+00 1.13162e+02 257.412 3.61974e+01 257.412 0.9223 
1 1 1 1   79  14 o 13 3.57847e+00 1.10662e+00 5.81894e+01 221.181 -2.88562e+00 -2.52449e+00 0.00000e+00 0.00000e+00 5.54245e+01 221.181 2.76488e+00 41.181  0.8568 
1 1 1 1   79  15 o 11 2.74446e+00 9.31054e-01 2.49710e+01 28.010  1.42159e+00  7.56182e-01  0.00000e+00 0.00000e+00 3.82519e+01 28.010  1.32809e+01 28.010  0.6222 
1 1 1 1   79  16 o 10 3.70329e+00 1.18327e+00 3.11796e+01 222.349 -1.85657e+00 -1.69223e+00 0.00000e+00 0.00000e+00 7.37916e+01 222.349 4.26120e+01 222.349 0.7663 
1 1 1 1   80  0  o 8  8.57997e+00 5.82263e-01 9.89881e+01 101.963 -1.46458e+00 6.91227e+00  0.00000e+00 0.00000e+00 1.97033e+02 101.963 9.80447e+01 101.963 0.9263 
1 1 1 1   80  1  o 2  2.05954e+01 6.20989e-01 4.00358e+02 171.916 -6.37595e+01 9.05637e+00  0.00000e+00 0.00000e+00 3.60807e+02 171.916 3.95506e+01 351.916 0.9922 
1 1 1 1   80  2  o 2  1.47487e+01 5.98299e-01 2.58508e+02 356.282 3.24968e+01  -2.11192e+00 0.00000e+00 0.00000e+00 2.82330e+02 356.282 2.38222e+01 356.282 0.9845 
1 1 1 1   80  3  o 15 1.37885e+01 4.94475e-01 2.12993e+02 120.655 -1.38781e+01 2.34155e+01  0.00000e+00 0.00000e+00 2.91000e+02 120.655 7.80065e+01 120.655 0.9815 
1 1 1 1   80  4  o 8  8.55743e+00 5.51290e-01 1.99470e+02 141.771 -1.29625e+01 1.02110e+01  0.00000e+00 0.00000e+00 1.09362e+02 141.771 9.01078e+01 321.771 0.9692 
1 1 1 1   80  5  o 12 1.02399e+01 4.69686e-01 1.37311e+02 225.501 -1.08620e+01 -1.10538e+01 0.00000e+00 0.00000e+00 2.31379e+02 225.501 9.40684e+01 225.501 0.9672 
1 1 1 1   80  6  o 13 7.72403e+00 5.48468e-01 7.25101e+01 173.961 -6.31388e+00 6.67923e-01  0.00000e+00 0.00000e+00 1.91223e+02 173.961 1.18713e+02 173.961 0.9175 
1 1 1 1   80  7  o 17 4.39319e+00 7.69108e-01 8.52071e+01 204.256 -4.25964e+00 -1.91939e+00 0.00000e+00 0.00000e+00 5.94660e+01 204.256 2.57411e+01 24.256  0.8852 
1 1 1 1   80  8  o 4  9.18615e+00 5.90210e-01 1.72467e+02 79.334  4.12287e+00  2.18916e+01  0.00000e+00 0.00000e+00 1.61383e+02 79.334  1.10837e+01 259.334 0.9773 
1 1 1 1   80  9  o 10 3.01219e+00 8.20784e-01 6.27404e+01 163.566 -2.42101e+00 7.14105e-01  0.00000e+00 0.00000e+00 2.32008e+01 163.566 3.95397e+01 343.566 0.7676 
1 1 1 1   80  10 o 18 1.04355e+01 6.50973e-01 1.92681e+02 115.812 -1.35221e+01 2.79574e+01  0.00000e+00 0.00000e+00 1.88697e+02 115.812 3.98459e+00 295.812 0.9838 
1 1 1 1   80  11 o 11 3.45400e+00 9.08104e-01 6.46394e+01 120.715 -1.85272e+00 3.11846e+00  0.00000e+00 0.00000e+00 4.40396e+01 120.715 2.05998e+01 300.715 0.8475 
1 1 1 1   80  12 o 17 1.50097e+01 7.16007e-01 2.26379e+02 310.081 4.30302e+01  -5.11341e+01 0.00000e+00 0.00000e+00 3.26337e+02 310.081 9.99581e+01 310.081 0.9925 
1 1 1 1   80  13 o 6  4.10091e+00 1.08334e+00 8.64018e+01 200.832 -5.92726e+00 -2.25531e+00 0.00000e+00 0.00000e+00 5.30778e+01 200.832 3.33240e+01 20.832  0.9174 
1 1 1 1   80  14 o 7  3.08092e+00 1.00591e+00 4.30996e+01 306.865 1.67654e+00  -2.23580e+00 0.00000e+00 0.00000e+00 4.74767e+01 306.865 4.37717e+00 306.865 0.7936 
1 1 1 1   80  15 o 9  6.14612e+00 1.38797e+00 9.36232e+01 53.710  6.01963e+00  8.19788e+00  0.00000e+00 0.00000e+00 1.22386e+02 53.710  2.87626e+01 53.710  0.9495 
1 1 1 1   80  16 o 14 5.14870e+00 1.45179e+00 8.55472e+01 21.756  7.29063e+00  2.90958e+00  0.00000e+00 0.00000e+00 9.22830e+01 21.756  6.73578e+00 21.756  0.9339 
1 1 1 1   81  0  o 14 9.41384e+00 5.87453e-01 1.43099e+02 313.276 7.89445e+00  -8.38440e+00 0.00000e+00 0.00000e+00 1.91887e+02 313.276 4.87879e+01 313.276 0.9555 
1 1 1 1   81  1  o 8  1.51234e+01 5.69679e-01 2.40215e+02 319.659 2.40832e+01  -2.04535e+01 0.00000e+00 0.00000e+00 3.14000e+02 319.659 7.37851e+01 319.659 0.9840 
1 1 1 1   81  2  o 17 5.35705e+00 8.06959e-01 3.31638e+01 171.446 -1.52148e+00 2.28844e-01  0.00000e+00 0.00000e+00 8.76317e+01 171.446 5.44679e+01 171.446 0.6055 
1 1 1 1   81  3  o 3  4.24814e+00 6.74891e-01 8.32729e+01 149.592 -2.71962e+00 1.59613e+00  0.00000e+00 0.00000e+00 4.65446e+01 149.592 3.67282e+01 329.591 0.8207 
1 1 1 1   81  4  o 19 6.97302e+00 6.49912e-01 9.00940e+01 209.215 -5.25054e+00 -2.93618e+00 0.00000e+00 0.00000e+00 1.46808e+02 209.215 5.67140e+01 209.215 0.9126 
1 1 1 1   81  5  o 7  1.30348e+01 5.37487e-01 2.55021e+02 230.838 -2.34477e+01 -2.87885e+01 0.00000e+00 0.00000e+00 2.23541e+02 230.838 3.14801e+01 50.838  0.9864 
1 1 1 1   81  6  o 7  8.83115e+00 5.21276e-01 1.53007e+02 70.781  5.15706e+00  1.47934e+01  0.00000e+00 0.00000e+00 1.64916e+02 70.781  1.19091e+01 70.781  0.9675 
1 1 1 1   81  7  o 19 8.59895e+00 5.58220e-01 1.79673e+02 250.777 -6.36923e+00 -1.82668e+01 0.00000e+00 0.00000e+00 1.31783e+02 250.777 4.78903e+01 70.777  0.9738 
1 1 1 1   81  8  o 17 7.10355e+00 6.60273e-01 9.58276e+01 230.362 -5.87106e+00 -7.08719e+00 0.00000e+00 0.00000e+00 1.53486e+02 230.362 5.76582e+01 230.362 0.9440 
1 1 1 1   81  9  o 16 4.38789e+00 8.97088e-01 1.00986e+02 186.142 -6.28556e+00 -6.76351e-01 0.00000e+00 0.00000e+00 4.85541e+01 186.142 5.24316e+01 6.142   0.9171 
1 1 1 1   81  10 f 0  2.69172e+00 8.17938e-01 1.16545e+02 2.681   5.06910e+00  2.37353e-01  0.00000e+00 0.00000e+00 2.70597e+01 182.681 1.43605e+02 182.681 0.8951 
1 1 1 1   81  11 o 15 7.53426e+00 8.03182e-01 1.38742e+02 305.626 1.07346e+01  -1.49795e+01 0.00000e+00 0.00000e+00 1.33225e+02 305.626 5.51729e+00 125.626 0.9725 
1 1 1 1   81  12 o 11 3.55343e+00 1.04013e+00 1.91536e+01 349.514 1.05857e+00  -1.95929e-01 0.00000e+00 0.00000e+00 4.31746e+01 349.514 2.40210e+01 349.514 0.4729 
1 1 1 1   81  13 o 13 3.51454e+00 1.01848e+00 4.00595e+01 85.510  1.96778e-01  2.50588e+00  0.00000e+00 0.00000e+00 5.97923e+01 85.510  1.97328e+01 85.510  0.7665 
1 1 1 1   81  14 o 7  2.81127e+00 9.35241e-01 1.90593e+01 334.135 1.13987e+00  -5.52633e-01 0.00000e+00 0.00000e+00 3.64369e+01 334.135 1.73777e+01 334.135 0.5330 
1 1 1 1   81  15 o 10 3.20295e+00 1.03265e+00 4.52539e+01 119.801 -1.65886e+00 2.89640e+00  0.00000e+00 0.00000e+00 5.33837e+01 119.801 8.12988e+00 119.801 0.8322 
1 1 1 1   82  0  o 15 3.08830e+00 7.91015e-01 9.92465e+01 144.465 -2.16621e+00 1.54713e+00  0.00000e+00 0.00000e+00 9.38524e+00 324.465 1.08632e+02 324.465 0.7815 
1 1 1 1   82  1  o 3  2.16311e+00 6.78553e-01 5.97823e+01 165.584 -1.11739e+00 2.87226e-01  0.00000e+00 0.00000e+00 1.96580e+01 345.584 7.94403e+01 345.584 0.4982 
1 1 1 1   82  2  o 18 2.06616e+00 6.41423e-01 7.69966e+01 106.615 -4.08435e-01 1.36879e+00  0.00000e+00 0.00000e+00 3.25399e+01 286.615 1.09536e+02 286.615 0.5779 
1 1 1 1   82  3  o 10 8.45409e+00 5.40201e-01 1.49055e+02 238.263 -6.49060e+00 -1.04939e+01 0.00000e+00 0.00000e+00 1.52620e+02 238.263 3.56580e+00 238.263 0.9586 
1 1 1 1   82  4  o 7  1.39610e+01 5.08629e-01 2.56429e+02 208.149 -3.39197e+01 -1.81491e+01 0.00000e+00 0.00000e+00 2.56391e+02 208.149 3.84543e-02 28.149  0.9869 
1 1 1 1   82  5  o 6  8.17004e+00 6.14533e-01 1.60568e+02 217.659 -1.15940e+01 -8.94775e+00 0.00000e+00 0.00000e+00 1.32875e+02 217.659 2.76931e+01 37.659  0.9652 
1 1 1 1   82  6  o 17 8.72615e+00 7.20247e-01 1.01775e+02 104.868 -2.77218e+00 1.04422e+01  0.00000e+00 0.00000e+00 2.07426e+02 104.868 1.05651e+02 104.868 0.9525 
1 1 1 1   82  7  f 0  4.44790e+00 7.71783e-01 9.26565e+01 227.875 -3.40358e+00 -3.76357e+00 0.00000e+00 0.00000e+00 5.53905e+01 227.875 3.72660e+01 47.875  0.8951 
1 1 1 1   82  8  o 18 4.27381e+00 8.73885e-01 1.62606e+02 88.955  1.72495e-01  9.45545e+00  0.00000e+00 0.00000e+00 1.23946e+01 268.955 1.75000e+02 268.955 0.9456 
1 1 1 1   82  9  f 0  7.74817e+00 6.57426e-01 1.87453e+02 67.910  8.62224e+00  2.12447e+01  0.00000e+00 0.00000e+00 9.40656e+01 67.910  9.33872e+01 247.910 0.9779 
1 1 1 1   82  10 o 12 9.25888e+00 7.05794e-01 1.46393e+02 285.176 6.17852e+00  -2.27779e+01 0.00000e+00 0.00000e+00 1.90051e+02 285.176 4.36580e+01 285.176 0.9786 
1 1 1 1   82  11 o 13 8.91216e+00 7.96846e-01 1.57871e+02 174.014 -2.43493e+01 2.55333e+00  0.00000e+00 0.00000e+00 1.66039e+02 174.014 8.16824e+00 174.014 0.9794 
1 1 1 1   82  12 o 8  7.30160e+00 9.75491e-01 8.92519e+01 133.717 -7.63876e+00 7.98876e+00  0.00000e+00 0.00000e+00 1.68980e+02 133.717 7.97278e+01 133.717 0.9536 
1 1 1 1   82  13 o 9  8.71077e+00 1.04073e+00 1.41351e+02 267.262 -1.09684e+00 -2.29313e+01 0.00000e+00 0.00000e+00 1.74352e+02 267.262 3.30007e+01 267.262 0.9780 
1 1 1 1   82  14 o 7  3.53508e+00 1.09341e+00 5.53664e+01 82.106  5.17869e-01  3.73493e+00  0.00000e+00 0.00000e+00 5.64372e+01 82.106  1.07079e+00 82.106  0.8541 
1 1 1 1   82  15 o 18 2.76789e+00 9.40355e-01 4.35812e+01 306.380 1.82088e+00  -2.47155e+00 0.00000e+00 0.00000e+00 3.98840e+01 306.380 3.69711e+00 126.380 0.8150 
1 1 1 1   83  0  o 1  7.12970e+00 6.32487e-01 1.54268e+02 313.258 6.77412e+00  -7.19903e+00 0.00000e+00 0.00000e+00 9.73166e+01 313.258 5.69517e+01 133.258 0.9480 
1 1 1 1   83  1  o 12 4.17054e+00 7.62671e-01 1.43113e+02 253.167 -1.59088e+00 -5.25838e+00 0.00000e+00 0.00000e+00 2.82110e+00 73.167  1.45935e+02 73.167  0.9037 
1 1 1 1   83  2  o 10 8.52479e+00 5.11751e-01 8.87723e+01 84.483  7.16272e-01  7.41515e+00  0.00000e+00 0.00000e+00 2.06397e+02 84.483  1.17624e+02 84.483  0.9302 
1 1 1 1   83  3  o 16 9.23126e+00 4.89413e-01 1.21288e+02 215.792 -9.97861e+00 -7.19458e+00 0.00000e+00 0.00000e+00 2.08001e+02 215.792 8.67127e+01 215.792 0.9585 
1 1 1 1   83  4  o 10 7.21907e+00 5.99214e-01 8.95652e+01 240.781 -3.47045e+00 -6.20489e+00 0.00000e+00 0.00000e+00 1.59382e+02 240.781 6.98169e+01 240.781 0.9267 
1 1 1 1   83  5  o 17 9.63515e+00 5.97411e-01 1.67815e+02 100.413 -3.32945e+00 1.81173e+01  0.00000e+00 0.00000e+00 1.80764e+02 100.413 1.29484e+01 100.413 0.9725 
1 1 1 1   83  6  o 3  6.37198e+00 7.48575e-01 2.05716e+02 189.234 -1.62236e+01 -2.63752e+00 0.00000e+00 0.00000e+00 2.39399e+01 189.234 1.81776e+02 9.234   0.9691 
1 1 1 1   83  7  o 3  6.58291e+00 7.40007e-01 1.58924e+02 178.344 -1.39711e+01 4.03911e-01  0.00000e+00 0.00000e+00 7.68905e+01 178.344 8.20333e+01 358.344 0.9635 
1 1 1 1   83  8  o 5  9.02432e+00 5.99259e-01 1.87844e+02 285.161 6.42955e+00  -2.37277e+01 0.00000e+00 0.00000e+00 1.40627e+02 285.161 4.72169e+01 105.161 0.9794 
1 1 1 1   83  9  o 19 3.75227e+00 8.45782e-01 6.91402e+01 152.959 -3.38375e+00 1.72715e+00  0.00000e+00 0.00000e+00 5.00721e+01 152.959 1.90681e+01 332.959 0.8553 
1 1 1 1   83  10 o 4  8.46724e+00 7.51616e-01 2.24171e+02 247.501 -1.25773e+01 -3.03654e+01 0.00000e+00 0.00000e+00 8.53522e+01 247.501 1.38818e+02 67.501  0.9847 
1 1 1 1   83  11 o 9  3.91546e+00 9.78395e-01 7.89824e+01 109.364 -1.53911e+00 4.37921e+00  0.00000e+00 0.00000e+00 4.94897e+01 109.364 2.94927e+01 289.364 0.8844 
1 1 1 1   83  12 o 14 4.51201e+00 1.08258e+00 9.94404e+01 262.368 -9.70238e-01 -7.24131e+00 0.00000e+00 0.00000e+00 5.59427e+01 262.368 4.34977e+01 82.369  0.9288 
1 1 1 1   83  13 o 16 4.62753e+00 1.14641e+00 9.76711e+01 337.461 7.17962e+00  -2.97967e+00 0.00000e+00 0.00000e+00 6.23411e+01 337.461 3.53300e+01 157.461 0.9333 
1 1 1 1   83  14 o 19 2.67951e+00 9.01910e-01 5.81601e+01 185.906 -3.72312e+00 -3.85151e-01 0.00000e+00 0.00000e+00 2.64435e+01 185.906 3.17166e+01 5.906   0.8529 
1 1 1 1   83  15 o 19 4.31179e+00 1.23389e+00 3.95935e+01 36.551  2.79283e+00  2.07043e+00  0.00000e+00 0.00000e+00 9.43619e+01 36.551  5.47685e+01 36.551  0.8399 
1 1 1 1   84  0  o 8  2.24668e+01 5.59232e-01 3.55139e+02 74.902  2.02511e+01  7.50650e+01  0.00000e+00 0.00000e+00 4.75560e+02 74.902  1.20421e+02 74.902  0.9935 
1 1 1 1   84  1  o 12 6.64760e+00 5.66187e-01 6.18236e+01 204.070 -3.65782e+00 -1.63390e+00 0.00000e+00 0.00000e+00 1.51862e+02 204.070 9.00382e+01 204.070 0.8638 
1 1 1 1   84  2  o 13 1.03802e+01 4.80924e-01 1.35039e+02 125.503 -8.95719e+00 1.25560e+01  0.00000e+00 0.00000e+00 2.38500e+02 125.503 1.03461e+02 125.503 0.9670 
1 1 1 1   84  3  o 13 7.82633e+00 5.34101e-01 1.68946e+02 187.468 -1.46596e+01 -1.92178e+00 0.00000e+00 0.00000e+00 1.12236e+02 187.468 5.67103e+01 7.469   0.9656 
1 1 1 1   84  4  o 5  5.62967e+00 6.99900e-01 1.35674e+02 225.243 -5.85885e+00 -5.90879e+00 0.00000e+00 0.00000e+00 6.07435e+01 225.243 7.49300e+01 45.243  0.9378 
1 1 1 1   84  5  o 10 5.71870e+00 8.03560e-01 9.75155e+01 123.178 -3.61012e+00 5.52138e+00  0.00000e+00 0.00000e+00 9.83244e+01 123.178 8.08886e-01 123.178 0.9207 
1 1 1 1   84  6  o 2  1.06609e+01 6.32577e-01 1.79953e+02 99.873  -4.43256e+00 2.54691e+01  0.00000e+00 0.00000e+00 2.08703e+02 99.873  2.87505e+01 99.873  0.9805 
1 1 1 1   84  7  o 13 6.63421e+00 8.88427e-01 6.76440e+01 237.667 -2.97872e+00 -4.70590e+00 0.00000e+00 0.00000e+00 1.55545e+02 237.667 8.79012e+01 237.667 0.9051 
1 1 1 1   84  8  o 11 4.49391e+00 9.24318e-01 2.88164e+01 290.686 6.44645e-01  -1.70726e+00 0.00000e+00 0.00000e+00 8.25200e+01 290.686 5.37036e+01 290.686 0.6668 
1 1 1 1   84  9  o 5  2.63598e+00 7.54728e-01 1.17840e+01 44.711  3.26794e-01  3.23517e-01  0.00000e+00 0.00000e+00 1.01484e+01 44.711  1.63556e+00 224.711 0.2241 
1 1 1 1   84  10 o 4  7.51793e+00 8.05791e-01 6.15631e+01 339.431 7.43413e+00  -2.78964e+00 0.00000e+00 0.00000e+00 1.99259e+02 339.431 1.37696e+02 339.431 0.9347 
1 1 1 1   84  11 o 12 1.04278e+01 7.88054e-01 1.92604e+02 121.966 -1.90190e+01 3.04774e+01  0.00000e+00 0.00000e+00 1.88780e+02 121.966 3.82435e+00 301.966 0.9860 
1 1 1 1   84  12 o 4  3.59791e+00 1.04308e+00 7.09412e+01 279.920 7.59499e-01  -4.34256e+00 0.00000e+00 0.00000e+00 4.61026e+01 279.920 2.48386e+01 99.921  0.8776 
1 1 1 1   84  13 o 8  6.58325e+00 1.20548e+00 1.11022e+02 79.803  2.11135e+00  1.17375e+01  0.00000e+00 0.00000e+00 1.22378e+02 79.803  1.13557e+01 79.803  0.9571 
1 1 1 1   84  14 o 15 4.10208e+00 1.19622e+00 1.02103e+02 268.388 -2.24681e-01 -7.98222e+00 0.00000e+00 0.00000e+00 3.98766e+01 268.388 6.22261e+01 88.388  0.9351 
1 1 1 1   84  15 o 13 4.46448e+00 1.25790e+00 5.04350e+01 25.610  3.97139e+00  1.90363e+00  0.00000e+00 0.00000e+00 9.44353e+01 25.610  4.40003e+01 25.610  0.8774 
1 1 1 1   85  0  o 19 3.37370e+00 6.62125e-01 6.03645e+01 261.758 -3.07751e-01 -2.12475e+00 0.00000e+00 0.00000e+00 3.00720e+01 261.758 3.02925e+01 81.759  0.7205 
1 1 1 1   85  1  o 4  9.59372e+00 4.74713e-01 1.99433e+02 172.729 -2.05170e+01 2.61764e+00  0.00000e+00 0.00000e+00 1.48775e+02 172.729 5.06582e+01 352.729 0.9755 
1 1 1 1   85  2  o 6  7.20225e+00 5.49322e-01 1.33426e+02 59.296  5.46648e+00  9.20507e+00  0.00000e+00 0.00000e+00 1.21691e+02 59.296  1.17354e+01 239.296 0.9521 
1 1 1 1   85  3  o 6  1.13378e+01 4.87086e-01 1.70847e+02 224.380 -1.59234e+01 -1.55822e+01 0.00000e+00 0.00000e+00 2.41345e+02 224.380 7.04982e+01 224.380 0.9773 
1 1 1 1   85  4  o 6  9.47432e+00 5.15931e-01 2.22662e+02 69.604  8.52610e+00  2.29306e+01  0.00000e+00 0.00000e+00 1.22445e+02 69.604  1.00216e+02 249.604 0.9793 
1 1 1 1   85  5  o 2  1.05312e+01 8.30802e-01 1.67172e+02 105.529 -5.73770e+00 2.06486e+01  0.00000e+00 0.00000e+00 2.15184e+02 105.529 4.80126e+01 105.529 0.9764 
1 1 1 1   85  6  o 9  3.45545e+00 8.52570e-01 3.12582e+01 62.814  6.27960e-01  1.22261e+00  0.00000e+00 0.00000e+00 4.11289e+01 62.814  9.87076e+00 62.814  0.5635 
1 1 1 1   85  7  o 11 2.29462e+00 7.38399e-01 3.40527e+01 258.125 -2.31468e-01 -1.10078e+00 0.00000e+00 0.00000e+00 7.63420e+00 258.125 2.64185e+01 78.125  0.4889 
1 1 1 1   85  8  o 17 3.01919e+00 8.96266e-01 7.21839e+01 1.075   3.10432e+00  5.82662e-02  0.00000e+00 0.00000e+00 1.94919e+01 1.075   5.26920e+01 181.075 0.8174 
1 1 1 1   85  9  o 2  9.12918e+00 6.83032e-01 1.62958e+02 55.900  1.32237e+01  1.95317e+01  0.00000e+00 0.00000e+00 1.68720e+02 55.900  5.76202e+00 55.900  0.9786 
1 1 1 1   85  10 o 10 4.14173e+00 9.73243e-01 1.31879e+02 120.400 -4.43461e+00 7.55863e+00  0.00000e+00 0.00000e+00 1.27553e+01 120.400 1.19124e+02 300.400 0.9411 
1 1 1 1   85  11 o 5  2.75729e+00 8.50851e-01 8.26008e+01 50.321  2.42635e+00  2.92474e+00  0.00000e+00 0.00000e+00 4.86486e+00 50.321  7.77359e+01 230.321 0.8554 
1 1 1 1   85  12 o 10 9.70958e+00 8.74450e-01 1.29829e+02 191.755 -2.55353e+01 -5.31362e+00 0.00000e+00 0.00000e+00 2.23047e+02 191.755 9.32179e+01 191.755 0.9806 
1 1 1 1   85  13 o 12 6.79580e+00 1.20619e+00 1.19967e+02 287.390 4.15623e+00  -1.32708e+01 0.00000e+00 0.00000e+00 1.22482e+02 287.390 2.51426e+00 287.390 0.9633 
1 1 1 1   85  14 o 18 2.44457e+00 8.48528e-01 2.93451e+01 198.240 -1.70726e+00 -5.62626e-01 0.00000e+00 0.00000e+00 3.05010e+01 198.240 1.15591e+00 198.240 0.6616 
1 1 1 1   86  0  o 4  5.71498e+00 5.51296e-01 4.81397e+01 20.244  2.87112e+00  1.05884e+00  0.00000e+00 0.00000e+00 1.24973e+02 20.244  7.68330e+01 20.244  0.8143 
1 1 1 1   86  1  o 3  5.23780e+00 5.47836e-01 6.86578e+01 244.807 -1.64338e+00 -3.49341e+00 0.00000e+00 0.00000e+00 9.84982e+01 244.807 2.98404e+01 244.807 0.8579 
1 1 1 1   86  2  f 0  3.52261e+00 7.19106e-01 1.51336e+02 233.065 -3.47522e+00 -4.62272e+00 0.00000e+00 0.00000e+00 3.22520e+01 53.065  1.83588e+02 53.065  0.9089 
1 1 1 1   86  3  o 8  5.12795e+00 6.93160e-01 1.37449e+02 232.153 -4.80124e+00 -6.17920e+00 0.00000e+00 0.00000e+00 4.06277e+01 232.153 9.68217e+01 52.153  0.9337 
1 1 1 1   86  4  o 8  7.52646e+00 5.60352e-01 1.58158e+02 334.612 1.37047e+01  -6.50385e+00 0.00000e+00 0.00000e+00 1.12326e+02 334.612 4.58325e+01 154.612 0.9665 
1 1 1 1   86  5  o 13 6.91039e+00 6.98961e-01 1.32761e+02 132.771 -8.21505e+00 8.88036e+00  0.00000e+00 0.00000e+00 1.13283e+02 132.771 1.94784e+01 312.771 0.9577 
1 1 1 1   86  6  o 16 3.52091e+00 8.79200e-01 1.21310e+02 305.147 3.21835e+00  -4.57129e+00 0.00000e+00 0.00000e+00 2.82150e+00 125.147 1.24131e+02 125.147 0.9055 
1 1 1 1   86  7  o 18 3.76162e+00 9.19236e-01 8.32937e+01 121.983 -2.12665e+00 3.40561e+00  0.00000e+00 0.00000e+00 3.74659e+01 121.983 4.58278e+01 301.983 0.8641 
1 1 1 1   86  8  o 19 7.08696e+00 9.15833e-01 1.04914e+02 101.127 -2.03495e+00 1.03460e+01  0.00000e+00 0.00000e+00 1.45462e+02 101.127 4.05475e+01 101.127 0.9513 
1 1 1 1   86  9  o 17 9.95209e+00 8.40243e-01 1.06375e+02 3.678   1.61964e+01  1.04125e+00  0.00000e+00 0.00000e+00 2.51467e+02 3.678   1.45092e+02 3.678   0.9687 
1 1 1 1   86  10 o 15 3.45758e+00 9.35526e-01 8.58960e+01 270.266 2.22641e-02  -4.79505e+00 0.00000e+00 0.00000e+00 2.80610e+01 270.266 5.78350e+01 90.266  0.8884 
1 1 1 1   86  11 o 2  2.95754e+00 9.11075e-01 3.26384e+01 66.302  6.73886e-01  1.53533e+00  0.00000e+00 0.00000e+00 3.71985e+01 66.302  4.56016e+00 66.302  0.6369 
1 1 1 1   86  12 o 19 4.11827e+00 1.12502e+00 6.27250e+01 349.725 4.19274e+00  -7.60024e-01 0.00000e+00 0.00000e+00 7.04642e+01 349.725 7.73922e+00 349.725 0.8729 
1 1 1 1   86  13 o 13 4.94238e+00 1.22147e+00 6.49274e+01 180.790 -5.79660e+00 -7.99705e-02 0.00000e+00 0.00000e+00 1.01428e+02 180.790 3.65008e+01 180.790 0.9091 
1 1 1 1   86  14 o 5  2.57631e+00 8.78980e-01 3.65041e+01 269.214 -3.65643e-02 -2.66638e+00 0.00000e+00 0.00000e+00 3.80278e+01 269.214 1.52369e+00 269.214 0.7820 
1 1 1 1   87  0  o 18 7.28348e+00 4.75883e-01 6.14811e+01 346.107 5.00297e+00  -1.23743e+00 0.00000e+00 0.00000e+00 1.81435e+02 346.107 1.19954e+02 346.107 0.8968 
1 1 1 1   87  1  o 8  5.82579e+00 5.50266e-01 6.51357e+01 304.639 2.28809e+00  -3.31187e+00 0.00000e+00 0.00000e+00 1.22160e+02 304.639 5.70242e+01 304.639 0.8645 
1 1 1 1   87  2  o 9  1.31925e+01 4.44068e-01 2.72956e+02 145.773 -3.50936e+01 2.38734e+01  0.00000e+00 0.00000e+00 2.11817e+02 145.773 6.11385e+01 325.773 0.9881 
1 1 1 1   87  3  o 4  1.16372e+01 4.85252e-01 2.63780e+02 62.186  1.86210e+01  3.52970e+01  0.00000e+00 0.00000e+00 1.63468e+02 62.186  1.00312e+02 242.186 0.9874 
1 1 1 1   87  4  o 19 8.16351e+00 5.54958e-01 1.53402e+02 358.072 1.56987e+01  -5.28450e-01 0.00000e+00 0.00000e+00 1.40262e+02 358.072 1.31400e+01 178.072 0.9676 
1 1 1 1   87  5  o 7  4.42998e+00 8.27464e-01 7.32880e+01 127.263 -2.52694e+00 3.32157e+00  0.00000e+00 0.00000e+00 6.99385e+01 127.263 3.34950e+00 307.263 0.8699 
1 1 1 1   87  6  o 3  3.09946e+00 8.05522e-01 4.60788e+01 238.167 -9.98558e-01 -1.60843e+00 0.00000e+00 0.00000e+00 3.21679e+01 238.167 1.39109e+01 58.167  0.6794 
1 1 1 1   87  7  o 9  4.33304e+00 9.64216e-01 1.00390e+02 336.718 5.51803e+00  -2.37438e+00 0.00000e+00 0.00000e+00 4.64660e+01 336.718 5.39239e+01 156.718 0.9125 
1 1 1 1   87  8  o 2  5.12172e+00 1.05344e+00 9.00653e+01 342.498 5.67388e+00  -1.78916e+00 0.00000e+00 0.00000e+00 8.32756e+01 342.498 6.78969e+00 162.498 0.9116 
1 1 1 1   87  9  o 13 3.74652e+00 1.07612e+00 1.03318e+02 271.158 1.13340e-01  -5.60774e+00 0.00000e+00 0.00000e+00 2.26208e+01 271.158 8.06972e+01 91.158  0.9058 
1 1 1 1   87  10 o 13 3.22560e+00 9.77719e-01 5.59310e+01 31.583  2.30674e+00  1.41820e+00  0.00000e+00 0.00000e+00 3.80838e+01 31.583  1.78473e+01 211.583 0.7858 
1 1 1 1   87  11 o 4  7.25212e+00 9.64018e-01 7.80959e+01 55.348  5.57056e+00  8.05941e+00  0.00000e+00 0.00000e+00 1.76611e+02 55.348  9.85146e+01 55.348  0.9475 
1 1 1 1   87  12 o 11 6.09578e+00 1.13212e+00 9.62240e+01 146.464 -8.46495e+00 5.61057e+00  0.00000e+00 0.00000e+00 1.18159e+02 146.464 2.19349e+01 146.464 0.9494 
1 1 1 1   87  13 f 0  8.72110e+00 1.10629e+00 1.33121e+02 196.441 -2.28694e+01 -6.74852e+00 0.00000e+00 0.00000e+00 1.82858e+02 196.441 4.97371e+01 196.441 0.9788 
1 1 1 1   87  14 o 5  3.05555e+00 9.94746e-01 5.18355e+01 141.489 -3.00904e+00 2.39442e+00  0.00000e+00 0.00000e+00 4.50542e+01 141.489 6.78124e+00 321.489 0.8573 
1 1 1 1   88  0  o 9  7.30091e+00 4.79062e-01 1.23343e+02 223.702 -7.60887e+00 -7.27176e+00 0.00000e+00 0.00000e+00 1.34865e+02 223.702 1.15219e+01 223.702 0.9512 
1 1 1 1   88  1  o 16 3.05745e+00 7.00506e-01 8.61387e+01 307.147 1.84688e+00  -2.43781e+00 0.00000e+00 0.00000e+00 6.41743e+00 307.147 7.97213e+01 127.147 0.8142 
1 1 1 1   88  2  o 13 6.25275e+00 5.48627e-01 1.27449e+02 47.832  6.84385e+00  7.55631e+00  0.00000e+00 0.00000e+00 9.33024e+01 47.832  3.41463e+01 227.832 0.9496 
1 1 1 1   88  3  o 7  1.36577e+01 4.83834e-01 2.17501e+02 80.335  6.76749e+00  3.97389e+01  0.00000e+00 0.00000e+00 2.83870e+02 80.335  6.63692e+01 80.335  0.9875 
1 1 1 1   88  4  o 14 2.42250e+01 5.54396e-01 3.83645e+02 303.991 6.85388e+01  -1.01648e+02 0.00000e+00 0.00000e+00 5.13052e+02 303.991 1.29407e+02 303.991 0.9959 
1 1 1 1   88  5  o 12 8.37954e+00 7.11161e-01 1.64964e+02 111.356 -7.04672e+00 1.80217e+01  0.00000e+00 0.00000e+00 1.38252e+02 111.356 2.67124e+01 291.356 0.9738 
1 1 1 1   88  6  f 0  8.98934e+00 6.04374e-01 1.36865e+02 258.902 -3.48836e+00 -1.77839e+01 0.00000e+00 0.00000e+00 1.87720e+02 258.902 5.08551e+01 258.902 0.9720 
1 1 1 1   88  7  o 19 1.25153e+01 6.27359e-01 1.74591e+02 127.574 -2.12681e+01 2.76436e+01  0.00000e+00 0.00000e+00 2.83446e+02 127.574 1.08854e+02 127.574 0.9856 
1 1 1 1   88  8  o 7  2.80830e+00 8.73689e-01 9.04238e+01 44.642  2.63589e+00  2.60311e+00  0.00000e+00 0.00000e+00 1.70247e+00 224.641 9.21263e+01 224.641 0.8511 
1 1 1 1   88  9  o 11 4.15060e+00 1.04657e+00 7.70153e+01 229.719 -2.95147e+00 -3.48257e+00 0.00000e+00 0.00000e+00 5.88379e+01 229.719 1.81774e+01 49.719  0.8822 
1 1 1 1   88  10 o 5  8.20646e+00 1.11537e+00 1.49541e+02 0.097   1.81833e+01  3.06397e-02  0.00000e+00 0.00000e+00 1.46273e+02 0.097   3.26843e+00 180.097 0.9721 
1 1 1 1   88  11 o 3  4.58998e+00 1.22605e+00 3.83729e+01 235.296 -1.53759e+00 -2.22027e+00 0.00000e+00 0.00000e+00 9.51838e+01 235.296 5.68109e+01 235.296 0.7852 
1 1 1 1   88  12 o 15 6.71778e+00 1.15620e+00 9.24639e+01 266.264 -6.79493e-01 -1.04048e+01 0.00000e+00 0.00000e+00 1.44075e+02 266.264 5.16110e+01 266.264 0.9508 
1 1 1 1   88  13 o 9  3.49575e+00 1.05216e+00 6.16940e+01 31.875  3.89112e+00  2.41969e+00  0.00000e+00 0.00000e+00 5.24990e+01 31.875  9.19498e+00 211.875 0.8827 
1 1 1 1   88  14 o 10 3.68688e+00 1.12928e+00 6.64482e+01 209.350 -4.80052e+00 -2.69946e+00 0.00000e+00 0.00000e+00 5.67927e+01 209.350 9.65547e+00 29.350  0.9040 
1 1 1 1   89  0  o 3  1.22458e+01 4.23938e-01 1.90818e+02 62.868  1.40213e+01  2.73628e+01  0.00000e+00 0.00000e+00 2.56901e+02 62.868  6.60832e+01 62.868  0.9836 
1 1 1 1   89  1  o 15 5.49608e+00 5.58802e-01 1.23389e+02 238.518 -4.72678e+00 -7.71879e+00 0.00000e+00 0.00000e+00 6.92649e+01 238.518 5.41244e+01 58.518  0.9430 
1 1 1 1   89  2  o 4  9.92428e+00 4.53233e-01 2.03413e+02 35.803  2.23710e+01  1.61359e+01  0.00000e+00 0.00000e+00 1.58712e+02 35.803  4.47016e+01 215.802 0.9817 
1 1 1 1   89  3  o 12 3.67080e+00 7.03392e-01 6.10757e+01 335.262 2.67973e+00  -1.23466e+00 0.00000e+00 0.00000e+00 4.89174e+01 335.262 1.21583e+01 155.262 0.8063 
1 1 1 1   89  4  o 17 2.52381e+00 7.04030e-01 6.47901e+01 323.175 1.77176e+00  -1.32667e+00 0.00000e+00 0.00000e+00 3.65889e+00 323.175 6.11312e+01 143.175 0.7299 
1 1 1 1   89  5  o 17 2.81432e+00 7.67194e-01 1.08883e+02 21.160  3.84484e+00  1.48821e+00  0.00000e+00 0.00000e+00 1.81242e+01 201.160 1.27007e+02 201.160 0.8681 
1 1 1 1   89  6  o 5  5.10880e+00 7.98193e-01 6.77530e+01 113.646 -2.12440e+00 4.85186e+00  0.00000e+00 0.00000e+00 1.02976e+02 113.646 3.52230e+01 113.646 0.8998 
1 1 1 1   89  7  o 2  3.16545e+00 8.83441e-01 9.22197e+01 272.314 1.69475e-01  -4.19472e+00 0.00000e+00 0.00000e+00 1.01071e+01 272.314 8.21126e+01 92.314  0.8707 
1 1 1 1   89  8  o 7  3.23996e+00 9.71048e-01 1.07254e+02 320.408 3.84714e+00  -3.18176e+00 0.00000e+00 0.00000e+00 1.39593e-01 320.408 1.07115e+02 140.408 0.8932 
1 1 1 1   89  9  f 0  6.94789e+00 9.99260e-01 1.38449e+02 300.097 7.94034e+00  -1.36992e+01 0.00000e+00 0.00000e+00 1.10987e+02 300.097 2.74615e+01 120.097 0.9679 
1 1 1 1   89  10 o 18 8.17335e+00 1.04732e+00 1.57551e+02 232.773 -1.16448e+01 -1.53268e+01 0.00000e+00 0.00000e+00 1.37473e+02 232.773 2.00778e+01 52.774  0.9737 
1 1 1 1   89  11 o 9  3.13164e+00 9.77538e-01 3.65251e+01 331.697 1.85125e+00  -9.96938e-01 0.00000e+00 0.00000e+00 4.63093e+01 331.697 9.78424e+00 331.697 0.7139 
1 1 1 1   89  12 o 1  4.18971e+00 1.25348e+00 8.74303e+01 109.289 -1.99161e+00 5.69062e+00  0.00000e+00 0.00000e+00 5.41691e+01 109.289 3.32612e+01 289.289 0.9128 
1 1 1 1   89  13 o 2  2.98873e+00 9.83718e-01 5.46356e+01 215.575 -2.92811e+00 -2.09440e+00 0.00000e+00 0.00000e+00 3.89316e+01 215.575 1.57040e+01 35.575  0.8462 
1 1 1 1   89  14 f 0  4.42933e+00 1.23693e+00 7.55652e+01 66.855  2.62538e+00  6.14180e+00  0.00000e+00 0.00000e+00 7.53738e+01 66.855  1.91334e-01 246.855 0.9218 
1 1 1 1   90  0  o 12 3.99401e+00 6.53208e-01 9.15854e+01 38.225  3.50570e+00  2.76123e+00  0.00000e+00 0.00000e+00 3.89110e+01 38.225  5.26744e+01 218.225 0.8792 
1 1 1 1   90  1  o 16 3.86403e+00 6.56175e-01 9.57374e+01 96.793  -5.32846e-01 4.47350e+00  0.00000e+00 0.00000e+00 3.06944e+01 96.793  6.50430e+01 276.793 0.8805 
1 1 1 1   90  2  o 16 5.13816e+00 6.13346e-01 2.97408e+01 1.462   2.06935e+00  5.28095e-02  0.00000e+00 0.00000e+00 1.05620e+02 1.462   7.58794e+01 1.462   0.7089 
1 1 1 1   90  3  o 3  4.79153e+00 6.50802e-01 4.64227e+01 124.703 -1.73511e+00 2.50556e+00  0.00000e+00 0.00000e+00 9.83978e+01 124.703 5.19751e+01 124.703 0.8135 
1 1 1 1   90  4  o 1  1.16867e+01 4.69980e-01 2.39360e+02 248.746 -1.44836e+01 -3.72362e+01 0.00000e+00 0.00000e+00 1.89322e+02 248.746 5.00383e+01 68.746  0.9874 
1 1 1 1   90  5  o 17 4.51162e+00 8.72842e-01 8.85578e+01 71.214  1.70946e+00  5.02551e+00  0.00000e+00 0.00000e+00 6.22617e+01 71.214  2.62961e+01 251.214 0.9001 
1 1 1 1   90  6  o 10 9.03566e+00 6.01802e-01 1.32670e+02 279.414 3.18527e+00  -1.92116e+01 0.00000e+00 0.00000e+00 1.94088e+02 279.414 6.14182e+01 279.414 0.9740 
1 1 1 1   90  7  o 9  5.74791e+00 9.35128e-01 9.50185e+01 139.117 -5.63607e+00 4.87915e+00  0.00000e+00 0.00000e+00 1.03449e+02 139.117 8.43040e+00 139.117 0.9303 
1 1 1 1   90  8  o 3  3.14054e+00 8.78591e-01 5.38518e+01 193.813 -2.65591e+00 -6.52994e-01 0.00000e+00 0.00000e+00 3.79995e+01 193.813 1.58522e+01 13.813  0.7883 
1 1 1 1   90  9  o 15 8.18645e+00 9.91800e-01 1.63573e+02 33.176  1.78651e+01  1.16799e+01  0.00000e+00 0.00000e+00 1.32805e+02 33.176  3.07684e+01 213.176 0.9763 
1 1 1 1   90  10 o 12 7.41880e+00 1.05589e+00 1.57989e+02 282.581 4.12094e+00  -1.84641e+01 0.00000e+00 0.00000e+00 1.09604e+02 282.581 4.83848e+01 102.581 0.9732 
1 1 1 1   90  11 o 6  2.72936e+00 9.24688e-01 6.32789e+01 42.594  2.39976e+00  2.20620e+00  0.00000e+00 0.00000e+00 2.03787e+01 42.594  4.29002e+01 222.594 0.8275 
1 1 1 1   90  12 o 14 3.80820e+00 1.18080e+00 4.91928e+01 355.376 3.41739e+00  -2.76415e-01 0.00000e+00 0.00000e+00 6.88346e+01 355.376 1.96419e+01 355.376 0.8373 
1 1 1 1   90  13 o 9  4.37705e+00 1.26787e+00 5.40616e+01 247.239 -1.66154e+00 -3.96016e+00 0.00000e+00 0.00000e+00 8.74371e+01 247.239 3.33755e+01 247.239 0.8740 
1 1 1 1   90  14 o 1  4.75215e+00 1.32930e+00 7.08673e+01 141.381 -4.99252e+00 3.98824e+00  0.00000e+00 0.00000e+00 9.03750e+01 141.381 1.95077e+01 141.381 0.9180 
1 1 1 1   91  0  o 7  2.95485e+00 7.17176e-01 7.51159e+01 5.467   2.77212e+00  2.65337e-01  0.00000e+00 0.00000e+00 1.19085e+01 5.467   6.32074e+01 185.467 0.7927 
1 1 1 1   91  1  o 3  3.71417e+00 6.90266e-01 7.85258e+01 191.631 -3.61272e+00 -7.43609e-01 0.00000e+00 0.00000e+00 3.88179e+01 191.631 3.97079e+01 11.631  0.8504 
1 1 1 1   91  2  o 18 5.40664e+00 6.03769e-01 1.26740e+02 286.164 2.65203e+00  -9.14960e+00 0.00000e+00 0.00000e+00 6.32654e+01 286.164 6.34746e+01 106.164 0.9460 
1 1 1 1   91  3  o 4  4.08944e+00 7.26102e-01 6.65106e+01 280.067 6.61420e-01  -3.72571e+00 0.00000e+00 0.00000e+00 6.33205e+01 280.067 3.19008e+00 100.067 0.8547 
1 1 1 1   91  4  o 16 8.62967e+00 4.99193e-01 1.59004e+02 293.848 8.66998e+00  -1.96125e+01 0.00000e+00 0.00000e+00 1.53937e+02 293.848 5.06665e+00 113.849 0.9764 
1 1 1 1   91  5  o 17 6.66130e+00 6.58475e-01 1.35917e+02 89.541  1.17721e-01  1.47005e+01  0.00000e+00 0.00000e+00 1.02859e+02 89.541  3.30578e+01 269.541 0.9654 
1 1 1 1   91  6  o 1  3.63603e+00 8.22037e-01 1.05791e+02 125.396 -3.30167e+00 4.64667e+00  0.00000e+00 0.00000e+00 1.66852e+01 125.396 8.91063e+01 305.396 0.9074 
1 1 1 1   91  7  o 18 8.45335e+00 9.24023e-01 1.12708e+02 306.365 8.03138e+00  -1.09074e+01 0.00000e+00 0.00000e+00 1.89160e+02 306.365 7.64515e+01 306.365 0.9623 
1 1 1 1   91  8  o 8  1.15388e+01 6.43302e-01 2.08509e+02 71.164  1.35373e+01  3.96833e+01  0.00000e+00 0.00000e+00 2.14347e+02 71.164  5.83774e+00 71.164  0.9880 
1 1 1 1   91  9  o 11 1.07704e+01 7.07640e-01 2.08285e+02 214.366 -3.45290e+01 -2.36128e+01 0.00000e+00 0.00000e+00 1.86212e+02 214.366 2.20728e+01 34.366  0.9880 
1 1 1 1   91  10 o 1  4.75577e+00 1.21349e+00 6.33021e+01 193.616 -4.36860e+00 -1.05819e+00 0.00000e+00 0.00000e+00 9.18027e+01 193.616 2.85005e+01 193.616 0.8802 
1 1 1 1   91  11 o 2  3.30170e+00 1.04862e+00 5.05784e+01 41.910  2.28596e+00  2.05178e+00  0.00000e+00 0.00000e+00 4.90874e+01 41.910  1.49101e+00 221.910 0.8151 
1 1 1 1   91  12 o 2  3.87574e+00 1.19242e+00 7.13461e+01 147.229 -4.43000e+00 2.85181e+00  0.00000e+00 0.00000e+00 5.76341e+01 147.229 1.37120e+01 327.228 0.8993 
1 1 1 1   91  13 o 11 3.45812e+00 1.12871e+00 2.55116e+01 279.682 3.25763e-01  -1.90941e+00 0.00000e+00 0.00000e+00 6.23628e+01 279.682 3.68512e+01 279.682 0.6872 
1 1 1 1   91  14 o 9  3.46587e+00 1.15517e+00 4.38384e+01 88.387  1.02345e-01  3.63467e+00  0.00000e+00 0.00000e+00 6.47515e+01 88.387  2.09130e+01 88.387  0.8479 
1 1 1 1   92  0  o 2  2.50515e+00 6.68402e-01 8.83994e+01 58.949  1.56440e+00  2.59840e+00  0.00000e+00 0.00000e+00 1.28074e+01 238.949 1.01207e+02 238.949 0.8124 
1 1 1 1   92  1  o 4  3.09282e+00 7.02798e-01 1.25395e+02 11.062  5.14775e+00  1.00637e+00  0.00000e+00 0.00000e+00 2.21463e+01 191.062 1.47541e+02 191.062 0.8988 
1 1 1 1   92  2  f 0  3.70630e+00 7.32240e-01 3.23289e+01 220.333 -1.26719e+00 -1.07589e+00 0.00000e+00 0.00000e+00 5.49144e+01 220.333 2.25854e+01 220.333 0.6338 
1 1 1 1   92  3  o 5  8.83909e+00 5.11034e-01 9.08730e+01 165.409 -1.13790e+01 2.96215e+00  0.00000e+00 0.00000e+00 2.23100e+02 165.409 1.32227e+02 165.409 0.9565 
1 1 1 1   92  4  o 13 6.88486e+00 5.53096e-01 9.74224e+01 57.880  5.23943e+00  8.34600e+00  0.00000e+00 0.00000e+00 1.44876e+02 57.880  4.74540e+01 57.880  0.9478 
1 1 1 1   92  5  o 14 5.30991e+00 7.36270e-01 6.24599e+01 223.204 -3.69909e+00 -3.47423e+00 0.00000e+00 0.00000e+00 1.13975e+02 223.204 5.15149e+01 223.204 0.8951 
1 1 1 1   92  6  o 1  1.32359e+01 5.77190e-01 1.87152e+02 307.039 2.36323e+01  -3.13162e+01 0.00000e+00 0.00000e+00 2.97743e+02 307.039 1.10590e+02 307.039 0.9872 
1 1 1 1   92  7  o 13 2.91476e+00 9.02336e-01 1.13334e+01 329.619 4.57199e-01  -2.68037e-01 0.00000e+00 0.00000e+00 1.63589e+01 329.619 5.02548e+00 329.619 0.2561 
1 1 1 1   92  8  o 2  6.93930e+00 8.01170e-01 1.11665e+02 8.031   1.41712e+01  1.99953e+00  0.00000e+00 0.00000e+00 1.36500e+02 8.031   2.48359e+01 8.031   0.9644 
1 1 1 1   92  9  o 6  2.88276e+00 8.86089e-01 4.63867e+01 236.316 -1.21539e+00 -1.82352e+00 0.00000e+00 0.00000e+00 3.12742e+01 236.316 1.51126e+01 56.316  0.7268 
1 1 1 1   92  10 o 11 4.63238e+00 1.09625e+00 1.20018e+02 236.607 -5.09820e+00 -7.73388e+00 0.00000e+00 0.00000e+00 4.20405e+01 236.607 7.79771e+01 56.607  0.9444 
1 1 1 1   92  11 o 2  2.65162e+00 9.05897e-01 4.29427e+01 342.759 2.17493e+00  -6.74956e-01 0.00000e+00 0.00000e+00 2.95486e+01 342.759 1.33941e+01 162.759 0.7384 
1 1 1 1   92  12 o 19 5.28096e+00 1.33187e+00 1.12088e+02 149.964 -8.17247e+00 4.72521e+00  0.00000e+00 0.00000e+00 7.26367e+01 149.964 3.94518e+01 329.964 0.9455 
1 1 1 1   92  13 o 9  4.83641e+00 1.40966e+00 1.10491e+02 303.253 4.91200e+00  -7.49108e+00 0.00000e+00 0.00000e+00 5.80179e+01 303.253 5.24732e+01 123.253 0.9424 
1 1 1 1   93  0  o 5  9.54307e+00 4.59993e-01 1.47171e+02 92.805  -9.83220e-01 2.00640e+01  0.00000e+00 0.00000e+00 1.98260e+02 92.805  5.10892e+01 92.805  0.9748 
1 1 1 1   93  1  o 2  2.57911e+00 7.11141e-01 3.35294e+01 183.480 -1.14405e+00 -6.95736e-02 0.00000e+00 0.00000e+00 1.39531e+01 183.480 1.95764e+01 3.480   0.4958 
1 1 1 1   93  2  o 16 2.29702e+01 4.84894e-01 3.53137e+02 247.970 -4.77560e+01 -1.18021e+02 0.00000e+00 0.00000e+00 4.96433e+02 247.970 1.43296e+02 247.970 0.9961 
1 1 1 1   93  3  o 2  5.11687e+00 6.27843e-01 1.16485e+02 34.942  7.01514e+00  4.90140e+00  0.00000e+00 0.00000e+00 6.20217e+01 34.942  5.44629e+01 214.942 0.9396 
1 1 1 1   93  4  o 18 4.25316e+00 7.24046e-01 8.92149e+01 104.504 -1.46357e+00 5.65736e+00  0.00000e+00 0.00000e+00 5.44357e+01 104.504 3.47792e+01 284.504 0.9099 
1 1 1 1   93  5  o 2  7.70229e+00 6.18875e-01 9.49353e+01 106.922 -3.42806e+00 1.12672e+01  0.00000e+00 0.00000e+00 1.78497e+02 106.922 8.35617e+01 106.922 0.9566 
1 1 1 1   93  6  o 1  4.70089e+00 8.30685e-01 6.02076e+01 9.758   4.14964e+00  7.13615e-01  0.00000e+00 0.00000e+00 9.17310e+01 9.758   3.15234e+01 9.758   0.8712 
1 1 1 1   93  7  o 7  2.23918e+00 7.50663e-01 3.51897e+01 283.202 3.17520e-01  -1.35351e+00 0.00000e+00 0.00000e+00 1.19654e+01 283.202 2.32243e+01 103.202 0.5678 
1 1 1 1   93  8  o 15 2.93326e+00 8.70477e-01 9.13784e+01 58.663  2.38032e+00  3.90920e+00  0.00000e+00 0.00000e+00 4.59354e+00 58.663  8.67849e+01 238.663 0.8825 
1 1 1 1   93  9  o 12 8.23664e+00 8.57208e-01 1.86673e+02 177.468 -2.75356e+01 1.21757e+00  0.00000e+00 0.00000e+00 1.12948e+02 177.468 7.37250e+01 357.468 0.9817 
1 1 1 1   93  10 f 0  3.27584e+00 9.63477e-01 6.94227e+01 29.619  3.84650e+00  2.18680e+00  0.00000e+00 0.00000e+00 3.71061e+01 29.619  3.23165e+01 209.619 0.8781 
1 1 1 1   93  11 o 5  8.43647e+00 1.06987e+00 1.04382e+02 198.637 -1.57869e+01 -5.32434e+00 0.00000e+00 0.00000e+00 1.98354e+02 198.637 9.39716e+01 198.637 0.9695 
1 1 1 1   93  12 o 6  4.15643e+00 1.26140e+00 1.03686e+02 30.790  6.68949e+00  3.98621e+00  0.00000e+00 0.00000e+00 3.98119e+01 30.790  6.38744e+01 210.790 0.9334 
1 1 1 1   93  13 o 15 3.18860e+00 1.06253e+00 5.95688e+01 192.069 -4.44264e+00 -9.49893e-01 0.00000e+00 0.00000e+00 4.43305e+01 192.069 1.52383e+01 12.069  0.8816 
1 1 1 1   94  0  o 5  5.40846e+00 6.16046e-01 1.57613e+02 180.266 -1.28241e+01 -5.96527e-02 0.00000e+00 0.00000e+00 3.51750e+01 180.266 1.22438e+02 0.267   0.9602 
1 1 1 1   94  1  o 7  1.55843e+01 4.44337e-01 2.35686e+02 254.765 -1.49065e+01 -5.47319e+01 0.00000e+00 0.00000e+00 3.37747e+02 254.765 1.02061e+02 254.765 0.9911 
1 1 1 1   94  2  o 1  2.87022e+00 7.15548e-01 5.98767e+01 12.488  2.33442e+00  5.16998e-01  0.00000e+00 0.00000e+00 2.03122e+01 12.488  3.95645e+01 192.488 0.7526 
1 1 1 1   94  3  o 8  9.66569e+00 4.82991e-01 1.38032e+02 73.358  6.42293e+00  2.14882e+01  0.00000e+00 0.00000e+00 2.12648e+02 73.358  7.46158e+01 73.358  0.9774 
1 1 1 1   94  4  o 9  9.99388e+00 5.04159e-01 1.47413e+02 14.708  2.36964e+01  6.21996e+00  0.00000e+00 0.00000e+00 2.15827e+02 14.708  6.84144e+01 14.708  0.9794 
1 1 1 1   94  5  o 12 4.80625e+00 7.61987e-01 1.20996e+02 10.166  8.44610e+00  1.51459e+00  0.00000e+00 0.00000e+00 4.65924e+01 10.166  7.44036e+01 190.166 0.9398 
1 1 1 1   94  6  o 11 3.91652e+00 8.22148e-01 5.05969e+01 274.557 2.43361e-01  -3.05326e+00 0.00000e+00 0.00000e+00 6.77316e+01 274.557 1.71346e+01 274.557 0.8145 
1 1 1 1   94  7  o 12 3.04047e+00 8.05466e-01 2.16619e+01 149.195 -9.96199e-01 5.93976e-01  0.00000e+00 0.00000e+00 3.47252e+01 149.195 1.30633e+01 149.195 0.5002 
1 1 1 1   94  8  o 10 8.76480e+00 7.40040e-01 1.42572e+02 221.887 -1.70630e+01 -1.53026e+01 0.00000e+00 0.00000e+00 1.75112e+02 221.887 3.25400e+01 221.887 0.9779 
1 1 1 1   94  9  o 7  2.49293e+00 8.00663e-01 6.92237e+01 259.041 -6.25283e-01 -3.22915e+00 0.00000e+00 0.00000e+00 7.36211e+00 259.041 6.18616e+01 79.041  0.8293 
1 1 1 1   94  10 o 8  6.55540e+00 1.07052e+00 1.25636e+02 94.269  -1.04854e+00 1.40481e+01  0.00000e+00 0.00000e+00 1.08301e+02 94.269  1.73348e+01 274.269 0.9638 
1 1 1 1   94  11 o 15 2.95330e+00 9.04983e-01 6.40087e+01 358.783 4.29542e+00  -9.12485e-02 0.00000e+00 0.00000e+00 3.15061e+01 358.783 3.25026e+01 178.783 0.8740 
1 1 1 1   94  12 o 5  6.66847e+00 1.29859e+00 1.35626e+02 76.786  3.58074e+00  1.52497e+01  0.00000e+00 0.00000e+00 1.02961e+02 76.786  3.26650e+01 256.786 0.9675 
1 1 1 1   94  13 o 14 3.34045e+00 1.12754e+00 8.25910e+01 199.374 -5.73645e+00 -2.01724e+00 0.00000e+00 0.00000e+00 3.01801e+01 199.374 5.24108e+01 19.374  0.9136 
1 1 1 1   95  0  o 12 7.67033e+00 5.20172e-01 1.23856e+02 149.569 -1.39973e+01 8.22246e+00  0.00000e+00 0.00000e+00 1.51910e+02 149.569 2.80532e+01 149.569 0.9687 
1 1 1 1   95  1  o 15 4.36137e+00 7.02276e-01 1.26164e+02 188.515 -8.68156e+00 -1.29987e+00 0.00000e+00 0.00000e+00 2.61868e+01 188.515 9.99772e+01 8.516   0.9412 
1 1 1 1   95  2  o 8  1.09336e+01 4.63253e-01 2.02420e+02 89.691  2.01458e-01  3.73964e+01  0.00000e+00 0.00000e+00 1.97894e+02 89.691  4.52555e+00 269.691 0.9865 
1 1 1 1   95  3  f 0  1.24261e+01 4.89655e-01 1.57203e+02 288.984 1.06229e+01  -3.08790e+01 0.00000e+00 0.00000e+00 2.96794e+02 288.984 1.39591e+02 288.984 0.9846 
1 1 1 1   95  4  o 10 6.97904e+00 5.73295e-01 1.17512e+02 75.135  3.60080e+00  1.35660e+01  0.00000e+00 0.00000e+00 1.32023e+02 75.135  1.45111e+01 75.135  0.9637 
1 1 1 1   95  5  o 6  1.48909e+01 5.20327e-01 3.04544e+02 261.971 -1.06474e+01 -7.54804e+01 0.00000e+00 0.00000e+00 2.44174e+02 261.971 6.03697e+01 81.971  0.9934 
1 1 1 1   95  6  o 6  1.07430e+01 5.75073e-01 1.47924e+02 58.106  1.56312e+01  2.51185e+01  0.00000e+00 0.00000e+00 2.43660e+02 58.106  9.57355e+01 58.106  0.9830 
1 1 1 1   95  7  o 15 6.72752e+00 7.59401e-01 1.09654e+02 222.241 -9.67913e+00 -8.78919e+00 0.00000e+00 0.00000e+00 1.29994e+02 222.241 2.03407e+01 222.241 0.9610 
1 1 1 1   95  8  o 12 5.15667e+00 9.15253e-01 9.05910e+01 235.987 -4.21258e+00 -6.24243e+00 0.00000e+00 0.00000e+00 8.73025e+01 235.987 3.28850e+00 55.987  0.9310 
1 1 1 1   95  9  o 17 5.52666e+00 1.01420e+00 5.80227e+01 49.204  3.71239e+00  4.30140e+00  0.00000e+00 0.00000e+00 1.27650e+02 49.204  6.96273e+01 49.204  0.9071 
1 1 1 1   95  10 o 9  2.81880e+00 8.79788e-01 2.53928e+01 98.463  -2.19136e-01 1.47285e+00  0.00000e+00 0.00000e+00 3.65247e+01 98.463  1.11320e+01 98.463  0.5934 
1 1 1 1   95  11 o 5  2.83901e+00 9.18968e-01 2.56527e+01 81.383  2.60973e-01  1.72206e+00  0.00000e+00 0.00000e+00 4.26625e+01 81.383  1.70098e+01 81.383  0.6505 
1 1 1 1   95  12 o 13 3.28506e+00 9.85720e-01 3.71518e+01 1.138   3.13409e+00  6.22309e-02  0.00000e+00 0.00000e+00 6.23697e+01 1.138   2.52179e+01 1.138   0.8195 
1 1 1 1   95  13 o 4  2.78303e+00 9.45901e-01 6.51653e+01 4.674   4.99372e+00  4.08273e-01  0.00000e+00 0.00000e+00 2.67098e+01 4.674   3.84555e+01 184.674 0.8936 
1 1 1 1   96  0  f 0  5.54113e+00 6.47825e-01 4.57476e+01 32.155  3.42962e+00  2.15603e+00  0.00000e+00 0.00000e+00 1.32191e+02 32.155  8.64432e+01 32.155  0.8655 
1 1 1 1   96  1  f 0  6.35177e+00 5.45696e-01 1.14110e+02 60.697  5.87605e+00  1.04699e+01  0.00000e+00 0.00000e+00 1.11533e+02 60.697  2.57686e+00 240.697 0.9574 
1 1 1 1   96  2  o 12 3.95777e+00 7.20047e-01 7.76606e+01 295.137 2.00753e+00  -4.27850e+00 0.00000e+00 0.00000e+00 5.25346e+01 295.137 2.51260e+01 115.137 0.8866 
1 1 1 1   96  3  o 1  9.92127e+00 4.92867e-01 2.07156e+02 281.452 6.84561e+00  -3.37924e+01 0.00000e+00 0.00000e+00 1.55534e+02 281.452 5.16216e+01 101.452 0.9854 
1 1 1 1   96  4  o 19 7.34611e+00 5.64200e-01 5.76607e+01 90.276  -3.69083e-02 7.65749e+00  0.00000e+00 0.00000e+00 1.96353e+02 90.276  1.38692e+02 90.276  0.9322 
1 1 1 1   96  5  o 13 2.40363e+00 7.19995e-01 2.98638e+01 209.877 -1.00672e+00 -5.78351e-01 0.00000e+00 0.00000e+00 1.47523e+01 209.877 1.51115e+01 29.877  0.5005 
1 1 1 1   96  6  o 16 4.03212e+00 8.48417e-01 6.98366e+01 151.335 -4.25597e+00 2.32671e+00  0.00000e+00 0.00000e+00 6.31714e+01 151.335 6.66517e+00 331.335 0.8898 
1 1 1 1   96  7  o 7  5.27646e+00 8.43267e-01 1.23780e+02 320.471 8.89365e+00  -7.33900e+00 0.00000e+00 0.00000e+00 6.30812e+01 320.471 6.06987e+01 140.471 0.9556 
1 1 1 1   96  8  o 18 5.02249e+00 9.38005e-01 7.08009e+01 136.131 -4.38120e+00 4.21152e+00  0.00000e+00 0.00000e+00 9.91662e+01 136.131 2.83653e+01 136.131 0.9135 
1 1 1 1   96  9  o 12 3.91943e+00 1.01688e+00 8.52056e+01 18.714  5.93314e+00  2.00993e+00  0.00000e+00 0.00000e+00 4.77667e+01 18.714  3.74389e+01 198.714 0.9163 
1 1 1 1   96  10 o 2  1.64755e+01 7.49965e-01 2.48353e+02 244.971 -3.86836e+01 -8.28465e+01 0.00000e+00 0.00000e+00 3.58001e+02 244.971 1.09648e+02 244.971 0.9945 
1 1 1 1   96  11 o 11 3.83793e+00 1.07899e+00 6.64919e+01 116.192 -2.34283e+00 4.76300e+00  0.00000e+00 0.00000e+00 6.12654e+01 116.192 5.22652e+00 296.192 0.9001 
1 1 1 1   96  12 o 11 2.66418e+00 8.91323e-01 5.42242e+01 62.285  1.74682e+00  3.32504e+00  0.00000e+00 0.00000e+00 2.98110e+01 62.285  2.44131e+01 242.285 0.8534 
1 1 1 1   96  13 o 16 4.27383e+00 1.14033e+00 1.68894e+01 26.792  1.51071e+00  7.62859e-01  0.00000e+00 0.00000e+00 8.41663e+01 26.792  6.72769e+01 26.792  0.6402 
1 1 1 1   97  0  o 8  2.95782e+00 6.98057e-01 3.96147e+01 213.703 -1.52061e+00 -1.01425e+00 0.00000e+00 0.00000e+00 3.36094e+01 213.703 6.00528e+00 33.703  0.6674 
1 1 1 1   97  1  o 10 7.22790e+00 5.26521e-01 1.13457e+02 45.488  9.53960e+00  9.70355e+00  0.00000e+00 0.00000e+00 1.44614e+02 45.488  3.11565e+01 45.488  0.9625 
1 1 1 1   97  2  o 4  5.10213e+00 6.58109e-01 6.63559e+01 277.563 7.38064e-01  -5.55911e+00 0.00000e+00 0.00000e+00 1.05071e+02 277.563 3.87149e+01 277.563 0.9058 
1 1 1 1   97  3  o 9  5.49144e+00 6.71255e-01 1.13646e+02 69.912  3.71301e+00  1.01529e+01  0.00000e+00 0.00000e+00 8.03637e+01 69.912  3.32828e+01 249.912 0.9526 
1 1 1 1   97  4  o 18 3.29502e+00 7.95357e-01 4.97588e+01 126.417 -1.62310e+00 2.20016e+00  0.00000e+00 0.00000e+00 4.65531e+01 126.417 3.20566e+00 306.417 0.7882 
1 1 1 1   97  5  o 1  2.83546e+00 7.77353e-01 1.69231e+01 208.826 -7.31939e-01 -4.02816e-01 0.00000e+00 0.00000e+00 2.35560e+01 208.826 6.63289e+00 208.826 0.3851 
1 1 1 1   97  6  o 5  8.39588e+00 6.32692e-01 1.27565e+02 213.425 -1.68283e+01 -1.11065e+01 0.00000e+00 0.00000e+00 1.75793e+02 213.425 4.82279e+01 213.425 0.9749 
1 1 1 1   97  7  o 11 1.09333e+01 6.00871e-01 1.94820e+02 69.471  1.55464e+01  4.15170e+01  0.00000e+00 0.00000e+00 2.05659e+02 69.471  1.08397e+01 69.471  0.9887 
1 1 1 1   97  8  o 9  2.16007e+00 7.13263e-01 3.59717e+01 12.208  1.51683e+00  3.28172e-01  0.00000e+00 0.00000e+00 1.27229e+01 12.208  2.32488e+01 192.208 0.6087 
1 1 1 1   97  9  o 7  6.64240e+00 9.46428e-01 8.80705e+01 177.175 -1.08624e+01 5.36099e-01  0.00000e+00 0.00000e+00 1.46215e+02 177.175 5.81446e+01 177.175 0.9529 
1 1 1 1   97  10 o 5  4.00572e+00 1.04582e+00 1.05481e+02 85.065  6.99988e-01  8.10658e+00  0.00000e+00 0.00000e+00 3.32865e+01 85.065  7.21942e+01 265.065 0.9364 
1 1 1 1   97  11 o 19 3.39677e+00 1.03256e+00 4.44023e+01 243.306 -1.48377e+00 -2.95087e+00 0.00000e+00 0.00000e+00 5.98529e+01 243.306 1.54505e+01 243.306 0.8301 
1 1 1 1   97  12 o 7  2.56905e+00 8.72358e-01 3.62047e+01 11.402  2.60621e+00  5.25592e-01  0.00000e+00 0.00000e+00 3.79520e+01 11.402  1.74724e+00 11.402  0.7812 
1 1 1 1   97  13 o 15 3.18692e+00 1.03754e+00 4.18628e+01 165.347 -3.27727e+00 8.56918e-01  0.00000e+00 0.00000e+00 5.63923e+01 165.347 1.45295e+01 165.347 0.8350 
1 1 1 1   98  0  o 18 8.86642e+00 5.06190e-01 1.57331e+02 345.464 2.36134e+01  -6.12246e+00 0.00000e+00 0.00000e+00 1.64666e+02 345.464 7.33502e+00 345.464 0.9793 
1 1 1 1   98  1  o 5  4.13722e+00 7.27162e-01 1.43550e+02 314.211 6.19821e+00  -6.37122e+00 0.00000e+00 0.00000e+00 9.72833e-01 314.211 1.42577e+02 134.211 0.9419 
1 1 1 1   98  2  o 4  9.87513e+00 5.44981e-01 1.83143e+02 147.805 -2.78629e+01 1.75428e+01  0.00000e+00 0.00000e+00 1.77454e+02 147.805 5.68836e+00 327.805 0.9847 
1 1 1 1   98  3  o 6  5.87409e+00 6.17954e-01 9.17100e+01 149.824 -8.42451e+00 4.89844e+00  0.00000e+00 0.00000e+00 1.14598e+02 149.824 2.28884e+01 149.824 0.9472 
1 1 1 1   98  4  o 18 3.13667e+00 7.93437e-01 3.95217e+01 322.370 1.65932e+00  -1.27923e+00 0.00000e+00 0.00000e+00 4.33661e+01 322.370 3.84442e+00 322.370 0.7128 
1 1 1 1   98  5  o 16 2.47340e+00 7.31765e-01 2.02343e+01 173.498 -9.09131e-01 1.03613e-01  0.00000e+00 0.00000e+00 1.78533e+01 173.498 2.38100e+00 353.498 0.4155 
1 1 1 1   98  6  o 11 5.22006e+00 8.06880e-01 7.58533e+01 113.768 -2.61684e+00 5.94215e+00  0.00000e+00 0.00000e+00 1.01975e+02 113.768 2.61213e+01 113.768 0.9194 
1 1 1 1   98  7  o 4  6.58290e+00 8.07695e-01 9.37029e+01 304.428 6.30509e+00  -9.19883e+00 0.00000e+00 0.00000e+00 1.38923e+02 304.428 4.52206e+01 304.428 0.9541 
1 1 1 1   98  8  o 13 6.19536e+00 9.48207e-01 8.02292e+01 31.120  7.82043e+00  4.72127e+00  0.00000e+00 0.00000e+00 1.36205e+02 31.120  5.59757e+01 31.120  0.9436 
1 1 1 1   98  9  o 10 3.05143e+00 9.08424e-01 6.14328e+01 316.129 2.73855e+00  -2.63274e+00 0.00000e+00 0.00000e+00 3.51519e+01 316.129 2.62809e+01 136.129 0.8553 
1 1 1 1   98  10 o 10 3.18343e+00 9.38878e-01 6.71057e+01 120.321 -2.44721e+00 4.18445e+00  0.00000e+00 0.00000e+00 3.76539e+01 120.321 2.94518e+01 300.320 0.8897 
1 1 1 1   98  11 o 3  6.41080e+00 1.09564e+00 5.08140e+01 152.596 -5.92783e+00 3.07328e+00  0.00000e+00 0.00000e+00 1.67611e+02 152.596 1.16797e+02 152.596 0.9217 
1 1 1 1   98  12 o 18 2.87276e+00 9.42985e-01 6.97636e+01 25.960  4.70616e+00  2.29124e+00  0.00000e+00 0.00000e+00 2.55896e+01 25.960  4.41740e+01 205.960 0.8985 
1 1 1 1   99  0  o 13 9.49832e+00 4.98533e-01 1.91244e+02 346.625 2.99352e+01  -7.11754e+00 0.00000e+00 0.00000e+00 1.55133e+02 346.625 3.61104e+01 166.625 0.9836 
1 1 1 1   99  1  o 3  5.29963e+00 6.75687e-01 9.43549e+01 175.935 -7.92294e+00 5.63090e-01  0.00000e+00 0.00000e+00 8.93091e+01 175.935 5.04581e+00 355.935 0.9348 
1 1 1 1   99  2  o 14 2.53746e+00 7.21073e-01 5.95695e+01 14.570  2.52701e+00  6.56848e-01  0.00000e+00 0.00000e+00 1.34819e+01 14.570  4.60877e+01 194.570 0.7765 
1 1 1 1   99  3  o 12 5.26955e+00 6.79542e-01 1.21111e+02 290.411 3.98267e+00  -1.07026e+01 0.00000e+00 0.00000e+00 6.54673e+01 290.411 5.56434e+01 110.411 0.9552 
1 1 1 1   99  4  o 14 6.94402e+00 6.42262e-01 1.49032e+02 334.069 1.62270e+01  -7.89019e+00 0.00000e+00 0.00000e+00 1.01095e+02 334.069 4.79379e+01 154.069 0.9719 
1 1 1 1   99  5  o 2  5.63956e+00 7.86464e-01 8.94315e+01 94.619  -7.09848e-01 8.78559e+00  0.00000e+00 0.00000e+00 1.07299e+02 94.619  1.78671e+01 94.619  0.9414 
1 1 1 1   99  6  o 8  1.00837e+01 6.15007e-01 1.77169e+02 24.747  3.15116e+01  1.45252e+01  0.00000e+00 0.00000e+00 1.90938e+02 24.747  1.37695e+01 24.747  0.9855 
1 1 1 1   99  7  o 19 3.06446e+00 8.77887e-01 7.07086e+01 160.905 -3.67550e+00 1.27243e+00  0.00000e+00 0.00000e+00 2.67828e+01 160.905 4.39258e+01 340.905 0.8591 
1 1 1 1   99  8  o 9  1.66435e+01 6.44330e-01 2.85562e+02 340.599 1.06960e+02  -3.76680e+01 0.00000e+00 0.00000e+00 3.27762e+02 340.599 4.21992e+01 340.599 0.9956 
1 1 1 1   99  9  o 3  7.78052e+00 9.00995e-01 1.29058e+02 122.502 -1.09356e+01 1.71642e+01  0.00000e+00 0.00000e+00 1.51631e+02 122.502 2.25737e+01 122.502 0.9751 
1 1 1 1   99  10 o 15 6.03340e+00 1.11612e+00 1.40668e+02 290.771 5.69385e+00  -1.50120e+01 0.00000e+00 0.00000e+00 7.53626e+01 290.771 6.53057e+01 110.771 0.9683 
1 1 1 1   99  11 o 8  2.81428e+00 9.03110e-01 6.66979e+01 179.609 -5.06395e+00 3.45826e-02  0.00000e+00 0.00000e+00 2.63661e+01 179.609 4.03318e+01 359.609 0.8948 
1 1 1 1   99  12 o 4  3.49055e+00 1.06467e+00 4.61650e+01 17.336  3.74949e+00  1.17044e+00  0.00000e+00 0.00000e+00 6.47830e+01 17.336  1.86180e+01 17.336  0.8607 
1 1 1 1   100 0  o 18 7.20029e+00 5.55373e-01 1.13426e+02 46.067  9.78514e+00  1.01564e+01  0.00000e+00 0.00000e+00 1.43807e+02 46.067  3.03807e+01 46.067  0.9639 
1 1 1 1   100 1  o 10 5.09417e+00 6.90327e-01 8.83598e+01 245.402 -3.06757e+00 -6.70066e+00 0.00000e+00 0.00000e+00 8.71329e+01 245.402 1.22692e+00 65.402  0.9294 
1 1 1 1   100 2  o 7  7.13773e+00 5.76290e-01 1.54050e+02 92.948  -1.05346e+00 2.04588e+01  0.00000e+00 0.00000e+00 1.03956e+02 92.948  5.00942e+01 272.948 0.9753 
1 1 1 1   100 3  o 17 4.03232e+00 7.33633e-01 9.24982e+01 153.946 -5.61814e+00 2.74669e+00  0.00000e+00 0.00000e+00 4.44020e+01 153.946 4.80962e+01 333.946 0.9161 
1 1 1 1   100 4  o 3  2.99790e+00 7.90113e-01 3.66474e+01 331.484 1.79314e+00  -9.74248e-01 0.00000e+00 0.00000e+00 4.15915e+01 331.484 4.94411e+00 331.484 0.7043 
1 1 1 1   100 5  o 16 2.77964e+00 7.28030e-01 5.71474e+01 334.496 2.68887e+00  -1.28278e+00 0.00000e+00 0.00000e+00 2.60959e+01 334.496 3.10515e+01 154.496 0.8084 
1 1 1 1   100 6  o 15 3.82752e+00 9.32158e-01 8.13291e+01 202.379 -4.85445e+00 -1.99881e+00 0.00000e+00 0.00000e+00 4.60806e+01 202.379 3.52486e+01 22.379  0.8989 
1 1 1 1   100 7  o 18 4.37271e+00 9.46944e-01 5.67999e+01 342.349 4.38750e+00  -1.39613e+00 0.00000e+00 0.00000e+00 8.61881e+01 342.349 2.93882e+01 342.349 0.8833 
1 1 1 1   100 8  o 1  4.35482e+00 1.01096e+00 1.20090e+02 135.226 -6.60632e+00 6.55436e+00  0.00000e+00 0.00000e+00 3.21354e+01 135.226 8.79544e+01 315.226 0.9446 
1 1 1 1   100 9  o 8  9.48472e+00 7.85080e-01 1.17004e+02 196.226 -2.47316e+01 -7.19731e+00 0.00000e+00 0.00000e+00 2.26923e+02 196.226 1.09919e+02 196.226 0.9804 
1 1 1 1   100 10 o 7  1.01250e+01 8.69588e-01 1.92874e+02 310.120 3.06721e+01  -3.63984e+01 0.00000e+00 0.00000e+00 1.77460e+02 310.120 1.54133e+01 130.120 0.9894 
1 1 1 1   100 11 o 17 3.39307e+00 1.01928e+00 5.46680e+01 119.577 -2.17314e+00 3.82896e+00  0.00000e+00 0.00000e+00 5.53179e+01 119.577 6.49938e-01 119.577 0.8774 
1 1 1 1   100 12 f 0  2.38595e+00 8.18873e-01 1.80844e+01 251.940 -4.31309e-01 -1.32273e+00 0.00000e+00 0.00000e+00 3.19572e+01 251.940 1.38728e+01 251.940 0.5681 
1 1 1 1   101 0  o 13 6.64869e+00 6.20436e-01 1.42924e+02 239.146 -8.89937e+00 -1.48969e+01 0.00000e+00 0.00000e+00 9.62316e+01 239.146 4.66928e+01 59.146  0.9707 
1 1 1 1   101 1  o 4  8.21844e+00 5.41868e-01 1.39909e+02 33.036  1.86405e+01  1.21218e+01  0.00000e+00 0.00000e+00 1.57695e+02 33.036  1.77854e+01 33.036  0.9772 
1 1 1 1   101 2  o 16 8.27982e+00 5.59521e-01 1.75800e+02 182.491 -2.61828e+01 -1.13922e+00 0.00000e+00 0.00000e+00 1.25080e+02 182.491 5.07209e+01 2.491   0.9807 
1 1 1 1   101 3  o 10 1.05891e+01 5.11826e-01 1.59347e+02 214.900 -2.93807e+01 -2.04966e+01 0.00000e+00 0.00000e+00 2.27449e+02 214.900 6.81018e+01 214.900 0.9859 
1 1 1 1   101 4  o 12 1.92021e+00 6.32203e-01 2.29101e+01 302.271 4.17543e-01  -6.61231e-01 0.00000e+00 0.00000e+00 2.97229e+00 302.271 1.99378e+01 122.271 0.3639 
1 1 1 1   101 5  o 1  3.21924e+00 8.24176e-01 4.68850e+01 39.333  2.16269e+00  1.77225e+00  0.00000e+00 0.00000e+00 4.77403e+01 39.333  8.55323e-01 39.333  0.7937 
1 1 1 1   101 6  o 13 2.26894e+00 7.43112e-01 7.65423e+01 290.055 1.15318e+00  -3.15893e+00 0.00000e+00 0.00000e+00 6.51761e+00 110.055 8.30599e+01 110.055 0.8336 
1 1 1 1   101 7  o 1  5.14381e+00 9.10246e-01 1.00790e+02 346.255 9.67651e+00  -2.36683e+00 0.00000e+00 0.00000e+00 7.97556e+01 346.255 2.10344e+01 166.256 0.9484 
1 1 1 1   101 8  o 19 5.51786e+00 1.01242e+00 9.71645e+01 196.540 -9.74244e+00 -2.89334e+00 0.00000e+00 0.00000e+00 9.66443e+01 196.540 5.20208e-01 16.541  0.9494 
1 1 1 1   101 9  o 3  3.05581e+00 9.36719e-01 5.94726e+01 36.852  3.30601e+00  2.47791e+00  0.00000e+00 0.00000e+00 3.86496e+01 36.852  2.08230e+01 216.852 0.8684 
1 1 1 1   101 10 o 16 2.81604e+00 8.90924e-01 1.48632e+01 297.602 4.59154e-01  -8.78218e-01 0.00000e+00 0.00000e+00 3.12601e+01 297.602 1.63969e+01 297.602 0.4432 
1 1 1 1   101 11 o 10 3.88917e+00 1.06062e+00 6.94107e+01 183.997 -6.45038e+00 -4.50708e-01 0.00000e+00 0.00000e+00 6.26029e+01 183.997 6.80786e+00 3.997   0.9190 
1 1 1 1   101 12 f 0  7.31611e+00 1.35843e+00 1.50238e+02 296.457 9.14150e+00  -1.83698e+01 0.00000e+00 0.00000e+00 1.13132e+02 296.457 3.71060e+01 116.457 0.9753 
1 1 1 1   102 0  o 18 7.57044e+00 5.53934e-01 1.02135e+02 91.278  -3.41802e-01 1.53202e+01  0.00000e+00 0.00000e+00 1.68994e+02 91.278  6.68586e+01 91.278  0.9668 
1 1 1 1   102 1  o 9  2.74451e+00 7.69883e-01 5.19273e+01 152.082 -2.25660e+00 1.19570e+00  0.00000e+00 0.00000e+00 2.64316e+01 152.082 2.54957e+01 332.082 0.7707 
1 1 1 1   102 2  o 19 2.15044e+00 6.74245e-01 2.43801e+01 80.136  1.77083e-01  1.01844e+00  0.00000e+00 0.00000e+00 1.21201e+01 80.136  1.22600e+01 260.136 0.4582 
1 1 1 1   102 3  o 9  3.00506e+00 7.69092e-01 8.49136e+01 75.558  1.14677e+00  4.45265e+00  0.00000e+00 0.00000e+00 1.33821e+01 75.558  7.15315e+01 255.557 0.8831 
1 1 1 1   102 4  o 6  3.37292e+00 7.73688e-01 6.57581e+01 274.346 3.02708e-01  -3.98288e+00 0.00000e+00 0.00000e+00 4.20739e+01 274.346 2.36842e+01 94.346  0.8633 
1 1 1 1   102 5  f 0  2.48930e+00 7.65107e-01 1.00505e+02 303.807 2.57173e+00  -3.84054e+00 0.00000e+00 0.00000e+00 1.90511e+01 123.807 1.19556e+02 123.807 0.8838 
1 1 1 1   102 6  o 8  6.29187e+00 9.05917e-01 9.45313e+01 161.414 -1.07332e+01 3.60927e+00  0.00000e+00 0.00000e+00 1.27812e+02 161.414 3.32808e+01 161.414 0.9548 
1 1 1 1   102 7  o 4  3.98932e+00 9.68525e-01 6.18121e+01 332.769 4.01986e+00  -2.06866e+00 0.00000e+00 0.00000e+00 6.82161e+01 332.769 6.40405e+00 332.769 0.8809 
1 1 1 1   102 8  o 4  1.18495e+01 6.80803e-01 1.97565e+02 82.786  6.83894e+00  5.40268e+01  0.00000e+00 0.00000e+00 2.36628e+02 82.786  3.90633e+01 82.786  0.9908 
1 1 1 1   102 9  o 17 3.85712e+00 1.00295e+00 8.25653e+01 209.702 -5.71235e+00 -3.25851e+00 0.00000e+00 0.00000e+00 4.86781e+01 209.702 3.38872e+01 29.702  0.9205 
1 1 1 1   102 10 o 15 2.51333e+00 8.35984e-01 4.72933e+01 309.195 2.21707e+00  -2.71890e+00 0.00000e+00 0.00000e+00 3.08493e+01 309.195 1.64440e+01 129.195 0.8415 
1 1 1 1   102 11 o 10 3.64167e+00 1.03506e+00 7.69738e+01 58.655  3.79403e+00  6.22894e+00  0.00000e+00 0.00000e+00 4.78991e+01 58.655  2.90747e+01 238.654 0.9287 
1 1 1 1   102 12 o 15 2.48339e+00 8.43959e-01 5.41051e+01 258.612 -9.22493e-01 -4.57989e+00 0.00000e+00 0.00000e+00 2.70080e+01 258.612 2.70971e+01 78.612  0.8852 
1 1 1 1   103 0  o 8  6.54017e+00 6.40840e-01 1.11323e+02 140.243 -1.04852e+01 8.72273e+00  0.00000e+00 0.00000e+00 1.21829e+02 140.243 1.05062e+01 140.243 0.9626 
1 1 1 1   103 1  o 5  7.11987e+00 6.27743e-01 1.41042e+02 331.343 1.70224e+01  -9.30272e+00 0.00000e+00 0.00000e+00 1.15747e+02 331.343 2.52946e+01 151.343 0.9739 
1 1 1 1   103 2  o 7  7.22140e+00 5.84599e-01 1.45283e+02 109.148 -6.23138e+00 1.79461e+01  0.00000e+00 0.00000e+00 1.15005e+02 109.148 3.02776e+01 289.148 0.9733 
1 1 1 1   103 3  o 17 4.24981e+00 7.81284e-01 1.12797e+02 78.814  1.66888e+00  8.43923e+00  0.00000e+00 0.00000e+00 3.51147e+01 78.814  7.76820e+01 258.814 0.9399 
1 1 1 1   103 4  o 10 2.64176e+00 7.64105e-01 1.53700e+01 126.703 -4.22549e-01 5.66826e-01  0.00000e+00 0.00000e+00 1.72083e+01 126.703 1.83822e+00 126.703 0.3331 
1 1 1 1   103 5  o 10 4.64965e+00 8.78184e-01 7.40490e+01 115.569 -2.70828e+00 5.66040e+00  0.00000e+00 0.00000e+00 8.36658e+01 115.569 9.61684e+00 115.569 0.9164 
1 1 1 1   103 6  o 7  2.84467e+00 8.74425e-01 9.89858e+01 261.949 -7.75532e-01 -5.48244e+00 0.00000e+00 0.00000e+00 3.77900e+00 81.948  1.02765e+02 81.948  0.9045 
1 1 1 1   103 7  o 3  8.77415e+00 7.35547e-01 1.14439e+02 144.233 -1.84837e+01 1.33147e+01  0.00000e+00 0.00000e+00 2.02900e+02 144.233 8.84604e+01 144.233 0.9778 
1 1 1 1   103 8  o 6  4.86768e+00 1.05591e+00 5.88634e+01 349.779 5.70391e+00  -1.02845e+00 0.00000e+00 0.00000e+00 1.04745e+02 349.779 4.58814e+01 349.779 0.9091 
1 1 1 1   103 9  o 13 3.50346e+00 9.78599e-01 6.16692e+01 309.281 3.05639e+00  -3.73665e+00 0.00000e+00 0.00000e+00 5.34604e+01 309.281 8.20884e+00 129.281 0.8892 
1 1 1 1   103 10 o 3  4.10524e+00 1.09009e+00 7.29052e+01 124.212 -3.67972e+00 5.41207e+00  0.00000e+00 0.00000e+00 6.66040e+01 124.212 6.30128e+00 304.212 0.9201 
1 1 1 1   103 11 o 7  2.42923e+00 8.19559e-01 4.15926e+01 259.964 -5.48202e-01 -3.09760e+00 0.00000e+00 0.00000e+00 3.19562e+01 259.964 9.63642e+00 79.964  0.8202 
1 1 1 1   103 12 o 1  4.79331e+00 1.25932e+00 9.68930e+01 216.603 -8.48243e+00 -6.30027e+00 0.00000e+00 0.00000e+00 7.13397e+01 216.603 2.55533e+01 36.603  0.9514 
1 1 1 1   104 0  o 6  2.46874e+00 6.88801e-01 8.73827e+01 176.401 -4.11580e+00 2.58849e-01  0.00000e+00 0.00000e+00 8.03550e+00 356.401 9.54182e+01 356.401 0.8681 
1 1 1 1   104 1  o 19 3.40547e+00 7.49048e-01 3.30227e+01 101.967 -4.32110e-01 2.03861e+00  0.00000e+00 0.00000e+00 5.66325e+01 101.967 2.36099e+01 101.967 0.7111 
1 1 1 1   104 2  o 7  9.52343e+00 5.39869e-01 1.69491e+02 296.546 1.44624e+01  -2.89490e+01 0.00000e+00 0.00000e+00 1.77591e+02 296.546 8.09951e+00 296.546 0.9844 
1 1 1 1   104 3  o 6  7.23819e+00 6.32050e-01 1.44029e+02 335.865 1.76212e+01  -7.89512e+00 0.00000e+00 0.00000e+00 1.16878e+02 335.865 2.71512e+01 155.865 0.9738 
1 1 1 1   104 4  o 15 2.10173e+00 6.79318e-01 4.38080e+01 338.656 1.71757e+00  -6.71175e-01 0.00000e+00 0.00000e+00 8.34264e+00 338.656 3.54653e+01 158.656 0.6704 
1 1 1 1   104 5  o 8  2.08834e+00 6.95069e-01 3.88949e+01 264.000 -1.83136e-01 -1.74256e+00 0.00000e+00 0.00000e+00 1.15320e+01 264.000 2.73628e+01 84.000  0.6526 
1 1 1 1   104 6  o 17 7.00408e+00 8.37623e-01 1.16141e+02 189.049 -1.61171e+01 -2.56675e+00 0.00000e+00 0.00000e+00 1.34882e+02 189.049 1.87410e+01 189.049 0.9689 
1 1 1 1   104 7  o 6  4.09935e+00 9.36134e-01 1.18901e+02 248.859 -3.43888e+00 -8.89330e+00 0.00000e+00 0.00000e+00 2.45016e+01 248.859 9.43998e+01 68.859  0.9460 
1 1 1 1   104 8  o 15 5.04875e+00 9.58570e-01 8.28284e+01 65.231  4.05848e+00  8.79582e+00  0.00000e+00 0.00000e+00 9.38755e+01 65.231  1.10471e+01 65.231  0.9469 
1 1 1 1   104 9  o 11 5.17026e+00 1.02283e+00 9.55028e+01 272.088 3.92143e-01  -1.07562e+01 0.00000e+00 0.00000e+00 8.64105e+01 272.088 9.09233e+00 92.088  0.9523 
1 1 1 1   104 10 f 0  2.84953e+00 9.18694e-01 6.59973e+01 113.978 -2.09258e+00 4.70485e+00  0.00000e+00 0.00000e+00 2.83563e+01 113.978 3.76410e+01 293.978 0.8967 
1 1 1 1   104 11 o 11 5.11617e+00 1.25026e+00 1.29392e+02 342.187 1.39380e+01  -4.47855e+00 0.00000e+00 0.00000e+00 5.28423e+01 342.187 7.65501e+01 162.187 0.9652 
1 1 1 1   105 0  o 18 3.04325e+00 7.74753e-01 3.48314e+01 135.667 -1.44298e+00 1.40977e+00  0.00000e+00 0.00000e+00 4.40832e+01 135.667 9.25176e+00 135.667 0.7006 
1 1 1 1   105 1  o 9  5.28155e+00 7.98740e-01 8.52558e+01 228.776 -5.08811e+00 -5.80726e+00 0.00000e+00 0.00000e+00 9.70919e+01 228.776 1.18361e+01 228.776 0.9328 
1 1 1 1   105 2  f 0  4.45529e+00 7.86664e-01 1.54523e+02 9.821   1.24080e+01  2.14794e+00  0.00000e+00 0.00000e+00 3.68227e+00 9.821   1.50841e+02 189.821 0.9594 
1 1 1 1   105 3  o 19 1.00158e+01 5.45522e-01 1.77770e+02 89.893  7.11243e-02  3.79855e+01  0.00000e+00 0.00000e+00 1.87972e+02 89.893  1.02011e+01 89.893  0.9867 
1 1 1 1   105 4  o 9  8.98519e+00 5.91115e-01 1.36364e+02 272.880 1.33033e+00  -2.64399e+01 0.00000e+00 0.00000e+00 1.89751e+02 272.880 5.33871e+01 272.880 0.9809 
1 1 1 1   105 5  o 10 1.04423e+01 6.28809e-01 1.49071e+02 237.524 -2.01261e+01 -3.16205e+01 0.00000e+00 0.00000e+00 2.32019e+02 237.524 8.29483e+01 237.524 0.9866 
1 1 1 1   105 6  o 3  8.30956e+00 8.18015e-01 1.30936e+02 123.781 -1.30237e+01 1.94682e+01  0.00000e+00 0.00000e+00 1.69725e+02 123.781 3.87882e+01 123.781 0.9784 
1 1 1 1   105 7  o 19 4.22433e+00 9.73014e-01 1.21620e+02 345.999 1.01315e+01  -2.52631e+00 0.00000e+00 0.00000e+00 2.68665e+01 345.999 9.47531e+01 165.999 0.9508 
1 1 1 1   105 8  f 0  2.48508e+00 8.17887e-01 3.72066e+00 283.194 5.42259e-02  -2.31304e-01 0.00000e+00 0.00000e+00 7.11124e+00 283.194 3.39058e+00 283.194 0.1180 
1 1 1 1   105 9  o 6  3.36924e+00 9.58836e-01 7.44519e+01 65.878  2.70036e+00  6.03053e+00  0.00000e+00 0.00000e+00 4.01421e+01 65.878  3.43097e+01 245.878 0.9209 
1 1 1 1   105 10 o 10 6.11282e+00 1.09709e+00 1.33545e+02 229.284 -1.20727e+01 -1.40280e+01 0.00000e+00 0.00000e+00 8.59238e+01 229.284 4.76208e+01 49.284  0.9726 
1 1 1 1   105 11 o 5  3.13755e+00 9.67046e-01 4.74824e+01 50.690  2.72028e+00  3.32232e+00  0.00000e+00 0.00000e+00 5.36778e+01 50.690  6.19545e+00 50.690  0.8739 
1 1 1 1   106 0  o 9  9.91081e+00 5.36148e-01 1.56857e+02 76.979  7.37136e+00  3.18763e+01  0.00000e+00 0.00000e+00 2.04213e+02 76.979  4.73565e+01 76.979  0.9846 
1 1 1 1   106 1  o 8  1.10258e+01 5.31384e-01 1.93251e+02 230.600 -2.84883e+01 -3.46819e+01 0.00000e+00 0.00000e+00 2.10156e+02 230.600 1.69057e+01 230.600 0.9888 
1 1 1 1   106 2  o 17 4.30608e+00 7.58812e-01 7.69678e+01 262.208 -8.62481e-01 -6.30242e+00 0.00000e+00 0.00000e+00 6.92347e+01 262.208 7.73307e+00 82.208  0.9176 
1 1 1 1   106 3  o 18 1.82172e+00 6.10906e-01 5.03050e+01 314.035 1.36385e+00  -1.41056e+00 0.00000e+00 0.00000e+00 3.70371e+00 134.035 5.40087e+01 134.035 0.6914 
1 1 1 1   106 4  o 11 5.95516e+00 8.52076e-01 1.15518e+02 196.570 -1.31534e+01 -3.91361e+00 0.00000e+00 0.00000e+00 9.65776e+01 196.570 1.89405e+01 16.570  0.9628 
1 1 1 1   106 5  o 10 2.71869e+00 7.93366e-01 2.75045e+01 189.355 -1.50794e+00 -2.48411e-01 0.00000e+00 0.00000e+00 3.31254e+01 189.355 5.62090e+00 189.355 0.6030 
1 1 1 1   106 6  o 12 3.87001e+00 8.84615e-01 7.32554e+01 96.890  -6.88593e-01 5.69823e+00  0.00000e+00 0.00000e+00 5.66728e+01 96.890  1.65826e+01 276.890 0.9081 
1 1 1 1   106 7  o 12 3.25256e+00 9.31265e-01 5.29806e+01 148.879 -3.36688e+00 2.03268e+00  0.00000e+00 0.00000e+00 5.05025e+01 148.879 2.47804e+00 328.879 0.8609 
1 1 1 1   106 8  o 12 2.83930e+00 8.88102e-01 5.54679e+01 221.329 -2.91650e+00 -2.56482e+00 0.00000e+00 0.00000e+00 3.46208e+01 221.329 2.08472e+01 41.329  0.8589 
1 1 1 1   106 9  o 7  2.58411e+00 8.42628e-01 3.48027e+01 227.269 -1.65300e+00 -1.78937e+00 0.00000e+00 0.00000e+00 3.75082e+01 227.269 2.70542e+00 227.269 0.7579 
1 1 1 1   106 10 o 15 4.56141e+00 1.11251e+00 6.48413e+01 310.856 4.54884e+00  -5.25953e+00 0.00000e+00 0.00000e+00 9.08693e+01 310.856 2.60280e+01 310.856 0.9250 
1 1 1 1   106 11 o 6  2.86053e+00 9.23731e-01 4.40551e+01 11.064  4.17373e+00  8.16166e-01  0.00000e+00 0.00000e+00 4.80035e+01 11.064  3.94832e+00 11.064  0.8726 
1 1 1 1   107 0  o 5  5.24515e+00 7.56804e-01 1.29046e+02 171.481 -1.30615e+01 1.95641e+00  0.00000e+00 0.00000e+00 5.74808e+01 171.481 7.15655e+01 351.481 0.9614 
1 1 1 1   107 1  o 8  7.20946e+00 6.55269e-01 1.02842e+02 7.257   1.54239e+01  1.96403e+00  0.00000e+00 0.00000e+00 1.55123e+02 7.257   5.22810e+01 7.257   0.9673 
1 1 1 1   107 2  o 5  2.75774e+00 7.74178e-01 8.89980e+01 335.535 4.60996e+00  -2.09749e+00 0.00000e+00 0.00000e+00 2.28459e+00 335.535 8.67134e+01 155.535 0.8949 
1 1 1 1   107 3  o 1  5.33200e+00 7.79673e-01 1.03380e+02 1.865   1.14944e+01  3.74279e-01  0.00000e+00 0.00000e+00 8.50467e+01 1.865   1.83333e+01 181.865 0.9555 
1 1 1 1   107 4  o 4  5.24762e+00 8.74187e-01 8.80112e+01 154.677 -8.18643e+00 3.87363e+00  0.00000e+00 0.00000e+00 9.49911e+01 154.677 6.97992e+00 154.677 0.9431 
1 1 1 1   107 5  o 12 1.08133e+01 6.47026e-01 1.95166e+02 351.692 5.02569e+01  -7.33865e+00 0.00000e+00 0.00000e+00 2.00650e+02 351.692 5.48350e+00 351.692 0.9901 
1 1 1 1   107 6  o 1  3.71353e+00 9.52086e-01 7.56066e+01 266.642 -3.39330e-01 -5.78273e+00 0.00000e+00 0.00000e+00 4.91549e+01 266.642 2.64517e+01 86.642  0.9090 
1 1 1 1   107 7  o 11 4.49443e+00 8.66143e-01 8.53642e+01 121.565 -4.59249e+00 7.47524e+00  0.00000e+00 0.00000e+00 7.09163e+01 121.565 1.44479e+01 301.565 0.9412 
1 1 1 1   107 8  o 9  2.68091e+00 8.88591e-01 3.51622e+01 188.345 -2.33258e+00 -3.42148e-01 0.00000e+00 0.00000e+00 3.89522e+01 188.345 3.78998e+00 188.345 0.7486 
1 1 1 1   107 9  o 8  8.41104e+00 9.06746e-01 1.13739e+02 339.296 2.47617e+01  -9.35845e+00 0.00000e+00 0.00000e+00 1.90816e+02 339.296 7.70767e+01 339.296 0.9809 
1 1 1 1   107 10 o 19 3.22018e+00 9.09089e-01 3.63585e+01 189.404 -3.40485e+00 -5.63907e-01 0.00000e+00 0.00000e+00 6.32591e+01 189.404 2.69006e+01 189.404 0.8385 
1 1 1 1   107 11 o 4  2.90859e+00 9.33487e-01 7.74905e+01 214.195 -5.87195e+00 -3.98991e+00 0.00000e+00 0.00000e+00 2.18830e+01 214.195 5.56075e+01 34.196  0.9266 
1 1 1 1   108 0  o 7  3.38196e+00 8.30510e-01 6.38937e+01 256.949 -9.65189e-01 -4.16365e+00 0.00000e+00 0.00000e+00 4.53247e+01 256.949 1.85690e+01 76.949  0.8733 
1 1 1 1   108 1  o 15 8.13550e+00 6.02231e-01 1.21052e+02 351.926 2.18837e+01  -3.10432e+00 0.00000e+00 0.00000e+00 1.72916e+02 351.926 5.18639e+01 351.926 0.9771 
1 1 1 1   108 2  o 4  2.25937e+00 7.09938e-01 3.95962e+01 283.365 4.48824e-01  -1.88902e+00 0.00000e+00 0.00000e+00 1.78808e+01 283.365 2.17155e+01 103.365 0.6879 
1 1 1 1   108 3  o 5  5.45240e+00 7.93054e-01 8.97784e+01 180.152 -1.00965e+01 -2.68641e-02 0.00000e+00 0.00000e+00 1.01561e+02 180.152 1.17826e+01 180.152 0.9491 
1 1 1 1   108 4  o 10 3.99230e+00 8.85328e-01 9.00212e+01 79.093  1.39996e+00  7.26528e+00  0.00000e+00 0.00000e+00 4.71961e+01 79.093  4.28251e+01 259.093 0.9297 
1 1 1 1   108 5  o 6  2.78511e+00 8.39500e-01 5.90743e+01 217.219 -2.75964e+00 -2.09614e+00 0.00000e+00 0.00000e+00 2.73175e+01 217.219 3.17568e+01 37.219  0.8393 
1 1 1 1   108 6  o 9  5.09226e+00 9.50550e-01 3.49102e+01 219.968 -3.17987e+00 -2.66520e+00 0.00000e+00 0.00000e+00 1.28597e+02 219.968 9.36865e+01 219.968 0.8690 
1 1 1 1   108 7  o 12 3.90891e+00 1.01291e+00 7.17464e+01 135.527 -4.34532e+00 4.26612e+00  0.00000e+00 0.00000e+00 6.01745e+01 135.527 1.15719e+01 315.527 0.9137 
1 1 1 1   108 8  o 9  3.39655e+00 9.85939e-01 9.91672e+01 240.693 -4.12265e+00 -7.34446e+00 0.00000e+00 0.00000e+00 1.85346e+01 240.693 8.06326e+01 60.693  0.9386 
1 1 1 1   108 9  o 13 3.58695e+00 1.00901e+00 3.21430e+01 72.848  9.08167e-01  2.94258e+00  0.00000e+00 0.00000e+00 7.58276e+01 72.848  4.36846e+01 72.848  0.8157 
1 1 1 1   108 10 o 1  3.58913e+00 1.05218e+00 4.52659e+01 197.878 -4.08561e+00 -1.31786e+00 0.00000e+00 0.00000e+00 7.04180e+01 197.878 2.51521e+01 197.878 0.8739 
1 1 1 1   109 0  o 11 5.37263e+00 7.74137e-01 8.02529e+01 59.961  4.75781e+00  8.22797e+00  0.00000e+00 0.00000e+00 1.07610e+02 59.961  2.73570e+01 59.961  0.9458 
1 1 1 1   109 1  o 7  5.46979e+00 7.53431e-01 5.29727e+01 159.549 -5.74036e+00 2.14066e+00  0.00000e+00 0.00000e+00 1.31909e+02 159.549 7.89363e+01 159.549 0.9143 
1 1 1 1   109 2  o 10 3.26821e+00 8.30886e-01 6.67579e+01 218.217 -3.42708e+00 -2.69848e+00 0.00000e+00 0.00000e+00 3.90942e+01 218.217 2.76638e+01 38.217  0.8761 
1 1 1 1   109 3  o 12 7.20922e+00 6.81619e-01 9.10838e+01 240.280 -7.62999e+00 -1.33657e+01 0.00000e+00 0.00000e+00 1.66585e+02 240.280 7.55017e+01 240.280 0.9669 
1 1 1 1   109 4  o 7  6.15788e+00 7.88940e-01 1.28946e+02 342.099 1.62691e+01  -5.25524e+00 0.00000e+00 0.00000e+00 9.18717e+01 342.099 3.70742e+01 162.098 0.9703 
1 1 1 1   109 5  o 12 4.12891e+00 9.12172e-01 3.83558e+01 258.277 -7.27423e-01 -3.50545e+00 0.00000e+00 0.00000e+00 9.05822e+01 258.277 5.22264e+01 258.277 0.8452 
1 1 1 1   109 6  o 1  3.25880e+00 8.92664e-01 5.86154e+01 55.778  2.40799e+00  3.54030e+00  0.00000e+00 0.00000e+00 4.65341e+01 55.778  1.20813e+01 235.778 0.8735 
1 1 1 1   109 7  o 10 7.93566e+00 8.27618e-01 1.27830e+02 347.627 2.52445e+01  -5.53790e+00 0.00000e+00 0.00000e+00 1.59462e+02 347.627 3.16319e+01 347.627 0.9805 
1 1 1 1   109 8  o 8  4.85108e+00 1.03023e+00 8.22632e+01 132.253 -6.77710e+00 7.46020e+00  0.00000e+00 0.00000e+00 8.76554e+01 132.253 5.39216e+00 132.253 0.9490 
1 1 1 1   109 9  o 9  3.77901e+00 1.04173e+00 6.51499e+01 262.674 -7.89877e-01 -6.14368e+00 0.00000e+00 0.00000e+00 6.24504e+01 262.674 2.69952e+00 82.674  0.9153 
1 1 1 1   109 10 o 6  3.73134e+00 1.04987e+00 4.19902e+01 23.638  4.04949e+00  1.77240e+00  0.00000e+00 0.00000e+00 7.87963e+01 23.638  3.68060e+01 23.638  0.8779 
1 1 1 1   110 0  o 13 2.51799e+00 7.44731e-01 7.64956e+01 177.886 -4.38887e+00 1.62019e-01  0.00000e+00 0.00000e+00 5.12393e+00 177.886 7.13717e+01 357.886 0.8771 
1 1 1 1   110 1  o 11 2.44067e+00 7.43948e-01 4.96701e+01 208.026 -2.43911e+00 -1.29830e+00 0.00000e+00 0.00000e+00 2.16647e+01 208.026 2.80054e+01 28.026  0.7908 
1 1 1 1   110 2  o 6  6.09821e+00 7.33202e-01 7.42524e+01 181.932 -1.02664e+01 -3.46386e-01 0.00000e+00 0.00000e+00 1.39848e+02 181.932 6.55957e+01 181.932 0.9500 
1 1 1 1   110 3  o 3  2.68016e+00 7.19244e-01 5.64593e+01 135.330 -2.41860e+00 2.39087e+00  0.00000e+00 0.00000e+00 2.63124e+01 135.330 3.01469e+01 315.330 0.8358 
1 1 1 1   110 4  o 1  6.88628e+00 7.87463e-01 1.65414e+02 53.294  1.57626e+01  2.11427e+01  0.00000e+00 0.00000e+00 8.41343e+01 53.294  8.12800e+01 233.294 0.9809 
1 1 1 1   110 5  o 3  3.83895e+00 9.14155e-01 6.77794e+01 320.067 4.78822e+00  -4.00827e+00 0.00000e+00 0.00000e+00 6.21095e+01 320.067 5.66991e+00 140.067 0.9160 
1 1 1 1   110 6  f 0  6.05520e+00 8.72573e-01 1.10367e+02 97.725  -2.24497e+00 1.65495e+01  0.00000e+00 0.00000e+00 1.06428e+02 97.725  3.93912e+00 277.725 0.9696 
1 1 1 1   110 7  o 18 2.79284e+00 8.69186e-01 2.90468e+01 143.553 -1.81459e+00 1.34011e+00  0.00000e+00 0.00000e+00 4.67893e+01 143.553 1.77425e+01 143.553 0.7356 
1 1 1 1   110 8  o 13 2.59303e+00 8.57234e-01 2.99926e+01 226.722 -1.64032e+00 -1.74199e+00 0.00000e+00 0.00000e+00 4.20337e+01 226.722 1.20412e+01 226.722 0.7528 
1 1 1 1   110 9  o 12 2.56130e+00 8.30455e-01 1.47671e+01 50.201  8.31781e-01  9.98354e-01  0.00000e+00 0.00000e+00 3.64788e+01 50.201  2.17118e+01 50.201  0.5425 
1 1 1 1   110 10 o 17 4.22019e+00 1.11064e+00 7.47196e+01 273.368 4.82323e-01  -8.19549e+00 0.00000e+00 0.00000e+00 7.10303e+01 273.368 3.68926e+00 93.368  0.9370 
1 1 1 1   111 0  o 15 5.97608e+00 7.19276e-01 1.06058e+02 150.761 -1.27242e+01 7.12270e+00  0.00000e+00 0.00000e+00 1.07029e+02 150.761 9.71399e-01 150.761 0.9651 
1 1 1 1   111 1  f 0  4.54823e+00 7.79486e-01 8.76376e+01 52.866  5.21814e+00  6.89123e+00  0.00000e+00 0.00000e+00 7.03647e+01 52.866  1.72729e+01 232.866 0.9402 
1 1 1 1   111 2  o 15 2.12149e+00 6.83592e-01 5.71461e+01 25.126  2.54871e+00  1.19531e+00  0.00000e+00 0.00000e+00 5.19090e+00 25.126  5.19552e+01 205.126 0.7953 
1 1 1 1   111 3  o 15 2.89402e+00 8.36867e-01 8.47577e+01 271.397 1.33868e-01  -5.48929e+00 0.00000e+00 0.00000e+00 1.18497e+01 271.397 7.29080e+01 91.397  0.9036 
1 1 1 1   111 4  o 1  4.11187e+00 9.50628e-01 7.01940e+01 357.830 6.72870e+00  -2.54963e-01 0.00000e+00 0.00000e+00 6.98963e+01 357.830 2.97702e-01 177.830 0.9224 
1 1 1 1   111 5  o 6  3.33737e+00 8.88370e-01 6.40076e+01 304.930 2.96955e+00  -4.25207e+00 0.00000e+00 0.00000e+00 4.66005e+01 304.930 1.74072e+01 124.930 0.8975 
1 1 1 1   111 6  o 3  4.88474e+00 9.00426e-01 8.05164e+01 304.634 5.37342e+00  -7.77930e+00 0.00000e+00 0.00000e+00 8.99836e+01 304.634 9.46718e+00 304.634 0.9455 
1 1 1 1   111 7  f 0  5.46912e+00 9.69632e-01 5.41314e+01 270.263 3.36401e-02  -7.34120e+00 0.00000e+00 0.00000e+00 1.33392e+02 270.263 7.92608e+01 270.263 0.9292 
1 1 1 1   111 8  o 12 3.21817e+00 9.55449e-01 4.80481e+01 218.505 -3.27667e+00 -2.60681e+00 0.00000e+00 0.00000e+00 5.52687e+01 218.505 7.22057e+00 218.505 0.8704 
1 1 1 1   111 9  o 19 2.52074e+00 8.09993e-01 6.47335e+01 115.445 -2.37161e+00 4.98439e+00  0.00000e+00 0.00000e+00 1.92990e+01 115.445 4.54345e+01 295.445 0.9042 
1 1 1 1   112 0  o 15 5.25553e+00 7.71241e-01 8.78185e+01 41.120  8.13650e+00  7.10282e+00  0.00000e+00 0.00000e+00 9.70802e+01 41.120  9.26167e+00 41.120  0.9525 
1 1 1 1   112 1  o 11 2.52940e+00 7.43108e-01 1.02939e+02 70.478  2.07689e+00  5.85784e+00  0.00000e+00 0.00000e+00 1.74006e+01 250.478 1.20340e+02 250.478 0.9156 
1 1 1 1   112 2  o 9  4.12462e+00 8.74762e-01 9.41937e+01 200.694 -8.45408e+00 -3.19352e+00 0.00000e+00 0.00000e+00 4.94517e+01 200.694 4.47421e+01 20.694  0.9429 
1 1 1 1   112 3  o 5  1.05685e+01 6.01509e-01 1.51455e+02 342.247 4.63960e+01  -1.48539e+01 0.00000e+00 0.00000e+00 2.34811e+02 342.247 8.33561e+01 342.247 0.9897 
1 1 1 1   112 4  o 12 5.12458e+00 8.74659e-01 1.02229e+02 187.697 -1.17847e+01 -1.59266e+00 0.00000e+00 0.00000e+00 7.88488e+01 187.697 2.33799e+01 7.697   0.9570 
1 1 1 1   112 5  o 1  4.46733e+00 9.70555e-01 3.90260e+01 3.347   3.87421e+00  2.26580e-01  0.00000e+00 0.00000e+00 1.02596e+02 3.347   6.35696e+01 3.347   0.8588 
1 1 1 1   112 6  f 0  3.38502e+00 9.21066e-01 1.16662e+01 45.020  7.40466e-01  7.40990e-01  0.00000e+00 0.00000e+00 4.61701e+01 45.020  3.45039e+01 45.020  0.4630 
1 1 1 1   112 7  o 13 2.67949e+00 8.35708e-01 5.78704e+01 182.053 -4.87164e+00 -1.74613e-01 0.00000e+00 0.00000e+00 3.01435e+01 182.053 2.77269e+01 2.053   0.8904 
1 1 1 1   112 8  o 14 3.29222e+00 9.60418e-01 4.42602e+01 308.572 2.54803e+00  -3.19502e+00 0.00000e+00 0.00000e+00 6.09674e+01 308.572 1.67072e+01 308.572 0.8668 
1 1 1 1   112 9  o 18 2.72965e+00 8.75451e-01 3.92244e+01 276.743 4.48280e-01  -3.79149e+00 0.00000e+00 0.00000e+00 4.69101e+01 276.743 7.68568e+00 276.743 0.8561 
1 1 1 1   113 0  o 18 4.37008e+00 8.45883e-01 5.91999e+01 97.113  -7.81891e-01 6.26539e+00  0.00000e+00 0.00000e+00 8.87649e+01 97.113  2.95650e+01 97.113  0.9170 
1 1 1 1   113 1  o 5  5.00835e+00 8.33602e-01 7.36873e+01 326.089 7.53867e+00  -5.06781e+00 0.00000e+00 0.00000e+00 1.00746e+02 326.089 2.70590e+01 326.089 0.9432 
1 1 1 1   113 2  o 7  2.52178e+00 7.57037e-01 1.53446e+01 298.536 5.02091e-01  -9.23362e-01 0.00000e+00 0.00000e+00 2.78760e+01 298.536 1.25314e+01 298.536 0.4642 
1 1 1 1   113 3  o 17 2.38955e+00 7.41043e-01 3.26411e+01 215.015 -1.59426e+00 -1.11693e+00 0.00000e+00 0.00000e+00 2.81242e+01 215.015 4.51684e+00 35.015  0.6888 
1 1 1 1   113 4  o 13 4.04708e+00 8.94824e-01 3.18341e+01 132.538 -2.13634e+00 2.32828e+00  0.00000e+00 0.00000e+00 9.08333e+01 132.538 5.89992e+01 132.538 0.8211 
1 1 1 1   113 5  o 9  4.66910e+00 9.52763e-01 1.18163e+02 217.463 -1.03677e+01 -7.94468e+00 0.00000e+00 0.00000e+00 4.74097e+01 217.463 7.07531e+01 37.463  0.9609 
1 1 1 1   113 6  o 19 7.12249e+00 8.43948e-01 9.27930e+01 311.330 1.31670e+01  -1.49717e+01 0.00000e+00 0.00000e+00 1.63297e+02 311.330 7.05036e+01 311.330 0.9746 
1 1 1 1   113 7  o 6  2.99764e+00 8.89531e-01 5.25895e+01 223.511 -3.43269e+00 -3.25870e+00 0.00000e+00 0.00000e+00 4.54473e+01 223.511 7.14217e+00 43.511  0.8868 
1 1 1 1   113 8  o 7  3.41796e+00 9.66172e-01 1.23831e+01 218.108 -9.06135e-01 -7.10715e-01 0.00000e+00 0.00000e+00 5.03059e+01 218.108 3.79228e+01 218.108 0.4975 
1 1 1 1   113 9  o 18 2.10156e+00 7.21194e-01 3.21802e+01 205.176 -2.55593e+00 -1.20144e+00 0.00000e+00 0.00000e+00 2.94655e+01 205.176 2.71472e+00 25.176  0.7961 
1 1 1 1   114 0  o 1  4.08620e+00 8.45780e-01 6.39891e+01 344.862 6.41921e+00  -1.73654e+00 0.00000e+00 0.00000e+00 7.49884e+01 344.862 1.09992e+01 344.862 0.9214 
1 1 1 1   114 1  o 5  3.48460e+00 8.55771e-01 9.14386e+01 285.346 1.94232e+00  -7.07778e+00 0.00000e+00 0.00000e+00 2.80738e+01 285.346 6.33648e+01 105.346 0.9291 
1 1 1 1   114 2  o 17 2.65168e+00 7.87665e-01 4.39747e+01 52.692  1.85624e+00  2.43599e+00  0.00000e+00 0.00000e+00 3.57468e+01 52.692  8.22791e+00 232.692 0.8145 
1 1 1 1   114 3  o 7  2.78595e+00 8.15565e-01 5.62761e+01 275.403 3.85723e-01  -4.07826e+00 0.00000e+00 0.00000e+00 3.28833e+01 275.403 2.33928e+01 95.403  0.8671 
1 1 1 1   114 4  f 0  2.91709e+00 8.45952e-01 5.90511e+01 48.617  2.94749e+00  3.34527e+00  0.00000e+00 0.00000e+00 3.55771e+01 48.617  2.34740e+01 228.617 0.8791 
1 1 1 1   114 5  o 12 3.25156e+00 8.80583e-01 2.92615e+01 288.890 8.08378e-01  -2.36235e+00 0.00000e+00 0.00000e+00 6.24633e+01 288.890 3.32018e+01 288.890 0.7647 
1 1 1 1   114 6  o 17 2.54850e+00 8.19509e-01 1.02705e+01 32.376  7.05382e-01  4.47233e-01  0.00000e+00 0.00000e+00 2.59136e+01 32.376  1.56431e+01 32.376  0.3850 
1 1 1 1   114 7  o 6  3.73351e+00 9.57015e-01 6.20682e+01 76.374  1.60251e+00  6.61100e+00  0.00000e+00 0.00000e+00 6.50147e+01 76.374  2.94652e+00 76.374  0.9233 
1 1 1 1   114 8  o 10 2.76795e+00 8.54484e-01 4.79698e+01 92.984  -2.41963e-01 4.64177e+00  0.00000e+00 0.00000e+00 4.22569e+01 92.984  5.71289e+00 272.984 0.8845 
1 1 1 1   115 0  o 8  5.47421e+00 7.92455e-01 7.15880e+01 254.458 -2.71380e+00 -9.75764e+00 0.00000e+00 0.00000e+00 1.20168e+02 254.458 4.85801e+01 254.458 0.9493 
1 1 1 1   115 1  o 19 1.93562e+00 6.42867e-01 4.67902e+01 54.031  1.58352e+00  2.18205e+00  0.00000e+00 0.00000e+00 9.26189e+00 54.031  3.75283e+01 234.031 0.7847 
1 1 1 1   115 2  o 6  2.93407e+00 8.26892e-01 6.14227e+01 44.719  3.18821e+00  3.15714e+00  0.00000e+00 0.00000e+00 3.38450e+01 44.719  2.75777e+01 224.719 0.8799 
1 1 1 1   115 3  o 6  5.72109e+00 8.17503e-01 8.49439e+01 224.886 -9.11694e+00 -9.08090e+00 0.00000e+00 0.00000e+00 1.17762e+02 224.886 3.28186e+01 224.886 0.9603 
1 1 1 1   115 4  o 6  6.13232e+00 9.22151e-01 7.41423e+01 127.438 -7.31864e+00 9.55934e+00  0.00000e+00 0.00000e+00 1.42464e+02 127.438 6.83214e+01 127.438 0.9575 
1 1 1 1   115 5  o 2  3.62459e+00 9.62845e-01 5.16842e+01 159.682 -4.61513e+00 1.70880e+00  0.00000e+00 0.00000e+00 6.74914e+01 159.682 1.58072e+01 159.682 0.8915 
1 1 1 1   115 6  o 14 5.76851e+00 9.65483e-01 8.70948e+01 277.519 1.76299e+00  -1.33569e+01 0.00000e+00 0.00000e+00 1.17535e+02 277.519 3.04399e+01 277.519 0.9621 
1 1 1 1   115 7  o 15 4.38022e+00 9.11711e-01 1.00166e+02 82.320  1.68251e+00  1.24768e+01  0.00000e+00 0.00000e+00 5.47218e+01 82.320  4.54444e+01 262.320 0.9594 
1 1 1 1   115 8  o 3  3.96184e+00 1.01637e+00 6.39773e+01 186.364 -7.26030e+00 -8.09819e-01 0.00000e+00 0.00000e+00 7.15869e+01 186.364 7.60958e+00 186.364 0.9288 
1 1 1 1   116 0  o 12 2.76924e+00 7.55061e-01 2.44429e+01 166.213 -1.77024e+00 4.34400e-01  0.00000e+00 0.00000e+00 4.36346e+01 166.213 1.91917e+01 166.213 0.6664 
1 1 1 1   116 1  o 7  2.22491e+00 7.07629e-01 4.34301e+01 234.427 -1.56621e+00 -2.18985e+00 0.00000e+00 0.00000e+00 2.09496e+01 234.427 2.24804e+01 54.427  0.7844 
1 1 1 1   116 2  o 3  3.41539e+00 8.67736e-01 5.18774e+01 82.268  6.05099e-01  4.45668e+00  0.00000e+00 0.00000e+00 5.90232e+01 82.268  7.14578e+00 82.268  0.8803 
1 1 1 1   116 3  o 17 3.21652e+00 8.64482e-01 7.53268e+01 185.845 -6.71968e+00 -6.87897e-01 0.00000e+00 0.00000e+00 3.41380e+01 185.845 4.11888e+01 5.845   0.9227 
1 1 1 1   116 4  o 5  6.88109e+00 8.03246e-01 9.49109e+01 286.994 5.97595e+00  -1.95537e+01 0.00000e+00 0.00000e+00 1.52560e+02 286.994 5.76489e+01 286.994 0.9752 
1 1 1 1   116 5  o 7  5.10118e+00 9.54396e-01 1.20826e+02 107.857 -4.87945e+00 1.51459e+01  0.00000e+00 0.00000e+00 6.12382e+01 107.857 5.95882e+01 287.857 0.9680 
1 1 1 1   116 6  o 6  2.33903e+00 7.59375e-01 2.93670e+01 43.150  1.71063e+00  1.60360e+00  0.00000e+00 0.00000e+00 3.50328e+01 43.150  5.66588e+00 43.150  0.7470 
1 1 1 1   116 7  o 1  4.10209e+00 9.54907e-01 3.49100e+01 48.818  2.95562e+00  3.37832e+00  0.00000e+00 0.00000e+00 9.80927e+01 48.818  6.31827e+01 48.818  0.8800 
1 1 1 1   116 8  o 12 2.22010e+00 7.45219e-01 2.66864e+01 235.081 -1.43889e+00 -2.06112e+00 0.00000e+00 0.00000e+00 3.59841e+01 235.081 9.29767e+00 235.081 0.7665 
1 1 1 1   117 0  o 19 2.98579e+00 8.21119e-01 3.01416e+01 52.778  1.57915e+00  2.07876e+00  0.00000e+00 0.00000e+00 5.53585e+01 52.778  2.52170e+01 52.778  0.7765 
1 1 1 1   117 1  o 14 3.65592e+00 8.68690e-01 5.65325e+01 31.348  4.90529e+00  2.98815e+00  0.00000e+00 0.00000e+00 6.59114e+01 31.348  9.37899e+00 31.348  0.9082 
1 1 1 1   117 2  o 1  8.19390e+00 7.02215e-01 1.38072e+02 233.239 -2.05705e+01 -2.75360e+01 0.00000e+00 0.00000e+00 1.59658e+02 233.239 2.15853e+01 233.239 0.9853 
1 1 1 1   117 3  o 7  1.09633e+01 7.03373e-01 1.84701e+02 23.257  6.37729e+01  2.74079e+01  0.00000e+00 0.00000e+00 2.16615e+02 23.257  3.19138e+01 23.257  0.9928 
1 1 1 1   117 4  o 5  8.25514e+00 8.05431e-01 1.15674e+02 190.631 -2.77199e+01 -5.20323e+00 0.00000e+00 0.00000e+00 1.83211e+02 190.631 6.75364e+01 190.631 0.9821 
1 1 1 1   117 5  o 6  2.18002e+00 7.05800e-01 5.54300e+01 144.639 -3.40545e+00 2.41667e+00  0.00000e+00 0.00000e+00 1.44700e+01 144.639 4.09600e+01 324.639 0.8700 
1 1 1 1   117 6  o 17 3.60817e+00 9.41866e-01 2.88497e+01 33.121  2.42727e+00  1.58359e+00  0.00000e+00 0.00000e+00 7.77953e+01 33.121  4.89456e+01 33.121  0.8022 
1 1 1 1   117 7  o 12 2.36223e+00 7.81784e-01 2.54950e+01 84.911  2.05417e-01  2.30677e+00  0.00000e+00 0.00000e+00 3.91863e+01 84.911  1.36912e+01 84.911  0.7434 
1 1 1 1   117 8  o 12 3.35881e+00 9.61600e-01 5.53744e+01 104.228 -1.45902e+00 5.75431e+00  0.00000e+00 0.00000e+00 5.73268e+01 104.228 1.95245e+00 104.228 0.9114 
1 1 1 1   118 0  o 10 2.19666e+00 7.09953e-01 3.87586e+01 314.930 1.86131e+00  -1.86584e+00 0.00000e+00 0.00000e+00 2.43232e+01 314.930 1.44354e+01 134.930 0.7790 
1 1 1 1   118 1  o 11 2.11231e+00 6.83958e-01 3.04326e+01 303.620 1.24185e+00  -1.86769e+00 0.00000e+00 0.00000e+00 2.67169e+01 303.620 3.71569e+00 123.620 0.7339 
1 1 1 1   118 2  o 5  4.56515e+00 8.94528e-01 8.71383e+01 127.783 -6.81878e+00 8.79616e+00  0.00000e+00 0.00000e+00 7.34037e+01 127.783 1.37346e+01 307.783 0.9540 
1 1 1 1   118 3  o 11 3.34673e+00 8.06259e-01 4.50519e+01 212.004 -3.77278e+00 -2.35791e+00 0.00000e+00 0.00000e+00 6.33590e+01 212.004 1.83071e+01 212.004 0.8788 
1 1 1 1   118 4  o 2  5.10790e+00 9.49285e-01 9.71344e+01 79.936  2.38672e+00  1.34485e+01  0.00000e+00 0.00000e+00 8.40825e+01 79.936  1.30519e+01 259.936 0.9627 
1 1 1 1   118 5  o 3  6.32620e+00 9.33968e-01 1.44952e+02 25.769  2.54162e+01  1.22696e+01  0.00000e+00 0.00000e+00 8.39697e+01 25.769  6.09819e+01 205.769 0.9821 
1 1 1 1   118 6  o 15 2.26430e+00 7.46476e-01 2.38509e+01 181.203 -2.12580e+00 -4.46337e-02 0.00000e+00 0.00000e+00 3.59874e+01 181.203 1.21365e+01 181.203 0.7175 
1 1 1 1   118 7  o 8  2.49355e+00 8.23190e-01 2.74656e+01 194.023 -2.57382e+00 -6.42808e-01 0.00000e+00 0.00000e+00 4.42096e+01 194.023 1.67440e+01 194.023 0.7807 
1 1 1 1   119 0  o 4  2.50993e+00 7.44017e-01 2.61177e+01 221.667 -1.67899e+00 -1.49422e+00 0.00000e+00 0.00000e+00 4.18256e+01 221.667 1.57079e+01 221.667 0.7345 
1 1 1 1   119 1  o 4  5.35309e+00 8.61365e-01 8.84677e+01 176.722 -1.32941e+01 7.61404e-01  0.00000e+00 0.00000e+00 1.01256e+02 176.722 1.27887e+01 176.722 0.9617 
1 1 1 1   119 2  o 18 3.87990e+00 8.81156e-01 4.76124e+01 40.723  4.24249e+00  3.65208e+00  0.00000e+00 0.00000e+00 8.18759e+01 40.723  3.42636e+01 40.723  0.9056 
1 1 1 1   119 3  o 9  3.41069e+00 9.14140e-01 5.00131e+01 281.465 9.65299e-01  -4.75924e+00 0.00000e+00 0.00000e+00 6.18318e+01 281.465 1.18187e+01 281.465 0.8899 
1 1 1 1   119 4  o 14 2.27105e+00 7.48270e-01 3.41537e+01 171.241 -2.64040e+00 4.06821e-01  0.00000e+00 0.00000e+00 3.13122e+01 171.241 2.84146e+00 351.241 0.7824 
1 1 1 1   119 5  o 17 3.72193e+00 9.13303e-01 6.47862e+01 53.664  4.61123e+00  6.26922e+00  0.00000e+00 0.00000e+00 6.31663e+01 53.664  1.61985e+00 233.664 0.9333 
1 1 1 1   119 6  f 0  3.11263e+00 8.52965e-01 4.31533e+01 149.184 -3.96485e+00 2.36502e+00  0.00000e+00 0.00000e+00 5.81262e+01 149.184 1.49729e+01 149.184 0.8837 
1 1 1 1   119 7  o 11 3.05752e+00 9.19883e-01 4.91394e+01 83.858  5.37935e-01  4.99917e+00  0.00000e+00 0.00000e+00 5.14785e+01 83.858  2.33918e+00 83.858  0.8940 
1 1 1 1   120 0  o 14 4.90561e+00 7.97802e-01 7.26876e+01 358.650 1.11922e+01  -2.63838e-01 0.00000e+00 0.00000e+00 9.97723e+01 358.650 2.70847e+01 358.650 0.9542 
1 1 1 1   120 1  o 8  4.88254e+00 8.89027e-01 7.52995e+01 247.546 -4.04564e+00 -9.78903e+00 0.00000e+00 0.00000e+00 9.58686e+01 247.546 2.05690e+01 247.546 0.9516 
1 1 1 1   120 2  o 7  1.90672e+00 6.37491e-01 1.66020e+01 89.207  1.77738e-02  1.28394e+00  0.00000e+00 0.00000e+00 2.11925e+01 89.207  4.59045e+00 89.207  0.5380 
1 1 1 1   120 3  o 7  2.03788e+00 6.84875e-01 1.91062e+01 198.666 -1.47305e+00 -4.97622e-01 0.00000e+00 0.00000e+00 2.66397e+01 198.666 7.53349e+00 198.666 0.6094 
1 1 1 1   120 4  o 6  5.57949e+00 8.82976e-01 1.19931e+02 16.363  2.01654e+01  5.92085e+00  0.00000e+00 0.00000e+00 8.06089e+01 16.363  3.93224e+01 196.363 0.9759 
1 1 1 1   120 5  o 10 2.72921e+00 8.44626e-01 5.13638e+01 142.058 -3.96861e+00 3.09413e+00  0.00000e+00 0.00000e+00 3.84887e+01 142.058 1.28751e+01 322.058 0.8941 
1 1 1 1   120 6  o 16 2.18583e+00 7.28044e-01 3.51908e+01 161.409 -3.18591e+00 1.07164e+00  0.00000e+00 0.00000e+00 3.18745e+01 161.409 3.31635e+00 341.409 0.8335 
1 1 1 1   120 7  o 19 3.08312e+00 9.02563e-01 5.39452e+01 32.681  5.07146e+00  3.25340e+00  0.00000e+00 0.00000e+00 4.96056e+01 32.681  4.33957e+00 212.681 0.9128 
1 1 1 1   121 0  o 12 2.23597e+00 6.89260e-01 2.81741e+01 248.542 -8.39778e-01 -2.13646e+00 0.00000e+00 0.00000e+00 3.28312e+01 248.542 4.65711e+00 248.542 0.7408 
1 1 1 1   121 1  o 15 6.17796e+00 7.92619e-01 6.05072e+01 203.377 -1.13287e+01 -4.89690e+00 0.00000e+00 0.00000e+00 1.57604e+02 203.377 9.70965e+01 203.377 0.9586 
1 1 1 1   121 2  o 11 3.67542e+00 8.96055e-01 3.93439e+01 109.487 -1.54444e+00 4.36447e+00  0.00000e+00 0.00000e+00 8.03156e+01 109.487 4.09717e+01 109.487 0.8840 
1 1 1 1   121 3  o 15 4.93629e+00 9.47924e-01 7.56273e+01 103.725 -2.60223e+00 1.06544e+01  0.00000e+00 0.00000e+00 9.76494e+01 103.725 2.20221e+01 103.725 0.9533 
1 1 1 1   121 4  o 1  2.66360e+00 8.12351e-01 3.08243e+01 170.095 -3.10019e+00 5.41357e-01  0.00000e+00 0.00000e+00 4.96196e+01 170.095 1.87953e+01 170.095 0.8203 
1 1 1 1   121 5  o 13 2.45721e+00 7.84975e-01 5.01935e+01 330.300 4.34428e+00  -2.47795e+00 0.00000e+00 0.00000e+00 3.06129e+01 330.300 1.95806e+01 150.300 0.8934 
1 1 1 1   121 6  o 11 2.37368e+00 7.76223e-01 1.68581e+01 128.260 -1.03325e+00 1.31019e+00  0.00000e+00 0.00000e+00 3.86183e+01 128.260 2.17601e+01 128.260 0.6351 
1 1 1 1   122 0  o 11 2.76392e+00 8.02066e-01 5.10201e+01 9.506   4.74603e+00  7.94720e-01  0.00000e+00 0.00000e+00 3.94274e+01 9.506   1.15927e+01 189.506 0.8888 
1 1 1 1   122 1  o 3  2.47144e+00 7.56618e-01 5.23565e+01 157.690 -4.27183e+00 1.75285e+00  0.00000e+00 0.00000e+00 2.80520e+01 157.690 2.43045e+01 337.690 0.8837 
1 1 1 1   122 2  o 3  3.04300e+00 8.29379e-01 1.94356e+01 125.107 -1.20130e+00 1.70885e+00  0.00000e+00 0.00000e+00 6.03118e+01 125.107 4.08762e+01 125.107 0.7118 
1 1 1 1   122 3  o 18 3.40487e+00 9.08067e-01 3.25133e+01 202.865 -3.50206e+00 -1.47678e+00 0.00000e+00 0.00000e+00 7.47006e+01 202.865 4.21873e+01 202.865 0.8554 
1 1 1 1   122 4  f 0  4.25426e+00 9.52529e-01 9.17828e+01 0.528   1.25581e+01  1.15729e-01  0.00000e+00 0.00000e+00 5.84264e+01 0.528   3.33564e+01 180.528 0.9593 
1 1 1 1   122 5  f 0  2.74897e+00 8.21463e-01 8.00374e+01 155.410 -7.88759e+00 3.60956e+00  0.00000e+00 0.00000e+00 1.50924e+01 155.410 6.49450e+01 335.410 0.9405 
1 1 1 1   122 6  o 19 2.78569e+00 8.36822e-01 4.84833e+01 292.309 2.19746e+00  -5.35542e+00 0.00000e+00 0.00000e+00 4.46594e+01 292.309 3.82398e+00 112.310 0.9089 
1 1 1 1   123 0  o 2  3.09848e+00 8.28198e-01 5.46600e+01 107.648 -1.93380e+00 6.07856e+00  0.00000e+00 0.00000e+00 5.00128e+01 107.648 4.64726e+00 287.648 0.9179 
1 1 1 1   123 1  o 3  2.70752e+00 7.88057e-01 4.19399e+01 346.369 4.34927e+00  -1.05471e+00 0.00000e+00 0.00000e+00 4.57132e+01 346.369 3.77325e+00 346.369 0.8796 
1 1 1 1   123 2  o 15 3.63449e+00 8.80419e-01 5.57173e+01 33.608  5.81169e+00  3.86250e+00  0.00000e+00 0.00000e+00 6.80502e+01 33.608  1.23329e+01 33.608  0.9253 
1 1 1 1   123 3  o 17 2.53490e+00 7.78879e-01 4.60982e+01 103.740 -1.08552e+00 4.43948e+00  0.00000e+00 0.00000e+00 3.62103e+01 103.740 9.88788e+00 283.740 0.8824 
1 1 1 1   123 4  o 9  3.27354e+00 8.78146e-01 6.03287e+01 245.545 -3.01504e+00 -6.62958e+00 0.00000e+00 0.00000e+00 5.15100e+01 245.545 8.81873e+00 65.545  0.9286 
1 1 1 1   123 5  o 12 3.22522e+00 8.56567e-01 5.96146e+01 350.155 7.65908e+00  -1.32911e+00 0.00000e+00 0.00000e+00 5.11054e+01 350.155 8.50922e+00 170.155 0.9333 
1 1 1 1   124 0  f 0  3.16400e+00 8.10017e-01 5.66562e+01 324.343 5.50601e+00  -3.95020e+00 0.00000e+00 0.00000e+00 5.07851e+01 324.343 5.87116e+00 144.343 0.9229 
1 1 1 1   124 1  o 14 2.52865e+00 7.44774e-01 1.23213e+01 304.234 7.12358e-01  -1.04686e+00 0.00000e+00 0.00000e+00 3.72501e+01 304.234 2.49288e+01 304.234 0.5328 
1 1 1 1   124 2  o 11 3.21816e+00 8.54539e-01 4.35064e+01 263.181 -6.20622e-01 -5.19018e+00 0.00000e+00 0.00000e+00 6.28626e+01 263.181 1.93562e+01 263.181 0.8984 
1 1 1 1   124 3  o 9  2.24048e+00 7.14612e-01 5.41123e+01 127.303 -3.28964e+00 4.31785e+00  0.00000e+00 0.00000e+00 2.02676e+01 127.303 3.38447e+01 307.303 0.9024 
1 1 1 1   124 4  o 1  2.62845e+00 8.05887e-01 6.68936e+01 272.367 3.13377e-01  -7.58182e+00 0.00000e+00 0.00000e+00 2.31657e+01 272.367 4.37279e+01 92.367  0.9316 
1 1 1 1   124 5  o 4  2.72770e+00 8.29307e-01 4.98896e+01 104.966 -1.45261e+00 5.43426e+00  0.00000e+00 0.00000e+00 4.09952e+01 104.966 8.89442e+00 284.966 0.9061 
1 1 1 1   125 0  o 2  2.31081e+00 6.98070e-01 2.34616e+01 10.354  2.41046e+00  4.40382e-01  0.00000e+00 0.00000e+00 4.10880e+01 10.354  1.76264e+01 10.354  0.7595 
1 1 1 1   125 1  o 6  2.01475e+00 6.70770e-01 3.77122e+01 296.067 1.57401e+00  -3.21758e+00 0.00000e+00 0.00000e+00 2.49248e+01 296.067 1.27875e+01 116.067 0.8453 
1 1 1 1   125 2  o 18 3.91431e+00 9.20024e-01 3.66477e+01 86.055  3.30155e-01  4.78757e+00  0.00000e+00 0.00000e+00 9.12623e+01 86.055  5.46146e+01 86.055  0.8885 
1 1 1 1   125 3  o 15 3.17302e+00 8.59293e-01 6.81651e+01 299.952 4.35205e+00  -7.55267e+00 0.00000e+00 0.00000e+00 4.16075e+01 299.952 2.65577e+01 119.952 0.9408 
1 1 1 1   125 4  o 5  2.43201e+00 7.70786e-01 4.33339e+01 84.985  4.10194e-01  4.67492e+00  0.00000e+00 0.00000e+00 3.58683e+01 84.985  7.46563e+00 264.985 0.8857 
1 1 1 1   125 5  o 4  2.47048e+00 7.93178e-01 3.15733e+01 311.921 2.02537e+00  -2.25561e+00 0.00000e+00 0.00000e+00 4.21925e+01 311.921 1.06191e+01 311.921 0.8123 
1 1 1 1   126 0  o 7  1.93007e+00 6.47758e-01 3.46610e+01 234.125 -1.89902e+00 -2.62576e+00 0.00000e+00 0.00000e+00 2.39760e+01 234.125 1.06850e+01 54.125  0.8263 
1 1 1 1   126 1  o 14 1.95858e+00 6.51776e-01 4.71369e+01 208.111 -4.27587e+00 -2.28421e+00 0.00000e+00 0.00000e+00 1.69342e+01 208.111 3.02027e+01 28.112  0.8897 
1 1 1 1   126 2  o 19 2.61255e+00 7.82931e-01 4.09569e+01 28.858  3.92017e+00  2.16029e+00  0.00000e+00 0.00000e+00 4.35324e+01 28.858  2.57542e+00 28.858  0.8796 
1 1 1 1   126 3  o 1  2.27254e+00 7.44905e-01 2.16626e+01 52.886  1.36609e+00  1.80540e+00  0.00000e+00 0.00000e+00 3.98823e+01 52.886  1.82197e+01 52.886  0.7367 
1 1 1 1   126 4  o 17 4.72343e+00 9.86262e-01 9.67935e+01 161.999 -1.35765e+01 4.41142e+00  0.00000e+00 0.00000e+00 7.06208e+01 161.999 2.61726e+01 341.999 0.9643 
1 1 1 1   127 0  o 18 2.35895e+00 7.29488e-01 5.02138e+01 194.774 -5.65154e+00 -1.49045e+00 0.00000e+00 0.00000e+00 2.86740e+01 194.774 2.15398e+01 14.774  0.9099 
1 1 1 1   127 1  o 4  2.04154e+00 6.69345e-01 1.11818e+01 204.954 -1.04649e+00 -4.86972e-01 0.00000e+00 0.00000e+00 2.62149e+01 204.954 1.50330e+01 204.954 0.4984 
1 1 1 1   127 2  o 17 2.42023e+00 7.69596e-01 3.67535e+01 309.938 2.96518e+00  -3.54149e+00 0.00000e+00 0.00000e+00 4.18540e+01 309.938 5.10045e+00 309.938 0.8837 
1 1 1 1   127 3  o 7  1.95173e+00 6.59332e-01 2.02533e+01 160.338 -1.68030e+00 6.00379e-01  0.00000e+00 0.00000e+00 2.70114e+01 160.338 6.75808e+00 160.338 0.6590 
1 1 1 1   127 4  o 6  1.94773e+00 6.66392e-01 3.06495e+01 356.857 2.74048e+00  -1.50469e-01 0.00000e+00 0.00000e+00 2.58271e+01 356.857 4.82242e+00 176.857 0.7892 
1 1 1 1   128 0  o 12 3.77618e+00 9.24507e-01 8.77336e+01 239.702 -5.84468e+00 -1.00029e+01 0.00000e+00 0.00000e+00 4.48789e+01 239.702 4.28546e+01 59.702  0.9558 
1 1 1 1   128 1  o 10 2.48161e+00 7.74217e-01 4.76709e+01 140.374 -3.61915e+00 2.99681e+00  0.00000e+00 0.00000e+00 3.31042e+01 140.374 1.45667e+01 320.374 0.8859 
1 1 1 1   128 2  o 9  1.94415e+00 6.61206e-01 1.50118e+01 297.444 7.85978e-01  -1.51345e+00 0.00000e+00 0.00000e+00 3.09132e+01 297.444 1.59014e+01 297.444 0.6430 
1 1 1 1   128 3  f 0  2.18845e+00 7.07872e-01 4.85879e+01 72.250  1.42088e+00  4.43876e+00  0.00000e+00 0.00000e+00 2.25507e+01 72.250  2.60372e+01 252.250 0.8849 
1 1 1 2   0   0  o 13 1.98574e+01 5.73587e-01 2.19024e+02 180.000 -4.77074e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.12277e+02 180.000 1.06747e+02 0.000   0.4439 
1 1 1 2   0   1  o 16 8.24075e+00 3.34868e-01 3.94388e+02 0.000   2.75934e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.11023e+02 180.000 7.05411e+02 180.000 0.2691 
1 1 1 2   0   2  o 9  9.06792e+00 3.64286e-01 4.09358e+02 180.000 -6.20912e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.21299e+02 0.000   6.30658e+02 0.000   0.5518 
1 1 1 2   0   3  o 4  1.64946e+01 5.19968e-01 1.68130e+02 0.000   6.65925e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.92852e+02 0.000   2.47218e+01 0.000   0.5823 
1 1 1 2   0   4  o 19 1.21844e+01 4.21353e-01 2.46577e+02 180.000 -7.19054e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.56224e+01 180.000 2.10955e+02 0.000   0.6163 
1 1 1 2   0   5  f 0  3.27424e+01 8.21993e-01 4.28265e+02 0.000   5.61633e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.01887e+02 0.000   3.73621e+02 0.000   1.0000 
1 1 1 2   0   6  o 15 9.91325e+00 4.29531e-01 4.09874e+02 180.000 -1.56388e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.87728e+01 0.000   4.78646e+02 0.000   0.9160 
1 1 1 2   0   7  o 19 2.33942e+01 6.61366e-01 3.11016e+02 180.000 -3.85179e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.66648e+02 180.000 2.55632e+02 180.000 0.9991 
1 1 1 2   0   8  o 7  2.78342e+01 7.60847e-01 8.39954e+02 0.000   1.43604e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.04829e+02 0.000   6.35124e+02 180.000 1.0000 
1 1 1 2   0   9  o 2  1.27653e+01 6.10063e-01 1.60066e+02 0.000   1.57897e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.79819e+02 0.000   1.19753e+02 0.000   0.9184 
1 1 1 2   0   10 o 1  2.71012e+01 1.06234e+00 3.49560e+02 0.000   1.04074e+01  0.00000e+00  0.00000e+00 0.00000e+00 6.66756e+02 0.000   3.17196e+02 0.000   1.0000 
1 1 1 2   0   11 o 10 2.56998e+01 8.56756e-01 3.19420e+02 0.000   1.17593e+01  0.00000e+00  0.00000e+00 0.00000e+00 6.43801e+02 0.000   3.24381e+02 0.000   1.0000 
1 1 1 2   0   12 o 14 1.86743e+01 8.95797e-01 3.26500e+02 0.000   1.29846e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.72971e+02 0.000   4.64719e+01 0.000   1.0000 
1 1 1 2   0   13 o 11 4.97431e+00 1.98219e+00 1.04103e+02 0.000   1.26795e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.47645e+01 0.000   4.93381e+01 180.000 0.8532 
1 1 1 2   0   14 o 17 2.52220e+01 1.15347e+00 3.43229e+02 180.000 -3.25910e+01 0.00000e+00  0.00000e+00 0.00000e+00 6.00148e+02 180.000 2.56919e+02 180.000 1.0000 
1 1 1 2   0   15 o 18 4.14091e+00 2.24004e+00 1.29431e+02 180.000 -2.05086e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.02895e+01 180.000 1.09141e+02 0.000   0.9674 
1 1 1 2   0   16 o 14 3.88669e+00 2.24465e+00 5.99765e-01 180.000 -1.04296e-02 0.00000e+00  0.00000e+00 0.00000e+00 9.13842e-01 180.000 3.14077e-01 180.000 0.0104 
1 1 1 2   0   17 o 17 2.83790e+00 1.90138e+00 1.02803e+02 0.000   1.64856e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.48545e+00 180.000 1.07288e+02 180.000 0.9287 
1 1 1 2   0   18 o 3  3.83764e+00 2.39271e+00 5.87299e+01 180.000 -1.18153e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.96854e+01 180.000 9.55467e-01 180.000 0.8279 
1 1 1 2   0   19 o 18 5.00709e+00 2.95633e+00 3.09407e+01 0.000   6.51119e-01  0.00000e+00  0.00000e+00 0.00000e+00 7.57664e+01 0.000   4.48257e+01 0.000   0.5724 
1 1 1 2   1   0  o 9  1.33937e+01 2.99718e-01 4.74711e+02 8.525   1.36980e+00  2.05341e-01  0.00000e+00 0.00000e+00 1.89572e+02 188.525 6.64283e+02 188.525 0.5664 
1 1 1 2   1   1  o 9  1.78489e+01 3.74870e-01 2.30205e+02 207.899 -1.38874e+00 -7.35265e-01 0.00000e+00 0.00000e+00 1.81242e+02 207.899 4.89636e+01 27.899  0.6133 
1 1 1 2   1   2  o 13 1.23094e+01 2.96800e-01 1.02840e+02 120.752 -2.15819e-01 3.62728e-01  0.00000e+00 0.00000e+00 7.31017e+00 300.752 1.10150e+02 300.752 0.2065 
1 1 1 2   1   3  o 17 4.56111e+01 8.79135e-01 7.49407e+02 79.125  3.07372e+00  1.59993e+01  0.00000e+00 0.00000e+00 9.11362e+02 79.125  1.61955e+02 79.125  0.9688 
1 1 1 2   1   4  o 11 3.25130e+01 6.05239e-01 4.92206e+02 228.451 -5.06270e+00 -5.71243e+00 0.00000e+00 0.00000e+00 6.46496e+02 228.451 1.54290e+02 228.451 0.9320 
1 1 1 2   1   5  o 11 2.06724e+01 4.06268e-01 5.24181e+02 63.349  3.90135e+00  7.77344e+00  0.00000e+00 0.00000e+00 2.06396e+02 63.349  3.17785e+02 243.349 0.9406 
1 1 1 2   1   6  o 16 2.82027e+01 5.21456e-01 5.52290e+02 340.777 1.12884e+01  -3.93610e+00 0.00000e+00 0.00000e+00 4.61738e+02 340.777 9.05519e+01 160.777 0.9572 
1 1 1 2   1   7  o 18 1.44423e+01 3.65197e-01 1.29807e+02 318.819 1.49613e+00  -1.30890e+00 0.00000e+00 0.00000e+00 2.47517e+02 318.819 1.17710e+02 318.819 0.6958 
1 1 1 2   1   8  o 14 2.32456e+01 4.80742e-01 4.26043e+02 299.003 5.90620e+00  -1.06536e+01 0.00000e+00 0.00000e+00 4.09881e+02 299.003 1.61615e+01 119.003 0.9580 
1 1 1 2   1   9  o 16 5.47407e+01 9.55592e-01 9.00002e+02 358.614 7.45428e+01  -1.80302e+00 0.00000e+00 0.00000e+00 1.14002e+03 358.614 2.40018e+02 358.614 0.9933 
1 1 1 2   1   10 o 4  1.94638e+01 5.47413e-01 1.96646e+02 211.307 -7.26392e+00 -4.41778e+00 0.00000e+00 0.00000e+00 4.88887e+02 211.307 2.92241e+02 211.307 0.9392 
1 1 1 2   1   11 o 15 1.93619e+01 5.67992e-01 1.95286e+02 254.882 -2.83186e+00 -1.04822e+01 0.00000e+00 0.00000e+00 4.96122e+02 254.882 3.00836e+02 254.882 0.9528 
1 1 1 2   1   12 o 7  1.46874e+01 6.74678e-01 3.19122e+02 53.838  1.17285e+01  1.60475e+01  0.00000e+00 0.00000e+00 2.16991e+02 53.838  1.02131e+02 233.838 0.9745 
1 1 1 2   1   13 o 9  1.34249e+01 7.44901e-01 2.30732e+02 136.641 -1.26648e+01 1.19592e+01  0.00000e+00 0.00000e+00 2.57129e+02 136.641 2.63962e+01 136.641 0.9709 
1 1 1 2   1   14 o 7  1.92497e+01 7.39619e-01 3.67753e+02 4.527   5.40330e+01  4.27822e+00  0.00000e+00 0.00000e+00 3.45568e+02 4.527   2.21860e+01 184.527 0.9907 
1 1 1 2   1   15 o 17 8.51726e+00 1.25863e+00 1.90926e+02 5.630   1.42722e+01  1.40683e+00  0.00000e+00 0.00000e+00 1.16082e+02 5.630   7.48438e+01 185.630 0.9645 
1 1 1 2   1   16 o 11 4.51356e+00 1.34381e+00 6.48307e+01 11.844  2.90937e+00  6.10130e-01  0.00000e+00 0.00000e+00 7.13385e+01 11.844  6.50774e+00 11.844  0.8079 
1 1 1 2   1   17 o 3  9.03914e+00 1.63203e+00 1.53626e+02 85.574  1.02604e+00  1.32551e+01  0.00000e+00 0.00000e+00 1.70645e+02 85.574  1.70186e+01 85.574  0.9616 
1 1 1 2   1   18 o 14 5.68885e+00 1.62465e+00 1.43199e+02 322.548 7.08928e+00  -5.43044e+00 0.00000e+00 0.00000e+00 5.65694e+01 322.548 8.66296e+01 142.548 0.9422 
1 1 1 2   1   19 o 1  4.99998e+00 1.61753e+00 3.90549e+01 154.976 -2.04970e+00 9.56838e-01  0.00000e+00 0.00000e+00 9.80320e+01 154.976 5.89772e+01 154.976 0.7364 
1 1 1 2   2   0  f 0  3.65145e+01 8.13525e-01 1.10814e+02 12.635  8.39806e-01  1.88253e-01  0.00000e+00 0.00000e+00 4.31069e+02 12.635  3.20255e+02 12.635  0.3948 
1 1 1 2   2   1  o 12 1.79448e+01 3.76923e-01 7.42895e+02 17.098  4.79463e+00  1.47488e+00  0.00000e+00 0.00000e+00 1.40063e+02 197.098 8.82958e+02 197.098 0.8938 
1 1 1 2   2   2  o 15 1.09979e+01 2.79125e-01 4.59622e+02 189.728 -1.64546e+00 -2.82097e-01 0.00000e+00 0.00000e+00 1.96998e+02 9.728   6.56620e+02 9.728   0.6353 
1 1 1 2   2   3  o 14 3.60157e+01 6.58980e-01 6.34793e+02 48.797  7.16082e+00  8.17893e+00  0.00000e+00 0.00000e+00 6.54965e+02 48.797  2.01721e+01 48.797  0.9528 
1 1 1 2   2   4  o 7  1.35792e+01 3.22577e-01 7.97293e+01 42.301  3.81625e-01  3.47268e-01  0.00000e+00 0.00000e+00 4.77241e+01 42.301  3.20052e+01 222.301 0.2498 
1 1 1 2   2   5  o 3  3.30185e+01 5.86371e-01 6.70659e+02 318.971 1.33477e+01  -1.16150e+01 0.00000e+00 0.00000e+00 5.34311e+02 318.971 1.36348e+02 138.971 0.9713 
1 1 1 2   2   6  o 1  1.73996e+01 3.75792e-01 3.83749e+02 323.478 4.12198e+00  -3.05256e+00 0.00000e+00 0.00000e+00 2.02035e+02 323.478 1.81714e+02 143.478 0.8963 
1 1 1 2   2   7  o 11 2.93681e+01 5.49128e-01 5.12462e+02 128.640 -9.92597e+00 1.24162e+01  0.00000e+00 0.00000e+00 5.55037e+02 128.640 4.25750e+01 128.640 0.9680 
1 1 1 2   2   8  o 12 3.16360e+01 5.93391e-01 6.88875e+02 347.501 2.60880e+01  -5.78309e+00 0.00000e+00 0.00000e+00 4.76172e+02 347.501 2.12703e+02 167.501 0.9811 
1 1 1 2   2   9  o 1  2.54823e+01 5.30486e-01 4.70533e+02 188.181 -1.82858e+01 -2.62873e+00 0.00000e+00 0.00000e+00 4.59299e+02 188.181 1.12334e+01 8.181   0.9725 
1 1 1 2   2   10 o 14 1.25979e+01 5.05939e-01 2.70836e+02 123.988 -4.24370e+00 6.29448e+00  0.00000e+00 0.00000e+00 1.69277e+02 123.988 1.01560e+02 303.987 0.9316 
1 1 1 2   2   11 o 5  2.95006e+01 6.39330e-01 4.93658e+02 36.484  3.34635e+01  2.47469e+01  0.00000e+00 0.00000e+00 5.98647e+02 36.484  1.04989e+02 36.484  0.9879 
1 1 1 2   2   12 o 9  2.21430e+01 6.64451e-01 3.23587e+02 320.403 2.34352e+01  -1.93854e+01 0.00000e+00 0.00000e+00 4.92054e+02 320.403 1.68467e+02 320.403 0.9834 
1 1 1 2   2   13 o 19 7.88207e+00 1.03148e+00 1.77871e+02 230.969 -4.71194e+00 -5.81224e+00 0.00000e+00 0.00000e+00 9.66707e+01 230.969 8.12005e+01 50.969  0.9306 
1 1 1 2   2   14 o 7  1.56554e+01 7.69740e-01 2.81325e+02 352.528 3.32147e+01  -4.35599e+00 0.00000e+00 0.00000e+00 2.95422e+02 352.528 1.40974e+01 352.528 0.9850 
1 1 1 2   2   15 o 3  1.50549e+01 9.33369e-01 2.86048e+02 96.228  -4.66796e+00 4.27780e+01  0.00000e+00 0.00000e+00 2.70016e+02 96.228  1.60324e+01 276.227 0.9883 
1 1 1 2   2   16 o 3  3.95048e+00 1.20971e+00 1.00872e+02 181.099 -4.32834e+00 -8.30504e-02 0.00000e+00 0.00000e+00 2.82131e+01 181.099 7.26593e+01 1.099   0.8751 
1 1 1 2   2   17 o 14 4.20554e+00 1.32099e+00 9.02160e+01 41.567  3.25074e+00  2.88284e+00  0.00000e+00 0.00000e+00 4.71555e+01 41.567  4.30606e+01 221.567 0.8756 
1 1 1 2   2   18 f 0  6.08862e+00 1.68852e+00 1.09340e+02 261.101 -1.08211e+00 -6.91102e+00 0.00000e+00 0.00000e+00 1.00665e+02 261.101 8.67469e+00 81.101  0.9255 
1 1 1 2   2   19 o 4  6.60967e+00 1.82154e+00 7.71644e+01 206.787 -4.58092e+00 -2.31271e+00 0.00000e+00 0.00000e+00 1.43405e+02 206.787 6.62410e+01 206.787 0.8963 
1 1 1 2   3   0  o 5  2.88044e+01 6.51517e-01 3.54898e+02 240.651 -1.03015e+00 -1.83206e+00 0.00000e+00 0.00000e+00 4.17872e+02 240.651 6.29739e+01 240.651 0.7138 
1 1 1 2   3   1  o 15 2.03969e+01 4.18202e-01 6.56189e+02 71.656  1.54355e+00  4.65528e+00  0.00000e+00 0.00000e+00 2.69885e+01 71.656  6.29200e+02 251.656 0.8911 
1 1 1 2   3   2  o 8  4.90040e+01 8.77786e-01 1.01714e+03 127.941 -9.92213e+00 1.27266e+01  0.00000e+00 0.00000e+00 7.66721e+02 127.941 2.50420e+02 307.941 0.9685 
1 1 1 2   3   3  o 9  4.04523e+01 7.34172e-01 1.29735e+02 189.169 -2.43918e+00 -3.93724e-01 0.00000e+00 0.00000e+00 1.02842e+03 189.169 8.98689e+02 189.169 0.7618 
1 1 1 2   3   4  o 12 3.03868e+01 5.69886e-01 5.70055e+02 46.010  7.99260e+00  8.27957e+00  0.00000e+00 0.00000e+00 5.21033e+02 46.010  4.90223e+01 226.010 0.9555 
1 1 1 2   3   5  o 11 1.03063e+01 2.93480e-01 1.00910e+02 173.517 -8.26367e-01 9.38987e-02  0.00000e+00 0.00000e+00 4.76243e+01 173.517 5.32855e+01 353.517 0.3836 
1 1 1 2   3   6  f 0  3.26612e+01 5.61485e-01 6.65881e+02 35.924  1.34723e+01  9.76087e+00  0.00000e+00 0.00000e+00 5.23462e+02 35.924  1.42419e+02 215.924 0.9695 
1 1 1 2   3   7  o 4  3.21668e+01 5.65209e-01 8.15125e+02 165.773 -2.68096e+01 6.79737e+00  0.00000e+00 0.00000e+00 3.70686e+02 165.773 4.44440e+02 345.773 0.9818 
1 1 1 2   3   8  o 14 2.41506e+01 4.90927e-01 3.26669e+02 347.920 9.47783e+00  -2.02846e+00 0.00000e+00 0.00000e+00 5.31717e+02 347.920 2.05049e+02 347.920 0.9469 
1 1 1 2   3   9  o 6  2.78033e+01 5.59435e-01 6.35282e+02 319.328 2.06128e+01  -1.77124e+01 0.00000e+00 0.00000e+00 3.88497e+02 319.328 2.46785e+02 139.328 0.9814 
1 1 1 2   3   10 o 17 3.17129e+01 6.34822e-01 4.71864e+02 167.020 -3.22368e+01 7.43050e+00  0.00000e+00 0.00000e+00 6.99263e+02 167.020 2.27399e+02 167.020 0.9848 
1 1 1 2   3   11 o 8  1.65352e+01 5.90154e-01 1.46423e+02 357.587 6.93353e+00  -2.92163e-01 0.00000e+00 0.00000e+00 4.26732e+02 357.587 2.80309e+02 357.587 0.9249 
1 1 1 2   3   12 o 1  7.71840e+00 9.17962e-01 1.01073e+02 83.124  3.84112e-01  3.18512e+00  0.00000e+00 0.00000e+00 1.37224e+02 83.124  3.61510e+01 83.124  0.8243 
1 1 1 2   3   13 o 9  1.83400e+01 6.71543e-01 3.30017e+02 129.637 -2.19456e+01 2.64929e+01  0.00000e+00 0.00000e+00 3.46405e+02 129.637 1.63879e+01 129.637 0.9854 
1 1 1 2   3   14 o 7  1.15209e+01 9.01401e-01 1.80434e+02 208.730 -1.34412e+01 -7.36804e+00 0.00000e+00 0.00000e+00 2.36174e+02 208.730 5.57409e+01 208.730 0.9668 
1 1 1 2   3   15 o 1  1.69494e+01 8.40095e-01 2.94679e+02 82.807  6.44795e+00  5.10877e+01  0.00000e+00 0.00000e+00 3.32581e+02 82.807  3.79023e+01 82.807  0.9902 
1 1 1 2   3   16 o 9  5.56158e+00 1.35153e+00 1.25918e+02 11.117  6.95225e+00  1.36607e+00  0.00000e+00 0.00000e+00 6.64815e+01 11.117  5.94369e+01 191.117 0.9265 
1 1 1 2   3   17 o 5  1.80301e+01 1.10719e+00 2.99835e+02 302.034 3.69294e+01  -5.90221e+01 0.00000e+00 0.00000e+00 3.67939e+02 302.034 6.81040e+01 302.034 0.9928 
1 1 1 2   3   18 o 2  5.10074e+00 1.54097e+00 7.68154e+01 42.163  3.36552e+00  3.04770e+00  0.00000e+00 0.00000e+00 9.07566e+01 42.163  1.39412e+01 42.163  0.8815 
1 1 1 2   3   19 o 9  4.87556e+00 1.56769e+00 3.98922e+01 287.636 7.06704e-01  -2.22301e+00 0.00000e+00 0.00000e+00 9.54265e+01 287.636 5.55342e+01 287.636 0.7455 
1 1 1 2   4   0  o 9  1.57111e+01 4.85163e-01 4.74644e+02 297.359 6.73001e-01  -1.30064e+00 0.00000e+00 0.00000e+00 1.27894e+02 117.359 6.02538e+02 117.359 0.5872 
1 1 1 2   4   1  o 4  1.44334e+01 3.65520e-01 2.84594e+02 63.936  6.38476e-01  1.30534e+00  0.00000e+00 0.00000e+00 3.24023e+01 63.936  2.52192e+02 243.936 0.5843 
1 1 1 2   4   2  o 3  2.23748e+01 4.30839e-01 4.54588e+02 246.311 -1.29965e+00 -2.96221e+00 0.00000e+00 0.00000e+00 2.40013e+02 246.311 2.14575e+02 66.311  0.8259 
1 1 1 2   4   3  o 10 3.75109e+01 6.44214e-01 9.16965e+02 40.331  1.22060e+01  1.03628e+01  0.00000e+00 0.00000e+00 4.48054e+02 40.331  4.68910e+02 220.331 0.9683 
1 1 1 2   4   4  o 17 3.79255e+01 6.56370e-01 7.28581e+02 83.496  2.06171e+00  1.80840e+01  0.00000e+00 0.00000e+00 6.56867e+02 83.496  7.17138e+01 263.496 0.9721 
1 1 1 2   4   5  o 1  1.31336e+01 3.15520e-01 3.92217e+02 264.004 -4.28383e-01 -4.07883e+00 0.00000e+00 0.00000e+00 3.57472e+01 264.004 3.56470e+02 84.004  0.8673 
1 1 1 2   4   6  o 15 2.64331e+01 4.78113e-01 5.67588e+02 41.910  8.53144e+00  7.65749e+00  0.00000e+00 0.00000e+00 3.80929e+02 41.910  1.86658e+02 221.910 0.9553 
1 1 1 2   4   7  o 4  1.74464e+01 3.85135e-01 2.88439e+02 43.620  3.85076e+00  3.66960e+00  0.00000e+00 0.00000e+00 3.01346e+02 43.620  1.29064e+01 43.620  0.9003 
1 1 1 2   4   8  o 13 2.75767e+01 5.15509e-01 4.51203e+02 272.193 5.84212e-01  -1.52546e+01 0.00000e+00 0.00000e+00 5.49393e+02 272.193 9.81894e+01 272.193 0.9667 
1 1 1 2   4   9  o 5  5.15756e+01 9.20365e-01 6.78827e+02 278.851 1.00102e+01  -6.42814e+01 0.00000e+00 0.00000e+00 1.24129e+03 278.851 5.62462e+02 278.851 0.9923 
1 1 1 2   4   10 o 16 3.79802e+01 6.93830e-01 5.52775e+02 187.631 -4.58359e+01 -6.14099e+00 0.00000e+00 0.00000e+00 8.55994e+02 187.631 3.03219e+02 187.631 0.9891 
1 1 1 2   4   11 o 14 2.18915e+01 6.09488e-01 2.89469e+02 269.414 -1.85422e-01 -1.81322e+01 0.00000e+00 0.00000e+00 5.08045e+02 269.414 2.18576e+02 269.414 0.9720 
1 1 1 2   4   12 o 3  2.80336e+01 6.62647e-01 5.17222e+02 315.830 4.41256e+01  -4.28650e+01 0.00000e+00 0.00000e+00 5.24223e+02 315.830 7.00040e+00 315.830 0.9918 
1 1 1 2   4   13 o 1  1.42682e+01 7.09055e-01 2.70009e+02 188.147 -2.15518e+01 -3.08550e+00 0.00000e+00 0.00000e+00 2.51637e+02 188.147 1.83711e+01 8.147   0.9768 
1 1 1 2   4   14 o 5  1.04612e+01 9.20987e-01 1.70595e+02 83.217  1.54609e+00  1.29995e+01  0.00000e+00 0.00000e+00 2.05420e+02 83.217  3.48249e+01 83.217  0.9610 
1 1 1 2   4   15 o 11 1.05990e+01 1.05163e+00 3.01316e+02 308.290 1.89386e+01  -2.39887e+01 0.00000e+00 0.00000e+00 8.82545e+01 308.290 2.13062e+02 128.290 0.9835 
1 1 1 2   4   16 o 17 5.49050e+00 1.39247e+00 7.09068e+01 345.004 3.72508e+00  -9.97866e-01 0.00000e+00 0.00000e+00 1.04947e+02 345.004 3.40400e+01 345.004 0.8578 
1 1 1 2   4   17 o 18 9.64466e+00 1.50724e+00 1.95851e+02 37.940  1.53314e+01  1.19522e+01  0.00000e+00 0.00000e+00 1.54564e+02 37.940  4.12873e+01 217.940 0.9739 
1 1 1 2   4   18 o 8  5.51791e+00 1.58000e+00 5.27191e+01 292.726 1.22242e+00  -2.91859e+00 0.00000e+00 0.00000e+00 1.16202e+02 292.726 6.34828e+01 292.726 0.8214 
1 1 1 2   4   19 o 13 4.52020e+00 1.51114e+00 6.39617e+01 54.870  2.10751e+00  2.99540e+00  0.00000e+00 0.00000e+00 7.89377e+01 54.870  1.49761e+01 54.870  0.8492 
1 1 1 2   5   0  o 18 1.96702e+01 4.33665e-01 3.54707e+02 202.768 -1.19418e+00 -5.01209e-01 0.00000e+00 0.00000e+00 4.54316e+01 202.768 3.09275e+02 22.768  0.5413 
1 1 1 2   5   1  o 2  3.38752e+01 6.46210e-01 3.74556e+02 127.914 -2.63584e+00 3.38419e+00  0.00000e+00 0.00000e+00 7.37992e+02 127.914 3.63436e+02 127.914 0.8738 
1 1 1 2   5   2  o 11 2.46346e+01 4.97823e-01 4.04649e+02 234.059 -1.81112e+00 -2.49822e+00 0.00000e+00 0.00000e+00 3.51000e+02 234.059 5.36491e+01 54.059  0.8161 
1 1 1 2   5   3  o 16 3.60622e+01 6.21286e-01 5.75025e+02 225.423 -6.67217e+00 -6.77133e+00 0.00000e+00 0.00000e+00 7.06890e+02 225.423 1.31865e+02 225.423 0.9458 
1 1 1 2   5   4  o 3  2.09546e+01 4.01136e-01 5.10234e+02 286.200 1.95351e+00  -6.72385e+00 0.00000e+00 0.00000e+00 2.18569e+02 286.200 2.91665e+02 106.200 0.9256 
1 1 1 2   5   5  o 17 1.65262e+01 3.53715e-01 1.91885e+02 24.316  2.28766e+00  1.03371e+00  0.00000e+00 0.00000e+00 2.83795e+02 24.316  9.19099e+01 24.316  0.7661 
1 1 1 2   5   6  o 13 1.51329e+01 3.54315e-01 2.24528e+02 210.524 -2.23307e+00 -1.31661e+00 0.00000e+00 0.00000e+00 2.15801e+02 210.524 8.72691e+00 30.524  0.7747 
1 1 1 2   5   7  o 7  2.48065e+01 4.68910e-01 3.70611e+02 126.599 -5.77604e+00 7.77768e+00  0.00000e+00 0.00000e+00 5.11377e+02 126.599 1.40766e+02 126.599 0.9469 
1 1 1 2   5   8  o 3  2.62226e+01 5.25901e-01 5.69736e+02 40.229  1.39765e+01  1.18232e+01  0.00000e+00 0.00000e+00 3.87248e+02 40.229  1.82488e+02 220.229 0.9723 
1 1 1 2   5   9  o 19 2.48840e+01 5.08354e-01 4.71234e+02 339.724 2.08499e+01  -7.70269e+00 0.00000e+00 0.00000e+00 4.41120e+02 339.724 3.01138e+01 159.724 0.9772 
1 1 1 2   5   10 o 5  3.73983e+01 6.85735e-01 5.19898e+02 221.404 -3.21233e+01 -2.83242e+01 0.00000e+00 0.00000e+00 8.66046e+02 221.404 3.46148e+02 221.404 0.9883 
1 1 1 2   5   11 o 2  2.88470e+01 6.81875e-01 4.34053e+02 213.884 -2.95800e+01 -1.98650e+01 0.00000e+00 0.00000e+00 6.31805e+02 213.884 1.97752e+02 213.884 0.9859 
1 1 1 2   5   12 o 17 1.24997e+01 6.97593e-01 2.08951e+02 257.899 -2.31105e+00 -1.07794e+01 0.00000e+00 0.00000e+00 2.37462e+02 257.899 2.85106e+01 257.899 0.9535 
1 1 1 2   5   13 o 2  1.40114e+01 7.24426e-01 2.73952e+02 4.367   2.15713e+01  1.64717e+00  0.00000e+00 0.00000e+00 2.38219e+02 4.367   3.57335e+01 184.367 0.9766 
1 1 1 2   5   14 o 14 9.78825e+00 9.88470e-01 1.14701e+02 230.275 -5.17019e+00 -6.22191e+00 0.00000e+00 0.00000e+00 2.27959e+02 230.275 1.13258e+02 230.275 0.9360 
1 1 1 2   5   15 o 1  9.17725e+00 1.05764e+00 2.06320e+02 18.466  1.71449e+01  5.72529e+00  0.00000e+00 0.00000e+00 1.27022e+02 18.466  7.92981e+01 198.466 0.9719 
1 1 1 2   5   16 o 10 1.39766e+01 1.07029e+00 2.40347e+02 303.325 2.14205e+01  -3.25789e+01 0.00000e+00 0.00000e+00 2.74791e+02 303.325 3.44443e+01 303.325 0.9871 
1 1 1 2   5   17 f 0  9.96689e+00 1.53515e+00 1.95285e+02 175.644 -1.96502e+01 1.49686e+00  0.00000e+00 0.00000e+00 1.66966e+02 175.644 2.83183e+01 355.644 0.9743 
1 1 1 2   5   18 o 1  1.03316e+01 1.73758e+00 1.66179e+02 314.932 1.19247e+01  -1.19532e+01 0.00000e+00 0.00000e+00 2.07274e+02 314.932 4.10948e+01 314.932 0.9699 
1 1 1 2   5   19 o 10 3.97408e+00 1.36485e+00 8.81736e+01 164.921 -4.75742e+00 1.28176e+00  0.00000e+00 0.00000e+00 4.37476e+01 164.921 4.44260e+01 344.921 0.8917 
1 1 1 2   6   0  o 18 2.31197e+01 4.93198e-01 2.71054e+02 10.181  1.07327e+00  1.92747e-01  0.00000e+00 0.00000e+00 1.43870e+02 10.181  1.27184e+02 190.181 0.4775 
1 1 1 2   6   1  o 18 1.52116e+01 3.35900e-01 1.66536e+02 57.565  4.37654e-01  6.88709e-01  0.00000e+00 0.00000e+00 4.92498e+01 57.565  1.17286e+02 237.565 0.3774 
1 1 1 2   6   2  o 9  1.00794e+01 3.01529e-01 4.18939e+02 152.602 -1.12565e+00 5.83418e-01  0.00000e+00 0.00000e+00 2.16910e+02 332.602 6.35849e+02 332.602 0.5333 
1 1 1 2   6   3  o 6  5.81389e+00 2.50026e-01 3.16182e+02 94.751  -6.87067e-02 8.26636e-01  0.00000e+00 0.00000e+00 2.32556e+02 274.751 5.48738e+02 274.751 0.3827 
1 1 1 2   6   4  o 5  2.18886e+01 4.14507e-01 3.74615e+02 144.676 -4.33298e+00 3.07061e+00  0.00000e+00 0.00000e+00 3.65745e+02 144.676 8.87014e+00 324.676 0.9001 
1 1 1 2   6   5  o 15 1.78183e+01 3.70000e-01 3.34200e+02 188.323 -4.63373e+00 -6.77874e-01 0.00000e+00 0.00000e+00 2.58561e+02 188.323 7.56393e+01 8.323   0.8855 
1 1 1 2   6   6  o 19 1.37839e+01 3.43226e-01 1.57317e+02 183.643 -1.87351e+00 -1.19290e-01 0.00000e+00 0.00000e+00 1.92954e+02 183.643 3.56373e+01 183.643 0.6766 
1 1 1 2   6   7  o 2  3.31448e+01 5.82003e-01 6.52756e+02 58.736  1.17574e+01  1.93652e+01  0.00000e+00 0.00000e+00 5.63988e+02 58.736  8.87681e+01 238.736 0.9777 
1 1 1 2   6   8  o 3  2.66530e+01 5.28338e-01 2.18266e+02 29.225  6.21301e+00  3.47589e+00  0.00000e+00 0.00000e+00 7.08942e+02 29.225  4.90677e+02 29.225  0.9268 
1 1 1 2   6   9  o 9  4.78981e+01 8.11414e-01 7.93499e+02 294.748 2.97076e+01  -6.44452e+01 0.00000e+00 0.00000e+00 9.90818e+02 294.748 1.97319e+02 294.748 0.9929 
1 1 1 2   6   10 o 6  3.19481e+01 6.41340e-01 7.36305e+02 108.568 -1.65298e+01 4.92076e+01  0.00000e+00 0.00000e+00 4.50117e+02 108.568 2.86188e+02 288.568 0.9903 
1 1 1 2   6   11 o 8  2.25466e+01 6.85282e-01 2.30850e+02 296.359 6.57035e+00  -1.32595e+01 0.00000e+00 0.00000e+00 5.85078e+02 296.359 3.54229e+02 296.359 0.9656 
1 1 1 2   6   12 o 3  1.06510e+01 7.53899e-01 2.32722e+02 234.321 -6.05954e+00 -8.43924e+00 0.00000e+00 0.00000e+00 1.46493e+02 234.321 8.62288e+01 54.321  0.9506 
1 1 1 2   6   13 o 15 2.82647e+01 7.15457e-01 5.13482e+02 52.871  4.94220e+01  6.52793e+01  0.00000e+00 0.00000e+00 5.37956e+02 52.871  2.44743e+01 52.871  0.9939 
1 1 1 2   6   14 o 12 1.86874e+01 7.49335e-01 2.56821e+02 276.796 4.33304e+00  -3.63576e+01 0.00000e+00 0.00000e+00 4.32496e+02 276.796 1.75675e+02 276.796 0.9862 
1 1 1 2   6   15 o 16 4.70475e+00 1.23661e+00 7.94477e+01 225.831 -2.31604e+00 -2.38419e+00 0.00000e+00 0.00000e+00 6.67210e+01 225.831 1.27267e+01 45.831  0.8313 
1 1 1 2   6   16 o 4  5.34434e+00 1.35634e+00 9.58377e+01 251.439 -1.64457e+00 -4.89771e+00 0.00000e+00 0.00000e+00 8.31798e+01 251.439 1.26579e+01 71.439  0.8971 
1 1 1 2   6   17 o 7  8.52646e+00 1.56579e+00 1.58806e+02 273.874 9.11086e-01  -1.34554e+01 0.00000e+00 0.00000e+00 1.47236e+02 273.874 1.15707e+01 93.874  0.9622 
1 1 1 2   6   18 o 6  4.71880e+00 1.49572e+00 8.31424e+01 149.298 -3.87176e+00 2.29907e+00  0.00000e+00 0.00000e+00 7.16845e+01 149.298 1.14579e+01 329.298 0.8804 
1 1 1 2   6   19 o 2  8.03261e+00 1.97944e+00 1.00302e+02 305.530 4.28008e+00  -5.99389e+00 0.00000e+00 0.00000e+00 1.77624e+02 305.530 7.73217e+01 305.530 0.9294 
1 1 1 2   7   0  o 11 2.25370e+01 4.99612e-01 3.76401e+02 248.697 -1.13166e+00 -2.90220e+00 0.00000e+00 0.00000e+00 3.16567e+02 248.697 5.98341e+01 68.698  0.8181 
1 1 1 2   7   1  o 5  3.21233e+01 7.05925e-01 6.61273e+02 186.041 -6.42125e+00 -6.79514e-01 0.00000e+00 0.00000e+00 4.48179e+02 186.041 2.13094e+02 6.041   0.9189 
1 1 1 2   7   2  o 16 3.88506e+01 7.96245e-01 5.50482e+02 101.450 -1.22669e+00 6.05631e+00  0.00000e+00 0.00000e+00 7.85654e+02 101.450 2.35171e+02 101.450 0.9151 
1 1 1 2   7   3  o 1  2.29277e+01 4.23170e-01 1.61172e+02 166.960 -1.58870e+00 3.67960e-01  0.00000e+00 0.00000e+00 3.78942e+02 166.960 2.17770e+02 166.960 0.6268 
1 1 1 2   7   4  o 5  3.08081e+01 5.46104e-01 6.54265e+02 130.796 -8.40950e+00 9.74384e+00  0.00000e+00 0.00000e+00 4.57471e+02 130.796 1.96794e+02 310.796 0.9603 
1 1 1 2   7   5  o 19 1.98307e+01 3.96929e-01 1.76565e+02 155.302 -2.48240e+00 1.14167e+00  0.00000e+00 0.00000e+00 4.10565e+02 155.302 2.34000e+02 155.302 0.7881 
1 1 1 2   7   6  o 10 1.95563e+01 4.07522e-01 1.80159e+02 24.058  2.77141e+00  1.23728e+00  0.00000e+00 0.00000e+00 4.16676e+02 24.058  2.36517e+02 24.058  0.8125 
1 1 1 2   7   7  o 4  8.60577e+00 3.55697e-01 2.33077e+02 159.798 -1.97446e+00 7.26528e-01  0.00000e+00 0.00000e+00 2.32727e+00 339.798 2.35405e+02 339.798 0.7141 
1 1 1 2   7   8  o 19 3.56539e+01 6.26964e-01 5.51562e+02 1.565   2.39602e+01  6.54521e-01  0.00000e+00 0.00000e+00 7.58433e+02 1.565   2.06871e+02 1.565   0.9789 
1 1 1 2   7   9  o 13 5.44406e+01 1.07140e+00 6.18592e+02 308.723 3.86260e+01  -4.81741e+01 0.00000e+00 0.00000e+00 1.40725e+03 308.723 7.88658e+02 308.723 0.9919 
1 1 1 2   7   10 o 11 4.33270e+01 7.66345e-01 7.19920e+02 144.151 -5.53508e+01 3.99918e+01  0.00000e+00 0.00000e+00 8.92825e+02 144.151 1.72905e+02 144.151 0.9927 
1 1 1 2   7   11 o 15 2.12710e+01 6.59998e-01 4.25229e+02 326.365 2.14332e+01  -1.42588e+01 0.00000e+00 0.00000e+00 3.56307e+02 326.365 6.89220e+01 146.365 0.9804 
1 1 1 2   7   12 o 2  3.22841e+01 6.90411e-01 4.41939e+02 154.537 -5.43473e+01 2.58790e+01  0.00000e+00 0.00000e+00 7.57140e+02 154.537 3.15201e+02 154.537 0.9917 
1 1 1 2   7   13 o 8  1.74595e+01 1.06617e+00 1.81986e+02 240.000 -8.40397e+00 -1.45563e+01 0.00000e+00 0.00000e+00 4.51746e+02 240.000 2.69760e+02 240.000 0.9698 
1 1 1 2   7   14 o 11 5.66899e+00 1.20009e+00 1.90839e+02 209.800 -6.86946e+00 -3.93417e+00 0.00000e+00 0.00000e+00 7.30119e+00 209.800 1.83537e+02 29.800  0.9345 
1 1 1 2   7   15 o 13 1.03211e+01 1.08582e+00 2.02024e+02 155.474 -1.73796e+01 7.92999e+00  0.00000e+00 0.00000e+00 1.73445e+02 155.474 2.85785e+01 335.474 0.9735 
1 1 1 2   7   16 o 7  7.56273e+00 1.28623e+00 1.27550e+02 169.700 -9.91681e+00 1.80217e+00  0.00000e+00 0.00000e+00 1.40430e+02 169.700 1.28798e+01 169.700 0.9490 
1 1 1 2   7   17 o 8  6.73657e+00 1.53256e+00 6.53305e+01 250.717 -1.47537e+00 -4.21699e+00 0.00000e+00 0.00000e+00 1.55653e+02 250.717 9.03222e+01 250.717 0.8794 
1 1 1 2   7   18 f 0  9.39625e+00 1.72245e+00 1.78512e+02 134.070 -1.15806e+01 1.19630e+01  0.00000e+00 0.00000e+00 1.60969e+02 134.070 1.75426e+01 314.070 0.9695 
1 1 1 2   7   19 o 4  6.42525e+00 1.88506e+00 1.68532e+02 291.148 3.80715e+00  -9.84173e+00 0.00000e+00 0.00000e+00 5.90311e+01 291.148 1.09501e+02 111.148 0.9514 
1 1 1 2   8   0  o 6  5.91424e+00 2.05723e-01 4.20596e+02 94.195  -6.21082e-02 8.46724e-01  0.00000e+00 0.00000e+00 3.33836e+02 274.195 7.54432e+02 274.195 0.3903 
1 1 1 2   8   1  o 11 1.49881e+01 3.35010e-01 2.35496e+02 323.081 8.09686e-01  -6.08339e-01 0.00000e+00 0.00000e+00 1.84944e+01 323.081 2.17002e+02 143.081 0.4509 
1 1 1 2   8   2  o 5  3.89918e+01 8.26257e-01 2.95436e+02 24.600  2.91040e+00  1.33246e+00  0.00000e+00 0.00000e+00 9.11807e+02 24.600  6.16370e+02 24.600  0.8238 
1 1 1 2   8   3  o 8  4.67909e+01 7.92561e-01 6.20093e+02 23.828  1.13974e+01  5.03345e+00  0.00000e+00 0.00000e+00 1.06623e+03 23.828  4.46133e+02 23.828  0.9590 
1 1 1 2   8   4  o 3  3.65100e+01 6.35326e-01 1.46212e+02 291.647 1.23819e+00  -3.11978e+00 0.00000e+00 0.00000e+00 9.96902e+02 291.647 8.50690e+02 291.647 0.8332 
1 1 1 2   8   5  o 14 1.66456e+01 3.58673e-01 2.42083e+02 253.261 -8.85901e-01 -2.94550e+00 0.00000e+00 0.00000e+00 2.67851e+02 253.261 2.57684e+01 253.261 0.8154 
1 1 1 2   8   6  o 6  1.40359e+01 3.47679e-01 3.44123e+02 109.340 -1.37242e+00 3.91027e+00  0.00000e+00 0.00000e+00 1.13905e+02 109.340 2.30217e+02 289.340 0.8688 
1 1 1 2   8   7  o 3  4.01825e+01 7.14194e-01 6.16345e+02 330.047 2.22767e+01  -1.28369e+01 0.00000e+00 0.00000e+00 8.62742e+02 330.047 2.46398e+02 330.047 0.9804 
1 1 1 2   8   8  o 12 1.16133e+01 3.89199e-01 3.36312e+02 221.851 -3.80957e+00 -3.41229e+00 0.00000e+00 0.00000e+00 5.42225e+01 221.851 2.82090e+02 41.851  0.8960 
1 1 1 2   8   9  o 3  4.04583e+01 8.36743e-01 5.37178e+02 118.405 -1.92270e+01 3.55528e+01  0.00000e+00 0.00000e+00 9.61767e+02 118.405 4.24589e+02 118.405 0.9876 
1 1 1 2   8   10 o 5  1.83198e+01 4.92083e-01 4.00372e+02 263.625 -1.80708e+00 -1.61744e+01 0.00000e+00 0.00000e+00 2.65124e+02 263.625 1.35248e+02 83.625  0.9688 
1 1 1 2   8   11 o 12 4.68609e+00 9.50046e-01 5.95021e+01 239.565 -3.91886e-01 -6.67017e-01 0.00000e+00 0.00000e+00 3.80633e+00 239.565 5.56958e+01 59.565  0.3605 
1 1 1 2   8   12 o 4  9.95709e+00 7.82738e-01 3.19174e+02 170.977 -1.30911e+01 2.07877e+00  0.00000e+00 0.00000e+00 3.93950e+01 170.977 2.79779e+02 350.977 0.9615 
1 1 1 2   8   13 o 8  2.18710e+01 7.10032e-01 3.52921e+02 343.918 4.18308e+01  -1.20597e+01 0.00000e+00 0.00000e+00 4.56199e+02 343.918 1.03278e+02 343.918 0.9884 
1 1 1 2   8   14 f 0  5.05638e+00 1.21441e+00 1.76546e+02 177.976 -6.49379e+00 2.29515e-01  0.00000e+00 0.00000e+00 2.66974e+00 357.976 1.79216e+02 357.976 0.9195 
1 1 1 2   8   15 o 6  4.24152e+00 1.25798e+00 4.61195e+01 153.551 -1.50037e+00 7.46383e-01  0.00000e+00 0.00000e+00 5.47962e+01 153.551 8.67676e+00 153.551 0.6367 
1 1 1 2   8   16 f 0  5.68686e+00 1.40697e+00 1.66365e+02 94.972  -8.05496e-01 9.25816e+00  0.00000e+00 0.00000e+00 3.41948e+01 94.972  1.32170e+02 274.972 0.9446 
1 1 1 2   8   17 o 17 4.90325e+00 1.47134e+00 1.57366e+02 279.057 1.27706e+00  -8.01169e+00 0.00000e+00 0.00000e+00 1.38635e+01 279.057 1.43503e+02 99.057  0.9362 
1 1 1 2   8   18 o 18 1.19482e+01 1.63146e+00 2.58467e+02 34.464  2.67813e+01  1.83812e+01  0.00000e+00 0.00000e+00 1.79885e+02 34.464  7.85815e+01 214.463 0.9845 
1 1 1 2   8   19 o 2  4.71313e+00 1.55585e+00 9.12664e+01 180.974 -5.27398e+00 -8.96452e-02 0.00000e+00 0.00000e+00 6.65344e+01 180.974 2.47320e+01 0.974   0.8994 
1 1 1 2   9   0  o 13 3.08429e+01 5.28591e-01 5.63158e+02 122.116 -2.91349e+00 4.64155e+00  0.00000e+00 0.00000e+00 4.84030e+02 122.116 7.91278e+01 302.116 0.9034 
1 1 1 2   9   1  o 17 2.36275e+01 4.71289e-01 2.85302e+02 69.319  6.41073e-01  1.69828e+00  0.00000e+00 0.00000e+00 3.05191e+02 69.319  1.98883e+01 69.319  0.6650 
1 1 1 2   9   2  o 8  2.96674e+01 6.25445e-01 5.03885e+02 78.829  1.07090e+00  5.42292e+00  0.00000e+00 0.00000e+00 5.04424e+02 78.829  5.39403e-01 78.829  0.9043 
1 1 1 2   9   3  o 4  1.76685e+01 3.53018e-01 4.64796e+02 354.374 3.95068e+00  -3.89201e-01 0.00000e+00 0.00000e+00 1.07786e+02 354.374 3.57010e+02 174.374 0.8624 
1 1 1 2   9   4  o 9  3.03286e+01 5.41296e-01 5.26098e+02 233.407 -5.89595e+00 -7.94084e+00 0.00000e+00 0.00000e+00 5.54246e+02 233.407 2.81478e+01 233.407 0.9480 
1 1 1 2   9   5  o 1  1.27677e+01 3.20991e-01 1.39590e+02 223.787 -9.73441e-01 -9.33088e-01 0.00000e+00 0.00000e+00 1.27272e+02 223.787 1.23171e+01 43.787  0.5564 
1 1 1 2   9   6  o 4  1.19793e+01 3.75643e-01 2.97229e+02 281.761 6.19259e-01  -2.97419e+00 0.00000e+00 0.00000e+00 6.84428e+01 281.761 2.28786e+02 101.762 0.8128 
1 1 1 2   9   7  o 5  1.73169e+01 4.02157e-01 3.00301e+02 294.785 2.27153e+00  -4.91945e+00 0.00000e+00 0.00000e+00 2.86330e+02 294.785 1.39709e+01 114.785 0.9023 
1 1 1 2   9   8  o 11 1.74619e+01 4.29917e-01 3.99767e+02 75.637  2.26167e+00  8.83254e+00  0.00000e+00 0.00000e+00 2.18550e+02 75.637  1.81217e+02 255.637 0.9435 
1 1 1 2   9   9  o 6  5.12285e+01 9.50485e-01 6.05947e+02 278.566 8.52545e+00  -5.66015e+01 0.00000e+00 0.00000e+00 1.29904e+03 278.566 6.93097e+02 278.566 0.9912 
1 1 1 2   9   10 o 1  1.74063e+01 8.32915e-01 3.55994e+02 127.453 -9.06521e+00 1.18341e+01  0.00000e+00 0.00000e+00 2.74396e+02 127.453 8.15971e+01 307.453 0.9659 
1 1 1 2   9   11 o 4  1.92437e+01 5.60957e-01 4.95045e+02 131.636 -1.80959e+01 2.03565e+01  0.00000e+00 0.00000e+00 2.12758e+02 131.636 2.82288e+02 311.635 0.9815 
1 1 1 2   9   12 o 18 1.08419e+01 7.94773e-01 2.41129e+02 305.386 6.29932e+00  -8.86870e+00 0.00000e+00 0.00000e+00 1.45787e+02 305.386 9.53412e+01 125.386 0.9529 
1 1 1 2   9   13 o 2  1.14079e+01 8.04302e-01 3.61223e+02 111.252 -8.84204e+00 2.27354e+01  0.00000e+00 0.00000e+00 5.68912e+01 111.252 3.04332e+02 291.252 0.9793 
1 1 1 2   9   14 o 7  9.92400e+00 9.57653e-01 1.70462e+02 225.641 -9.31028e+00 -9.52097e+00 0.00000e+00 0.00000e+00 1.86464e+02 225.641 1.60019e+01 225.641 0.9617 
1 1 1 2   9   15 o 4  7.38426e+00 1.32493e+00 1.33566e+02 267.537 -3.53196e-01 -8.21063e+00 0.00000e+00 0.00000e+00 1.24997e+02 267.537 8.56899e+00 87.537  0.9370 
1 1 1 2   9   16 o 14 1.01808e+01 1.38886e+00 1.62711e+02 64.255  7.16937e+00  1.48671e+01  0.00000e+00 0.00000e+00 2.05701e+02 64.255  4.29903e+01 64.255  0.9692 
1 1 1 2   9   17 o 6  4.58063e+00 1.37788e+00 8.07084e+01 296.079 1.80225e+00  -3.68222e+00 0.00000e+00 0.00000e+00 6.74738e+01 296.079 1.32346e+01 116.079 0.8672 
1 1 1 2   9   18 o 19 4.58417e+00 1.47927e+00 4.42342e+01 75.196  6.00551e-01  2.27234e+00  0.00000e+00 0.00000e+00 8.34928e+01 75.196  3.92586e+01 75.196  0.7477 
1 1 1 2   9   19 o 5  7.84056e+00 2.02367e+00 9.91361e+01 235.502 -3.90495e+00 -5.68213e+00 0.00000e+00 0.00000e+00 1.70650e+02 235.502 7.15143e+01 235.502 0.9243 
1 1 1 2   10  0  o 6  1.23114e+01 2.90537e-01 3.20107e+02 84.683  1.06653e-01  1.14597e+00  0.00000e+00 0.00000e+00 9.00176e+01 264.683 4.10125e+02 264.683 0.4973 
1 1 1 2   10  1  o 16 3.40454e+01 6.52287e-01 5.14015e+02 142.883 -4.71785e+00 3.57032e+00  0.00000e+00 0.00000e+00 6.51657e+02 142.883 1.37642e+02 142.883 0.9110 
1 1 1 2   10  2  o 1  1.36943e+01 3.61466e-01 2.22926e+02 253.320 -3.10644e-01 -1.03675e+00 0.00000e+00 0.00000e+00 2.14249e+01 253.320 2.01501e+02 73.320  0.4748 
1 1 1 2   10  3  o 7  2.16048e+01 4.08412e-01 2.07193e+02 304.510 1.19216e+00  -1.73396e+00 0.00000e+00 0.00000e+00 3.72631e+02 304.510 1.65438e+02 304.510 0.7142 
1 1 1 2   10  4  o 15 1.91613e+01 3.81948e-01 3.33312e+02 2.300   5.21227e+00  2.09360e-01  0.00000e+00 0.00000e+00 3.13337e+02 2.300   1.99750e+01 182.300 0.8982 
1 1 1 2   10  5  o 13 1.97513e+01 4.00762e-01 5.19277e+02 137.712 -5.67887e+00 5.16522e+00  0.00000e+00 0.00000e+00 1.72541e+02 137.712 3.46736e+02 317.712 0.9324 
1 1 1 2   10  6  o 18 1.14677e+01 3.36128e-01 1.70193e+02 121.171 -8.57404e-01 1.41737e+00  0.00000e+00 0.00000e+00 1.02224e+02 121.171 6.79692e+01 301.171 0.6325 
1 1 1 2   10  7  f 0  3.12454e+01 5.81691e-01 3.75815e+02 174.557 -1.20973e+01 1.15261e+00  0.00000e+00 0.00000e+00 7.47940e+02 174.557 3.72125e+02 174.557 0.9579 
1 1 1 2   10  8  o 15 4.32397e+01 7.69076e-01 6.36640e+02 174.350 -3.53603e+01 3.49817e+00  0.00000e+00 0.00000e+00 9.63180e+02 174.350 3.26539e+02 174.350 0.9858 
1 1 1 2   10  9  o 5  2.56450e+01 5.25261e-01 4.60609e+02 207.434 -1.97283e+01 -1.02412e+01 0.00000e+00 0.00000e+00 4.79550e+02 207.434 1.89414e+01 207.434 0.9772 
1 1 1 2   10  10 o 14 1.23887e+01 5.03762e-01 9.33898e+01 78.003  5.89566e-01  2.77437e+00  0.00000e+00 0.00000e+00 2.76888e+02 78.003  1.83498e+02 78.003  0.7971 
1 1 1 2   10  11 o 2  1.52558e+01 6.04598e-01 3.13741e+02 46.210  1.06343e+01  1.10930e+01  0.00000e+00 0.00000e+00 2.39037e+02 46.210  7.47048e+01 226.210 0.9669 
1 1 1 2   10  12 o 3  1.37126e+01 6.86438e-01 3.09833e+02 227.787 -1.20165e+01 -1.32464e+01 0.00000e+00 0.00000e+00 1.89152e+02 227.787 1.20680e+02 47.787  0.9716 
1 1 1 2   10  13 f 0  3.03245e+01 7.37038e-01 3.51806e+02 336.042 5.83316e+01  -2.59198e+01 0.00000e+00 0.00000e+00 7.74186e+02 336.042 4.22380e+02 336.042 0.9921 
1 1 1 2   10  14 o 17 7.55360e+00 1.06970e+00 9.41701e+01 174.570 -5.39016e+00 5.12405e-01  0.00000e+00 0.00000e+00 1.60686e+02 174.570 6.65160e+01 174.570 0.9022 
1 1 1 2   10  15 o 19 9.52172e+00 1.18411e+00 1.45413e+02 240.000 -6.10129e+00 -1.05679e+01 0.00000e+00 0.00000e+00 1.95487e+02 240.000 5.00740e+01 240.000 0.9581 
1 1 1 2   10  16 o 5  1.19748e+01 1.15969e+00 1.52255e+02 30.359  1.75808e+01  1.02978e+01  0.00000e+00 0.00000e+00 2.83716e+02 30.359  1.31460e+02 30.359  0.9751 
1 1 1 2   10  17 o 15 6.80490e+00 1.53499e+00 1.56610e+02 257.851 -2.27127e+00 -1.05501e+01 0.00000e+00 0.00000e+00 8.51560e+01 257.851 7.14535e+01 77.851  0.9525 
1 1 1 2   10  18 o 4  1.23372e+01 1.62036e+00 2.09401e+02 315.969 1.99498e+01  -1.92862e+01 0.00000e+00 0.00000e+00 2.41971e+02 315.969 3.25701e+01 315.969 0.9818 
1 1 1 2   10  19 o 11 8.53610e+00 2.11899e+00 1.22246e+02 138.538 -6.65259e+00 5.87776e+00  0.00000e+00 0.00000e+00 1.77037e+02 138.538 5.47918e+01 138.538 0.9419 
1 1 1 2   11  0  o 11 1.38842e+01 3.58951e-01 2.73087e+02 214.911 -8.39148e-01 -5.85646e-01 0.00000e+00 0.00000e+00 3.59056e+01 34.911  3.08993e+02 34.911  0.4546 
1 1 1 2   11  1  o 2  1.43040e+01 2.94833e-01 3.27664e+01 83.141  1.77552e-02  1.47609e-01  0.00000e+00 0.00000e+00 7.08359e+00 83.141  2.56829e+01 263.141 0.0741 
1 1 1 2   11  2  o 3  2.16941e+01 4.03536e-01 3.81405e+02 228.805 -1.84562e+00 -2.10862e+00 0.00000e+00 0.00000e+00 2.66111e+02 228.805 1.15294e+02 48.805  0.7942 
1 1 1 2   11  3  o 11 3.78727e+01 6.52641e-01 7.39222e+02 62.464  5.89686e+00  1.13105e+01  0.00000e+00 0.00000e+00 6.26968e+02 62.464  1.12253e+02 242.464 0.9600 
1 1 1 2   11  4  o 19 1.94376e+01 3.87724e-01 5.44201e+02 279.904 1.45949e+00  -8.35918e+00 0.00000e+00 0.00000e+00 1.41635e+02 279.904 4.02565e+02 99.904  0.9391 
1 1 1 2   11  5  o 17 1.80535e+01 3.82575e-01 5.01706e+02 38.416  5.25634e+00  4.16849e+00  0.00000e+00 0.00000e+00 1.23667e+02 38.416  3.78039e+02 218.416 0.9221 
1 1 1 2   11  6  o 13 3.35088e+01 6.06843e-01 4.50188e+02 250.390 -4.51928e+00 -1.26844e+01 0.00000e+00 0.00000e+00 7.60594e+02 250.390 3.10406e+02 250.390 0.9621 
1 1 1 2   11  7  o 3  1.94135e+01 4.28681e-01 1.76657e+02 235.873 -2.32551e+00 -3.43129e+00 0.00000e+00 0.00000e+00 4.56631e+02 235.873 2.79974e+02 235.873 0.8689 
1 1 1 2   11  8  o 3  3.32320e+01 6.21981e-01 8.17542e+02 208.234 -3.09874e+01 -1.66390e+01 0.00000e+00 0.00000e+00 4.11787e+02 208.234 4.05755e+02 28.234  0.9857 
1 1 1 2   11  9  o 6  3.33815e+01 6.41320e-01 7.61307e+02 302.323 2.37866e+01  -3.75937e+01 0.00000e+00 0.00000e+00 4.76788e+02 302.323 2.84519e+02 122.323 0.9887 
1 1 1 2   11  10 o 3  2.53233e+01 5.51338e-01 4.96105e+02 31.767  2.60900e+01  1.61558e+01  0.00000e+00 0.00000e+00 4.37778e+02 31.767  5.83277e+01 211.767 0.9836 
1 1 1 2   11  11 o 2  2.53209e+01 6.41095e-01 6.29556e+02 168.605 -4.99749e+01 1.00717e+01  0.00000e+00 0.00000e+00 3.09955e+02 168.605 3.19601e+02 348.605 0.9901 
1 1 1 2   11  12 o 19 1.09870e+01 1.23924e+00 2.58748e+02 49.898  7.32082e+00  8.69305e+00  0.00000e+00 0.00000e+00 1.34177e+02 49.898  1.24572e+02 229.898 0.9549 
1 1 1 2   11  13 o 19 1.16016e+01 8.56390e-01 2.35903e+02 208.538 -1.40721e+01 -7.65257e+00 0.00000e+00 0.00000e+00 1.84503e+02 208.538 5.14007e+01 28.538  0.9683 
1 1 1 2   11  14 o 4  6.72724e+00 1.12996e+00 1.66780e+02 44.190  6.00562e+00  5.83826e+00  0.00000e+00 0.00000e+00 6.92631e+01 44.190  9.75168e+01 224.190 0.9383 
1 1 1 2   11  15 o 9  7.88738e+00 1.23479e+00 1.67730e+02 224.715 -8.11726e+00 -8.03691e+00 0.00000e+00 0.00000e+00 1.13783e+02 224.715 5.39472e+01 44.715  0.9552 
1 1 1 2   11  16 o 12 1.72354e+01 9.80209e-01 3.00694e+02 10.662  6.18512e+01  1.16441e+01  0.00000e+00 0.00000e+00 3.37645e+02 10.662  3.69510e+01 10.662  0.9920 
1 1 1 2   11  17 o 10 3.97098e+00 1.26813e+00 1.24143e+02 215.128 -4.91504e+00 -3.45792e+00 0.00000e+00 0.00000e+00 1.10147e+01 215.128 1.13128e+02 35.128  0.9125 
1 1 1 2   11  18 o 9  3.61375e+00 1.23289e+00 1.44158e+01 220.788 -5.43791e-01 -4.69197e-01 0.00000e+00 0.00000e+00 3.10702e+01 220.788 1.66544e+01 220.788 0.3378 
1 1 1 2   11  19 o 4  5.48226e+00 1.69856e+00 1.10378e+02 112.476 -2.63779e+00 6.37579e+00  0.00000e+00 0.00000e+00 7.82640e+01 112.476 3.21136e+01 292.476 0.9244 
1 1 1 2   12  0  o 2  1.61622e+01 3.14657e-01 3.77359e+02 89.611  1.38532e-02  2.04280e+00  0.00000e+00 0.00000e+00 5.06264e+01 89.611  3.26733e+02 269.611 0.7047 
1 1 1 2   12  1  o 16 1.54676e+01 3.12985e-01 5.79307e+02 281.596 5.34727e-01  -2.60591e+00 0.00000e+00 0.00000e+00 1.25130e+02 101.596 7.04437e+02 101.596 0.7814 
1 1 1 2   12  2  o 15 1.25476e+01 3.21907e-01 3.63176e+02 252.496 -4.43186e-01 -1.40531e+00 0.00000e+00 0.00000e+00 8.51987e+01 72.497  4.48374e+02 72.497  0.5895 
1 1 1 2   12  3  o 15 1.82514e+01 3.67241e-01 3.48514e+02 34.959  2.31018e+00  1.61515e+00  0.00000e+00 0.00000e+00 1.97158e+02 34.959  1.51355e+02 214.959 0.7956 
1 1 1 2   12  4  o 12 4.54842e+00 3.37573e-01 2.57025e+02 169.136 -9.04293e-01 1.73544e-01  0.00000e+00 0.00000e+00 1.85658e+02 349.136 4.42683e+02 349.136 0.4176 
1 1 1 2   12  5  o 6  9.89322e+00 3.16126e-01 2.82448e+02 340.842 2.02592e+00  -7.03816e-01 0.00000e+00 0.00000e+00 1.48145e+01 160.842 2.97263e+02 160.842 0.7202 
1 1 1 2   12  6  o 8  1.21268e+01 3.46302e-01 2.57969e+02 288.269 8.73298e-01  -2.64540e+00 0.00000e+00 0.00000e+00 1.03093e+02 288.269 1.54876e+02 108.269 0.7928 
1 1 1 2   12  7  o 6  3.29731e+01 6.07374e-01 6.92917e+02 193.597 -2.66229e+01 -6.43918e+00 0.00000e+00 0.00000e+00 5.22173e+02 193.597 1.70744e+02 13.597  0.9816 
1 1 1 2   12  8  o 5  1.42392e+01 5.29206e-01 1.48139e+02 293.242 1.06732e+00  -2.48524e+00 0.00000e+00 0.00000e+00 2.71640e+02 293.242 1.23501e+02 293.242 0.7855 
1 1 1 2   12  9  o 10 2.55415e+01 5.41808e-01 4.82775e+02 127.475 -1.31583e+01 1.71638e+01  0.00000e+00 0.00000e+00 4.52920e+02 127.475 2.98554e+01 307.475 0.9766 
1 1 1 2   12  10 o 1  2.61910e+01 5.64917e-01 3.93065e+02 87.188  1.23120e+00  2.50634e+01  0.00000e+00 0.00000e+00 5.69153e+02 87.188  1.76088e+02 87.188  0.9799 
1 1 1 2   12  11 o 14 2.08696e+01 6.46617e-01 3.67392e+02 58.364  1.28396e+01  2.08408e+01  0.00000e+00 0.00000e+00 3.98497e+02 58.364  3.11046e+01 58.364  0.9794 
1 1 1 2   12  12 o 7  1.27817e+01 7.14293e-01 2.79721e+02 204.150 -1.41118e+01 -6.32742e+00 0.00000e+00 0.00000e+00 1.83196e+02 204.150 9.65254e+01 24.150  0.9671 
1 1 1 2   12  13 o 18 1.70960e+01 7.03909e-01 2.35667e+02 315.479 1.72440e+01  -1.69579e+01 0.00000e+00 0.00000e+00 3.90755e+02 315.479 1.55088e+02 315.479 0.9791 
1 1 1 2   12  14 o 7  1.88070e+01 8.11607e-01 3.21096e+02 127.506 -3.04528e+01 3.96785e+01  0.00000e+00 0.00000e+00 3.75136e+02 127.506 5.40400e+01 127.506 0.9900 
1 1 1 2   12  15 o 14 1.05703e+01 1.06883e+00 2.12951e+02 303.263 1.19314e+01  -1.81891e+01 0.00000e+00 0.00000e+00 1.72825e+02 303.263 4.01258e+01 123.264 0.9767 
1 1 1 2   12  16 o 18 7.32571e+00 1.42289e+00 8.04927e+01 287.352 1.72019e+00  -5.50529e+00 0.00000e+00 0.00000e+00 1.68000e+02 287.352 8.75072e+01 287.352 0.9086 
1 1 1 2   12  17 o 2  4.82638e+00 1.37718e+00 1.00686e+02 311.551 3.68609e+00  -4.15895e+00 0.00000e+00 0.00000e+00 6.22081e+01 311.551 3.84777e+01 131.551 0.9049 
1 1 1 2   12  18 o 14 7.65983e+00 1.77908e+00 1.51453e+02 156.779 -1.03293e+01 4.43170e+00  0.00000e+00 0.00000e+00 1.20957e+02 156.779 3.04959e+01 336.779 0.9544 
1 1 1 2   12  19 o 3  9.36190e+00 2.10690e+00 1.75298e+02 47.642  9.47916e+00  1.03965e+01  0.00000e+00 0.00000e+00 1.60553e+02 47.642  1.47453e+01 227.642 0.9638 
1 1 1 2   13  0  o 12 2.87754e+01 5.02389e-01 5.06991e+02 103.628 -1.06533e+00 4.39421e+00  0.00000e+00 0.00000e+00 4.45572e+02 103.628 6.14191e+01 283.628 0.8810 
1 1 1 2   13  1  o 6  3.81363e+01 6.52666e-01 6.42584e+02 303.327 3.73623e+00  -5.68198e+00 0.00000e+00 0.00000e+00 6.80500e+02 303.327 3.79161e+01 303.327 0.9232 
1 1 1 2   13  2  o 3  1.18542e+01 2.83870e-01 2.72269e+02 42.770  1.13501e+00  1.04994e+00  0.00000e+00 0.00000e+00 1.72517e+00 222.770 2.73995e+02 222.770 0.6073 
1 1 1 2   13  3  o 5  2.61398e+01 4.77427e-01 3.23449e+02 195.835 -4.17035e+00 -1.18282e+00 0.00000e+00 0.00000e+00 5.36248e+02 195.835 2.12800e+02 195.835 0.8753 
1 1 1 2   13  4  o 8  1.06720e+01 3.03041e-01 1.82079e+02 243.523 -6.69312e-01 -1.34377e+00 0.00000e+00 0.00000e+00 5.70627e+01 243.523 1.25016e+02 63.523  0.5964 
1 1 1 2   13  5  o 12 1.01180e+01 3.21160e-01 2.48089e+02 24.242  1.73612e+00  7.81761e-01  0.00000e+00 0.00000e+00 1.08724e+01 24.242  2.37216e+02 204.242 0.6814 
1 1 1 2   13  6  o 18 1.97410e+01 4.18123e-01 3.40304e+02 36.531  4.76993e+00  3.53352e+00  0.00000e+00 0.00000e+00 3.35322e+02 36.531  4.98201e+00 216.531 0.9114 
1 1 1 2   13  7  o 9  2.26273e+01 4.72278e-01 4.35684e+02 79.991  2.05218e+00  1.16284e+01  0.00000e+00 0.00000e+00 3.76973e+02 79.991  5.87107e+01 259.991 0.9567 
1 1 1 2   13  8  o 15 2.88554e+01 5.64038e-01 5.50334e+02 315.976 1.45890e+01  -1.41004e+01 0.00000e+00 0.00000e+00 5.05498e+02 315.976 4.48360e+01 135.976 0.9750 
1 1 1 2   13  9  o 12 1.95894e+01 4.91559e-01 3.71539e+02 28.192  1.12471e+01  6.02866e+00  0.00000e+00 0.00000e+00 3.33868e+02 28.192  3.76707e+01 208.192 0.9600 
1 1 1 2   13  10 o 17 5.14988e+00 8.31972e-01 1.89582e+02 30.171  1.99591e+00  1.16030e+00  0.00000e+00 0.00000e+00 4.62245e+01 210.171 2.35807e+02 210.171 0.7425 
1 1 1 2   13  11 o 13 3.45256e+01 6.93690e-01 5.27987e+02 31.640  4.77783e+01  2.94398e+01  0.00000e+00 0.00000e+00 7.54144e+02 31.640  2.26157e+02 31.640  0.9911 
1 1 1 2   13  12 f 0  1.50572e+01 7.21431e-01 1.08416e+02 186.886 -6.99665e+00 -8.45000e-01 0.00000e+00 0.00000e+00 4.13749e+02 186.886 3.05333e+02 186.886 0.9261 
1 1 1 2   13  13 o 11 1.21897e+01 9.92994e-01 2.29308e+02 327.043 1.36161e+01  -8.82801e+00 0.00000e+00 0.00000e+00 2.12570e+02 327.043 1.67385e+01 147.043 0.9687 
1 1 1 2   13  14 o 10 5.93060e+00 1.26254e+00 5.57191e+01 242.355 -1.10837e+00 -2.11605e+00 0.00000e+00 0.00000e+00 1.11127e+02 242.355 5.54075e+01 242.355 0.7523 
1 1 1 2   13  15 o 16 7.58067e+00 1.26449e+00 1.05750e+02 230.402 -4.55927e+00 -5.51155e+00 0.00000e+00 0.00000e+00 1.56876e+02 230.402 5.11257e+01 230.402 0.9272 
1 1 1 2   13  16 o 16 1.29035e+01 1.05196e+00 1.89286e+02 276.653 3.43556e+00  -2.94529e+01 0.00000e+00 0.00000e+00 2.84231e+02 276.653 9.49449e+01 276.653 0.9830 
1 1 1 2   13  17 o 14 4.72247e+00 1.42284e+00 6.26687e+01 266.895 -1.78394e-01 -3.28856e+00 0.00000e+00 0.00000e+00 8.34418e+01 266.895 2.07731e+01 266.895 0.8295 
1 1 1 2   13  18 o 18 6.02543e+00 1.52414e+00 1.21642e+02 83.787  9.06011e-01  8.32182e+00  0.00000e+00 0.00000e+00 8.89967e+01 83.787  3.26455e+01 263.786 0.9382 
1 1 1 2   13  19 o 12 6.21140e+00 1.81544e+00 1.16721e+02 39.854  5.83409e+00  4.87002e+00  0.00000e+00 0.00000e+00 9.86779e+01 39.854  1.80433e+01 219.853 0.9317 
1 1 1 2   14  0  o 1  1.70266e+01 4.20904e-01 4.63755e+02 227.684 -1.52928e+00 -1.67971e+00 0.00000e+00 0.00000e+00 8.20401e+00 227.684 4.55551e+02 47.684  0.7377 
1 1 1 2   14  1  o 8  3.32918e+01 5.76210e-01 5.70620e+02 316.748 4.98766e+00  -4.69218e+00 0.00000e+00 0.00000e+00 5.85048e+02 316.748 1.44284e+01 316.748 0.9238 
1 1 1 2   14  2  o 12 3.82719e+01 6.57530e-01 7.60683e+02 192.473 -1.29455e+01 -2.86366e+00 0.00000e+00 0.00000e+00 6.22097e+02 192.473 1.38585e+02 12.473  0.9615 
1 1 1 2   14  3  o 8  2.93391e+01 5.27157e-01 2.06904e+02 61.787  1.42473e+00  2.65571e+00  0.00000e+00 0.00000e+00 6.87125e+02 61.787  4.80221e+02 61.787  0.8110 
1 1 1 2   14  4  o 14 1.45560e+01 3.73871e-01 2.24546e+02 250.099 -6.45379e-01 -1.78279e+00 0.00000e+00 0.00000e+00 1.47277e+02 250.099 7.72684e+01 70.099  0.6799 
1 1 1 2   14  5  f 0  1.26491e+01 3.51507e-01 2.20229e+02 318.727 1.56844e+00  -1.37660e+00 0.00000e+00 0.00000e+00 1.17835e+02 318.727 1.02394e+02 138.727 0.7115 
1 1 1 2   14  6  o 6  2.30488e+01 4.61707e-01 1.91811e+02 154.153 -3.48861e+00 1.69003e+00  0.00000e+00 0.00000e+00 5.51327e+02 154.153 3.59516e+02 154.153 0.8586 
1 1 1 2   14  7  o 9  1.47158e+01 3.91957e-01 2.54792e+02 103.975 -1.08157e+00 4.34591e+00  0.00000e+00 0.00000e+00 2.31179e+02 103.975 2.36130e+01 283.975 0.8797 
1 1 1 2   14  8  o 16 2.85207e+01 5.62457e-01 5.22701e+02 0.428   1.89944e+01  1.41764e-01  0.00000e+00 0.00000e+00 5.18997e+02 0.428   3.70380e+00 180.428 0.9733 
1 1 1 2   14  9  o 15 5.08712e+01 9.62271e-01 8.78054e+02 160.164 -7.04638e+01 2.54185e+01  0.00000e+00 0.00000e+00 1.01731e+03 160.164 1.39260e+02 160.164 0.9933 
1 1 1 2   14  10 o 8  6.42050e+00 7.73386e-01 2.11036e+02 345.777 3.11498e+00  -7.89552e-01 0.00000e+00 0.00000e+00 1.25453e+01 165.777 2.23581e+02 165.777 0.8246 
1 1 1 2   14  11 o 13 2.87887e+01 6.37904e-01 5.89908e+02 184.407 -5.22796e+01 -4.02941e+00 0.00000e+00 0.00000e+00 4.78457e+02 184.407 1.11451e+02 4.407   0.9904 
1 1 1 2   14  12 o 13 1.52575e+01 6.71132e-01 1.96436e+02 178.695 -1.36296e+01 3.10442e-01  0.00000e+00 0.00000e+00 3.53532e+02 178.695 1.57096e+02 178.695 0.9626 
1 1 1 2   14  13 o 17 1.05212e+01 9.03265e-01 1.61077e+02 158.874 -9.33957e+00 3.60864e+00  0.00000e+00 0.00000e+00 2.12426e+02 158.874 5.13489e+01 158.874 0.9487 
1 1 1 2   14  14 o 16 4.86047e+00 1.22450e+00 9.38239e+01 136.533 -2.42136e+00 2.29516e+00  0.00000e+00 0.00000e+00 5.74029e+01 136.533 3.64209e+01 316.533 0.8321 
1 1 1 2   14  15 o 16 1.37199e+01 9.39035e-01 1.83942e+02 267.512 -1.10954e+00 -2.55318e+01 0.00000e+00 0.00000e+00 3.18539e+02 267.512 1.34598e+02 267.512 0.9802 
1 1 1 2   14  16 f 0  5.62106e+00 1.35524e+00 1.43724e+02 264.830 -7.58026e-01 -8.37837e+00 0.00000e+00 0.00000e+00 5.32150e+01 264.830 9.05092e+01 84.830  0.9385 
1 1 1 2   14  17 o 9  3.72204e+00 1.19997e+00 1.06942e+02 103.491 -1.17541e+00 4.89949e+00  0.00000e+00 0.00000e+00 1.71972e+01 103.491 8.97449e+01 283.491 0.8943 
1 1 1 2   14  18 o 2  8.62469e+00 1.80097e+00 6.00818e+01 332.247 4.20706e+00  -2.21368e+00 0.00000e+00 0.00000e+00 2.25064e+02 332.247 1.64982e+02 332.247 0.8873 
1 1 1 2   14  19 o 2  4.57872e+00 1.53032e+00 1.12825e+02 181.895 -6.44323e+00 -2.13149e-01 0.00000e+00 0.00000e+00 4.37534e+01 181.895 6.90720e+01 1.895   0.9188 
1 1 1 2   15  0  o 1  1.42667e+01 2.96379e-01 3.14471e+02 20.169  1.56207e+00  5.73769e-01  0.00000e+00 0.00000e+00 2.54734e+01 20.169  2.88998e+02 200.169 0.6342 
1 1 1 2   15  1  o 3  4.85515e+01 8.18743e-01 9.51022e+02 142.203 -1.23150e+01 9.55158e+00  0.00000e+00 0.00000e+00 8.13789e+02 142.203 1.37233e+02 322.202 0.9674 
1 1 1 2   15  2  o 7  1.91263e+01 3.74422e-01 2.90095e+02 109.318 -7.99210e-01 2.27986e+00  0.00000e+00 0.00000e+00 2.52881e+02 109.318 3.72140e+01 289.318 0.7555 
1 1 1 2   15  3  o 10 2.92190e+01 5.24875e-01 6.54277e+02 13.953  8.92052e+00  2.21633e+00  0.00000e+00 0.00000e+00 3.81991e+02 13.953  2.72286e+02 193.953 0.9439 
1 1 1 2   15  4  o 4  2.16124e+01 4.22095e-01 3.18869e+02 254.543 -1.04336e+00 -3.77334e+00 0.00000e+00 0.00000e+00 3.79522e+02 254.543 6.06532e+01 254.543 0.8602 
1 1 1 2   15  5  o 15 6.76161e+00 3.44761e-01 1.18647e+02 353.280 6.95368e-01  -8.19340e-02 0.00000e+00 0.00000e+00 3.47741e+01 173.280 1.53421e+02 173.280 0.3303 
1 1 1 2   15  6  o 3  2.47243e+01 4.85858e-01 6.08348e+02 33.512  1.20068e+01  7.95062e+00  0.00000e+00 0.00000e+00 2.87220e+02 33.512  3.21127e+02 213.512 0.9646 
1 1 1 2   15  7  o 2  1.98924e+01 4.45515e-01 3.87877e+02 53.477  5.08995e+00  6.87301e+00  0.00000e+00 0.00000e+00 3.13735e+02 53.477  7.41425e+01 233.477 0.9396 
1 1 1 2   15  8  o 19 2.23885e+01 4.90135e-01 4.53280e+02 195.243 -1.24622e+01 -3.39591e+00 0.00000e+00 0.00000e+00 3.53629e+02 195.243 9.96516e+01 15.243  0.9605 
1 1 1 2   15  9  o 6  7.74772e+00 5.57621e-01 1.81988e+02 284.527 6.03307e-01  -2.32830e+00 0.00000e+00 0.00000e+00 3.72062e+01 284.527 1.44781e+02 104.527 0.7543 
1 1 1 2   15  10 o 16 3.10601e+01 6.40958e-01 4.32922e+02 40.028  2.45929e+01  2.06562e+01  0.00000e+00 0.00000e+00 7.13223e+02 40.028  2.80301e+02 40.028  0.9843 
1 1 1 2   15  11 o 1  3.57719e+01 7.16759e-01 5.81267e+02 245.079 -2.68456e+01 -5.77785e+01 0.00000e+00 0.00000e+00 7.48478e+02 245.079 1.67210e+02 245.079 0.9921 
1 1 1 2   15  12 f 0  2.16185e+01 6.49172e-01 3.19341e+02 323.729 2.53399e+01  -1.85942e+01 0.00000e+00 0.00000e+00 4.77178e+02 323.729 1.57837e+02 323.729 0.9840 
1 1 1 2   15  13 o 11 1.70648e+01 7.48054e-01 3.28112e+02 294.342 1.40145e+01  -3.09786e+01 0.00000e+00 0.00000e+00 3.00980e+02 294.342 2.71328e+01 114.342 0.9852 
1 1 1 2   15  14 o 11 1.88910e+01 7.68634e-01 3.15360e+02 263.595 -5.83977e+00 -5.20181e+01 0.00000e+00 0.00000e+00 3.84221e+02 263.595 6.88605e+01 263.595 0.9904 
1 1 1 2   15  15 o 10 5.12297e+00 1.30413e+00 9.94649e+01 133.861 -2.94331e+00 3.06276e+00  0.00000e+00 0.00000e+00 6.75164e+01 133.861 3.19485e+01 313.861 0.8724 
1 1 1 2   15  16 o 10 4.35614e+00 1.28976e+00 8.47713e+01 255.359 -1.00541e+00 -3.84840e+00 0.00000e+00 0.00000e+00 5.55051e+01 255.359 2.92661e+01 75.359  0.8627 
1 1 1 2   15  17 o 15 6.42108e+00 1.55847e+00 1.02073e+02 71.932  1.99321e+00  6.10991e+00  0.00000e+00 0.00000e+00 1.17884e+02 71.932  1.58113e+01 71.932  0.9185 
1 1 1 2   15  18 o 11 4.80591e+00 1.47968e+00 1.08162e+02 289.032 1.89565e+00  -5.49554e+00 0.00000e+00 0.00000e+00 5.46645e+01 289.032 5.34971e+01 109.032 0.9094 
1 1 1 2   15  19 o 2  4.31969e+00 1.45703e+00 6.00326e+01 98.629  -5.11279e-01 3.36928e+00  0.00000e+00 0.00000e+00 7.43956e+01 98.629  1.43630e+01 98.629  0.8361 
1 1 1 2   16  0  o 4  8.78703e+00 3.57222e-01 1.65688e+02 171.255 -4.97310e-01 7.64950e-02  0.00000e+00 0.00000e+00 8.51518e+01 351.255 2.50840e+02 351.255 0.2439 
1 1 1 2   16  1  o 19 1.87131e+01 3.64419e-01 4.27568e+02 119.751 -1.96232e+00 3.43324e+00  0.00000e+00 0.00000e+00 1.78348e+02 119.751 2.49219e+02 299.751 0.8617 
1 1 1 2   16  2  o 17 1.80808e+01 3.63524e-01 1.97610e+02 248.012 -6.39403e-01 -1.58351e+00 0.00000e+00 0.00000e+00 2.39524e+02 248.012 4.19143e+01 248.012 0.6435 
1 1 1 2   16  3  o 15 2.67063e+01 4.89415e-01 6.19728e+02 337.667 1.00135e+01  -4.11365e+00 0.00000e+00 0.00000e+00 3.36118e+02 337.667 2.83609e+02 157.667 0.9526 
1 1 1 2   16  4  o 12 9.69089e+00 3.01872e-01 2.90705e+02 249.514 -5.49069e-01 -1.46967e+00 0.00000e+00 0.00000e+00 6.76518e+01 69.514  3.58357e+02 69.514  0.6127 
1 1 1 2   16  5  o 4  1.27383e+01 4.33327e-01 1.72296e+02 168.246 -1.84930e+00 3.84789e-01  0.00000e+00 0.00000e+00 1.52395e+02 168.246 1.99009e+01 348.246 0.6787 
1 1 1 2   16  6  o 15 5.32279e+00 4.20798e-01 2.01331e+02 148.263 -8.66882e-01 5.36170e-01  0.00000e+00 0.00000e+00 1.10755e+02 328.263 3.12086e+02 328.263 0.4532 
1 1 1 2   16  7  o 2  1.82985e+01 4.85730e-01 3.79461e+02 283.664 1.80855e+00  -7.43910e+00 0.00000e+00 0.00000e+00 2.60837e+02 283.664 1.18624e+02 103.664 0.9322 
1 1 1 2   16  8  o 7  4.35865e+01 7.81709e-01 8.65554e+02 178.341 -4.94237e+01 1.43109e+00  0.00000e+00 0.00000e+00 7.53310e+02 178.341 1.12243e+02 358.341 0.9898 
1 1 1 2   16  9  o 2  2.43603e+01 5.73151e-01 5.41368e+02 240.901 -1.09058e+01 -1.95944e+01 0.00000e+00 0.00000e+00 3.51687e+02 240.901 1.89682e+02 60.901  0.9774 
1 1 1 2   16  10 o 1  2.76207e+01 6.09626e-01 3.09989e+02 314.536 1.60236e+01  -1.62851e+01 0.00000e+00 0.00000e+00 7.02524e+02 314.536 3.92535e+02 314.536 0.9779 
1 1 1 2   16  11 o 8  2.08249e+01 6.09209e-01 3.40864e+02 327.291 1.90591e+01  -1.22402e+01 0.00000e+00 0.00000e+00 4.21949e+02 327.291 8.10852e+01 327.291 0.9777 
1 1 1 2   16  12 o 1  6.48948e+00 1.07426e+00 1.38851e+02 30.702  3.31462e+00  1.96823e+00  0.00000e+00 0.00000e+00 6.95601e+01 30.702  6.92909e+01 210.702 0.8577 
1 1 1 2   16  13 o 4  1.36038e+01 9.73296e-01 1.98912e+02 84.123  1.76041e+00  1.71014e+01  0.00000e+00 0.00000e+00 2.95078e+02 84.123  9.61656e+01 84.123  0.9705 
1 1 1 2   16  14 o 19 8.94611e+00 1.18333e+00 1.02448e+02 102.311 -1.51375e+00 6.93629e+00  0.00000e+00 0.00000e+00 2.07503e+02 102.311 1.05055e+02 102.311 0.9266 
1 1 1 2   16  15 o 11 1.79380e+01 8.75744e-01 3.72745e+02 161.540 -6.18021e+01 2.06306e+01  0.00000e+00 0.00000e+00 2.92250e+02 161.540 8.04956e+01 341.540 0.9923 
1 1 1 2   16  16 o 15 7.64197e+00 1.47087e+00 1.34323e+02 4.826   9.65352e+00  8.15082e-01  0.00000e+00 0.00000e+00 1.35782e+02 4.826   1.45859e+00 4.826   0.9469 
1 1 1 2   16  17 o 8  4.03456e+00 1.24257e+00 3.45110e+01 226.840 -1.11351e+00 -1.18744e+00 0.00000e+00 0.00000e+00 5.97052e+01 226.840 2.51942e+01 226.840 0.6262 
1 1 1 2   16  18 o 1  8.31048e+00 1.82051e+00 1.66968e+02 238.579 -6.55069e+00 -1.07229e+01 0.00000e+00 0.00000e+00 1.30059e+02 238.579 3.69082e+01 58.579  0.9593 
1 1 1 2   16  19 o 10 4.90199e+00 1.58138e+00 1.16355e+02 69.683  2.38122e+00  6.43155e+00  0.00000e+00 0.00000e+00 5.22005e+01 69.683  6.41544e+01 249.683 0.9239 
1 1 1 2   17  0  f 0  3.72189e+01 5.87544e-01 4.88056e+02 152.069 -5.17586e+00 2.74402e+00  0.00000e+00 0.00000e+00 7.84559e+02 152.069 2.96502e+02 152.069 0.9101 
1 1 1 2   17  1  o 6  1.75251e+01 3.50294e-01 5.61988e+02 284.802 1.17080e+00  -4.43062e+00 0.00000e+00 0.00000e+00 1.92407e+01 284.802 5.42747e+02 104.802 0.8827 
1 1 1 2   17  2  o 12 4.37069e+01 7.47319e-01 7.86363e+02 197.496 -1.49045e+01 -4.69837e+00 0.00000e+00 0.00000e+00 8.02342e+02 197.496 1.59796e+01 197.496 0.9675 
1 1 1 2   17  3  o 4  1.64971e+01 3.98833e-01 6.74038e+01 253.501 -2.00218e-01 -6.75951e-01 0.00000e+00 0.00000e+00 1.38526e+02 253.501 7.11221e+01 253.501 0.3323 
1 1 1 2   17  4  o 2  1.29718e+01 3.27320e-01 2.01367e+02 125.929 -1.23591e+00 1.70554e+00  0.00000e+00 0.00000e+00 1.46776e+02 125.929 5.45908e+01 305.929 0.7145 
1 1 1 2   17  5  o 5  1.95114e+01 4.62500e-01 2.90084e+02 45.747  3.35386e+00  3.44245e+00  0.00000e+00 0.00000e+00 3.61128e+02 45.747  7.10437e+01 45.747  0.8887 
1 1 1 2   17  6  o 15 1.56361e+01 3.92078e-01 3.92080e+02 28.705  4.90406e+00  2.68545e+00  0.00000e+00 0.00000e+00 1.39532e+02 28.705  2.52549e+02 208.705 0.9055 
1 1 1 2   17  7  o 5  2.73790e+01 5.39428e-01 6.02521e+02 183.628 -2.16669e+01 -1.37369e+00 0.00000e+00 0.00000e+00 4.01205e+02 183.628 2.01316e+02 3.628   0.9767 
1 1 1 2   17  8  o 3  3.20856e+01 6.17789e-01 5.63941e+02 22.808  2.19131e+01  9.21513e+00  0.00000e+00 0.00000e+00 6.14347e+02 22.808  5.04059e+01 22.808  0.9787 
1 1 1 2   17  9  o 1  1.20867e+01 4.96704e-01 1.76160e+02 107.676 -1.11162e+00 3.48824e+00  0.00000e+00 0.00000e+00 2.08740e+02 107.676 3.25796e+01 107.676 0.8491 
1 1 1 2   17  10 o 9  2.13910e+01 7.18076e-01 2.67619e+02 14.807  1.46386e+01  3.86963e+00  0.00000e+00 0.00000e+00 5.07292e+02 14.807  2.39673e+02 14.807  0.9664 
1 1 1 2   17  11 o 10 2.14919e+01 6.11698e-01 3.80150e+02 353.668 2.58552e+01  -2.86915e+00 0.00000e+00 0.00000e+00 4.09411e+02 353.668 2.92613e+01 353.668 0.9806 
1 1 1 2   17  12 o 9  1.32986e+01 7.04922e-01 2.71246e+02 288.459 5.44729e+00  -1.63194e+01 0.00000e+00 0.00000e+00 2.11979e+02 288.459 5.92669e+01 108.459 0.9705 
1 1 1 2   17  13 o 10 1.55751e+01 8.71921e-01 2.89898e+02 7.809   2.90248e+01  3.98051e+00  0.00000e+00 0.00000e+00 2.82826e+02 7.809   7.07257e+00 187.809 0.9828 
1 1 1 2   17  14 o 12 3.08232e+01 7.85158e-01 5.03139e+02 182.699 -1.35173e+02 -6.37167e+00 0.00000e+00 0.00000e+00 6.45015e+02 182.699 1.41876e+02 182.699 0.9963 
1 1 1 2   17  15 o 5  1.17490e+01 1.02300e+00 1.46742e+02 143.538 -1.28435e+01 9.49031e+00  0.00000e+00 0.00000e+00 2.78207e+02 143.538 1.31465e+02 143.538 0.9682 
1 1 1 2   17  16 o 9  5.76104e+00 1.35644e+00 1.14293e+02 15.186  6.35545e+00  1.72507e+00  0.00000e+00 0.00000e+00 8.36665e+01 15.186  3.06260e+01 195.186 0.9206 
1 1 1 2   17  17 o 15 4.44867e+00 1.34179e+00 1.07238e+02 283.163 1.31405e+00  -5.61896e+00 0.00000e+00 0.00000e+00 4.35016e+01 283.163 6.37363e+01 103.163 0.9086 
1 1 1 2   17  18 o 13 5.30694e+00 1.58291e+00 9.04727e+01 119.082 -2.59471e+00 4.66520e+00  0.00000e+00 0.00000e+00 8.75967e+01 119.082 2.87591e+00 299.082 0.9007 
1 1 1 2   17  19 o 15 7.82981e+00 1.94329e+00 1.36673e+02 118.722 -4.79423e+00 8.74870e+00  0.00000e+00 0.00000e+00 1.39700e+02 118.722 3.02765e+00 118.722 0.9485 
1 1 1 2   18  0  o 4  4.38534e+01 6.84249e-01 9.30055e+02 261.674 -2.76614e+00 -1.89018e+01 0.00000e+00 0.00000e+00 6.73732e+02 261.674 2.56322e+02 81.674  0.9735 
1 1 1 2   18  1  o 13 1.66587e+01 3.85831e-01 2.81513e+02 196.223 -1.97580e+00 -5.74899e-01 0.00000e+00 0.00000e+00 1.61000e+02 196.223 1.20513e+02 16.223  0.7070 
1 1 1 2   18  2  o 2  2.12121e+01 4.07120e-01 5.53510e+02 106.351 -1.72150e+00 5.86781e+00  0.00000e+00 0.00000e+00 1.74979e+02 106.351 3.78531e+02 286.351 0.9141 
1 1 1 2   18  3  o 11 2.67811e+01 6.30666e-01 3.14977e+02 66.329  2.77168e+00  6.32290e+00  0.00000e+00 0.00000e+00 6.15096e+02 66.329  3.00118e+02 66.329  0.9244 
1 1 1 2   18  4  o 18 1.07030e+01 3.15130e-01 3.21478e+02 295.369 1.16407e+00  -2.45491e+00 0.00000e+00 0.00000e+00 5.21665e+00 115.369 3.26695e+02 115.369 0.7867 
1 1 1 2   18  5  o 16 2.33484e+01 4.61160e-01 5.04827e+02 14.324  8.87942e+00  2.26724e+00  0.00000e+00 0.00000e+00 3.22701e+02 14.324  1.82125e+02 194.324 0.9438 
1 1 1 2   18  6  o 8  2.04020e+01 4.39621e-01 3.28452e+02 187.970 -6.00058e+00 -8.40151e-01 0.00000e+00 0.00000e+00 3.71112e+02 187.970 4.26606e+01 187.970 0.9133 
1 1 1 2   18  7  o 15 1.72738e+01 4.30094e-01 3.67411e+02 269.234 -1.11419e-01 -8.33178e+00 0.00000e+00 0.00000e+00 2.40685e+02 269.234 1.26725e+02 89.234  0.9379 
1 1 1 2   18  8  o 13 4.14120e+01 7.52572e-01 6.93660e+02 11.472  3.80162e+01  7.71546e+00  0.00000e+00 0.00000e+00 8.39931e+02 11.472  1.46271e+02 11.472  0.9870 
1 1 1 2   18  9  f 0  1.54846e+01 4.88942e-01 4.35490e+02 197.009 -1.10751e+01 -3.38790e+00 0.00000e+00 0.00000e+00 1.19562e+02 197.009 3.15928e+02 17.009  0.9558 
1 1 1 2   18  10 o 14 1.79173e+01 5.46508e-01 3.73243e+02 326.153 1.48250e+01  -9.94210e+00 0.00000e+00 0.00000e+00 2.79279e+02 326.153 9.39637e+01 146.153 0.9716 
1 1 1 2   18  11 o 8  1.31239e+01 1.09315e+00 2.01153e+02 278.661 1.20429e+00  -7.90587e+00 0.00000e+00 0.00000e+00 2.58656e+02 278.661 5.75034e+01 278.661 0.9352 
1 1 1 2   18  12 o 8  1.40316e+01 7.59712e-01 9.88014e+01 155.241 -5.95354e+00 2.74569e+00  0.00000e+00 0.00000e+00 3.84625e+02 155.241 2.85824e+02 155.241 0.9202 
1 1 1 2   18  13 o 18 1.20816e+01 8.02001e-01 2.17875e+02 146.341 -1.49019e+01 9.92275e+00  0.00000e+00 0.00000e+00 2.21336e+02 146.341 3.46100e+00 146.341 0.9717 
1 1 1 2   18  14 o 2  1.64895e+01 8.10062e-01 1.86349e+02 14.009  2.58439e+01  6.44781e+00  0.00000e+00 0.00000e+00 4.18447e+02 14.009  2.32098e+02 14.009  0.9810 
1 1 1 2   18  15 o 18 1.77127e+01 8.92002e-01 2.71410e+02 98.767  -7.66153e+00 4.96819e+01  0.00000e+00 0.00000e+00 3.83655e+02 98.767  1.12245e+02 98.767  0.9900 
1 1 1 2   18  16 o 6  1.24750e+01 1.15538e+00 1.78735e+02 268.534 -6.29301e-01 -2.45938e+01 0.00000e+00 0.00000e+00 2.77316e+02 268.534 9.85807e+01 268.534 0.9795 
1 1 1 2   18  17 f 0  6.81253e+00 1.58724e+00 7.50811e+01 24.367  4.84732e+00  2.19543e+00  0.00000e+00 0.00000e+00 1.53635e+02 24.367  7.85544e+01 24.367  0.9003 
1 1 1 2   18  18 f 0  1.06094e+01 1.86595e+00 1.16569e+02 230.502 -7.27177e+00 -8.82210e+00 0.00000e+00 0.00000e+00 2.60958e+02 230.502 1.44389e+02 230.502 0.9552 
1 1 1 2   18  19 o 11 4.02232e+00 1.35615e+00 9.07371e+01 35.935  4.14658e+00  3.00551e+00  0.00000e+00 0.00000e+00 4.33978e+01 35.935  4.73393e+01 215.935 0.8961 
1 1 1 2   19  0  o 10 3.12030e+01 5.04225e-01 5.43026e+02 109.236 -2.46088e+00 7.05256e+00  0.00000e+00 0.00000e+00 5.47614e+02 109.236 4.58757e+00 109.236 0.9304 
1 1 1 2   19  1  o 16 1.78944e+01 4.35842e-01 3.97181e+02 10.410  3.33402e+00  6.12527e-01  0.00000e+00 0.00000e+00 1.64250e+02 10.410  2.32931e+02 190.410 0.8351 
1 1 1 2   19  2  o 11 3.10588e+01 5.52865e-01 5.70593e+02 10.077  8.68339e+00  1.54319e+00  0.00000e+00 0.00000e+00 5.27938e+02 10.077  4.26555e+01 190.077 0.9415 
1 1 1 2   19  3  o 10 2.51130e+01 4.71333e-01 4.77572e+02 298.471 4.54627e+00  -8.38340e+00 0.00000e+00 0.00000e+00 4.14885e+02 298.471 6.26868e+01 118.471 0.9460 
1 1 1 2   19  4  o 10 1.40780e+01 3.44925e-01 4.63111e+02 173.865 -4.94059e+00 5.31058e-01  0.00000e+00 0.00000e+00 8.90307e+00 173.865 4.54208e+02 353.865 0.8927 
1 1 1 2   19  5  o 4  7.13385e+00 3.51555e-01 1.42094e+02 46.219  5.38945e-01  5.62378e-01  0.00000e+00 0.00000e+00 4.49453e+01 226.219 1.87039e+02 226.219 0.3626 
1 1 1 2   19  6  o 19 1.78552e+01 4.16302e-01 4.03607e+02 158.999 -6.03722e+00 2.31762e+00  0.00000e+00 0.00000e+00 2.12476e+02 158.999 1.91131e+02 338.999 0.9191 
1 1 1 2   19  7  o 16 1.86527e+01 6.35510e-01 3.54248e+02 300.300 4.33170e+00  -7.41270e+00 0.00000e+00 0.00000e+00 3.03686e+02 300.300 5.05619e+01 120.300 0.9398 
1 1 1 2   19  8  o 4  7.91632e+00 5.30726e-01 2.73498e+02 339.269 2.74542e+00  -1.03910e+00 0.00000e+00 0.00000e+00 3.43835e+01 159.269 3.07882e+02 159.269 0.8051 
1 1 1 2   19  9  o 7  1.06192e+01 5.33971e-01 1.91338e+02 72.290  1.29796e+00  4.06469e+00  0.00000e+00 0.00000e+00 1.56338e+02 72.290  3.49995e+01 252.290 0.8731 
1 1 1 2   19  10 o 1  1.08613e+01 5.96494e-01 1.58740e+02 165.119 -4.33784e+00 1.15264e+00  0.00000e+00 0.00000e+00 1.99509e+02 165.119 4.07692e+01 165.119 0.8800 
1 1 1 2   19  11 o 18 1.16181e+01 8.19753e-01 1.73561e+02 325.457 5.35400e+00  -3.68558e+00 0.00000e+00 0.00000e+00 2.26626e+02 325.457 5.30647e+01 325.457 0.9195 
1 1 1 2   19  12 o 5  2.13640e+01 6.80571e-01 3.99161e+02 206.687 -3.56077e+01 -1.78989e+01 0.00000e+00 0.00000e+00 3.90564e+02 206.687 8.59771e+00 26.687  0.9874 
1 1 1 2   19  13 o 10 7.39687e+00 1.55098e+00 2.11396e+02 25.643  7.82290e+00  3.75536e+00  0.00000e+00 0.00000e+00 4.88670e+01 25.643  1.62530e+02 205.643 0.9405 
1 1 1 2   19  14 o 3  1.57841e+01 8.09764e-01 2.32245e+02 149.344 -2.73065e+01 1.61851e+01  0.00000e+00 0.00000e+00 3.48465e+02 149.344 1.16219e+02 149.344 0.9841 
1 1 1 2   19  15 o 16 1.59841e+01 1.11010e+00 2.28942e+02 68.665  1.28154e+01  3.28104e+01  0.00000e+00 0.00000e+00 3.59597e+02 68.665  1.30655e+02 68.665  0.9857 
1 1 1 2   19  16 o 8  6.70514e+00 1.47370e+00 1.31026e+02 282.232 1.79674e+00  -8.28761e+00 0.00000e+00 0.00000e+00 1.03969e+02 282.232 2.70570e+01 102.232 0.9390 
1 1 1 2   19  17 o 17 6.19419e+00 1.59952e+00 4.86091e+01 240.855 -1.51335e+00 -2.71388e+00 0.00000e+00 0.00000e+00 1.40232e+02 240.855 9.16226e+01 240.855 0.8176 
1 1 1 2   19  18 o 6  6.84371e+00 1.80888e+00 1.13664e+02 12.952  7.21408e+00  1.65908e+00  0.00000e+00 0.00000e+00 1.23363e+02 12.952  9.69888e+00 12.952  0.9298 
1 1 1 2   20  0  o 11 2.28490e+01 3.93175e-01 1.06561e+02 316.877 8.49679e-01  -7.95742e-01 0.00000e+00 0.00000e+00 3.23904e+02 316.877 2.17343e+02 316.877 0.5015 
1 1 1 2   20  1  o 18 3.00133e+01 6.49136e-01 5.38314e+02 337.598 6.73572e+00  -2.77648e+00 0.00000e+00 0.00000e+00 5.08666e+02 337.598 2.96479e+01 157.598 0.9286 
1 1 1 2   20  2  o 16 1.27446e+01 3.07438e-01 5.29205e+01 338.723 3.00201e-01  -1.16903e-01 0.00000e+00 0.00000e+00 2.32156e+01 338.723 2.97049e+01 158.723 0.1590 
1 1 1 2   20  3  o 10 1.59360e+01 3.53442e-01 2.36089e+02 183.886 -2.89791e+00 -1.96828e-01 0.00000e+00 0.00000e+00 2.44400e+02 183.886 8.31029e+00 183.886 0.8027 
1 1 1 2   20  4  o 18 1.84516e+01 3.92958e-01 4.18600e+02 197.953 -5.48300e+00 -1.77657e+00 0.00000e+00 0.00000e+00 2.11015e+02 197.953 2.07585e+02 17.953  0.9085 
1 1 1 2   20  5  o 3  2.60727e+01 5.01278e-01 4.62467e+02 88.412  2.88061e-01  1.03891e+01  0.00000e+00 0.00000e+00 4.68226e+02 88.412  5.75913e+00 88.412  0.9506 
1 1 1 2   20  6  o 18 1.83698e+00 5.32633e-01 8.23951e+01 350.164 1.58309e-01  -2.74468e-02 0.00000e+00 0.00000e+00 7.68727e+01 170.164 1.59268e+02 170.164 0.0801 
1 1 1 2   20  7  o 1  3.18532e+01 6.04328e-01 9.03663e+02 99.542  -5.65479e+00 3.36402e+01  0.00000e+00 0.00000e+00 2.74120e+02 99.542  6.29543e+02 279.542 0.9852 
1 1 1 2   20  8  o 9  2.16943e+01 6.95484e-01 3.29681e+02 282.787 2.50686e+00  -1.10454e+01 0.00000e+00 0.00000e+00 4.47384e+02 282.787 1.17703e+02 282.787 0.9548 
1 1 1 2   20  9  o 13 2.92392e+01 6.46204e-01 5.32667e+02 273.023 1.71146e+00  -3.24050e+01 0.00000e+00 0.00000e+00 5.46744e+02 273.023 1.40769e+01 273.023 0.9845 
1 1 1 2   20  10 o 14 1.30429e+01 6.44288e-01 2.36899e+02 187.399 -7.94313e+00 -1.03154e+00 0.00000e+00 0.00000e+00 2.20331e+02 187.399 1.65684e+01 7.399   0.9353 
1 1 1 2   20  11 o 8  4.35175e+01 8.45862e-01 6.82364e+02 309.537 6.06510e+01  -7.34796e+01 0.00000e+00 0.00000e+00 9.39189e+02 309.537 2.56826e+02 309.537 0.9947 
1 1 1 2   20  12 o 5  1.75987e+01 6.81916e-01 3.39266e+02 183.043 -2.77976e+01 -1.47782e+00 0.00000e+00 0.00000e+00 3.07612e+02 183.043 3.16540e+01 3.043   0.9819 
1 1 1 2   20  13 o 8  9.90516e+00 9.64153e-01 1.78626e+02 51.966  7.13434e+00  9.12024e+00  0.00000e+00 0.00000e+00 1.75548e+02 51.966  3.07766e+00 231.965 0.9558 
1 1 1 2   20  14 o 18 1.41406e+01 8.88011e-01 2.63696e+02 283.810 7.54543e+00  -3.06953e+01 0.00000e+00 0.00000e+00 2.56483e+02 283.810 7.21337e+00 103.810 0.9841 
1 1 1 2   20  15 o 16 5.68782e+00 1.32631e+00 6.12967e+01 98.090  -4.48265e-01 3.15357e+00  0.00000e+00 0.00000e+00 1.13510e+02 98.090  5.22135e+01 98.090  0.8228 
1 1 1 2   20  16 o 5  6.62699e+00 1.48964e+00 1.16333e+02 27.666  6.53052e+00  3.42369e+00  0.00000e+00 0.00000e+00 1.13546e+02 27.666  2.78746e+00 207.666 0.9295 
1 1 1 2   20  17 o 18 6.77836e+00 1.63034e+00 1.08979e+02 355.787 7.10419e+00  -5.23309e-01 0.00000e+00 0.00000e+00 1.25276e+02 355.787 1.62972e+01 355.787 0.9269 
1 1 1 2   20  18 o 8  6.60312e+00 1.85542e+00 1.10319e+02 164.006 -6.46527e+00 1.85317e+00  0.00000e+00 0.00000e+00 1.16535e+02 164.006 6.21671e+00 164.006 0.9223 
1 1 1 2   21  0  o 10 2.89488e+01 5.20623e-01 3.99044e+02 168.506 -5.10738e+00 1.03854e+00  0.00000e+00 0.00000e+00 5.77514e+02 168.506 1.78470e+02 168.506 0.8981 
1 1 1 2   21  1  o 8  2.93369e+01 5.93935e-01 5.62045e+02 244.055 -3.69062e+00 -7.58542e+00 0.00000e+00 0.00000e+00 4.72434e+02 244.055 8.96109e+01 64.055  0.9387 
1 1 1 2   21  2  o 18 9.63242e+00 2.84358e-01 4.87980e+01 84.809  2.73875e-02  3.01449e-01  0.00000e+00 0.00000e+00 5.34591e+00 84.809  4.34521e+01 264.809 0.1496 
1 1 1 2   21  3  o 11 1.64702e+01 4.01138e-01 5.72430e+02 5.824   5.38407e+00  5.49177e-01  0.00000e+00 0.00000e+00 1.43324e+01 185.824 5.86763e+02 185.824 0.9021 
1 1 1 2   21  4  o 3  3.41859e+01 6.14074e-01 8.30096e+02 160.745 -2.04504e+01 7.14359e+00  0.00000e+00 0.00000e+00 4.23804e+02 160.745 4.06292e+02 340.745 0.9766 
1 1 1 2   21  5  o 14 2.20678e+01 4.50905e-01 5.66832e+02 46.355  7.35234e+00  7.70855e+00  0.00000e+00 0.00000e+00 2.21882e+02 46.355  3.44949e+02 226.355 0.9518 
1 1 1 2   21  6  o 16 1.93411e+01 4.31777e-01 4.46488e+02 94.301  -6.83388e-01 9.08688e+00  0.00000e+00 0.00000e+00 2.38485e+02 94.301  2.08003e+02 274.301 0.9434 
1 1 1 2   21  7  o 7  2.64875e+01 5.31600e-01 6.31098e+02 320.085 1.51393e+01  -1.26650e+01 0.00000e+00 0.00000e+00 3.37394e+02 320.085 2.93703e+02 140.085 0.9743 
1 1 1 2   21  8  o 9  3.90085e+01 7.20431e-01 7.38071e+02 70.723  1.49711e+01  4.28055e+01  0.00000e+00 0.00000e+00 7.09041e+02 70.723  2.90294e+01 250.723 0.9889 
1 1 1 2   21  9  f 0  3.07270e+01 7.56158e-01 5.91199e+02 183.191 -3.75213e+01 -2.09192e+00 0.00000e+00 0.00000e+00 5.45532e+02 183.191 4.56672e+01 3.191   0.9866 
1 1 1 2   21  10 o 12 1.20417e+01 5.98550e-01 3.05932e+02 347.782 9.84644e+00  -2.13217e+00 0.00000e+00 0.00000e+00 1.22348e+02 347.782 1.83584e+02 167.782 0.9490 
1 1 1 2   21  11 o 1  3.35185e+01 8.73959e-01 5.22548e+02 342.218 5.75893e+01  -1.84696e+01 0.00000e+00 0.00000e+00 7.22533e+02 342.218 1.99985e+02 342.218 0.9917 
1 1 1 2   21  12 o 12 1.53503e+01 1.06687e+00 3.34595e+02 58.677  1.17323e+01  1.92785e+01  0.00000e+00 0.00000e+00 2.27147e+02 58.677  1.07447e+02 238.676 0.9776 
1 1 1 2   21  13 o 9  7.92230e+00 1.29978e+00 1.17603e+02 333.728 5.23820e+00  -2.58565e+00 0.00000e+00 0.00000e+00 1.52031e+02 333.728 3.44280e+01 333.728 0.9098 
1 1 1 2   21  14 o 2  1.39216e+01 8.89814e-01 2.12966e+02 101.664 -5.07293e+00 2.45745e+01  0.00000e+00 0.00000e+00 2.96950e+02 101.664 8.39834e+01 101.664 0.9799 
1 1 1 2   21  15 o 3  1.89272e+01 8.85065e-01 3.29081e+02 330.672 5.94498e+01  -3.33997e+01 0.00000e+00 0.00000e+00 3.72652e+02 330.672 4.35716e+01 330.672 0.9926 
1 1 1 2   21  16 o 8  1.92484e+01 9.98931e-01 3.40930e+02 138.728 -6.34843e+01 5.57169e+01  0.00000e+00 0.00000e+00 3.73113e+02 138.728 3.21832e+01 138.728 0.9941 
1 1 1 2   21  17 o 8  5.39801e+00 1.51277e+00 6.01849e+01 9.705   3.30527e+00  5.65297e-01  0.00000e+00 0.00000e+00 1.07472e+02 9.705   4.72873e+01 9.705   0.8331 
1 1 1 2   21  18 o 2  1.35542e+01 1.37162e+00 1.98920e+02 252.844 -1.04434e+01 -3.38288e+01 0.00000e+00 0.00000e+00 2.98744e+02 252.844 9.98248e+01 252.844 0.9858 
1 1 1 2   22  0  o 10 1.29175e+01 3.17379e-01 2.48008e+02 220.258 -1.24995e+00 -1.05845e+00 0.00000e+00 0.00000e+00 5.68904e+01 220.258 1.91118e+02 40.258  0.6284 
1 1 1 2   22  1  o 13 7.91584e+00 3.75704e-01 3.93275e+02 95.809  -1.53692e-01 1.51082e+00  0.00000e+00 0.00000e+00 2.14664e+02 275.809 6.07939e+02 275.809 0.6007 
1 1 1 2   22  2  o 2  2.73666e+01 5.00906e-01 5.91128e+02 87.494  4.36673e-01  9.97803e+00  0.00000e+00 0.00000e+00 3.83904e+02 87.494  2.07224e+02 267.494 0.9485 
1 1 1 2   22  3  o 3  1.84435e+01 4.76924e-01 2.12376e+02 217.384 -1.73380e+00 -1.32481e+00 0.00000e+00 0.00000e+00 2.90201e+02 217.384 7.78253e+01 217.384 0.7255 
1 1 1 2   22  4  o 17 1.25998e+01 3.35768e-01 3.95978e+02 258.374 -7.55278e-01 -3.67111e+00 0.00000e+00 0.00000e+00 7.67634e+00 258.374 3.88302e+02 78.374  0.8531 
1 1 1 2   22  5  o 11 2.40045e+01 4.77191e-01 6.25866e+02 55.724  7.55735e+00  1.10887e+01  0.00000e+00 0.00000e+00 2.41164e+02 55.724  3.84702e+02 235.724 0.9620 
1 1 1 2   22  6  o 4  1.41468e+01 3.91592e-01 1.74324e+02 262.145 -3.52312e-01 -2.55387e+00 0.00000e+00 0.00000e+00 2.36282e+02 262.145 6.19575e+01 262.145 0.7732 
1 1 1 2   22  7  o 2  1.34234e+01 6.26537e-01 8.08069e+01 3.922   1.32600e+00  9.09068e-02  0.00000e+00 0.00000e+00 1.96723e+02 3.922   1.15916e+02 3.922   0.5510 
1 1 1 2   22  8  o 1  3.37746e+01 6.47301e-01 5.91616e+02 181.019 -3.08342e+01 -5.48369e-01 0.00000e+00 0.00000e+00 6.54592e+02 181.019 6.29760e+01 181.019 0.9837 
1 1 1 2   22  9  o 9  3.51330e+01 6.84653e-01 5.70227e+02 298.980 2.01072e+01  -3.63036e+01 0.00000e+00 0.00000e+00 7.31101e+02 298.980 1.60874e+02 298.980 0.9879 
1 1 1 2   22  10 o 19 2.49982e+01 8.82693e-01 2.85123e+02 136.408 -1.37951e+01 1.31333e+01  0.00000e+00 0.00000e+00 6.26774e+02 136.408 3.41651e+02 136.408 0.9734 
1 1 1 2   22  11 o 13 1.25736e+01 7.06914e-01 1.34263e+02 9.686   5.83151e+00  9.95296e-01  0.00000e+00 0.00000e+00 2.94780e+02 9.686   1.60517e+02 9.686   0.9110 
1 1 1 2   22  12 o 7  3.11302e+01 7.34475e-01 4.30785e+02 347.015 6.48298e+01  -1.49498e+01 0.00000e+00 0.00000e+00 7.25674e+02 347.015 2.94889e+02 347.015 0.9925 
1 1 1 2   22  13 o 5  6.31711e+00 1.18117e+00 2.81375e+01 326.250 9.58141e-01  -6.40217e-01 0.00000e+00 0.00000e+00 8.94853e+01 326.250 6.13478e+01 326.250 0.4978 
1 1 1 2   22  14 o 5  1.48597e+01 8.57895e-01 3.99559e+02 348.498 5.23401e+01  -1.06508e+01 0.00000e+00 0.00000e+00 1.50645e+02 348.498 2.48913e+02 168.498 0.9906 
1 1 1 2   22  15 o 7  1.01586e+01 1.17360e+00 1.83495e+02 129.691 -1.21587e+01 1.46497e+01  0.00000e+00 0.00000e+00 1.85808e+02 129.691 2.31221e+00 129.691 0.9734 
1 1 1 2   22  16 o 4  5.61749e+00 1.44428e+00 9.41098e+01 160.684 -5.08816e+00 1.78341e+00  0.00000e+00 0.00000e+00 9.49128e+01 160.684 8.02951e-01 160.684 0.9017 
1 1 1 2   22  17 f 0  4.37973e+00 1.37489e+00 1.44723e+01 174.089 -7.58033e-01 7.84831e-02  0.00000e+00 0.00000e+00 4.36256e+01 174.089 2.91533e+01 174.089 0.3558 
1 1 1 2   22  18 o 14 4.12284e+00 1.33069e+00 5.35305e+01 192.803 -2.90248e+00 -6.59565e-01 0.00000e+00 0.00000e+00 7.05753e+01 192.803 1.70448e+01 192.803 0.8082 
1 1 1 2   23  0  o 2  1.66305e+01 3.54702e-01 4.89197e+02 295.654 1.70983e+00  -3.56005e+00 0.00000e+00 0.00000e+00 4.89307e+01 295.654 4.40267e+02 115.654 0.8615 
1 1 1 2   23  1  o 2  2.25624e+01 4.65973e-01 2.15369e+02 92.726  -1.50936e-01 3.16978e+00  0.00000e+00 0.00000e+00 4.81250e+02 92.726  2.65881e+02 92.726  0.8220 
1 1 1 2   23  2  o 2  1.11434e+01 3.01102e-01 1.56091e+02 91.047  -2.53026e-02 1.38477e+00  0.00000e+00 0.00000e+00 8.09665e+01 91.047  7.51243e+01 271.047 0.5664 
1 1 1 2   23  3  o 6  1.17056e+01 3.77185e-01 4.30656e+02 40.345  3.07862e+00  2.61507e+00  0.00000e+00 0.00000e+00 5.03731e+01 220.345 4.81029e+02 220.345 0.8650 
1 1 1 2   23  4  o 13 1.62629e+01 3.72388e-01 3.72656e+02 225.000 -3.72307e+00 -3.72301e+00 0.00000e+00 0.00000e+00 1.76478e+02 225.000 1.96178e+02 45.000  0.8992 
1 1 1 2   23  5  o 11 2.37779e+01 4.73054e-01 4.98454e+02 175.630 -1.04256e+01 7.96693e-01  0.00000e+00 0.00000e+00 3.50446e+02 175.630 1.48008e+02 355.630 0.9509 
1 1 1 2   23  6  o 4  2.17560e+01 4.64075e-01 4.95468e+02 358.875 1.11621e+01  -2.19255e-01 0.00000e+00 0.00000e+00 2.83663e+02 358.875 2.11805e+02 178.875 0.9541 
1 1 1 2   23  7  o 6  2.58097e+01 5.28322e-01 5.45858e+02 147.186 -1.44728e+01 9.33216e+00  0.00000e+00 0.00000e+00 3.94045e+02 147.186 1.51812e+02 327.186 0.9705 
1 1 1 2   23  8  o 15 3.73309e+01 6.96565e-01 5.72553e+02 326.095 2.72179e+01  -1.82931e+01 0.00000e+00 0.00000e+00 8.06167e+02 326.095 2.33613e+02 326.095 0.9846 
1 1 1 2   23  9  o 14 7.26593e+00 6.40722e-01 2.91206e+02 151.105 -4.01068e+00 2.21356e+00  0.00000e+00 0.00000e+00 5.07536e+01 331.105 3.41959e+02 331.105 0.8827 
1 1 1 2   23  10 o 17 1.56918e+01 5.74326e-01 2.61263e+02 269.329 -1.34318e-01 -1.14720e+01 0.00000e+00 0.00000e+00 3.00523e+02 269.329 3.92598e+01 269.329 0.9554 
1 1 1 2   23  11 o 12 2.31880e+01 9.88934e-01 3.08107e+02 355.211 2.35605e+01  -1.97397e+00 0.00000e+00 0.00000e+00 5.41771e+02 355.211 2.33664e+02 355.211 0.9786 
1 1 1 2   23  12 o 5  1.24441e+01 8.32390e-01 2.01251e+02 237.589 -7.03823e+00 -1.10860e+01 0.00000e+00 0.00000e+00 2.46419e+02 237.589 4.51679e+01 237.589 0.9611 
1 1 1 2   23  13 o 5  1.40283e+01 7.90293e-01 2.67473e+02 246.960 -1.05662e+01 -2.48438e+01 0.00000e+00 0.00000e+00 2.47426e+02 246.960 2.00463e+01 66.960  0.9813 
1 1 1 2   23  14 o 15 6.03506e+00 1.30034e+00 1.46958e+02 61.766  3.24809e+00  6.04906e+00  0.00000e+00 0.00000e+00 6.14653e+01 61.766  8.54926e+01 241.766 0.9240 
1 1 1 2   23  15 o 1  2.30829e+01 8.56993e-01 4.32095e+02 197.470 -1.10640e+02 -3.48208e+01 0.00000e+00 0.00000e+00 4.26231e+02 197.470 5.86434e+00 17.470  0.9957 
1 1 1 2   23  16 o 3  1.60170e+01 1.10619e+00 2.40380e+02 67.959  1.72772e+01  4.26740e+01  0.00000e+00 0.00000e+00 3.50743e+02 67.959  1.10364e+02 67.959  0.9891 
1 1 1 2   23  17 o 11 7.24285e+00 1.55269e+00 7.21872e+01 296.421 2.50332e+00  -5.03815e+00 0.00000e+00 0.00000e+00 1.72470e+02 296.421 1.00283e+02 296.421 0.9061 
1 1 1 2   23  18 f 0  7.78509e+00 1.74953e+00 6.31915e+01 226.207 -3.29805e+00 -3.44006e+00 0.00000e+00 0.00000e+00 1.94166e+02 226.207 1.30975e+02 226.207 0.8876 
1 1 1 2   24  0  o 3  1.96045e+01 4.31480e-01 4.36357e+02 68.481  2.03655e+00  5.16519e+00  0.00000e+00 0.00000e+00 2.29800e+02 68.481  2.06556e+02 248.482 0.9048 
1 1 1 2   24  1  o 10 1.54366e+01 3.16026e-01 2.21709e+02 57.699  1.14328e+00  1.80845e+00  0.00000e+00 0.00000e+00 1.95374e+02 57.699  2.63354e+01 237.700 0.7194 
1 1 1 2   24  2  o 16 2.50010e+01 4.70098e-01 3.71681e+02 194.963 -5.27222e+00 -1.40908e+00 0.00000e+00 0.00000e+00 4.76209e+02 194.963 1.04529e+02 194.963 0.9030 
1 1 1 2   24  3  o 12 1.27475e+01 3.90293e-01 1.36212e+02 301.832 7.03717e-01  -1.13356e+00 0.00000e+00 0.00000e+00 1.28238e+02 301.832 7.97373e+00 121.832 0.5524 
1 1 1 2   24  4  o 7  2.80459e+01 5.26567e-01 5.95902e+02 145.114 -1.16602e+01 8.13012e+00  0.00000e+00 0.00000e+00 4.19457e+02 145.114 1.76445e+02 325.114 0.9642 
1 1 1 2   24  5  o 3  2.00171e+01 4.29278e-01 4.72785e+02 247.200 -3.51983e+00 -8.37316e+00 0.00000e+00 0.00000e+00 2.36036e+02 247.200 2.36749e+02 67.200  0.9432 
1 1 1 2   24  6  o 13 3.15048e+01 5.92828e-01 7.80835e+02 141.968 -2.31909e+01 1.81396e+01  0.00000e+00 0.00000e+00 3.81359e+02 141.968 3.99476e+02 321.968 0.9829 
1 1 1 2   24  7  o 15 2.45335e+01 5.13755e-01 6.43221e+02 341.460 1.94779e+01  -6.53249e+00 0.00000e+00 0.00000e+00 2.54597e+02 341.460 3.88623e+02 161.460 0.9754 
1 1 1 2   24  8  o 18 2.31378e+01 5.18074e-01 2.26231e+02 126.071 -5.83665e+00 8.01263e+00  0.00000e+00 0.00000e+00 5.96573e+02 126.071 3.70341e+02 126.071 0.9481 
1 1 1 2   24  9  o 19 3.91646e+01 7.41199e-01 7.05208e+02 100.021 -1.03168e+01 5.83849e+01  0.00000e+00 0.00000e+00 7.50631e+02 100.021 4.54232e+01 100.021 0.9915 
1 1 1 2   24  10 o 10 2.00869e+01 5.78997e-01 3.72612e+02 171.787 -2.06774e+01 2.98431e+00  0.00000e+00 0.00000e+00 3.61826e+02 171.787 1.07859e+01 351.787 0.9758 
1 1 1 2   24  11 o 15 1.76073e+01 6.64438e-01 3.37588e+02 301.982 1.07545e+01  -1.72226e+01 0.00000e+00 0.00000e+00 3.05357e+02 301.982 3.22310e+01 121.982 0.9751 
1 1 1 2   24  12 o 2  1.19711e+01 8.59542e-01 1.77568e+02 268.441 -3.01231e-01 -1.10669e+01 0.00000e+00 0.00000e+00 2.49732e+02 268.441 7.21641e+01 268.441 0.9537 
1 1 1 2   24  13 o 19 5.28216e+00 1.25261e+00 1.25220e+02 179.815 -4.15415e+00 1.33983e-02  0.00000e+00 0.00000e+00 4.64980e+01 179.815 7.87224e+01 359.815 0.8692 
1 1 1 2   24  14 o 16 4.04791e+00 1.15515e+00 8.81933e+01 340.325 2.77293e+00  -9.91474e-01 0.00000e+00 0.00000e+00 3.37155e+01 340.325 5.44778e+01 160.325 0.8058 
1 1 1 2   24  15 o 17 1.18391e+01 1.09041e+00 1.61461e+02 51.259  1.31488e+01  1.63883e+01  0.00000e+00 0.00000e+00 2.69998e+02 51.259  1.08538e+02 51.259  0.9759 
1 1 1 2   24  16 o 2  4.53526e+00 1.25757e+00 9.75435e+01 41.843  3.64673e+00  3.26552e+00  0.00000e+00 0.00000e+00 5.32092e+01 41.843  4.43343e+01 221.843 0.8909 
1 1 1 2   24  17 f 0  4.81151e+00 1.31950e+00 1.38176e+02 349.721 7.75673e+00  -1.40666e+00 0.00000e+00 0.00000e+00 2.93841e+01 349.721 1.08792e+02 169.721 0.9342 
1 1 1 2   24  18 o 7  3.69165e+00 1.24517e+00 6.61969e+01 214.873 -2.66673e+00 -1.85845e+00 0.00000e+00 0.00000e+00 4.74842e+01 214.873 1.87127e+01 34.873  0.8269 
1 1 1 2   25  0  o 7  9.07030e+00 2.92513e-01 1.43844e+02 340.005 7.60635e-01  -2.76773e-01 0.00000e+00 0.00000e+00 1.61742e+01 160.005 1.60019e+02 160.005 0.3748 
1 1 1 2   25  1  o 14 2.53342e+01 4.35856e-01 5.42555e+02 258.115 -2.26531e+00 -1.07639e+01 0.00000e+00 0.00000e+00 3.64532e+02 258.115 1.78023e+02 78.115  0.9534 
1 1 1 2   25  2  o 8  2.12948e+01 3.91800e-01 4.74691e+02 245.845 -2.34704e+00 -5.23337e+00 0.00000e+00 0.00000e+00 2.51483e+02 245.845 2.23208e+02 65.845  0.9080 
1 1 1 2   25  3  o 13 1.99495e+01 4.95518e-01 4.04949e+02 221.897 -4.49429e+00 -4.03210e+00 0.00000e+00 0.00000e+00 2.78973e+02 221.897 1.25976e+02 41.897  0.9129 
1 1 1 2   25  4  o 4  7.79205e+00 3.29251e-01 1.15744e+02 192.352 -6.84251e-01 -1.49838e-01 0.00000e+00 0.00000e+00 1.90888e+01 12.352  1.34833e+02 12.352  0.3304 
1 1 1 2   25  5  o 4  1.47672e+01 3.78229e-01 2.95921e+02 312.674 2.81091e+00  -3.04897e+00 0.00000e+00 0.00000e+00 1.85780e+02 312.674 1.10140e+02 132.674 0.8689 
1 1 1 2   25  6  o 9  2.71759e+01 5.33562e-01 3.68283e+02 88.174  3.53829e-01  1.11013e+01  0.00000e+00 0.00000e+00 6.04570e+02 88.174  2.36287e+02 88.174  0.9539 
1 1 1 2   25  7  o 8  3.72139e+01 6.85601e-01 7.14893e+02 300.741 1.75328e+01  -2.94806e+01 0.00000e+00 0.00000e+00 6.60794e+02 300.741 5.40992e+01 120.741 0.9853 
1 1 1 2   25  8  o 19 4.49999e+01 8.11218e-01 9.59613e+02 135.652 -5.74333e+01 5.61406e+01  0.00000e+00 0.00000e+00 7.17515e+02 135.652 2.42098e+02 315.652 0.9938 
1 1 1 2   25  9  o 12 3.23795e+01 6.49542e-01 3.87401e+02 284.442 6.90706e+00  -2.68189e+01 0.00000e+00 0.00000e+00 8.04302e+02 284.442 4.16902e+02 284.442 0.9818 
1 1 1 2   25  10 f 0  2.12822e+01 5.84810e-01 2.43996e+02 262.453 -2.05365e+00 -1.55015e+01 0.00000e+00 0.00000e+00 5.27485e+02 262.453 2.83489e+02 262.453 0.9675 
1 1 1 2   25  11 o 8  2.48610e+01 6.53724e-01 4.85043e+02 230.226 -2.99252e+01 -3.59509e+01 0.00000e+00 0.00000e+00 4.35937e+02 230.226 4.91062e+01 50.226  0.9893 
1 1 1 2   25  12 o 9  1.20190e+01 7.77813e-01 2.10694e+02 112.067 -5.51191e+00 1.35964e+01  0.00000e+00 0.00000e+00 2.23497e+02 112.067 1.28028e+01 112.067 0.9653 
1 1 1 2   25  13 o 5  1.37942e+01 8.24980e-01 1.68736e+02 249.263 -5.76615e+00 -1.52304e+01 0.00000e+00 0.00000e+00 3.31051e+02 249.263 1.62315e+02 249.263 0.9688 
1 1 1 2   25  14 o 5  1.13989e+01 9.26876e-01 2.18067e+02 126.730 -1.32175e+01 1.77130e+01  0.00000e+00 0.00000e+00 1.98167e+02 126.730 1.98998e+01 306.730 0.9771 
1 1 1 2   25  15 o 10 6.03708e+00 1.22058e+00 7.29010e+01 158.805 -4.24380e+00 1.64566e+00  0.00000e+00 0.00000e+00 1.25890e+02 158.805 5.29890e+01 158.805 0.8818 
1 1 1 2   25  16 o 5  4.24961e+00 1.31411e+00 8.47691e+01 34.180  3.16039e+00  2.14619e+00  0.00000e+00 0.00000e+00 5.09842e+01 34.180  3.37849e+01 214.180 0.8562 
1 1 1 2   25  17 o 1  4.65979e+00 1.35741e+00 5.91078e+01 146.868 -2.83579e+00 1.85088e+00  0.00000e+00 0.00000e+00 8.59120e+01 146.868 2.68042e+01 146.868 0.8349 
1 1 1 2   25  18 o 15 7.28410e+00 1.72454e+00 1.02142e+02 121.708 -3.97696e+00 6.43719e+00  0.00000e+00 0.00000e+00 1.50479e+02 121.708 4.83364e+01 121.708 0.9314 
1 1 1 2   26  0  o 18 4.50708e+01 6.99800e-01 9.60783e+02 49.128  2.23787e+01  2.58601e+01  0.00000e+00 0.00000e+00 7.06711e+02 49.128  2.54072e+02 229.128 0.9853 
1 1 1 2   26  1  o 13 2.84370e+01 4.78791e-01 3.92017e+02 186.537 -8.50541e+00 -9.74688e-01 0.00000e+00 0.00000e+00 6.11401e+02 186.537 2.19384e+02 186.537 0.9396 
1 1 1 2   26  2  o 1  4.37009e+00 3.15127e-01 1.83642e+02 87.561  2.77245e-02  6.51018e-01  0.00000e+00 0.00000e+00 1.32826e+02 267.561 3.16468e+02 267.561 0.3097 
1 1 1 2   26  3  o 12 1.62888e+01 4.52573e-01 2.36105e+02 72.226  8.96515e-01  2.79661e+00  0.00000e+00 0.00000e+00 2.56379e+02 72.226  2.02741e+01 72.226  0.8052 
1 1 1 2   26  4  o 4  8.79723e+00 3.32903e-01 1.96556e+02 60.448  6.50784e-01  1.14784e+00  0.00000e+00 0.00000e+00 1.54812e+01 240.448 2.12038e+02 240.448 0.5482 
1 1 1 2   26  5  o 17 6.95154e+00 3.74151e-01 6.48384e+01 114.740 -1.70895e-01 3.70870e-01  0.00000e+00 0.00000e+00 1.26417e+01 294.740 7.74801e+01 294.740 0.2000 
1 1 1 2   26  6  o 1  2.63167e+01 5.23632e-01 5.02424e+02 316.245 1.05210e+01  -1.00733e+01 0.00000e+00 0.00000e+00 4.50640e+02 316.245 5.17839e+01 136.245 0.9650 
1 1 1 2   26  7  o 14 4.12763e+01 7.48352e-01 8.46585e+02 94.764  -3.67753e+00 4.41224e+01  0.00000e+00 0.00000e+00 6.84321e+02 94.764  1.62264e+02 274.764 0.9886 
1 1 1 2   26  8  o 11 1.33871e+01 4.69625e-01 2.98043e+02 85.100  5.99828e-01  6.99660e+00  0.00000e+00 0.00000e+00 1.66727e+02 85.100  1.31317e+02 265.100 0.9258 
1 1 1 2   26  9  o 5  2.61070e+01 6.60045e-01 3.01535e+02 0.480   1.73215e+01  1.45225e-01  0.00000e+00 0.00000e+00 6.48398e+02 0.480   3.46863e+02 0.480   0.9707 
1 1 1 2   26  10 o 13 1.26693e+01 7.50857e-01 2.75761e+02 213.639 -8.24295e+00 -5.48460e+00 0.00000e+00 0.00000e+00 1.74259e+02 213.639 1.01502e+02 33.639  0.9481 
1 1 1 2   26  11 o 6  3.50743e+01 1.07452e+00 4.97662e+02 316.656 5.11493e+01  -4.82751e+01 0.00000e+00 0.00000e+00 8.06326e+02 316.656 3.08664e+02 316.656 0.9929 
1 1 1 2   26  12 o 16 1.87751e+01 7.10047e-01 2.87341e+02 84.691  2.91723e+00  3.13912e+01  0.00000e+00 0.00000e+00 4.04022e+02 84.691  1.16680e+02 84.691  0.9840 
1 1 1 2   26  13 o 1  1.23288e+01 8.44293e-01 2.38539e+02 108.641 -6.90071e+00 2.04571e+01  0.00000e+00 0.00000e+00 2.11705e+02 108.641 2.68344e+01 288.641 0.9766 
1 1 1 2   26  14 f 0  1.59302e+01 8.39961e-01 1.24782e+02 317.352 1.33540e+01  -1.23002e+01 0.00000e+00 0.00000e+00 4.53870e+02 317.352 3.29087e+02 317.352 0.9721 
1 1 1 2   26  15 o 13 8.58759e+00 1.24560e+00 2.05582e+02 294.229 7.39301e+00  -1.64276e+01 0.00000e+00 0.00000e+00 1.06033e+02 294.229 9.95492e+01 114.229 0.9718 
1 1 1 2   26  16 o 5  9.99264e+00 1.44177e+00 1.40374e+02 77.589  3.27663e+00  1.48891e+01  0.00000e+00 0.00000e+00 2.19969e+02 77.589  7.95948e+01 77.589  0.9666 
1 1 1 2   26  17 o 8  3.52011e+00 1.15184e+00 8.76862e+01 155.244 -3.90466e+00 1.80058e+00  0.00000e+00 0.00000e+00 2.69998e+01 155.244 6.06864e+01 335.244 0.8741 
1 1 1 2   26  18 o 14 4.20634e+00 1.37868e+00 3.70090e+01 34.404  1.63781e+00  1.12161e+00  0.00000e+00 0.00000e+00 7.18902e+01 34.404  3.48812e+01 34.404  0.6953 
1 1 1 2   27  0  o 12 1.58868e+01 3.34078e-01 2.41824e+02 295.104 9.52141e-01  -2.03221e+00 0.00000e+00 0.00000e+00 1.96056e+02 295.104 4.57679e+01 115.104 0.7341 
1 1 1 2   27  1  o 8  2.53432e+01 4.80979e-01 3.72280e+02 229.768 -3.45428e+00 -4.08300e+00 0.00000e+00 0.00000e+00 4.85018e+02 229.768 1.12738e+02 229.768 0.9009 
1 1 1 2   27  2  o 2  1.80354e+01 3.56996e-01 2.97792e+02 84.727  3.87918e-01  4.20357e+00  0.00000e+00 0.00000e+00 2.92416e+02 84.727  5.37521e+00 264.727 0.8715 
1 1 1 2   27  3  o 7  3.45588e+01 6.20407e-01 5.98657e+02 293.965 6.24871e+00  -1.40581e+01 0.00000e+00 0.00000e+00 6.55994e+02 293.965 5.73367e+01 293.965 0.9669 
1 1 1 2   27  4  o 10 1.72859e+01 3.93108e-01 3.58629e+02 157.581 -4.89267e+00 2.01849e+00  0.00000e+00 0.00000e+00 2.25254e+02 157.581 1.33375e+02 337.581 0.8998 
1 1 1 2   27  5  o 15 3.85241e+01 6.91873e-01 7.86623e+02 302.087 1.71172e+01  -2.73013e+01 0.00000e+00 0.00000e+00 6.36729e+02 302.087 1.49894e+02 122.087 0.9844 
1 1 1 2   27  6  o 2  3.11525e+01 5.89995e-01 6.45303e+02 43.233  1.91916e+01  1.80432e+01  0.00000e+00 0.00000e+00 5.01270e+02 43.233  1.44033e+02 223.233 0.9808 
1 1 1 2   27  7  o 18 3.79261e+01 6.98749e-01 6.80840e+02 205.685 -3.06180e+01 -1.47256e+01 0.00000e+00 0.00000e+00 7.20771e+02 205.685 3.99307e+01 205.685 0.9852 
1 1 1 2   27  8  f 0  2.04438e+01 5.03437e-01 4.32667e+02 301.223 8.02606e+00  -1.32404e+01 0.00000e+00 0.00000e+00 3.08759e+02 301.223 1.23908e+02 121.223 0.9671 
1 1 1 2   27  9  o 4  1.50011e+01 5.21990e-01 2.01141e+02 80.595  1.20606e+00  7.28101e+00  0.00000e+00 0.00000e+00 3.21516e+02 80.595  1.20374e+02 80.595  0.9295 
1 1 1 2   27  10 o 15 1.55660e+01 6.03757e-01 3.02946e+02 144.481 -1.09583e+01 7.82197e+00  0.00000e+00 0.00000e+00 2.58114e+02 144.481 4.48315e+01 324.481 0.9621 
1 1 1 2   27  11 o 18 9.89240e+00 8.31778e-01 1.62999e+02 164.665 -6.47426e+00 1.77536e+00  0.00000e+00 0.00000e+00 1.78572e+02 164.665 1.55738e+01 164.665 0.9222 
1 1 1 2   27  12 o 17 1.86055e+01 7.04632e-01 2.96883e+02 217.155 -2.47356e+01 -1.87449e+01 0.00000e+00 0.00000e+00 3.88007e+02 217.155 9.11240e+01 217.155 0.9838 
1 1 1 2   27  13 o 16 1.38256e+01 8.31815e-01 2.76663e+02 337.971 2.60554e+01  -1.05423e+01 0.00000e+00 0.00000e+00 2.31040e+02 337.971 4.56234e+01 157.971 0.9820 
1 1 1 2   27  14 o 1  1.35674e+01 9.39121e-01 2.51425e+02 267.262 -1.58779e+00 -3.32005e+01 0.00000e+00 0.00000e+00 2.47845e+02 267.262 3.58030e+00 87.262  0.9848 
1 1 1 2   27  15 o 8  6.31688e+00 1.36026e+00 1.66353e+02 130.023 -6.24395e+00 7.43510e+00  0.00000e+00 0.00000e+00 5.69938e+01 130.023 1.09359e+02 310.023 0.9470 
1 1 1 2   27  16 o 10 8.78238e+00 1.33931e+00 1.52447e+02 55.672  8.70429e+00  1.27467e+01  0.00000e+00 0.00000e+00 1.64367e+02 55.672  1.19201e+01 55.672  0.9670 
1 1 1 2   27  17 o 19 9.11593e+00 1.45301e+00 1.11057e+02 28.964  1.02265e+01  5.66029e+00  0.00000e+00 0.00000e+00 2.13806e+02 28.964  1.02750e+02 28.964  0.9562 
1 1 1 2   27  18 f 0  5.83302e+00 1.57182e+00 9.03847e+01 208.901 -5.24663e+00 -2.89646e+00 0.00000e+00 0.00000e+00 1.07732e+02 208.901 1.73474e+01 208.901 0.9123 
1 1 1 2   28  0  o 12 9.71961e+00 3.00996e-01 2.95738e+02 70.468  5.40200e-01  1.52274e+00  0.00000e+00 0.00000e+00 6.82225e+01 250.468 3.63960e+02 250.468 0.6235 
1 1 1 2   28  1  o 13 2.48448e+01 3.96685e-01 4.81367e+02 100.891 -1.82822e+00 9.50181e+00  0.00000e+00 0.00000e+00 4.01868e+02 100.891 7.94998e+01 280.891 0.9468 
1 1 1 2   28  2  o 4  2.21858e+01 4.07095e-01 4.17892e+02 38.064  5.48499e+00  4.29529e+00  0.00000e+00 0.00000e+00 3.52760e+02 38.064  6.51317e+01 218.064 0.9252 
1 1 1 2   28  3  o 2  1.38078e+01 3.49750e-01 2.52086e+02 314.623 2.10340e+00  -2.13128e+00 0.00000e+00 0.00000e+00 1.67593e+02 314.623 8.44934e+01 134.623 0.8096 
1 1 1 2   28  4  o 19 1.02463e+01 3.42417e-01 3.77705e+02 142.464 -2.74123e+00 2.10612e+00  0.00000e+00 0.00000e+00 5.50695e+01 322.464 4.32774e+02 322.464 0.8388 
1 1 1 2   28  5  o 4  1.33072e+01 3.78531e-01 1.68010e+02 311.390 1.56523e+00  -1.77602e+00 0.00000e+00 0.00000e+00 2.06446e+02 311.390 3.84365e+01 311.390 0.7498 
1 1 1 2   28  6  o 17 1.60008e+01 4.13945e-01 2.31313e+02 42.393  3.57023e+00  3.25923e+00  0.00000e+00 0.00000e+00 3.02656e+02 42.393  7.13432e+01 42.393  0.8894 
1 1 1 2   28  7  o 15 3.45354e+01 6.50456e-01 6.70079e+02 297.176 1.38541e+01  -2.69848e+01 0.00000e+00 0.00000e+00 6.03802e+02 297.176 6.62777e+01 117.176 0.9834 
1 1 1 2   28  8  o 19 2.29234e+01 7.77838e-01 4.98247e+02 105.214 -5.05927e+00 1.86026e+01  0.00000e+00 0.00000e+00 3.38683e+02 105.214 1.59564e+02 285.214 0.9737 
1 1 1 2   28  9  o 19 7.01040e+00 7.29482e-01 7.70645e+01 220.523 -9.77567e-01 -8.35601e-01 0.00000e+00 0.00000e+00 6.44550e+01 220.523 1.26094e+01 40.523  0.5386 
1 1 1 2   28  10 o 5  7.02260e+00 8.96102e-01 8.77950e+01 121.319 -1.00174e+00 1.64632e+00  0.00000e+00 0.00000e+00 9.25232e+01 121.319 4.72828e+00 121.319 0.6854 
1 1 1 2   28  11 o 17 2.53246e+01 8.83850e-01 3.86784e+02 96.291  -4.42104e+00 4.01051e+01  0.00000e+00 0.00000e+00 5.49532e+02 96.291  1.62747e+02 96.291  0.9875 
1 1 1 2   28  12 o 7  5.42597e+00 1.46161e+00 1.82156e+02 251.377 -1.52217e+00 -4.51711e+00 0.00000e+00 0.00000e+00 1.94129e+00 71.377  1.84097e+02 71.377  0.8877 
1 1 1 2   28  13 o 19 8.69321e+00 1.07658e+00 1.03142e+02 110.801 -2.36081e+00 6.21460e+00  0.00000e+00 0.00000e+00 1.96346e+02 110.801 9.32042e+01 110.801 0.9214 
1 1 1 2   28  14 o 7  1.80101e+01 8.38476e-01 4.07376e+02 263.346 -8.54777e+00 -7.32670e+01 0.00000e+00 0.00000e+00 2.60955e+02 263.346 1.46421e+02 83.346  0.9932 
1 1 1 2   28  15 o 17 1.01913e+01 1.22496e+00 2.13544e+02 39.352  1.65287e+01  1.35534e+01  0.00000e+00 0.00000e+00 1.57916e+02 39.352  5.56280e+01 219.352 0.9763 
1 1 1 2   28  16 f 0  8.85633e+00 1.30029e+00 1.89260e+02 264.075 -2.00189e+00 -1.92887e+01 0.00000e+00 0.00000e+00 1.32451e+02 264.075 5.68082e+01 84.075  0.9739 
1 1 1 2   28  17 o 6  4.23874e+00 1.26670e+00 1.03612e+02 15.910  5.46705e+00  1.55841e+00  0.00000e+00 0.00000e+00 3.96844e+01 15.910  6.39272e+01 195.910 0.9072 
1 1 1 2   28  18 o 17 5.51612e+00 1.63219e+00 8.55171e+01 250.333 -1.75033e+00 -4.89730e+00 0.00000e+00 0.00000e+00 9.88624e+01 250.333 1.33453e+01 250.333 0.8978 
1 1 1 2   29  0  o 16 3.69784e+01 5.41290e-01 7.43818e+02 47.279  1.49124e+01  1.61486e+01  0.00000e+00 0.00000e+00 6.12465e+02 47.279  1.31353e+02 227.279 0.9770 
1 1 1 2   29  1  o 15 2.67968e+01 4.19869e-01 4.78677e+02 231.481 -6.24471e+00 -7.84533e+00 0.00000e+00 0.00000e+00 4.75808e+02 231.481 2.86932e+00 51.481  0.9487 
1 1 1 2   29  2  o 13 1.97830e+01 3.80425e-01 3.63292e+02 75.234  1.40137e+00  5.31688e+00  0.00000e+00 0.00000e+00 3.07970e+02 75.234  5.53213e+01 255.234 0.9038 
1 1 1 2   29  3  o 8  3.48310e+01 5.82366e-01 8.29745e+02 205.505 -2.02966e+01 -9.68329e+00 0.00000e+00 0.00000e+00 4.48419e+02 205.505 3.81326e+02 25.505  0.9775 
1 1 1 2   29  4  o 5  1.00201e+01 3.46940e-01 2.46290e+02 288.880 7.02258e-01  -2.05352e+00 0.00000e+00 0.00000e+00 2.59552e+01 288.880 2.20335e+02 108.880 0.7238 
1 1 1 2   29  5  o 10 2.70483e+01 5.27474e-01 6.06856e+02 97.733  -2.30302e+00 1.69605e+01  0.00000e+00 0.00000e+00 3.78106e+02 97.733  2.28750e+02 277.733 0.9703 
1 1 1 2   29  6  o 17 2.15974e+01 4.69211e-01 5.27135e+02 207.685 -1.19510e+01 -6.27036e+00 0.00000e+00 0.00000e+00 2.52548e+02 207.685 2.74587e+02 27.685  0.9622 
1 1 1 2   29  7  o 14 2.58648e+01 5.41277e-01 3.86561e+02 233.828 -7.99963e+00 -1.09412e+01 0.00000e+00 0.00000e+00 5.47044e+02 233.828 1.60483e+02 233.828 0.9624 
1 1 1 2   29  8  o 7  1.12384e+01 4.89309e-01 2.07713e+02 70.721  1.32496e+00  3.78792e+00  0.00000e+00 0.00000e+00 1.56347e+02 70.721  5.13659e+01 250.721 0.8640 
1 1 1 2   29  9  o 19 2.20670e+01 5.56696e-01 5.61316e+02 187.867 -2.94242e+01 -4.06543e+00 0.00000e+00 0.00000e+00 2.51631e+02 187.867 3.09685e+02 7.867   0.9830 
1 1 1 2   29  10 o 6  2.70090e+01 6.32311e-01 6.36437e+02 212.510 -4.62575e+01 -2.94808e+01 0.00000e+00 0.00000e+00 3.65990e+02 212.510 2.70446e+02 32.510  0.9908 
1 1 1 2   29  11 o 1  1.49228e+01 6.92498e-01 1.78734e+02 323.848 9.05557e+00  -6.61601e+00 0.00000e+00 0.00000e+00 3.54403e+02 323.848 1.75669e+02 323.848 0.9543 
1 1 1 2   29  12 o 11 1.44849e+01 7.26435e-01 3.48322e+02 165.273 -2.74695e+01 7.22047e+00  0.00000e+00 0.00000e+00 1.83977e+02 165.273 1.64345e+02 345.273 0.9822 
1 1 1 2   29  13 o 11 7.81190e+00 1.07493e+00 8.74383e+01 201.950 -4.46523e+00 -1.79950e+00 0.00000e+00 0.00000e+00 1.72178e+02 201.950 8.47400e+01 201.950 0.8889 
1 1 1 2   29  14 o 1  6.78791e+00 1.29074e+00 1.30747e+02 301.431 3.88501e+00  -6.35684e+00 0.00000e+00 0.00000e+00 1.05157e+02 301.431 2.55907e+01 121.431 0.9302 
1 1 1 2   29  15 o 1  7.66302e+00 1.30417e+00 1.07759e+02 257.262 -1.85367e+00 -8.20008e+00 0.00000e+00 0.00000e+00 1.60705e+02 257.262 5.29460e+01 257.262 0.9385 
1 1 1 2   29  16 o 5  3.72311e+00 1.15221e+00 5.51206e+01 353.689 2.57412e+00  -2.84680e-01 0.00000e+00 0.00000e+00 5.24180e+01 353.689 2.70261e+00 173.689 0.7744 
1 1 1 2   29  17 o 10 8.50325e+00 1.57613e+00 1.03717e+02 140.972 -7.42100e+00 6.01541e+00  0.00000e+00 0.00000e+00 1.96065e+02 140.972 9.23476e+01 140.972 0.9461 
1 1 1 2   29  18 o 16 4.78499e+00 1.49889e+00 5.49160e+01 122.771 -1.71319e+00 2.66128e+00  0.00000e+00 0.00000e+00 9.14115e+01 122.771 3.64955e+01 122.771 0.8215 
1 1 1 2   30  0  o 10 1.35773e+01 3.54753e-01 3.44520e+02 59.244  1.82581e+00  3.06821e+00  0.00000e+00 0.00000e+00 8.60016e+01 59.244  2.58519e+02 239.244 0.8447 
1 1 1 2   30  1  o 2  1.81790e+01 3.25819e-01 5.47103e+02 194.531 -7.19455e+00 -1.86477e+00 0.00000e+00 0.00000e+00 8.76224e+01 194.531 4.59481e+02 14.531  0.9301 
1 1 1 2   30  2  o 3  2.20134e+01 3.94074e-01 3.91471e+02 272.857 3.19937e-01  -6.40984e+00 0.00000e+00 0.00000e+00 3.67482e+02 272.857 2.39890e+01 92.857  0.9184 
1 1 1 2   30  3  o 15 1.55876e+01 3.50174e-01 2.51066e+02 275.610 2.92527e-01  -2.97786e+00 0.00000e+00 0.00000e+00 2.22534e+02 275.610 2.85322e+01 95.610  0.8094 
1 1 1 2   30  4  o 3  3.14145e+01 5.85179e-01 7.96591e+02 163.643 -2.28068e+01 6.69378e+00  0.00000e+00 0.00000e+00 3.57399e+02 163.643 4.39192e+02 343.643 0.9787 
1 1 1 2   30  5  o 13 2.04777e+01 5.09539e-01 4.47743e+02 169.334 -1.08666e+01 2.04654e+00  0.00000e+00 0.00000e+00 2.85073e+02 169.334 1.62670e+02 349.334 0.9537 
1 1 1 2   30  6  o 1  1.52352e+01 7.60586e-01 2.20397e+02 129.406 -2.60165e+00 3.16664e+00  0.00000e+00 0.00000e+00 2.75257e+02 129.406 5.48594e+01 129.406 0.8672 
1 1 1 2   30  7  o 2  9.13141e+00 4.59893e-01 3.96239e+01 258.779 -1.12193e-01 -5.65520e-01 0.00000e+00 0.00000e+00 5.52111e+01 258.779 1.55872e+01 258.779 0.2769 
1 1 1 2   30  8  o 9  1.97234e+01 5.04849e-01 2.98306e+02 24.276  9.19425e+00  4.14667e+00  0.00000e+00 0.00000e+00 4.03446e+02 24.276  1.05140e+02 24.276  0.9491 
1 1 1 2   30  9  o 17 2.06179e+01 5.50032e-01 4.72220e+02 282.181 5.48983e+00  -2.54333e+01 0.00000e+00 0.00000e+00 2.85402e+02 282.181 1.86819e+02 102.180 0.9806 
1 1 1 2   30  10 o 5  1.79366e+01 6.00091e-01 3.67973e+02 302.793 1.10466e+01  -1.71458e+01 0.00000e+00 0.00000e+00 2.87150e+02 302.793 8.08228e+01 122.793 0.9752 
1 1 1 2   30  11 o 14 1.93773e+01 6.50879e-01 1.81144e+02 357.184 1.52544e+01  -7.50190e-01 0.00000e+00 0.00000e+00 5.20053e+02 357.184 3.38909e+02 357.184 0.9667 
1 1 1 2   30  12 o 15 1.14671e+01 9.06983e-01 2.38379e+02 254.011 -4.36727e+00 -1.52419e+01 0.00000e+00 0.00000e+00 1.76851e+02 254.011 6.15279e+01 74.011  0.9679 
1 1 1 2   30  13 o 10 7.86641e+00 1.09689e+00 1.98781e+02 147.557 -9.22117e+00 5.86166e+00  0.00000e+00 0.00000e+00 8.15039e+01 147.557 1.17277e+02 327.557 0.9531 
1 1 1 2   30  14 o 7  9.84256e+00 1.08969e+00 2.33664e+02 268.011 -7.53470e-01 -2.16981e+01 0.00000e+00 0.00000e+00 1.25452e+02 268.011 1.08212e+02 88.011  0.9767 
1 1 1 2   30  15 o 4  3.81209e+00 1.12594e+00 3.96853e+01 137.537 -1.19422e+00 1.09288e+00  0.00000e+00 0.00000e+00 4.91286e+01 137.537 9.44328e+00 137.537 0.6242 
1 1 1 2   30  16 o 18 1.00575e+01 1.21557e+00 1.34643e+02 43.891  1.18822e+01  1.14307e+01  0.00000e+00 0.00000e+00 2.28885e+02 43.891  9.42416e+01 43.891  0.9692 
1 1 1 2   30  17 o 16 7.24855e+00 1.67636e+00 1.46834e+02 132.206 -7.02478e+00 7.74573e+00  0.00000e+00 0.00000e+00 1.09988e+02 132.206 3.68452e+01 312.206 0.9509 
1 1 1 2   30  18 o 2  4.30422e+00 1.35662e+00 3.91322e+01 91.001  -3.94136e-02 2.25636e+00  0.00000e+00 0.00000e+00 7.87441e+01 91.001  3.96118e+01 91.001  0.7357 
1 1 1 2   31  0  o 4  7.70911e+00 2.54276e-01 6.66421e+01 86.171  2.53829e-02  3.79288e-01  0.00000e+00 0.00000e+00 1.26128e+01 266.171 7.92548e+01 266.171 0.1867 
1 1 1 2   31  1  o 15 1.04294e+01 2.67830e-01 2.78780e+02 232.543 -1.34390e+00 -1.75412e+00 0.00000e+00 0.00000e+00 6.76856e+00 232.543 2.72011e+02 52.543  0.7294 
1 1 1 2   31  2  o 9  1.44745e+01 3.18814e-01 2.58106e+02 0.188   3.20225e+00  1.05028e-02  0.00000e+00 0.00000e+00 1.89542e+02 0.188   6.85643e+01 180.188 0.8239 
1 1 1 2   31  3  o 5  1.29024e+01 3.31462e-01 2.72428e+02 307.187 1.81423e+00  -2.39126e+00 0.00000e+00 0.00000e+00 1.19892e+02 307.187 1.52536e+02 127.187 0.8101 
1 1 1 2   31  4  o 17 2.69475e+01 5.22776e-01 5.46772e+02 124.351 -7.52943e+00 1.10167e+01  0.00000e+00 0.00000e+00 4.25887e+02 124.351 1.20885e+02 304.351 0.9618 
1 1 1 2   31  5  o 6  1.55939e+00 4.89399e-01 2.00748e+02 216.996 -2.98589e-01 -2.24967e-01 0.00000e+00 0.00000e+00 1.89997e+02 36.996  3.90745e+02 36.996  0.1837 
1 1 1 2   31  6  o 4  1.59755e+01 4.90703e-01 2.57874e+02 317.145 3.68947e+00  -3.42310e+00 0.00000e+00 0.00000e+00 2.77968e+02 317.145 2.00942e+01 317.145 0.8941 
1 1 1 2   31  7  o 16 3.01999e+01 5.95856e-01 4.83642e+02 112.585 -8.84339e+00 2.12611e+01  0.00000e+00 0.00000e+00 6.24003e+02 112.585 1.40361e+02 112.585 0.9780 
1 1 1 2   31  8  o 17 1.87961e+01 5.05315e-01 2.93668e+02 170.566 -1.14040e+01 1.89480e+00  0.00000e+00 0.00000e+00 3.79731e+02 170.566 8.60637e+01 170.566 0.9557 
1 1 1 2   31  9  o 1  1.72816e+01 5.45265e-01 4.05261e+02 79.523  3.32498e+00  1.79810e+01  0.00000e+00 0.00000e+00 2.24321e+02 79.523  1.80940e+02 259.523 0.9723 
1 1 1 2   31  10 o 2  1.13983e+01 1.20171e+00 3.07508e+02 214.555 -8.63887e+00 -5.94954e+00 0.00000e+00 0.00000e+00 9.84839e+01 214.555 2.09024e+02 34.555  0.9511 
1 1 1 2   31  11 o 3  5.85146e+00 1.35891e+00 1.71694e+02 270.580 4.12586e-02  -4.07760e+00 0.00000e+00 0.00000e+00 1.80781e+01 270.580 1.53615e+02 90.580  0.8664 
1 1 1 2   31  12 o 18 2.21899e+01 6.98783e-01 3.99215e+02 38.829  4.23567e+01  3.40916e+01  0.00000e+00 0.00000e+00 4.23175e+02 38.829  2.39595e+01 38.829  0.9908 
1 1 1 2   31  13 o 15 6.52028e+00 1.15956e+00 2.07472e+02 253.656 -2.81706e+00 -9.60594e+00 0.00000e+00 0.00000e+00 2.37519e+01 253.656 1.83720e+02 73.656  0.9487 
1 1 1 2   31  14 o 7  5.90486e+00 1.11457e+00 1.79974e+02 80.014  1.72061e+00  9.77153e+00  0.00000e+00 0.00000e+00 2.91654e+01 80.014  1.50808e+02 260.014 0.9482 
1 1 1 2   31  15 o 15 8.24851e+00 1.18931e+00 1.86700e+02 240.716 -7.82046e+00 -1.39451e+01 0.00000e+00 0.00000e+00 1.11375e+02 240.716 7.53253e+01 60.716  0.9682 
1 1 1 2   31  16 o 14 4.14003e+00 1.22816e+00 6.09606e+01 356.754 3.02775e+00  -1.71725e-01 0.00000e+00 0.00000e+00 6.44585e+01 356.754 3.49789e+00 356.754 0.8124 
1 1 1 2   31  17 o 8  8.11009e+00 1.63951e+00 1.26191e+02 129.708 -6.56395e+00 7.90418e+00  0.00000e+00 0.00000e+00 1.60861e+02 129.708 3.46705e+01 129.708 0.9500 
1 1 1 2   31  18 o 14 4.25999e+00 1.36811e+00 4.89558e+01 195.944 -2.69720e+00 -7.70550e-01 0.00000e+00 0.00000e+00 7.70135e+01 195.944 2.80577e+01 195.944 0.7945 
1 1 1 2   32  0  o 6  3.04944e+01 4.64950e-01 4.80005e+02 182.556 -1.09768e+01 -4.89970e-01 0.00000e+00 0.00000e+00 6.11129e+02 182.556 1.31124e+02 182.556 0.9533 
1 1 1 2   32  1  o 5  2.58026e+01 4.09896e-01 5.49469e+02 257.500 -2.67180e+00 -1.20513e+01 0.00000e+00 0.00000e+00 3.78917e+02 257.500 1.70553e+02 77.500  0.9586 
1 1 1 2   32  2  o 18 3.71533e+01 5.89008e-01 7.82558e+02 279.773 3.81767e+00  -2.21641e+01 0.00000e+00 0.00000e+00 5.80589e+02 279.773 2.01970e+02 99.773  0.9775 
1 1 1 2   32  3  o 16 1.99373e+01 3.84833e-01 3.69884e+02 24.468  5.97604e+00  2.71942e+00  0.00000e+00 0.00000e+00 3.18779e+02 24.468  5.11047e+01 204.468 0.9203 
1 1 1 2   32  4  o 12 1.81894e+01 3.87832e-01 3.53149e+02 149.010 -5.89211e+00 3.53896e+00  0.00000e+00 0.00000e+00 2.77615e+02 149.010 7.55336e+01 329.010 0.9241 
1 1 1 2   32  5  o 5  4.31535e+01 7.68254e-01 9.02702e+02 181.507 -4.26707e+01 -1.12292e+00 0.00000e+00 0.00000e+00 6.97292e+02 181.507 2.05410e+02 1.507   0.9882 
1 1 1 2   32  6  o 9  2.63526e+01 5.35707e-01 4.24623e+02 307.213 8.78017e+00  -1.15620e+01 0.00000e+00 0.00000e+00 5.29169e+02 307.213 1.04546e+02 307.213 0.9649 
1 1 1 2   32  7  o 10 2.46905e+01 5.30363e-01 5.84850e+02 131.702 -1.48089e+01 1.66200e+01  0.00000e+00 0.00000e+00 3.19939e+02 131.702 2.64910e+02 311.702 0.9773 
1 1 1 2   32  8  o 14 3.19916e+01 6.38961e-01 5.09159e+02 337.406 3.12323e+01  -1.29967e+01 0.00000e+00 0.00000e+00 6.72132e+02 337.406 1.62973e+02 337.406 0.9851 
1 1 1 2   32  9  o 1  2.97652e+01 6.35977e-01 7.04298e+02 111.546 -1.99530e+01 5.05357e+01  0.00000e+00 0.00000e+00 4.00599e+02 111.546 3.03699e+02 291.546 0.9908 
1 1 1 2   32  10 o 6  1.60891e+01 9.30617e-01 2.81972e+02 276.175 1.55532e+00  -1.43746e+01 0.00000e+00 0.00000e+00 2.99312e+02 276.175 1.73404e+01 276.175 0.9648 
1 1 1 2   32  11 o 2  1.71779e+01 7.85224e-01 2.09684e+02 314.756 1.19656e+01  -1.20678e+01 0.00000e+00 0.00000e+00 4.14023e+02 314.756 2.04339e+02 314.756 0.9701 
1 1 1 2   32  12 o 4  9.11572e+00 9.26483e-01 1.58203e+02 302.094 4.49922e+00  -7.17399e+00 0.00000e+00 0.00000e+00 1.61946e+02 302.094 3.74329e+00 302.094 0.9390 
1 1 1 2   32  13 o 14 1.71921e+01 6.99011e-01 3.91575e+02 160.252 -5.38490e+01 1.93317e+01  0.00000e+00 0.00000e+00 2.45393e+02 160.252 1.46182e+02 340.252 0.9912 
1 1 1 2   32  14 o 19 1.15444e+01 8.83352e-01 2.06460e+02 320.280 1.79971e+01  -1.49520e+01 0.00000e+00 0.00000e+00 2.15411e+02 320.280 8.95130e+00 320.280 0.9784 
1 1 1 2   32  15 o 15 6.75567e+00 1.23969e+00 1.25708e+02 14.614  8.78965e+00  2.29179e+00  0.00000e+00 0.00000e+00 1.12104e+02 14.614  1.36038e+01 194.614 0.9432 
1 1 1 2   32  16 o 15 9.95342e+00 1.53487e+00 2.19438e+02 227.886 -1.48452e+01 -1.64214e+01 0.00000e+00 0.00000e+00 1.43224e+02 227.886 7.62134e+01 47.886  0.9771 
1 1 1 2   32  17 o 2  7.41078e+00 1.61812e+00 1.63158e+02 50.237  8.28503e+00  9.95711e+00  0.00000e+00 0.00000e+00 1.02039e+02 50.237  6.11187e+01 230.237 0.9606 
1 1 1 2   32  18 o 9  4.64405e+00 1.54786e+00 4.33335e+01 199.287 -2.25640e+00 -7.89596e-01 0.00000e+00 0.00000e+00 8.67343e+01 199.287 4.34008e+01 199.287 0.7525 
1 1 1 2   33  0  o 4  1.09084e+01 2.68378e-01 1.79575e+02 244.148 -7.37223e-01 -1.52147e+00 0.00000e+00 0.00000e+00 8.23721e+01 244.148 9.72024e+01 64.148  0.6399 
1 1 1 2   33  1  o 14 3.95677e+00 3.16220e-01 6.44525e+01 107.012 -6.33513e-02 2.07056e-01  0.00000e+00 0.00000e+00 4.84684e+01 287.012 1.12921e+02 287.012 0.1076 
1 1 1 2   33  2  o 7  9.31955e+00 2.92933e-01 1.89142e+02 180.534 -1.52441e+00 -1.42034e-02 0.00000e+00 0.00000e+00 2.14625e+01 180.534 1.67679e+02 0.534   0.6021 
1 1 1 2   33  3  f 0  4.99191e+00 3.40745e-01 2.96163e+02 38.089  1.12125e+00  8.78819e-01  0.00000e+00 0.00000e+00 1.88082e+02 218.089 4.84244e+02 218.089 0.5769 
1 1 1 2   33  4  o 12 1.18214e+01 3.58185e-01 1.66894e+02 135.182 -1.47901e+00 1.46965e+00  0.00000e+00 0.00000e+00 1.48599e+02 135.182 1.82949e+01 315.182 0.7113 
1 1 1 2   33  5  o 16 3.04392e+01 5.83199e-01 6.27697e+02 42.484  1.84570e+01  1.69032e+01  0.00000e+00 0.00000e+00 4.91194e+02 42.484  1.36503e+02 222.484 0.9798 
1 1 1 2   33  6  o 15 4.29653e+01 7.71212e-01 7.42781e+02 149.550 -3.48507e+01 2.04879e+01  0.00000e+00 0.00000e+00 8.48619e+02 149.550 1.05837e+02 149.550 0.9876 
1 1 1 2   33  7  o 14 2.83673e+01 5.77089e-01 4.50853e+02 354.560 2.39885e+01  -2.28460e+00 0.00000e+00 0.00000e+00 5.90446e+02 354.560 1.39593e+02 354.560 0.9790 
1 1 1 2   33  8  o 17 1.71328e+01 7.28019e-01 2.65768e+02 115.135 -4.16281e+00 8.87245e+00  0.00000e+00 0.00000e+00 3.42668e+02 115.135 7.69005e+01 115.135 0.9475 
1 1 1 2   33  9  o 19 3.45474e+01 6.93029e-01 3.52391e+02 153.182 -2.94737e+01 1.48997e+01  0.00000e+00 0.00000e+00 9.22126e+02 153.182 5.69735e+02 153.182 0.9847 
1 1 1 2   33  10 o 19 9.42082e+00 7.59469e-01 2.16646e+02 64.122  2.87922e+00  5.93521e+00  0.00000e+00 0.00000e+00 1.08152e+02 64.122  1.08493e+02 244.122 0.9207 
1 1 1 2   33  11 o 5  1.21629e+01 7.35869e-01 1.08730e+02 311.039 4.11357e+00  -4.72568e+00 0.00000e+00 0.00000e+00 3.08350e+02 311.039 1.99620e+02 311.039 0.9163 
1 1 1 2   33  12 o 15 8.26928e+00 1.03346e+00 1.38991e+02 224.524 -5.12424e+00 -5.03980e+00 0.00000e+00 0.00000e+00 1.47883e+02 224.524 8.89181e+00 224.524 0.9276 
1 1 1 2   33  13 o 1  1.22482e+01 7.85981e-01 2.74041e+02 39.569  2.26272e+01  1.86980e+01  0.00000e+00 0.00000e+00 1.75867e+02 39.569  9.81741e+01 219.569 0.9828 
1 1 1 2   33  14 o 13 8.86681e+00 1.07475e+00 1.69226e+02 5.823   1.43830e+01  1.46690e+00  0.00000e+00 0.00000e+00 1.50258e+02 5.823   1.89672e+01 185.823 0.9648 
1 1 1 2   33  15 o 1  3.66414e+00 1.11723e+00 1.08489e+02 212.547 -3.82101e+00 -2.43869e+00 0.00000e+00 0.00000e+00 1.20148e+01 212.547 9.64739e+01 32.547  0.8813 
1 1 1 2   33  16 o 5  9.58999e+00 1.37642e+00 1.93123e+02 200.104 -1.93213e+01 -7.07213e+00 0.00000e+00 0.00000e+00 1.55637e+02 200.104 3.74864e+01 20.104  0.9754 
1 1 1 2   33  17 o 1  4.99409e+00 1.47021e+00 7.52220e+01 265.899 -3.26518e-01 -4.55377e+00 0.00000e+00 0.00000e+00 8.88989e+01 265.899 1.36769e+01 265.899 0.8822 
1 1 1 2   33  18 o 6  5.57752e+00 1.75603e+00 1.12893e+02 57.973  3.53079e+00  5.64445e+00  0.00000e+00 0.00000e+00 7.83718e+01 57.973  3.45214e+01 237.973 0.9215 
1 1 1 2   34  0  o 2  4.82803e+00 3.09297e-01 1.58155e+02 312.284 4.00576e-01  -4.40468e-01 0.00000e+00 0.00000e+00 1.06478e+02 132.284 2.64633e+02 132.284 0.2852 
1 1 1 2   34  1  f 0  2.16345e+01 3.66966e-01 3.09854e+02 164.430 -4.96095e+00 1.38234e+00  0.00000e+00 0.00000e+00 4.18207e+02 164.430 1.08353e+02 164.430 0.8967 
1 1 1 2   34  2  o 12 1.15440e+01 3.28696e-01 3.32173e+02 104.827 -8.30985e-01 3.13908e+00  0.00000e+00 0.00000e+00 2.59725e+01 104.827 3.06201e+02 284.827 0.8267 
1 1 1 2   34  3  o 18 1.94015e+01 3.80064e-01 3.84380e+02 242.803 -3.22892e+00 -6.28364e+00 0.00000e+00 0.00000e+00 2.89957e+02 242.803 9.44230e+01 62.803  0.9262 
1 1 1 2   34  4  f 0  3.99399e+01 6.36680e-01 9.42747e+02 357.882 3.89839e+01  -1.44151e+00 0.00000e+00 0.00000e+00 5.36440e+02 357.882 4.06306e+02 177.882 0.9871 
1 1 1 2   34  5  f 0  5.63070e+01 9.41190e-01 1.08917e+03 156.507 -6.60695e+01 2.87181e+01  0.00000e+00 0.00000e+00 1.00832e+03 156.507 8.08449e+01 336.507 0.9930 
1 1 1 2   34  6  o 8  1.41166e+01 4.83830e-01 3.03079e+02 167.404 -5.52397e+00 1.23435e+00  0.00000e+00 0.00000e+00 1.76952e+02 167.404 1.26127e+02 347.404 0.9067 
1 1 1 2   34  7  o 18 3.15191e+01 6.19251e-01 5.31760e+02 326.126 2.43638e+01  -1.63557e+01 0.00000e+00 0.00000e+00 6.29598e+02 326.126 9.78377e+01 326.126 0.9828 
1 1 1 2   34  8  o 9  3.47576e+01 6.79828e-01 4.89153e+02 168.764 -3.58442e+01 7.12104e+00  0.00000e+00 0.00000e+00 7.95491e+02 168.764 3.06338e+02 168.764 0.9862 
1 1 1 2   34  9  o 1  2.71217e+01 6.18862e-01 4.47126e+02 357.205 3.37655e+01  -1.64815e+00 0.00000e+00 0.00000e+00 5.53712e+02 357.205 1.06586e+02 357.205 0.9851 
1 1 1 2   34  10 o 11 3.26133e+01 7.90292e-01 4.65001e+02 311.675 3.50431e+01  -3.93656e+01 0.00000e+00 0.00000e+00 7.44445e+02 311.675 2.79444e+02 311.675 0.9905 
1 1 1 2   34  11 o 11 3.23177e+01 7.63449e-01 6.59061e+02 250.653 -3.25194e+01 -9.26196e+01 0.00000e+00 0.00000e+00 5.44104e+02 250.653 1.14957e+02 70.653  0.9949 
1 1 1 2   34  12 o 15 1.21530e+01 7.18134e-01 2.11491e+02 13.857  1.72268e+01  4.24962e+00  0.00000e+00 0.00000e+00 2.29998e+02 13.857  1.85069e+01 13.857  0.9714 
1 1 1 2   34  13 o 4  6.21914e+00 1.04359e+00 1.26248e+02 107.708 -1.93405e+00 6.05722e+00  0.00000e+00 0.00000e+00 8.70182e+01 107.708 3.92295e+01 287.708 0.9176 
1 1 1 2   34  14 o 17 7.12926e+00 1.16355e+00 1.71102e+02 225.979 -7.46763e+00 -7.72743e+00 0.00000e+00 0.00000e+00 8.24242e+01 225.979 8.86773e+01 45.980  0.9523 
1 1 1 2   34  15 o 13 7.45976e+00 1.22888e+00 1.01416e+02 30.319  7.26355e+00  4.24763e+00  0.00000e+00 0.00000e+00 1.59830e+02 30.319  5.84143e+01 30.319  0.9385 
1 1 1 2   34  16 o 10 7.95311e+00 1.38317e+00 1.51283e+02 345.389 1.28648e+01  -3.35375e+00 0.00000e+00 0.00000e+00 1.33841e+02 345.389 1.74414e+01 165.389 0.9616 
1 1 1 2   34  17 o 18 5.84047e+00 1.60033e+00 1.12220e+02 138.459 -5.26573e+00 4.66538e+00  0.00000e+00 0.00000e+00 8.92037e+01 138.459 2.30165e+01 318.459 0.9259 
1 1 1 2   34  18 o 18 4.78476e+00 1.58555e+00 4.91719e+01 233.299 -1.66642e+00 -2.23559e+00 0.00000e+00 0.00000e+00 9.20201e+01 233.299 4.28482e+01 233.299 0.7930 
1 1 1 2   35  0  o 8  7.00322e+00 2.66996e-01 8.57770e+01 213.783 -3.80224e-01 -2.54375e-01 0.00000e+00 0.00000e+00 2.71907e+01 33.783  1.12968e+02 33.783  0.2230 
1 1 1 2   35  1  o 9  1.26086e+01 2.88266e-01 1.74968e+02 190.801 -1.85502e+00 -3.53883e-01 0.00000e+00 0.00000e+00 1.46086e+02 190.801 2.88818e+01 10.801  0.6786 
1 1 1 2   35  2  o 12 8.35192e+00 3.33658e-01 3.25024e+02 69.550  8.37083e-01  2.24488e+00  0.00000e+00 0.00000e+00 8.89820e+01 249.550 4.14006e+02 249.550 0.7532 
1 1 1 2   35  3  o 4  2.27271e+01 4.16108e-01 4.91786e+02 252.809 -2.97461e+00 -9.61452e+00 0.00000e+00 0.00000e+00 3.17413e+02 252.809 1.74373e+02 72.809  0.9489 
1 1 1 2   35  4  o 6  1.38018e+01 3.46951e-01 3.88150e+02 149.004 -5.52538e+00 3.31946e+00  0.00000e+00 0.00000e+00 8.75770e+01 149.004 3.00573e+02 329.004 0.9188 
1 1 1 2   35  5  o 10 2.52910e+01 4.61939e-01 5.70461e+02 81.316  2.57333e+00  1.68476e+01  0.00000e+00 0.00000e+00 3.49905e+02 81.316  2.20556e+02 261.316 0.9702 
1 1 1 2   35  6  o 19 2.44323e+01 4.97662e-01 3.66590e+02 100.549 -2.23216e+00 1.19863e+01  0.00000e+00 0.00000e+00 5.11182e+02 100.549 1.44593e+02 100.549 0.9581 
1 1 1 2   35  7  o 11 9.37881e+00 5.39002e-01 2.10807e+02 279.949 5.84420e-01  -3.33160e+00 0.00000e+00 0.00000e+00 8.26681e+01 279.949 1.28139e+02 99.949  0.8347 
1 1 1 2   35  8  f 0  1.17306e+01 5.23040e-01 1.03999e+02 66.444  1.07967e+00  2.47647e+00  0.00000e+00 0.00000e+00 2.41184e+02 66.444  1.37185e+02 66.444  0.7853 
1 1 1 2   35  9  o 3  2.33721e+01 6.24607e-01 5.47862e+02 1.908   3.84479e+01  1.28088e+00  0.00000e+00 0.00000e+00 3.16122e+02 1.908   2.31740e+02 181.908 0.9869 
1 1 1 2   35  10 o 3  2.24710e+01 6.63969e-01 3.57378e+02 261.914 -3.86180e+00 -2.71832e+01 0.00000e+00 0.00000e+00 4.68423e+02 261.914 1.11044e+02 261.914 0.9816 
1 1 1 2   35  11 o 3  2.80308e+01 8.48058e-01 4.13483e+02 138.229 -4.21611e+01 3.76578e+01  0.00000e+00 0.00000e+00 6.26020e+02 138.229 2.12537e+02 138.229 0.9911 
1 1 1 2   35  12 o 16 1.39714e+01 6.77583e-01 2.94442e+02 21.751  2.80080e+01  1.11746e+01  0.00000e+00 0.00000e+00 2.19260e+02 21.751  7.51820e+01 201.751 0.9833 
1 1 1 2   35  13 o 17 8.55233e+00 9.18877e-01 1.53383e+02 318.350 8.23386e+00  -7.32328e+00 0.00000e+00 0.00000e+00 1.51336e+02 318.350 2.04731e+00 138.350 0.9535 
1 1 1 2   35  14 o 12 1.89275e+01 7.56995e-01 3.59213e+02 150.585 -5.97163e+01 3.36687e+01  0.00000e+00 0.00000e+00 3.42370e+02 150.585 1.68432e+01 330.585 0.9927 
1 1 1 2   35  15 f 0  5.07920e+00 1.23943e+00 8.82641e+01 24.177  4.51967e+00  2.02903e+00  0.00000e+00 0.00000e+00 8.08338e+01 24.177  7.43032e+00 204.177 0.8923 
1 1 1 2   35  16 o 7  4.79033e+00 1.35627e+00 3.53866e+01 147.481 -1.65396e+00 1.05444e+00  0.00000e+00 0.00000e+00 8.80692e+01 147.481 5.26826e+01 147.481 0.6913 
1 1 1 2   35  17 o 11 6.18092e+00 1.64042e+00 1.55970e+02 209.625 -8.88435e+00 -5.05208e+00 0.00000e+00 0.00000e+00 6.26577e+01 209.625 9.33126e+01 29.625  0.9497 
1 1 1 2   35  18 o 12 5.12063e+00 1.68455e+00 1.29912e+02 68.680  2.70913e+00  6.94140e+00  0.00000e+00 0.00000e+00 4.73198e+01 68.680  8.25925e+01 248.680 0.9303 
1 1 1 2   36  0  o 12 1.54588e+01 3.07300e-01 3.62369e+02 313.914 3.29440e+00  -3.42177e+00 0.00000e+00 0.00000e+00 1.52222e+02 313.914 2.10148e+02 133.914 0.8872 
1 1 1 2   36  1  o 7  1.78918e+01 3.34197e-01 5.45682e+02 284.348 2.15452e+00  -8.42269e+00 0.00000e+00 0.00000e+00 8.57463e+01 284.348 4.59935e+02 104.349 0.9406 
1 1 1 2   36  2  o 1  2.71558e+01 4.93758e-01 5.07200e+02 115.764 -5.69788e+00 1.18054e+01  0.00000e+00 0.00000e+00 4.72016e+02 115.764 3.51837e+01 295.764 0.9611 
1 1 1 2   36  3  o 8  8.89663e+00 3.44894e-01 2.11796e+02 119.107 -9.73112e-01 1.74786e+00  0.00000e+00 0.00000e+00 2.11317e+01 119.107 1.90664e+02 299.107 0.6979 
1 1 1 2   36  4  o 1  1.01718e+01 3.35216e-01 3.65867e+02 307.657 2.52386e+00  -3.27060e+00 0.00000e+00 0.00000e+00 3.45217e+01 127.657 4.00388e+02 127.657 0.8684 
1 1 1 2   36  5  o 13 2.84119e+01 4.96773e-01 6.95415e+02 321.009 1.88010e+01  -1.52197e+01 0.00000e+00 0.00000e+00 3.47907e+02 321.009 3.47509e+02 141.009 0.9791 
1 1 1 2   36  6  o 5  3.26214e+01 6.02233e-01 6.39633e+02 349.029 2.76342e+01  -5.35727e+00 0.00000e+00 0.00000e+00 5.61590e+02 349.029 7.80427e+01 169.029 0.9821 
1 1 1 2   36  7  o 16 1.47860e+01 4.47569e-01 3.89206e+02 108.736 -3.15233e+00 9.29411e+00  0.00000e+00 0.00000e+00 1.35979e+02 108.736 2.53227e+02 288.736 0.9476 
1 1 1 2   36  8  o 4  1.39104e+01 4.85363e-01 2.71563e+02 182.334 -9.23409e+00 -3.76424e-01 0.00000e+00 0.00000e+00 2.20590e+02 182.334 5.09732e+01 2.334   0.9442 
1 1 1 2   36  9  o 1  1.36543e+01 6.41519e-01 2.84179e+02 284.536 2.78022e+00  -1.07222e+01 0.00000e+00 0.00000e+00 2.03553e+02 284.536 8.06258e+01 104.536 0.9537 
1 1 1 2   36  10 f 0  1.84264e+01 5.75524e-01 2.76012e+02 134.284 -1.38695e+01 1.42206e+01  0.00000e+00 0.00000e+00 3.96172e+02 134.284 1.20161e+02 134.284 0.9745 
1 1 1 2   36  11 o 19 2.32021e+01 6.25924e-01 3.72748e+02 335.975 4.26053e+01  -1.89913e+01 0.00000e+00 0.00000e+00 4.85961e+02 335.975 1.13213e+02 335.975 0.9892 
1 1 1 2   36  12 o 4  3.14448e+01 7.15310e-01 5.80007e+02 264.284 -1.32824e+01 -1.32698e+02 0.00000e+00 0.00000e+00 5.91292e+02 264.284 1.12854e+01 264.284 0.9962 
1 1 1 2   36  13 o 7  2.30233e+01 7.04521e-01 3.36879e+02 168.808 -6.75465e+01 1.33642e+01  0.00000e+00 0.00000e+00 5.17103e+02 168.808 1.80224e+02 168.808 0.9927 
1 1 1 2   36  14 o 11 1.66959e+01 7.54573e-01 3.01293e+02 76.461  1.28627e+01  5.34156e+01  0.00000e+00 0.00000e+00 3.16377e+02 76.461  1.50840e+01 76.461  0.9909 
1 1 1 2   36  15 o 18 6.01890e+00 1.34052e+00 4.43629e+01 42.033  1.99867e+00  1.80171e+00  0.00000e+00 0.00000e+00 1.31738e+02 42.033  8.73748e+01 42.033  0.7843 
1 1 1 2   36  16 o 17 8.83123e+00 1.39149e+00 1.26543e+02 193.862 -1.16876e+01 -2.88425e+00 0.00000e+00 0.00000e+00 1.88650e+02 193.862 6.21067e+01 193.862 0.9575 
1 1 1 2   36  17 o 19 6.97656e+00 1.86012e+00 8.13129e+01 125.115 -3.00083e+00 4.26742e+00  0.00000e+00 0.00000e+00 1.52038e+02 125.115 7.07254e+01 125.115 0.8982 
1 1 1 2   36  18 o 10 5.94031e+00 1.84055e+00 1.82903e+01 100.105 -1.96463e-01 1.10242e+00  0.00000e+00 0.00000e+00 8.93856e+01 100.105 7.10953e+01 100.105 0.4872 
1 1 1 2   37  0  o 16 1.47878e+01 3.05236e-01 3.02468e+02 149.209 -3.39192e+00 2.02127e+00  0.00000e+00 0.00000e+00 1.75463e+02 149.209 1.27005e+02 329.209 0.8615 
1 1 1 2   37  1  o 8  6.56572e+00 2.87207e-01 1.54361e+02 205.992 -8.76175e-01 -4.27179e-01 0.00000e+00 0.00000e+00 4.66247e+01 25.992  2.00985e+02 25.992  0.4374 
1 1 1 2   37  2  o 12 9.66485e+00 3.28429e-01 1.27438e+02 178.543 -1.11545e+00 2.83666e-02  0.00000e+00 0.00000e+00 4.87518e+01 178.543 7.86863e+01 358.543 0.4859 
1 1 1 2   37  3  o 10 1.03100e+01 3.25290e-01 4.86508e+02 55.777  2.94894e+00  4.33555e+00  0.00000e+00 0.00000e+00 1.38908e+02 235.777 6.25417e+02 235.777 0.8987 
1 1 1 2   37  4  o 16 3.05679e+01 5.63723e-01 6.10512e+02 40.630  1.85969e+01  1.59566e+01  0.00000e+00 0.00000e+00 5.12399e+02 40.630  9.81133e+01 220.630 0.9794 
1 1 1 2   37  5  o 18 2.51759e+01 4.95921e-01 4.26228e+02 271.955 4.75902e-01  -1.39421e+01 0.00000e+00 0.00000e+00 4.83404e+02 271.955 5.71764e+01 271.955 0.9635 
1 1 1 2   37  6  o 19 3.55225e+01 5.95146e-01 5.51838e+02 5.317   3.08065e+01  2.86679e+00  0.00000e+00 0.00000e+00 7.58256e+02 5.317   2.06418e+02 5.317   0.9837 
1 1 1 2   37  7  o 15 5.00477e+01 8.58531e-01 9.53862e+02 59.219  4.12547e+01  6.92572e+01  0.00000e+00 0.00000e+00 9.10241e+02 59.219  4.36219e+01 239.219 0.9938 
1 1 1 2   37  8  o 17 1.80239e+01 4.96201e-01 3.76652e+02 254.938 -4.24530e+00 -1.57751e+01 0.00000e+00 0.00000e+00 2.77617e+02 254.938 9.90347e+01 74.938  0.9689 
1 1 1 2   37  9  o 15 1.78639e+01 5.38342e-01 2.43400e+02 28.898  1.08899e+01  6.01096e+00  0.00000e+00 0.00000e+00 3.98106e+02 28.898  1.54706e+02 28.898  0.9589 
1 1 1 2   37  10 o 10 9.21991e+00 7.06197e-01 2.37949e+02 329.093 7.96911e+00  -4.77075e+00 0.00000e+00 0.00000e+00 8.80121e+01 329.093 1.49937e+02 149.093 0.9445 
1 1 1 2   37  11 o 2  2.07999e+01 6.13587e-01 4.52001e+02 283.161 1.27094e+01  -5.43521e+01 0.00000e+00 0.00000e+00 3.19110e+02 283.161 1.32891e+02 103.161 0.9910 
1 1 1 2   37  12 o 18 6.72072e+00 9.50131e-01 1.10292e+02 127.315 -3.11159e+00 4.08227e+00  0.00000e+00 0.00000e+00 1.14934e+02 127.315 4.64178e+00 127.315 0.8964 
1 1 1 2   37  13 o 18 5.58390e+00 1.11080e+00 1.67774e+02 66.124  3.14501e+00  7.10514e+00  0.00000e+00 0.00000e+00 2.69154e+01 66.124  1.40859e+02 246.124 0.9332 
1 1 1 2   37  14 o 19 9.41141e+00 1.07394e+00 1.22388e+02 107.697 -3.56295e+00 1.11659e+01  0.00000e+00 0.00000e+00 2.13627e+02 107.697 9.12389e+01 107.697 0.9563 
1 1 1 2   37  15 o 2  6.60759e+00 1.31971e+00 1.99421e+02 10.690  1.35418e+01  2.55620e+00  0.00000e+00 0.00000e+00 3.79416e+01 10.690  1.61480e+02 190.690 0.9630 
1 1 1 2   37  16 o 19 6.59011e+00 1.48172e+00 1.32132e+02 135.055 -6.84232e+00 6.82919e+00  0.00000e+00 0.00000e+00 1.00411e+02 135.055 3.17201e+01 315.055 0.9468 
1 1 1 2   37  17 o 16 4.91417e+00 1.57715e+00 3.35131e+01 25.097  1.56966e+00  7.35178e-01  0.00000e+00 0.00000e+00 8.51962e+01 25.097  5.16831e+01 25.097  0.6487 
1 1 1 2   37  18 o 11 5.30005e+00 1.72397e+00 1.14907e+02 31.024  5.68281e+00  3.41777e+00  0.00000e+00 0.00000e+00 6.67085e+01 31.024  4.81984e+01 211.024 0.9212 
1 1 1 2   38  0  o 16 1.26886e+01 2.93603e-01 9.47109e+01 192.973 -1.11647e+00 -2.57209e-01 0.00000e+00 0.00000e+00 1.41195e+02 192.973 4.64841e+01 192.973 0.4956 
1 1 1 2   38  1  o 5  3.30745e+01 5.05174e-01 6.08694e+02 2.168   1.82976e+01  6.92771e-01  0.00000e+00 0.00000e+00 5.97650e+02 2.168   1.10437e+01 182.168 0.9723 
1 1 1 2   38  2  o 15 3.39816e+00 4.44920e-01 1.28084e+02 65.233  1.93996e-01  4.20480e-01  0.00000e+00 0.00000e+00 9.93335e+01 245.233 2.27418e+02 245.233 0.2255 
1 1 1 2   38  3  o 13 2.09937e+01 4.01884e-01 3.19926e+02 358.149 8.08451e+00  -2.61223e-01 0.00000e+00 0.00000e+00 4.17122e+02 358.149 9.71962e+01 358.149 0.9360 
1 1 1 2   38  4  o 16 1.96313e+01 4.81456e-01 4.93345e+02 211.318 -1.07748e+01 -6.55583e+00 0.00000e+00 0.00000e+00 2.13101e+02 211.318 2.80244e+02 31.318  0.9595 
1 1 1 2   38  5  o 10 4.57030e+01 7.21996e-01 1.00361e+03 306.403 3.45445e+01  -4.68503e+01 0.00000e+00 0.00000e+00 6.95339e+02 306.403 3.08276e+02 126.403 0.9914 
1 1 1 2   38  6  o 14 4.67159e+01 7.42106e-01 1.00150e+03 121.931 -3.78457e+01 6.07288e+01  0.00000e+00 0.00000e+00 7.37487e+02 121.931 2.64016e+02 301.931 0.9930 
1 1 1 2   38  7  o 12 3.07600e+01 5.92129e-01 4.79728e+02 242.165 -1.43743e+01 -2.72230e+01 0.00000e+00 0.00000e+00 6.54151e+02 242.165 1.74422e+02 242.165 0.9836 
1 1 1 2   38  8  o 3  2.48739e+01 5.45257e-01 4.20365e+02 306.195 1.65040e+01  -2.25543e+01 0.00000e+00 0.00000e+00 4.94628e+02 306.195 7.42636e+01 306.195 0.9819 
1 1 1 2   38  9  o 19 2.20298e+01 5.60865e-01 3.26692e+02 102.666 -5.06243e+00 2.25255e+01  0.00000e+00 0.00000e+00 4.80154e+02 102.666 1.53462e+02 102.666 0.9781 
1 1 1 2   38  10 o 8  9.80799e+00 8.48812e-01 1.90997e+02 122.766 -4.19772e+00 6.52218e+00  0.00000e+00 0.00000e+00 1.51530e+02 122.766 3.94675e+01 302.766 0.9331 
1 1 1 2   38  11 o 11 2.93321e+01 7.30830e-01 5.90609e+02 164.286 -9.34161e+01 2.62833e+01  0.00000e+00 0.00000e+00 5.00908e+02 164.286 8.97008e+01 344.286 0.9948 
1 1 1 2   38  12 o 7  1.94167e+01 6.50278e-01 3.33208e+02 117.221 -2.14042e+01 4.16100e+01  0.00000e+00 0.00000e+00 3.84836e+02 117.221 5.16279e+01 117.221 0.9893 
1 1 1 2   38  13 o 11 1.75843e+01 7.10167e-01 2.89883e+02 356.641 4.81141e+01  -2.82398e+00 0.00000e+00 0.00000e+00 3.60160e+02 356.641 7.02774e+01 356.641 0.9896 
1 1 1 2   38  14 o 6  1.56602e+01 9.01385e-01 3.32107e+02 102.001 -1.23658e+01 5.81735e+01  0.00000e+00 0.00000e+00 2.47535e+02 102.001 8.45726e+01 282.001 0.9916 
1 1 1 2   38  15 o 18 1.79258e+01 1.07729e+00 2.70322e+02 1.800   5.99723e+01  1.88522e+00  0.00000e+00 0.00000e+00 3.92695e+02 1.800   1.22373e+02 1.800   0.9916 
1 1 1 2   38  16 o 14 7.23740e+00 1.53949e+00 9.92982e+01 281.428 1.44833e+00  -7.16486e+00 0.00000e+00 0.00000e+00 1.51222e+02 281.428 5.19236e+01 281.428 0.9288 
1 1 1 2   38  17 o 5  4.83229e+00 1.49430e+00 7.46068e+01 211.348 -3.62594e+00 -2.20877e+00 0.00000e+00 0.00000e+00 8.23426e+01 211.348 7.73575e+00 211.348 0.8723 
1 1 1 2   38  18 o 19 3.70066e+00 1.26228e+00 9.73770e+01 13.256  5.29115e+00  1.24650e+00  0.00000e+00 0.00000e+00 2.68632e+01 13.256  7.05138e+01 193.256 0.9026 
1 1 1 2   38  19 o 17 7.43286e+00 2.05407e+00 1.44851e+02 93.214  -5.75719e-01 1.02514e+01  0.00000e+00 0.00000e+00 1.17512e+02 93.214  2.73392e+01 273.214 0.9500 
1 1 1 2   39  0  o 9  2.47891e+01 4.05831e-01 4.82250e+02 294.652 4.50441e+00  -9.81489e+00 0.00000e+00 0.00000e+00 4.03359e+02 294.652 7.88914e+01 114.652 0.9525 
1 1 1 2   39  1  o 7  1.08569e+01 2.95861e-01 7.87492e+01 284.740 1.95095e-01  -7.41530e-01 0.00000e+00 0.00000e+00 6.69232e+01 284.740 1.18260e+01 104.740 0.3577 
1 1 1 2   39  2  o 1  2.08869e+01 4.19975e-01 5.29023e+02 288.338 3.63913e+00  -1.09791e+01 0.00000e+00 0.00000e+00 2.19738e+02 288.338 3.09285e+02 108.338 0.9557 
1 1 1 2   39  3  o 10 5.68002e+00 3.55410e-01 1.86445e+02 119.062 -5.71296e-01 1.02801e+00  0.00000e+00 0.00000e+00 7.87968e+01 299.062 2.65242e+02 299.062 0.5053 
1 1 1 2   39  4  f 0  1.07783e+01 4.49873e-01 1.41582e+02 235.839 -1.01205e+00 -1.49138e+00 0.00000e+00 0.00000e+00 1.26194e+02 235.839 1.53880e+01 55.839  0.6625 
1 1 1 2   39  5  o 19 2.17298e+01 5.81213e-01 2.42418e+02 116.745 -3.12517e+00 6.20152e+00  0.00000e+00 0.00000e+00 5.11124e+02 116.745 2.68706e+02 116.745 0.9249 
1 1 1 2   39  6  o 3  8.56023e+00 4.17725e-01 1.60827e+02 107.352 -7.77014e-01 2.48679e+00  0.00000e+00 0.00000e+00 8.81642e+01 107.352 7.26625e+01 287.352 0.7760 
1 1 1 2   39  7  o 1  3.61790e+01 6.21112e-01 6.99102e+02 3.201   5.24383e+01  2.93312e+00  0.00000e+00 0.00000e+00 6.43624e+02 3.201   5.54782e+01 183.201 0.9904 
1 1 1 2   39  8  o 9  2.73124e+01 5.73193e-01 5.72722e+02 201.532 -3.79061e+01 -1.49560e+01 0.00000e+00 0.00000e+00 4.37707e+02 201.532 1.35015e+02 21.532  0.9877 
1 1 1 2   39  9  o 2  4.15936e+01 7.67311e-01 7.40810e+02 53.191  5.62621e+01  7.51812e+01  0.00000e+00 0.00000e+00 8.08192e+02 53.191  6.73819e+01 53.191  0.9947 
1 1 1 2   39  10 o 10 1.65577e+01 5.81215e-01 3.16593e+02 210.135 -1.99077e+01 -1.15564e+01 0.00000e+00 0.00000e+00 2.89428e+02 210.135 2.71649e+01 30.135  0.9780 
1 1 1 2   39  11 o 3  2.37618e+01 6.29032e-01 3.71804e+02 77.940  1.04489e+01  4.89052e+01  0.00000e+00 0.00000e+00 5.07995e+02 77.940  1.36191e+02 77.940  0.9900 
1 1 1 2   39  12 o 7  2.20861e+01 6.47828e-01 4.25068e+02 250.642 -2.37560e+01 -6.76159e+01 0.00000e+00 0.00000e+00 3.94693e+02 250.642 3.03753e+01 70.642  0.9930 
1 1 1 2   39  13 o 16 1.02042e+01 8.65000e-01 2.86764e+02 102.359 -5.68089e+00 2.59273e+01  0.00000e+00 0.00000e+00 8.71433e+01 102.359 1.99620e+02 282.359 0.9810 
1 1 1 2   39  14 o 13 7.56706e+00 1.21603e+00 1.03242e+02 253.634 -2.28255e+00 -7.77270e+00 0.00000e+00 0.00000e+00 1.61144e+02 253.634 5.79017e+01 253.634 0.9361 
1 1 1 2   39  15 o 3  1.27322e+01 1.04310e+00 1.04828e+02 355.699 1.64072e+01  -1.23392e+00 0.00000e+00 0.00000e+00 3.55355e+02 355.699 2.50527e+02 355.699 0.9691 
1 1 1 2   39  16 o 11 5.71062e+00 1.63049e+00 1.32592e+02 133.666 -5.36397e+00 5.61965e+00  0.00000e+00 0.00000e+00 6.59915e+01 133.666 6.66007e+01 313.666 0.9332 
1 1 1 2   39  17 o 17 4.29941e+00 1.44978e+00 1.38528e+02 56.495  3.94476e+00  5.95866e+00  0.00000e+00 0.00000e+00 9.86761e+00 56.495  1.28660e+02 236.495 0.9271 
1 1 1 2   39  18 o 17 5.42880e+00 1.54382e+00 9.74921e+01 271.137 1.29045e-01  -6.50019e+00 0.00000e+00 0.00000e+00 8.81604e+01 271.137 9.33172e+00 91.137  0.9195 
1 1 1 2   39  19 f 0  1.12768e+01 2.02656e+00 1.45719e+02 132.601 -1.07749e+01 1.17174e+01  0.00000e+00 0.00000e+00 2.59860e+02 132.601 1.14140e+02 132.601 0.9681 
1 1 1 2   40  0  o 4  8.27407e+00 3.28367e-01 5.53797e+01 104.895 -1.25225e-01 4.70785e-01  0.00000e+00 0.00000e+00 1.80456e+01 104.895 3.73341e+01 284.895 0.2366 
1 1 1 2   40  1  o 16 2.61673e+01 4.25514e-01 4.90719e+02 164.990 -1.30666e+01 3.50356e+00  0.00000e+00 0.00000e+00 4.53676e+02 164.990 3.70425e+01 344.990 0.9623 
1 1 1 2   40  2  f 0  2.02930e+01 3.70424e-01 3.14741e+02 312.977 5.25610e+00  -5.64111e+00 0.00000e+00 0.00000e+00 3.95111e+02 312.977 8.03696e+01 312.977 0.9327 
1 1 1 2   40  3  o 10 3.07883e+01 5.18653e-01 5.63145e+02 273.545 1.40925e+00  -2.27455e+01 0.00000e+00 0.00000e+00 5.65840e+02 273.545 2.69439e+00 273.545 0.9778 
1 1 1 2   40  4  o 11 3.69734e+01 7.22086e-01 7.12375e+02 5.498   3.18565e+01  3.06632e+00  0.00000e+00 0.00000e+00 6.52167e+02 5.498   6.02083e+01 185.498 0.9843 
1 1 1 2   40  5  o 17 1.40230e+01 4.02959e-01 1.93911e+02 220.116 -2.83196e+00 -2.38606e+00 0.00000e+00 0.00000e+00 2.53498e+02 220.116 5.95868e+01 220.116 0.8511 
1 1 1 2   40  6  o 9  1.62425e+01 4.05555e-01 3.50571e+02 115.157 -4.25936e+00 9.06937e+00  0.00000e+00 0.00000e+00 2.26965e+02 115.157 1.23606e+02 295.157 0.9487 
1 1 1 2   40  7  f 0  2.43331e+01 4.91115e-01 5.54198e+02 16.410  2.81173e+01  8.28051e+00  0.00000e+00 0.00000e+00 3.41821e+02 16.410  2.12377e+02 196.410 0.9828 
1 1 1 2   40  8  o 14 6.19546e+01 1.05121e+00 1.20325e+03 186.454 -1.95003e+02 -2.20583e+01 0.00000e+00 0.00000e+00 1.11126e+03 186.454 9.19927e+01 6.454   0.9974 
1 1 1 2   40  9  o 3  1.65597e+01 5.53146e-01 3.59604e+02 346.894 1.85023e+01  -4.30783e+00 0.00000e+00 0.00000e+00 2.43801e+02 346.894 1.15803e+02 166.894 0.9733 
1 1 1 2   40  10 f 0  1.43946e+01 6.03528e-01 1.31127e+02 69.906  2.83119e+00  7.73896e+00  0.00000e+00 0.00000e+00 3.73675e+02 69.906  2.42548e+02 69.906  0.9372 
1 1 1 2   40  11 o 19 1.44802e+01 6.26468e-01 2.98724e+02 322.319 1.95277e+01  -1.50824e+01 0.00000e+00 0.00000e+00 2.31712e+02 322.319 6.70117e+01 142.319 0.9795 
1 1 1 2   40  12 o 10 9.97556e+00 7.78882e-01 1.74874e+02 97.609  -1.85286e+00 1.38691e+01  0.00000e+00 0.00000e+00 1.84376e+02 97.609  9.50155e+00 97.609  0.9636 
1 1 1 2   40  13 o 7  5.94467e+00 1.09200e+00 1.33374e+02 354.175 7.27141e+00  -7.41794e-01 0.00000e+00 0.00000e+00 7.28511e+01 354.175 6.05225e+01 174.175 0.9288 
1 1 1 2   40  14 f 0  1.11263e+01 9.94872e-01 1.97427e+02 69.412  8.82459e+00  2.34930e+01  0.00000e+00 0.00000e+00 2.09458e+02 69.412  1.20305e+01 69.412  0.9799 
1 1 1 2   40  15 o 11 5.23466e+00 1.36982e+00 1.11900e+02 219.291 -4.67009e+00 -3.82118e+00 0.00000e+00 0.00000e+00 6.63008e+01 219.291 4.55987e+01 39.291  0.9129 
1 1 1 2   40  16 o 18 7.40667e+00 1.85153e+00 1.85214e+02 69.275  4.19492e+00  1.10870e+01  0.00000e+00 0.00000e+00 7.88389e+01 69.275  1.06375e+02 249.275 0.9568 
1 1 1 2   40  17 o 13 5.53012e+00 1.61781e+00 7.31650e+01 163.807 -4.32195e+00 1.25504e+00  0.00000e+00 0.00000e+00 1.08057e+02 163.807 3.48925e+01 163.807 0.8803 
1 1 1 2   40  18 o 9  4.22458e+00 1.39804e+00 5.82188e+01 87.036  1.82283e-01  3.51993e+00  0.00000e+00 0.00000e+00 7.41198e+01 87.036  1.59010e+01 87.036  0.8424 
1 1 1 2   40  19 o 12 4.23697e+00 1.43362e+00 6.22237e+01 52.008  2.53450e+00  3.24499e+00  0.00000e+00 0.00000e+00 7.43792e+01 52.008  1.21554e+01 52.008  0.8679 
1 1 1 2   41  0  o 12 3.71735e+01 5.55285e-01 6.93267e+02 316.217 1.93650e+01  -1.85595e+01 0.00000e+00 0.00000e+00 6.74453e+02 316.217 1.88139e+01 136.217 0.9812 
1 1 1 2   41  1  o 12 2.08845e+01 3.71655e-01 3.74915e+02 234.280 -4.73949e+00 -6.59080e+00 0.00000e+00 0.00000e+00 3.58310e+02 234.280 1.66044e+01 54.280  0.9362 
1 1 1 2   41  2  o 4  1.40453e+01 3.20378e-01 7.69897e+01 126.065 -7.08007e-01 9.72175e-01  0.00000e+00 0.00000e+00 1.93528e+02 126.065 1.16538e+02 126.065 0.5136 
1 1 1 2   41  3  o 7  1.20428e+01 3.37394e-01 1.58445e+02 130.446 -1.47875e+00 1.73470e+00  0.00000e+00 0.00000e+00 1.75143e+02 130.446 1.66978e+01 130.446 0.7387 
1 1 1 2   41  4  o 13 2.08997e+01 4.97095e-01 4.05037e+02 170.117 -1.08207e+01 1.88521e+00  0.00000e+00 0.00000e+00 3.41973e+02 170.117 6.30635e+01 350.117 0.9533 
1 1 1 2   41  5  o 16 1.31878e+01 4.33313e-01 1.68536e+02 6.921   3.51587e+00  4.26779e-01  0.00000e+00 0.00000e+00 2.48322e+02 6.921   7.97865e+01 6.921   0.8433 
1 1 1 2   41  6  o 11 1.28664e+01 4.00684e-01 4.12690e+02 359.440 9.09196e+00  -8.89258e-02 0.00000e+00 0.00000e+00 4.21421e+01 359.440 3.70547e+02 179.440 0.9433 
1 1 1 2   41  7  f 0  2.42969e+01 4.91049e-01 5.49720e+02 100.868 -5.59163e+00 2.91234e+01  0.00000e+00 0.00000e+00 3.45048e+02 100.868 2.04672e+02 280.868 0.9830 
1 1 1 2   41  8  o 1  2.49518e+01 5.55228e-01 4.50924e+02 247.199 -1.22130e+01 -2.90518e+01 0.00000e+00 0.00000e+00 4.68563e+02 247.199 1.76387e+01 247.199 0.9840 
1 1 1 2   41  9  o 4  2.25919e+01 5.66471e-01 3.92563e+02 203.108 -2.67986e+01 -1.14351e+01 0.00000e+00 0.00000e+00 4.38480e+02 203.108 4.59171e+01 203.108 0.9827 
1 1 1 2   41  10 o 10 2.00526e+01 7.82001e-01 5.72053e+02 305.035 2.94156e+01  -4.19545e+01 0.00000e+00 0.00000e+00 1.70845e+02 305.035 4.01208e+02 125.035 0.9902 
1 1 1 2   41  11 o 4  8.63938e+00 7.87549e-01 1.85978e+02 208.641 -8.34358e+00 -4.55673e+00 0.00000e+00 0.00000e+00 1.19583e+02 208.641 6.63956e+01 28.641  0.9458 
1 1 1 2   41  12 o 9  1.56482e+01 6.54079e-01 3.68394e+02 79.215  8.39214e+00  4.40544e+01  0.00000e+00 0.00000e+00 2.09826e+02 79.215  1.58569e+02 259.215 0.9888 
1 1 1 2   41  13 o 12 1.38051e+01 8.11993e-01 2.47389e+02 244.044 -1.49065e+01 -3.06230e+01 0.00000e+00 0.00000e+00 2.60532e+02 244.044 1.31429e+01 244.044 0.9852 
1 1 1 2   41  14 o 15 3.39882e+00 1.04883e+00 2.20018e+01 52.337  4.84552e-01  6.27769e-01  0.00000e+00 0.00000e+00 2.47096e+01 52.337  2.70776e+00 52.337  0.3683 
1 1 1 2   41  15 o 12 5.77980e+00 1.27106e+00 1.37235e+02 311.836 6.34424e+00  -7.08656e+00 0.00000e+00 0.00000e+00 6.66107e+01 311.836 7.06243e+01 131.836 0.9459 
1 1 1 2   41  16 o 2  6.28710e+00 1.66277e+00 1.73695e+02 63.272  4.98519e+00  9.90006e+00  0.00000e+00 0.00000e+00 4.96992e+01 63.272  1.23995e+02 243.272 0.9538 
1 1 1 2   41  17 o 19 4.82345e+00 1.45225e+00 7.48681e+01 189.597 -4.16146e+00 -7.03655e-01 0.00000e+00 0.00000e+00 8.15905e+01 189.597 6.72239e+00 189.597 0.8715 
1 1 1 2   41  18 o 9  5.02264e+00 1.53977e+00 2.11122e+01 214.104 -1.12573e+00 -7.62282e-01 0.00000e+00 0.00000e+00 8.33681e+01 214.104 6.22560e+01 214.104 0.5594 
1 1 1 2   41  19 o 5  4.69693e+00 1.51909e+00 5.44200e+01 247.591 -1.38671e+00 -3.36295e+00 0.00000e+00 0.00000e+00 9.35219e+01 247.591 3.91019e+01 247.591 0.8480 
1 1 1 2   42  0  o 16 4.56707e+01 6.63776e-01 9.23416e+02 325.035 4.12894e+01  -2.88738e+01 0.00000e+00 0.00000e+00 7.71900e+02 325.035 1.51516e+02 145.035 0.9900 
1 1 1 2   42  1  o 5  1.44560e+01 3.19259e-01 2.00736e+02 93.190  -1.93145e-01 3.46503e+00  0.00000e+00 0.00000e+00 2.54336e+02 93.190  5.36002e+01 93.190  0.8395 
1 1 1 2   42  2  o 12 1.39355e+01 3.21672e-01 2.32268e+02 348.296 4.18442e+00  -8.66830e-01 0.00000e+00 0.00000e+00 2.24033e+02 348.296 8.23508e+00 168.296 0.8733 
1 1 1 2   42  3  o 16 3.14772e+01 5.28924e-01 6.99946e+02 307.769 1.66112e+01  -2.14389e+01 0.00000e+00 0.00000e+00 4.58267e+02 307.769 2.41679e+02 127.769 0.9814 
1 1 1 2   42  4  f 0  3.81886e+01 6.74980e-01 6.69003e+02 188.976 -3.19851e+01 -5.05240e+00 0.00000e+00 0.00000e+00 7.40334e+02 188.976 7.13305e+01 188.976 0.9844 
1 1 1 2   42  5  o 15 1.37506e+01 4.54894e-01 3.04722e+02 44.978  4.59257e+00  4.58909e+00  0.00000e+00 0.00000e+00 1.69118e+02 44.978  1.35604e+02 224.978 0.9194 
1 1 1 2   42  6  o 7  1.03429e+01 4.04800e-01 3.18497e+02 133.185 -3.88017e+00 4.13416e+00  0.00000e+00 0.00000e+00 3.29838e+01 133.185 2.85513e+02 313.185 0.9069 
1 1 1 2   42  7  o 8  2.31862e+01 4.86192e-01 4.18560e+02 226.448 -1.63709e+01 -1.72199e+01 0.00000e+00 0.00000e+00 4.31501e+02 226.448 1.29410e+01 226.448 0.9787 
1 1 1 2   42  8  o 17 2.07752e+01 4.96881e-01 4.17691e+02 85.637  1.99987e+00  2.62128e+01  0.00000e+00 0.00000e+00 3.45300e+02 85.637  7.23909e+01 265.637 0.9808 
1 1 1 2   42  9  f 0  2.12792e+01 5.69345e-01 2.93359e+02 194.233 -2.14452e+01 -5.43975e+00 0.00000e+00 0.00000e+00 4.84883e+02 194.233 1.91524e+02 194.233 0.9771 
1 1 1 2   42  10 o 14 2.76168e+01 6.33100e-01 5.59385e+02 313.130 5.06507e+01  -5.40687e+01 0.00000e+00 0.00000e+00 4.66769e+02 313.130 9.26159e+01 133.131 0.9932 
1 1 1 2   42  11 o 12 4.44556e+00 1.03478e+00 9.27933e+01 168.009 -2.31460e+00 4.91609e-01  0.00000e+00 0.00000e+00 3.18068e+01 168.009 6.09865e+01 348.009 0.7496 
1 1 1 2   42  12 o 4  1.65555e+01 6.58387e-01 3.21737e+02 349.543 4.43327e+01  -8.18223e+00 0.00000e+00 0.00000e+00 2.89975e+02 349.543 3.17617e+01 169.543 0.9888 
1 1 1 2   42  13 o 19 8.66233e+00 1.00617e+00 1.95722e+02 346.647 1.60645e+01  -3.81319e+00 0.00000e+00 0.00000e+00 1.17779e+02 346.647 7.79433e+01 166.647 0.9692 
1 1 1 2   42  14 o 13 8.82006e+00 1.13643e+00 1.65005e+02 27.915  1.41960e+01  7.52113e+00  0.00000e+00 0.00000e+00 1.53681e+02 27.915  1.13243e+01 207.915 0.9684 
1 1 1 2   42  15 o 19 7.78279e+00 1.66979e+00 9.99809e+01 245.356 -3.03553e+00 -6.61685e+00 0.00000e+00 0.00000e+00 1.69444e+02 245.356 6.94632e+01 245.356 0.9285 
1 1 1 2   42  16 o 6  5.11601e+00 1.53847e+00 8.44957e+01 311.440 3.13199e+00  -3.54750e+00 0.00000e+00 0.00000e+00 8.45002e+01 311.440 4.53452e-03 311.440 0.8868 
1 1 1 2   42  17 o 12 6.89355e+00 1.69566e+00 7.44401e+01 58.920  2.74480e+00  4.55372e+00  0.00000e+00 0.00000e+00 1.56517e+02 58.920  8.20774e+01 58.920  0.9002 
1 1 1 2   42  18 o 3  6.98351e+00 1.78653e+00 1.10244e+02 56.604  4.55651e+00  6.91147e+00  0.00000e+00 0.00000e+00 1.33168e+02 56.604  2.29249e+01 56.604  0.9375 
1 1 1 2   43  0  o 4  2.66258e+01 4.31906e-01 3.54189e+02 94.950  -9.00027e-01 1.03920e+01  0.00000e+00 0.00000e+00 5.94888e+02 94.950  2.40699e+02 94.950  0.9508 
1 1 1 2   43  1  o 16 1.32060e+01 3.40472e-01 3.18203e+02 319.830 3.53653e+00  -2.98541e+00 0.00000e+00 0.00000e+00 1.19471e+02 319.830 1.98732e+02 139.830 0.8840 
1 1 1 2   43  2  o 17 3.29129e+01 5.10742e-01 5.30184e+02 18.045  1.97508e+01  6.43441e+00  0.00000e+00 0.00000e+00 6.73692e+02 18.045  1.43508e+02 18.045  0.9756 
1 1 1 2   43  3  o 18 3.32787e+01 5.52604e-01 5.62567e+02 164.388 -2.35047e+01 6.56809e+00  0.00000e+00 0.00000e+00 6.59177e+02 164.388 9.66101e+01 164.388 0.9793 
1 1 1 2   43  4  o 2  2.54601e+01 4.65706e-01 4.73671e+02 333.472 1.42172e+01  -7.09703e+00 0.00000e+00 0.00000e+00 4.50134e+02 333.472 2.35368e+01 153.472 0.9680 
1 1 1 2   43  5  o 8  1.39424e+01 3.81578e-01 3.16419e+02 198.287 -7.95481e+00 -2.62877e+00 0.00000e+00 0.00000e+00 1.73840e+02 198.287 1.42579e+02 18.287  0.9383 
1 1 1 2   43  6  o 4  1.28655e+01 4.43577e-01 2.31366e+02 142.048 -4.93054e+00 3.84545e+00  0.00000e+00 0.00000e+00 2.10230e+02 142.048 2.11358e+01 322.048 0.9161 
1 1 1 2   43  7  o 18 1.71929e+01 4.92666e-01 3.35700e+02 168.321 -1.36026e+01 2.81173e+00  0.00000e+00 0.00000e+00 2.84630e+02 168.321 5.10697e+01 348.321 0.9633 
1 1 1 2   43  8  o 17 1.80045e+01 4.93552e-01 3.76912e+02 17.440  1.86378e+01  5.85503e+00  0.00000e+00 0.00000e+00 2.79706e+02 17.440  9.72060e+01 197.440 0.9741 
1 1 1 2   43  9  o 13 2.20421e+01 5.34287e-01 4.91401e+02 256.915 -8.46064e+00 -3.64009e+01 0.00000e+00 0.00000e+00 3.22401e+02 256.915 1.69000e+02 76.915  0.9865 
1 1 1 2   43  10 o 4  9.92936e+00 6.72070e-01 2.73745e+02 73.438  3.60690e+00  1.21283e+01  0.00000e+00 0.00000e+00 8.26776e+01 73.438  1.91067e+02 253.438 0.9596 
1 1 1 2   43  11 o 1  1.40892e+01 6.47395e-01 2.92109e+02 283.144 6.32446e+00  -2.70839e+01 0.00000e+00 0.00000e+00 2.25055e+02 283.144 6.70535e+01 103.144 0.9819 
1 1 1 2   43  12 o 11 1.63318e+01 6.62166e-01 2.23875e+02 333.268 2.79410e+01  -1.40724e+01 0.00000e+00 0.00000e+00 3.76473e+02 333.268 1.52598e+02 333.268 0.9839 
1 1 1 2   43  13 o 17 1.31031e+01 8.55307e-01 2.62832e+02 143.587 -2.74759e+01 2.02663e+01  0.00000e+00 0.00000e+00 2.19167e+02 143.587 4.36648e+01 323.587 0.9852 
1 1 1 2   43  14 o 8  4.89243e+00 1.24213e+00 8.77212e+01 77.574  9.36117e-01  4.24851e+00  0.00000e+00 0.00000e+00 7.21301e+01 77.574  1.55911e+01 257.574 0.8758 
1 1 1 2   43  15 o 10 4.92815e+00 1.38504e+00 9.82955e+01 12.844  5.23079e+00  1.19260e+00  0.00000e+00 0.00000e+00 6.72685e+01 12.844  3.10270e+01 192.844 0.9012 
1 1 1 2   43  16 o 17 4.34017e+00 1.42117e+00 8.74361e+01 281.978 9.41887e-01  -4.43966e+00 0.00000e+00 0.00000e+00 5.50535e+01 281.978 3.23826e+01 101.978 0.8815 
1 1 1 2   43  17 o 8  5.94931e+00 1.61051e+00 1.04583e+02 76.999  1.55073e+00  6.71661e+00  0.00000e+00 0.00000e+00 1.00046e+02 76.999  4.53703e+00 256.999 0.9243 
1 1 1 2   43  18 o 3  5.01895e+00 1.54738e+00 1.31240e+02 192.326 -8.12354e+00 -1.77502e+00 0.00000e+00 0.00000e+00 4.37298e+01 192.326 8.75106e+01 12.326  0.9378 
1 1 1 2   44  0  o 14 3.42928e+01 5.45463e-01 6.56335e+02 235.886 -1.65170e+01 -2.43822e+01 0.00000e+00 0.00000e+00 6.07131e+02 235.886 4.92033e+01 55.886  0.9829 
1 1 1 2   44  1  o 2  3.65329e+01 5.52484e-01 6.05708e+02 355.583 2.87059e+01  -2.21752e+00 0.00000e+00 0.00000e+00 7.39818e+02 355.583 1.34110e+02 355.583 0.9825 
1 1 1 2   44  2  o 9  1.72405e+01 3.50772e-01 2.24766e+02 190.855 -4.69846e+00 -9.00971e-01 0.00000e+00 0.00000e+00 3.49223e+02 190.855 1.24458e+02 190.855 0.8881 
1 1 1 2   44  3  o 16 3.96549e+01 6.43738e-01 6.79197e+02 72.447  1.03668e+01  3.27738e+01  0.00000e+00 0.00000e+00 7.85456e+02 72.447  1.06259e+02 72.447  0.9853 
1 1 1 2   44  4  o 13 2.98694e+01 5.18129e-01 6.06627e+02 242.772 -1.12170e+01 -2.18001e+01 0.00000e+00 0.00000e+00 4.89784e+02 242.772 1.16843e+02 62.772  0.9794 
1 1 1 2   44  5  o 14 3.67199e+01 6.09462e-01 6.72411e+02 95.190  -3.90948e+00 4.30449e+01  0.00000e+00 0.00000e+00 6.87546e+02 95.190  1.51348e+01 95.190  0.9884 
1 1 1 2   44  6  o 18 3.53047e+01 6.06352e-01 4.83438e+02 292.079 1.33327e+01  -3.28694e+01 0.00000e+00 0.00000e+00 8.20385e+02 292.079 3.36947e+02 292.079 0.9858 
1 1 1 2   44  7  o 3  2.60352e+01 5.10476e-01 6.09885e+02 30.238  3.67109e+01  2.13987e+01  0.00000e+00 0.00000e+00 3.53607e+02 30.238  2.56279e+02 210.238 0.9882 
1 1 1 2   44  8  o 11 3.98216e+01 6.85700e-01 6.14192e+02 17.259  7.44443e+01  2.31286e+01  0.00000e+00 0.00000e+00 8.66993e+02 17.259  2.52801e+02 17.259  0.9936 
1 1 1 2   44  9  o 8  1.74157e+01 5.34230e-01 2.40720e+02 311.489 1.08655e+01  -1.22860e+01 0.00000e+00 0.00000e+00 3.90786e+02 311.489 1.50066e+02 311.489 0.9690 
1 1 1 2   44  10 o 6  7.81072e+00 7.91398e-01 1.94415e+02 108.952 -2.42016e+00 7.04762e+00  0.00000e+00 0.00000e+00 7.73407e+01 108.952 1.17075e+02 288.952 0.9303 
1 1 1 2   44  11 o 11 2.22228e+01 6.34126e-01 4.55665e+02 244.004 -3.10346e+01 -6.36427e+01 0.00000e+00 0.00000e+00 3.69146e+02 244.004 8.65187e+01 64.004  0.9929 
1 1 1 2   44  12 o 16 1.00747e+01 8.15849e-01 1.79972e+02 231.675 -9.73502e+00 -1.23157e+01 0.00000e+00 0.00000e+00 1.84196e+02 231.675 4.22343e+00 231.675 0.9676 
1 1 1 2   44  13 o 8  6.03615e+00 1.11290e+00 6.92595e+01 20.440  3.71953e+00  1.38621e+00  0.00000e+00 0.00000e+00 1.25059e+02 20.440  5.57992e+01 20.440  0.8623 
1 1 1 2   44  14 o 16 1.01577e+01 9.88878e-01 1.71979e+02 293.102 8.25315e+00  -1.93477e+01 0.00000e+00 0.00000e+00 1.97823e+02 293.102 2.58445e+01 293.102 0.9759 
1 1 1 2   44  15 o 13 6.00200e+00 1.48077e+00 2.30014e+02 292.980 5.61650e+00  -1.32444e+01 0.00000e+00 0.00000e+00 1.42180e+01 112.980 2.44232e+02 112.980 0.9646 
1 1 1 2   44  16 o 13 6.80630e+00 1.67924e+00 2.14070e+02 58.640  7.43887e+00  1.22062e+01  0.00000e+00 0.00000e+00 3.03728e+01 58.640  1.83697e+02 238.640 0.9644 
1 1 1 2   44  17 o 1  3.23159e+00 1.11216e+00 6.08107e+01 138.324 -2.28632e+00 2.03531e+00  0.00000e+00 0.00000e+00 3.71105e+01 138.324 2.37002e+01 318.324 0.8144 
1 1 1 2   44  18 o 3  8.70895e+00 1.79294e+00 7.06376e+01 301.589 3.42849e+00  -5.57526e+00 0.00000e+00 0.00000e+00 2.27202e+02 301.589 1.56565e+02 301.589 0.9201 
1 1 1 2   45  0  o 1  1.73557e+01 3.34398e-01 3.45570e+02 70.825  2.34206e+00  6.73491e+00  0.00000e+00 0.00000e+00 2.57428e+02 70.825  8.81420e+01 250.825 0.9270 
1 1 1 2   45  1  o 10 1.48366e+01 3.33079e-01 1.99846e+02 263.607 -3.90475e-01 -3.48484e+00 0.00000e+00 0.00000e+00 2.68098e+02 263.607 6.82528e+01 263.607 0.8415 
1 1 1 2   45  2  o 17 4.64852e+01 6.80736e-01 7.38835e+02 139.111 -3.36813e+01 2.91646e+01  0.00000e+00 0.00000e+00 9.83878e+02 139.111 2.45044e+02 139.111 0.9887 
1 1 1 2   45  3  f 0  4.26337e+01 6.78430e-01 7.99352e+02 288.829 1.44819e+01  -4.24698e+01 0.00000e+00 0.00000e+00 7.80640e+02 288.829 1.87124e+01 108.829 0.9888 
1 1 1 2   45  4  o 14 4.44723e+00 4.90081e-01 5.18248e+01 37.607  2.88921e-01  2.22555e-01  0.00000e+00 0.00000e+00 2.19289e+01 217.607 7.37537e+01 217.607 0.1794 
1 1 1 2   45  5  o 17 2.80597e+01 5.08205e-01 3.72786e+02 97.737  -2.40626e+00 1.77102e+01  0.00000e+00 0.00000e+00 6.48690e+02 97.737  2.75904e+02 97.737  0.9716 
1 1 1 2   45  6  o 13 3.24217e+01 5.65573e-01 4.19785e+02 246.070 -1.19554e+01 -2.69403e+01 0.00000e+00 0.00000e+00 7.73881e+02 246.070 3.54097e+02 246.070 0.9829 
1 1 1 2   45  7  o 5  1.78005e+01 4.56357e-01 3.85131e+02 84.938  1.58353e+00  1.78777e+01  0.00000e+00 0.00000e+00 2.62584e+02 84.938  1.22546e+02 264.938 0.9717 
1 1 1 2   45  8  o 18 2.65997e+01 5.43117e-01 4.77494e+02 133.214 -2.70090e+01 2.87476e+01  0.00000e+00 0.00000e+00 5.05481e+02 133.214 2.79866e+01 133.214 0.9872 
1 1 1 2   45  9  o 17 8.60941e+00 7.97968e-01 1.91179e+02 263.000 -8.37804e-01 -6.82335e+00 0.00000e+00 0.00000e+00 1.06498e+02 263.000 8.46816e+01 83.000  0.9241 
1 1 1 2   45  10 o 12 2.04926e+01 5.61553e-01 3.53937e+02 110.346 -1.36662e+01 3.68529e+01  0.00000e+00 0.00000e+00 4.02606e+02 110.346 4.86696e+01 110.346 0.9872 
1 1 1 2   45  11 f 0  6.79214e+00 9.00332e-01 2.11528e+02 241.445 -4.78879e+00 -8.79987e+00 0.00000e+00 0.00000e+00 2.93096e+01 241.445 1.82218e+02 61.445  0.9487 
1 1 1 2   45  12 o 19 1.11766e+01 8.34731e-01 2.39383e+02 315.776 1.64836e+01  -1.60431e+01 0.00000e+00 0.00000e+00 1.68913e+02 315.776 7.04697e+01 135.776 0.9780 
1 1 1 2   45  13 o 15 3.36317e+00 1.01605e+00 6.07612e+01 22.561  1.75459e+00  7.28965e-01  0.00000e+00 0.00000e+00 2.46854e+01 22.561  3.60758e+01 202.561 0.6806 
1 1 1 2   45  14 o 13 7.82646e+00 1.50632e+00 7.73145e+01 84.742  5.19423e-01  5.64388e+00  0.00000e+00 0.00000e+00 1.87419e+02 84.742  1.10104e+02 84.742  0.9069 
1 1 1 2   45  15 o 3  4.40705e+00 1.37639e+00 6.76467e+01 214.793 -2.71764e+00 -1.88835e+00 0.00000e+00 0.00000e+00 6.87584e+01 214.793 1.11166e+00 214.793 0.8305 
1 1 1 2   45  16 o 11 3.79775e+00 1.22638e+00 4.10103e+01 341.606 2.03798e+00  -6.77704e-01 0.00000e+00 0.00000e+00 6.08942e+01 341.606 1.98839e+01 341.606 0.7206 
1 1 1 2   45  17 o 2  3.64113e+00 1.21586e+00 5.03127e+01 204.687 -2.45095e+00 -1.12664e+00 0.00000e+00 0.00000e+00 5.60052e+01 204.687 5.69246e+00 204.687 0.7849 
1 1 1 2   45  18 o 3  4.98822e+00 1.51130e+00 7.06762e+01 201.596 -4.42899e+00 -1.75319e+00 0.00000e+00 0.00000e+00 9.38742e+01 201.596 2.31980e+01 201.596 0.8876 
1 1 1 2   46  0  o 15 2.56887e+01 4.13964e-01 4.89524e+02 166.783 -1.50311e+01 3.53011e+00  0.00000e+00 0.00000e+00 4.41475e+02 166.783 4.80486e+01 346.783 0.9671 
1 1 1 2   46  1  o 11 1.53625e+01 3.36088e-01 1.50037e+02 300.392 1.42741e+00  -2.43375e+00 0.00000e+00 0.00000e+00 3.08191e+02 300.392 1.58155e+02 300.392 0.7959 
1 1 1 2   46  2  o 19 1.62096e+01 3.49842e-01 1.73794e+02 64.857  1.53603e+00  3.27272e+00  0.00000e+00 0.00000e+00 3.40699e+02 64.857  1.66905e+02 64.857  0.8469 
1 1 1 2   46  3  o 2  3.92683e+01 5.97230e-01 7.18065e+02 97.083  -4.71354e+00 3.79355e+01  0.00000e+00 0.00000e+00 7.34139e+02 97.083  1.60746e+01 97.083  0.9868 
1 1 1 2   46  4  f 0  3.59346e+01 5.98561e-01 4.23795e+02 121.204 -1.21081e+01 1.99901e+01  0.00000e+00 0.00000e+00 8.93549e+02 121.204 4.69754e+02 121.204 0.9784 
1 1 1 2   46  5  o 4  3.42944e+00 5.87709e-01 9.84392e+01 187.021 -5.73340e-01 -7.06109e-02 0.00000e+00 0.00000e+00 6.27971e+01 7.021   1.61236e+02 7.021   0.2774 
1 1 1 2   46  6  o 11 4.32478e+01 7.02487e-01 5.99596e+02 334.762 5.14871e+01  -2.42698e+01 0.00000e+00 0.00000e+00 1.00588e+03 334.762 4.06283e+02 334.762 0.9912 
1 1 1 2   46  7  o 12 1.60674e+01 4.52019e-01 2.53789e+02 18.273  1.06500e+01  3.51651e+00  0.00000e+00 0.00000e+00 3.20318e+02 18.273  6.65292e+01 18.273  0.9543 
1 1 1 2   46  8  o 8  1.22852e+01 5.12076e-01 2.29294e+02 282.750 1.99181e+00  -8.80244e+00 0.00000e+00 0.00000e+00 2.04230e+02 282.750 2.50638e+01 102.750 0.9429 
1 1 1 2   46  9  f 0  9.02239e+00 7.09935e-01 9.17428e+01 61.858  1.63835e+00  3.06301e+00  0.00000e+00 0.00000e+00 1.91690e+02 61.858  9.99475e+01 61.858  0.8397 
1 1 1 2   46  10 o 18 1.65607e+01 5.70462e-01 2.50589e+02 22.545  2.19465e+01  9.11062e+00  0.00000e+00 0.00000e+00 3.55478e+02 22.545  1.04889e+02 22.545  0.9787 
1 1 1 2   46  11 o 5  1.55560e+01 6.28747e-01 2.62719e+02 67.295  1.14838e+01  2.74458e+01  0.00000e+00 0.00000e+00 3.08770e+02 67.295  4.60507e+01 67.295  0.9830 
1 1 1 2   46  12 o 4  6.68143e+00 1.02987e+00 1.43201e+02 301.414 4.04543e+00  -6.62373e+00 0.00000e+00 0.00000e+00 8.96568e+01 301.414 5.35444e+01 121.414 0.9332 
1 1 1 2   46  13 o 16 4.77568e+00 1.19037e+00 1.52962e+02 180.217 -6.80921e+00 -2.57729e-02 0.00000e+00 0.00000e+00 1.16132e+01 180.217 1.41349e+02 0.217   0.9233 
1 1 1 2   46  14 o 13 4.47306e+00 1.31239e+00 1.53597e+02 198.278 -6.94581e+00 -2.29418e+00 0.00000e+00 0.00000e+00 1.36074e+00 198.278 1.52237e+02 18.278  0.9289 
1 1 1 2   46  15 o 16 9.26200e+00 1.58677e+00 2.09651e+02 296.896 8.63651e+00  -1.70265e+01 0.00000e+00 0.00000e+00 1.26330e+02 296.896 8.33211e+01 116.896 0.9734 
1 1 1 2   46  16 o 2  1.18297e+01 1.20429e+00 1.86842e+02 295.471 1.37729e+01  -2.89132e+01 0.00000e+00 0.00000e+00 2.46673e+02 295.471 5.98307e+01 295.471 0.9843 
1 1 1 2   46  17 o 11 3.08283e+00 1.06928e+00 1.01708e+02 104.604 -1.29921e+00 4.98641e+00  0.00000e+00 0.00000e+00 1.13336e+00 104.604 1.00575e+02 284.604 0.8968 
1 1 1 2   46  18 o 15 6.83714e+00 1.80008e+00 1.47082e+02 256.064 -2.63850e+00 -1.06331e+01 0.00000e+00 0.00000e+00 9.51041e+01 256.064 5.19780e+01 76.064  0.9532 
1 1 1 2   47  0  o 13 2.18175e+01 4.37669e-01 3.17280e+02 201.863 -8.35424e+00 -3.35220e+00 0.00000e+00 0.00000e+00 4.53412e+02 201.863 1.36133e+02 201.863 0.9427 
1 1 1 2   47  1  o 19 1.01165e+01 3.38946e-01 2.96064e+02 89.877  8.29447e-03  3.84841e+00  0.00000e+00 0.00000e+00 2.89875e+01 89.877  2.67077e+02 269.876 0.8574 
1 1 1 2   47  2  o 8  5.62143e+00 3.78166e-01 1.16037e+02 249.052 -3.08902e-01 -8.06929e-01 0.00000e+00 0.00000e+00 3.25881e+01 69.053  1.48625e+02 69.053  0.3961 
1 1 1 2   47  3  o 3  4.13439e+01 6.23416e-01 8.32640e+02 313.228 3.73207e+01  -3.97042e+01 0.00000e+00 0.00000e+00 7.02244e+02 313.228 1.30396e+02 133.228 0.9908 
1 1 1 2   47  4  o 16 3.77497e+01 6.23692e-01 7.95627e+02 339.782 4.93883e+01  -1.81892e+01 0.00000e+00 0.00000e+00 6.05175e+02 339.782 1.90452e+02 159.782 0.9905 
1 1 1 2   47  5  o 1  1.64101e+01 4.46770e-01 1.44640e+02 77.443  1.08347e+00  4.86431e+00  0.00000e+00 0.00000e+00 4.04278e+02 77.443  2.59638e+02 77.443  0.8930 
1 1 1 2   47  6  o 3  2.90644e+01 5.38617e-01 6.59026e+02 353.812 4.64270e+01  -5.03383e+00 0.00000e+00 0.00000e+00 4.17674e+02 353.812 2.41352e+02 173.812 0.9892 
1 1 1 2   47  7  o 18 1.47455e+01 5.00329e-01 1.49765e+02 194.349 -5.99638e+00 -1.53394e+00 0.00000e+00 0.00000e+00 3.55447e+02 194.349 2.05683e+02 194.349 0.9152 
1 1 1 2   47  8  o 6  1.61048e+01 5.49680e-01 2.84534e+02 218.264 -1.18428e+01 -9.34097e+00 0.00000e+00 0.00000e+00 2.97812e+02 218.264 1.32774e+01 218.264 0.9663 
1 1 1 2   47  9  o 17 3.05088e+01 5.96932e-01 5.14509e+02 50.313  4.37830e+01  5.27611e+01  0.00000e+00 0.00000e+00 6.18351e+02 50.313  1.03841e+02 50.313  0.9927 
1 1 1 2   47  10 o 11 8.40742e+00 7.14152e-01 8.40217e+01 95.287  -3.67517e-01 3.97133e+00  0.00000e+00 0.00000e+00 1.87268e+02 95.287  1.03247e+02 95.287  0.8631 
1 1 1 2   47  11 o 4  2.07061e+01 6.56662e-01 3.75764e+02 54.477  3.45075e+01  4.83367e+01  0.00000e+00 0.00000e+00 3.91405e+02 54.477  1.56410e+01 54.477  0.9915 
1 1 1 2   47  12 o 17 1.58485e+01 7.71467e-01 2.58860e+02 235.175 -2.15303e+01 -3.09488e+01 0.00000e+00 0.00000e+00 3.25070e+02 235.175 6.62096e+01 235.175 0.9866 
1 1 1 2   47  13 o 8  4.28000e+00 1.08107e+00 9.82949e+01 142.023 -3.36615e+00 2.62770e+00  0.00000e+00 0.00000e+00 4.11668e+01 142.023 5.71282e+01 322.023 0.8732 
1 1 1 2   47  14 o 8  1.51476e+01 1.19947e+00 2.48913e+02 9.024   4.02430e+01  6.39079e+00  0.00000e+00 0.00000e+00 3.08963e+02 9.024   6.00500e+01 9.024   0.9877 
1 1 1 2   47  15 o 13 5.59292e+00 1.52649e+00 1.27178e+02 194.992 -7.19007e+00 -1.92550e+00 0.00000e+00 0.00000e+00 6.66626e+01 194.992 6.05149e+01 14.992  0.9302 
1 1 1 2   47  16 f 0  3.91013e+00 1.15384e+00 5.88864e+01 274.440 2.53675e-01  -3.26693e+00 0.00000e+00 0.00000e+00 6.17187e+01 274.440 2.83233e+00 274.440 0.8285 
1 1 1 2   47  17 o 17 5.70400e+00 1.58910e+00 1.21651e+02 5.357   8.20695e+00  7.69617e-01  0.00000e+00 0.00000e+00 7.71794e+01 5.357   4.44717e+01 185.357 0.9372 
1 1 1 2   47  18 o 3  4.76034e+00 1.49722e+00 6.01943e+01 257.260 -8.97653e-01 -3.97046e+00 0.00000e+00 0.00000e+00 9.30134e+01 257.260 3.28191e+01 257.260 0.8662 
1 1 1 2   48  0  o 16 2.20506e+01 3.80827e-01 3.78665e+02 169.551 -1.04820e+01 1.93306e+00  0.00000e+00 0.00000e+00 4.07732e+02 169.551 2.90664e+01 169.551 0.9519 
1 1 1 2   48  1  o 19 7.87701e+00 3.42238e-01 1.24268e+02 107.097 -3.81726e-01 1.24108e+00  0.00000e+00 0.00000e+00 3.57633e+01 107.097 8.85047e+01 287.097 0.5422 
1 1 1 2   48  2  o 10 3.45027e+01 5.36783e-01 5.94598e+02 349.721 2.73604e+01  -4.96202e+00 0.00000e+00 0.00000e+00 6.74690e+02 349.721 8.00921e+01 349.721 0.9819 
1 1 1 2   48  3  o 16 2.66686e+01 4.56712e-01 2.93911e+02 70.205  4.10576e+00  1.14074e+01  0.00000e+00 0.00000e+00 6.63100e+02 70.205  3.69190e+02 70.205  0.9578 
1 1 1 2   48  4  o 19 2.40601e+01 4.61185e-01 4.30133e+02 198.173 -1.68445e+01 -5.52934e+00 0.00000e+00 0.00000e+00 4.45366e+02 198.173 1.52325e+01 198.173 0.9714 
1 1 1 2   48  5  f 0  1.95820e+01 4.34012e-01 3.02764e+02 327.463 1.04515e+01  -6.66779e+00 0.00000e+00 0.00000e+00 4.00411e+02 327.463 9.76468e+01 327.463 0.9588 
1 1 1 2   48  6  o 15 1.57540e+01 4.31178e-01 3.04349e+02 232.267 -7.06738e+00 -9.13310e+00 0.00000e+00 0.00000e+00 2.59387e+02 232.267 4.49629e+01 52.267  0.9557 
1 1 1 2   48  7  o 3  1.55810e+01 4.66788e-01 2.91012e+02 273.152 7.53692e-01  -1.36883e+01 0.00000e+00 0.00000e+00 2.70519e+02 273.152 2.04938e+01 93.152  0.9628 
1 1 1 2   48  8  o 15 1.59900e+01 4.99027e-01 3.58561e+02 64.968  8.64263e+00  1.85069e+01  0.00000e+00 0.00000e+00 2.24910e+02 64.968  1.33652e+02 244.968 0.9752 
1 1 1 2   48  9  o 13 3.45357e+00 9.68227e-01 2.32942e+01 38.046  2.90583e-01  2.27403e-01  0.00000e+00 0.00000e+00 1.39659e-01 38.046  2.31546e+01 218.046 0.1814 
1 1 1 2   48  10 o 17 2.54734e+01 5.86536e-01 3.81283e+02 283.085 1.34493e+01  -5.78657e+01 0.00000e+00 0.00000e+00 5.62924e+02 283.085 1.81641e+02 283.085 0.9915 
1 1 1 2   48  11 o 13 2.93937e+01 7.40490e-01 4.43614e+02 233.239 -6.32297e+01 -8.46423e+01 0.00000e+00 0.00000e+00 6.49367e+02 233.239 2.05753e+02 233.239 0.9953 
1 1 1 2   48  12 o 14 6.98463e+00 1.04833e+00 1.22918e+02 356.034 7.31737e+00  -5.07326e-01 0.00000e+00 0.00000e+00 1.19384e+02 356.034 3.53403e+00 176.034 0.9291 
1 1 1 2   48  13 o 14 5.16278e+00 1.23997e+00 1.05110e+02 260.993 -8.41185e-01 -5.30716e+00 0.00000e+00 0.00000e+00 6.85292e+01 260.993 3.65808e+01 80.994  0.9014 
1 1 1 2   48  14 o 11 1.59368e+01 1.10389e+00 2.47956e+02 333.936 4.13285e+01  -2.02140e+01 0.00000e+00 0.00000e+00 3.39754e+02 333.936 9.17973e+01 333.936 0.9891 
1 1 1 2   48  15 o 1  3.51503e+00 1.10346e+00 5.04116e+01 61.553  1.06198e+00  1.96022e+00  0.00000e+00 0.00000e+00 4.54546e+01 61.553  4.95706e+00 241.553 0.7321 
1 1 1 2   48  16 o 12 9.91726e+00 1.43214e+00 1.78972e+02 180.539 -2.15282e+01 -2.02412e-01 0.00000e+00 0.00000e+00 1.81497e+02 180.539 2.52456e+00 180.539 0.9765 
1 1 1 2   48  17 o 2  5.02107e+00 1.46992e+00 8.25748e+01 331.317 4.67283e+00  -2.55653e+00 0.00000e+00 0.00000e+00 8.55594e+01 331.317 2.98464e+00 331.317 0.9004 
1 1 1 2   48  18 o 15 7.26673e+00 1.79539e+00 1.24438e+02 192.300 -1.02858e+01 -2.24265e+00 0.00000e+00 0.00000e+00 1.32371e+02 192.300 7.93326e+00 192.300 0.9513 
1 1 1 2   49  0  o 3  3.27332e+01 4.96138e-01 5.88651e+02 221.851 -1.88705e+01 -1.69025e+01 0.00000e+00 0.00000e+00 6.13136e+02 221.851 2.44850e+01 221.851 0.9801 
1 1 1 2   49  1  o 4  1.81385e+01 3.93542e-01 3.32555e+02 14.401  7.94974e+00  2.04129e+00  0.00000e+00 0.00000e+00 3.04123e+02 14.401  2.84322e+01 194.401 0.9369 
1 1 1 2   49  2  o 8  3.32208e+01 5.23011e-01 5.74773e+02 230.438 -1.92632e+01 -2.33168e+01 0.00000e+00 0.00000e+00 6.49032e+02 230.438 7.42593e+01 230.438 0.9833 
1 1 1 2   49  3  o 18 1.04310e+01 3.59895e-01 1.60151e+02 138.159 -2.35822e+00 2.11150e+00  0.00000e+00 0.00000e+00 1.60851e+02 138.159 6.99869e-01 138.159 0.8215 
1 1 1 2   49  4  o 3  1.12286e+01 3.86568e-01 1.74825e+02 305.057 1.94193e+00  -2.76753e+00 0.00000e+00 0.00000e+00 1.76196e+02 305.057 1.37174e+00 305.057 0.8346 
1 1 1 2   49  5  o 13 2.32128e+01 4.65965e-01 3.35546e+02 214.255 -1.39813e+01 -9.52133e+00 0.00000e+00 0.00000e+00 5.07632e+02 214.255 1.72085e+02 214.255 0.9700 
1 1 1 2   49  6  o 5  1.43920e+01 4.73166e-01 1.90354e+02 45.867  4.99697e+00  5.15061e+00  0.00000e+00 0.00000e+00 3.09372e+02 45.867  1.19018e+02 45.867  0.9274 
1 1 1 2   49  7  o 15 1.06366e+01 4.94403e-01 2.18380e+02 320.678 5.15039e+00  -4.21880e+00 0.00000e+00 0.00000e+00 1.48462e+02 320.678 6.99180e+01 140.678 0.9215 
1 1 1 2   49  8  o 3  2.26658e+01 5.25568e-01 6.22660e+02 358.576 4.86845e+01  -1.20998e+00 0.00000e+00 0.00000e+00 2.16573e+02 358.576 4.06088e+02 178.576 0.9897 
1 1 1 2   49  9  o 13 1.59387e+01 5.32694e-01 2.89332e+02 295.896 9.54463e+00  -1.96599e+01 0.00000e+00 0.00000e+00 2.92914e+02 295.896 3.58244e+00 295.896 0.9768 
1 1 1 2   49  10 o 2  1.05433e+01 6.26929e-01 2.13526e+02 217.254 -1.10993e+01 -8.44150e+00 0.00000e+00 0.00000e+00 1.66151e+02 217.254 4.73755e+01 37.254  0.9634 
1 1 1 2   49  11 o 6  2.00348e+01 6.73207e-01 2.90551e+02 14.004  4.37991e+01  1.09235e+01  0.00000e+00 0.00000e+00 4.49543e+02 14.004  1.58992e+02 14.004  0.9889 
1 1 1 2   49  12 o 18 1.92416e+01 7.10632e-01 3.20103e+02 286.532 1.83205e+01  -6.17221e+01 0.00000e+00 0.00000e+00 3.92648e+02 286.532 7.25452e+01 286.532 0.9922 
1 1 1 2   49  13 o 11 4.60732e+00 1.29972e+00 1.17082e+02 209.079 -4.69504e+00 -2.61094e+00 0.00000e+00 0.00000e+00 3.78509e+01 209.079 7.92309e+01 29.079  0.9014 
1 1 1 2   49  14 o 9  5.69911e+00 1.39838e+00 8.40459e+01 147.557 -4.22689e+00 2.68692e+00  0.00000e+00 0.00000e+00 1.05807e+02 147.557 2.17611e+01 147.557 0.8936 
1 1 1 2   49  15 o 3  8.39321e+00 1.23276e+00 1.56374e+02 315.363 1.20441e+01  -1.18924e+01 0.00000e+00 0.00000e+00 1.46892e+02 315.363 9.48184e+00 135.363 0.9700 
1 1 1 2   49  16 o 11 6.46889e+00 1.56934e+00 8.02533e+01 175.766 -5.47779e+00 4.05556e-01  0.00000e+00 0.00000e+00 1.37315e+02 175.766 5.70615e+01 175.766 0.9037 
1 1 1 2   49  17 o 17 5.44493e+00 1.54208e+00 8.47672e+01 141.774 -4.63518e+00 3.65094e+00  0.00000e+00 0.00000e+00 9.96299e+01 141.774 1.48627e+01 141.774 0.9108 
1 1 1 2   49  18 o 13 3.79198e+00 1.27605e+00 1.13363e+02 184.604 -7.63198e+00 -6.14632e-01 0.00000e+00 0.00000e+00 1.79458e+01 184.604 9.54175e+01 4.604   0.9322 
1 1 1 2   50  0  o 4  3.00579e+01 4.66505e-01 3.76918e+02 223.993 -1.29918e+01 -1.25431e+01 0.00000e+00 0.00000e+00 7.17317e+02 223.993 3.40399e+02 223.993 0.9719 
1 1 1 2   50  1  o 17 2.74848e+01 4.55116e-01 4.26563e+02 307.237 1.12639e+01  -1.48195e+01 0.00000e+00 0.00000e+00 5.74925e+02 307.237 1.48362e+02 307.237 0.9728 
1 1 1 2   50  2  o 2  2.57133e+01 4.40359e-01 4.02388e+02 93.332  -9.28015e-01 1.59413e+01  0.00000e+00 0.00000e+00 5.30117e+02 93.332  1.27729e+02 93.332  0.9682 
1 1 1 2   50  3  o 2  2.85367e+01 6.20019e-01 3.60512e+02 68.536  6.56344e+00  1.66929e+01  0.00000e+00 0.00000e+00 6.78102e+02 68.536  3.17590e+02 68.536  0.9717 
1 1 1 2   50  4  o 14 2.63853e+01 4.86721e-01 5.42532e+02 287.593 9.07115e+00  -2.86085e+01 0.00000e+00 0.00000e+00 4.29000e+02 287.593 1.13532e+02 107.593 0.9832 
1 1 1 2   50  5  o 13 4.79268e+01 7.66696e-01 9.23861e+02 150.189 -8.38699e+01 4.80539e+01  0.00000e+00 0.00000e+00 8.61357e+02 150.189 6.25041e+01 330.189 0.9948 
1 1 1 2   50  6  o 7  4.59270e+01 7.43971e-01 8.35956e+02 43.790  7.49811e+01  7.18783e+01  0.00000e+00 0.00000e+00 8.74954e+02 43.790  3.89982e+01 43.790  0.9952 
1 1 1 2   50  7  o 3  3.03468e+01 5.68198e-01 5.49923e+02 336.590 4.74957e+01  -2.05627e+01 0.00000e+00 0.00000e+00 5.74679e+02 336.590 2.47555e+01 336.590 0.9903 
1 1 1 2   50  8  o 13 3.59472e+01 6.48380e-01 4.91489e+02 276.468 7.70212e+00  -6.79368e+01 0.00000e+00 0.00000e+00 8.43334e+02 276.468 3.51845e+02 276.468 0.9927 
1 1 1 2   50  9  o 4  6.28069e+00 8.15493e-01 1.79982e+02 206.842 -4.94425e+00 -2.50211e+00 0.00000e+00 0.00000e+00 3.24531e+01 206.842 1.47529e+02 26.842  0.9046 
1 1 1 2   50  10 o 9  5.68933e+00 9.28696e-01 9.53461e+01 49.108  2.27422e+00  2.62621e+00  0.00000e+00 0.00000e+00 8.32020e+01 49.108  1.21441e+01 229.108 0.8397 
1 1 1 2   50  11 o 18 7.97199e+00 8.91425e-01 1.64599e+02 36.266  8.46900e+00  6.21326e+00  0.00000e+00 0.00000e+00 1.18616e+02 36.266  4.59827e+01 216.266 0.9511 
1 1 1 2   50  12 o 8  1.47558e+01 6.81538e-01 2.51430e+02 251.932 -1.18960e+01 -3.64657e+01 0.00000e+00 0.00000e+00 2.92149e+02 251.932 4.07187e+01 251.932 0.9869 
1 1 1 2   50  13 f 0  6.44817e+00 1.35210e+00 2.22332e+02 96.826  -1.65053e+00 1.37876e+01  0.00000e+00 0.00000e+00 9.37272e+00 96.826  2.12959e+02 276.826 0.9633 
1 1 1 2   50  14 o 3  1.92796e+01 8.93701e-01 4.15371e+02 300.486 5.35862e+01  -9.10225e+01 0.00000e+00 0.00000e+00 2.99864e+02 300.486 1.15507e+02 120.486 0.9953 
1 1 1 2   50  15 o 14 7.61908e+00 1.23099e+00 1.42446e+02 258.272 -2.67339e+00 -1.28780e+01 0.00000e+00 0.00000e+00 1.30316e+02 258.272 1.21304e+01 78.272  0.9612 
1 1 1 2   50  16 o 7  9.21979e+00 1.48918e+00 2.24386e+02 138.304 -1.82525e+01 1.62603e+01  0.00000e+00 0.00000e+00 1.11615e+02 138.304 1.12771e+02 318.304 0.9793 
1 1 1 2   50  17 o 2  4.69171e+00 1.41600e+00 1.24481e+02 326.731 6.61074e+00  -4.33740e+00 0.00000e+00 0.00000e+00 3.85120e+01 326.731 8.59694e+01 146.731 0.9344 
1 1 1 2   50  18 f 0  3.94621e+00 1.31493e+00 6.53565e+01 229.504 -2.70895e+00 -3.17228e+00 0.00000e+00 0.00000e+00 6.21295e+01 229.504 3.22699e+00 49.504  0.8698 
1 1 1 2   51  0  o 7  1.71964e+01 3.43069e-01 3.41835e+02 57.021  4.96704e+00  7.65467e+00  0.00000e+00 0.00000e+00 2.65807e+02 57.021  7.60276e+01 237.021 0.9435 
1 1 1 2   51  1  o 15 1.85923e+01 3.96729e-01 2.66081e+02 161.300 -7.24040e+00 2.45074e+00  0.00000e+00 0.00000e+00 3.82969e+02 161.300 1.16889e+02 161.300 0.9321 
1 1 1 2   51  2  o 18 2.63155e+01 4.50030e-01 4.73543e+02 289.196 7.72060e+00  -2.21750e+01 0.00000e+00 0.00000e+00 4.90825e+02 289.196 1.72821e+01 289.196 0.9785 
1 1 1 2   51  3  o 18 1.53894e+01 4.56617e-01 4.51860e+02 12.296  1.15734e+01  2.52247e+00  0.00000e+00 0.00000e+00 9.95844e+01 12.296  3.52275e+02 192.296 0.9568 
1 1 1 2   51  4  o 15 2.59724e+01 5.28966e-01 4.75683e+02 174.813 -2.56273e+01 2.32635e+00  0.00000e+00 0.00000e+00 4.77770e+02 174.813 2.08640e+00 174.813 0.9804 
1 1 1 2   51  5  o 12 2.05818e+01 4.83847e-01 1.83395e+02 292.319 3.45366e+00  -8.41309e+00 0.00000e+00 0.00000e+00 5.43456e+02 292.319 3.60061e+02 292.319 0.9433 
1 1 1 2   51  6  o 15 2.20744e+01 4.76124e-01 4.23732e+02 293.389 1.04321e+01  -2.41202e+01 0.00000e+00 0.00000e+00 3.86601e+02 293.389 3.71313e+01 113.389 0.9808 
1 1 1 2   51  7  o 6  2.40933e+01 5.17466e-01 4.65617e+02 268.845 -7.23958e-01 -3.59120e+01 0.00000e+00 0.00000e+00 4.23229e+02 268.845 4.23881e+01 88.845  0.9860 
1 1 1 2   51  8  o 19 1.06205e+01 5.49426e-01 2.15188e+02 56.880  5.34110e+00  8.18707e+00  0.00000e+00 0.00000e+00 1.61140e+02 56.880  5.40485e+01 236.880 0.9474 
1 1 1 2   51  9  o 4  1.60428e+01 5.84893e-01 1.71991e+02 357.288 1.49170e+01  -7.06464e-01 0.00000e+00 0.00000e+00 4.07339e+02 357.288 2.35349e+02 357.288 0.9659 
1 1 1 2   51  10 o 4  3.84818e+00 9.87011e-01 7.95300e+01 71.648  6.26981e-01  1.89002e+00  0.00000e+00 0.00000e+00 2.06008e+01 71.648  5.89291e+01 251.648 0.6963 
1 1 1 2   51  11 o 15 7.36588e+00 8.67964e-01 1.17976e+02 169.005 -6.94373e+00 1.34906e+00  0.00000e+00 0.00000e+00 1.36850e+02 169.005 1.88738e+01 169.005 0.9263 
1 1 1 2   51  12 o 1  6.68629e+00 1.23101e+00 1.64228e+02 286.626 2.80053e+00  -9.37871e+00 0.00000e+00 0.00000e+00 7.22107e+01 286.626 9.20175e+01 106.626 0.9475 
1 1 1 2   51  13 o 17 6.45035e+00 1.38252e+00 9.91194e+01 194.044 -5.66097e+00 -1.41609e+00 0.00000e+00 0.00000e+00 1.19744e+02 194.044 2.06244e+01 194.044 0.9097 
1 1 1 2   51  14 o 11 9.86889e+00 1.00136e+00 1.47106e+02 241.262 -9.69812e+00 -1.76862e+01 0.00000e+00 0.00000e+00 2.11468e+02 241.262 6.43618e+01 241.262 0.9749 
1 1 1 2   51  15 o 2  1.10647e+01 1.03685e+00 2.13549e+02 178.465 -3.28430e+01 8.79863e-01  0.00000e+00 0.00000e+00 1.92178e+02 178.465 2.13708e+01 358.465 0.9847 
1 1 1 2   51  16 o 3  4.85798e+00 1.37467e+00 1.18748e+02 348.522 7.11739e+00  -1.44524e+00 0.00000e+00 0.00000e+00 4.90555e+01 348.522 6.96922e+01 168.522 0.9284 
1 1 1 2   51  17 o 18 4.72564e+00 1.46193e+00 9.06768e+01 62.589  2.56943e+00  4.95460e+00  0.00000e+00 0.00000e+00 6.83573e+01 62.589  2.23195e+01 242.589 0.9053 
1 1 1 2   51  18 o 17 4.58326e+00 1.46416e+00 9.76604e+01 217.455 -5.36149e+00 -4.10734e+00 0.00000e+00 0.00000e+00 5.93840e+01 217.455 3.82764e+01 37.455  0.9227 
1 1 1 2   52  0  o 17 3.53313e+01 5.29232e-01 6.95932e+02 337.682 4.28891e+01  -1.76056e+01 0.00000e+00 0.00000e+00 6.12740e+02 337.682 8.31917e+01 157.682 0.9892 
1 1 1 2   52  1  f 0  3.57221e+01 5.50640e-01 6.48219e+02 217.870 -3.43191e+01 -2.66883e+01 0.00000e+00 0.00000e+00 6.74025e+02 217.870 2.58058e+01 217.870 0.9884 
1 1 1 2   52  2  o 9  2.03220e+01 3.95566e-01 4.31434e+02 335.117 1.36435e+01  -6.32807e+00 0.00000e+00 0.00000e+00 3.03821e+02 335.117 1.27614e+02 155.117 0.9662 
1 1 1 2   52  3  o 13 5.28991e+01 8.79187e-01 9.20371e+02 285.246 2.63321e+01  -9.66131e+01 0.00000e+00 0.00000e+00 1.05051e+03 285.246 1.30140e+02 285.246 0.9950 
1 1 1 2   52  4  f 0  1.70030e+01 4.15129e-01 2.88230e+02 318.798 8.01650e+00  -7.01850e+00 0.00000e+00 0.00000e+00 3.17707e+02 318.798 2.94767e+01 318.798 0.9518 
1 1 1 2   52  5  o 7  7.24536e+00 5.33232e-01 1.80010e+02 61.078  1.68607e+00  3.05152e+00  0.00000e+00 0.00000e+00 4.79134e+01 61.078  1.32097e+02 241.078 0.8404 
1 1 1 2   52  6  o 6  1.60706e+01 4.47900e-01 1.78262e+02 175.418 -8.65125e+00 6.93392e-01  0.00000e+00 0.00000e+00 3.87361e+02 175.418 2.09099e+02 175.418 0.9405 
1 1 1 2   52  7  o 16 3.64957e+01 6.41491e-01 5.05266e+02 18.152  5.72443e+01  1.87680e+01  0.00000e+00 0.00000e+00 8.48700e+02 18.152  3.43434e+02 18.152  0.9917 
1 1 1 2   52  8  o 16 1.37296e+01 5.80810e-01 2.64959e+02 89.199  2.22898e-01  1.59464e+01  0.00000e+00 0.00000e+00 2.32120e+02 89.199  3.28387e+01 269.199 0.9681 
1 1 1 2   52  9  o 16 2.17658e+01 5.43339e-01 3.72082e+02 232.975 -2.91314e+01 -3.86241e+01 0.00000e+00 0.00000e+00 4.33085e+02 232.975 6.10032e+01 232.975 0.9896 
1 1 1 2   52  10 o 9  9.38133e+00 7.30899e-01 2.16539e+02 248.569 -5.36650e+00 -1.36721e+01 0.00000e+00 0.00000e+00 1.21815e+02 248.569 9.47241e+01 68.569  0.9653 
1 1 1 2   52  11 o 9  1.21945e+01 7.23251e-01 2.06231e+02 36.132  1.79725e+01  1.31210e+01  0.00000e+00 0.00000e+00 2.38771e+02 36.132  3.25407e+01 36.132  0.9773 
1 1 1 2   52  12 o 19 1.29497e+01 8.75690e-01 2.09857e+02 186.195 -2.65621e+01 -2.88331e+00 0.00000e+00 0.00000e+00 2.64266e+02 186.195 5.44096e+01 186.195 0.9811 
1 1 1 2   52  13 o 19 8.18424e+00 1.33641e+00 1.95286e+02 2.906   1.54703e+01  7.85314e-01  0.00000e+00 0.00000e+00 9.99007e+01 2.906   9.53854e+01 182.906 0.9672 
1 1 1 2   52  14 o 10 5.58554e+00 1.15405e+00 6.30388e+01 129.952 -2.83456e+00 3.38386e+00  0.00000e+00 0.00000e+00 1.19659e+02 129.952 5.66205e+01 129.952 0.8778 
1 1 1 2   52  15 o 10 3.54131e+00 1.12273e+00 3.72364e+01 208.645 -1.64034e+00 -8.96033e-01 0.00000e+00 0.00000e+00 5.17771e+01 208.645 1.45406e+01 208.645 0.6751 
1 1 1 2   52  16 o 9  3.58662e+00 1.16609e+00 8.35910e+01 285.786 1.13954e+00  -4.03078e+00 0.00000e+00 0.00000e+00 3.25476e+01 285.786 5.10434e+01 105.786 0.8704 
1 1 1 2   52  17 o 7  4.58030e+00 1.40099e+00 8.54934e+01 230.377 -3.57182e+00 -4.31408e+00 0.00000e+00 0.00000e+00 6.86883e+01 230.377 1.68050e+01 50.377  0.9057 
1 1 1 2   52  18 o 10 3.74217e+00 1.27236e+00 6.64303e+01 94.347  -3.30513e-01 4.34799e+00  0.00000e+00 0.00000e+00 5.53022e+01 94.347  1.11281e+01 274.347 0.8761 
1 1 1 2   53  0  o 7  3.97689e+01 5.82574e-01 7.72497e+02 60.761  2.61975e+01  4.68007e+01  0.00000e+00 0.00000e+00 7.02530e+02 60.761  6.99669e+01 240.761 0.9906 
1 1 1 2   53  1  o 4  3.96185e+01 5.99723e-01 6.10511e+02 248.664 -1.49944e+01 -3.83878e+01 0.00000e+00 0.00000e+00 8.54796e+02 248.664 2.44286e+02 248.664 0.9878 
1 1 1 2   53  2  o 1  3.45010e+01 5.42827e-01 7.02726e+02 223.908 -2.99216e+01 -2.88019e+01 0.00000e+00 0.00000e+00 5.73415e+02 223.908 1.29311e+02 43.908  0.9879 
1 1 1 2   53  3  o 9  2.18774e+01 5.37624e-01 2.95647e+02 192.753 -1.31508e+01 -2.97635e+00 0.00000e+00 0.00000e+00 4.92447e+02 192.753 1.96800e+02 192.753 0.9622 
1 1 1 2   53  4  o 19 3.31089e+01 5.69503e-01 5.03537e+02 52.261  2.49093e+01  3.21835e+01  0.00000e+00 0.00000e+00 7.20554e+02 52.261  2.17017e+02 52.261  0.9876 
1 1 1 2   53  5  o 16 3.44858e+01 6.47829e-01 5.62716e+02 245.452 -2.08768e+01 -4.57087e+01 0.00000e+00 0.00000e+00 7.15082e+02 245.452 1.52367e+02 245.452 0.9900 
1 1 1 2   53  6  o 9  1.69635e+01 4.56646e-01 2.72365e+02 175.453 -1.32337e+01 1.05248e+00  0.00000e+00 0.00000e+00 3.37975e+02 175.453 6.56103e+01 175.453 0.9616 
1 1 1 2   53  7  o 3  4.80176e+01 7.87028e-01 7.98146e+02 22.443  1.22980e+02  5.07976e+01  0.00000e+00 0.00000e+00 9.91225e+02 22.443  1.93080e+02 22.443  0.9962 
1 1 1 2   53  8  o 15 5.15724e+00 7.97133e-01 1.02144e+02 129.304 -1.48922e+00 1.81923e+00  0.00000e+00 0.00000e+00 4.20549e+01 129.304 6.00892e+01 309.304 0.7478 
1 1 1 2   53  9  o 5  1.06872e+01 6.45816e-01 1.62125e+02 270.225 3.87385e-02  -9.88068e+00 0.00000e+00 0.00000e+00 2.16526e+02 270.225 5.44002e+01 270.225 0.9480 
1 1 1 2   53  10 o 1  1.44284e+01 6.47173e-01 2.21867e+02 98.394  -3.38729e+00 2.29542e+01  0.00000e+00 0.00000e+00 3.05380e+02 98.394  8.35128e+01 98.394  0.9782 
1 1 1 2   53  11 o 9  3.21920e+00 9.05657e-01 1.06225e+02 217.756 -2.27817e+00 -1.76430e+00 0.00000e+00 0.00000e+00 9.97347e+00 37.756  1.16199e+02 37.756  0.8008 
1 1 1 2   53  12 o 14 5.82867e+00 1.24561e+00 1.02577e+02 145.308 -4.41381e+00 3.05531e+00  0.00000e+00 0.00000e+00 9.34332e+01 145.308 9.14368e+00 325.308 0.9013 
1 1 1 2   53  13 o 15 4.38001e+00 1.20237e+00 1.14235e+02 58.656  2.83496e+00  4.65463e+00  0.00000e+00 0.00000e+00 3.32189e+01 58.656  8.10161e+01 238.656 0.9029 
1 1 1 2   53  14 o 6  1.18822e+01 8.85630e-01 1.50523e+02 187.868 -2.55943e+01 -3.53693e+00 0.00000e+00 0.00000e+00 2.83543e+02 187.868 1.33020e+02 187.868 0.9805 
1 1 1 2   53  15 o 8  8.56656e+00 1.26515e+00 1.44407e+02 158.473 -1.49134e+01 5.88271e+00  0.00000e+00 0.00000e+00 1.64406e+02 158.473 1.99984e+01 158.473 0.9683 
1 1 1 2   53  16 o 6  6.46012e+00 1.46449e+00 1.32773e+02 277.333 1.32056e+00  -1.02614e+01 0.00000e+00 0.00000e+00 9.55976e+01 277.333 3.71753e+01 97.333  0.9504 
1 1 1 2   53  17 o 3  6.94208e+00 1.66494e+00 9.37712e+01 107.766 -2.32441e+00 7.25447e+00  0.00000e+00 0.00000e+00 1.46630e+02 107.766 5.28586e+01 107.766 0.9318 
1 1 1 2   53  18 o 9  3.14332e+00 1.10174e+00 1.28308e+01 102.552 -1.75662e-01 7.88954e-01  0.00000e+00 0.00000e+00 3.08568e+01 102.552 1.80260e+01 102.552 0.3744 
1 1 1 2   54  0  o 8  1.86878e+01 3.61599e-01 1.28487e+02 237.588 -2.19633e+00 -3.45924e+00 0.00000e+00 0.00000e+00 4.78171e+02 237.588 3.49684e+02 237.588 0.8672 
1 1 1 2   54  1  o 6  2.74733e+01 4.79816e-01 4.25532e+02 4.987   1.99868e+01  1.74406e+00  0.00000e+00 0.00000e+00 5.77019e+02 4.987   1.51487e+02 4.987   0.9748 
1 1 1 2   54  2  o 10 2.24030e+01 4.17667e-01 4.08334e+02 149.937 -1.66144e+01 9.61665e+00  0.00000e+00 0.00000e+00 4.08213e+02 149.937 1.20732e-01 329.937 0.9736 
1 1 1 2   54  3  o 12 2.30711e+01 4.85825e-01 4.69738e+02 311.703 1.56495e+01  -1.75627e+01 0.00000e+00 0.00000e+00 3.75345e+02 311.703 9.43935e+01 131.703 0.9785 
1 1 1 2   54  4  o 4  3.88579e+01 6.44099e-01 7.08222e+02 38.445  5.14526e+01  4.08469e+01  0.00000e+00 0.00000e+00 7.35076e+02 38.445  2.68533e+01 38.445  0.9924 
1 1 1 2   54  5  o 14 1.75063e+01 5.37253e-01 1.85965e+02 172.580 -8.82893e+00 1.14974e+00  0.00000e+00 0.00000e+00 4.31182e+02 172.580 2.45217e+02 172.580 0.9420 
1 1 1 2   54  6  o 4  1.69597e+01 4.69416e-01 3.20594e+02 301.264 8.80391e+00  -1.45002e+01 0.00000e+00 0.00000e+00 2.94908e+02 301.264 2.56860e+01 121.264 0.9701 
1 1 1 2   54  7  o 14 1.94171e+01 5.08277e-01 3.52380e+02 190.913 -2.63891e+01 -5.08814e+00 0.00000e+00 0.00000e+00 3.60185e+02 190.913 7.80530e+00 190.913 0.9812 
1 1 1 2   54  8  o 8  2.27429e+01 5.27718e-01 2.94306e+02 103.791 -7.73450e+00 3.15110e+01  0.00000e+00 0.00000e+00 5.42758e+02 103.791 2.48453e+02 103.791 0.9845 
1 1 1 2   54  9  o 15 8.97772e+00 7.02381e-01 7.38253e+01 125.699 -2.32520e+00 3.23593e+00  0.00000e+00 0.00000e+00 2.15684e+02 125.699 1.41859e+02 125.699 0.8629 
1 1 1 2   54  10 o 16 3.19322e+00 9.08187e-01 3.96430e+01 337.036 8.41226e-01  -3.56460e-01 0.00000e+00 0.00000e+00 9.84833e+00 337.036 2.97947e+01 157.036 0.4150 
1 1 1 2   54  11 o 8  4.81426e+00 1.17550e+00 1.34158e+02 253.376 -1.49716e+00 -5.01462e+00 0.00000e+00 0.00000e+00 2.73228e+01 253.376 1.06835e+02 73.377  0.8985 
1 1 1 2   54  12 o 2  1.66168e+01 8.73411e-01 2.74260e+02 36.271  3.86374e+01  2.83519e+01  0.00000e+00 0.00000e+00 3.39160e+02 36.271  6.49002e+01 36.271  0.9895 
1 1 1 2   54  13 o 12 7.07452e+00 1.04969e+00 9.14220e+01 209.270 -6.63365e+00 -3.71804e+00 0.00000e+00 0.00000e+00 1.54317e+02 209.270 6.28953e+01 209.270 0.9317 
1 1 1 2   54  14 o 14 4.58124e+00 1.12850e+00 5.04599e+01 220.655 -2.22222e+00 -1.90839e+00 0.00000e+00 0.00000e+00 8.68615e+01 220.655 3.64016e+01 220.655 0.8046 
1 1 1 2   54  15 o 1  5.36280e+00 1.32727e+00 9.75839e+01 47.082  4.51624e+00  4.85708e+00  0.00000e+00 0.00000e+00 8.63054e+01 47.082  1.12785e+01 227.082 0.9212 
1 1 1 2   54  16 o 3  6.56563e+00 1.48928e+00 7.74807e+01 69.259  2.16312e+00  5.71217e+00  0.00000e+00 0.00000e+00 1.45706e+02 69.259  6.82256e+01 69.259  0.9140 
1 1 1 2   54  17 o 13 5.72246e+00 1.56962e+00 6.96714e+01 302.807 2.68570e+00  -4.16628e+00 0.00000e+00 0.00000e+00 1.20073e+02 302.807 5.04021e+01 302.807 0.8924 
1 1 1 2   55  0  o 3  2.18197e+01 3.92271e-01 4.09987e+02 55.373  1.06994e+01  1.54942e+01  0.00000e+00 0.00000e+00 3.84724e+02 55.373  2.52624e+01 235.373 0.9731 
1 1 1 2   55  1  o 18 2.64322e+01 4.38750e-01 3.14326e+02 17.197  1.66359e+01  5.14869e+00  0.00000e+00 0.00000e+00 6.46229e+02 17.197  3.31903e+02 17.197  0.9708 
1 1 1 2   55  2  o 13 2.01379e+01 4.01166e-01 4.79556e+02 126.416 -1.19737e+01 1.62315e+01  0.00000e+00 0.00000e+00 2.55295e+02 126.416 2.24262e+02 306.416 0.9749 
1 1 1 2   55  3  o 17 1.79262e+01 4.00181e-01 2.61572e+02 106.987 -3.04263e+00 9.96028e+00  0.00000e+00 0.00000e+00 3.76303e+02 106.987 1.14731e+02 106.987 0.9507 
1 1 1 2   55  4  o 19 1.22568e+01 4.49660e-01 7.53906e+01 131.826 -1.65152e+00 1.84540e+00  0.00000e+00 0.00000e+00 2.74321e+02 131.826 1.98931e+02 131.826 0.7624 
1 1 1 2   55  5  o 2  1.25909e+01 5.37360e-01 3.20172e+02 189.678 -1.20035e+01 -2.04705e+00 0.00000e+00 0.00000e+00 1.31152e+02 189.678 1.89020e+02 9.678   0.9580 
1 1 1 2   55  6  o 12 3.76485e+01 6.47233e-01 6.39681e+02 169.415 -7.50874e+01 1.40323e+01  0.00000e+00 0.00000e+00 7.59371e+02 169.415 1.19691e+02 169.415 0.9934 
1 1 1 2   55  7  o 15 1.45946e+01 4.82190e-01 3.35783e+02 104.164 -5.17851e+00 2.05188e+01  0.00000e+00 0.00000e+00 1.96924e+02 104.164 1.38859e+02 284.164 0.9761 
1 1 1 2   55  8  o 10 4.59775e+00 8.53238e-01 1.68223e+02 93.484  -2.29363e-01 3.76684e+00  0.00000e+00 0.00000e+00 2.14104e+01 273.484 1.89633e+02 273.484 0.8542 
1 1 1 2   55  9  o 12 1.69885e+01 5.93451e-01 2.56755e+02 285.741 7.35840e+00  -2.61059e+01 0.00000e+00 0.00000e+00 3.66192e+02 285.741 1.09437e+02 285.741 0.9814 
1 1 1 2   55  10 o 6  2.05129e+01 6.34597e-01 2.81927e+02 268.599 -1.16873e+00 -4.77773e+01 0.00000e+00 0.00000e+00 4.76079e+02 268.599 1.94152e+02 268.599 0.9895 
1 1 1 2   55  11 o 19 5.70475e+00 1.14691e+00 1.42758e+02 239.608 -3.40314e+00 -5.80229e+00 0.00000e+00 0.00000e+00 5.36343e+01 239.608 8.91240e+01 59.608  0.9223 
1 1 1 2   55  12 o 6  8.74300e+00 1.13223e+00 1.14667e+02 67.319  3.83937e+00  9.18670e+00  0.00000e+00 0.00000e+00 1.94620e+02 67.319  7.99527e+01 67.319  0.9484 
1 1 1 2   55  13 o 18 4.66000e+00 1.08359e+00 1.08324e+02 244.729 -2.57213e+00 -5.44848e+00 0.00000e+00 0.00000e+00 5.02255e+01 244.729 5.80981e+01 64.729  0.9127 
1 1 1 2   55  14 o 15 9.61639e+00 1.07049e+00 1.29614e+02 130.463 -1.06260e+01 1.24578e+01  0.00000e+00 0.00000e+00 2.17463e+02 130.463 8.78489e+01 130.463 0.9690 
1 1 1 2   55  15 o 5  8.52559e+00 1.23470e+00 1.63204e+02 39.995  1.46187e+01  1.22644e+01  0.00000e+00 0.00000e+00 1.45673e+02 39.995  1.75317e+01 219.995 0.9734 
1 1 1 2   55  16 o 4  4.96832e+00 1.37876e+00 8.94045e+01 160.541 -5.46698e+00 1.93152e+00  0.00000e+00 0.00000e+00 7.85537e+01 160.541 1.08508e+01 340.541 0.9091 
1 1 1 2   55  17 o 1  7.01793e+00 1.59908e+00 7.93547e+01 309.690 4.35213e+00  -5.24404e+00 0.00000e+00 0.00000e+00 1.61400e+02 309.690 8.20458e+01 309.690 0.9234 
1 1 1 2   56  0  o 17 2.03088e+01 3.79385e-01 6.02340e+02 219.702 -1.97055e+01 -1.63611e+01 0.00000e+00 0.00000e+00 1.42705e+02 219.702 4.59635e+02 39.702  0.9803 
1 1 1 2   56  1  o 14 8.58631e+00 3.84676e-01 5.81308e+01 308.246 6.75068e-01  -8.56429e-01 0.00000e+00 0.00000e+00 9.53260e+01 308.246 3.71952e+01 308.246 0.4775 
1 1 1 2   56  2  o 8  2.50782e+01 4.44688e-01 4.59422e+02 167.370 -2.50048e+01 5.60309e+00  0.00000e+00 0.00000e+00 4.60639e+02 167.370 1.21747e+00 167.370 0.9803 
1 1 1 2   56  3  o 15 1.34018e+01 3.89676e-01 1.85708e+02 219.699 -4.62705e+00 -3.84135e+00 0.00000e+00 0.00000e+00 2.71974e+02 219.699 8.62664e+01 219.699 0.9126 
1 1 1 2   56  4  o 14 8.76735e+00 4.54338e-01 1.81034e+02 222.228 -3.07109e+00 -2.78742e+00 0.00000e+00 0.00000e+00 1.04032e+02 222.228 7.70014e+01 42.228  0.8690 
1 1 1 2   56  5  o 9  8.34485e+00 6.25909e-01 1.80841e+02 236.880 -2.34993e+00 -3.60198e+00 0.00000e+00 0.00000e+00 9.20601e+01 236.880 8.87804e+01 56.880  0.8742 
1 1 1 2   56  6  o 15 1.80563e+01 4.66487e-01 3.59397e+02 171.577 -2.12058e+01 3.14024e+00  0.00000e+00 0.00000e+00 2.99980e+02 171.577 5.94166e+01 351.577 0.9764 
1 1 1 2   56  7  o 4  6.79535e+00 6.68028e-01 9.76902e+01 241.805 -1.32237e+00 -2.46677e+00 0.00000e+00 0.00000e+00 1.04027e+02 241.805 6.33729e+00 241.805 0.7939 
1 1 1 2   56  8  o 4  2.11950e+01 5.88908e-01 3.31834e+02 73.614  1.07373e+01  3.65160e+01  0.00000e+00 0.00000e+00 4.49850e+02 73.614  1.18016e+02 73.614  0.9868 
1 1 1 2   56  9  o 17 5.92598e+00 8.80279e-01 6.41450e+01 5.791   2.44438e+00  2.47898e-01  0.00000e+00 0.00000e+00 1.04159e+02 5.791   4.00137e+01 5.791   0.7602 
1 1 1 2   56  10 o 7  3.50946e+00 9.26460e-01 1.60671e+02 321.198 3.48867e+00  -2.80519e+00 0.00000e+00 0.00000e+00 4.54013e+01 141.198 2.06073e+02 141.198 0.8796 
1 1 1 2   56  11 o 7  1.26626e+01 7.97854e-01 2.35506e+02 71.877  9.45223e+00  2.88792e+01  0.00000e+00 0.00000e+00 2.29206e+02 71.877  6.29955e+00 251.877 0.9834 
1 1 1 2   56  12 o 5  5.86124e+00 1.10132e+00 7.44691e+01 193.571 -4.46583e+00 -1.07797e+00 0.00000e+00 0.00000e+00 1.18561e+02 193.571 4.40917e+01 193.571 0.8830 
1 1 1 2   56  13 o 14 9.48919e+00 8.59251e-01 1.43263e+02 54.112  1.03635e+01  1.43228e+01  0.00000e+00 0.00000e+00 2.00248e+02 54.112  5.69842e+01 54.112  0.9713 
1 1 1 2   56  14 o 19 6.24452e+00 1.22927e+00 6.81806e+01 60.526  2.60844e+00  4.61536e+00  0.00000e+00 0.00000e+00 1.41109e+02 60.526  7.29287e+01 60.526  0.8999 
1 1 1 2   56  15 o 18 3.70496e+00 1.15442e+00 8.32005e+01 239.063 -2.37009e+00 -3.95435e+00 0.00000e+00 0.00000e+00 3.86060e+01 239.063 4.45944e+01 59.063  0.8835 
1 1 1 2   56  16 o 4  6.57433e+00 1.49668e+00 1.32964e+02 359.705 1.07654e+01  -5.54660e-02 0.00000e+00 0.00000e+00 9.98255e+01 359.705 3.31387e+01 179.705 0.9524 
1 1 1 2   56  17 o 5  4.93429e+00 1.46874e+00 1.01119e+02 118.622 -3.33623e+00 6.11345e+00  0.00000e+00 0.00000e+00 6.84465e+01 118.622 3.26729e+01 298.622 0.9251 
1 1 1 2   57  0  o 16 1.06267e+01 3.40345e-01 2.11578e+02 102.595 -1.06763e+00 4.77819e+00  0.00000e+00 0.00000e+00 1.42677e+02 102.595 6.89014e+01 282.595 0.8909 
1 1 1 2   57  1  o 1  3.42143e+01 5.24788e-01 5.19508e+02 84.714  3.62800e+00  3.92130e+01  0.00000e+00 0.00000e+00 7.44428e+02 84.714  2.24920e+02 84.714  0.9872 
1 1 1 2   57  2  o 17 3.29246e+01 5.29930e-01 5.02866e+02 152.744 -3.58954e+01 1.84923e+01  0.00000e+00 0.00000e+00 7.13806e+02 152.744 2.10940e+02 152.744 0.9875 
1 1 1 2   57  3  o 9  1.34398e+01 3.91449e-01 1.81474e+02 198.430 -6.21758e+00 -2.07191e+00 0.00000e+00 0.00000e+00 2.81262e+02 198.430 9.97871e+01 198.430 0.9202 
1 1 1 2   57  4  o 16 9.09935e+00 5.06199e-01 1.89272e+02 220.685 -3.66275e+00 -3.14878e+00 0.00000e+00 0.00000e+00 1.13463e+02 220.685 7.58093e+01 40.685  0.8893 
1 1 1 2   57  5  o 2  3.19460e+01 6.87978e-01 4.63731e+02 324.332 3.82197e+01  -2.74309e+01 0.00000e+00 0.00000e+00 7.18427e+02 324.332 2.54696e+02 324.332 0.9893 
1 1 1 2   57  6  o 16 2.64724e+01 5.31533e-01 4.52241e+02 142.354 -3.27653e+01 2.52743e+01  0.00000e+00 0.00000e+00 5.25659e+02 142.354 7.34185e+01 142.354 0.9878 
1 1 1 2   57  7  o 11 2.28205e+01 6.06536e-01 3.69035e+02 318.410 2.74609e+01  -2.43722e+01 0.00000e+00 0.00000e+00 4.72369e+02 318.410 1.03334e+02 318.410 0.9863 
1 1 1 2   57  8  o 18 1.22551e+01 5.89956e-01 2.19707e+02 231.158 -1.00271e+01 -1.24524e+01 0.00000e+00 0.00000e+00 2.23692e+02 231.158 3.98505e+00 231.158 0.9682 
1 1 1 2   57  9  o 1  9.92882e+00 6.60277e-01 1.65826e+02 286.103 3.35511e+00  -1.16220e+01 0.00000e+00 0.00000e+00 1.89366e+02 286.103 2.35403e+01 286.103 0.9577 
1 1 1 2   57  10 o 9  1.48896e+01 7.26231e-01 2.89451e+02 74.710  9.58730e+00  3.50689e+01  0.00000e+00 0.00000e+00 2.58737e+02 74.710  3.07143e+01 254.710 0.9861 
1 1 1 2   57  11 o 18 6.99946e+00 1.08500e+00 1.61835e+02 233.779 -6.08036e+00 -8.30124e+00 0.00000e+00 0.00000e+00 8.63011e+01 233.779 7.55343e+01 53.779  0.9501 
1 1 1 2   57  12 o 13 9.48619e+00 7.81367e-01 1.58267e+02 181.220 -1.86519e+01 -3.97122e-01 0.00000e+00 0.00000e+00 1.85857e+02 181.220 2.75905e+01 181.220 0.9728 
1 1 1 2   57  13 o 17 4.14809e+00 1.09124e+00 3.98396e+01 246.889 -7.97156e-01 -1.86792e+00 0.00000e+00 0.00000e+00 6.87941e+01 246.889 2.89545e+01 246.889 0.7028 
1 1 1 2   57  14 o 8  1.08615e+01 9.83281e-01 1.69131e+02 91.576  -6.75098e-01 2.45313e+01  0.00000e+00 0.00000e+00 2.26987e+02 91.576  5.78564e+01 91.576  0.9794 
1 1 1 2   57  15 f 0  3.36202e+00 1.07469e+00 6.70165e+01 94.330  -2.53666e-01 3.35025e+00  0.00000e+00 0.00000e+00 3.72375e+01 94.330  2.97790e+01 274.330 0.8334 
1 1 1 2   57  16 o 5  3.99345e+00 1.26365e+00 1.84968e+02 28.413  9.71130e+00  5.25379e+00  0.00000e+00 0.00000e+00 4.34046e+01 208.413 2.28372e+02 208.413 0.9536 
1 1 1 2   57  17 o 14 3.86098e+00 1.26562e+00 4.12583e+01 226.264 -1.88473e+00 -1.96977e+00 0.00000e+00 0.00000e+00 7.16689e+01 226.264 3.04106e+01 226.264 0.7875 
1 1 1 2   58  0  o 15 1.64789e+01 3.59928e-01 2.96065e+02 301.718 6.30927e+00  -1.02082e+01 0.00000e+00 0.00000e+00 2.94172e+02 301.718 1.89323e+00 121.719 0.9574 
1 1 1 2   58  1  o 17 3.81763e+01 5.71563e-01 6.02970e+02 185.947 -5.56761e+01 -5.79971e+00 0.00000e+00 0.00000e+00 8.12545e+02 185.947 2.09575e+02 185.947 0.9910 
1 1 1 2   58  2  o 9  4.44465e+01 6.67927e-01 8.89555e+02 345.965 9.12071e+01  -2.28001e+01 0.00000e+00 0.00000e+00 7.64484e+02 345.965 1.25071e+02 165.965 0.9947 
1 1 1 2   58  3  o 4  3.17725e+01 5.28336e-01 5.64557e+02 325.582 3.85260e+01  -2.63975e+01 0.00000e+00 0.00000e+00 6.11286e+02 325.582 4.67290e+01 325.582 0.9892 
1 1 1 2   58  4  o 18 3.32403e+01 5.52634e-01 5.32346e+02 94.091  -3.79869e+00 5.31086e+01  0.00000e+00 0.00000e+00 6.99306e+02 94.091  1.66960e+02 94.091  0.9906 
1 1 1 2   58  5  o 5  1.78588e+01 4.95787e-01 2.61983e+02 41.654  1.12136e+01  9.97470e+00  0.00000e+00 0.00000e+00 3.83262e+02 41.654  1.21279e+02 41.654  0.9661 
1 1 1 2   58  6  o 15 2.67575e+01 5.38329e-01 4.24722e+02 215.402 -3.62449e+01 -2.57596e+01 0.00000e+00 0.00000e+00 5.64403e+02 215.402 1.39682e+02 215.402 0.9887 
1 1 1 2   58  7  o 3  2.48614e+01 5.27485e-01 5.67150e+02 44.879  4.84924e+01  4.82885e+01  0.00000e+00 0.00000e+00 3.55287e+02 44.879  2.11863e+02 224.879 0.9927 
1 1 1 2   58  8  o 11 7.68293e+00 8.54086e-01 9.83924e+01 43.533  3.02303e+00  2.87204e+00  0.00000e+00 0.00000e+00 1.51276e+02 43.533  5.28839e+01 43.533  0.8697 
1 1 1 2   58  9  o 8  1.73623e+01 5.99063e-01 2.12931e+02 116.378 -1.22365e+01 2.46744e+01  0.00000e+00 0.00000e+00 4.23614e+02 116.378 2.10682e+02 116.378 0.9817 
1 1 1 2   58  10 o 19 2.22614e+01 7.29812e-01 3.53390e+02 45.980  4.83138e+01  4.99949e+01  0.00000e+00 0.00000e+00 4.71590e+02 45.980  1.18200e+02 45.980  0.9928 
1 1 1 2   58  11 o 5  1.23742e+01 8.32484e-01 2.37762e+02 249.830 -1.04658e+01 -2.84912e+01 0.00000e+00 0.00000e+00 2.16215e+02 249.830 2.15465e+01 69.830  0.9834 
1 1 1 2   58  12 o 9  8.68878e+00 8.42641e-01 1.46625e+02 180.132 -1.46260e+01 -3.37301e-02 0.00000e+00 0.00000e+00 1.66049e+02 180.132 1.94234e+01 180.132 0.9652 
1 1 1 2   58  13 o 18 3.54529e+00 1.06186e+00 5.08751e+01 28.173  1.93991e+00  1.03898e+00  0.00000e+00 0.00000e+00 4.53034e+01 28.173  5.57175e+00 208.173 0.7281 
1 1 1 2   58  14 o 12 1.28827e+01 9.00954e-01 2.23353e+02 80.305  6.99058e+00  4.09201e+01  0.00000e+00 0.00000e+00 2.50469e+02 80.305  2.71156e+01 80.305  0.9879 
1 1 1 2   58  15 o 13 3.96038e+00 1.20996e+00 9.45343e+01 16.409  4.73277e+00  1.39375e+00  0.00000e+00 0.00000e+00 3.68576e+01 16.409  5.76767e+01 196.409 0.8918 
1 1 1 2   58  16 o 8  5.88804e+00 1.50889e+00 9.26266e+01 298.949 3.29970e+00  -5.96546e+00 0.00000e+00 0.00000e+00 1.09467e+02 298.949 1.68402e+01 298.949 0.9234 
1 1 1 2   58  17 o 10 5.20277e+00 1.49013e+00 1.09400e+02 192.428 -8.07378e+00 -1.77931e+00 0.00000e+00 0.00000e+00 7.17089e+01 192.428 3.76909e+01 12.428  0.9374 
1 1 1 2   59  0  o 5  1.72957e+01 3.66287e-01 3.52622e+02 74.945  3.82371e+00  1.42154e+01  0.00000e+00 0.00000e+00 2.71966e+02 74.945  8.06565e+01 254.945 0.9654 
1 1 1 2   59  1  o 6  1.01898e+01 3.65624e-01 1.22546e+02 73.103  9.77869e-01  3.21912e+00  0.00000e+00 0.00000e+00 1.95243e+02 73.103  7.26968e+01 73.103  0.8337 
1 1 1 2   59  2  o 5  4.28025e+00 5.88667e-01 6.46498e+01 170.072 -7.08461e-01 1.24006e-01  0.00000e+00 0.00000e+00 1.04987e+01 350.072 7.51484e+01 350.072 0.3382 
1 1 1 2   59  3  o 1  9.30194e+00 4.28753e-01 2.84310e+01 232.654 -4.51551e-01 -5.91755e-01 0.00000e+00 0.00000e+00 9.28522e+01 232.654 6.44211e+01 232.654 0.3486 
1 1 1 2   59  4  o 10 3.07495e+01 5.27736e-01 5.90158e+02 147.836 -4.95192e+01 3.11405e+01  0.00000e+00 0.00000e+00 5.49998e+02 147.836 4.01599e+01 327.836 0.9914 
1 1 1 2   59  5  f 0  3.20592e+01 5.77683e-01 4.55965e+02 190.824 -4.71129e+01 -9.00788e+00 0.00000e+00 0.00000e+00 7.30250e+02 190.824 2.74285e+02 190.824 0.9895 
1 1 1 2   59  6  o 7  4.05714e+01 6.89344e-01 7.41165e+02 57.315  6.86300e+01  1.06963e+02  0.00000e+00 0.00000e+00 7.69543e+02 57.315  2.83774e+01 57.315  0.9961 
1 1 1 2   59  7  o 17 2.89288e+00 8.38762e-01 1.19478e+02 244.588 -6.75571e-01 -1.42196e+00 0.00000e+00 0.00000e+00 5.31015e+01 64.588  1.72579e+02 64.588  0.6140 
1 1 1 2   59  8  o 9  1.94114e+01 5.77133e-01 3.17752e+02 52.427  2.30010e+01  2.98968e+01  0.00000e+00 0.00000e+00 3.97724e+02 52.427  7.99713e+01 52.427  0.9867 
1 1 1 2   59  9  o 15 2.14834e+01 6.73487e-01 2.16017e+02 11.809  3.26689e+01  6.83022e+00  0.00000e+00 0.00000e+00 5.74080e+02 11.809  3.58063e+02 11.809  0.9849 
1 1 1 2   59  10 o 15 5.00060e+00 1.03755e+00 1.55801e+02 196.861 -6.03820e+00 -1.83008e+00 0.00000e+00 0.00000e+00 1.53256e+01 196.861 1.40475e+02 16.861  0.9169 
1 1 1 2   59  11 o 4  1.88527e+01 6.30515e-01 3.76266e+02 242.030 -3.70926e+01 -6.98490e+01 0.00000e+00 0.00000e+00 3.22503e+02 242.030 5.37630e+01 62.030  0.9937 
1 1 1 2   59  12 o 8  8.78249e+00 8.87280e-01 1.77279e+02 145.870 -1.58475e+01 1.07415e+01  0.00000e+00 0.00000e+00 1.41446e+02 145.870 3.58336e+01 325.870 0.9735 
1 1 1 2   59  13 o 9  1.27978e+01 7.72962e-01 2.57770e+02 265.686 -3.85036e+00 -5.10366e+01 0.00000e+00 0.00000e+00 2.14300e+02 265.686 4.34705e+01 85.686  0.9902 
1 1 1 2   59  14 o 16 1.02153e+01 1.01160e+00 1.51670e+02 50.301  1.47529e+01  1.77708e+01  0.00000e+00 0.00000e+00 2.20266e+02 50.301  6.85962e+01 50.301  0.9781 
1 1 1 2   59  15 o 15 3.25820e+00 1.06146e+00 5.72500e+01 186.550 -2.88083e+00 -3.30769e-01 0.00000e+00 0.00000e+00 3.99786e+01 186.550 1.72715e+01 6.550   0.8023 
1 1 1 2   59  16 o 10 6.61785e+00 1.42587e+00 1.45422e+02 60.564  6.58365e+00  1.16671e+01  0.00000e+00 0.00000e+00 9.11493e+01 60.564  5.42732e+01 240.564 0.9619 
1 1 1 2   59  17 o 13 4.63855e+00 1.40114e+00 5.59743e+01 221.079 -3.12998e+00 -2.72849e+00 0.00000e+00 0.00000e+00 9.37084e+01 221.079 3.77340e+01 221.079 0.8691 
1 1 1 2   60  0  o 17 5.21595e+00 4.95500e-01 1.94650e+02 49.637  1.71860e+00  2.02198e+00  0.00000e+00 0.00000e+00 4.23478e+01 229.637 2.36998e+02 229.637 0.7807 
1 1 1 2   60  1  o 1  3.80708e+01 5.72080e-01 6.56031e+02 275.374 6.08129e+00  -6.46492e+01 0.00000e+00 0.00000e+00 7.56883e+02 275.374 1.00852e+02 275.374 0.9923 
1 1 1 2   60  2  o 14 7.45969e+00 4.43507e-01 2.46446e+02 93.357  -2.95793e-01 5.04200e+00  0.00000e+00 0.00000e+00 3.13596e+00 93.357  2.43310e+02 273.357 0.8945 
1 1 1 2   60  3  o 11 2.58830e+01 4.74227e-01 3.78842e+02 74.867  7.73391e+00  2.85970e+01  0.00000e+00 0.00000e+00 5.72671e+02 74.867  1.93828e+02 74.867  0.9830 
1 1 1 2   60  4  o 16 4.50676e+01 6.91718e-01 7.48889e+02 12.479  1.01079e+02  2.23698e+01  0.00000e+00 0.00000e+00 9.28205e+02 12.479  1.79316e+02 12.479  0.9952 
1 1 1 2   60  5  o 16 2.38635e+01 4.98054e-01 3.49797e+02 295.892 1.29528e+01  -2.66847e+01 0.00000e+00 0.00000e+00 5.27206e+02 295.892 1.77409e+02 295.892 0.9830 
1 1 1 2   60  6  o 18 2.25623e+01 5.03280e-01 3.81369e+02 249.381 -1.33751e+01 -3.55490e+01 0.00000e+00 0.00000e+00 4.50767e+02 249.381 6.93979e+01 249.381 0.9867 
1 1 1 2   60  7  o 2  2.52122e+01 6.02027e-01 3.39665e+02 154.214 -4.16955e+01 2.01438e+01  0.00000e+00 0.00000e+00 5.92166e+02 154.214 2.52501e+02 154.214 0.9891 
1 1 1 2   60  8  o 2  9.77067e+00 5.97706e-01 1.46668e+02 230.887 -5.60984e+00 -6.89965e+00 0.00000e+00 0.00000e+00 1.97100e+02 230.887 5.04324e+01 230.887 0.9420 
1 1 1 2   60  9  o 18 1.50093e+01 6.69445e-01 2.27227e+02 155.898 -2.55861e+01 1.14463e+01  0.00000e+00 0.00000e+00 3.23052e+02 155.898 9.58247e+01 155.898 0.9820 
1 1 1 2   60  10 o 18 7.12118e+00 9.81992e-01 2.42047e+02 285.065 3.87282e+00  -1.43876e+01 0.00000e+00 0.00000e+00 1.46087e+01 285.065 2.27439e+02 105.066 0.9658 
1 1 1 2   60  11 o 16 2.35593e+01 6.35286e-01 4.62892e+02 187.876 -1.12521e+02 -1.55664e+01 0.00000e+00 0.00000e+00 4.11880e+02 187.876 5.10117e+01 7.876   0.9956 
1 1 1 2   60  12 o 1  5.82199e+00 1.03031e+00 9.78207e+01 291.077 2.41970e+00  -6.27835e+00 0.00000e+00 0.00000e+00 1.02330e+02 291.077 4.50970e+00 291.077 0.9224 
1 1 1 2   60  13 o 6  5.83060e+00 1.11058e+00 1.04248e+02 236.249 -4.33034e+00 -6.48047e+00 0.00000e+00 0.00000e+00 9.84685e+01 236.249 5.77985e+00 56.249  0.9335 
1 1 1 2   60  14 o 11 9.86005e+00 1.02057e+00 1.59094e+02 314.679 1.54441e+01  -1.56180e+01 0.00000e+00 0.00000e+00 1.99431e+02 314.679 4.03367e+01 314.679 0.9770 
1 1 1 2   60  15 o 18 6.37893e+00 1.36263e+00 1.15584e+02 52.591  5.68199e+00  7.42933e+00  0.00000e+00 0.00000e+00 1.08575e+02 52.591  7.00918e+00 232.591 0.9449 
1 1 1 2   60  16 o 5  6.88146e+00 1.54428e+00 8.86096e+01 138.241 -5.61710e+00 5.01502e+00  0.00000e+00 0.00000e+00 1.49443e+02 138.241 6.08333e+01 138.241 0.9310 
1 1 1 2   60  17 f 0  8.74761e+00 1.61696e+00 1.47365e+02 77.080  3.68404e+00  1.60591e+01  0.00000e+00 0.00000e+00 1.67351e+02 77.080  1.99858e+01 77.080  0.9692 
1 1 1 2   61  0  o 19 1.66050e+01 3.70184e-01 3.58568e+02 134.934 -1.15976e+01 1.16241e+01  0.00000e+00 0.00000e+00 2.43141e+02 134.934 1.15427e+02 314.934 0.9691 
1 1 1 2   61  1  o 18 2.49312e+01 4.32877e-01 3.78651e+02 293.133 1.01854e+01  -2.38413e+01 0.00000e+00 0.00000e+00 5.35509e+02 293.133 1.56858e+02 293.133 0.9805 
1 1 1 2   61  2  o 15 5.07983e+00 5.96511e-01 1.60209e+02 127.717 -1.49712e+00 1.93584e+00  0.00000e+00 0.00000e+00 1.60030e+01 307.717 1.76212e+02 307.717 0.7591 
1 1 1 2   61  3  o 16 3.88791e+01 6.12611e-01 6.78155e+02 59.771  4.25119e+01  7.29575e+01  0.00000e+00 0.00000e+00 7.67002e+02 59.771  8.88468e+01 59.771  0.9941 
1 1 1 2   61  4  o 15 4.42775e+01 6.82350e-01 6.99623e+02 191.091 -9.58609e+01 -1.87909e+01 0.00000e+00 0.00000e+00 9.47311e+02 191.091 2.47688e+02 191.091 0.9949 
1 1 1 2   61  5  o 12 9.78389e+00 6.34768e-01 1.11763e+02 286.556 1.20892e+00  -4.06675e+00 0.00000e+00 0.00000e+00 2.07238e+02 286.556 9.54750e+01 286.556 0.8722 
1 1 1 2   61  6  o 17 5.46034e+00 7.58709e-01 1.17933e+02 240.449 -1.42337e+00 -2.51062e+00 0.00000e+00 0.00000e+00 4.55563e+01 240.449 7.23767e+01 60.449  0.8012 
1 1 1 2   61  7  o 17 1.00358e+01 5.92598e-01 2.16459e+02 239.616 -6.52408e+00 -1.11272e+01 0.00000e+00 0.00000e+00 1.43626e+02 239.616 7.28331e+01 59.616  0.9604 
1 1 1 2   61  8  o 11 1.94644e+01 5.73970e-01 4.02623e+02 227.412 -3.74771e+01 -4.07733e+01 0.00000e+00 0.00000e+00 3.17681e+02 227.412 8.49424e+01 47.412  0.9909 
1 1 1 2   61  9  o 13 1.53516e+01 6.60001e-01 2.38078e+02 223.504 -2.05672e+01 -1.95202e+01 0.00000e+00 0.00000e+00 3.24777e+02 223.504 8.66997e+01 223.504 0.9822 
1 1 1 2   61  10 o 19 1.55374e+01 7.23092e-01 3.01455e+02 77.604  9.47822e+00  4.31242e+01  0.00000e+00 0.00000e+00 2.71642e+02 77.604  2.98133e+01 257.604 0.9886 
1 1 1 2   61  11 o 9  5.76592e+00 9.13187e-01 1.40500e+02 191.618 -8.21202e+00 -1.68832e+00 0.00000e+00 0.00000e+00 6.12427e+01 191.618 7.92572e+01 11.618  0.9383 
1 1 1 2   61  12 o 15 7.01243e+00 9.64749e-01 1.61173e+02 45.503  9.67377e+00  9.84527e+00  0.00000e+00 0.00000e+00 9.04985e+01 45.503  7.06744e+01 225.503 0.9631 
1 1 1 2   61  13 o 9  6.53821e+00 1.10936e+00 1.88513e+02 268.024 -5.44500e-01 -1.57820e+01 0.00000e+00 0.00000e+00 4.71317e+01 268.024 1.41381e+02 88.024  0.9678 
1 1 1 2   61  14 o 4  7.80527e+00 1.19763e+00 1.26639e+02 269.784 -5.02677e-02 -1.33479e+01 0.00000e+00 0.00000e+00 1.52714e+02 269.784 2.60757e+01 269.784 0.9618 
1 1 1 2   61  15 o 5  8.50309e+00 1.29908e+00 1.23516e+02 57.637  7.23335e+00  1.14144e+01  0.00000e+00 0.00000e+00 1.80718e+02 57.637  5.72012e+01 57.637  0.9623 
1 1 1 2   61  16 o 11 8.97875e+00 1.46704e+00 1.29409e+02 89.198  2.21621e-01  1.58302e+01  0.00000e+00 0.00000e+00 1.93442e+02 89.198  6.40330e+01 89.198  0.9679 
1 1 1 2   61  17 o 13 3.69184e+00 1.21408e+00 7.04884e+01 292.439 1.84506e+00  -4.46779e+00 0.00000e+00 0.00000e+00 5.13801e+01 292.439 1.91084e+01 112.439 0.8894 
1 1 1 2   62  0  o 15 2.71310e+01 4.54843e-01 5.37552e+02 271.356 9.67239e-01  -4.08701e+01 0.00000e+00 0.00000e+00 4.64326e+02 271.356 7.32253e+01 91.356  0.9877 
1 1 1 2   62  1  o 16 1.80445e+01 3.84068e-01 1.49765e+02 51.642  5.09603e+00  6.43934e+00  0.00000e+00 0.00000e+00 4.82385e+02 51.642  3.32619e+02 51.642  0.9370 
1 1 1 2   62  2  o 2  3.47961e+01 5.60154e-01 4.46950e+02 352.938 4.41055e+01  -5.46395e+00 0.00000e+00 0.00000e+00 8.39322e+02 352.938 3.92372e+02 352.938 0.9887 
1 1 1 2   62  3  o 3  2.75751e+01 4.90848e-01 3.12345e+02 172.456 -2.65290e+01 3.51312e+00  0.00000e+00 0.00000e+00 6.99136e+02 172.456 3.86791e+02 172.456 0.9811 
1 1 1 2   62  4  o 14 2.06543e+01 4.54728e-01 3.74660e+02 20.493  2.58993e+01  9.67982e+00  0.00000e+00 0.00000e+00 3.83331e+02 20.493  8.67164e+00 20.493  0.9817 
1 1 1 2   62  5  o 7  2.27677e+01 4.95280e-01 3.73596e+02 337.606 3.38356e+01  -1.39419e+01 0.00000e+00 0.00000e+00 4.65617e+02 337.606 9.20205e+01 337.606 0.9862 
1 1 1 2   62  6  o 1  3.39789e+01 7.02214e-01 6.46302e+02 216.061 -8.25863e+01 -6.01376e+01 0.00000e+00 0.00000e+00 6.17073e+02 216.061 2.92284e+01 36.061  0.9951 
1 1 1 2   62  7  o 15 3.01763e+01 6.61442e-01 5.73729e+02 130.524 -6.39729e+01 7.48378e+01  0.00000e+00 0.00000e+00 5.47698e+02 130.524 2.60317e+01 310.524 0.9949 
1 1 1 2   62  8  o 9  6.88766e+00 8.32402e-01 2.44124e+02 39.631  9.16956e+00  7.59418e+00  0.00000e+00 0.00000e+00 2.00266e+00 39.631  2.42121e+02 219.631 0.9570 
1 1 1 2   62  9  o 11 1.78228e+01 6.52030e-01 2.89872e+02 165.353 -4.28703e+01 1.12044e+01  0.00000e+00 0.00000e+00 3.67767e+02 165.353 7.78948e+01 165.353 0.9887 
1 1 1 2   62  10 o 6  2.75728e+00 8.31991e-01 6.87833e+01 227.995 -1.27797e+00 -1.41909e+00 0.00000e+00 0.00000e+00 1.40362e+00 227.995 6.73797e+01 47.995  0.6824 
1 1 1 2   62  11 o 19 5.71136e+00 8.92106e-01 1.00984e+02 149.842 -5.71905e+00 3.32298e+00  0.00000e+00 0.00000e+00 9.51191e+01 149.842 5.86534e+00 329.842 0.9210 
1 1 1 2   62  12 o 6  1.84771e+01 6.81423e-01 3.10480e+02 257.792 -1.63164e+01 -7.54186e+01 0.00000e+00 0.00000e+00 3.73492e+02 257.792 6.30115e+01 257.792 0.9935 
1 1 1 2   62  13 o 3  6.33403e+00 1.11573e+00 1.79490e+02 279.829 2.48666e+00  -1.43526e+01 0.00000e+00 0.00000e+00 4.81059e+01 279.829 1.31384e+02 99.829  0.9650 
1 1 1 2   62  14 o 11 9.53245e+00 1.02640e+00 1.57553e+02 195.001 -2.20683e+01 -5.91375e+00 0.00000e+00 0.00000e+00 1.89263e+02 195.001 3.17104e+01 195.001 0.9779 
1 1 1 2   62  15 o 2  3.45159e+00 1.10938e+00 5.33706e+01 68.371  1.02910e+00  2.59538e+00  0.00000e+00 0.00000e+00 4.84296e+01 68.371  4.94091e+00 248.371 0.7933 
1 1 1 2   62  16 o 4  1.27888e+01 1.24320e+00 2.02631e+02 77.971  8.62103e+00  4.04590e+01  0.00000e+00 0.00000e+00 2.66621e+02 77.971  6.39901e+01 77.971  0.9878 
1 1 1 2   62  17 o 13 3.29159e+00 1.10937e+00 4.49022e+01 344.666 2.92950e+00  -8.03278e-01 0.00000e+00 0.00000e+00 5.43728e+01 344.666 9.47056e+00 344.666 0.8127 
1 1 1 2   63  0  o 13 2.72044e+01 4.57286e-01 4.73547e+02 290.175 1.27805e+01  -3.47823e+01 0.00000e+00 0.00000e+00 5.29567e+02 290.175 5.60195e+01 290.175 0.9864 
1 1 1 2   63  1  o 18 2.28825e+01 4.23213e-01 3.78107e+02 180.633 -2.48674e+01 -2.74869e-01 0.00000e+00 0.00000e+00 4.59931e+02 180.633 8.18234e+01 180.633 0.9797 
1 1 1 2   63  2  o 7  2.05068e+01 4.27765e-01 3.01949e+02 333.380 1.72932e+01  -8.66718e+00 0.00000e+00 0.00000e+00 4.44562e+02 333.380 1.42613e+02 333.380 0.9738 
1 1 1 2   63  3  o 2  9.95054e+00 4.51391e-01 1.60072e+02 329.750 4.55843e+00  -2.65842e+00 0.00000e+00 0.00000e+00 1.74473e+02 329.750 1.44012e+01 329.750 0.8994 
1 1 1 2   63  4  o 8  3.18069e+01 5.43556e-01 4.08010e+02 93.667  -2.85684e+00 4.45721e+01  0.00000e+00 0.00000e+00 7.67385e+02 93.667  3.59375e+02 93.667  0.9887 
1 1 1 2   63  5  o 9  1.20025e+01 4.80633e-01 1.96697e+02 213.351 -8.71461e+00 -5.73552e+00 0.00000e+00 0.00000e+00 2.29741e+02 213.351 3.30435e+01 213.351 0.9508 
1 1 1 2   63  6  f 0  1.71490e+01 5.43146e-01 3.15056e+02 270.139 6.63273e-02  -2.73682e+01 0.00000e+00 0.00000e+00 3.13784e+02 270.139 1.27260e+00 90.139  0.9816 
1 1 1 2   63  7  o 10 2.80802e+01 6.39104e-01 5.38815e+02 74.544  2.44387e+01  8.83845e+01  0.00000e+00 0.00000e+00 5.04143e+02 74.544  3.46716e+01 254.544 0.9945 
1 1 1 2   63  8  o 10 1.65909e+01 6.16495e-01 3.34299e+02 233.934 -2.37780e+01 -3.26482e+01 0.00000e+00 0.00000e+00 2.77361e+02 233.934 5.69384e+01 53.934  0.9875 
1 1 1 2   63  9  o 2  1.49213e+01 6.47566e-01 2.35712e+02 116.313 -1.40408e+01 2.83928e+01  0.00000e+00 0.00000e+00 3.12227e+02 116.313 7.65143e+01 116.313 0.9841 
1 1 1 2   63  10 o 16 2.84827e+00 8.29837e-01 5.25604e+01 327.161 1.24364e+00  -8.02682e-01 0.00000e+00 0.00000e+00 1.02438e+01 327.161 4.23166e+01 147.161 0.5912 
1 1 1 2   63  11 f 0  7.46584e+00 7.69775e-01 5.06372e+01 138.492 -3.53641e+00 3.12961e+00  0.00000e+00 0.00000e+00 1.96080e+02 138.492 1.45443e+02 138.492 0.8865 
1 1 1 2   63  12 o 12 6.67770e+00 9.18766e-01 1.10077e+02 311.490 6.16830e+00  -6.97451e+00 0.00000e+00 0.00000e+00 1.24923e+02 311.490 1.48460e+01 311.490 0.9447 
1 1 1 2   63  13 o 13 8.66147e+00 1.01726e+00 2.48759e+02 120.991 -1.55365e+01 2.58660e+01  0.00000e+00 0.00000e+00 6.82974e+01 120.991 1.80462e+02 300.991 0.9833 
1 1 1 2   63  14 o 17 2.79309e+00 9.26628e-01 5.44838e+01 277.522 3.28927e-01  -2.49112e+00 0.00000e+00 0.00000e+00 2.51449e+01 277.522 2.93389e+01 97.522  0.7664 
1 1 1 2   63  15 o 15 3.26859e+00 9.99497e-01 5.98922e+01 117.119 -1.49292e+00 2.91510e+00  0.00000e+00 0.00000e+00 4.07572e+01 117.119 1.91350e+01 297.118 0.8284 
1 1 1 2   63  16 o 3  1.43627e+01 1.11764e+00 2.08160e+02 324.800 4.22174e+01  -2.97806e+01 0.00000e+00 0.00000e+00 3.20051e+02 324.800 1.11891e+02 324.800 0.9903 
1 1 1 2   63  17 o 17 4.53520e+00 1.38818e+00 7.89091e+01 133.512 -3.90022e+00 4.10821e+00  0.00000e+00 0.00000e+00 7.36812e+01 133.512 5.22792e+00 313.512 0.9068 
1 1 1 2   64  0  o 18 3.08164e+00 6.69745e-01 1.70762e+02 229.016 -1.09620e+00 -1.26173e+00 0.00000e+00 0.00000e+00 9.75403e+01 49.016  2.68302e+02 49.016  0.6357 
1 1 1 2   64  1  o 18 1.27659e+01 3.76364e-01 1.81883e+02 246.683 -2.87412e+00 -6.66834e+00 0.00000e+00 0.00000e+00 2.61071e+02 246.683 7.91885e+01 246.683 0.9283 
1 1 1 2   64  2  o 18 2.56974e+01 4.70815e-01 4.68294e+02 48.215  2.56831e+01  2.87403e+01  0.00000e+00 0.00000e+00 4.79632e+02 48.215  1.13378e+01 48.215  0.9869 
1 1 1 2   64  3  o 9  3.38877e+01 5.59022e-01 6.19334e+02 282.632 1.62611e+01  -7.25599e+01 0.00000e+00 0.00000e+00 6.38618e+02 282.632 1.92839e+01 282.632 0.9933 
1 1 1 2   64  4  o 17 1.77943e+01 4.40134e-01 2.96491e+02 359.729 2.28415e+01  -1.08152e-01 0.00000e+00 0.00000e+00 3.53731e+02 359.729 5.72400e+01 359.729 0.9779 
1 1 1 2   64  5  o 6  1.69629e+01 5.15521e-01 3.51760e+02 290.788 9.73219e+00  -2.56367e+01 0.00000e+00 0.00000e+00 2.70326e+02 290.788 8.14343e+01 110.788 0.9816 
1 1 1 2   64  6  o 17 2.81631e+01 6.29108e-01 5.95641e+02 135.713 -7.10888e+01 6.93421e+01  0.00000e+00 0.00000e+00 4.50986e+02 135.713 1.44656e+02 315.713 0.9950 
1 1 1 2   64  7  o 7  1.29349e+01 5.13911e-01 2.71009e+02 347.168 2.36106e+01  -5.37797e+00 0.00000e+00 0.00000e+00 2.01898e+02 347.168 6.91109e+01 167.168 0.9791 
1 1 1 2   64  8  o 13 3.87706e+00 9.15236e-01 3.05205e+01 241.964 -4.00237e-01 -7.51592e-01 0.00000e+00 0.00000e+00 2.61085e+01 241.964 4.41202e+00 61.964  0.3913 
1 1 1 2   64  9  o 14 5.74078e+00 9.68734e-01 1.58667e+02 70.004  2.57542e+00  7.07729e+00  0.00000e+00 0.00000e+00 4.07446e+01 70.004  1.17922e+02 250.003 0.9310 
1 1 1 2   64  10 o 7  1.45448e+01 5.83477e-01 2.59599e+02 120.329 -2.03366e+01 3.47613e+01  0.00000e+00 0.00000e+00 2.76010e+02 120.329 1.64109e+01 120.329 0.9875 
1 1 1 2   64  11 o 19 6.71461e+00 8.51554e-01 1.33211e+02 198.694 -9.69462e+00 -3.28033e+00 0.00000e+00 0.00000e+00 1.04482e+02 198.694 2.87289e+01 18.694  0.9498 
1 1 1 2   64  12 o 13 1.20247e+01 7.13822e-01 1.49686e+02 96.642  -2.95841e+00 2.54073e+01  0.00000e+00 0.00000e+00 2.89347e+02 96.642  1.39661e+02 96.642  0.9803 
1 1 1 2   64  13 o 5  8.99014e+00 1.01959e+00 1.40097e+02 197.238 -1.57874e+01 -4.89846e+00 0.00000e+00 0.00000e+00 1.84241e+02 197.238 4.41441e+01 197.238 0.9693 
1 1 1 2   64  14 o 16 3.21237e+00 1.04158e+00 1.01991e+02 312.974 3.58510e+00  -3.84802e+00 0.00000e+00 0.00000e+00 5.42851e+00 312.974 9.65628e+01 132.974 0.8991 
1 1 1 2   64  15 o 7  3.62796e+00 1.16043e+00 8.16115e+01 317.214 3.31690e+00  -3.06993e+00 0.00000e+00 0.00000e+00 3.71585e+01 317.214 4.44531e+01 137.214 0.8809 
1 1 1 2   64  16 o 19 3.68323e+00 1.19552e+00 8.25889e+01 19.544  4.71522e+00  1.67384e+00  0.00000e+00 0.00000e+00 3.96041e+01 19.544  4.29849e+01 199.544 0.8935 
1 1 1 2   64  17 f 0  4.65385e+00 1.33282e+00 6.76106e+01 0.741   5.40235e+00  6.99012e-02  0.00000e+00 0.00000e+00 8.81059e+01 0.741   2.04954e+01 0.741   0.9020 
1 1 1 2   65  0  o 2  1.34131e+01 3.77741e-01 7.88542e+01 265.594 -2.61705e-01 -3.39616e+00 0.00000e+00 0.00000e+00 3.40194e+02 265.594 2.61340e+02 265.594 0.8361 
1 1 1 2   65  1  o 18 1.09006e+01 4.20488e-01 2.50673e+02 271.738 2.65641e-01  -8.75695e+00 0.00000e+00 0.00000e+00 1.32674e+02 271.738 1.17999e+02 91.738  0.9411 
1 1 1 2   65  2  o 10 2.45106e+01 4.62087e-01 3.13308e+02 123.706 -1.52302e+01 2.28313e+01  0.00000e+00 0.00000e+00 5.85796e+02 123.706 2.72488e+02 123.706 0.9816 
1 1 1 2   65  3  o 4  1.52827e+01 4.25129e-01 3.52088e+02 233.031 -1.27694e+01 -1.69645e+01 0.00000e+00 0.00000e+00 2.05363e+02 233.031 1.46725e+02 53.031  0.9762 
1 1 1 2   65  4  o 2  1.19787e+01 4.85402e-01 2.78862e+02 330.227 1.24123e+01  -7.10094e+00 0.00000e+00 0.00000e+00 1.52739e+02 330.227 1.26122e+02 150.227 0.9644 
1 1 1 2   65  5  o 12 2.13700e+01 5.49251e-01 5.09317e+02 45.234  3.62034e+01  3.65005e+01  0.00000e+00 0.00000e+00 2.81147e+02 45.234  2.28170e+02 225.234 0.9902 
1 1 1 2   65  6  o 4  1.18577e+01 5.57399e-01 1.50368e+02 156.236 -9.32628e+00 4.10642e+00  0.00000e+00 0.00000e+00 2.70134e+02 156.236 1.19766e+02 156.236 0.9496 
1 1 1 2   65  7  o 15 1.14230e+01 6.25494e-01 2.58899e+02 305.957 1.21601e+01  -1.67632e+01 0.00000e+00 0.00000e+00 1.57129e+02 305.957 1.01769e+02 125.957 0.9755 
1 1 1 2   65  8  o 19 7.35295e+00 8.38073e-01 1.41328e+02 124.837 -4.44148e+00 6.38163e+00  0.00000e+00 0.00000e+00 1.14769e+02 124.837 2.65593e+01 304.837 0.9333 
1 1 1 2   65  9  o 1  1.93494e+01 5.46346e-01 3.06507e+02 235.934 -3.21462e+01 -4.75405e+01 0.00000e+00 0.00000e+00 4.08962e+02 235.934 1.02456e+02 235.934 0.9912 
1 1 1 2   65  10 f 0  6.58231e+00 7.88837e-01 1.57338e+02 27.457  9.76607e+00  5.07450e+00  0.00000e+00 0.00000e+00 7.66477e+01 27.457  8.06901e+01 207.457 0.9534 
1 1 1 2   65  11 o 14 1.51608e+01 6.27778e-01 2.79583e+02 68.704  2.07943e+01  5.33463e+01  0.00000e+00 0.00000e+00 2.80400e+02 68.704  8.16269e-01 68.704  0.9912 
1 1 1 2   65  12 o 5  2.61817e+00 8.32298e-01 5.26322e+01 274.852 1.55166e-01  -1.82804e+00 0.00000e+00 0.00000e+00 1.25622e+01 274.852 4.00701e+01 94.852  0.6687 
1 1 1 2   65  13 o 17 3.90038e+00 1.10609e+00 8.82473e+01 161.073 -4.22936e+00 1.45022e+00  0.00000e+00 0.00000e+00 3.94095e+01 161.073 4.88379e+01 341.073 0.8795 
1 1 1 2   65  14 o 8  4.46631e+00 1.20253e+00 1.26539e+02 325.859 6.56973e+00  -4.45487e+00 0.00000e+00 0.00000e+00 2.87045e+01 325.859 9.78345e+01 145.859 0.9347 
1 1 1 2   65  15 o 10 5.17650e+00 1.34650e+00 7.33342e+01 267.401 -2.42832e-01 -5.34869e+00 0.00000e+00 0.00000e+00 9.99659e+01 267.401 2.66317e+01 267.401 0.9010 
1 1 1 2   65  16 o 9  3.82016e+00 1.23977e+00 8.63640e+01 301.838 2.89730e+00  -4.66589e+00 0.00000e+00 0.00000e+00 4.17970e+01 301.838 4.45670e+01 121.838 0.9037 
1 1 1 2   65  17 o 9  4.06772e+00 1.30510e+00 7.29733e+01 23.890  5.17067e+00  2.29026e+00  0.00000e+00 0.00000e+00 6.38148e+01 23.890  9.15845e+00 203.890 0.9066 
1 1 1 2   66  0  o 3  1.23082e+01 3.82728e-01 2.32191e+02 127.703 -5.78561e+00 7.48498e+00  0.00000e+00 0.00000e+00 2.02632e+02 127.703 2.95590e+01 307.703 0.9456 
1 1 1 2   66  1  o 4  1.69619e+01 3.91874e-01 3.05548e+02 291.066 6.67295e+00  -1.73240e+01 0.00000e+00 0.00000e+00 3.10891e+02 291.066 5.34316e+00 291.066 0.9727 
1 1 1 2   66  2  o 10 8.95792e+00 4.48996e-01 2.29204e+02 119.110 -3.45916e+00 6.21235e+00  0.00000e+00 0.00000e+00 8.09708e+01 119.110 1.48234e+02 299.110 0.9267 
1 1 1 2   66  3  o 10 2.59307e+01 4.82828e-01 3.58172e+02 243.009 -1.81597e+01 -3.56536e+01 0.00000e+00 0.00000e+00 5.98417e+02 243.009 2.40245e+02 243.009 0.9874 
1 1 1 2   66  4  o 16 1.00002e+01 5.54879e-01 1.98583e+02 178.887 -9.10747e+00 1.76906e-01  0.00000e+00 0.00000e+00 1.53831e+02 178.887 4.47519e+01 358.887 0.9434 
1 1 1 2   66  5  o 19 1.55779e+01 5.16663e-01 3.38808e+02 352.142 2.65013e+01  -3.65773e+00 0.00000e+00 0.00000e+00 2.32012e+02 352.142 1.06795e+02 172.142 0.9811 
1 1 1 2   66  6  o 4  1.70545e+01 5.48251e-01 2.95434e+02 68.434  1.13795e+01  2.87916e+01  0.00000e+00 0.00000e+00 3.30981e+02 68.434  3.55463e+01 68.434  0.9837 
1 1 1 2   66  7  o 3  1.22884e+01 6.27619e-01 1.98783e+02 6.433   1.80116e+01  2.03076e+00  0.00000e+00 0.00000e+00 2.47063e+02 6.433   4.82796e+01 6.433   0.9720 
1 1 1 2   66  8  o 6  1.21039e+01 6.55821e-01 1.85723e+02 317.851 1.40856e+01  -1.27494e+01 0.00000e+00 0.00000e+00 2.53853e+02 317.851 6.81309e+01 317.851 0.9733 
1 1 1 2   66  9  o 12 1.06805e+01 5.76758e-01 1.40224e+02 242.834 -6.66145e+00 -1.29809e+01 0.00000e+00 0.00000e+00 2.44214e+02 242.834 1.03989e+02 242.834 0.9651 
1 1 1 2   66  10 o 11 1.11863e+01 6.20458e-01 2.73939e+02 173.153 -3.45056e+01 4.14340e+00  0.00000e+00 0.00000e+00 1.37013e+02 173.153 1.36926e+02 353.153 0.9855 
1 1 1 2   66  11 o 3  4.24126e+00 9.76682e-01 1.05864e+02 122.319 -2.90305e+00 4.58874e+00  0.00000e+00 0.00000e+00 3.67410e+01 122.319 6.91234e+01 302.319 0.9025 
1 1 1 2   66  12 o 13 1.20539e+01 7.33325e-01 1.77383e+02 342.198 3.13245e+01  -1.00586e+01 0.00000e+00 0.00000e+00 2.64548e+02 342.198 8.71650e+01 342.198 0.9847 
1 1 1 2   66  13 o 13 1.00346e+01 9.44890e-01 1.59775e+02 82.420  3.26969e+00  2.45716e+01  0.00000e+00 0.00000e+00 2.05983e+02 82.420  4.62083e+01 82.420  0.9796 
1 1 1 2   66  14 o 7  9.17319e+00 1.09772e+00 1.63407e+02 243.634 -9.35025e+00 -1.88639e+01 0.00000e+00 0.00000e+00 1.69453e+02 243.634 6.04645e+00 243.634 0.9760 
1 1 1 2   66  15 o 8  8.33402e+00 1.29189e+00 9.95843e+01 319.784 9.22377e+00  -7.79897e+00 0.00000e+00 0.00000e+00 1.96920e+02 319.784 9.73355e+01 319.784 0.9577 
1 1 1 2   66  16 o 6  3.14534e+00 1.06740e+00 3.52691e+01 215.439 -1.81143e+00 -1.28916e+00 0.00000e+00 0.00000e+00 5.01028e+01 215.439 1.48337e+01 215.439 0.7312 
1 1 1 2   66  17 o 7  3.59160e+00 1.19878e+00 7.96913e+01 319.413 4.32173e+00  -3.70244e+00 0.00000e+00 0.00000e+00 4.11479e+01 319.413 3.85434e+01 139.413 0.9073 
1 1 1 2   67  0  o 6  2.31319e+01 4.62801e-01 5.59557e+02 332.909 3.98865e+01  -2.04033e+01 0.00000e+00 0.00000e+00 2.94827e+02 332.909 2.64729e+02 152.909 0.9888 
1 1 1 2   67  1  o 2  1.57550e+01 3.89173e-01 3.66633e+02 239.489 -1.15985e+01 -1.96817e+01 0.00000e+00 0.00000e+00 2.08890e+02 239.489 1.57743e+02 59.489  0.9779 
1 1 1 2   67  2  o 11 1.27822e+01 4.22684e-01 2.07691e+02 13.600  1.11846e+01  2.70589e+00  0.00000e+00 0.00000e+00 2.48556e+02 13.600  4.08647e+01 13.600  0.9555 
1 1 1 2   67  3  f 0  7.35393e+00 5.17093e-01 4.66317e+01 8.323   1.49475e+00  2.18676e-01  0.00000e+00 0.00000e+00 1.17843e+02 8.323   7.12110e+01 8.323   0.5988 
1 1 1 2   67  4  o 5  6.17647e+00 7.21609e-01 1.61256e+02 43.552  3.41894e+00  3.25040e+00  0.00000e+00 0.00000e+00 4.32171e+01 43.552  1.18039e+02 223.552 0.8864 
1 1 1 2   67  5  o 18 1.53257e+01 5.14140e-01 3.79554e+02 292.079 1.31099e+01  -3.23198e+01 0.00000e+00 0.00000e+00 1.84458e+02 292.079 1.95097e+02 112.079 0.9856 
1 1 1 2   67  6  o 15 1.58055e+01 5.90367e-01 3.05234e+02 28.032  2.64585e+01  1.40871e+01  0.00000e+00 0.00000e+00 2.74883e+02 28.032  3.03510e+01 208.032 0.9832 
1 1 1 2   67  7  o 8  1.64418e+01 6.14725e-01 3.01064e+02 146.476 -3.00020e+01 1.98756e+01  0.00000e+00 0.00000e+00 3.03954e+02 146.476 2.89046e+00 146.476 0.9860 
1 1 1 2   67  8  o 7  8.79471e+00 6.05704e-01 1.14400e+02 318.112 6.81203e+00  -6.10959e+00 0.00000e+00 0.00000e+00 1.95209e+02 318.112 8.08089e+01 318.112 0.9437 
1 1 1 2   67  9  o 4  7.35137e+00 6.97605e-01 1.17999e+02 134.373 -6.34475e+00 6.48519e+00  0.00000e+00 0.00000e+00 1.40548e+02 134.373 2.25492e+01 134.373 0.9432 
1 1 1 2   67  10 o 15 4.38248e+00 8.83895e-01 6.37339e+01 257.373 -7.02674e-01 -3.13676e+00 0.00000e+00 0.00000e+00 7.09661e+01 257.373 7.23219e+00 257.373 0.8247 
1 1 1 2   67  11 o 17 6.35752e+00 8.85558e-01 1.39283e+02 330.682 1.00999e+01  -5.67184e+00 0.00000e+00 0.00000e+00 8.70679e+01 330.682 5.22147e+01 150.683 0.9558 
1 1 1 2   67  12 o 7  6.51010e+00 9.76894e-01 7.08674e+01 216.034 -5.15016e+00 -3.74654e+00 0.00000e+00 0.00000e+00 1.51544e+02 216.034 8.06762e+01 216.034 0.9177 
1 1 1 2   67  13 f 0  4.94711e+00 1.15203e+00 1.46087e+02 117.578 -4.65993e+00 8.92208e+00  0.00000e+00 0.00000e+00 2.85555e+01 117.578 1.17531e+02 297.578 0.9489 
1 1 1 2   67  14 o 3  5.82735e+00 1.27069e+00 8.17961e+01 295.599 2.77245e+00  -5.78681e+00 0.00000e+00 0.00000e+00 1.17146e+02 295.599 3.53501e+01 295.599 0.9184 
1 1 1 2   67  15 o 16 3.08657e+00 1.02003e+00 3.69405e+01 203.467 -1.95786e+00 -8.49961e-01 0.00000e+00 0.00000e+00 4.54502e+01 203.467 8.50977e+00 203.467 0.7187 
1 1 1 2   67  16 o 14 1.04404e+01 1.37455e+00 1.42568e+02 267.519 -1.05426e+00 -2.43333e+01 0.00000e+00 0.00000e+00 2.36849e+02 267.519 9.42806e+01 267.519 0.9793 
1 1 1 2   67  17 o 17 3.65342e+00 1.21218e+00 4.38194e+01 88.404  8.89585e-02  3.19353e+00  0.00000e+00 0.00000e+00 6.77180e+01 88.404  2.38986e+01 88.404  0.8234 
1 1 1 2   68  0  o 2  3.98921e+01 6.02138e-01 7.12797e+02 22.160  1.12508e+02  4.58231e+01  0.00000e+00 0.00000e+00 7.70933e+02 22.160  5.81362e+01 22.160  0.9959 
1 1 1 2   68  1  f 0  9.43699e+00 4.08397e-01 1.69051e+02 231.427 -4.30785e+00 -5.40163e+00 0.00000e+00 0.00000e+00 1.56805e+02 231.427 1.22457e+01 51.427  0.9245 
1 1 1 2   68  2  o 14 3.07609e+01 5.26774e-01 5.13936e+02 215.191 -5.51041e+01 -3.88591e+01 0.00000e+00 0.00000e+00 6.26401e+02 215.191 1.12465e+02 215.191 0.9926 
1 1 1 2   68  3  o 5  9.02222e+00 5.65783e-01 1.30650e+02 0.893   5.38855e+00  8.40362e-02  0.00000e+00 0.00000e+00 1.73172e+02 0.893   4.25216e+01 0.893   0.9017 
1 1 1 2   68  4  o 15 1.32159e+01 5.40302e-01 2.44578e+02 256.488 -3.82449e+00 -1.59153e+01 0.00000e+00 0.00000e+00 2.33600e+02 256.488 1.09779e+01 76.488  0.9690 
1 1 1 2   68  5  o 1  4.02013e+00 8.10753e-01 8.73146e+01 159.825 -1.83007e+00 6.72413e-01  0.00000e+00 0.00000e+00 1.61467e+01 159.825 7.11679e+01 339.825 0.6893 
1 1 1 2   68  6  o 4  7.74925e+00 7.09435e-01 1.47559e+02 179.200 -7.89571e+00 1.10204e-01  0.00000e+00 0.00000e+00 1.22691e+02 179.200 2.48677e+01 359.200 0.9344 
1 1 1 2   68  7  o 11 1.69848e+01 6.08254e-01 3.71594e+02 289.180 1.72471e+01  -4.95826e+01 0.00000e+00 0.00000e+00 2.56093e+02 289.180 1.15501e+02 109.180 0.9904 
1 1 1 2   68  8  o 15 7.18637e+00 6.30361e-01 1.70316e+02 144.229 -8.95065e+00 6.44857e+00  0.00000e+00 0.00000e+00 8.52724e+01 144.229 8.50441e+01 324.229 0.9535 
1 1 1 2   68  9  f 0  1.36331e+01 5.52609e-01 2.45018e+02 61.625  1.77002e+01  3.27707e+01  0.00000e+00 0.00000e+00 2.56386e+02 61.625  1.13673e+01 61.625  0.9865 
1 1 1 2   68  10 o 4  7.25694e+00 8.01116e-01 1.29345e+02 191.072 -1.13792e+01 -2.22667e+00 0.00000e+00 0.00000e+00 1.29137e+02 191.072 2.08028e-01 11.072  0.9559 
1 1 1 2   68  11 o 5  2.66663e+00 8.26050e-01 5.12998e+01 224.168 -1.24978e+00 -1.21399e+00 0.00000e+00 0.00000e+00 1.33118e+01 224.168 3.79879e+01 44.168  0.6506 
1 1 1 2   68  12 o 5  1.02312e+01 8.37971e-01 1.80080e+02 327.171 2.27915e+01  -1.47042e+01 0.00000e+00 0.00000e+00 1.93635e+02 327.171 1.35546e+01 327.171 0.9814 
1 1 1 2   68  13 o 19 7.17979e+00 1.10919e+00 1.26578e+02 29.913  1.12014e+01  6.44440e+00  0.00000e+00 0.00000e+00 1.29919e+02 29.913  3.34100e+00 29.913  0.9605 
1 1 1 2   68  14 o 5  2.56870e+00 8.83410e-01 6.04655e+01 98.681  -3.85393e-01 2.52423e+00  0.00000e+00 0.00000e+00 1.31120e+01 98.681  4.73535e+01 278.681 0.7707 
1 1 1 2   68  15 o 18 9.26837e+00 1.28189e+00 1.41632e+02 297.824 9.06815e+00  -1.71817e+01 0.00000e+00 0.00000e+00 1.93585e+02 297.824 5.19530e+01 297.824 0.9739 
1 1 1 2   68  16 o 6  3.51044e+00 1.15120e+00 6.86537e+01 175.939 -4.75490e+00 3.37614e-01  0.00000e+00 0.00000e+00 4.69690e+01 175.939 2.16847e+01 355.939 0.8877 
1 1 1 2   68  17 o 15 3.91833e+00 1.25646e+00 7.16322e+01 338.884 5.22366e+00  -2.01734e+00 0.00000e+00 0.00000e+00 5.99162e+01 338.884 1.17160e+01 158.884 0.9057 
1 1 1 2   69  0  o 17 6.64236e+00 4.80444e-01 2.70195e+02 21.263  7.16146e+00  2.78686e+00  0.00000e+00 0.00000e+00 3.89165e+01 201.263 3.09111e+02 201.263 0.9325 
1 1 1 2   69  1  o 10 5.04879e+00 6.07432e-01 1.48633e+02 116.392 -1.45682e+00 2.93578e+00  0.00000e+00 0.00000e+00 7.58031e+00 116.392 1.41053e+02 296.392 0.8286 
1 1 1 2   69  2  o 3  1.56125e+01 4.19250e-01 2.35266e+02 142.002 -1.34198e+01 1.04838e+01  0.00000e+00 0.00000e+00 3.30352e+02 142.002 9.50864e+01 142.002 0.9702 
1 1 1 2   69  3  o 18 8.65890e+00 5.20652e-01 1.47746e+02 352.399 5.99990e+00  -8.00673e-01 0.00000e+00 0.00000e+00 1.47500e+02 352.399 2.46788e-01 172.399 0.9132 
1 1 1 2   69  4  o 4  2.44802e+01 5.97951e-01 4.98088e+02 15.778  6.96881e+01  1.96905e+01  0.00000e+00 0.00000e+00 4.09531e+02 15.778  8.85567e+01 195.778 0.9931 
1 1 1 2   69  5  o 7  1.03540e+01 5.02169e-01 1.55981e+02 151.248 -8.72659e+00 4.78803e+00  0.00000e+00 0.00000e+00 2.10544e+02 151.248 5.45638e+01 151.248 0.9484 
1 1 1 2   69  6  o 17 1.23570e+01 6.59904e-01 8.24821e+01 340.222 7.02367e+00  -2.52564e+00 0.00000e+00 0.00000e+00 3.46543e+02 340.222 2.64061e+02 340.222 0.9304 
1 1 1 2   69  7  o 2  1.00259e+01 6.65004e-01 2.31521e+02 153.176 -1.60421e+01 8.11194e+00  0.00000e+00 0.00000e+00 1.31945e+02 153.176 9.95765e+01 333.176 0.9718 
1 1 1 2   69  8  o 16 7.45249e+00 6.39812e-01 1.04481e+02 216.739 -5.92057e+00 -4.41927e+00 0.00000e+00 0.00000e+00 1.53877e+02 216.739 4.93958e+01 216.739 0.9296 
1 1 1 2   69  9  o 6  9.60270e+00 6.08696e-01 1.44940e+02 328.014 1.32308e+01  -8.26307e+00 0.00000e+00 0.00000e+00 2.01333e+02 328.014 5.63931e+01 328.014 0.9674 
1 1 1 2   69  10 o 8  6.62029e+00 7.57103e-01 1.05171e+02 44.302  5.89231e+00  5.75046e+00  0.00000e+00 0.00000e+00 1.25976e+02 44.302  2.08055e+01 44.302  0.9371 
1 1 1 2   69  11 o 14 6.62747e+00 8.89530e-01 7.34741e+01 150.334 -5.72375e+00 3.26021e+00  0.00000e+00 0.00000e+00 1.53714e+02 150.334 8.02397e+01 150.334 0.9206 
1 1 1 2   69  12 o 19 9.08673e+00 8.46584e-01 1.63680e+02 257.922 -4.75221e+00 -2.22084e+01 0.00000e+00 0.00000e+00 1.66931e+02 257.922 3.25022e+00 257.922 0.9777 
1 1 1 2   69  13 o 13 3.44677e+00 9.97065e-01 6.94571e+01 308.765 2.20303e+00  -2.74341e+00 0.00000e+00 0.00000e+00 3.84747e+01 308.765 3.09824e+01 128.765 0.8421 
1 1 1 2   69  14 o 4  6.49936e+00 1.23508e+00 1.21126e+02 355.336 1.09822e+01  -8.95941e-01 0.00000e+00 0.00000e+00 1.09152e+02 355.336 1.19737e+01 175.336 0.9535 
1 1 1 2   69  15 o 1  7.15740e+00 1.36772e+00 1.09502e+02 194.424 -1.11277e+01 -2.86214e+00 0.00000e+00 0.00000e+00 1.44408e+02 194.424 3.49065e+01 194.424 0.9554 
1 1 1 2   69  16 o 12 3.44641e+00 1.13987e+00 2.64067e+01 108.911 -5.83120e-01 1.70212e+00  0.00000e+00 0.00000e+00 5.82179e+01 108.911 3.18112e+01 108.911 0.6619 
1 1 1 2   69  17 o 9  2.91933e+00 1.01073e+00 5.27194e+01 80.416  6.77853e-01  4.01473e+00  0.00000e+00 0.00000e+00 4.10048e+01 80.416  1.17146e+01 260.416 0.8662 
1 1 1 2   70  0  o 8  2.31099e+01 4.35377e-01 4.33460e+02 199.673 -4.36831e+01 -1.56177e+01 0.00000e+00 0.00000e+00 4.19964e+02 199.673 1.34955e+01 19.673  0.9892 
1 1 1 2   70  1  o 16 1.87379e+01 4.09592e-01 3.38797e+02 349.577 2.89061e+01  -5.31712e+00 0.00000e+00 0.00000e+00 3.48782e+02 349.577 9.98567e+00 349.577 0.9828 
1 1 1 2   70  2  o 13 3.32032e+00 5.96492e-01 1.07899e+02 213.048 -1.41239e+00 -9.18908e-01 0.00000e+00 0.00000e+00 2.87293e+01 33.048  1.36628e+02 33.048  0.6387 
1 1 1 2   70  3  o 18 2.05300e+01 5.86507e-01 3.65423e+02 60.669  1.98964e+01  3.54106e+01  0.00000e+00 0.00000e+00 3.91512e+02 60.669  2.60882e+01 60.669  0.9876 
1 1 1 2   70  4  o 9  1.24545e+01 4.99381e-01 2.43135e+02 202.359 -1.60836e+01 -6.61572e+00 0.00000e+00 0.00000e+00 2.08188e+02 202.359 3.49465e+01 22.359  0.9708 
1 1 1 2   70  5  o 12 2.45426e+01 6.14638e-01 4.43908e+02 224.426 -5.28860e+01 -5.18369e+01 0.00000e+00 0.00000e+00 4.65814e+02 224.426 2.19064e+01 224.426 0.9932 
1 1 1 2   70  6  o 16 1.61664e+01 6.39412e-01 3.15301e+02 166.810 -3.59393e+01 8.42299e+00  0.00000e+00 0.00000e+00 2.79646e+02 166.810 3.56558e+01 346.810 0.9864 
1 1 1 2   70  7  o 2  1.16941e+01 5.00059e-01 2.24257e+02 262.952 -2.83512e+00 -2.29322e+01 0.00000e+00 0.00000e+00 2.02371e+02 262.952 2.18860e+01 82.952  0.9781 
1 1 1 2   70  8  o 17 5.90752e+00 7.00016e-01 1.10514e+02 26.102  5.55221e+00  2.72020e+00  0.00000e+00 0.00000e+00 9.10470e+01 26.102  1.94671e+01 206.102 0.9151 
1 1 1 2   70  9  o 14 1.30088e+01 5.57793e-01 1.94674e+02 177.425 -2.68044e+01 1.20529e+00  0.00000e+00 0.00000e+00 2.81019e+02 177.425 8.63453e+01 177.425 0.9812 
1 1 1 2   70  10 o 9  5.29500e+00 8.81013e-01 6.97712e+01 171.946 -4.50662e+00 6.37715e-01  0.00000e+00 0.00000e+00 1.04157e+02 171.946 3.43859e+01 171.946 0.8818 
1 1 1 2   70  11 o 7  5.19483e+00 9.91763e-01 8.24076e+01 215.262 -4.40749e+00 -3.11632e+00 0.00000e+00 0.00000e+00 9.20089e+01 215.262 9.60131e+00 215.262 0.9019 
1 1 1 2   70  12 o 16 9.43410e+00 8.43025e-01 1.75624e+02 314.587 1.65929e+01  -1.68338e+01 0.00000e+00 0.00000e+00 1.67870e+02 314.587 7.75365e+00 134.587 0.9786 
1 1 1 2   70  13 o 16 5.94292e+00 1.12350e+00 8.15855e+01 22.939  6.81314e+00  2.88348e+00  0.00000e+00 0.00000e+00 1.23846e+02 22.939  4.22601e+01 22.939  0.9297 
1 1 1 2   70  14 o 7  7.97325e+00 1.22763e+00 1.61943e+02 309.775 1.19334e+01  -1.43358e+01 0.00000e+00 0.00000e+00 1.26230e+02 309.775 3.57132e+01 129.775 0.9728 
1 1 1 2   70  15 o 11 2.78093e+00 9.49994e-01 2.94748e+01 150.315 -1.41206e+00 8.04936e-01  0.00000e+00 0.00000e+00 3.51124e+01 150.315 5.63763e+00 150.315 0.6256 
1 1 1 2   70  16 o 2  4.47418e+00 1.33237e+00 5.87117e+01 308.582 2.78819e+00  -3.49492e+00 0.00000e+00 0.00000e+00 8.72352e+01 308.582 2.85235e+01 308.582 0.8795 
1 1 1 2   70  17 o 14 3.12881e+00 1.06037e+00 9.40601e+01 98.401  -1.09029e+00 7.38265e+00  0.00000e+00 0.00000e+00 1.38073e+01 98.401  8.02528e+01 278.401 0.9304 
1 1 1 2   71  0  o 7  8.86040e+00 4.25529e-01 1.59391e+02 298.135 3.18094e+00  -5.94858e+00 0.00000e+00 0.00000e+00 1.45729e+02 298.135 1.36626e+01 118.135 0.9226 
1 1 1 2   71  1  o 13 1.16390e+01 3.97689e-01 2.06680e+02 64.771  4.89641e+00  1.03917e+01  0.00000e+00 0.00000e+00 2.08416e+02 64.771  1.73577e+00 64.771  0.9554 
1 1 1 2   71  2  o 1  2.69109e+01 5.51764e-01 5.27251e+02 289.749 2.42142e+01  -6.74475e+01 0.00000e+00 0.00000e+00 4.70239e+02 289.749 5.70121e+01 109.749 0.9930 
1 1 1 2   71  3  o 9  1.26145e+01 4.81358e-01 2.61701e+02 205.041 -1.79693e+01 -8.39497e+00 0.00000e+00 0.00000e+00 1.97107e+02 205.041 6.45938e+01 25.041  0.9745 
1 1 1 2   71  4  o 10 2.74272e+01 5.15602e-01 4.75395e+02 158.640 -7.47612e+01 2.92381e+01  0.00000e+00 0.00000e+00 5.41792e+02 158.640 6.63973e+01 158.640 0.9938 
1 1 1 2   71  5  o 1  1.98619e+01 5.79101e-01 3.56767e+02 24.680  4.53341e+01  2.08319e+01  0.00000e+00 0.00000e+00 3.76869e+02 24.680  2.01021e+01 24.680  0.9899 
1 1 1 2   71  6  o 12 1.67799e+01 7.49826e-01 2.61490e+02 305.128 2.03916e+01  -2.89838e+01 0.00000e+00 0.00000e+00 3.55558e+02 305.128 9.40674e+01 305.128 0.9858 
1 1 1 2   71  7  o 2  4.44829e+00 7.90032e-01 9.88092e+01 122.701 -2.06553e+00 3.21723e+00  0.00000e+00 0.00000e+00 4.32470e+01 122.701 5.55621e+01 302.701 0.8564 
1 1 1 2   71  8  o 19 1.16056e+01 5.30928e-01 1.49021e+02 147.483 -1.58807e+01 1.01237e+01  0.00000e+00 0.00000e+00 2.71957e+02 147.483 1.22936e+02 147.483 0.9731 
1 1 1 2   71  9  o 12 8.94409e+00 6.15777e-01 1.36506e+02 127.031 -8.76358e+00 1.16168e+01  0.00000e+00 0.00000e+00 1.85097e+02 127.031 4.85907e+01 127.031 0.9650 
1 1 1 2   71  10 o 13 5.22061e+00 9.03153e-01 7.59263e+01 66.647  1.96027e+00  4.54023e+00  0.00000e+00 0.00000e+00 9.75227e+01 66.647  2.15963e+01 66.647  0.8921 
1 1 1 2   71  11 o 1  3.96809e+00 1.01737e+00 6.92420e+01 322.668 3.00716e+00  -2.29349e+00 0.00000e+00 0.00000e+00 5.69780e+01 322.668 1.22640e+01 142.668 0.8546 
1 1 1 2   71  12 o 17 6.88390e+00 9.52521e-01 1.39424e+02 112.755 -5.21825e+00 1.24411e+01  0.00000e+00 0.00000e+00 1.06965e+02 112.755 3.24590e+01 292.755 0.9622 
1 1 1 2   71  13 o 13 5.42431e+00 1.16245e+00 1.15181e+02 270.071 1.09132e-02  -8.83358e+00 0.00000e+00 0.00000e+00 7.46749e+01 270.071 4.05062e+01 90.071  0.9416 
1 1 1 2   71  14 o 11 8.30002e+00 1.20982e+00 1.27151e+02 235.618 -8.92745e+00 -1.30472e+01 0.00000e+00 0.00000e+00 1.71240e+02 235.618 4.40888e+01 235.618 0.9678 
1 1 1 2   71  15 o 10 7.19452e+00 1.41738e+00 1.00694e+02 177.515 -1.00414e+01 4.35703e-01  0.00000e+00 0.00000e+00 1.52680e+02 177.515 5.19858e+01 177.515 0.9489 
1 1 1 2   71  16 o 15 5.10213e+00 1.45764e+00 4.92895e+01 287.581 1.13626e+00  -3.58604e+00 0.00000e+00 0.00000e+00 1.12232e+02 287.581 6.29426e+01 287.581 0.8537 
1 1 1 2   71  17 o 8  6.35321e+00 1.71146e+00 1.29360e+02 57.897  5.91170e+00  9.42303e+00  0.00000e+00 0.00000e+00 9.51763e+01 57.897  3.41836e+01 237.897 0.9539 
1 1 1 2   72  0  f 0  8.63625e+00 4.33746e-01 1.54679e+02 58.932  3.51991e+00  5.84229e+00  0.00000e+00 0.00000e+00 1.42952e+02 58.932  1.17266e+01 238.931 0.9235 
1 1 1 2   72  1  o 10 7.28595e+00 4.73659e-01 2.06738e+02 263.623 -9.15994e-01 -8.19652e+00 0.00000e+00 0.00000e+00 4.81179e+01 263.623 1.58621e+02 83.623  0.9373 
1 1 1 2   72  2  o 17 1.12175e+01 4.86236e-01 1.64167e+02 305.211 6.38244e+00  -9.04399e+00 0.00000e+00 0.00000e+00 2.35090e+02 305.211 7.09223e+01 305.211 0.9537 
1 1 1 2   72  3  o 6  1.75897e+01 4.85757e-01 3.58332e+02 359.044 3.65405e+01  -6.09559e-01 0.00000e+00 0.00000e+00 2.89031e+02 359.044 6.93014e+01 179.044 0.9862 
1 1 1 2   72  4  o 10 9.43339e+00 6.67457e-01 1.41469e+02 168.146 -8.80471e+00 1.84797e+00  0.00000e+00 0.00000e+00 1.90336e+02 168.146 4.88661e+01 168.146 0.9427 
1 1 1 2   72  5  o 1  2.20197e+01 6.00137e-01 3.19605e+02 246.536 -2.08461e+01 -4.80244e+01 0.00000e+00 0.00000e+00 4.93966e+02 246.536 1.74362e+02 246.536 0.9904 
1 1 1 2   72  6  o 6  9.44282e+00 7.19689e-01 2.11484e+02 116.474 -6.81784e+00 1.36901e+01  0.00000e+00 0.00000e+00 1.28979e+02 116.474 8.25047e+01 296.474 0.9667 
1 1 1 2   72  7  o 11 7.50249e+00 5.84105e-01 1.00219e+02 114.104 -2.79062e+00 6.23741e+00  0.00000e+00 0.00000e+00 1.58139e+02 114.104 5.79200e+01 114.104 0.9236 
1 1 1 2   72  8  o 14 5.01884e+00 7.90105e-01 3.09209e+01 139.308 -1.22975e+00 1.05747e+00  0.00000e+00 0.00000e+00 8.59589e+01 139.308 5.50381e+01 139.308 0.6249 
1 1 1 2   72  9  o 11 8.85206e+00 6.35328e-01 1.97138e+02 121.268 -1.18503e+01 1.95146e+01  0.00000e+00 0.00000e+00 1.25329e+02 121.268 7.18086e+01 301.268 0.9778 
1 1 1 2   72  10 o 11 4.39081e+00 9.20317e-01 7.39130e+01 256.016 -1.00987e+00 -4.05525e+00 0.00000e+00 0.00000e+00 6.83368e+01 256.016 5.57621e+00 76.016  0.8701 
1 1 1 2   72  11 f 0  8.43653e+00 7.87394e-01 1.76024e+02 181.387 -2.24380e+01 -5.43122e-01 0.00000e+00 0.00000e+00 1.30859e+02 181.387 4.51655e+01 1.387   0.9775 
1 1 1 2   72  12 o 5  3.38290e+00 9.75898e-01 7.25060e+01 220.179 -2.69035e+00 -2.27181e+00 0.00000e+00 0.00000e+00 3.34550e+01 220.179 3.90510e+01 40.179  0.8422 
1 1 1 2   72  13 o 14 3.84431e+00 1.07133e+00 1.08942e+02 254.814 -1.56562e+00 -5.76794e+00 0.00000e+00 0.00000e+00 2.13605e+01 254.814 8.75813e+01 74.814  0.9120 
1 1 1 2   72  14 o 7  3.92869e+00 1.16164e+00 8.32231e+01 326.393 4.36884e+00  -2.90346e+00 0.00000e+00 0.00000e+00 4.79128e+01 326.393 3.53102e+01 146.393 0.8988 
1 1 1 2   72  15 o 6  7.26313e+00 1.45681e+00 9.50109e+01 264.625 -9.10673e-01 -9.67862e+00 0.00000e+00 0.00000e+00 1.60247e+02 264.625 6.52358e+01 264.625 0.9471 
1 1 1 2   72  16 f 0  4.22472e+00 1.21372e+00 3.22496e+01 111.594 -9.52516e-01 2.40653e+00  0.00000e+00 0.00000e+00 8.90266e+01 111.594 5.67770e+01 111.594 0.7743 
1 1 1 2   73  0  o 7  1.26926e+01 4.62822e-01 1.92117e+02 24.924  1.33221e+01  6.19080e+00  0.00000e+00 0.00000e+00 2.65048e+02 24.924  7.29301e+01 24.924  0.9653 
1 1 1 2   73  1  o 12 1.16439e+01 4.82488e-01 2.54478e+02 21.039  1.65958e+01  6.38337e+00  0.00000e+00 0.00000e+00 1.67596e+02 21.039  8.68817e+01 201.039 0.9715 
1 1 1 2   73  2  o 2  1.29140e+01 4.83036e-01 2.08221e+02 268.831 -3.18499e-01 -1.56035e+01 0.00000e+00 0.00000e+00 2.57934e+02 268.831 4.97138e+01 268.831 0.9674 
1 1 1 2   73  3  o 8  1.41455e+01 4.85595e-01 3.12467e+02 41.979  2.07144e+01  1.86375e+01  0.00000e+00 0.00000e+00 2.05746e+02 41.979  1.06721e+02 221.979 0.9819 
1 1 1 2   73  4  o 3  9.83129e+00 5.67319e-01 1.64184e+02 326.602 9.50552e+00  -6.26731e+00 0.00000e+00 0.00000e+00 1.86078e+02 326.602 2.18940e+01 326.602 0.9550 
1 1 1 2   73  5  o 18 1.79978e+01 5.76916e-01 3.39154e+02 116.781 -2.12414e+01 4.20852e+01  0.00000e+00 0.00000e+00 3.24972e+02 116.781 1.41819e+01 296.781 0.9893 
1 1 1 2   73  6  o 4  7.63020e+00 6.24081e-01 1.80505e+02 141.443 -9.27235e+00 7.39050e+00  0.00000e+00 0.00000e+00 9.17385e+01 141.443 8.87665e+01 321.443 0.9569 
1 1 1 2   73  7  o 10 3.00827e+00 7.94600e-01 1.03063e+02 115.524 -1.23267e+00 2.58162e+00  0.00000e+00 0.00000e+00 1.34484e+01 295.524 1.16511e+02 295.524 0.7991 
1 1 1 2   73  8  o 13 1.00453e+01 5.46294e-01 1.49944e+02 273.405 1.01699e+00  -1.70941e+01 0.00000e+00 0.00000e+00 2.13270e+02 273.405 6.33257e+01 273.405 0.9703 
1 1 1 2   73  9  o 3  3.26741e+00 7.32820e-01 1.06504e+02 285.531 1.17575e+00  -4.23056e+00 0.00000e+00 0.00000e+00 2.30344e-01 285.531 1.06273e+02 105.532 0.8770 
1 1 1 2   73  10 o 5  7.99316e+00 7.44338e-01 9.87410e+01 62.589  4.94479e+00  9.53494e+00  0.00000e+00 0.00000e+00 1.84616e+02 62.589  8.58747e+01 62.589  0.9522 
1 1 1 2   73  11 o 16 5.16923e+00 1.00811e+00 9.59761e+01 328.213 5.68481e+00  -3.52296e+00 0.00000e+00 0.00000e+00 8.13282e+01 328.213 1.46480e+01 148.213 0.9219 
1 1 1 2   73  12 o 10 4.87043e+00 1.06222e+00 8.89679e+01 192.828 -6.19867e+00 -1.41153e+00 0.00000e+00 0.00000e+00 7.72055e+01 192.828 1.17623e+01 12.828  0.9176 
1 1 1 2   73  13 o 8  4.97053e+00 1.10622e+00 1.19571e+02 297.998 4.16459e+00  -7.83302e+00 0.00000e+00 0.00000e+00 5.43813e+01 297.998 6.51896e+01 117.998 0.9418 
1 1 1 2   73  14 o 18 6.40857e+00 1.22438e+00 6.68365e+01 28.379  5.85168e+00  3.16120e+00  0.00000e+00 0.00000e+00 1.52418e+02 28.379  8.55815e+01 28.379  0.9214 
1 1 1 2   73  15 o 1  3.51639e+00 1.12946e+00 8.66787e+01 238.287 -3.05705e+00 -4.94734e+00 0.00000e+00 0.00000e+00 3.19615e+01 238.287 5.47173e+01 58.287  0.9094 
1 1 1 2   73  16 o 11 4.79795e+00 1.36710e+00 9.05949e+01 118.225 -3.63401e+00 6.77031e+00  0.00000e+00 0.00000e+00 7.52452e+01 118.225 1.53497e+01 298.225 0.9325 
1 1 1 2   74  0  o 2  9.05890e+00 5.29143e-01 1.73686e+02 222.714 -6.67389e+00 -6.16159e+00 0.00000e+00 0.00000e+00 1.45064e+02 222.714 2.86224e+01 42.714  0.9432 
1 1 1 2   74  1  f 0  2.41774e+01 6.57616e-01 3.13252e+02 128.473 -2.67236e+01 3.36285e+01  0.00000e+00 0.00000e+00 5.78144e+02 128.473 2.64892e+02 128.473 0.9883 
1 1 1 2   74  2  o 10 1.07769e+01 5.05612e-01 1.83382e+02 8.785   1.20135e+01  1.85659e+00  0.00000e+00 0.00000e+00 2.01747e+02 8.785   1.83642e+01 8.785   0.9579 
1 1 1 2   74  3  o 16 2.29028e+01 5.56595e-01 4.34227e+02 71.658  2.13992e+01  6.45481e+01  0.00000e+00 0.00000e+00 4.13803e+02 71.658  2.04240e+01 251.658 0.9926 
1 1 1 2   74  4  o 13 1.31101e+01 5.40989e-01 2.31540e+02 165.174 -2.20338e+01 5.83229e+00  0.00000e+00 0.00000e+00 2.46588e+02 165.174 1.50479e+01 165.174 0.9778 
1 1 1 2   74  5  o 10 1.60026e+01 5.44932e-01 3.58741e+02 175.170 -4.53614e+01 3.83300e+00  0.00000e+00 0.00000e+00 2.31411e+02 175.170 1.27331e+02 355.170 0.9890 
1 1 1 2   74  6  o 18 7.74495e+00 5.85359e-01 1.63196e+02 180.981 -1.15108e+01 -1.97076e-01 0.00000e+00 0.00000e+00 1.12703e+02 180.981 5.04923e+01 0.981   0.9555 
1 1 1 2   74  7  o 3  7.68420e+00 5.86223e-01 1.82069e+02 189.042 -1.48818e+01 -2.36825e+00 0.00000e+00 0.00000e+00 9.46429e+01 189.042 8.74263e+01 9.042   0.9662 
1 1 1 2   74  8  o 3  6.39298e+00 7.03014e-01 7.29212e+01 278.917 8.01560e-01  -5.10881e+00 0.00000e+00 0.00000e+00 1.40768e+02 278.917 6.78470e+01 278.917 0.8972 
1 1 1 2   74  9  o 5  6.62531e+00 7.27546e-01 7.28385e+01 293.892 2.55426e+00  -5.76624e+00 0.00000e+00 0.00000e+00 1.53372e+02 293.892 8.05331e+01 293.892 0.9169 
1 1 1 2   74  10 o 4  8.14739e+00 7.26387e-01 1.59563e+02 200.075 -1.76734e+01 -6.45891e+00 0.00000e+00 0.00000e+00 1.35513e+02 200.075 2.40494e+01 20.075  0.9731 
1 1 1 2   74  11 o 6  1.48479e+01 6.71388e-01 2.72781e+02 144.220 -5.18877e+01 3.73953e+01  0.00000e+00 0.00000e+00 2.75215e+02 144.220 2.43416e+00 144.220 0.9922 
1 1 1 2   74  12 o 17 4.42377e+00 1.07072e+00 1.31680e+02 153.503 -7.72993e+00 3.85355e+00  0.00000e+00 0.00000e+00 2.29430e+01 153.503 1.08737e+02 333.503 0.9402 
1 1 1 2   74  13 o 19 3.69789e+00 1.09589e+00 8.60193e+01 171.045 -4.93884e+00 7.78230e-01  0.00000e+00 0.00000e+00 3.67126e+01 171.045 4.93068e+01 351.045 0.8934 
1 1 1 2   74  14 f 0  9.70232e+00 1.23654e+00 1.10040e+02 339.916 1.54200e+01  -5.63801e+00 0.00000e+00 0.00000e+00 2.38994e+02 339.916 1.28954e+02 339.916 0.9691 
1 1 1 2   74  15 f 0  3.14603e+00 1.04266e+00 4.36672e+01 164.921 -2.86966e+00 7.73146e-01  0.00000e+00 0.00000e+00 5.06110e+01 164.921 6.94376e+00 164.921 0.8079 
1 1 1 2   74  16 o 16 3.99020e+00 1.26894e+00 8.69923e+01 162.083 -6.16749e+00 1.99411e+00  0.00000e+00 0.00000e+00 4.89476e+01 162.083 3.80447e+01 342.083 0.9192 
1 1 1 2   75  0  o 2  1.80798e+01 6.00892e-01 3.97019e+02 180.620 -4.36025e+01 -4.72038e-01 0.00000e+00 0.00000e+00 2.69514e+02 180.620 1.27504e+02 0.620   0.9885 
1 1 1 2   75  1  o 15 1.28314e+01 6.07252e-01 2.27713e+02 88.838  3.67181e-01  1.81080e+01  0.00000e+00 0.00000e+00 2.37468e+02 88.838  9.75521e+00 88.838  0.9720 
1 1 1 2   75  2  o 4  3.46937e+01 8.12213e-01 6.03802e+02 348.196 1.34314e+02  -2.80695e+01 0.00000e+00 0.00000e+00 6.85471e+02 348.196 8.16685e+01 348.196 0.9963 
1 1 1 2   75  3  f 0  1.58826e+01 5.20409e-01 3.73467e+02 208.606 -3.90251e+01 -2.12823e+01 0.00000e+00 0.00000e+00 2.12174e+02 208.606 1.61293e+02 28.606  0.9887 
1 1 1 2   75  4  o 10 4.29851e+00 8.32583e-01 1.08216e+02 250.760 -1.12513e+00 -3.22378e+00 0.00000e+00 0.00000e+00 2.58698e+01 250.760 8.23461e+01 70.761  0.8365 
1 1 1 2   75  5  o 7  9.01627e+00 4.94497e-01 1.66760e+02 330.232 1.13523e+01  -6.49306e+00 0.00000e+00 0.00000e+00 1.56274e+02 330.232 1.04866e+01 150.232 0.9610 
1 1 1 2   75  6  o 15 4.03453e+00 7.58012e-01 7.52363e+01 221.390 -2.10153e+00 -1.85210e+00 0.00000e+00 0.00000e+00 4.41872e+01 221.390 3.10490e+01 41.390  0.7941 
1 1 1 2   75  7  o 7  8.86567e+00 5.35826e-01 2.31510e+02 115.608 -9.93288e+00 2.07242e+01  0.00000e+00 0.00000e+00 9.15695e+01 115.608 1.39941e+02 295.608 0.9780 
1 1 1 2   75  8  o 2  1.07590e+01 5.58032e-01 1.19212e+02 356.646 1.54714e+01  -9.06737e-01 0.00000e+00 0.00000e+00 2.68381e+02 356.646 1.49169e+02 356.646 0.9672 
1 1 1 2   75  9  o 14 4.29796e+00 8.63940e-01 7.71516e+01 170.479 -4.14884e+00 6.95864e-01  0.00000e+00 0.00000e+00 6.22286e+01 170.479 1.49230e+01 350.479 0.8710 
1 1 1 2   75  10 o 7  1.08361e+01 6.63066e-01 2.23040e+02 358.359 3.43074e+01  -9.82938e-01 0.00000e+00 0.00000e+00 1.74279e+02 358.359 4.87618e+01 178.359 0.9853 
1 1 1 2   75  11 o 17 5.21597e+00 1.04639e+00 8.05978e+01 148.242 -4.62809e+00 2.86488e+00  0.00000e+00 0.00000e+00 9.45244e+01 148.242 1.39267e+01 148.242 0.9027 
1 1 1 2   75  12 f 0  5.06833e+00 1.10387e+00 1.50884e+02 182.106 -1.13624e+01 -4.17873e-01 0.00000e+00 0.00000e+00 2.90135e+01 182.106 1.21870e+02 2.106   0.9550 
1 1 1 2   75  13 o 9  4.02937e+00 1.12036e+00 6.48203e+01 16.199  3.77552e+00  1.09685e+00  0.00000e+00 0.00000e+00 6.40162e+01 16.199  8.04070e-01 196.199 0.8608 
1 1 1 2   75  14 o 3  3.24706e+00 1.03138e+00 2.27306e+01 93.668  -8.29684e-02 1.29421e+00  0.00000e+00 0.00000e+00 4.25605e+01 93.668  1.98299e+01 93.668  0.5418 
1 1 1 2   75  15 o 5  3.54892e+00 1.14919e+00 7.51425e+01 236.217 -2.93747e+00 -4.39070e+00 0.00000e+00 0.00000e+00 4.32512e+01 236.217 3.18913e+01 56.217  0.8996 
1 1 1 2   75  16 o 5  5.38667e+00 1.48237e+00 1.24728e+02 293.736 4.45805e+00  -1.01386e+01 0.00000e+00 0.00000e+00 6.56316e+01 293.736 5.90960e+01 113.736 0.9537 
1 1 1 2   76  0  o 3  1.73234e+01 7.05292e-01 3.20097e+02 82.066  5.11245e+00  3.66837e+01  0.00000e+00 0.00000e+00 3.17087e+02 82.066  3.01005e+00 262.066 0.9864 
1 1 1 2   76  1  o 12 6.51464e+00 7.68942e-01 1.05931e+02 242.779 -2.15403e+00 -4.18748e+00 0.00000e+00 0.00000e+00 1.09350e+02 242.779 3.41884e+00 242.779 0.8862 
1 1 1 2   76  2  o 10 1.07572e+01 7.18149e-01 1.45457e+02 342.710 1.08319e+01  -3.37159e+00 0.00000e+00 0.00000e+00 2.37571e+02 342.710 9.21138e+01 342.710 0.9549 
1 1 1 2   76  3  o 2  1.79274e+01 5.75624e-01 3.05675e+02 71.298  1.28561e+01  3.79782e+01  0.00000e+00 0.00000e+00 3.54402e+02 71.298  4.87278e+01 71.298  0.9874 
1 1 1 2   76  4  o 7  1.19946e+01 5.38549e-01 1.94590e+02 237.316 -1.00004e+01 -1.55868e+01 0.00000e+00 0.00000e+00 2.40352e+02 237.316 4.57621e+01 237.316 0.9726 
1 1 1 2   76  5  f 0  2.99665e+00 7.37473e-01 1.12005e+02 113.840 -1.19589e+00 2.70632e+00  0.00000e+00 0.00000e+00 2.18742e+01 293.840 1.33879e+02 293.840 0.8069 
1 1 1 2   76  6  o 13 2.07832e+01 5.05711e-01 3.96043e+02 80.446  1.34650e+01  7.99973e+01  0.00000e+00 0.00000e+00 3.73667e+02 80.446  2.23762e+01 260.446 0.9938 
1 1 1 2   76  7  o 14 4.95921e+00 7.61311e-01 6.47452e+01 119.913 -1.62742e+00 2.82870e+00  0.00000e+00 0.00000e+00 8.81758e+01 119.913 2.34306e+01 119.913 0.8277 
1 1 1 2   76  8  o 13 1.80842e+01 5.68362e-01 3.42858e+02 52.782  4.99767e+01  6.57993e+01  0.00000e+00 0.00000e+00 3.26505e+02 52.782  1.63532e+01 232.782 0.9939 
1 1 1 2   76  9  o 10 4.25791e+00 8.86187e-01 1.34560e+02 263.960 -7.88032e-01 -7.44806e+00 0.00000e+00 0.00000e+00 1.29382e+01 263.960 1.21622e+02 83.960  0.9306 
1 1 1 2   76  10 o 17 9.18721e+00 6.97005e-01 1.20722e+02 146.563 -1.44467e+01 9.53926e+00  0.00000e+00 0.00000e+00 2.11063e+02 146.563 9.03403e+01 146.563 0.9707 
1 1 1 2   76  11 o 7  9.89639e+00 7.56242e-01 1.89521e+02 21.749  2.68365e+01  1.07062e+01  0.00000e+00 0.00000e+00 1.72041e+02 21.749  1.74794e+01 201.749 0.9825 
1 1 1 2   76  12 o 6  3.40448e+00 9.71794e-01 9.89911e+01 137.089 -4.13328e+00 3.84242e+00  0.00000e+00 0.00000e+00 1.56853e+01 137.089 8.33058e+01 317.088 0.9064 
1 1 1 2   76  13 o 12 1.17780e+01 9.11011e-01 1.44627e+02 72.376  9.10024e+00  2.86458e+01  0.00000e+00 0.00000e+00 2.85417e+02 72.376  1.40790e+02 72.376  0.9832 
1 1 1 2   76  14 o 11 8.87116e+00 1.19924e+00 1.81885e+02 313.535 1.83190e+01  -1.92808e+01 0.00000e+00 0.00000e+00 1.41055e+02 313.535 4.08295e+01 133.535 0.9810 
1 1 1 2   76  15 o 4  3.46507e+00 1.10786e+00 4.82152e+01 230.678 -2.14880e+00 -2.62326e+00 0.00000e+00 0.00000e+00 5.90895e+01 230.678 1.08744e+01 230.678 0.8352 
1 1 1 2   76  16 o 1  2.85417e+00 9.93265e-01 4.60173e+01 94.053  -2.50050e-01 3.52887e+00  0.00000e+00 0.00000e+00 4.31228e+01 94.053  2.89455e+00 274.053 0.8431 
1 1 1 2   77  0  o 15 2.48624e+01 6.71323e-01 3.89988e+02 117.710 -3.29592e+01 6.27513e+01  0.00000e+00 0.00000e+00 5.30339e+02 117.710 1.40351e+02 117.710 0.9929 
1 1 1 2   77  1  o 5  2.17793e+01 6.48383e-01 3.94170e+02 295.248 2.70465e+01  -5.73508e+01 0.00000e+00 0.00000e+00 4.11392e+02 295.248 1.72225e+01 295.248 0.9921 
1 1 1 2   77  2  o 19 1.63624e+01 6.93637e-01 3.83320e+02 49.980  2.89345e+01  3.44589e+01  0.00000e+00 0.00000e+00 2.19888e+02 49.980  1.63432e+02 229.980 0.9888 
1 1 1 2   77  3  o 16 1.22176e+01 7.11049e-01 2.89062e+02 109.392 -9.54502e+00 2.71164e+01  0.00000e+00 0.00000e+00 1.58413e+02 109.392 1.30649e+02 289.392 0.9825 
1 1 1 2   77  4  o 16 6.40433e+00 5.95133e-01 1.07672e+02 62.632  2.70749e+00  5.23046e+00  0.00000e+00 0.00000e+00 1.09708e+02 62.632  2.03566e+00 62.632  0.9106 
1 1 1 2   77  5  o 12 6.83205e+00 5.55080e-01 1.47538e+02 223.211 -6.71792e+00 -6.31089e+00 0.00000e+00 0.00000e+00 9.28389e+01 223.211 5.46987e+01 43.211  0.9441 
1 1 1 2   77  6  o 13 1.21161e+01 4.97342e-01 1.73883e+02 51.579  1.43600e+01  1.81039e+01  0.00000e+00 0.00000e+00 2.67660e+02 51.579  9.37767e+01 51.579  0.9781 
1 1 1 2   77  7  o 5  4.86369e+00 7.32799e-01 7.98797e+01 209.346 -3.43373e+00 -1.93051e+00 0.00000e+00 0.00000e+00 7.61192e+01 209.346 3.76052e+00 29.346  0.8611 
1 1 1 2   77  8  o 18 5.39194e+00 7.59979e-01 6.93642e+01 14.276  4.27903e+00  1.08881e+00  0.00000e+00 0.00000e+00 1.06854e+02 14.276  3.74902e+01 14.276  0.8778 
1 1 1 2   77  9  o 10 1.00447e+01 6.12412e-01 1.54395e+02 35.545  1.73164e+01  1.23723e+01  0.00000e+00 0.00000e+00 2.10534e+02 35.545  5.61389e+01 35.545  0.9762 
1 1 1 2   77  10 o 10 4.23054e+00 9.57675e-01 1.23950e+02 148.070 -6.15990e+00 3.83873e+00  0.00000e+00 0.00000e+00 2.21320e+01 148.070 1.01818e+02 328.070 0.9283 
1 1 1 2   77  11 o 14 1.53146e+01 6.76808e-01 2.53162e+02 330.187 5.56098e+01  -3.18641e+01 0.00000e+00 0.00000e+00 3.11718e+02 330.187 5.85559e+01 330.187 0.9922 
1 1 1 2   77  12 o 1  1.85688e+01 7.18904e-01 2.40243e+02 124.231 -4.64700e+01 6.82988e+01  0.00000e+00 0.00000e+00 4.45458e+02 124.231 2.05216e+02 124.231 0.9939 
1 1 1 2   77  13 o 7  9.78870e+00 1.01850e+00 1.73003e+02 305.153 1.65606e+01  -2.35174e+01 0.00000e+00 0.00000e+00 1.84054e+02 305.153 1.10515e+01 305.153 0.9825 
1 1 1 2   77  14 o 16 4.87386e+00 1.23167e+00 6.42751e+01 77.800  1.05251e+00  4.86806e+00  0.00000e+00 0.00000e+00 9.71848e+01 77.800  3.29098e+01 77.800  0.8929 
1 1 1 2   77  15 o 16 3.31342e+00 1.07693e+00 7.81753e+01 176.312 -5.45540e+00 3.51676e-01  0.00000e+00 0.00000e+00 3.27624e+01 176.312 4.54129e+01 356.311 0.9032 
1 1 1 2   77  16 o 14 8.25208e+00 1.59447e+00 1.28183e+02 229.323 -1.04978e+01 -1.22146e+01 0.00000e+00 0.00000e+00 1.67812e+02 229.323 3.96285e+01 229.323 0.9684 
1 1 1 2   78  0  o 16 7.08827e+00 6.44241e-01 1.42274e+02 110.806 -2.59094e+00 6.81858e+00  0.00000e+00 0.00000e+00 1.03083e+02 110.806 3.91919e+01 290.806 0.9287 
1 1 1 2   78  1  o 12 3.37780e+00 8.60616e-01 8.45169e+01 62.357  9.16125e-01  1.74922e+00  0.00000e+00 0.00000e+00 2.80658e+00 62.357  8.17104e+01 242.357 0.6936 
1 1 1 2   78  2  f 0  1.19761e+01 6.90747e-01 1.23660e+02 23.045  1.11462e+01  4.74169e+00  0.00000e+00 0.00000e+00 3.03898e+02 23.045  1.80237e+02 23.045  0.9578 
1 1 1 2   78  3  o 17 1.36148e+01 7.06740e-01 2.40494e+02 22.087  2.54023e+01  1.03079e+01  0.00000e+00 0.00000e+00 2.57608e+02 22.087  1.71142e+01 22.087  0.9816 
1 1 1 2   78  4  o 7  8.09839e+00 6.25550e-01 1.67615e+02 142.979 -9.79184e+00 7.38429e+00  0.00000e+00 0.00000e+00 1.21606e+02 142.979 4.60094e+01 322.979 0.9583 
1 1 1 2   78  5  o 16 6.63731e+00 5.64346e-01 1.26670e+02 281.614 1.65092e+00  -8.03234e+00 0.00000e+00 0.00000e+00 1.05023e+02 281.614 2.16463e+01 101.614 0.9369 
1 1 1 2   78  6  o 16 9.79998e+00 5.30341e-01 1.35064e+02 56.072  8.27133e+00  1.22961e+01  0.00000e+00 0.00000e+00 2.17443e+02 56.072  8.23790e+01 56.072  0.9656 
1 1 1 2   78  7  o 15 4.81853e+00 7.44446e-01 5.23258e+01 134.095 -2.01131e+00 2.07588e+00  0.00000e+00 0.00000e+00 9.14981e+01 134.095 3.91722e+01 134.095 0.8015 
1 1 1 2   78  8  o 13 1.34735e+01 5.44855e-01 2.94640e+02 41.402  3.94198e+01  3.47556e+01  0.00000e+00 0.00000e+00 2.02103e+02 41.402  9.25372e+01 221.402 0.9904 
1 1 1 2   78  9  o 19 1.10495e+01 5.83559e-01 2.25465e+02 175.379 -3.78419e+01 3.05873e+00  0.00000e+00 0.00000e+00 1.80211e+02 175.379 4.52535e+01 355.379 0.9867 
1 1 1 2   78  10 o 11 5.31951e+00 8.52143e-01 1.35081e+02 339.695 9.84100e+00  -3.64123e+00 0.00000e+00 0.00000e+00 5.30700e+01 339.695 8.20112e+01 159.695 0.9511 
1 1 1 2   78  11 o 2  4.79056e+00 1.05630e+00 6.58070e+01 235.250 -2.64421e+00 -3.81162e+00 0.00000e+00 0.00000e+00 9.16448e+01 235.250 2.58378e+01 235.250 0.8843 
1 1 1 2   78  12 o 10 3.65829e+00 1.03980e+00 4.13387e+01 97.378  -3.05712e-01 2.36108e+00  0.00000e+00 0.00000e+00 6.07651e+01 97.378  1.94264e+01 97.378  0.7514 
1 1 1 2   78  13 o 7  4.63801e+00 1.17628e+00 8.26185e+01 24.694  5.49699e+00  2.52767e+00  0.00000e+00 0.00000e+00 7.45886e+01 24.694  8.02991e+00 204.694 0.9131 
1 1 1 2   78  14 o 19 4.67422e+00 1.25384e+00 2.69129e+01 198.682 -1.96173e+00 -6.63307e-01 0.00000e+00 0.00000e+00 9.60236e+01 198.682 6.91106e+01 198.682 0.7091 
1 1 1 2   78  15 o 8  3.30031e+00 1.08642e+00 6.50406e+01 11.588  4.34787e+00  8.91523e-01  0.00000e+00 0.00000e+00 4.24138e+01 11.588  2.26268e+01 191.588 0.8785 
1 1 1 2   79  0  f 0  1.40870e+01 5.64694e-01 1.63473e+02 197.590 -1.83828e+01 -5.82783e+00 0.00000e+00 0.00000e+00 3.47679e+02 197.590 1.84207e+02 197.590 0.9737 
1 1 1 2   79  1  o 16 4.38569e+00 8.06404e-01 1.21695e+02 233.679 -2.51256e+00 -3.41782e+00 0.00000e+00 0.00000e+00 2.08610e+01 233.679 1.00834e+02 53.679  0.8722 
1 1 1 2   79  2  o 13 6.92170e+00 8.86355e-01 1.23180e+02 122.335 -3.36097e+00 5.30926e+00  0.00000e+00 0.00000e+00 1.13242e+02 122.335 9.93790e+00 302.335 0.9166 
1 1 1 2   79  3  o 6  8.57056e+00 6.54523e-01 1.84492e+02 137.331 -9.93050e+00 9.15378e+00  0.00000e+00 0.00000e+00 1.22817e+02 137.331 6.16751e+01 317.331 0.9622 
1 1 1 2   79  4  o 4  3.18986e+00 7.88418e-01 5.22488e+01 208.537 -1.27016e+00 -6.90708e-01 0.00000e+00 0.00000e+00 1.69753e+01 208.537 3.52736e+01 28.537  0.5825 
1 1 1 2   79  5  o 7  1.92396e+01 6.00072e-01 3.54324e+02 57.748  3.90569e+01  6.18974e+01  0.00000e+00 0.00000e+00 3.57466e+02 57.748  3.14209e+00 57.748  0.9931 
1 1 1 2   79  6  o 16 1.69495e+01 4.98657e-01 2.57362e+02 275.867 5.11989e+00  -4.98254e+01 0.00000e+00 0.00000e+00 3.67537e+02 275.867 1.10176e+02 275.867 0.9900 
1 1 1 2   79  7  o 17 1.03384e+01 5.44320e-01 1.50100e+02 269.533 -1.69547e-01 -2.08231e+01 0.00000e+00 0.00000e+00 2.25443e+02 269.533 7.53430e+01 269.533 0.9757 
1 1 1 2   79  8  o 8  2.01644e+01 5.49745e-01 3.18101e+02 116.688 -4.10505e+01 8.16608e+01  0.00000e+00 0.00000e+00 4.28223e+02 116.688 1.10122e+02 116.688 0.9945 
1 1 1 2   79  9  f 0  8.73586e+00 6.62785e-01 9.38359e+01 204.949 -1.05519e+01 -4.90895e+00 0.00000e+00 0.00000e+00 2.16844e+02 204.949 1.23008e+02 204.949 0.9560 
1 1 1 2   79  10 o 18 5.87254e+00 8.65817e-01 8.90817e+01 337.248 7.28466e+00  -3.05502e+00 0.00000e+00 0.00000e+00 1.14937e+02 337.248 2.58554e+01 337.248 0.9344 
1 1 1 2   79  11 o 13 5.49979e+00 1.03763e+00 1.04172e+02 154.463 -7.81035e+00 3.73148e+00  0.00000e+00 0.00000e+00 8.80061e+01 154.463 1.61660e+01 334.463 0.9403 
1 1 1 2   79  12 o 5  1.31690e+01 7.88391e-01 2.27395e+02 9.940   5.58392e+01  9.78534e+00  0.00000e+00 0.00000e+00 2.57330e+02 9.940   2.99348e+01 9.940   0.9911 
1 1 1 2   79  13 o 4  1.53867e+01 8.50066e-01 2.99670e+02 149.580 -7.94407e+01 4.66457e+01  0.00000e+00 0.00000e+00 2.68251e+02 149.580 3.14189e+01 329.579 0.9946 
1 1 1 2   79  14 o 16 3.85150e+00 1.12922e+00 5.00192e+01 176.654 -3.67119e+00 2.14627e-01  0.00000e+00 0.00000e+00 7.13665e+01 176.654 2.13473e+01 176.654 0.8499 
1 1 1 2   79  15 o 11 3.19832e+00 1.05610e+00 2.29576e+01 54.958  1.01426e+00  1.44627e+00  0.00000e+00 0.00000e+00 5.47205e+01 54.958  3.17629e+01 54.958  0.6554 
1 1 1 2   80  0  o 9  2.47209e+01 6.51579e-01 3.79297e+02 218.333 -6.22781e+01 -4.92430e+01 0.00000e+00 0.00000e+00 5.35904e+02 218.333 1.56606e+02 218.333 0.9937 
1 1 1 2   80  1  o 2  1.71733e+01 5.78862e-01 3.12923e+02 340.429 4.34180e+01  -1.54359e+01 0.00000e+00 0.00000e+00 3.19948e+02 340.429 7.02566e+00 340.429 0.9891 
1 1 1 2   80  2  o 7  3.45586e+00 9.06303e-01 1.24492e+02 106.362 -9.74479e-01 3.31904e+00  0.00000e+00 0.00000e+00 1.64706e+01 286.362 1.40962e+02 286.362 0.8389 
1 1 1 2   80  3  o 10 9.25379e+00 5.74009e-01 2.09922e+02 222.845 -1.29774e+01 -1.20364e+01 0.00000e+00 0.00000e+00 1.24947e+02 222.845 8.49746e+01 42.845  0.9713 
1 1 1 2   80  4  f 0  3.49218e+00 8.25561e-01 1.00703e+02 165.212 -3.10913e+00 8.20748e-01  0.00000e+00 0.00000e+00 6.58457e+00 165.212 9.41180e+01 345.212 0.8247 
1 1 1 2   80  5  o 1  5.34105e+00 8.64756e-01 6.60509e+01 99.802  -6.13332e-01 3.55025e+00  0.00000e+00 0.00000e+00 1.02294e+02 99.802  3.62429e+01 99.802  0.8463 
1 1 1 2   80  6  o 9  9.07746e+00 6.55545e-01 2.14022e+02 255.964 -5.29213e+00 -2.11687e+01 0.00000e+00 0.00000e+00 1.16128e+02 255.964 9.78935e+01 75.964  0.9768 
1 1 1 2   80  7  o 2  6.55273e+00 6.51436e-01 1.03295e+02 177.819 -8.26418e+00 3.14703e-01  0.00000e+00 0.00000e+00 1.25351e+02 177.819 2.20565e+01 177.819 0.9374 
1 1 1 2   80  8  o 17 2.48105e+00 7.27196e-01 7.85908e+01 244.504 -1.16820e+00 -2.44966e+00 0.00000e+00 0.00000e+00 5.99486e+00 64.504  8.45857e+01 64.504  0.7864 
1 1 1 2   80  9  o 19 2.32466e+00 7.45606e-01 1.93082e+01 162.737 -6.55389e-01 2.03666e-01  0.00000e+00 0.00000e+00 8.74009e+00 162.737 1.05681e+01 342.737 0.3244 
1 1 1 2   80  10 o 13 6.05109e+00 9.13117e-01 1.00082e+02 1.019   9.34110e+00  1.66080e-01  0.00000e+00 0.00000e+00 1.12453e+02 1.019   1.23715e+01 1.019   0.9449 
1 1 1 2   80  11 o 11 3.71852e+00 9.86556e-01 4.48434e+01 16.990  2.54080e+00  7.76306e-01  0.00000e+00 0.00000e+00 6.30557e+01 16.990  1.82124e+01 16.990  0.7810 
1 1 1 2   80  12 o 8  6.01853e+00 1.13414e+00 1.08882e+02 143.559 -7.87109e+00 5.81184e+00  0.00000e+00 0.00000e+00 1.02833e+02 143.559 6.04946e+00 323.559 0.9474 
1 1 1 2   80  13 o 12 6.51510e+00 1.23468e+00 9.38054e+01 342.910 8.98416e+00  -2.76219e+00 0.00000e+00 0.00000e+00 1.34683e+02 342.910 4.08777e+01 342.910 0.9452 
1 1 1 2   80  14 o 6  4.19261e+00 1.20347e+00 6.39284e+01 322.973 4.04360e+00  -3.05003e+00 0.00000e+00 0.00000e+00 7.51749e+01 322.973 1.12465e+01 322.973 0.8949 
1 1 1 2   80  15 o 10 3.42130e+00 1.12073e+00 4.13104e+01 66.877  1.18255e+00  2.76937e+00  0.00000e+00 0.00000e+00 6.14575e+01 66.877  2.01472e+01 66.877  0.8108 
1 1 1 2   81  0  o 4  4.36300e+00 8.26610e-01 9.70846e+01 131.052 -2.40113e+00 2.75717e+00  0.00000e+00 0.00000e+00 4.08684e+01 131.052 5.62162e+01 311.051 0.8489 
1 1 1 2   81  1  o 17 3.08951e+00 8.04112e-01 1.32561e+02 146.790 -2.97038e+00 1.94448e+00  0.00000e+00 0.00000e+00 3.54652e+01 326.790 1.68026e+02 326.790 0.8437 
1 1 1 2   81  2  o 10 1.23106e+01 5.15539e-01 2.94279e+02 92.585  -1.50522e+00 3.33381e+01  0.00000e+00 0.00000e+00 1.57367e+02 92.585  1.36912e+02 272.585 0.9849 
1 1 1 2   81  3  o 10 3.35228e+00 8.30736e-01 8.82037e+01 106.989 -7.79957e-01 2.55291e+00  0.00000e+00 0.00000e+00 9.46830e+00 106.989 7.87354e+01 286.989 0.7822 
1 1 1 2   81  4  o 3  4.81052e+00 7.62268e-01 1.06339e+02 237.366 -2.83353e+00 -4.42483e+00 0.00000e+00 0.00000e+00 5.47149e+01 237.366 5.16242e+01 57.366  0.8990 
1 1 1 2   81  5  o 13 1.42167e+01 8.08128e-01 2.67160e+02 333.795 3.41417e+01  -1.68037e+01 0.00000e+00 0.00000e+00 2.55196e+02 333.795 1.19641e+01 153.795 0.9868 
1 1 1 2   81  6  o 15 1.05208e+01 6.34896e-01 1.76319e+02 188.612 -2.29453e+01 -3.47528e+00 0.00000e+00 0.00000e+00 2.06789e+02 188.612 3.04703e+01 188.612 0.9782 
1 1 1 2   81  7  o 4  6.72088e+00 8.34784e-01 1.08924e+02 342.977 8.43534e+00  -2.58259e+00 0.00000e+00 0.00000e+00 1.26552e+02 342.977 1.76276e+01 342.977 0.9415 
1 1 1 2   81  8  o 16 3.87717e+00 8.63313e-01 1.10232e+02 31.175  4.73598e+00  2.86542e+00  0.00000e+00 0.00000e+00 2.02203e+01 31.175  9.00117e+01 211.175 0.9045 
1 1 1 2   81  9  o 6  1.26676e+01 5.81099e-01 2.21201e+02 145.438 -3.75125e+01 2.58410e+01  0.00000e+00 0.00000e+00 2.44623e+02 145.438 2.34220e+01 145.438 0.9890 
1 1 1 2   81  10 o 16 6.97832e+00 8.48644e-01 1.31213e+02 260.002 -2.58513e+00 -1.46641e+01 0.00000e+00 0.00000e+00 1.19268e+02 260.002 1.19450e+01 80.002  0.9658 
1 1 1 2   81  11 o 4  7.73209e+00 8.70103e-01 1.50102e+02 323.480 1.56284e+01  -1.15728e+01 0.00000e+00 0.00000e+00 1.29614e+02 323.480 2.04876e+01 143.480 0.9739 
1 1 1 2   81  12 o 5  6.06276e+00 1.12656e+00 1.52411e+02 94.145  -1.03052e+00 1.42206e+01  0.00000e+00 0.00000e+00 6.46024e+01 94.145  8.78084e+01 274.145 0.9643 
1 1 1 2   81  13 o 6  4.59904e+00 1.16820e+00 5.94722e+01 344.573 4.48160e+00  -1.23674e+00 0.00000e+00 0.00000e+00 9.14362e+01 344.573 3.19640e+01 344.573 0.8846 
1 1 1 2   81  14 o 8  7.35441e+00 1.25736e+00 1.68416e+02 105.463 -5.97012e+00 2.15823e+01  0.00000e+00 0.00000e+00 9.80384e+01 105.463 7.03773e+01 285.463 0.9774 
1 1 1 2   81  15 f 0  3.48668e+00 1.13017e+00 2.80771e+01 342.997 2.01048e+00  -6.14781e-01 0.00000e+00 0.00000e+00 6.41145e+01 342.997 3.60374e+01 342.997 0.7139 
1 1 1 2   82  0  o 8  5.40652e+00 7.62264e-01 1.32049e+02 155.051 -5.65250e+00 2.62972e+00  0.00000e+00 0.00000e+00 5.23481e+01 155.051 7.97011e+01 335.051 0.9159 
1 1 1 2   82  1  o 18 4.43307e+00 8.23614e-01 7.73105e+01 199.265 -2.78154e+00 -9.72175e-01 0.00000e+00 0.00000e+00 5.57495e+01 199.265 2.15610e+01 19.265  0.8060 
1 1 1 2   82  2  o 19 2.00196e+01 5.23617e-01 3.84210e+02 349.958 7.35193e+01  -1.30191e+01 0.00000e+00 0.00000e+00 3.56343e+02 349.958 2.78673e+01 169.958 0.9933 
1 1 1 2   82  3  o 15 1.45106e+01 4.92587e-01 2.28942e+02 156.564 -3.01133e+01 1.30537e+01  0.00000e+00 0.00000e+00 3.03121e+02 156.564 7.41790e+01 156.564 0.9846 
1 1 1 2   82  4  o 5  1.07771e+01 5.75142e-01 1.39348e+02 296.748 7.48965e+00  -1.48604e+01 0.00000e+00 0.00000e+00 2.49676e+02 296.748 1.10329e+02 296.748 0.9695 
1 1 1 2   82  5  o 6  6.23082e+00 9.63230e-01 1.61688e+02 74.390  2.55759e+00  9.15402e+00  0.00000e+00 0.00000e+00 5.77009e+01 74.390  1.03987e+02 254.390 0.9458 
1 1 1 2   82  6  o 3  5.74148e+00 8.00423e-01 8.96428e+01 10.371  6.23940e+00  1.14194e+00  0.00000e+00 0.00000e+00 1.06385e+02 10.371  1.67419e+01 10.371  0.9174 
1 1 1 2   82  7  o 3  3.59203e+00 8.96535e-01 1.00242e+02 202.930 -4.17003e+00 -1.76406e+00 0.00000e+00 0.00000e+00 1.75162e+01 202.930 8.27260e+01 22.930  0.8811 
1 1 1 2   82  8  o 14 9.25190e+00 7.74585e-01 1.86868e+02 95.906  -2.46397e+00 2.38184e+01  0.00000e+00 0.00000e+00 1.49960e+02 95.906  3.69083e+01 275.906 0.9789 
1 1 1 2   82  9  o 10 5.06310e+00 8.84132e-01 8.60393e+01 265.310 -5.12974e-01 -6.25348e+00 0.00000e+00 0.00000e+00 8.64510e+01 265.310 4.11693e-01 265.310 0.9164 
1 1 1 2   82  10 o 10 7.86239e+00 8.08256e-01 1.29592e+02 158.192 -1.59446e+01 6.37990e+00  0.00000e+00 0.00000e+00 1.53910e+02 158.192 2.43172e+01 158.192 0.9704 
1 1 1 2   82  11 o 14 3.34088e+00 9.43425e-01 2.42102e+01 239.572 -6.27223e-01 -1.06788e+00 0.00000e+00 0.00000e+00 4.08663e+01 239.572 1.66561e+01 239.572 0.5245 
1 1 1 2   82  12 o 4  4.01632e+00 1.06220e+00 5.67988e+01 12.821  3.67277e+00  8.35868e-01  0.00000e+00 0.00000e+00 7.04816e+01 12.821  1.36827e+01 12.821  0.8539 
1 1 1 2   82  13 f 0  6.49416e+00 1.28187e+00 6.78205e+01 92.340  -2.79997e-01 6.85262e+00  0.00000e+00 0.00000e+00 1.54705e+02 92.340  8.68841e+01 92.340  0.9239 
1 1 1 2   82  14 o 17 3.95921e+00 1.18599e+00 6.19288e+01 302.444 2.50035e+00  -3.93325e+00 0.00000e+00 0.00000e+00 6.79055e+01 302.444 5.97677e+00 302.444 0.8849 
1 1 1 2   82  15 o 15 3.35694e+00 1.08852e+00 6.11494e+01 67.344  1.84483e+00  4.41984e+00  0.00000e+00 0.00000e+00 4.92672e+01 67.344  1.18822e+01 247.344 0.8883 
1 1 1 2   83  0  o 15 8.16783e+00 5.66940e-01 1.92787e+02 90.169  -4.46010e-02 1.51410e+01  0.00000e+00 0.00000e+00 1.01095e+02 90.169  9.16925e+01 270.169 0.9664 
1 1 1 2   83  1  o 10 1.21562e+01 5.05610e-01 2.63426e+02 354.671 3.14317e+01  -2.93158e+00 0.00000e+00 0.00000e+00 1.81966e+02 354.671 8.14604e+01 174.672 0.9840 
1 1 1 2   83  2  o 18 1.20937e+01 5.17491e-01 1.98444e+02 222.606 -1.73701e+01 -1.59758e+01 0.00000e+00 0.00000e+00 2.42197e+02 222.606 4.37532e+01 222.606 0.9786 
1 1 1 2   83  3  o 5  8.57727e+00 5.69033e-01 1.64036e+02 132.036 -9.98073e+00 1.10707e+01  0.00000e+00 0.00000e+00 1.44396e+02 132.036 1.96401e+01 312.036 0.9659 
1 1 1 2   83  4  o 1  6.54685e+00 6.40654e-01 5.66947e+01 258.593 -8.14556e-01 -4.03709e+00 0.00000e+00 0.00000e+00 1.54828e+02 258.593 9.81332e+01 258.593 0.8679 
1 1 1 2   83  5  o 16 1.16181e+01 7.59383e-01 2.18441e+02 114.413 -1.19534e+01 2.63352e+01  0.00000e+00 0.00000e+00 2.06421e+02 114.413 1.20203e+01 294.413 0.9826 
1 1 1 2   83  6  o 6  5.37717e+00 8.31999e-01 7.25091e+01 157.561 -4.53202e+00 1.87158e+00  0.00000e+00 0.00000e+00 1.05778e+02 157.561 3.32693e+01 157.561 0.8911 
1 1 1 2   83  7  f 0  2.73034e+00 7.89064e-01 1.12144e+02 266.082 -2.70479e-01 -3.94883e+00 0.00000e+00 0.00000e+00 2.46097e+01 86.082  1.36754e+02 86.082  0.8619 
1 1 1 2   83  8  o 7  4.08077e+00 9.10226e-01 2.90354e+01 156.183 -1.57423e+00 6.94885e-01  0.00000e+00 0.00000e+00 6.90106e+01 156.183 3.99752e+01 156.183 0.6462 
1 1 1 2   83  9  o 4  3.36180e+00 9.23406e-01 7.17069e+01 200.161 -3.11181e+00 -1.14252e+00 0.00000e+00 0.00000e+00 3.21013e+01 200.161 3.96057e+01 20.161  0.8308 
1 1 1 2   83  10 o 3  8.61922e+00 8.45133e-01 9.66210e+01 170.419 -1.38169e+01 2.33215e+00  0.00000e+00 0.00000e+00 2.11921e+02 170.419 1.15300e+02 170.419 0.9636 
1 1 1 2   83  11 o 4  3.67194e+00 1.00618e+00 5.69327e+01 20.510  3.10236e+00  1.16054e+00  0.00000e+00 0.00000e+00 5.63111e+01 20.510  6.21558e-01 200.510 0.8307 
1 1 1 2   83  12 o 14 3.99410e+00 1.03327e+00 3.57165e+01 283.148 5.64528e-01  -2.41677e+00 0.00000e+00 0.00000e+00 7.73590e+01 283.148 4.16426e+01 283.148 0.7630 
1 1 1 2   83  13 o 6  2.82297e+00 9.32683e-01 1.06275e+01 323.843 4.80184e-01  -3.50894e-01 0.00000e+00 0.00000e+00 1.91986e+01 323.843 8.57112e+00 323.843 0.2849 
1 1 1 2   83  14 f 0  5.30936e+00 1.28391e+00 1.00731e+02 6.957   9.40116e+00  1.14710e+00  0.00000e+00 0.00000e+00 8.52929e+01 6.957   1.54377e+01 186.957 0.9456 
1 1 1 2   84  0  o 8  1.17648e+01 4.96454e-01 2.61813e+02 130.301 -1.96476e+01 2.31668e+01  0.00000e+00 0.00000e+00 1.68842e+02 130.301 9.29715e+01 310.301 0.9834 
1 1 1 2   84  1  o 13 3.07624e+00 7.15820e-01 8.77403e+01 127.465 -1.70859e+00 2.22949e+00  0.00000e+00 0.00000e+00 3.27488e+00 127.465 8.44654e+01 307.465 0.7948 
1 1 1 2   84  2  o 5  1.01359e+01 5.09884e-01 1.48894e+02 159.150 -1.51297e+01 5.76249e+00  0.00000e+00 0.00000e+00 2.16569e+02 159.150 6.76753e+01 159.150 0.9686 
1 1 1 2   84  3  o 3  3.07950e+00 7.25485e-01 6.87793e+01 272.890 1.09649e-01  -2.17196e+00 0.00000e+00 0.00000e+00 1.42642e+01 272.890 5.45151e+01 92.890  0.7245 
1 1 1 2   84  4  o 13 4.58011e+00 6.99929e-01 6.20803e+01 69.393  1.10949e+00  2.95064e+00  0.00000e+00 0.00000e+00 7.78055e+01 69.393  1.57252e+01 69.393  0.8206 
1 1 1 2   84  5  o 4  5.72357e+00 7.58253e-01 6.05879e+01 113.891 -1.75980e+00 3.97286e+00  0.00000e+00 0.00000e+00 1.25890e+02 113.891 6.53024e+01 113.891 0.8756 
1 1 1 2   84  6  o 5  7.01264e+00 7.69685e-01 1.65439e+02 292.303 5.79662e+00  -1.41314e+01 0.00000e+00 0.00000e+00 8.67437e+01 292.303 7.86953e+01 112.303 0.9667 
1 1 1 2   84  7  o 18 1.11235e+01 7.25132e-01 1.58927e+02 200.774 -2.25920e+01 -8.56996e+00 0.00000e+00 0.00000e+00 2.46089e+02 200.774 8.71625e+01 200.774 0.9791 
1 1 1 2   84  8  o 1  1.66850e+01 6.96283e-01 3.40517e+02 8.562   8.81223e+01  1.32669e+01  0.00000e+00 0.00000e+00 2.76250e+02 8.562   6.42665e+01 188.562 0.9944 
1 1 1 2   84  9  o 13 3.97134e+00 1.03117e+00 8.89957e+01 260.562 -7.82497e-01 -4.70753e+00 0.00000e+00 0.00000e+00 4.20172e+01 260.562 4.69785e+01 80.562  0.8878 
1 1 1 2   84  10 o 6  6.69106e+00 1.07068e+00 1.02046e+02 101.423 -2.05022e+00 1.01467e+01  0.00000e+00 0.00000e+00 1.34130e+02 101.423 3.20840e+01 101.423 0.9504 
1 1 1 2   84  11 f 0  3.99076e+00 1.07311e+00 9.95315e+01 152.507 -5.19705e+00 2.70463e+00  0.00000e+00 0.00000e+00 3.52844e+01 152.507 6.42471e+01 332.507 0.9101 
1 1 1 2   84  12 o 13 3.38404e+00 1.01371e+00 3.40760e+01 318.954 1.63582e+00  -1.42430e+00 0.00000e+00 0.00000e+00 5.67676e+01 318.954 2.26916e+01 318.954 0.7237 
1 1 1 2   84  13 o 13 6.55096e+00 1.07643e+00 5.77736e+01 51.441  4.44169e+00  5.57212e+00  0.00000e+00 0.00000e+00 1.67323e+02 51.441  1.09550e+02 51.441  0.9269 
1 1 1 2   84  14 o 8  3.30036e+00 1.08223e+00 7.80533e+01 293.319 2.11390e+00  -4.90388e+00 0.00000e+00 0.00000e+00 3.20630e+01 293.319 4.59903e+01 113.319 0.9007 
1 1 1 2   85  0  o 15 1.94944e+01 4.61826e-01 3.61544e+02 99.192  -1.21794e+01 7.52606e+01  0.00000e+00 0.00000e+00 3.59159e+02 99.192  2.38475e+00 279.192 0.9934 
1 1 1 2   85  1  o 6  6.56647e+00 5.17462e-01 1.38292e+02 227.906 -6.83170e+00 -7.56239e+00 0.00000e+00 0.00000e+00 9.37708e+01 227.906 4.45208e+01 47.906  0.9496 
1 1 1 2   85  2  o 13 1.47086e+01 4.98524e-01 2.19390e+02 146.769 -2.92626e+01 1.91714e+01  0.00000e+00 0.00000e+00 3.20125e+02 146.769 1.00735e+02 146.769 0.9856 
1 1 1 2   85  3  o 19 9.71414e+00 5.32430e-01 2.21917e+02 30.072  1.98571e+01  1.14979e+01  0.00000e+00 0.00000e+00 1.31612e+02 30.072  9.03048e+01 210.072 0.9780 
1 1 1 2   85  4  o 5  4.77344e+00 7.61471e-01 6.10085e+01 231.833 -2.16115e+00 -2.74956e+00 0.00000e+00 0.00000e+00 8.83560e+01 231.833 2.73475e+01 231.833 0.8410 
1 1 1 2   85  5  o 7  2.19137e+00 6.77789e-01 7.84449e+01 131.557 -1.38013e+00 1.55686e+00  0.00000e+00 0.00000e+00 2.05186e+01 311.557 9.89635e+01 311.557 0.7106 
1 1 1 2   85  6  o 14 6.10820e+00 7.12200e-01 1.21308e+02 198.274 -9.49083e+00 -3.13399e+00 0.00000e+00 0.00000e+00 9.41831e+01 198.274 2.71251e+01 18.274  0.9486 
1 1 1 2   85  7  o 18 3.24440e+00 9.47690e-01 3.07768e+01 341.830 1.21974e+00  -4.00320e-01 0.00000e+00 0.00000e+00 3.41154e+01 341.830 3.33869e+00 341.830 0.5380 
1 1 1 2   85  8  o 4  2.95345e+00 8.81230e-01 6.97932e+01 350.198 2.92627e+00  -5.05537e-01 0.00000e+00 0.00000e+00 1.88676e+01 350.198 5.09255e+01 170.198 0.8077 
1 1 1 2   85  9  o 16 9.19592e+00 8.76796e-01 1.43012e+02 214.276 -1.63890e+01 -1.11698e+01 0.00000e+00 0.00000e+00 1.89885e+02 214.276 4.68732e+01 214.276 0.9745 
1 1 1 2   85  10 o 19 4.13526e+00 1.07788e+00 6.27392e+01 19.943  3.62969e+00  1.31698e+00  0.00000e+00 0.00000e+00 6.89982e+01 19.943  6.25903e+00 19.943  0.8580 
1 1 1 2   85  11 o 9  6.35073e+00 1.22868e+00 1.51242e+02 185.573 -1.36338e+01 -1.33032e+00 0.00000e+00 0.00000e+00 7.56622e+01 185.573 7.55800e+01 5.573   0.9628 
1 1 1 2   85  12 o 3  5.10012e+00 1.26759e+00 6.27718e+01 290.222 1.65401e+00  -4.49002e+00 0.00000e+00 0.00000e+00 1.05220e+02 290.222 4.24477e+01 290.222 0.8881 
1 1 1 2   85  13 o 3  5.67633e+00 1.31566e+00 9.85987e+01 185.544 -9.32084e+00 -9.04673e-01 0.00000e+00 0.00000e+00 1.00205e+02 185.544 1.60595e+00 185.544 0.9450 
1 1 1 2   85  14 o 18 3.89002e+00 1.16737e+00 3.43711e+01 277.816 3.93747e-01  -2.86836e+00 0.00000e+00 0.00000e+00 8.11583e+01 277.816 4.67872e+01 277.816 0.8019 
1 1 1 2   86  0  o 13 5.04997e+00 5.83162e-01 1.88725e+02 356.272 1.01130e+01  -6.58882e-01 0.00000e+00 0.00000e+00 1.03625e+01 176.272 1.99088e+02 176.272 0.9493 
1 1 1 2   86  1  f 0  4.92513e+00 5.92896e-01 8.41255e+01 60.475  2.29225e+00  4.04734e+00  0.00000e+00 0.00000e+00 7.79831e+01 60.475  6.14245e+00 240.475 0.8846 
1 1 1 2   86  2  o 3  1.66428e+01 4.56371e-01 2.50422e+02 99.038  -7.07236e+00 4.44604e+01  0.00000e+00 0.00000e+00 3.61894e+02 99.038  1.11473e+02 99.038  0.9888 
1 1 1 2   86  3  f 0  1.46508e+01 5.11886e-01 2.43217e+02 284.748 1.10791e+01  -4.20879e+01 0.00000e+00 0.00000e+00 2.95563e+02 284.748 5.23466e+01 284.748 0.9884 
1 1 1 2   86  4  o 12 3.13691e+00 7.96478e-01 2.73134e+01 238.857 -5.46512e-01 -9.04443e-01 0.00000e+00 0.00000e+00 2.70807e+01 238.857 2.32769e-01 58.857  0.4661 
1 1 1 2   86  5  f 0  4.35508e+00 7.97720e-01 8.26193e+01 30.673  3.77379e+00  2.23831e+00  0.00000e+00 0.00000e+00 5.94229e+01 30.673  2.31964e+01 210.673 0.8769 
1 1 1 2   86  6  o 2  1.03659e+01 5.82388e-01 2.21630e+02 302.141 1.75726e+01  -2.79691e+01 0.00000e+00 0.00000e+00 1.57924e+02 302.141 6.37063e+01 122.141 0.9847 
1 1 1 2   86  7  o 3  3.39701e+00 9.44212e-01 4.33670e+01 335.219 1.90913e+00  -8.81386e-01 0.00000e+00 0.00000e+00 4.67839e+01 335.219 3.41688e+00 335.219 0.7139 
1 1 1 2   86  8  f 0  3.80724e+00 9.68734e-01 1.48183e+02 251.027 -2.62967e+00 -7.64893e+00 0.00000e+00 0.00000e+00 1.57752e+01 71.027  1.63959e+02 71.027  0.9360 
1 1 1 2   86  9  o 15 6.82503e+00 1.00313e+00 6.49247e+01 262.908 -8.27470e-01 -6.65081e+00 0.00000e+00 0.00000e+00 1.68803e+02 262.908 1.03878e+02 262.908 0.9220 
1 1 1 2   86  10 o 9  1.11815e+01 9.01423e-01 1.77180e+02 274.542 2.45597e+00  -3.09175e+01 0.00000e+00 0.00000e+00 2.31156e+02 274.542 5.39762e+01 274.542 0.9837 
1 1 1 2   86  11 o 1  6.21625e+00 1.28730e+00 8.53513e+01 115.459 -3.20115e+00 6.72369e+00  0.00000e+00 0.00000e+00 1.29184e+02 115.459 4.38328e+01 115.459 0.9302 
1 1 1 2   86  12 o 19 5.14811e+00 1.35031e+00 7.34955e+01 56.517  3.08037e+00  4.65700e+00  0.00000e+00 0.00000e+00 9.93233e+01 56.517  2.58279e+01 56.517  0.9054 
1 1 1 2   86  13 o 2  3.84685e+00 1.19566e+00 9.17854e+01 296.112 2.96121e+00  -6.04132e+00 0.00000e+00 0.00000e+00 3.96859e+01 296.112 5.20995e+01 116.112 0.9224 
1 1 1 2   86  14 o 1  3.11154e+00 1.03143e+00 3.40775e+01 290.887 8.70426e-01  -2.28101e+00 0.00000e+00 0.00000e+00 5.33034e+01 290.887 1.92259e+01 290.887 0.7585 
1 1 1 2   87  0  o 8  2.02228e+00 6.16531e-01 4.34491e+01 29.667  7.96178e-01  4.53531e-01  0.00000e+00 0.00000e+00 1.21606e+01 209.667 5.56096e+01 209.667 0.4159 
1 1 1 2   87  1  o 9  1.03411e+01 4.43632e-01 2.06218e+02 132.786 -1.70800e+01 1.84536e+01  0.00000e+00 0.00000e+00 1.70731e+02 132.786 3.54872e+01 312.786 0.9799 
1 1 1 2   87  2  o 5  1.06679e+01 4.69174e-01 2.23603e+02 13.986  2.85330e+01  7.10677e+00  0.00000e+00 0.00000e+00 1.66420e+02 13.986  5.71826e+01 193.986 0.9828 
1 1 1 2   87  3  o 16 6.23850e+00 6.10397e-01 1.03813e+02 187.542 -8.44310e+00 -1.11790e+00 0.00000e+00 0.00000e+00 1.14151e+02 187.542 1.03377e+01 187.542 0.9393 
1 1 1 2   87  4  o 19 4.00768e+00 7.60418e-01 7.87344e+01 63.124  1.84115e+00  3.63287e+00  0.00000e+00 0.00000e+00 5.03812e+01 63.124  2.83532e+01 243.124 0.8663 
1 1 1 2   87  5  o 13 6.39204e+00 6.74707e-01 1.11004e+02 298.797 4.67168e+00  -8.49897e+00 0.00000e+00 0.00000e+00 1.14066e+02 298.797 3.06137e+00 298.797 0.9469 
1 1 1 2   87  6  o 13 1.07828e+01 5.84040e-01 2.28403e+02 119.081 -1.77794e+01 3.19684e+01  0.00000e+00 0.00000e+00 1.66921e+02 119.081 6.14820e+01 299.081 0.9862 
1 1 1 2   87  7  o 12 9.41946e+00 8.52027e-01 1.98690e+02 292.461 1.04047e+01  -2.51670e+01 0.00000e+00 0.00000e+00 1.44871e+02 292.461 5.38190e+01 112.461 0.9815 
1 1 1 2   87  8  o 2  7.43707e+00 7.82608e-01 1.41278e+02 337.554 1.59862e+01  -6.60410e+00 0.00000e+00 0.00000e+00 1.26888e+02 337.554 1.43895e+01 157.554 0.9706 
1 1 1 2   87  9  o 9  4.42748e+00 1.06871e+00 1.06223e+02 150.126 -5.75980e+00 3.30854e+00  0.00000e+00 0.00000e+00 4.52408e+01 150.126 6.09825e+01 330.126 0.9213 
1 1 1 2   87  10 o 2  8.08865e+00 1.16384e+00 1.72767e+02 36.542  1.61596e+01  1.19759e+01  0.00000e+00 0.00000e+00 1.19871e+02 36.542  5.28959e+01 216.542 0.9748 
1 1 1 2   87  11 o 6  1.11047e+01 1.16752e+00 1.74948e+02 184.964 -3.09318e+01 -2.68670e+00 0.00000e+00 0.00000e+00 2.30267e+02 184.964 5.53188e+01 184.964 0.9838 
1 1 1 2   87  12 o 17 4.80045e+00 1.32277e+00 9.08985e+01 204.641 -5.90368e+00 -2.70797e+00 0.00000e+00 0.00000e+00 7.27138e+01 204.641 1.81847e+01 24.641  0.9194 
1 1 1 2   87  13 o 18 5.73221e+00 1.38450e+00 3.02956e+01 17.796  2.66519e+00  8.55468e-01  0.00000e+00 0.00000e+00 1.38299e+02 17.796  1.08003e+02 17.796  0.7940 
1 1 1 2   87  14 f 0  4.02281e+00 1.20907e+00 6.93933e+01 83.176  7.05109e-01  5.89219e+00  0.00000e+00 0.00000e+00 6.63131e+01 83.176  3.08022e+00 263.176 0.9113 
1 1 1 2   88  0  o 7  4.70046e+00 6.21886e-01 2.69823e+01 359.430 1.59180e+00  -1.58371e-02 0.00000e+00 0.00000e+00 8.10515e+01 359.430 5.40691e+01 359.430 0.6180 
1 1 1 2   88  1  o 13 7.89250e+00 4.84155e-01 1.04469e+02 100.342 -1.92460e+00 1.05466e+01  0.00000e+00 0.00000e+00 1.75009e+02 100.342 7.05405e+01 100.342 0.9522 
1 1 1 2   88  2  o 1  3.82160e+00 7.32740e-01 7.52065e+01 242.384 -1.68376e+00 -3.21862e+00 0.00000e+00 0.00000e+00 4.52762e+01 242.384 2.99303e+01 62.384  0.8477 
1 1 1 2   88  3  o 16 9.19310e+00 5.03436e-01 1.68940e+02 272.575 8.85556e-01  -1.96874e+01 0.00000e+00 0.00000e+00 1.64133e+02 272.575 4.80685e+00 92.575  0.9743 
1 1 1 2   88  4  o 9  1.26804e+01 4.99424e-01 1.71696e+02 19.486  2.94573e+01  1.04234e+01  0.00000e+00 0.00000e+00 2.92180e+02 19.486  1.20484e+02 19.486  0.9839 
1 1 1 2   88  5  o 8  8.74462e+00 6.12362e-01 1.87669e+02 181.388 -2.24926e+01 -5.45074e-01 0.00000e+00 0.00000e+00 1.30101e+02 181.388 5.75678e+01 1.388   0.9775 
1 1 1 2   88  6  o 17 5.09316e+00 8.37891e-01 7.43316e+01 197.389 -5.43432e+00 -1.70186e+00 0.00000e+00 0.00000e+00 9.74166e+01 197.389 2.30849e+01 197.389 0.9073 
1 1 1 2   88  7  o 11 5.79499e+00 1.00909e+00 9.53085e+01 93.834  -5.00296e-01 7.46512e+00  0.00000e+00 0.00000e+00 1.05042e+02 93.834  9.73354e+00 93.834  0.9305 
1 1 1 2   88  8  o 7  2.98357e+00 8.15752e-01 7.14267e+01 266.612 -2.08029e-01 -3.51444e+00 0.00000e+00 0.00000e+00 2.18927e+01 266.612 4.95339e+01 86.612  0.8422 
1 1 1 2   88  9  o 8  6.06764e+00 9.39538e-01 1.57326e+02 290.316 5.66177e+00  -1.52929e+01 0.00000e+00 0.00000e+00 6.09046e+01 290.316 9.64211e+01 110.316 0.9688 
1 1 1 2   88  10 o 6  5.96111e+00 1.29285e+00 1.37995e+02 180.049 -1.06178e+01 -9.14531e-03 0.00000e+00 0.00000e+00 7.25007e+01 180.049 6.54944e+01 0.049   0.9517 
1 1 1 2   88  11 o 19 2.49958e+00 8.54584e-01 6.10414e+01 348.614 2.98154e+00  -6.00420e-01 0.00000e+00 0.00000e+00 1.43185e+01 348.614 4.67230e+01 168.614 0.8130 
1 1 1 2   88  12 f 0  4.08522e+00 1.23674e+00 6.89834e+01 82.787  5.90208e-01  4.66348e+00  0.00000e+00 0.00000e+00 6.51495e+01 82.787  3.83389e+00 262.787 0.8859 
1 1 1 2   88  13 o 18 3.45150e+00 1.11470e+00 5.95081e+01 178.381 -4.19506e+00 1.18561e-01  0.00000e+00 0.00000e+00 5.17891e+01 178.381 7.71894e+00 358.381 0.8707 
1 1 1 2   88  14 o 12 4.16660e+00 1.29039e+00 7.67110e+01 354.367 6.39859e+00  -6.31124e-01 0.00000e+00 0.00000e+00 6.49277e+01 354.367 1.17833e+01 174.367 0.9186 
1 1 1 2   89  0  o 15 1.13960e+01 4.37736e-01 3.02222e+02 72.064  1.45581e+01  4.49764e+01  0.00000e+00 0.00000e+00 1.16965e+02 72.064  1.85257e+02 252.064 0.9894 
1 1 1 2   89  1  o 4  6.34727e+00 5.26646e-01 1.19914e+02 105.603 -2.74772e+00 9.83945e+00  0.00000e+00 0.00000e+00 1.04217e+02 105.603 1.56977e+01 285.603 0.9497 
1 1 1 2   89  2  o 9  4.84190e+00 6.67876e-01 7.67417e+01 306.550 2.68483e+00  -3.62173e+00 0.00000e+00 0.00000e+00 8.17836e+01 306.550 5.04186e+00 306.550 0.8806 
1 1 1 2   89  3  o 4  5.76140e+00 6.45108e-01 1.54758e+02 96.676  -1.32993e+00 1.13630e+01  0.00000e+00 0.00000e+00 4.98522e+01 96.676  1.04905e+02 276.675 0.9552 
1 1 1 2   89  4  o 12 4.29014e+00 7.41792e-01 1.30160e+02 147.014 -6.48341e+00 4.20819e+00  0.00000e+00 0.00000e+00 1.86115e+01 147.014 1.11548e+02 327.014 0.9329 
1 1 1 2   89  5  o 17 1.13396e+01 5.58903e-01 2.39396e+02 136.792 -3.03523e+01 2.85110e+01  0.00000e+00 0.00000e+00 1.76957e+02 136.792 6.24388e+01 316.792 0.9879 
1 1 1 2   89  6  o 19 4.07407e+00 8.96671e-01 6.30510e+01 300.263 1.85885e+00  -3.18572e+00 0.00000e+00 0.00000e+00 6.56755e+01 300.263 2.62451e+00 300.263 0.8504 
1 1 1 2   89  7  o 12 2.72700e+00 8.23275e-01 3.82607e+01 166.434 -1.45946e+00 3.52165e-01  0.00000e+00 0.00000e+00 2.21569e+01 166.434 1.61039e+01 346.434 0.5965 
1 1 1 2   89  8  o 1  5.54495e+00 8.91369e-01 1.20142e+02 226.255 -7.42681e+00 -7.75955e+00 0.00000e+00 0.00000e+00 7.59122e+01 226.255 4.42300e+01 46.255  0.9522 
1 1 1 2   89  9  o 13 4.17394e+00 8.96708e-01 7.87198e+01 79.032  1.05378e+00  5.43743e+00  0.00000e+00 0.00000e+00 6.14039e+01 79.032  1.73159e+01 259.032 0.9045 
1 1 1 2   89  10 o 6  2.41771e+00 8.06879e-01 6.79584e+01 151.902 -2.67277e+00 1.42701e+00  0.00000e+00 0.00000e+00 4.88196e+00 151.902 6.30765e+01 331.902 0.8122 
1 1 1 2   89  11 o 17 3.26954e+00 1.03114e+00 3.42988e+01 49.940  1.27844e+00  1.52037e+00  0.00000e+00 0.00000e+00 5.00122e+01 49.940  1.57134e+01 49.940  0.6955 
1 1 1 2   89  12 o 14 9.21648e+00 1.37677e+00 1.25207e+02 146.602 -1.50781e+01 9.94121e+00  0.00000e+00 0.00000e+00 2.06687e+02 146.602 8.14800e+01 146.602 0.9719 
1 1 1 2   89  13 o 7  3.56327e+00 1.14961e+00 7.46922e+01 266.515 -3.17059e-01 -5.20636e+00 0.00000e+00 0.00000e+00 4.38068e+01 266.515 3.08854e+01 86.515  0.8982 
1 1 1 2   89  14 o 1  3.41144e+00 1.14923e+00 6.19122e+01 333.011 4.23458e+00  -2.15655e+00 0.00000e+00 0.00000e+00 5.00819e+01 333.011 1.18303e+01 153.012 0.8873 
1 1 1 2   90  0  o 2  4.24839e+00 6.55843e-01 7.08475e+01 213.129 -3.37282e+00 -2.20118e+00 0.00000e+00 0.00000e+00 6.56793e+01 213.129 5.16817e+00 33.129  0.8646 
1 1 1 2   90  1  o 16 1.25023e+01 4.37311e-01 2.24822e+02 324.481 3.25123e+01  -2.32073e+01 0.00000e+00 0.00000e+00 2.34058e+02 324.481 9.23579e+00 324.481 0.9874 
1 1 1 2   90  2  o 5  1.13001e+01 4.71942e-01 1.82096e+02 223.487 -2.00730e+01 -1.90399e+01 0.00000e+00 0.00000e+00 2.30281e+02 223.487 4.81855e+01 223.487 0.9818 
1 1 1 2   90  3  o 14 1.11870e+01 4.90086e-01 1.55830e+02 23.164  2.31622e+01  9.91020e+00  0.00000e+00 0.00000e+00 2.51637e+02 23.164  9.58077e+01 23.164  0.9799 
1 1 1 2   90  4  o 2  7.35518e+00 5.68313e-01 7.33072e+01 303.106 4.24507e+00  -6.51033e+00 0.00000e+00 0.00000e+00 1.81794e+02 303.106 1.08487e+02 303.106 0.9333 
1 1 1 2   90  5  o 2  8.70948e+00 5.57892e-01 1.22450e+02 335.519 1.63873e+01  -7.46156e+00 0.00000e+00 0.00000e+00 1.92046e+02 335.519 6.95957e+01 335.519 0.9718 
1 1 1 2   90  6  o 8  6.92932e+00 7.27412e-01 1.65841e+02 67.753  6.71522e+00  1.64165e+01  0.00000e+00 0.00000e+00 8.41982e+01 67.753  8.16426e+01 247.753 0.9714 
1 1 1 2   90  7  o 8  2.99064e+00 8.50637e-01 8.84803e+01 65.324  1.62949e+00  3.54674e+00  0.00000e+00 0.00000e+00 6.99578e+00 65.324  8.14845e+01 245.324 0.8597 
1 1 1 2   90  8  o 4  5.83752e+00 8.99116e-01 7.15443e+01 275.781 6.51295e-01  -6.43333e+00 0.00000e+00 0.00000e+00 1.27609e+02 275.781 5.60647e+01 275.781 0.9190 
1 1 1 2   90  9  o 19 1.14261e+01 7.07647e-01 1.90607e+02 135.536 -2.94584e+01 2.89122e+01  0.00000e+00 0.00000e+00 2.28190e+02 135.536 3.75838e+01 135.536 0.9878 
1 1 1 2   90  10 o 9  8.23900e+00 8.77166e-01 1.50159e+02 354.599 2.24627e+01  -2.12378e+00 0.00000e+00 0.00000e+00 1.48547e+02 354.599 1.61168e+00 174.599 0.9776 
1 1 1 2   90  11 f 0  4.75771e+00 1.18705e+00 5.13846e+01 322.959 3.27090e+00  -2.46847e+00 0.00000e+00 0.00000e+00 1.01541e+02 322.959 5.01561e+01 322.959 0.8672 
1 1 1 2   90  12 o 3  5.94001e+00 1.28928e+00 4.91904e+01 230.468 -3.26812e+00 -3.96000e+00 0.00000e+00 0.00000e+00 1.48050e+02 230.468 9.88595e+01 230.468 0.8964 
1 1 1 2   90  13 o 3  4.04440e+00 1.26092e+00 5.85450e+01 77.413  1.02406e+00  4.58614e+00  0.00000e+00 0.00000e+00 7.40860e+01 77.413  1.55410e+01 77.413  0.8859 
1 1 1 2   91  0  o 6  1.27077e+01 4.33094e-01 1.85677e+02 289.733 1.16216e+01  -3.23994e+01 0.00000e+00 0.00000e+00 2.79639e+02 289.733 9.39623e+01 289.733 0.9854 
1 1 1 2   91  1  o 18 1.31250e+01 4.43087e-01 2.28860e+02 271.193 9.08842e-01  -4.36572e+01 0.00000e+00 0.00000e+00 2.53282e+02 271.193 2.44225e+01 271.193 0.9885 
1 1 1 2   91  2  o 1  9.10902e+00 4.92182e-01 1.74107e+02 104.996 -6.17224e+00 2.30417e+01  0.00000e+00 0.00000e+00 1.57230e+02 104.996 1.68768e+01 284.996 0.9788 
1 1 1 2   91  3  o 5  3.59797e+00 7.68511e-01 3.37728e+01 131.349 -1.08100e+00 1.22834e+00  0.00000e+00 0.00000e+00 5.01978e+01 131.349 1.64250e+01 131.349 0.6281 
1 1 1 2   91  4  o 12 3.30060e+00 7.80937e-01 1.11503e+02 35.914  4.11513e+00  2.98035e+00  0.00000e+00 0.00000e+00 1.71934e+00 215.914 1.13223e+02 215.914 0.8952 
1 1 1 2   91  5  o 4  8.89831e+00 5.54818e-01 1.58368e+02 52.614  1.41568e+01  1.85256e+01  0.00000e+00 0.00000e+00 1.65012e+02 52.614  6.64407e+00 52.614  0.9783 
1 1 1 2   91  6  o 9  2.16055e+00 6.76858e-01 4.96583e+01 314.542 1.23735e+00  -1.25727e+00 0.00000e+00 0.00000e+00 2.89430e+00 314.542 4.67640e+01 134.542 0.6550 
1 1 1 2   91  7  o 9  6.17661e+00 7.89744e-01 9.38978e+01 147.211 -7.65721e+00 4.93257e+00  0.00000e+00 0.00000e+00 1.22435e+02 147.211 2.85376e+01 147.211 0.9434 
1 1 1 2   91  8  o 2  7.10910e+00 8.50664e-01 1.30192e+02 256.638 -3.84828e+00 -1.62013e+01 0.00000e+00 0.00000e+00 1.25593e+02 256.638 4.59884e+00 76.638  0.9695 
1 1 1 2   91  9  o 6  6.20535e+00 9.35457e-01 9.89832e+01 327.504 8.99769e+00  -5.73127e+00 0.00000e+00 0.00000e+00 1.20139e+02 327.504 2.11558e+01 327.504 0.9519 
1 1 1 2   91  10 o 3  3.96241e+00 9.65406e-01 6.57486e+01 308.728 2.98347e+00  -3.72028e+00 0.00000e+00 0.00000e+00 6.46724e+01 308.728 1.07617e+00 128.728 0.8877 
1 1 1 2   91  11 o 10 3.93085e+00 1.04851e+00 1.99163e+01 27.786  1.27867e+00  6.73763e-01  0.00000e+00 0.00000e+00 6.49068e+01 27.786  4.49904e+01 27.786  0.5823 
1 1 1 2   91  12 o 10 2.91610e+00 9.58973e-01 7.13782e+01 211.709 -3.77963e+00 -2.33515e+00 0.00000e+00 0.00000e+00 2.35072e+01 211.709 4.78709e+01 31.709  0.8786 
1 1 1 2   91  13 o 6  1.00089e+01 1.44074e+00 2.03271e+02 75.983  8.04052e+00  3.22080e+01  0.00000e+00 0.00000e+00 1.61517e+02 75.983  4.17531e+01 255.983 0.9848 
1 1 1 2   92  0  o 8  9.48774e+00 4.77638e-01 1.26322e+02 127.360 -1.09711e+01 1.43703e+01  0.00000e+00 0.00000e+00 2.16270e+02 127.360 8.99487e+01 127.360 0.9719 
1 1 1 2   92  1  f 0  3.04327e+00 6.97112e-01 9.82356e+01 235.432 -2.38462e+00 -3.46088e+00 0.00000e+00 0.00000e+00 2.34100e-01 235.432 9.80015e+01 55.432  0.8709 
1 1 1 2   92  2  o 14 9.97677e+00 4.92491e-01 1.88064e+02 328.477 2.35778e+01  -1.44614e+01 0.00000e+00 0.00000e+00 1.75838e+02 328.477 1.22253e+01 148.477 0.9818 
1 1 1 2   92  3  o 18 9.84269e+00 5.11721e-01 1.71224e+02 221.802 -1.90621e+01 -1.70446e+01 0.00000e+00 0.00000e+00 1.87211e+02 221.802 1.59862e+01 221.802 0.9802 
1 1 1 2   92  4  o 4  7.78572e+00 5.61628e-01 1.69513e+02 261.854 -3.14942e+00 -2.20016e+01 0.00000e+00 0.00000e+00 1.13107e+02 261.854 5.64064e+01 81.854  0.9772 
1 1 1 2   92  5  o 5  3.36980e+00 8.21730e-01 2.43501e+01 280.957 2.30984e-01  -1.19306e+00 0.00000e+00 0.00000e+00 4.04097e+01 280.957 1.60596e+01 280.957 0.5175 
1 1 1 2   92  6  o 15 2.94182e+00 7.87044e-01 1.52549e+01 26.403  6.60244e-01  3.27789e-01  0.00000e+00 0.00000e+00 2.24942e+01 26.403  7.23935e+00 26.403  0.3456 
1 1 1 2   92  7  o 16 1.03025e+01 6.05194e-01 1.45905e+02 344.595 2.66836e+01  -7.35262e+00 0.00000e+00 0.00000e+00 2.29516e+02 344.595 8.36107e+01 344.595 0.9818 
1 1 1 2   92  8  o 5  5.46089e+00 9.20802e-01 7.51086e+01 275.188 6.16751e-01  -6.79233e+00 0.00000e+00 0.00000e+00 1.11999e+02 275.188 3.68903e+01 275.188 0.9235 
1 1 1 2   92  9  o 17 3.62604e+00 9.85926e-01 8.33303e+01 68.779  1.78630e+00  4.60028e+00  0.00000e+00 0.00000e+00 3.66031e+01 68.779  4.67272e+01 248.779 0.8919 
1 1 1 2   92  10 f 0  3.30718e+00 9.41114e-01 4.33829e+01 279.251 4.56409e-01  -2.80199e+00 0.00000e+00 0.00000e+00 5.43625e+01 279.251 1.09796e+01 279.251 0.7973 
1 1 1 2   92  11 o 15 6.26010e+00 1.16169e+00 9.53736e+01 44.381  7.53929e+00  7.37823e+00  0.00000e+00 0.00000e+00 1.25263e+02 44.381  2.98893e+01 44.381  0.9514 
1 1 1 2   92  12 o 15 3.73206e+00 1.09886e+00 1.87911e+01 252.635 -4.23874e-01 -1.35546e+00 0.00000e+00 0.00000e+00 6.07675e+01 252.635 4.19764e+01 252.635 0.5758 
1 1 1 2   92  13 o 15 4.24976e+00 1.23405e+00 5.40215e+01 76.988  1.05332e+00  4.55815e+00  0.00000e+00 0.00000e+00 8.51868e+01 76.988  3.11653e+01 76.988  0.8853 
1 1 1 2   93  0  o 19 5.59798e+00 6.09775e-01 1.25380e+02 288.709 3.20121e+00  -9.45279e+00 0.00000e+00 0.00000e+00 7.18311e+01 288.709 5.35486e+01 108.709 0.9485 
1 1 1 2   93  1  o 16 7.73663e+00 5.12198e-01 1.37252e+02 257.509 -3.57737e+00 -1.61483e+01 0.00000e+00 0.00000e+00 1.41288e+02 257.509 4.03610e+00 257.509 0.9693 
1 1 1 2   93  2  o 17 2.58565e+00 7.24952e-01 1.27803e+02 43.088  3.40683e+00  3.18666e+00  0.00000e+00 0.00000e+00 4.28092e+01 223.087 1.70612e+02 223.087 0.8850 
1 1 1 2   93  3  o 2  6.24473e+00 6.15974e-01 1.07832e+02 223.469 -8.07300e+00 -7.65281e+00 0.00000e+00 0.00000e+00 1.13418e+02 223.469 5.58682e+00 223.469 0.9539 
1 1 1 2   93  4  o 11 1.44522e+01 5.03714e-01 3.01881e+02 10.466  7.15118e+01  1.32095e+01  0.00000e+00 0.00000e+00 2.31111e+02 10.466  7.07699e+01 190.466 0.9931 
1 1 1 2   93  5  o 4  3.82617e+00 7.66997e-01 1.03081e+02 210.111 -5.39319e+00 -3.12770e+00 0.00000e+00 0.00000e+00 2.70253e+01 210.111 7.60562e+01 30.111  0.9159 
1 1 1 2   93  6  o 3  2.58357e+00 7.50619e-01 2.40885e+01 7.175   1.05270e+00  1.32518e-01  0.00000e+00 0.00000e+00 2.07532e+01 7.175   3.33530e+00 187.175 0.4676 
1 1 1 2   93  7  o 14 2.73046e+00 8.02800e-01 3.00490e+01 335.184 1.20764e+00  -5.58419e-01 0.00000e+00 0.00000e+00 2.58143e+01 335.184 4.23469e+00 155.184 0.5514 
1 1 1 2   93  8  o 13 1.02158e+01 6.65319e-01 1.81237e+02 187.733 -3.54879e+01 -4.81916e+00 0.00000e+00 0.00000e+00 1.92374e+02 187.733 1.11374e+01 187.733 0.9859 
1 1 1 2   93  9  o 17 3.26312e+00 9.26876e-01 5.20387e+01 116.134 -1.32592e+00 2.70250e+00  0.00000e+00 0.00000e+00 4.60502e+01 116.134 5.98846e+00 296.134 0.8107 
1 1 1 2   93  10 o 7  3.36434e+00 9.95541e-01 8.88046e+01 259.766 -9.56107e-01 -5.29596e+00 0.00000e+00 0.00000e+00 2.35971e+01 259.766 6.52074e+01 79.766  0.9015 
1 1 1 2   93  11 o 7  3.70669e+00 1.08259e+00 5.51299e+01 301.149 2.09375e+00  -3.46420e+00 0.00000e+00 0.00000e+00 6.36698e+01 301.149 8.53985e+00 301.149 0.8653 
1 1 1 2   93  12 o 5  3.44300e+00 1.05327e+00 8.19437e+01 341.895 5.57994e+00  -1.82436e+00 0.00000e+00 0.00000e+00 3.40664e+01 341.895 4.78773e+01 161.895 0.9103 
1 1 1 2   93  13 o 12 2.84532e+00 9.53804e-01 4.95518e+01 72.833  1.07646e+00  3.48468e+00  0.00000e+00 0.00000e+00 3.97434e+01 72.833  9.80838e+00 252.833 0.8484 
1 1 1 2   94  0  o 13 2.15787e+00 6.44435e-01 3.01155e+01 29.821  8.18691e-01  4.69273e-01  0.00000e+00 0.00000e+00 4.02397e+00 29.821  2.60915e+01 209.821 0.4261 
1 1 1 2   94  1  o 1  2.03372e+00 6.31421e-01 6.85872e+01 19.816  1.88119e+00  6.77862e-01  0.00000e+00 0.00000e+00 1.58958e+01 199.816 8.44831e+01 199.816 0.6977 
1 1 1 2   94  2  o 7  3.37835e+00 7.95991e-01 8.56471e+01 226.179 -3.06901e+00 -3.19803e+00 0.00000e+00 0.00000e+00 2.45382e+01 226.179 6.11089e+01 46.179  0.8783 
1 1 1 2   94  3  o 19 4.51357e+00 7.79253e-01 7.95244e+01 339.847 5.10036e+00  -1.87185e+00 0.00000e+00 0.00000e+00 7.17365e+01 339.847 7.78800e+00 159.847 0.9025 
1 1 1 2   94  4  o 18 7.69970e+00 6.03645e-01 1.32763e+02 143.889 -1.33748e+01 9.75708e+00  0.00000e+00 0.00000e+00 1.44326e+02 143.889 1.15633e+01 143.889 0.9693 
1 1 1 2   94  5  o 16 3.95969e+00 8.60504e-01 8.21001e+01 346.336 5.00185e+00  -1.21598e+00 0.00000e+00 0.00000e+00 4.96961e+01 346.336 3.24040e+01 166.336 0.8967 
1 1 1 2   94  6  o 7  4.36669e+00 8.59552e-01 4.94069e+01 129.365 -2.23750e+00 2.72740e+00  0.00000e+00 0.00000e+00 8.71233e+01 129.365 3.77164e+01 129.365 0.8425 
1 1 1 2   94  7  o 6  1.27981e+01 6.03251e-01 2.04648e+02 259.844 -8.81862e+00 -4.92284e+01 0.00000e+00 0.00000e+00 2.65363e+02 259.844 6.07156e+01 259.844 0.9900 
1 1 1 2   94  8  o 18 5.08850e+00 9.22319e-01 5.57731e+01 163.615 -4.76503e+00 1.40111e+00  0.00000e+00 0.00000e+00 1.12663e+02 163.615 5.68896e+01 163.615 0.8926 
1 1 1 2   94  9  o 6  2.70932e+00 8.56482e-01 7.43631e+01 104.773 -1.00958e+00 3.82829e+00  0.00000e+00 0.00000e+00 1.21990e+01 104.773 6.21641e+01 284.773 0.8619 
1 1 1 2   94  10 o 18 3.09300e+00 9.58452e-01 8.30211e+01 181.886 -5.02906e+00 -1.65595e-01 0.00000e+00 0.00000e+00 1.94381e+01 181.886 6.35831e+01 1.886   0.8941 
1 1 1 2   94  11 o 1  5.54075e+00 1.11830e+00 1.11712e+02 359.791 1.25595e+01  -4.58942e-02 0.00000e+00 0.00000e+00 8.51070e+01 359.791 2.66053e+01 179.791 0.9593 
1 1 1 2   94  12 o 5  4.89474e+00 1.24591e+00 1.14114e+02 188.122 -1.11370e+01 -1.58941e+00 0.00000e+00 0.00000e+00 5.87691e+01 188.122 5.53446e+01 8.122   0.9545 
1 1 1 2   94  13 o 18 3.28757e+00 1.05723e+00 6.50703e+01 13.485  5.10821e+00  1.22493e+00  0.00000e+00 0.00000e+00 4.42174e+01 13.485  2.08529e+01 193.485 0.8989 
1 1 1 2   95  0  o 11 5.14770e+00 6.50174e-01 5.70813e+01 144.339 -3.79063e+00 2.71992e+00  0.00000e+00 0.00000e+00 1.12040e+02 144.339 5.49585e+01 144.339 0.8850 
1 1 1 2   95  1  o 8  7.63006e+00 5.29867e-01 1.51357e+02 136.624 -1.38992e+01 1.31330e+01  0.00000e+00 0.00000e+00 1.24398e+02 136.624 2.69594e+01 316.624 0.9735 
1 1 1 2   95  2  o 6  7.37744e+00 5.61031e-01 1.33172e+02 26.909  1.44382e+01  7.32778e+00  0.00000e+00 0.00000e+00 1.32113e+02 26.909  1.05928e+00 206.909 0.9686 
1 1 1 2   95  3  o 10 5.42426e+00 7.11929e-01 8.35132e+01 39.029  5.45821e+00  4.42448e+00  0.00000e+00 0.00000e+00 1.02908e+02 39.029  1.93950e+01 39.029  0.9258 
1 1 1 2   95  4  o 16 2.89878e+00 7.71899e-01 7.07202e+01 285.705 8.15347e-01  -2.89977e+00 0.00000e+00 0.00000e+00 1.65253e+01 285.705 5.41950e+01 105.705 0.8109 
1 1 1 2   95  5  o 6  3.54857e+00 8.38285e-01 4.08018e+01 248.378 -8.19456e-01 -2.06742e+00 0.00000e+00 0.00000e+00 5.55026e+01 248.378 1.47008e+01 248.378 0.7313 
1 1 1 2   95  6  o 19 5.27917e+00 8.34474e-01 9.92169e+01 267.076 -4.27067e-01 -8.36149e+00 0.00000e+00 0.00000e+00 8.45418e+01 267.076 1.46751e+01 87.076  0.9382 
1 1 1 2   95  7  o 17 8.74502e+00 6.87323e-01 1.57663e+02 48.599  1.58379e+01  1.79638e+01  0.00000e+00 0.00000e+00 1.59829e+02 48.599  2.16652e+00 48.599  0.9789 
1 1 1 2   95  8  o 12 3.68784e+00 9.19557e-01 4.48250e+01 163.393 -2.68897e+00 8.01960e-01  0.00000e+00 0.00000e+00 6.38093e+01 163.393 1.89843e+01 163.393 0.7946 
1 1 1 2   95  9  o 11 4.15383e+00 1.01042e+00 7.30631e+01 68.495  2.00243e+00  5.08204e+00  0.00000e+00 0.00000e+00 6.59538e+01 68.495  7.10930e+00 248.495 0.9031 
1 1 1 2   95  10 o 7  4.83645e+00 1.11637e+00 9.23558e+01 219.226 -5.97470e+00 -4.87741e+00 0.00000e+00 0.00000e+00 7.47310e+01 219.226 1.76249e+01 39.226  0.9327 
1 1 1 2   95  11 o 14 3.39073e+00 1.00648e+00 7.63935e+01 287.354 1.59008e+00  -5.08831e+00 0.00000e+00 0.00000e+00 3.66413e+01 287.354 3.97522e+01 107.354 0.9005 
1 1 1 2   95  12 o 2  4.32028e+00 1.17120e+00 8.78670e+01 4.320   7.70975e+00  5.82339e-01  0.00000e+00 0.00000e+00 6.12383e+01 4.320   2.66287e+01 184.319 0.9329 
1 1 1 2   95  13 o 2  3.07490e+00 9.93542e-01 3.56770e+01 222.099 -2.29986e+00 -2.07803e+00 0.00000e+00 0.00000e+00 5.72096e+01 222.099 2.15325e+01 222.099 0.8171 
1 1 1 2   96  0  o 2  7.25403e+00 5.34798e-01 1.19934e+02 170.689 -1.41543e+01 2.32072e+00  0.00000e+00 0.00000e+00 1.39724e+02 170.689 1.97904e+01 170.689 0.9645 
1 1 1 2   96  1  o 12 6.72573e+00 5.60769e-01 8.68954e+01 309.295 6.04436e+00  -7.38604e+00 0.00000e+00 0.00000e+00 1.49266e+02 309.295 6.23705e+01 309.295 0.9461 
1 1 1 2   96  2  o 14 6.42200e+00 6.07282e-01 9.70526e+01 14.719  9.75350e+00  2.56217e+00  0.00000e+00 0.00000e+00 1.29152e+02 14.719  3.20990e+01 14.719  0.9490 
1 1 1 2   96  3  o 6  6.28102e+00 6.51691e-01 1.05542e+02 334.107 9.19988e+00  -4.46578e+00 0.00000e+00 0.00000e+00 1.15850e+02 334.107 1.03085e+01 334.107 0.9498 
1 1 1 2   96  4  o 17 5.65044e+00 6.91461e-01 1.20647e+02 229.842 -6.93994e+00 -8.22469e+00 0.00000e+00 0.00000e+00 7.90308e+01 229.842 4.16160e+01 49.843  0.9523 
1 1 1 2   96  5  o 16 8.70154e+00 6.00320e-01 1.84115e+02 28.563  2.59714e+01  1.41386e+01  0.00000e+00 0.00000e+00 1.33204e+02 28.563  5.09109e+01 208.563 0.9829 
1 1 1 2   96  6  f 0  1.02455e+01 6.43454e-01 2.09279e+02 176.851 -4.29154e+01 2.36081e+00  0.00000e+00 0.00000e+00 1.66283e+02 176.851 4.29960e+01 356.851 0.9883 
1 1 1 2   96  7  o 1  8.60828e+00 6.79055e-01 1.67589e+02 102.202 -5.76005e+00 2.66372e+01  0.00000e+00 0.00000e+00 1.45682e+02 102.202 2.19072e+01 282.202 0.9815 
1 1 1 2   96  8  o 6  4.16497e+00 9.90860e-01 6.84243e+01 261.602 -7.08844e-01 -4.80129e+00 0.00000e+00 0.00000e+00 6.89467e+01 261.602 5.22373e-01 261.602 0.8899 
1 1 1 2   96  9  o 8  6.19183e+00 1.01066e+00 1.26949e+02 202.936 -1.29961e+01 -5.49930e+00 0.00000e+00 0.00000e+00 9.41635e+01 202.936 3.27858e+01 22.936  0.9639 
1 1 1 2   96  10 o 16 4.81187e+00 1.09995e+00 1.01139e+02 32.387  7.59657e+00  4.81844e+00  0.00000e+00 0.00000e+00 6.68262e+01 32.387  3.43133e+01 212.387 0.9427 
1 1 1 2   96  11 o 13 5.41278e+00 1.09728e+00 8.62995e+01 196.721 -9.06846e+00 -2.72436e+00 0.00000e+00 0.00000e+00 1.03129e+02 196.721 1.68292e+01 196.721 0.9456 
1 1 1 2   96  12 o 7  3.21670e+00 1.02511e+00 2.35516e+01 222.122 -1.42537e+00 -1.28891e+00 0.00000e+00 0.00000e+00 5.78838e+01 222.122 3.43322e+01 222.122 0.6845 
1 1 1 2   96  13 o 3  3.74885e+00 1.12330e+00 3.45813e+01 260.510 -4.99658e-01 -2.98901e+00 0.00000e+00 0.00000e+00 7.79591e+01 260.510 4.33778e+01 260.510 0.8122 
1 1 1 2   97  0  o 4  7.92798e+00 5.12438e-01 1.78629e+02 33.702  1.96531e+01  1.31079e+01  0.00000e+00 0.00000e+00 1.09230e+02 33.702  6.93991e+01 213.702 0.9786 
1 1 1 2   97  1  o 4  5.56789e+00 6.08492e-01 1.47413e+02 40.033  1.06171e+01  8.91920e+00  0.00000e+00 0.00000e+00 5.15895e+01 40.033  9.58233e+01 220.033 0.9632 
1 1 1 2   97  2  f 0  8.47739e+00 5.55077e-01 2.12853e+02 351.714 2.84737e+01  -4.14652e+00 0.00000e+00 0.00000e+00 9.61828e+01 351.714 1.16671e+02 171.714 0.9825 
1 1 1 2   97  3  f 0  8.14810e+00 5.90178e-01 1.91429e+02 162.443 -2.44282e+01 7.72873e+00  0.00000e+00 0.00000e+00 1.04923e+02 162.443 8.65067e+01 342.443 0.9803 
1 1 1 2   97  4  o 16 3.21889e+00 8.20468e-01 7.83180e+01 294.106 1.72429e+00  -3.85358e+00 0.00000e+00 0.00000e+00 2.57536e+01 294.106 5.25644e+01 114.106 0.8715 
1 1 1 2   97  5  o 8  7.55758e+00 6.55298e-01 1.88450e+02 215.179 -2.01877e+01 -1.42297e+01 0.00000e+00 0.00000e+00 8.61250e+01 215.179 1.02325e+02 35.179  0.9795 
1 1 1 2   97  6  o 4  6.23661e+00 8.46721e-01 7.69295e+01 122.729 -4.48942e+00 6.98520e+00  0.00000e+00 0.00000e+00 1.39919e+02 122.729 6.29891e+01 122.729 0.9377 
1 1 1 2   97  7  o 6  4.63129e+00 8.67007e-01 6.31934e+01 287.552 1.45940e+00  -4.61412e+00 0.00000e+00 0.00000e+00 8.95158e+01 287.552 2.63224e+01 287.552 0.8895 
1 1 1 2   97  8  o 1  8.66798e+00 7.43307e-01 1.05207e+02 295.857 8.36041e+00  -1.72503e+01 0.00000e+00 0.00000e+00 2.07489e+02 295.857 1.02282e+02 295.857 0.9736 
1 1 1 2   97  9  o 10 2.52126e+00 8.15164e-01 1.82491e+01 164.999 -9.68282e-01 2.59464e-01  0.00000e+00 0.00000e+00 2.35172e+01 164.999 5.26810e+00 164.999 0.4473 
1 1 1 2   97  10 o 8  3.42306e+00 9.87331e-01 4.74135e+01 185.135 -3.53458e+00 -3.17640e-01 0.00000e+00 0.00000e+00 5.94904e+01 185.135 1.20769e+01 185.135 0.8436 
1 1 1 2   97  11 o 8  5.55060e+00 1.21928e+00 9.70986e+01 118.790 -4.80409e+00 8.74234e+00  0.00000e+00 0.00000e+00 9.76860e+01 118.790 5.87406e-01 118.790 0.9485 
1 1 1 2   97  12 o 1  4.95766e+00 1.21538e+00 8.50562e+01 295.116 3.87201e+00  -8.25998e+00 0.00000e+00 0.00000e+00 8.78990e+01 295.116 2.84277e+00 295.116 0.9435 
1 1 1 2   98  0  o 4  1.27071e+01 4.64569e-01 1.96869e+02 18.728  3.87772e+01  1.31467e+01  0.00000e+00 0.00000e+00 2.68688e+02 18.728  7.18185e+01 18.728  0.9877 
1 1 1 2   98  1  o 4  7.50961e+00 5.61399e-01 1.81043e+02 212.175 -2.08275e+01 -1.31032e+01 0.00000e+00 0.00000e+00 9.18066e+01 212.175 8.92368e+01 32.175  0.9795 
1 1 1 2   98  2  o 18 2.16718e+00 6.73817e-01 4.42763e+01 300.861 7.82563e-01  -1.30958e+00 0.00000e+00 0.00000e+00 4.15085e+00 300.861 4.01254e+01 120.861 0.6024 
1 1 1 2   98  3  o 2  1.58334e+01 5.15752e-01 3.05803e+02 258.855 -1.63896e+01 -8.31896e+01 0.00000e+00 0.00000e+00 2.78019e+02 258.855 2.77843e+01 78.855  0.9941 
1 1 1 2   98  4  o 8  5.37479e+00 7.53009e-01 1.00117e+02 156.762 -8.71236e+00 3.74103e+00  0.00000e+00 0.00000e+00 8.83941e+01 156.762 1.17233e+01 336.762 0.9457 
1 1 1 2   98  5  o 16 5.93508e+00 7.54042e-01 9.77775e+01 96.487  -1.24178e+00 1.09218e+01  0.00000e+00 0.00000e+00 1.12033e+02 96.487  1.42553e+01 96.487  0.9534 
1 1 1 2   98  6  o 15 3.28831e+00 8.97705e-01 1.04533e+02 70.233  1.96063e+00  5.45571e+00  0.00000e+00 0.00000e+00 6.28481e+00 70.233  9.82477e+01 250.233 0.9091 
1 1 1 2   98  7  o 1  4.64811e+00 9.26239e-01 5.44479e+01 153.796 -3.97016e+00 1.95390e+00  0.00000e+00 0.00000e+00 9.68048e+01 153.796 4.23569e+01 153.796 0.8781 
1 1 1 2   98  8  o 3  9.12180e+00 7.67507e-01 1.38941e+02 72.707  7.91380e+00  2.54198e+01  0.00000e+00 0.00000e+00 1.92566e+02 72.707  5.36247e+01 72.707  0.9810 
1 1 1 2   98  9  o 13 3.31784e+00 8.97960e-01 6.87516e+01 135.758 -3.28606e+00 3.20019e+00  0.00000e+00 0.00000e+00 3.97084e+01 135.758 2.90432e+01 315.758 0.8828 
1 1 1 2   98  10 o 19 4.30714e+00 1.09181e+00 6.99388e+01 205.286 -5.66548e+00 -2.67636e+00 0.00000e+00 0.00000e+00 7.61265e+01 205.286 6.18767e+00 205.286 0.9163 
1 1 1 2   98  11 o 14 3.94210e+00 1.05554e+00 1.12476e+02 146.781 -8.92496e+00 5.84445e+00  0.00000e+00 0.00000e+00 2.63277e+01 146.781 8.61478e+01 326.781 0.9519 
1 1 1 2   98  12 o 9  3.23005e+00 1.02581e+00 5.90099e+01 101.283 -9.44339e-01 4.73332e+00  0.00000e+00 0.00000e+00 4.71632e+01 101.283 1.18467e+01 281.283 0.8892 
1 1 1 2   99  0  o 4  9.63362e+00 4.97022e-01 1.23255e+02 79.542  4.08429e+00  2.21284e+01  0.00000e+00 0.00000e+00 2.25962e+02 79.542  1.02707e+02 79.542  0.9775 
1 1 1 2   99  1  o 14 4.89531e+00 7.19490e-01 8.08883e+01 252.963 -2.00581e+00 -6.54579e+00 0.00000e+00 0.00000e+00 8.68169e+01 252.963 5.92863e+00 252.963 0.9238 
1 1 1 2   99  2  o 15 3.58666e+00 8.23568e-01 7.80016e+01 249.767 -1.61765e+00 -4.38880e+00 0.00000e+00 0.00000e+00 3.97558e+01 249.767 3.82458e+01 69.767  0.8853 
1 1 1 2   99  3  o 16 6.95067e+00 6.56593e-01 1.39721e+02 40.243  1.36774e+01  1.15759e+01  0.00000e+00 0.00000e+00 1.10725e+02 40.243  2.89958e+01 220.243 0.9717 
1 1 1 2   99  4  o 6  4.63224e+00 8.07001e-01 7.55595e+01 180.920 -6.15487e+00 -9.88863e-02 0.00000e+00 0.00000e+00 8.15425e+01 180.920 5.98306e+00 180.920 0.9147 
1 1 1 2   99  5  o 1  8.61758e+00 6.15130e-01 1.60712e+02 11.787  2.42780e+01  5.06630e+00  0.00000e+00 0.00000e+00 1.52233e+02 11.787  8.47887e+00 191.787 0.9796 
1 1 1 2   99  6  o 14 2.95508e+00 8.56110e-01 4.33210e+01 358.037 2.12932e+00  -7.29669e-02 0.00000e+00 0.00000e+00 3.53222e+01 358.037 7.99884e+00 178.037 0.7181 
1 1 1 2   99  7  o 3  6.07966e+00 8.57519e-01 1.02152e+02 92.968  -6.02892e-01 1.16276e+01  0.00000e+00 0.00000e+00 1.13190e+02 92.968  1.10381e+01 92.968  0.9560 
1 1 1 2   99  8  o 18 3.61653e+00 9.49586e-01 2.61486e+01 194.426 -1.70034e+00 -4.37382e-01 0.00000e+00 0.00000e+00 6.13512e+01 194.426 3.52026e+01 194.426 0.6533 
1 1 1 2   99  9  o 2  6.13423e+00 9.99482e-01 6.74652e+01 215.881 -6.68371e+00 -4.83480e+00 0.00000e+00 0.00000e+00 1.45370e+02 215.881 7.79049e+01 215.881 0.9373 
1 1 1 2   99  10 o 9  4.83711e+00 1.07245e+00 6.34035e+01 154.563 -5.78680e+00 2.75232e+00  0.00000e+00 0.00000e+00 1.00941e+02 154.563 3.75378e+01 154.563 0.9183 
1 1 1 2   99  11 f 0  1.07613e+01 9.16398e-01 1.48359e+02 31.797  3.45348e+01  2.14100e+01  0.00000e+00 0.00000e+00 2.44657e+02 31.797  9.62977e+01 31.797  0.9876 
1 1 1 2   99  12 o 2  4.60659e+00 1.21579e+00 7.66718e+01 219.545 -6.12739e+00 -5.05915e+00 0.00000e+00 0.00000e+00 8.24670e+01 219.545 5.79518e+00 219.545 0.9348 
1 1 1 2   100 0  o 17 3.27513e+00 7.50558e-01 7.24389e+01 330.049 3.55894e+00  -2.05073e+00 0.00000e+00 0.00000e+00 3.28966e+01 330.049 3.95422e+01 150.049 0.8675 
1 1 1 2   100 1  o 7  5.99704e+00 6.88813e-01 1.56331e+02 121.526 -8.70713e+00 1.41942e+01  0.00000e+00 0.00000e+00 5.92268e+01 121.526 9.71042e+01 301.526 0.9695 
1 1 1 2   100 2  o 19 2.69348e+00 7.46625e-01 8.51981e+01 149.912 -3.50904e+00 2.03311e+00  0.00000e+00 0.00000e+00 1.24266e+00 149.912 8.39555e+01 329.912 0.8656 
1 1 1 2   100 3  o 19 4.27454e+00 7.86036e-01 1.02760e+02 175.200 -7.78865e+00 6.53979e-01  0.00000e+00 0.00000e+00 4.51909e+01 175.200 5.75690e+01 355.200 0.9336 
1 1 1 2   100 4  o 18 3.59042e+00 7.86934e-01 7.01385e+01 109.549 -1.50743e+00 4.24535e+00  0.00000e+00 0.00000e+00 4.70413e+01 109.549 2.30972e+01 289.549 0.8805 
1 1 1 2   100 5  o 12 3.67050e+00 8.48369e-01 7.04750e+01 227.632 -3.01841e+00 -3.30934e+00 0.00000e+00 0.00000e+00 4.91909e+01 227.632 2.12841e+01 47.632  0.8797 
1 1 1 2   100 6  o 3  5.26151e+00 8.68428e-01 8.18911e+01 161.527 -7.27248e+00 2.42945e+00  0.00000e+00 0.00000e+00 9.98533e+01 161.527 1.79623e+01 161.527 0.9323 
1 1 1 2   100 7  o 6  2.57753e+00 8.00991e-01 1.49301e+01 222.752 -5.68702e-01 -5.25734e-01 0.00000e+00 0.00000e+00 1.95184e+01 222.752 4.58832e+00 222.752 0.3608 
1 1 1 2   100 8  o 13 3.42930e+00 9.64008e-01 3.32849e+01 88.981  3.95932e-02  2.22703e+00  0.00000e+00 0.00000e+00 5.96300e+01 88.981  2.63451e+01 88.981  0.7318 
1 1 1 2   100 9  o 15 2.65893e+00 8.33022e-01 5.08486e+00 173.063 -3.21834e-01 3.91544e-02  0.00000e+00 0.00000e+00 1.06606e+01 173.063 5.57576e+00 173.063 0.1600 
1 1 1 2   100 10 o 17 6.29447e+00 1.13418e+00 1.29992e+02 99.503  -2.63482e+00 1.57401e+01  0.00000e+00 0.00000e+00 9.54230e+01 99.503  3.45694e+01 279.503 0.9681 
1 1 1 2   100 11 o 9  3.78598e+00 1.06885e+00 9.60629e+01 280.572 1.58761e+00  -8.50592e+00 0.00000e+00 0.00000e+00 3.55466e+01 280.572 6.05163e+01 100.572 0.9403 
1 1 1 2   100 12 o 5  4.18115e+00 1.18602e+00 2.97316e+01 26.745  2.61954e+00  1.32008e+00  0.00000e+00 0.00000e+00 9.46128e+01 26.745  6.48812e+01 26.745  0.8049 
1 1 1 2   101 0  o 6  5.17136e+00 6.54872e-01 1.24699e+02 293.698 4.49904e+00  -1.02500e+01 0.00000e+00 0.00000e+00 5.81946e+01 293.698 6.65045e+01 113.698 0.9542 
1 1 1 2   101 1  o 16 7.74785e+00 5.71305e-01 1.28498e+02 205.299 -1.61380e+01 -7.62812e+00 0.00000e+00 0.00000e+00 1.50511e+02 205.299 2.20132e+01 205.299 0.9716 
1 1 1 2   101 2  o 6  2.05719e+00 6.51694e-01 3.16218e+01 297.123 5.63038e-01  -1.09916e+00 0.00000e+00 0.00000e+00 8.29288e+00 297.123 2.33289e+01 117.124 0.5235 
1 1 1 2   101 3  o 11 3.77739e+00 8.33444e-01 5.23617e+01 318.337 2.52095e+00  -2.24318e+00 0.00000e+00 0.00000e+00 6.44331e+01 318.337 1.20713e+01 318.337 0.8343 
1 1 1 2   101 4  o 1  3.21864e+00 8.25890e-01 7.66223e+01 309.505 2.79356e+00  -3.38824e+00 0.00000e+00 0.00000e+00 2.79856e+01 309.505 4.86367e+01 129.505 0.8770 
1 1 1 2   101 5  o 15 3.74581e+00 8.77200e-01 5.77357e+01 168.033 -3.47724e+00 7.37012e-01  0.00000e+00 0.00000e+00 5.93813e+01 168.033 1.64569e+00 168.033 0.8439 
1 1 1 2   101 6  o 7  9.22068e+00 6.62520e-01 1.44782e+02 21.453  2.59778e+01  1.02081e+01  0.00000e+00 0.00000e+00 1.90579e+02 21.453  4.57968e+01 21.453  0.9819 
1 1 1 2   101 7  o 19 3.33808e+00 9.11603e-01 5.69229e+01 20.666  3.41085e+00  1.28657e+00  0.00000e+00 0.00000e+00 4.79370e+01 20.666  8.98581e+00 200.666 0.8484 
1 1 1 2   101 8  o 11 1.44206e+01 7.41900e-01 2.28651e+02 123.521 -4.04073e+01 6.09995e+01  0.00000e+00 0.00000e+00 3.01460e+02 123.521 7.28092e+01 123.521 0.9931 
1 1 1 2   101 9  f 0  9.40936e+00 8.38768e-01 1.45473e+02 255.482 -8.79204e+00 -3.39530e+01 0.00000e+00 0.00000e+00 1.97658e+02 255.482 5.21851e+01 255.482 0.9856 
1 1 1 2   101 10 o 11 3.05550e+00 9.52449e-01 9.12974e+01 1.498   6.61043e+00  1.72895e-01  0.00000e+00 0.00000e+00 1.27604e+01 1.498   7.85370e+01 181.498 0.9209 
1 1 1 2   101 11 o 16 2.61490e+00 8.73752e-01 4.42653e+01 33.138  2.69477e+00  1.75926e+00  0.00000e+00 0.00000e+00 3.54570e+01 33.138  8.80834e+00 213.138 0.8249 
1 1 1 2   101 12 o 6  4.08416e+00 1.06111e+00 5.38914e+01 120.809 -3.09947e+00 5.19764e+00  0.00000e+00 0.00000e+00 8.38601e+01 120.809 2.99687e+01 120.809 0.9132 
1 1 1 2   102 0  o 7  1.11961e+01 4.92643e-01 1.88169e+02 195.398 -4.34555e+01 -1.19682e+01 0.00000e+00 0.00000e+00 2.22048e+02 195.398 3.38786e+01 195.398 0.9888 
1 1 1 2   102 1  o 19 2.53070e+00 7.03628e-01 5.55090e+01 171.848 -2.70237e+00 3.87100e-01  0.00000e+00 0.00000e+00 1.83714e+01 171.848 3.71376e+01 351.848 0.7879 
1 1 1 2   102 2  o 2  6.77864e+00 6.62746e-01 9.69723e+01 80.420  2.08059e+00  1.23267e+01  0.00000e+00 0.00000e+00 1.43939e+02 80.420  4.69664e+01 80.420  0.9591 
1 1 1 2   102 3  o 7  6.42836e+00 7.35331e-01 1.40189e+02 109.658 -5.66600e+00 1.58611e+01  0.00000e+00 0.00000e+00 9.08086e+01 109.658 4.93804e+01 289.658 0.9698 
1 1 1 2   102 4  o 2  2.59910e+00 7.70602e-01 8.01058e+01 166.850 -3.86766e+00 9.03581e-01  0.00000e+00 0.00000e+00 2.93549e+00 166.850 7.71703e+01 346.850 0.8624 
1 1 1 2   102 5  o 14 2.72429e+00 8.02450e-01 3.47893e+01 300.337 8.98505e-01  -1.53535e+00 0.00000e+00 0.00000e+00 3.15987e+01 300.337 3.19067e+00 120.337 0.6579 
1 1 1 2   102 6  o 3  3.00774e+00 8.52080e-01 3.34451e+01 257.300 -4.31649e-01 -1.91532e+00 0.00000e+00 0.00000e+00 4.35899e+01 257.300 1.01447e+01 257.300 0.6917 
1 1 1 2   102 7  o 17 9.03731e+00 7.33994e-01 1.71464e+02 98.133  -5.03474e+00 3.52294e+01  0.00000e+00 0.00000e+00 1.58346e+02 98.133  1.31174e+01 278.133 0.9858 
1 1 1 2   102 8  f 0  8.18451e+00 1.07775e+00 1.00701e+02 269.815 -5.01706e-02 -1.55062e+01 0.00000e+00 0.00000e+00 1.92225e+02 269.815 9.15247e+01 269.815 0.9672 
1 1 1 2   102 9  o 15 3.44565e+00 9.40442e-01 2.58683e+01 44.081  1.49112e+00  1.44403e+00  0.00000e+00 0.00000e+00 6.45973e+01 44.081  3.87290e+01 44.081  0.7098 
1 1 1 2   102 10 o 16 4.38206e+00 1.10531e+00 1.28429e+02 347.358 1.23060e+01  -2.76013e+00 0.00000e+00 0.00000e+00 2.70116e+01 347.358 1.01417e+02 167.358 0.9595 
1 1 1 2   102 11 o 19 8.60084e+00 1.10874e+00 1.79637e+02 158.043 -3.34778e+01 1.34964e+01  0.00000e+00 0.00000e+00 1.33719e+02 158.043 4.59182e+01 338.043 0.9860 
1 1 1 2   102 12 o 11 2.13010e+00 7.50512e-01 7.01883e+00 274.059 4.35450e-02  -6.13640e-01 0.00000e+00 0.00000e+00 1.60982e+01 274.059 9.07937e+00 274.059 0.2939 
1 1 1 2   103 0  o 3  2.44684e+00 6.98061e-01 9.99607e+01 154.619 -4.12540e+00 1.95719e+00  0.00000e+00 0.00000e+00 1.99972e+01 334.619 1.19958e+02 334.619 0.8822 
1 1 1 2   103 1  o 7  6.56348e+00 6.83017e-01 1.54625e+02 127.183 -1.06624e+01 1.40560e+01  0.00000e+00 0.00000e+00 8.15188e+01 127.183 7.31062e+01 307.183 0.9712 
1 1 1 2   103 2  f 0  5.19607e+00 7.87937e-01 8.74716e+01 105.263 -2.17348e+00 7.96504e+00  0.00000e+00 0.00000e+00 9.29465e+01 105.263 5.47490e+00 105.263 0.9373 
1 1 1 2   103 3  o 10 2.74294e+00 7.87256e-01 4.85427e+01 249.376 -8.87023e-01 -2.35688e+00 0.00000e+00 0.00000e+00 2.93824e+01 249.376 1.91603e+01 69.376  0.7670 
1 1 1 2   103 4  o 6  9.46361e+00 5.99025e-01 1.49840e+02 309.537 1.84900e+01  -2.24006e+01 0.00000e+00 0.00000e+00 1.94568e+02 309.537 4.47279e+01 309.537 0.9826 
1 1 1 2   103 5  o 13 3.99643e+00 9.41480e-01 8.31662e+01 43.591  4.28431e+00  4.07862e+00  0.00000e+00 0.00000e+00 5.16501e+01 43.591  3.15161e+01 223.591 0.9110 
1 1 1 2   103 6  o 18 4.19867e+00 9.39739e-01 7.68858e+01 319.587 4.85658e+00  -4.13519e+00 0.00000e+00 0.00000e+00 6.57804e+01 319.587 1.11054e+01 139.587 0.9179 
1 1 1 2   103 7  o 6  2.82005e+00 8.58429e-01 3.40807e+01 313.945 1.40452e+00  -1.45719e+00 0.00000e+00 0.00000e+00 3.91468e+01 313.945 5.06610e+00 313.945 0.7017 
1 1 1 2   103 8  o 5  4.49169e+00 1.14557e+00 1.07903e+02 118.732 -4.47862e+00 8.16956e+00  0.00000e+00 0.00000e+00 4.90730e+01 118.732 5.88301e+01 298.732 0.9447 
1 1 1 2   103 9  o 9  2.81374e+00 8.94564e-01 4.85355e+01 217.477 -2.56327e+00 -1.96525e+00 0.00000e+00 0.00000e+00 3.73690e+01 217.477 1.11665e+01 37.477  0.8256 
1 1 1 2   103 10 o 14 4.48485e+00 1.13782e+00 8.80540e+01 226.565 -6.18261e+00 -6.52998e+00 0.00000e+00 0.00000e+00 6.81942e+01 226.565 1.98598e+01 46.565  0.9426 
1 1 1 2   103 11 o 18 2.42195e+00 8.21594e-01 4.73597e+01 252.951 -1.08114e+00 -3.52539e+00 0.00000e+00 0.00000e+00 2.87129e+01 252.951 1.86468e+01 72.951  0.8503 
1 1 1 2   103 12 o 2  2.48441e+00 8.49459e-01 6.18539e+01 78.399  1.11741e+00  5.44299e+00  0.00000e+00 0.00000e+00 2.11340e+01 78.399  4.07199e+01 258.399 0.9049 
1 1 1 2   104 0  o 11 7.09061e+00 5.86333e-01 1.34779e+02 344.487 1.81312e+01  -5.03265e+00 0.00000e+00 0.00000e+00 1.20724e+02 344.487 1.40552e+01 164.487 0.9731 
1 1 1 2   104 1  o 7  5.95692e+00 7.41233e-01 5.15140e+01 228.659 -3.70935e+00 -4.21616e+00 0.00000e+00 0.00000e+00 1.48342e+02 228.659 9.68281e+01 228.659 0.9059 
1 1 1 2   104 2  o 18 1.13536e+01 5.48005e-01 1.87995e+02 331.782 3.61405e+01  -1.93929e+01 0.00000e+00 0.00000e+00 2.27309e+02 331.782 3.93139e+01 331.782 0.9877 
1 1 1 2   104 3  o 8  3.92448e+00 8.78503e-01 9.33444e+01 155.336 -5.78164e+00 2.65489e+00  0.00000e+00 0.00000e+00 4.00123e+01 155.336 5.33321e+01 335.336 0.9176 
1 1 1 2   104 4  o 2  1.19166e+01 5.73087e-01 1.64013e+02 359.026 4.18391e+01  -7.11123e-01 0.00000e+00 0.00000e+00 2.71903e+02 359.026 1.07890e+02 359.026 0.9880 
1 1 1 2   104 5  o 5  4.76539e+00 9.34727e-01 1.11230e+02 247.022 -3.91685e+00 -9.23715e+00 0.00000e+00 0.00000e+00 5.61406e+01 247.022 5.50894e+01 67.021  0.9488 
1 1 1 2   104 6  o 10 3.08757e+00 8.62656e-01 6.82029e+01 86.008  3.09677e-01  4.43747e+00  0.00000e+00 0.00000e+00 3.22145e+01 86.008  3.59884e+01 266.008 0.8788 
1 1 1 2   104 7  o 13 6.45939e+00 9.08779e-01 1.08077e+02 354.979 1.48106e+01  -1.30112e+00 0.00000e+00 0.00000e+00 1.22720e+02 354.979 1.46429e+01 354.979 0.9658 
1 1 1 2   104 8  o 18 8.19452e+00 1.12385e+00 1.74350e+02 221.120 -2.02411e+01 -1.76699e+01 0.00000e+00 0.00000e+00 1.23016e+02 221.120 5.13336e+01 41.120  0.9812 
1 1 1 2   104 9  o 6  1.25172e+01 7.64147e-01 1.57379e+02 22.840  5.01282e+01  2.11130e+01  0.00000e+00 0.00000e+00 3.01070e+02 22.840  1.43691e+02 22.840  0.9908 
1 1 1 2   104 10 f 0  3.69796e+00 9.67907e-01 4.66976e+01 228.086 -3.18379e+00 -3.54671e+00 0.00000e+00 0.00000e+00 7.45873e+01 228.086 2.78897e+01 228.086 0.8877 
1 1 1 2   104 11 o 15 2.91085e+00 9.47186e-01 6.09948e+01 103.369 -1.13757e+00 4.78642e+00  0.00000e+00 0.00000e+00 3.48324e+01 103.369 2.61623e+01 283.369 0.8915 
1 1 1 2   105 0  o 13 1.08196e+01 5.14278e-01 1.52902e+02 68.433  1.18085e+01  2.98752e+01  0.00000e+00 0.00000e+00 2.41366e+02 68.433  8.84632e+01 68.433  0.9843 
1 1 1 2   105 1  f 0  6.12440e+00 7.32361e-01 1.33438e+02 359.150 1.53786e+01  -2.28107e-01 0.00000e+00 0.00000e+00 8.58055e+01 359.150 4.76329e+01 179.150 0.9669 
1 1 1 2   105 2  o 13 5.17492e+00 7.96870e-01 4.65982e+01 62.700  2.04922e+00  3.97030e+00  0.00000e+00 0.00000e+00 1.21882e+02 62.700  7.52833e+01 62.700  0.8794 
1 1 1 2   105 3  o 9  6.26630e+00 7.54585e-01 9.17547e+01 169.673 -1.10605e+01 2.01543e+00  0.00000e+00 0.00000e+00 1.29653e+02 169.673 3.78983e+01 169.673 0.9544 
1 1 1 2   105 4  o 11 3.30191e+00 8.47531e-01 4.22530e+01 111.792 -1.01430e+00 2.53701e+00  0.00000e+00 0.00000e+00 5.40643e+01 111.792 1.18113e+01 111.792 0.7881 
1 1 1 2   105 5  o 7  4.21274e+00 9.36789e-01 9.74144e+01 221.307 -5.81043e+00 -5.10585e+00 0.00000e+00 0.00000e+00 4.80321e+01 221.307 4.93822e+01 41.307  0.9329 
1 1 1 2   105 6  o 18 4.40273e+00 9.47584e-01 8.65210e+01 191.138 -7.40627e+00 -1.45815e+00 0.00000e+00 0.00000e+00 6.51638e+01 191.138 2.13572e+01 11.138  0.9312 
1 1 1 2   105 7  o 14 4.43935e+00 1.01242e+00 9.66747e+01 134.093 -6.24388e+00 6.44482e+00  0.00000e+00 0.00000e+00 5.80829e+01 134.093 3.85918e+01 314.093 0.9425 
1 1 1 2   105 8  o 15 6.71257e+00 1.01622e+00 1.06710e+02 24.223  1.41569e+01  6.36927e+00  0.00000e+00 0.00000e+00 1.33340e+02 24.223  2.66296e+01 24.223  0.9672 
1 1 1 2   105 9  o 16 3.06149e+00 8.97388e-01 5.63456e+01 175.068 -4.45128e+00 3.84120e-01  0.00000e+00 0.00000e+00 4.31486e+01 175.068 1.31969e+01 355.068 0.8794 
1 1 1 2   105 10 o 9  3.34676e+00 9.45408e-01 5.86850e+01 230.737 -3.39910e+00 -4.15833e+00 0.00000e+00 0.00000e+00 5.27391e+01 230.737 5.94591e+00 50.737  0.9013 
1 1 1 2   105 11 o 19 3.54729e+00 1.07383e+00 7.51027e+01 103.997 -1.77174e+00 7.10788e+00  0.00000e+00 0.00000e+00 4.65550e+01 103.997 2.85477e+01 283.997 0.9290 
1 1 1 2   106 0  o 17 1.45437e+01 4.99226e-01 2.13392e+02 357.455 6.74189e+01  -2.99652e+00 0.00000e+00 0.00000e+00 3.20872e+02 357.455 1.07479e+02 357.455 0.9926 
1 1 1 2   106 1  o 17 9.82860e+00 5.81955e-01 1.64422e+02 294.932 1.42799e+01  -3.07187e+01 0.00000e+00 0.00000e+00 1.93947e+02 294.932 2.95247e+01 294.932 0.9851 
1 1 1 2   106 2  o 19 7.09121e+00 6.90167e-01 1.70681e+02 220.542 -1.85856e+01 -1.58970e+01 0.00000e+00 0.00000e+00 8.63550e+01 220.542 8.43260e+01 40.542  0.9793 
1 1 1 2   106 3  o 15 9.18744e+00 6.23413e-01 1.24479e+02 182.681 -2.56027e+01 -1.19883e+00 0.00000e+00 0.00000e+00 2.08840e+02 182.681 8.43612e+01 182.681 0.9803 
1 1 1 2   106 4  o 7  4.82349e+00 7.84372e-01 8.44459e+01 71.782  2.79084e+00  8.47916e+00  0.00000e+00 0.00000e+00 8.37276e+01 71.782  7.18338e-01 251.781 0.9422 
1 1 1 2   106 5  o 3  8.32763e+00 7.16928e-01 1.56525e+02 205.837 -2.69419e+01 -1.30456e+01 0.00000e+00 0.00000e+00 1.46382e+02 205.837 1.01435e+01 25.837  0.9832 
1 1 1 2   106 6  o 8  2.68617e+00 8.36885e-01 5.78462e+01 70.457  1.16447e+00  3.28054e+00  0.00000e+00 0.00000e+00 2.56230e+01 70.457  3.22233e+01 250.457 0.8401 
1 1 1 2   106 7  o 8  3.15646e+00 9.30612e-01 4.25578e+01 281.159 6.18373e-01  -3.13482e+00 0.00000e+00 0.00000e+00 5.35487e+01 281.159 1.09909e+01 281.159 0.8234 
1 1 1 2   106 8  o 4  3.97186e+00 1.00375e+00 3.74566e+01 135.287 -2.34086e+00 2.31751e+00  0.00000e+00 0.00000e+00 8.43311e+01 135.287 4.68745e+01 135.287 0.8296 
1 1 1 2   106 9  o 10 2.48321e+00 8.11713e-01 4.10365e+01 265.565 -2.44876e-01 -3.15725e+00 0.00000e+00 0.00000e+00 3.43397e+01 265.565 6.69688e+00 85.565  0.8216 
1 1 1 2   106 10 o 7  3.10810e+00 9.59052e-01 3.21485e+01 135.049 -2.07102e+00 2.06751e+00  0.00000e+00 0.00000e+00 6.01744e+01 135.049 2.80259e+01 135.049 0.8044 
1 1 1 2   106 11 o 13 4.05711e+00 1.11713e+00 4.68197e+01 332.150 4.44956e+00  -2.35094e+00 0.00000e+00 0.00000e+00 8.70620e+01 332.150 4.02423e+01 332.150 0.8941 
1 1 1 2   107 0  o 17 2.64843e+00 7.54497e-01 6.99947e+01 57.538  1.97641e+00  3.10687e+00  0.00000e+00 0.00000e+00 1.33059e+01 57.538  5.66887e+01 237.538 0.8501 
1 1 1 2   107 1  o 5  2.86311e+00 7.86356e-01 9.88474e+01 221.945 -4.31318e+00 -3.87617e+00 0.00000e+00 0.00000e+00 2.53616e+00 41.945  1.01384e+02 41.945  0.9091 
1 1 1 2   107 2  o 12 7.26761e+00 7.10160e-01 8.21431e+01 106.718 -3.64250e+00 1.21273e+01  0.00000e+00 0.00000e+00 1.75919e+02 106.718 9.37763e+01 106.718 0.9597 
1 1 1 2   107 3  o 14 6.22053e+00 7.74432e-01 7.88155e+01 263.445 -1.23489e+00 -1.07460e+01 0.00000e+00 0.00000e+00 1.40423e+02 263.445 6.16073e+01 263.445 0.9526 
1 1 1 2   107 4  o 5  7.12769e+00 7.51577e-01 1.15325e+02 144.997 -1.52986e+01 1.07134e+01  0.00000e+00 0.00000e+00 1.41194e+02 144.997 2.58695e+01 144.997 0.9728 
1 1 1 2   107 5  o 19 3.58792e+00 9.34478e-01 4.45033e+01 96.378  -3.47558e-01 3.10952e+00  0.00000e+00 0.00000e+00 6.41917e+01 96.378  1.96884e+01 96.378  0.8191 
1 1 1 2   107 6  o 2  2.81535e+00 8.48267e-01 4.15641e+01 123.099 -1.51481e+00 2.32377e+00  0.00000e+00 0.00000e+00 4.08617e+01 123.099 7.02395e-01 303.099 0.7918 
1 1 1 2   107 7  o 12 8.33255e+00 8.13800e-01 1.40975e+02 15.402  2.91493e+01  8.03040e+00  0.00000e+00 0.00000e+00 1.61902e+02 15.402  2.09271e+01 15.402  0.9833 
1 1 1 2   107 8  o 5  3.60743e+00 9.61145e-01 2.93642e+01 129.900 -1.78574e+00 2.13572e+00  0.00000e+00 0.00000e+00 7.62949e+01 129.900 4.69306e+01 129.900 0.7926 
1 1 1 2   107 9  o 12 2.80364e+00 8.69965e-01 6.07697e+01 168.170 -4.65548e+00 9.75143e-01  0.00000e+00 0.00000e+00 3.11239e+01 168.170 2.96458e+01 348.170 0.8874 
1 1 1 2   107 10 o 3  2.39729e+00 8.12912e-01 5.03374e+01 299.266 1.86133e+00  -3.32144e+00 0.00000e+00 0.00000e+00 2.53906e+01 299.266 2.49467e+01 119.266 0.8557 
1 1 1 2   107 11 o 17 3.68139e+00 1.10021e+00 9.19426e+01 68.045  3.55160e+00  8.81065e+00  0.00000e+00 0.00000e+00 3.65239e+01 68.045  5.54187e+01 248.045 0.9458 
1 1 1 2   108 0  o 13 8.16089e+00 6.16623e-01 1.55494e+02 277.793 3.93436e+00  -2.87490e+01 0.00000e+00 0.00000e+00 1.41119e+02 277.793 1.43749e+01 97.793  0.9826 
1 1 1 2   108 1  o 4  4.12244e+00 8.06186e-01 9.10660e+01 211.411 -6.56992e+00 -4.01197e+00 0.00000e+00 0.00000e+00 5.11451e+01 211.411 3.99209e+01 31.411  0.9326 
1 1 1 2   108 2  o 10 4.92801e+00 8.57110e-01 6.45771e+01 51.556  3.92964e+00  4.95014e+00  0.00000e+00 0.00000e+00 1.02593e+02 51.556  3.80157e+01 51.556  0.9171 
1 1 1 2   108 3  o 9  4.19890e+00 9.14601e-01 4.81727e+01 102.425 -8.87801e-01 4.02950e+00  0.00000e+00 0.00000e+00 8.66649e+01 102.425 3.84922e+01 102.425 0.8682 
1 1 1 2   108 4  o 1  1.02239e+01 6.30825e-01 1.82539e+02 338.288 4.20743e+01  -1.67535e+01 0.00000e+00 0.00000e+00 1.91370e+02 338.288 8.83140e+00 338.288 0.9889 
1 1 1 2   108 5  o 13 9.52070e+00 6.51542e-01 1.53441e+02 172.524 -3.66424e+01 4.80830e+00  0.00000e+00 0.00000e+00 1.93795e+02 172.524 4.03543e+01 172.524 0.9864 
1 1 1 2   108 6  o 1  4.19031e+00 1.00029e+00 7.35897e+01 73.226  1.99824e+00  6.62921e+00  0.00000e+00 0.00000e+00 6.96405e+01 73.226  3.94919e+00 253.226 0.9247 
1 1 1 2   108 7  o 13 2.40951e+00 7.83944e-01 9.80599e+01 267.049 -3.12886e-01 -6.06877e+00 0.00000e+00 0.00000e+00 1.67172e+01 87.049  1.14777e+02 87.049  0.9135 
1 1 1 2   108 8  o 13 3.72784e+00 1.00256e+00 4.01148e+01 194.162 -3.49479e+00 -8.81840e-01 0.00000e+00 0.00000e+00 7.64371e+01 194.162 3.63223e+01 194.162 0.8464 
1 1 1 2   108 9  o 4  5.73068e+00 1.08580e+00 6.45993e+01 125.581 -5.14660e+00 7.19361e+00  0.00000e+00 0.00000e+00 1.34654e+02 125.581 7.00545e+01 125.581 0.9417 
1 1 1 2   108 10 o 6  4.54236e+00 1.09042e+00 3.47917e+01 48.212  2.80425e+00  3.13770e+00  0.00000e+00 0.00000e+00 1.11234e+02 48.212  7.64426e+01 48.212  0.8711 
1 1 1 2   109 0  o 12 2.74172e+00 8.22235e-01 6.15618e+01 155.044 -3.09955e+00 1.44245e+00  0.00000e+00 0.00000e+00 2.32696e+01 155.044 3.82921e+01 335.044 0.8367 
1 1 1 2   109 1  o 10 4.32632e+00 8.08185e-01 1.03819e+02 109.894 -3.09874e+00 8.56284e+00  0.00000e+00 0.00000e+00 4.71082e+01 109.894 5.67111e+01 289.894 0.9434 
1 1 1 2   109 2  o 9  3.47512e+00 8.91265e-01 1.00076e+02 17.856  6.85362e+00  2.20781e+00  0.00000e+00 0.00000e+00 1.91411e+01 17.856  8.09344e+01 197.856 0.9277 
1 1 1 2   109 3  o 4  2.95658e+00 8.43161e-01 4.03400e+01 205.085 -2.29914e+00 -1.07627e+00 0.00000e+00 0.00000e+00 4.37443e+01 205.085 3.40425e+00 205.085 0.7691 
1 1 1 2   109 4  o 18 4.12175e+00 8.75751e-01 7.06636e+01 158.064 -5.89023e+00 2.37213e+00  0.00000e+00 0.00000e+00 6.91480e+01 158.064 1.51555e+00 338.064 0.9175 
1 1 1 2   109 5  o 13 3.20917e+00 8.81200e-01 3.03751e+01 251.805 -7.22488e-01 -2.19813e+00 0.00000e+00 0.00000e+00 5.77792e+01 251.805 2.74041e+01 251.805 0.7431 
1 1 1 2   109 6  o 15 5.39272e+00 9.70677e-01 1.16878e+02 352.438 1.40654e+01  -1.86716e+00 0.00000e+00 0.00000e+00 7.52530e+01 352.438 4.16253e+01 172.438 0.9641 
1 1 1 2   109 7  o 9  7.19635e+00 8.63008e-01 1.29120e+02 157.760 -2.19248e+01 8.96535e+00  0.00000e+00 0.00000e+00 1.31062e+02 157.760 1.94186e+00 157.760 0.9787 
1 1 1 2   109 8  o 9  4.43582e+00 1.04452e+00 8.30098e+01 4.782   8.92458e+00  7.46517e-01  0.00000e+00 0.00000e+00 7.13656e+01 4.782   1.16442e+01 184.781 0.9424 
1 1 1 2   109 9  o 14 2.77902e+00 8.86392e-01 7.45783e+01 260.699 -1.01065e+00 -6.17118e+00 0.00000e+00 0.00000e+00 1.93998e+01 260.699 5.51785e+01 80.699  0.9161 
1 1 1 2   109 10 o 18 3.96674e+00 1.10852e+00 1.19916e+02 340.174 1.19731e+01  -4.31664e+00 0.00000e+00 0.00000e+00 2.05624e+01 340.174 9.93539e+01 160.174 0.9599 
1 1 1 2   110 0  o 1  1.13044e+01 5.98270e-01 1.68927e+02 213.012 -3.93353e+01 -2.55562e+01 0.00000e+00 0.00000e+00 2.44481e+02 213.012 7.55537e+01 213.012 0.9893 
1 1 1 2   110 1  o 6  6.38570e+00 7.69496e-01 8.20676e+01 81.431  1.73212e+00  1.14949e+01  0.00000e+00 0.00000e+00 1.43608e+02 81.431  6.15400e+01 81.431  0.9560 
1 1 1 2   110 2  o 18 3.61478e+00 8.81542e-01 4.93780e+01 265.983 -2.54056e-01 -3.61810e+00 0.00000e+00 0.00000e+00 6.38708e+01 265.983 1.44928e+01 265.983 0.8475 
1 1 1 2   110 3  o 7  6.41660e+00 7.81626e-01 1.15817e+02 10.357  1.70111e+01  3.10881e+00  0.00000e+00 0.00000e+00 1.14412e+02 10.357  1.40534e+00 190.357 0.9706 
1 1 1 2   110 4  o 17 6.94334e+00 7.66370e-01 1.10243e+02 195.320 -1.85738e+01 -5.08816e+00 0.00000e+00 0.00000e+00 1.39631e+02 195.320 2.93882e+01 195.320 0.9737 
1 1 1 2   110 5  o 9  6.45603e+00 9.15945e-01 1.30213e+02 69.113  6.60660e+00  1.73128e+01  0.00000e+00 0.00000e+00 1.01829e+02 69.113  2.83838e+01 249.113 0.9726 
1 1 1 2   110 6  o 17 4.10913e+00 9.64192e-01 3.32378e+01 304.782 1.74217e+00  -2.50828e+00 0.00000e+00 0.00000e+00 9.03174e+01 304.782 5.70796e+01 304.782 0.8139 
1 1 1 2   110 7  o 6  2.95789e+00 8.92597e-01 6.03392e+01 201.298 -4.32023e+00 -1.68423e+00 0.00000e+00 0.00000e+00 3.62543e+01 201.298 2.40849e+01 21.298  0.8842 
1 1 1 2   110 8  o 8  3.66677e+00 9.96879e-01 6.11327e+01 306.073 3.56688e+00  -4.89616e+00 0.00000e+00 0.00000e+00 6.24940e+01 306.073 1.36137e+00 306.073 0.9132 
1 1 1 2   110 9  o 11 4.36575e+00 1.11619e+00 6.69651e+01 84.486  6.60655e-01  6.84341e+00  0.00000e+00 0.00000e+00 8.19137e+01 84.486  1.49485e+01 84.486  0.9241 
1 1 1 2   110 10 o 4  5.00613e+00 1.18621e+00 1.05961e+02 117.756 -6.29497e+00 1.19618e+01  0.00000e+00 0.00000e+00 7.17162e+01 117.756 3.42444e+01 297.756 0.9623 
1 1 1 2   111 0  o 8  2.14652e+00 6.99136e-01 4.27132e+01 27.718  1.87012e+00  9.82583e-01  0.00000e+00 0.00000e+00 1.40375e+01 27.718  2.86756e+01 207.718 0.7154 
1 1 1 2   111 1  o 15 3.07211e+00 8.61680e-01 4.61109e+01 160.707 -2.77712e+00 9.72161e-01  0.00000e+00 0.00000e+00 4.53581e+01 160.707 7.52734e-01 340.707 0.8056 
1 1 1 2   111 2  o 10 2.54944e+00 7.47619e-01 5.17159e+01 13.258  3.05000e+00  7.18637e-01  0.00000e+00 0.00000e+00 2.54865e+01 13.258  2.62294e+01 193.258 0.8194 
1 1 1 2   111 3  o 7  3.24511e+00 8.73589e-01 6.38996e+01 254.528 -1.28672e+00 -4.64868e+00 0.00000e+00 0.00000e+00 4.27240e+01 254.528 2.11756e+01 74.528  0.8891 
1 1 1 2   111 4  o 1  5.67987e+00 8.57821e-01 8.77261e+01 47.011  8.56792e+00  9.19162e+00  0.00000e+00 0.00000e+00 1.13609e+02 47.011  2.58827e+01 47.011  0.9593 
1 1 1 2   111 5  o 11 4.53941e+00 9.65763e-01 5.58466e+01 257.049 -1.28146e+00 -5.57258e+00 0.00000e+00 0.00000e+00 9.63772e+01 257.049 4.05306e+01 257.049 0.9077 
1 1 1 2   111 6  o 16 6.77429e+00 8.58375e-01 7.99853e+01 224.930 -1.10935e+01 -1.10667e+01 0.00000e+00 0.00000e+00 1.62087e+02 224.930 8.21019e+01 224.930 0.9675 
1 1 1 2   111 7  o 3  3.42653e+00 9.16446e-01 8.47471e+01 57.048  4.33376e+00  6.68570e+00  0.00000e+00 0.00000e+00 3.35352e+01 57.048  5.12119e+01 237.048 0.9350 
1 1 1 2   111 8  o 12 4.28891e+00 1.02128e+00 8.97602e+01 208.964 -8.63916e+00 -4.78160e+00 0.00000e+00 0.00000e+00 6.02873e+01 208.964 2.94728e+01 28.964  0.9479 
1 1 1 2   111 9  o 16 2.80659e+00 9.03337e-01 5.71395e+01 341.308 5.03825e+00  -1.70460e+00 0.00000e+00 0.00000e+00 3.60738e+01 341.308 2.10657e+01 161.308 0.9003 
1 1 1 2   112 0  o 1  2.74288e+00 8.07001e-01 2.04742e+01 45.581  8.97649e-01  9.16043e-01  0.00000e+00 0.00000e+00 3.40030e+01 45.581  1.35289e+01 45.581  0.5376 
1 1 1 2   112 1  o 9  9.63547e+00 6.30009e-01 1.60005e+02 187.705 -4.22242e+01 -5.71293e+00 0.00000e+00 0.00000e+00 1.91784e+02 187.705 3.17787e+01 187.705 0.9882 
1 1 1 2   112 2  o 1  2.12031e+00 6.87321e-01 4.16809e+01 291.894 9.03117e-01  -2.24729e+00 0.00000e+00 0.00000e+00 1.75594e+01 291.894 2.41215e+01 111.894 0.7562 
1 1 1 2   112 3  o 16 2.48572e+00 7.91191e-01 7.18357e+01 9.165   4.68601e+00  7.56009e-01  0.00000e+00 0.00000e+00 9.63143e+00 9.165   6.22043e+01 189.165 0.8872 
1 1 1 2   112 4  o 8  2.36857e+00 7.63342e-01 2.46530e+01 133.693 -1.06720e+00 1.11702e+00  0.00000e+00 0.00000e+00 2.84565e+01 133.693 3.80349e+00 133.693 0.6070 
1 1 1 2   112 5  o 4  2.79281e+00 8.46884e-01 1.03700e+01 274.342 5.50174e-02  -7.24609e-01 0.00000e+00 0.00000e+00 2.48316e+01 274.342 1.44616e+01 274.342 0.3413 
1 1 1 2   112 6  o 15 4.63439e+00 1.02224e+00 4.01399e+01 240.828 -2.10415e+00 -3.76917e+00 0.00000e+00 0.00000e+00 1.09525e+02 240.828 6.93855e+01 240.828 0.8747 
1 1 1 2   112 7  o 7  2.69281e+00 8.65195e-01 2.32979e+01 194.676 -1.69898e+00 -4.44957e-01 0.00000e+00 0.00000e+00 4.16448e+01 194.676 1.83469e+01 194.676 0.6534 
1 1 1 2   112 8  o 17 2.82123e+00 8.53713e-01 4.40467e+01 358.619 4.16249e+00  -1.00383e-01 0.00000e+00 0.00000e+00 4.64641e+01 358.619 2.41730e+00 358.619 0.8695 
1 1 1 2   112 9  o 6  2.48894e+00 8.26454e-01 4.34989e+01 174.863 -3.81769e+00 3.43226e-01  0.00000e+00 0.00000e+00 3.51461e+01 174.863 8.35277e+00 354.863 0.8568 
1 1 1 2   113 0  o 14 4.19173e+00 9.13652e-01 5.51162e+01 190.187 -5.46499e+00 -9.82034e-01 0.00000e+00 0.00000e+00 8.49565e+01 190.187 2.98402e+01 190.187 0.9048 
1 1 1 2   113 1  o 7  2.67287e+00 7.69145e-01 5.85403e+01 281.090 8.10099e-01  -4.13282e+00 0.00000e+00 0.00000e+00 2.74644e+01 281.090 3.10758e+01 101.090 0.8712 
1 1 1 2   113 2  o 2  5.33322e+00 8.74895e-01 1.08632e+02 270.701 1.61074e-01  -1.31695e+01 0.00000e+00 0.00000e+00 8.07134e+01 270.701 2.79189e+01 90.701  0.9613 
1 1 1 2   113 3  o 5  7.98566e+00 7.09597e-01 1.12132e+02 102.152 -5.18814e+00 2.40939e+01  0.00000e+00 0.00000e+00 1.76744e+02 102.152 6.46119e+01 102.152 0.9795 
1 1 1 2   113 4  o 19 2.93415e+00 8.27059e-01 3.81862e+01 277.725 3.74564e-01  -2.76125e+00 0.00000e+00 0.00000e+00 4.77204e+01 277.725 9.53425e+00 277.725 0.7929 
1 1 1 2   113 5  o 12 3.97132e+00 9.07261e-01 6.32339e+01 292.385 2.56936e+00  -6.23831e+00 0.00000e+00 0.00000e+00 7.20349e+01 292.385 8.80103e+00 292.385 0.9226 
1 1 1 2   113 6  o 10 3.90617e+00 9.73345e-01 9.15437e+01 138.479 -6.96270e+00 6.16459e+00  0.00000e+00 0.00000e+00 4.46453e+01 138.479 4.68984e+01 318.479 0.9446 
1 1 1 2   113 7  o 15 3.58852e+00 1.04537e+00 5.76672e+01 35.763  4.21060e+00  3.03263e+00  0.00000e+00 0.00000e+00 6.11827e+01 35.763  3.51553e+00 35.763  0.8976 
1 1 1 2   113 8  o 7  3.69586e+00 1.00387e+00 7.37267e+01 196.815 -7.63106e+00 -2.30614e+00 0.00000e+00 0.00000e+00 5.37315e+01 196.815 1.99952e+01 16.815  0.9350 
1 1 1 2   113 9  o 8  2.65141e+00 8.49144e-01 4.13930e+01 294.632 1.71855e+00  -3.74804e+00 0.00000e+00 0.00000e+00 4.34659e+01 294.632 2.07288e+00 294.632 0.8681 
1 1 1 2   114 0  o 9  3.86975e+00 8.75610e-01 6.26486e+01 162.603 -5.67914e+00 1.77935e+00  0.00000e+00 0.00000e+00 6.75965e+01 162.603 4.94799e+00 162.603 0.9116 
1 1 1 2   114 1  o 17 4.70882e+00 8.65761e-01 6.77769e+01 8.929   7.79364e+00  1.22449e+00  0.00000e+00 0.00000e+00 9.46620e+01 8.929   2.68851e+01 8.929   0.9343 
1 1 1 2   114 2  o 11 3.82335e+00 8.92933e-01 8.86942e+01 162.456 -7.73111e+00 2.44412e+00  0.00000e+00 0.00000e+00 4.34585e+01 162.456 4.52357e+01 342.456 0.9361 
1 1 1 2   114 3  o 12 5.15847e+00 8.78298e-01 6.32809e+01 190.674 -7.67049e+00 -1.44570e+00 0.00000e+00 0.00000e+00 1.14515e+02 190.674 5.12340e+01 190.674 0.9336 
1 1 1 2   114 4  o 8  3.37679e+00 8.46123e-01 3.45963e+01 240.730 -1.66963e+00 -2.97885e+00 0.00000e+00 0.00000e+00 6.96809e+01 240.730 3.50845e+01 240.730 0.8365 
1 1 1 2   114 5  o 6  2.77405e+00 8.17594e-01 2.40637e+01 278.778 2.88372e-01  -1.86746e+00 0.00000e+00 0.00000e+00 4.54329e+01 278.778 2.13692e+01 278.778 0.6788 
1 1 1 2   114 6  o 3  3.17580e+00 9.28325e-01 5.73717e+01 342.961 5.04012e+00  -1.54463e+00 0.00000e+00 0.00000e+00 4.80124e+01 342.961 9.35931e+00 162.961 0.8993 
1 1 1 2   114 7  o 5  4.06587e+00 1.07958e+00 9.53685e+01 359.029 1.02346e+01  -1.73520e-01 0.00000e+00 0.00000e+00 4.70827e+01 359.029 4.82858e+01 179.029 0.9498 
1 1 1 2   114 8  o 1  2.52485e+00 8.19190e-01 2.76222e+01 215.701 -2.15314e+00 -1.54723e+00 0.00000e+00 0.00000e+00 4.50419e+01 215.701 1.74197e+01 215.701 0.7805 
1 1 1 2   115 0  o 10 2.83860e+00 7.92311e-01 2.87797e+01 351.173 2.14647e+00  -3.33326e-01 0.00000e+00 0.00000e+00 4.70874e+01 351.173 1.83076e+01 351.173 0.7241 
1 1 1 2   115 1  o 6  2.90054e+00 7.99814e-01 6.44995e+01 122.497 -2.55443e+00 4.01004e+00  0.00000e+00 0.00000e+00 3.05039e+01 122.497 3.39956e+01 302.497 0.8874 
1 1 1 2   115 2  o 5  2.85494e+00 8.48168e-01 5.21105e+01 165.965 -3.61826e+00 9.04504e-01  0.00000e+00 0.00000e+00 3.76992e+01 165.965 1.44113e+01 345.965 0.8523 
1 1 1 2   115 3  o 10 3.12275e+00 8.79169e-01 3.36461e+01 250.206 -1.00900e+00 -2.80351e+00 0.00000e+00 0.00000e+00 5.95339e+01 250.206 2.58877e+01 250.206 0.8085 
1 1 1 2   115 4  o 13 3.23747e+00 8.97504e-01 5.43991e+01 203.549 -4.26973e+00 -1.86089e+00 0.00000e+00 0.00000e+00 5.13099e+01 203.549 3.08917e+00 23.549  0.8848 
1 1 1 2   115 5  f 0  6.66687e+00 8.63599e-01 7.56096e+01 95.102  -1.37097e+00 1.53539e+01  0.00000e+00 0.00000e+00 1.62255e+02 95.102  8.66458e+01 95.102  0.9670 
1 1 1 2   115 6  o 4  7.17700e+00 9.17486e-01 1.39844e+02 19.791  2.67717e+01  9.63348e+00  0.00000e+00 0.00000e+00 1.20199e+02 19.791  1.96450e+01 199.791 0.9823 
1 1 1 2   115 7  o 10 4.42156e+00 1.06859e+00 5.62453e+01 198.658 -6.11661e+00 -2.06532e+00 0.00000e+00 0.00000e+00 9.35787e+01 198.658 3.73334e+01 198.658 0.9189 
1 1 1 2   115 8  o 15 4.57448e+00 1.07494e+00 1.00989e+02 190.173 -1.27456e+01 -2.28721e+00 0.00000e+00 0.00000e+00 6.09848e+01 190.173 4.00038e+01 10.174  0.9606 
1 1 1 2   116 0  o 18 3.75865e+00 8.36684e-01 6.91027e+01 155.910 -6.17842e+00 2.76239e+00  0.00000e+00 0.00000e+00 5.88831e+01 155.910 1.02197e+01 335.910 0.9228 
1 1 1 2   116 1  o 3  3.43453e+00 8.75309e-01 7.03602e+01 120.346 -3.08027e+00 5.26159e+00  0.00000e+00 0.00000e+00 4.54535e+01 120.346 2.49067e+01 300.346 0.9138 
1 1 1 2   116 2  o 9  3.86077e+00 9.03606e-01 6.75201e+01 296.057 3.08653e+00  -6.31245e+00 0.00000e+00 0.00000e+00 6.43732e+01 296.057 3.14688e+00 116.057 0.9258 
1 1 1 2   116 3  o 13 3.29381e+00 8.67967e-01 5.61520e+01 110.937 -1.79345e+00 4.68749e+00  0.00000e+00 0.00000e+00 5.24744e+01 110.937 3.67768e+00 290.937 0.8938 
1 1 1 2   116 4  o 10 2.40977e+00 7.65845e-01 1.78892e+01 229.552 -8.78863e-01 -1.03093e+00 0.00000e+00 0.00000e+00 3.17271e+01 229.552 1.38379e+01 229.552 0.5581 
1 1 1 2   116 5  o 19 3.23684e+00 9.01770e-01 2.87806e+01 354.013 2.64018e+00  -2.76907e-01 0.00000e+00 0.00000e+00 6.44415e+01 354.013 3.56609e+01 354.013 0.7808 
1 1 1 2   116 6  o 11 2.69987e+00 8.41212e-01 8.56753e+01 240.339 -3.88565e+00 -6.82310e+00 0.00000e+00 0.00000e+00 7.30851e+00 240.339 7.83667e+01 60.339  0.9340 
1 1 1 2   116 7  f 0  2.48214e+00 7.97159e-01 2.43830e+01 202.968 -2.17360e+00 -9.21201e-01 0.00000e+00 0.00000e+00 4.41472e+01 202.968 1.97642e+01 202.968 0.7490 
1 1 1 2   116 8  o 10 4.00284e+00 1.03766e+00 6.51492e+01 35.277  6.50082e+00  4.59897e+00  0.00000e+00 0.00000e+00 7.27547e+01 35.277  7.60550e+00 35.277  0.9349 
1 1 1 2   117 0  o 11 7.96849e+00 6.98845e-01 1.18798e+02 69.023  1.03342e+01  2.69538e+01  0.00000e+00 0.00000e+00 1.69992e+02 69.023  5.11947e+01 69.023  0.9825 
1 1 1 2   117 1  o 1  3.87801e+00 9.35578e-01 8.52780e+01 338.403 7.69479e+00  -3.04618e+00 0.00000e+00 0.00000e+00 4.88301e+01 338.403 3.64478e+01 158.403 0.9375 
1 1 1 2   117 2  o 9  2.46612e+00 7.75014e-01 4.99286e+01 318.957 2.72475e+00  -2.37221e+00 0.00000e+00 0.00000e+00 2.71024e+01 318.957 2.28262e+01 138.957 0.8468 
1 1 1 2   117 3  o 1  4.30975e+00 9.58949e-01 9.09609e+01 216.700 -8.27840e+00 -6.17052e+00 0.00000e+00 0.00000e+00 6.00980e+01 216.700 3.08629e+01 36.700  0.9503 
1 1 1 2   117 4  o 5  5.06074e+00 9.70217e-01 4.29200e+01 118.996 -2.92015e+00 5.26894e+00  0.00000e+00 0.00000e+00 1.27432e+02 118.996 8.45121e+01 118.996 0.9127 
1 1 1 2   117 5  o 17 2.05523e+00 6.90076e-01 4.31643e+01 354.062 3.21580e+00  -3.34446e-01 0.00000e+00 0.00000e+00 1.94202e+01 354.062 2.37441e+01 174.063 0.8258 
1 1 1 2   117 6  o 19 2.61742e+00 8.35179e-01 4.45128e+01 125.547 -2.37936e+00 3.32994e+00  0.00000e+00 0.00000e+00 3.91407e+01 125.547 5.37212e+00 305.547 0.8670 
1 1 1 2   117 7  o 4  3.57793e+00 9.93746e-01 5.54448e+01 167.953 -5.95691e+00 1.27129e+00  0.00000e+00 0.00000e+00 6.50361e+01 167.953 9.59127e+00 167.953 0.9138 
1 1 1 2   117 8  o 7  2.70718e+00 8.55659e-01 2.70344e+01 234.168 -1.73529e+00 -2.40317e+00 0.00000e+00 0.00000e+00 5.34752e+01 234.168 2.64408e+01 234.168 0.8073 
1 1 1 2   118 0  o 14 2.37067e+00 7.47920e-01 5.17381e+01 191.188 -3.84753e+00 -7.60998e-01 0.00000e+00 0.00000e+00 2.34801e+01 191.188 2.82580e+01 11.188  0.8605 
1 1 1 2   118 1  o 5  3.11693e+00 8.62392e-01 5.31769e+01 119.824 -2.37558e+00 4.14401e+00  0.00000e+00 0.00000e+00 4.88820e+01 119.824 4.29490e+00 299.824 0.8879 
1 1 1 2   118 2  f 0  3.27476e+00 9.02317e-01 4.47086e+01 291.897 1.60743e+00  -3.99927e+00 0.00000e+00 0.00000e+00 6.08921e+01 291.897 1.61835e+01 291.897 0.8745 
1 1 1 2   118 3  o 6  3.13626e+00 8.29458e-01 3.23578e+01 6.259   3.21377e+00  3.52456e-01  0.00000e+00 0.00000e+00 6.31450e+01 6.259   3.07872e+01 6.259   0.8258 
1 1 1 2   118 4  o 10 4.08978e+00 9.56080e-01 6.30648e+01 119.320 -3.71238e+00 6.61008e+00  0.00000e+00 0.00000e+00 7.73889e+01 119.320 1.43241e+01 119.320 0.9315 
1 1 1 2   118 5  o 14 3.13468e+00 8.69124e-01 7.65811e+01 229.580 -4.64796e+00 -5.45746e+00 0.00000e+00 0.00000e+00 3.05737e+01 229.580 4.60074e+01 49.580  0.9274 
1 1 1 2   118 6  o 4  4.32194e+00 1.01628e+00 7.27798e+01 151.553 -8.19675e+00 4.44068e+00  0.00000e+00 0.00000e+00 7.76887e+01 151.553 4.90884e+00 151.553 0.9447 
1 1 1 2   118 7  o 11 3.46206e+00 9.80446e-01 4.18569e+01 125.614 -2.75654e+00 3.84837e+00  0.00000e+00 0.00000e+00 7.12495e+01 125.614 2.93926e+01 125.614 0.8868 
1 1 1 2   119 0  o 17 5.77115e+00 8.80869e-01 9.48891e+01 211.783 -1.28462e+01 -7.95970e+00 0.00000e+00 0.00000e+00 1.10685e+02 211.783 1.57957e+01 211.783 0.9663 
1 1 1 2   119 1  o 18 3.78851e+00 9.14135e-01 5.95928e+01 336.584 6.07718e+00  -2.63189e+00 0.00000e+00 0.00000e+00 6.90424e+01 336.584 9.44953e+00 336.584 0.9211 
1 1 1 2   119 2  o 14 2.43044e+00 7.81844e-01 7.35636e+00 141.213 -4.44092e-01 3.56890e-01  0.00000e+00 0.00000e+00 1.71835e+01 141.213 9.82709e+00 141.213 0.2739 
1 1 1 2   119 3  o 7  2.92742e+00 8.52741e-01 9.09725e+01 65.452  3.61812e+00  7.92167e+00  0.00000e+00 0.00000e+00 1.05368e+01 65.452  8.04357e+01 245.452 0.9407 
1 1 1 2   119 4  o 13 4.76251e+00 9.42783e-01 7.52577e+01 250.778 -3.28658e+00 -9.42633e+00 0.00000e+00 0.00000e+00 9.12318e+01 250.778 1.59741e+01 250.778 0.9485 
1 1 1 2   119 5  o 18 3.78454e+00 9.93656e-01 8.14868e+01 95.650  -9.11086e-01 9.20963e+00  0.00000e+00 0.00000e+00 5.02045e+01 95.650  3.12824e+01 275.650 0.9443 
1 1 1 2   119 6  o 7  3.04602e+00 8.98923e-01 4.25187e+01 218.133 -3.47841e+00 -2.73071e+00 0.00000e+00 0.00000e+00 5.60052e+01 218.133 1.34865e+01 218.133 0.8780 
1 1 1 2   119 7  o 15 2.67741e+00 8.66403e-01 7.85036e+01 59.977  3.93420e+00  6.80800e+00  0.00000e+00 0.00000e+00 1.35976e+01 59.977  6.49059e+01 239.977 0.9341 
1 1 1 2   120 0  o 11 2.51663e+00 7.47839e-01 3.88664e+01 60.600  1.59736e+00  2.83489e+00  0.00000e+00 0.00000e+00 3.78408e+01 60.600  1.02564e+00 240.600 0.8271 
1 1 1 2   120 1  o 7  2.70729e+00 8.11691e-01 6.69684e+01 87.033  3.20231e-01  6.17921e+00  0.00000e+00 0.00000e+00 2.43381e+01 87.033  4.26302e+01 267.033 0.9152 
1 1 1 2   120 2  o 3  3.47189e+00 8.98174e-01 5.36276e+01 104.065 -1.34880e+00 5.38372e+00  0.00000e+00 0.00000e+00 6.21303e+01 104.065 8.50273e+00 104.065 0.9047 
1 1 1 2   120 3  o 9  3.73896e+00 9.29763e-01 6.23392e+01 307.961 4.04325e+00  -5.18230e+00 0.00000e+00 0.00000e+00 6.44747e+01 307.961 2.13548e+00 307.961 0.9204 
1 1 1 2   120 4  o 6  2.30929e+00 7.52866e-01 3.34675e+01 105.465 -8.06770e-01 2.91594e+00  0.00000e+00 0.00000e+00 3.56079e+01 105.465 2.14043e+00 105.465 0.8119 
1 1 1 2   120 5  o 1  3.03328e+00 8.86045e-01 9.13947e+01 155.142 -8.34142e+00 3.86456e+00  0.00000e+00 0.00000e+00 1.40772e+01 155.142 7.73175e+01 335.142 0.9439 
1 1 1 2   120 6  o 14 2.66767e+00 8.15136e-01 4.29578e+01 321.066 3.54159e+00  -2.86119e+00 0.00000e+00 0.00000e+00 4.36798e+01 321.066 7.21986e-01 321.066 0.8819 
1 1 1 2   120 7  o 2  2.85177e+00 8.91645e-01 5.84149e+01 50.079  4.25937e+00  5.09033e+00  0.00000e+00 0.00000e+00 3.83066e+01 50.079  2.01082e+01 230.079 0.9212 
1 1 1 2   121 0  o 16 3.05586e+00 8.74084e-01 6.06045e+01 124.690 -3.45637e+00 4.99344e+00  0.00000e+00 0.00000e+00 4.22273e+01 124.690 1.83772e+01 304.690 0.9135 
1 1 1 2   121 1  o 11 3.42494e+00 8.90085e-01 6.15495e+01 307.739 4.15700e+00  -5.37104e+00 0.00000e+00 0.00000e+00 5.49259e+01 307.739 6.62357e+00 127.739 0.9231 
1 1 1 2   121 2  o 14 3.27365e+00 9.24632e-01 6.18433e+01 12.122  5.96247e+00  1.28062e+00  0.00000e+00 0.00000e+00 4.83678e+01 12.122  1.34755e+01 192.122 0.9139 
1 1 1 2   121 3  o 15 8.26525e+00 7.51199e-01 1.00930e+02 259.555 -5.92960e+00 -3.21655e+01 0.00000e+00 0.00000e+00 1.98844e+02 259.555 9.79136e+01 259.555 0.9846 
1 1 1 2   121 4  o 14 3.77799e+00 9.31730e-01 9.08962e+01 94.133  -8.05147e-01 1.11424e+01  0.00000e+00 0.00000e+00 4.18722e+01 94.133  4.90240e+01 274.133 0.9541 
1 1 1 2   121 5  o 14 2.67779e+00 8.17307e-01 3.60369e+01 38.627  2.96509e+00  2.36928e+00  0.00000e+00 0.00000e+00 4.82903e+01 38.627  1.22534e+01 38.627  0.8552 
1 1 1 2   121 6  o 4  2.40498e+00 7.82932e-01 4.43797e+01 269.231 -6.36166e-02 -4.74118e+00 0.00000e+00 0.00000e+00 3.41575e+01 269.231 1.02221e+01 89.231  0.8870 
1 1 1 2   122 0  o 19 3.57596e+00 9.28692e-01 7.26808e+01 16.831  7.89557e+00  2.38847e+00  0.00000e+00 0.00000e+00 5.07453e+01 16.831  2.19356e+01 196.831 0.9373 
1 1 1 2   122 1  o 3  3.74077e+00 9.12673e-01 4.19723e+01 282.414 1.08933e+00  -4.94881e+00 0.00000e+00 0.00000e+00 8.13148e+01 282.414 3.93425e+01 282.414 0.8949 
1 1 1 2   122 2  o 2  1.99429e+00 6.69829e-01 3.68799e+01 344.446 3.19460e+00  -8.89164e-01 0.00000e+00 0.00000e+00 2.41434e+01 344.446 1.27366e+01 164.446 0.8309 
1 1 1 2   122 3  o 17 2.23895e+00 7.36569e-01 5.09295e+01 53.078  2.66909e+00  3.55200e+00  0.00000e+00 0.00000e+00 2.15124e+01 53.078  2.94171e+01 233.078 0.8786 
1 1 1 2   122 4  o 9  6.12524e+00 9.13026e-01 1.33490e+02 180.782 -2.84935e+01 -3.88895e-01 0.00000e+00 0.00000e+00 8.80457e+01 180.782 4.54442e+01 0.782   0.9823 
1 1 1 2   122 5  o 4  3.86775e+00 9.80465e-01 1.18198e+02 4.981   1.48894e+01  1.29774e+00  0.00000e+00 0.00000e+00 1.93349e+01 4.981   9.88627e+01 184.981 0.9659 
1 1 1 2   122 6  o 3  2.10150e+00 7.11311e-01 3.35767e+01 202.234 -3.13368e+00 -1.28101e+00 0.00000e+00 0.00000e+00 3.09947e+01 202.234 2.58201e+00 22.234  0.8349 
1 1 1 2   123 0  o 16 2.22269e+00 7.01700e-01 4.34191e+01 105.984 -1.11688e+00 3.89909e+00  0.00000e+00 0.00000e+00 2.74114e+01 105.984 1.60076e+01 285.984 0.8656 
1 1 1 2   123 1  o 15 3.51751e+00 8.75831e-01 4.94942e+01 234.924 -3.46523e+00 -4.93493e+00 0.00000e+00 0.00000e+00 6.87145e+01 234.924 1.92202e+01 234.924 0.9128 
1 1 1 2   123 2  o 11 6.45485e+00 8.67933e-01 1.00222e+02 58.420  1.14477e+01  1.86224e+01  0.00000e+00 0.00000e+00 1.31911e+02 58.420  3.16890e+01 58.420  0.9769 
1 1 1 2   123 3  o 6  4.11703e+00 9.70268e-01 4.69731e+01 279.761 1.06857e+00  -6.21140e+00 0.00000e+00 0.00000e+00 9.19770e+01 279.761 4.50039e+01 279.761 0.9168 
1 1 1 2   123 4  o 4  3.73815e+00 9.36859e-01 7.36240e+01 344.724 8.71272e+00  -2.37956e+00 0.00000e+00 0.00000e+00 5.61102e+01 344.724 1.75138e+01 164.724 0.9429 
1 1 1 2   123 5  o 1  2.50775e+00 7.97702e-01 3.94653e+01 13.877  4.33592e+00  1.07122e+00  0.00000e+00 0.00000e+00 4.16842e+01 13.877  2.21888e+00 13.877  0.8793 
1 1 1 2   124 0  o 10 3.28808e+00 8.85565e-01 1.30951e+01 291.725 5.74141e-01  -1.44088e+00 0.00000e+00 0.00000e+00 6.05363e+01 291.725 4.74412e+01 291.725 0.6085 
1 1 1 2   124 1  o 11 2.43486e+00 7.21502e-01 4.87111e+01 192.619 -5.04810e+00 -1.13019e+00 0.00000e+00 0.00000e+00 3.16906e+01 192.619 1.70205e+01 12.620  0.8972 
1 1 1 2   124 2  o 10 3.79868e+00 9.38802e-01 4.40039e+01 280.313 1.01893e+00  -5.59944e+00 0.00000e+00 0.00000e+00 8.28340e+01 280.313 3.88301e+01 280.313 0.9073 
1 1 1 2   124 3  o 14 3.34773e+00 9.04353e-01 8.54688e+01 341.310 9.22576e+00  -3.12089e+00 0.00000e+00 0.00000e+00 3.12193e+01 341.310 5.42495e+01 161.310 0.9472 
1 1 1 2   124 4  o 16 3.77244e+00 9.79737e-01 6.01051e+01 139.899 -5.72628e+00 4.82215e+00  0.00000e+00 0.00000e+00 6.90664e+01 139.899 8.96123e+00 139.899 0.9306 
1 1 1 2   124 5  o 5  1.90210e+00 6.54730e-01 2.26482e+01 219.728 -1.59886e+00 -1.32872e+00 0.00000e+00 0.00000e+00 2.70553e+01 219.728 4.40709e+00 219.728 0.7103 
1 1 1 2   125 0  o 1  2.87964e+00 8.04405e-01 3.38795e+01 203.407 -3.41657e+00 -1.47900e+00 0.00000e+00 0.00000e+00 5.63741e+01 203.407 2.24946e+01 203.407 0.8520 
1 1 1 2   125 1  o 18 2.84727e+00 8.44827e-01 6.33938e+01 315.659 4.70254e+00  -4.59552e+00 0.00000e+00 0.00000e+00 3.30256e+01 315.659 3.03682e+01 135.659 0.9205 
1 1 1 2   125 2  o 10 3.07628e+00 8.76423e-01 2.96776e+01 61.102  1.63112e+00  2.95501e+00  0.00000e+00 0.00000e+00 6.47466e+01 61.102  3.50690e+01 61.102  0.8343 
1 1 1 2   125 3  o 10 4.43428e+00 8.79008e-01 5.25522e+01 311.254 5.72277e+00  -6.52460e+00 0.00000e+00 0.00000e+00 1.00865e+02 311.254 4.83126e+01 311.254 0.9405 
1 1 1 2   125 4  o 18 1.82264e+00 6.25026e-01 3.43935e+00 280.178 7.12306e-02  -3.96738e-01 0.00000e+00 0.00000e+00 9.80489e+00 280.178 6.36554e+00 280.178 0.1976 
1 1 1 2   126 0  o 14 2.23163e+00 7.22822e-01 9.43910e+00 50.699  6.00344e-01  7.33445e-01  0.00000e+00 0.00000e+00 2.56534e+01 50.699  1.62143e+01 50.699  0.4276 
1 1 1 2   126 1  o 19 3.01265e+00 8.68663e-01 8.60350e+01 102.205 -2.06706e+00 9.55646e+00  0.00000e+00 0.00000e+00 1.89339e+01 102.205 6.71011e+01 282.205 0.9474 
1 1 1 2   126 2  o 14 2.64162e+00 8.02654e-01 3.54253e+01 310.547 2.72515e+00  -3.18550e+00 0.00000e+00 0.00000e+00 4.91468e+01 310.547 1.37215e+01 310.547 0.8705 
1 1 1 2   126 3  o 10 2.46566e+00 7.80169e-01 4.12126e+01 127.852 -3.18673e+00 4.10059e+00  0.00000e+00 0.00000e+00 4.01830e+01 127.852 1.02954e+00 307.852 0.8977 
1 1 1 2   126 4  o 1  2.82344e+00 8.48460e-01 4.98511e+01 173.858 -6.27311e+00 6.75056e-01  0.00000e+00 0.00000e+00 4.53397e+01 173.858 4.51137e+00 353.858 0.9169 
1 1 1 2   127 0  o 5  2.59968e+00 8.07007e-01 8.55584e+01 97.193  -1.36983e+00 1.08542e+01  0.00000e+00 0.00000e+00 5.53484e+00 97.193  8.00235e+01 277.193 0.9531 
1 1 1 2   127 1  o 17 2.91772e+00 8.48798e-01 4.00099e+01 226.214 -3.73710e+00 -3.89887e+00 0.00000e+00 0.00000e+00 5.67376e+01 226.214 1.67277e+01 226.214 0.9019 
1 1 1 2   127 2  o 2  2.45479e+00 7.76905e-01 4.26392e+01 1.015   4.36533e+00  7.73685e-02  0.00000e+00 0.00000e+00 3.64419e+01 1.015   6.19737e+00 181.015 0.8763 
1 1 1 2   127 3  o 7  2.48267e+00 7.81210e-01 2.25726e+01 103.799 -6.58423e-01 2.68090e+00  0.00000e+00 0.00000e+00 4.95830e+01 103.799 2.70104e+01 103.799 0.7906 
1 1 1 2   128 0  o 6  2.61845e+00 8.17695e-01 3.53279e+01 6.128   4.30737e+00  4.62439e-01  0.00000e+00 0.00000e+00 4.88891e+01 6.128   1.35612e+01 6.128   0.8752 
1 1 1 2   128 1  o 9  3.11837e+00 8.62851e-01 5.82782e+01 11.955  7.81127e+00  1.65396e+00  0.00000e+00 0.00000e+00 4.88903e+01 11.955  9.38781e+00 191.955 0.9351 
1 1 1 2   128 2  o 4  2.76585e+00 8.46223e-01 3.81503e+01 116.887 -2.12899e+00 4.19879e+00  0.00000e+00 0.00000e+00 5.19243e+01 116.887 1.37741e+01 116.887 0.8861 
1 1 1 3   0   0  f 0  4.51886e+00 5.75923e-01 2.04727e+02 180.000 -1.47449e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.79854e+02 0.000   3.84581e+02 0.000   0.1464 
1 1 1 3   0   1  o 4  2.63478e+01 7.57882e-01 4.76012e+02 0.000   1.76341e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.58157e+02 0.000   1.78553e+01 180.000 0.9429 
1 1 1 3   0   2  o 4  1.73016e+01 5.60948e-01 5.14262e+02 0.000   2.13237e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.18317e+02 0.000   3.95945e+02 180.000 0.9723 
1 1 1 3   0   3  o 14 3.00452e+01 8.59422e-01 6.30387e+02 0.000   4.82843e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.99259e+02 0.000   1.31128e+02 180.000 0.9999 
1 1 1 3   0   4  o 8  1.84183e+01 6.03193e-01 5.32005e+02 180.000 -2.88203e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.56181e+02 180.000 3.75825e+02 0.000   0.9937 
1 1 1 3   0   5  o 17 1.75971e+01 5.98804e-01 5.39425e+01 180.000 -3.57811e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.73154e+02 180.000 1.19212e+02 180.000 0.3433 
1 1 1 3   0   6  o 5  1.29415e+01 5.12808e-01 1.31468e+02 180.000 -7.49458e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.77319e+02 180.000 4.58510e+01 180.000 0.6348 
1 1 1 3   0   7  o 10 2.08997e+01 6.50493e-01 4.72615e+02 0.000   5.90177e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.12686e+02 0.000   1.59929e+02 180.000 1.0000 
1 1 1 3   0   8  o 6  4.80662e+01 1.20451e+00 9.66750e+02 180.000 -2.93475e+01 0.00000e+00  0.00000e+00 0.00000e+00 8.38742e+02 180.000 1.28008e+02 0.000   1.0000 
1 1 1 3   0   9  o 10 6.02864e+00 9.68381e-01 1.24375e+02 0.000   6.38332e-01  0.00000e+00  0.00000e+00 0.00000e+00 3.23938e+00 0.000   1.21135e+02 180.000 0.5638 
1 1 1 3   0   10 f 0  1.56395e+01 7.56846e-01 1.57133e+02 0.000   2.95712e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.26660e+02 0.000   2.69527e+02 0.000   0.9946 
1 1 1 3   0   11 o 5  9.10994e+00 1.19911e+00 1.88063e+02 180.000 -2.59901e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.49901e+02 180.000 3.81617e+01 0.000   0.9890 
1 1 1 3   0   13 o 15 2.35033e+01 1.03515e+00 5.34222e+02 180.000 -3.82806e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.46326e+02 180.000 1.87896e+02 0.000   1.0000 
1 1 1 3   0   14 o 17 2.31622e+01 1.10721e+00 4.16593e+02 0.000   4.22861e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.50567e+02 0.000   3.39740e+01 0.000   1.0000 
1 1 1 3   0   15 f 0  4.74177e+00 2.47159e+00 4.41831e+01 180.000 -7.21403e-01 0.00000e+00  0.00000e+00 0.00000e+00 6.54039e+01 180.000 2.12208e+01 180.000 0.6178 
1 1 1 3   0   16 o 2  7.75761e+00 2.62520e+00 8.67662e+01 180.000 -2.66855e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.00430e+02 180.000 1.13663e+02 180.000 0.9904 
1 1 1 3   0   17 o 13 1.73672e+01 1.73664e+00 2.73964e+02 0.000   2.80585e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.74631e+02 0.000   1.00667e+02 0.000   1.0000 
1 1 1 3   0   18 o 3  2.93959e+00 2.05107e+00 1.19985e+01 180.000 -2.00792e-01 0.00000e+00  0.00000e+00 0.00000e+00 9.73268e+00 180.000 2.26577e+00 0.000   0.1981 
1 1 1 3   1   0  o 15 3.08017e+01 8.65962e-01 3.54253e+02 133.333 -2.37140e+00 2.51359e+00  0.00000e+00 0.00000e+00 6.17135e+02 133.333 2.62882e+02 133.333 0.8388 
1 1 1 3   1   1  o 12 4.02969e+01 7.82874e-01 1.27817e+03 295.873 6.29349e+00  -1.29764e+01 0.00000e+00 0.00000e+00 1.83605e+02 295.873 1.09456e+03 115.873 0.9647 
1 1 1 3   1   2  o 17 3.66510e+01 7.23327e-01 5.76079e+02 116.141 -4.43599e+00 9.03874e+00  0.00000e+00 0.00000e+00 7.31809e+02 116.141 1.55730e+02 116.141 0.9490 
1 1 1 3   1   3  o 17 3.53130e+01 7.00437e-01 6.27111e+02 340.879 1.06430e+01  -3.68982e+00 0.00000e+00 0.00000e+00 6.40375e+02 340.879 1.32634e+01 340.879 0.9545 
1 1 1 3   1   4  o 3  3.85427e+01 7.63978e-01 5.10457e+02 132.148 -7.72632e+00 8.53636e+00  0.00000e+00 0.00000e+00 8.74290e+02 132.148 3.63834e+02 132.148 0.9555 
1 1 1 3   1   5  o 5  7.71412e+00 3.31762e-01 1.77894e+02 309.066 6.52347e-01  -8.03685e-01 0.00000e+00 0.00000e+00 4.48719e+01 129.066 2.22766e+02 129.066 0.4587 
1 1 1 3   1   6  o 13 1.15154e+01 3.55947e-01 2.86803e+02 77.663  6.21565e-01  2.84190e+00  0.00000e+00 0.00000e+00 6.07590e+01 77.663  2.26044e+02 257.663 0.8030 
1 1 1 3   1   7  o 7  2.26921e+01 4.79253e-01 3.39470e+02 237.791 -4.90379e+00 -7.78431e+00 0.00000e+00 0.00000e+00 4.65423e+02 237.791 1.25953e+02 237.791 0.9440 
1 1 1 3   1   8  o 14 3.97434e+01 7.28317e-01 5.64340e+02 98.161  -4.03986e+00 2.81710e+01  0.00000e+00 0.00000e+00 9.02055e+02 98.161  3.37715e+02 98.161  0.9823 
1 1 1 3   1   9  o 10 2.41456e+01 5.67069e-01 5.80942e+02 89.465  2.24049e-01  2.39933e+01  0.00000e+00 0.00000e+00 3.06568e+02 89.465  2.74375e+02 269.465 0.9789 
1 1 1 3   1   10 o 3  1.01811e+01 6.13302e-01 1.55035e+02 338.161 3.51169e+00  -1.40734e+00 0.00000e+00 0.00000e+00 1.71521e+02 338.161 1.64859e+01 338.161 0.8546 
1 1 1 3   1   11 o 18 1.36740e+01 6.74311e-01 1.49584e+02 126.586 -3.75514e+00 5.05888e+00  0.00000e+00 0.00000e+00 3.20656e+02 126.586 1.71072e+02 126.586 0.9168 
1 1 1 3   1   12 o 16 2.49342e+01 6.87786e-01 4.90427e+02 105.105 -1.44688e+01 5.36035e+01  0.00000e+00 0.00000e+00 4.35875e+02 105.105 5.45524e+01 285.105 0.9910 
1 1 1 3   1   13 o 19 8.61096e+00 1.08791e+00 9.00358e+01 44.704  3.12842e+00  3.09625e+00  0.00000e+00 0.00000e+00 1.93010e+02 44.704  1.02974e+02 44.704  0.8774 
1 1 1 3   1   14 o 18 1.62093e+01 8.59824e-01 1.70591e+02 274.957 2.05157e+00  -2.36537e+01 0.00000e+00 0.00000e+00 4.23339e+02 274.957 2.52748e+02 274.957 0.9787 
1 1 1 3   1   15 o 2  5.69383e+00 1.37547e+00 8.38690e+01 257.117 -8.62366e-01 -3.77037e+00 0.00000e+00 0.00000e+00 9.89401e+01 257.117 1.50711e+01 257.117 0.8582 
1 1 1 3   1   16 o 15 5.66235e+00 1.49877e+00 4.43355e+01 84.906  2.14964e-01  2.41131e+00  0.00000e+00 0.00000e+00 1.15697e+02 84.906  7.13613e+01 84.906  0.7561 
1 1 1 3   1   17 f 0  3.98630e+00 1.32800e+00 1.60463e+01 319.848 5.45896e-01  -4.60526e-01 0.00000e+00 0.00000e+00 3.39913e+01 319.848 1.79450e+01 319.848 0.3361 
1 1 1 3   1   18 o 11 5.80184e+00 1.73779e+00 7.33266e+01 236.176 -2.25690e+00 -3.36831e+00 0.00000e+00 0.00000e+00 1.14046e+02 236.176 4.07196e+01 236.176 0.8656 
1 1 1 3   2   0  o 9  1.35517e+01 4.66012e-01 4.13506e+02 293.642 7.07570e-01  -1.61631e+00 0.00000e+00 0.00000e+00 7.97400e+01 113.642 4.93246e+02 113.642 0.6550 
1 1 1 3   2   1  o 12 2.56745e+01 5.23181e-01 4.20689e+02 260.495 -4.96515e-01 -2.96553e+00 0.00000e+00 0.00000e+00 3.61785e+02 260.495 5.89034e+01 80.495  0.8105 
1 1 1 3   2   2  o 14 2.75619e+01 6.57652e-01 3.48056e+02 1.912   4.55104e+00  1.51903e-01  0.00000e+00 0.00000e+00 5.65963e+02 1.912   2.17907e+02 1.912   0.8819 
1 1 1 3   2   3  o 3  4.35178e+01 8.48939e-01 8.36361e+02 164.556 -1.77427e+01 4.90172e+00  0.00000e+00 0.00000e+00 7.54941e+02 164.556 8.14194e+01 344.556 0.9724 
1 1 1 3   2   4  o 13 1.51083e+01 3.64886e-01 1.64010e+02 59.761  7.32276e-01  1.25622e+00  0.00000e+00 0.00000e+00 1.68063e+02 59.761  4.05239e+00 59.761  0.5846 
1 1 1 3   2   5  f 0  1.18439e+01 3.43740e-01 2.54197e+02 353.682 2.25384e+00  -2.49537e-01 0.00000e+00 0.00000e+00 7.40317e+01 353.682 1.80165e+02 173.682 0.7372 
1 1 1 3   2   6  o 8  1.70269e+01 4.15306e-01 3.09039e+02 52.561  2.81333e+00  3.67446e+00  0.00000e+00 0.00000e+00 2.56670e+02 52.561  5.23690e+01 232.561 0.8840 
1 1 1 3   2   7  o 7  2.95790e+01 5.69956e-01 2.87177e+02 176.105 -1.00952e+01 6.87342e-01  0.00000e+00 0.00000e+00 7.67816e+02 176.105 4.80639e+02 176.105 0.9492 
1 1 1 3   2   8  o 9  2.82733e+01 5.68054e-01 5.05750e+02 296.258 8.06445e+00  -1.63476e+01 0.00000e+00 0.00000e+00 5.26710e+02 296.258 2.09601e+01 296.258 0.9722 
1 1 1 3   2   9  o 6  1.12357e+01 4.88442e-01 1.74962e+02 24.162  3.07548e+00  1.37969e+00  0.00000e+00 0.00000e+00 1.76904e+02 24.162  1.94222e+00 24.162  0.8341 
1 1 1 3   2   10 o 9  2.01543e+01 5.93506e-01 1.74143e+02 301.476 4.39651e+00  -7.18111e+00 0.00000e+00 0.00000e+00 5.35803e+02 301.476 3.61660e+02 301.476 0.9386 
1 1 1 3   2   11 o 19 8.31105e+00 8.41851e-01 1.99322e+02 123.240 -2.75608e+00 4.20534e+00  0.00000e+00 0.00000e+00 7.93935e+01 123.240 1.19929e+02 303.240 0.8940 
1 1 1 3   2   12 f 0  1.62220e+01 7.13851e-01 2.92569e+02 326.237 1.78562e+01  -1.19369e+01 0.00000e+00 0.00000e+00 3.01246e+02 326.237 8.67747e+00 326.237 0.9764 
1 1 1 3   2   13 o 17 1.62221e+01 8.09920e-01 1.63933e+02 144.475 -1.30162e+01 9.29297e+00  0.00000e+00 0.00000e+00 4.24506e+02 144.475 2.60573e+02 144.475 0.9682 
1 1 1 3   2   14 o 9  1.07991e+01 1.04650e+00 2.25244e+02 225.765 -1.37800e+01 -1.41530e+01 0.00000e+00 0.00000e+00 1.68687e+02 225.765 5.65570e+01 45.765  0.9743 
1 1 1 3   2   15 o 13 1.16945e+01 1.09160e+00 2.00735e+02 353.209 2.11186e+01  -2.51469e+00 0.00000e+00 0.00000e+00 2.26339e+02 353.209 2.56046e+01 353.209 0.9762 
1 1 1 3   2   16 f 0  5.16393e+00 1.42161e+00 2.74304e+01 53.448  8.47889e-01  1.14370e+00  0.00000e+00 0.00000e+00 8.38857e+01 53.448  5.64553e+01 53.448  0.5767 
1 1 1 3   2   17 o 4  5.52339e+00 1.58333e+00 8.77601e+01 285.779 1.27420e+00  -4.50924e+00 0.00000e+00 0.00000e+00 9.49058e+01 285.779 7.14576e+00 285.779 0.8855 
1 1 1 3   2   18 o 14 5.51207e+00 1.72512e+00 7.26735e+01 235.012 -2.20621e+00 -3.15215e+00 0.00000e+00 0.00000e+00 1.03655e+02 235.012 3.09814e+01 235.012 0.8574 
1 1 1 3   3   0  o 15 9.51120e+00 3.33771e-01 3.26500e+02 178.432 -9.63710e-01 2.63741e-02  0.00000e+00 0.00000e+00 1.71470e+02 358.432 4.97970e+02 358.432 0.4335 
1 1 1 3   3   1  o 8  3.11158e+01 6.17938e-01 4.96257e+02 66.654  2.32914e+00  5.39622e+00  0.00000e+00 0.00000e+00 5.68957e+02 66.654  7.26998e+01 66.654  0.9104 
1 1 1 3   3   2  o 9  4.97071e+01 1.11247e+00 7.94089e+02 217.196 -1.46870e+01 -1.11465e+01 0.00000e+00 0.00000e+00 1.02367e+03 217.196 2.29578e+02 217.196 0.9725 
1 1 1 3   3   3  f 0  1.28772e+01 3.40138e-01 1.21539e+02 331.068 6.92641e-01  -3.82858e-01 0.00000e+00 0.00000e+00 5.64804e+01 331.068 6.50584e+01 151.068 0.3676 
1 1 1 3   3   4  o 13 7.11463e+00 3.16564e-01 2.53719e+02 335.787 9.62848e-01  -4.32989e-01 0.00000e+00 0.00000e+00 1.29119e+02 155.787 3.82838e+02 155.787 0.4658 
1 1 1 3   3   5  o 13 2.20562e+01 4.65274e-01 4.55171e+02 112.287 -2.85728e+00 6.97142e+00  0.00000e+00 0.00000e+00 3.16825e+02 112.287 1.38347e+02 292.286 0.9311 
1 1 1 3   3   6  o 12 1.15773e+01 3.69348e-01 9.64337e+01 284.496 2.45605e-01  -9.49964e-01 0.00000e+00 0.00000e+00 9.48903e+01 284.496 1.54339e+00 104.496 0.4397 
1 1 1 3   3   7  o 12 3.27514e+01 6.17478e-01 7.18486e+02 23.559  2.56418e+01  1.11808e+01  0.00000e+00 0.00000e+00 4.89941e+02 23.559  2.28546e+02 203.559 0.9820 
1 1 1 3   3   8  o 19 2.25039e+01 4.96217e-01 6.60338e+02 315.437 1.35150e+01  -1.33102e+01 0.00000e+00 0.00000e+00 1.62365e+02 315.437 4.97973e+02 135.437 0.9733 
1 1 1 3   3   9  o 2  2.78943e+01 5.86556e-01 6.02026e+02 180.680 -2.86830e+01 -3.40362e-01 0.00000e+00 0.00000e+00 4.26905e+02 180.680 1.75121e+02 0.680   0.9824 
1 1 1 3   3   10 o 5  2.96719e+01 6.97534e-01 4.82845e+02 1.351   3.41475e+01  8.05351e-01  0.00000e+00 0.00000e+00 6.14313e+02 1.351   1.31467e+02 1.351   0.9853 
1 1 1 3   3   11 o 9  1.58224e+01 6.36330e-01 3.00507e+02 137.502 -1.08249e+01 9.91836e+00  0.00000e+00 0.00000e+00 2.72414e+02 137.502 2.80928e+01 317.502 0.9653 
1 1 1 3   3   12 o 8  2.67153e+01 7.03207e-01 4.17348e+02 42.544  3.72128e+01  3.41523e+01  0.00000e+00 0.00000e+00 5.74206e+02 42.544  1.56857e+02 42.544  0.9901 
1 1 1 3   3   13 o 2  1.46279e+01 9.14948e-01 2.56911e+02 241.221 -1.06609e+01 -1.94089e+01 0.00000e+00 0.00000e+00 2.78594e+02 241.221 2.16835e+01 241.221 0.9772 
1 1 1 3   3   14 o 5  3.97017e+00 1.16130e+00 1.89055e+02 73.859  1.63135e+00  5.63678e+00  0.00000e+00 0.00000e+00 5.37579e+01 253.859 2.42813e+02 253.859 0.9103 
1 1 1 3   3   15 o 9  1.52249e+01 9.87822e-01 1.73030e+02 260.106 -4.25588e+00 -2.44004e+01 0.00000e+00 0.00000e+00 3.84908e+02 260.106 2.11878e+02 260.106 0.9796 
1 1 1 3   3   16 o 15 8.60004e+00 1.62683e+00 6.48884e+01 329.534 4.32584e+00  -2.54462e+00 0.00000e+00 0.00000e+00 2.22435e+02 329.534 1.57547e+02 329.534 0.8938 
1 1 1 3   3   17 o 11 4.79747e+00 1.50572e+00 7.64191e+01 253.177 -1.07200e+00 -3.54549e+00 0.00000e+00 0.00000e+00 7.60653e+01 253.177 3.53734e-01 73.177  0.8511 
1 1 1 3   3   18 o 3  4.94590e+00 1.56039e+00 5.95121e+01 164.497 -3.01649e+00 8.36735e-01  0.00000e+00 0.00000e+00 9.16525e+01 164.497 3.21403e+01 164.497 0.8192 
1 1 1 3   4   0  o 14 1.71273e+01 3.81391e-01 3.60059e+02 272.561 8.38166e-02  -1.87401e+00 0.00000e+00 0.00000e+00 7.54568e+01 272.561 2.84602e+02 92.561  0.6763 
1 1 1 3   4   1  o 4  1.86074e+01 4.06659e-01 5.07871e+02 320.602 2.73655e+00  -2.24767e+00 0.00000e+00 0.00000e+00 8.21208e+01 320.602 4.25751e+02 140.602 0.8432 
1 1 1 3   4   2  o 10 2.98836e+01 7.10743e-01 5.28970e+02 319.360 5.57021e+00  -4.78096e+00 0.00000e+00 0.00000e+00 5.15140e+02 319.360 1.38301e+01 139.360 0.9292 
1 1 1 3   4   3  o 18 2.48962e+01 4.92428e-01 2.57769e+02 156.977 -2.95878e+00 1.25736e+00  0.00000e+00 0.00000e+00 5.14270e+02 156.977 2.56501e+02 156.977 0.8247 
1 1 1 3   4   4  o 19 2.86738e+01 5.55826e-01 6.72861e+02 168.114 -1.09603e+01 2.30694e+00  0.00000e+00 0.00000e+00 3.55922e+02 168.114 3.16940e+02 348.114 0.9543 
1 1 1 3   4   5  o 8  1.95609e+01 4.32043e-01 1.47256e+02 357.646 2.15412e+00  -8.85440e-02 0.00000e+00 0.00000e+00 3.83512e+02 357.646 2.36256e+02 357.646 0.7218 
1 1 1 3   4   6  o 15 2.35335e+01 4.99192e-01 2.45530e+02 144.739 -4.54639e+00 3.21443e+00  0.00000e+00 0.00000e+00 5.55014e+02 144.739 3.09484e+02 144.739 0.9051 
1 1 1 3   4   7  o 5  1.16015e+01 4.03112e-01 1.92431e+02 171.204 -2.45639e+00 3.80112e-01  0.00000e+00 0.00000e+00 1.40360e+02 171.204 5.20712e+01 351.204 0.7634 
1 1 1 3   4   8  o 17 8.57277e+00 5.27333e-01 3.05784e+02 99.256  -5.37437e-01 3.29779e+00  0.00000e+00 0.00000e+00 3.77558e+01 279.256 3.43540e+02 279.256 0.8324 
1 1 1 3   4   9  o 17 3.33664e+01 6.60707e-01 5.83008e+02 98.195  -4.71966e+00 3.27720e+01  0.00000e+00 0.00000e+00 6.50727e+02 98.195  6.77186e+01 98.195  0.9848 
1 1 1 3   4   10 o 12 3.03537e+01 6.70361e-01 5.61529e+02 62.056  1.90680e+01  3.59467e+01  0.00000e+00 0.00000e+00 5.63545e+02 62.056  2.01626e+00 62.056  0.9876 
1 1 1 3   4   11 o 6  2.73973e+01 6.66769e-01 5.51251e+02 278.679 7.01852e+00  -4.59784e+01 0.00000e+00 0.00000e+00 4.65315e+02 278.679 8.59367e+01 98.679  0.9892 
1 1 1 3   4   12 o 1  1.09594e+01 8.40189e-01 2.68546e+02 276.610 1.50701e+00  -1.30056e+01 0.00000e+00 0.00000e+00 1.26288e+02 276.610 1.42258e+02 96.610  0.9610 
1 1 1 3   4   13 o 5  1.59096e+01 7.76778e-01 4.53350e+02 72.247  1.32978e+01  4.15351e+01  0.00000e+00 0.00000e+00 1.35814e+02 72.247  3.17536e+02 252.247 0.9885 
1 1 1 3   4   14 o 5  1.09643e+01 1.02365e+00 3.10569e+02 169.206 -2.73472e+01 5.21393e+00  0.00000e+00 0.00000e+00 9.24670e+01 169.206 2.18102e+02 349.206 0.9819 
1 1 1 3   4   15 o 15 6.31601e+00 1.35507e+00 1.23292e+02 326.205 5.28375e+00  -3.53650e+00 0.00000e+00 0.00000e+00 9.35118e+01 326.205 2.97802e+01 146.205 0.9176 
1 1 1 3   4   16 o 8  6.70292e+00 1.60308e+00 6.80174e+01 226.402 -2.77007e+00 -2.90903e+00 0.00000e+00 0.00000e+00 1.48494e+02 226.402 8.04771e+01 226.402 0.8642 
1 1 1 3   4   17 o 7  5.27449e+00 1.53679e+00 8.21549e+01 255.187 -1.09955e+00 -4.15783e+00 0.00000e+00 0.00000e+00 9.00350e+01 255.187 7.88010e+00 255.187 0.8742 
1 1 1 3   4   18 o 2  3.75790e+00 1.29574e+00 1.67024e+02 50.596  4.98415e+00  6.06693e+00  0.00000e+00 0.00000e+00 3.60767e+01 230.596 2.03100e+02 230.596 0.9340 
1 1 1 3   5   0  o 14 9.90745e+00 2.87574e-01 3.92162e+02 222.517 -8.49784e-01 -7.79157e-01 0.00000e+00 0.00000e+00 2.06671e+02 42.517  5.98833e+02 42.517  0.4980 
1 1 1 3   5   1  o 11 2.26186e+01 4.72900e-01 6.37563e+02 179.401 -5.28676e+00 5.52740e-02  0.00000e+00 0.00000e+00 1.27582e+02 179.401 5.09981e+02 359.401 0.8996 
1 1 1 3   5   2  o 16 4.00294e+01 9.08826e-01 7.03149e+02 357.354 1.28203e+01  -5.92438e-01 0.00000e+00 0.00000e+00 7.42186e+02 357.354 3.90370e+01 357.354 0.9602 
1 1 1 3   5   3  o 5  3.31084e+01 6.21637e-01 7.33630e+02 193.538 -1.16926e+01 -2.81545e+00 0.00000e+00 0.00000e+00 4.58366e+02 193.538 2.75264e+02 13.538  0.9575 
1 1 1 3   5   4  o 11 3.76290e+01 7.01607e-01 6.25328e+02 83.643  1.49966e+00  1.34615e+01  0.00000e+00 0.00000e+00 7.36185e+02 83.643  1.10856e+02 83.643  0.9623 
1 1 1 3   5   5  o 16 1.55384e+01 3.80312e-01 2.97066e+02 10.504  3.38570e+00  6.27774e-01  0.00000e+00 0.00000e+00 1.92487e+02 10.504  1.04579e+02 190.504 0.8381 
1 1 1 3   5   6  o 2  2.85996e+01 5.75720e-01 2.93768e+02 175.741 -8.04291e+00 5.98960e-01  0.00000e+00 0.00000e+00 7.12099e+02 175.741 4.18331e+02 175.741 0.9358 
1 1 1 3   5   7  o 10 1.86018e+01 4.54778e-01 3.75568e+02 67.391  2.98349e+00  7.16415e+00  0.00000e+00 0.00000e+00 2.76653e+02 67.391  9.89150e+01 247.391 0.9332 
1 1 1 3   5   8  o 10 1.47994e+01 4.32800e-01 3.86811e+02 43.980  5.25729e+00  5.07330e+00  0.00000e+00 0.00000e+00 1.29495e+02 43.980  2.57316e+02 223.980 0.9288 
1 1 1 3   5   9  o 11 3.69325e+01 7.08176e-01 7.04197e+02 294.869 1.85636e+01  -4.00483e+01 0.00000e+00 0.00000e+00 6.66686e+02 294.869 3.75106e+01 114.869 0.9886 
1 1 1 3   5   10 o 4  1.17926e+01 5.65208e-01 1.86382e+02 51.858  3.25840e+00  4.14936e+00  0.00000e+00 0.00000e+00 2.11665e+02 51.858  2.52829e+01 51.858  0.8994 
1 1 1 3   5   11 o 8  2.29101e+01 6.44493e-01 2.27631e+02 8.943   1.58847e+01  2.49955e+00  0.00000e+00 0.00000e+00 6.04552e+02 8.943   3.76921e+02 8.943   0.9684 
1 1 1 3   5   12 o 6  7.91100e+00 1.05414e+00 2.60923e+02 130.598 -5.77751e+00 6.74114e+00  0.00000e+00 0.00000e+00 1.84046e+01 130.598 2.42519e+02 310.598 0.9419 
1 1 1 3   5   13 o 11 1.74063e+01 7.93366e-01 2.71382e+02 283.973 7.54374e+00  -3.03165e+01 0.00000e+00 0.00000e+00 3.70199e+02 283.973 9.88170e+01 283.973 0.9839 
1 1 1 3   5   14 o 8  2.01265e+01 8.16169e-01 4.25610e+02 113.740 -2.99333e+01 6.80593e+01  0.00000e+00 0.00000e+00 3.22785e+02 113.740 1.02825e+02 293.740 0.9933 
1 1 1 3   5   15 o 18 1.55853e+01 9.31057e-01 2.18426e+02 192.197 -3.18787e+01 -6.89061e+00 0.00000e+00 0.00000e+00 3.55591e+02 192.197 1.37165e+02 192.197 0.9845 
1 1 1 3   5   16 o 10 1.12341e+01 1.34108e+00 3.15281e+02 266.011 -2.48598e+00 -3.56539e+01 0.00000e+00 0.00000e+00 9.87065e+01 266.011 2.16575e+02 86.011  0.9859 
1 1 1 3   5   17 o 5  1.17654e+01 1.59221e+00 2.60550e+02 82.665  3.76264e+00  2.92323e+01  0.00000e+00 0.00000e+00 1.71305e+02 82.665  8.92454e+01 262.665 0.9829 
1 1 1 3   5   18 o 11 3.93109e+00 1.32576e+00 8.80234e+01 232.827 -2.56779e+00 -3.38623e+00 0.00000e+00 0.00000e+00 3.99397e+01 232.827 4.80837e+01 52.827  0.8725 
1 1 1 3   6   0  o 1  4.75629e+01 9.16066e-01 9.38541e+02 197.116 -1.22396e+01 -3.76920e+00 0.00000e+00 0.00000e+00 7.78419e+02 197.116 1.60122e+02 17.116  0.9601 
1 1 1 3   6   1  f 0  1.05359e+01 4.45744e-01 3.67738e+02 183.391 -1.38268e+00 -8.19375e-02 0.00000e+00 0.00000e+00 1.43343e+02 3.391   5.11080e+02 3.391   0.5664 
1 1 1 3   6   2  o 6  4.51174e+00 3.23068e-01 1.72158e+02 122.526 -1.88098e-01 2.94956e-01  0.00000e+00 0.00000e+00 1.42928e+02 302.526 3.15085e+02 302.526 0.1723 
1 1 1 3   6   3  o 15 1.03740e+01 3.07523e-01 2.05122e+02 271.796 3.27079e-02  -1.04302e+00 0.00000e+00 0.00000e+00 2.50618e+01 91.796  2.30184e+02 91.796  0.4616 
1 1 1 3   6   4  o 7  1.29708e+01 3.43006e-01 2.38640e+02 247.343 -6.83786e-01 -1.63811e+00 0.00000e+00 0.00000e+00 8.18400e+01 247.343 1.56800e+02 67.343  0.6572 
1 1 1 3   6   5  o 3  2.28101e+01 4.77594e-01 3.98239e+02 281.030 1.28893e+00  -6.61220e+00 0.00000e+00 0.00000e+00 3.92753e+02 281.030 5.48661e+00 101.030 0.9225 
1 1 1 3   6   6  o 4  3.53353e+01 6.46734e-01 8.12905e+02 151.639 -2.41587e+01 1.30414e+01  0.00000e+00 0.00000e+00 4.90713e+02 151.639 3.22192e+02 331.639 0.9816 
1 1 1 3   6   7  o 6  3.89284e+01 7.48477e-01 5.69844e+02 36.705  1.95790e+01  1.45964e+01  0.00000e+00 0.00000e+00 8.62560e+02 36.705  2.92715e+02 36.705  0.9793 
1 1 1 3   6   8  o 2  3.56342e+01 6.73239e-01 3.66895e+02 236.883 -9.43087e+00 -1.44575e+01 0.00000e+00 0.00000e+00 9.32183e+02 236.883 5.65288e+02 236.883 0.9706 
1 1 1 3   6   9  o 18 3.65167e+01 7.04045e-01 6.05496e+02 176.836 -3.74422e+01 2.06947e+00  0.00000e+00 0.00000e+00 7.47145e+02 176.836 1.41649e+02 176.836 0.9866 
1 1 1 3   6   10 o 5  1.51145e+01 5.48913e-01 2.97513e+02 143.872 -8.72113e+00 6.36599e+00  0.00000e+00 0.00000e+00 2.42770e+02 143.872 5.47438e+01 323.872 0.9525 
1 1 1 3   6   11 o 18 1.78430e+01 6.29773e-01 1.81890e+02 77.074  2.23973e+00  9.75856e+00  0.00000e+00 0.00000e+00 4.53024e+02 77.074  2.71134e+02 77.074  0.9487 
1 1 1 3   6   12 o 14 1.06178e+01 8.60571e-01 1.68814e+02 261.330 -1.19717e+00 -7.85149e+00 0.00000e+00 0.00000e+00 2.03245e+02 261.330 3.44307e+01 261.330 0.9347 
1 1 1 3   6   13 o 8  7.52781e+00 1.20599e+00 1.09453e+02 88.160  1.58686e-01  4.93920e+00  0.00000e+00 0.00000e+00 1.42108e+02 88.160  3.26549e+01 88.160  0.8920 
1 1 1 3   6   14 o 11 1.47559e+01 8.97547e-01 1.91880e+02 358.037 2.40061e+01  -8.22944e-01 0.00000e+00 0.00000e+00 3.48907e+02 358.037 1.57027e+02 358.037 0.9790 
1 1 1 3   6   15 f 0  6.18601e+00 1.35986e+00 9.32905e+01 227.383 -3.18222e+00 -3.45863e+00 0.00000e+00 0.00000e+00 1.11718e+02 227.383 1.84275e+01 227.383 0.8859 
1 1 1 3   6   16 o 9  6.08524e+00 1.52952e+00 9.54780e+01 32.141  4.50381e+00  2.82975e+00  0.00000e+00 0.00000e+00 1.09292e+02 32.141  1.38143e+01 32.141  0.9003 
1 1 1 3   6   17 o 13 8.16301e+00 1.78554e+00 1.76111e+02 357.011 1.23529e+01  -6.44912e-01 0.00000e+00 0.00000e+00 1.16134e+02 357.011 5.99773e+01 177.011 0.9587 
1 1 1 3   6   18 o 8  7.04079e+00 1.75972e+00 2.39178e+02 145.435 -1.37366e+01 9.46389e+00  0.00000e+00 0.00000e+00 1.55045e+01 145.435 2.23674e+02 325.435 0.9695 
1 1 1 3   7   0  o 14 1.82505e+01 4.00181e-01 3.20075e+02 102.021 -3.38768e-01 1.59091e+00  0.00000e+00 0.00000e+00 1.09398e+02 102.021 2.10676e+02 282.021 0.6259 
1 1 1 3   7   1  o 11 3.82973e+01 7.02686e-01 7.02192e+02 175.366 -9.29191e+00 7.53144e-01  0.00000e+00 0.00000e+00 6.58232e+02 175.366 4.39607e+01 355.366 0.9447 
1 1 1 3   7   2  o 1  1.93523e+01 4.05138e-01 6.43462e+02 310.320 3.55103e+00  -4.18422e+00 0.00000e+00 0.00000e+00 1.40608e+01 310.320 6.29401e+02 130.320 0.9036 
1 1 1 3   7   3  o 3  2.07515e+01 4.10741e-01 6.52675e+02 90.145  -1.66105e-02 6.54352e+00  0.00000e+00 0.00000e+00 6.52106e+01 90.145  5.87465e+02 270.145 0.9201 
1 1 1 3   7   4  o 6  2.59418e+01 4.90129e-01 6.50947e+02 200.699 -8.96566e+00 -3.38774e+00 0.00000e+00 0.00000e+00 2.72011e+02 200.699 3.78936e+02 20.699  0.9463 
1 1 1 3   7   5  o 3  2.08967e+01 4.32910e-01 5.90721e+02 107.732 -3.27221e+00 1.02332e+01  0.00000e+00 0.00000e+00 1.57310e+02 107.732 4.33411e+02 287.732 0.9523 
1 1 1 3   7   6  o 7  7.71098e+00 3.66093e-01 1.55390e+02 74.575  3.05162e-01  1.10603e+00  0.00000e+00 0.00000e+00 1.15988e+01 254.575 1.66989e+02 254.575 0.4962 
1 1 1 3   7   7  o 10 1.97676e+01 4.52295e-01 5.50125e+01 149.951 -1.04195e+00 6.02765e-01  0.00000e+00 0.00000e+00 3.26701e+02 149.951 2.71688e+02 149.951 0.5139 
1 1 1 3   7   8  o 3  3.06045e+01 6.04329e-01 4.48593e+02 214.427 -1.49641e+01 -1.02566e+01 0.00000e+00 0.00000e+00 6.68770e+02 214.427 2.20177e+02 214.427 0.9720 
1 1 1 3   7   9  o 17 3.57355e+01 7.33733e-01 6.22098e+02 61.198  1.81202e+01  3.29585e+01  0.00000e+00 0.00000e+00 7.01638e+02 61.198  7.95398e+01 61.198  0.9866 
1 1 1 3   7   10 o 9  3.11093e+01 6.63565e-01 5.51622e+02 311.003 2.99752e+01  -3.44787e+01 0.00000e+00 0.00000e+00 6.02995e+02 311.003 5.13728e+01 311.003 0.9890 
1 1 1 3   7   11 o 5  1.95281e+01 6.31584e-01 3.08892e+02 302.710 1.03946e+01  -1.61849e+01 0.00000e+00 0.00000e+00 4.04272e+02 302.710 9.53802e+01 302.710 0.9736 
1 1 1 3   7   12 o 9  2.99590e+01 7.69078e-01 4.46239e+02 315.382 4.26639e+01  -4.20986e+01 0.00000e+00 0.00000e+00 6.67412e+02 315.382 2.21173e+02 315.382 0.9916 
1 1 1 3   7   13 o 2  1.08462e+01 9.17804e-01 1.14034e+02 17.002  7.61354e+00  2.32793e+00  0.00000e+00 0.00000e+00 2.65842e+02 17.002  1.51808e+02 17.002  0.9349 
1 1 1 3   7   14 f 0  1.14082e+01 9.62900e-01 2.31186e+02 225.871 -1.52760e+01 -1.57476e+01 0.00000e+00 0.00000e+00 1.86042e+02 225.871 4.51439e+01 45.871  0.9769 
1 1 1 3   7   15 o 11 6.74692e+00 1.40779e+00 1.29621e+02 123.575 -3.85942e+00 5.81436e+00  0.00000e+00 0.00000e+00 1.03909e+02 123.575 2.57123e+01 303.575 0.9253 
1 1 1 3   7   16 f 0  1.24522e+01 1.31969e+00 1.65399e+02 163.890 -2.01733e+01 5.82639e+00  0.00000e+00 0.00000e+00 2.88801e+02 163.890 1.23402e+02 163.890 0.9759 
1 1 1 3   7   17 f 0  4.98305e+00 1.52908e+00 8.55865e+01 331.431 3.73181e+00  -2.03203e+00 0.00000e+00 0.00000e+00 7.67649e+01 331.431 8.82158e+00 151.431 0.8725 
1 1 1 3   7   18 o 5  6.97236e+00 1.88068e+00 1.55194e+02 171.375 -9.79835e+00 1.48615e+00  0.00000e+00 0.00000e+00 9.14356e+01 171.375 6.37583e+01 351.375 0.9481 
1 1 1 3   8   0  o 13 1.46636e+01 4.34523e-01 3.62211e+02 53.174  1.18379e+00  1.58090e+00  0.00000e+00 0.00000e+00 2.01850e+01 53.174  3.42026e+02 233.174 0.6936 
1 1 1 3   8   1  o 14 2.53538e+01 6.51545e-01 2.19173e+01 51.330  1.16645e-01  1.45755e-01  0.00000e+00 0.00000e+00 6.66793e+01 51.330  4.47620e+01 51.330  0.0929 
1 1 1 3   8   2  o 8  4.60750e+01 7.88749e-01 1.06551e+03 62.914  9.58631e+00  1.87443e+01  0.00000e+00 0.00000e+00 6.25290e+02 62.914  4.40224e+02 242.914 0.9760 
1 1 1 3   8   3  o 4  2.19110e+01 4.26433e-01 3.60739e+02 253.140 -1.08993e+00 -3.59632e+00 0.00000e+00 0.00000e+00 3.42431e+02 253.140 1.83080e+01 73.140  0.8535 
1 1 1 3   8   4  o 3  1.59863e+01 3.61144e-01 4.66107e+02 85.890  3.00354e-01  4.18042e+00  0.00000e+00 0.00000e+00 5.70781e+01 85.890  4.09029e+02 265.890 0.8705 
1 1 1 3   8   5  o 5  1.22276e+01 3.41461e-01 1.17372e+02 337.538 1.14847e+00  -4.74818e-01 0.00000e+00 0.00000e+00 1.24319e+02 337.538 6.94728e+00 337.538 0.5258 
1 1 1 3   8   6  o 3  1.34321e+01 3.71491e-01 2.78021e+02 11.054  3.49640e+00  6.83075e-01  0.00000e+00 0.00000e+00 1.48190e+02 11.054  1.29831e+02 191.054 0.8443 
1 1 1 3   8   7  o 5  3.35142e+00 5.97515e-01 1.74144e+02 203.460 -5.89477e-01 -2.55822e-01 0.00000e+00 0.00000e+00 1.35641e+02 23.460  3.09785e+02 23.460  0.3058 
1 1 1 3   8   8  o 7  4.29097e+01 7.79690e-01 5.77164e+02 118.516 -1.55069e+01 2.85411e+01  0.00000e+00 0.00000e+00 1.00949e+03 118.516 4.32325e+02 118.516 0.9845 
1 1 1 3   8   9  o 3  2.93334e+01 5.94581e-01 7.18026e+02 334.025 3.21831e+01  -1.56792e+01 0.00000e+00 0.00000e+00 3.67784e+02 334.025 3.50242e+02 154.025 0.9859 
1 1 1 3   8   10 o 10 2.60959e+01 6.40655e-01 3.72548e+02 249.174 -9.20913e+00 -2.42099e+01 0.00000e+00 0.00000e+00 5.87660e+02 249.174 2.15112e+02 249.174 0.9805 
1 1 1 3   8   11 o 10 2.48588e+01 6.52646e-01 2.99408e+02 261.533 -3.48568e+00 -2.34164e+01 0.00000e+00 0.00000e+00 6.13076e+02 261.533 3.13668e+02 261.533 0.9786 
1 1 1 3   8   12 o 7  1.97873e+01 7.00194e-01 3.12631e+02 73.829  8.23461e+00  2.83981e+01  0.00000e+00 0.00000e+00 4.16457e+02 73.829  1.03826e+02 73.829  0.9829 
1 1 1 3   8   13 o 1  1.43518e+01 8.19910e-01 1.77861e+02 318.685 1.25914e+01  -1.10676e+01 0.00000e+00 0.00000e+00 3.43489e+02 318.685 1.65628e+02 318.685 0.9697 
1 1 1 3   8   14 o 15 5.28595e+00 1.30772e+00 1.53997e+02 62.608  2.77537e+00  5.35605e+00  0.00000e+00 0.00000e+00 2.66408e+01 62.608  1.27356e+02 242.608 0.9129 
1 1 1 3   8   15 o 18 4.96089e+00 1.31234e+00 6.97750e+01 247.632 -1.09305e+00 -2.65617e+00 0.00000e+00 0.00000e+00 7.86962e+01 247.632 8.92119e+00 247.632 0.8001 
1 1 1 3   8   16 o 8  5.24078e+00 1.43636e+00 1.32380e+02 74.135  1.82147e+00  6.40906e+00  0.00000e+00 0.00000e+00 4.81342e+01 74.135  8.42456e+01 254.135 0.9216 
1 1 1 3   8   17 o 5  6.13375e+00 1.62254e+00 5.25151e+01 285.464 8.74608e-01  -3.16138e+00 0.00000e+00 0.00000e+00 1.37307e+02 285.464 8.47919e+01 285.464 0.8287 
1 1 1 3   8   18 o 15 4.55352e+00 1.49535e+00 5.48319e+01 36.392  2.36622e+00  1.74400e+00  0.00000e+00 0.00000e+00 8.19902e+01 36.392  2.71583e+01 36.392  0.8054 
1 1 1 3   9   0  f 0  1.85141e+01 3.82408e-01 7.50376e+01 220.442 -3.77994e-01 -3.22177e-01 0.00000e+00 0.00000e+00 9.26941e+01 220.442 1.76565e+01 220.442 0.2410 
1 1 1 3   9   1  o 1  3.40905e+01 5.97425e-01 6.78555e+02 351.326 7.42594e+00  -1.13286e+00 0.00000e+00 0.00000e+00 5.14562e+02 351.326 1.63994e+02 171.326 0.9308 
1 1 1 3   9   2  o 4  1.49169e+01 4.23419e-01 2.80049e+02 243.033 -9.14103e-01 -1.79657e+00 0.00000e+00 0.00000e+00 1.12757e+02 243.033 1.67292e+02 63.033  0.7003 
1 1 1 3   9   3  o 17 1.80517e+01 3.76400e-01 2.50287e+02 243.813 -1.30920e+00 -2.66216e+00 0.00000e+00 0.00000e+00 2.97775e+02 243.813 4.74886e+01 243.813 0.8075 
1 1 1 3   9   4  o 14 2.66844e+01 5.01981e-01 3.01305e+02 327.636 3.77251e+00  -2.39079e+00 0.00000e+00 0.00000e+00 5.80851e+02 327.636 2.79546e+02 327.636 0.8793 
1 1 1 3   9   5  o 6  8.95576e+00 3.28494e-01 9.10241e+01 62.103  3.28046e-01  6.19650e-01  0.00000e+00 0.00000e+00 2.02870e+01 62.103  7.07371e+01 242.103 0.3307 
1 1 1 3   9   6  o 11 3.27103e+01 6.06907e-01 6.93612e+02 311.901 1.43372e+01  -1.59782e+01 0.00000e+00 0.00000e+00 5.06706e+02 311.901 1.86906e+02 131.902 0.9764 
1 1 1 3   9   7  o 13 1.61522e+01 4.24294e-01 5.46164e+01 164.751 -9.38287e-01 2.55790e-01  0.00000e+00 0.00000e+00 2.10319e+02 164.751 1.55702e+02 164.751 0.4366 
1 1 1 3   9   8  o 7  1.93581e+01 4.76483e-01 4.81918e+02 77.615  2.64467e+00  1.20435e+01  0.00000e+00 0.00000e+00 2.15005e+02 77.615  2.66913e+02 257.615 0.9586 
1 1 1 3   9   9  o 14 4.26986e+01 9.60110e-01 3.82974e+02 290.207 9.51762e+00  -2.58587e+01 0.00000e+00 0.00000e+00 1.19071e+03 290.207 8.07741e+02 290.207 0.9817 
1 1 1 3   9   10 o 14 3.52618e+01 6.90721e-01 7.01943e+02 296.374 2.91741e+01  -5.88368e+01 0.00000e+00 0.00000e+00 6.11183e+02 296.374 9.07594e+01 116.374 0.9924 
1 1 1 3   9   11 o 7  3.61319e+01 7.38855e-01 5.43414e+02 146.642 -5.17410e+01 3.40622e+01  0.00000e+00 0.00000e+00 8.00791e+02 146.642 2.57377e+02 146.642 0.9919 
1 1 1 3   9   12 o 4  2.62511e+01 7.00994e-01 4.97434e+02 254.551 -1.66131e+01 -6.01131e+01 0.00000e+00 0.00000e+00 4.78665e+02 254.551 1.87689e+01 74.551  0.9920 
1 1 1 3   9   13 o 15 1.55314e+01 8.75454e-01 2.35741e+02 105.676 -6.41809e+00 2.28692e+01  0.00000e+00 0.00000e+00 3.33693e+02 105.676 9.79516e+01 105.676 0.9787 
1 1 1 3   9   14 o 5  1.09179e+01 1.06163e+00 1.53192e+02 188.113 -1.33548e+01 -1.90380e+00 0.00000e+00 0.00000e+00 2.40058e+02 188.113 8.68660e+01 188.113 0.9622 
1 1 1 3   9   15 o 16 9.22968e+00 1.31636e+00 1.50905e+02 65.526  5.10498e+00  1.12154e+01  0.00000e+00 0.00000e+00 1.80019e+02 65.526  2.91146e+01 65.526  0.9585 
1 1 1 3   9   16 o 5  6.08153e+00 1.51329e+00 1.09988e+02 78.809  1.19763e+00  6.05325e+00  0.00000e+00 0.00000e+00 9.79726e+01 78.809  1.20153e+01 258.809 0.9149 
1 1 1 3   9   17 o 15 5.70031e+00 1.61972e+00 1.43397e+02 24.302  7.59773e+00  3.43086e+00  0.00000e+00 0.00000e+00 5.62546e+01 24.302  8.71425e+01 204.302 0.9380 
1 1 1 3   9   18 o 1  4.97923e+00 1.57613e+00 5.28553e+01 145.994 -2.43515e+00 1.64293e+00  0.00000e+00 0.00000e+00 9.67270e+01 145.994 4.38717e+01 145.994 0.8053 
1 1 1 3   10  0  o 14 2.52220e+01 5.84890e-01 4.74854e+02 342.312 3.90745e+00  -1.24609e+00 0.00000e+00 0.00000e+00 3.47538e+02 342.312 1.27317e+02 162.312 0.8673 
1 1 1 3   10  1  o 13 2.50080e+01 5.86156e-01 4.04786e+02 85.862  3.54917e-01  4.90585e+00  0.00000e+00 0.00000e+00 4.33410e+02 85.862  2.86249e+01 85.862  0.8915 
1 1 1 3   10  2  o 7  2.49182e+01 4.62914e-01 5.10941e+02 281.266 1.16730e+00  -5.85994e+00 0.00000e+00 0.00000e+00 3.43483e+02 281.266 1.67458e+02 101.266 0.9120 
1 1 1 3   10  3  o 18 1.95492e+01 3.96216e-01 5.33745e+02 195.554 -6.47589e+00 -1.80251e+00 0.00000e+00 0.00000e+00 1.44147e+02 195.554 3.89598e+02 15.554  0.9223 
1 1 1 3   10  4  o 19 2.39547e+01 4.62973e-01 2.35921e+02 285.559 1.23015e+00  -4.41801e+00 0.00000e+00 0.00000e+00 5.59101e+02 285.559 3.23181e+02 285.559 0.8828 
1 1 1 3   10  5  o 14 1.85180e+01 4.04930e-01 1.85743e+02 284.702 7.44501e-01  -2.83750e+00 0.00000e+00 0.00000e+00 3.74556e+02 284.702 1.88813e+02 284.702 0.8049 
1 1 1 3   10  6  o 4  2.75789e+01 6.00549e-01 2.71404e+02 110.616 -2.39874e+00 6.37628e+00  0.00000e+00 0.00000e+00 6.85611e+02 110.616 4.14207e+02 110.616 0.9234 
1 1 1 3   10  7  o 17 2.14587e+01 4.73839e-01 3.19364e+02 327.184 7.59750e+00  -4.89915e+00 0.00000e+00 0.00000e+00 4.40851e+02 327.184 1.21486e+02 327.184 0.9430 
1 1 1 3   10  8  f 0  3.79534e+01 7.06920e-01 7.15270e+02 103.716 -8.43527e+00 3.45600e+01  0.00000e+00 0.00000e+00 6.89984e+02 103.716 2.52850e+01 283.716 0.9858 
1 1 1 3   10  9  o 18 1.06044e+01 5.26480e-01 2.27041e+02 266.838 -2.28276e-01 -4.13190e+00 0.00000e+00 0.00000e+00 1.18776e+02 266.838 1.08265e+02 86.838  0.8686 
1 1 1 3   10  10 o 11 1.95695e+01 6.42332e-01 3.78812e+02 16.249  1.89267e+01  5.51623e+00  0.00000e+00 0.00000e+00 3.36663e+02 16.249  4.21496e+01 196.249 0.9743 
1 1 1 3   10  11 o 15 2.33601e+01 6.39139e-01 3.16198e+02 235.049 -1.34443e+01 -1.92352e+01 0.00000e+00 0.00000e+00 5.41063e+02 235.049 2.24865e+02 235.049 0.9785 
1 1 1 3   10  12 o 14 1.23321e+01 7.94065e-01 2.75762e+02 306.963 9.63916e+00  -1.28086e+01 0.00000e+00 0.00000e+00 1.71835e+02 306.963 1.03928e+02 126.963 0.9683 
1 1 1 3   10  13 o 8  7.59459e+00 1.18871e+00 5.93170e+01 156.833 -2.48918e+00 1.06518e+00  0.00000e+00 0.00000e+00 1.64237e+02 156.833 1.04920e+02 156.833 0.7858 
1 1 1 3   10  14 o 14 1.86663e+01 8.50808e-01 4.18256e+02 6.033   6.66406e+01  7.04331e+00  0.00000e+00 0.00000e+00 2.75254e+02 6.033   1.43002e+02 186.033 0.9925 
1 1 1 3   10  15 o 7  6.50135e+00 1.43376e+00 2.04027e+02 138.740 -8.37100e+00 7.34363e+00  0.00000e+00 0.00000e+00 2.79645e+01 138.740 1.76062e+02 318.740 0.9540 
1 1 1 3   10  16 o 2  7.04788e+00 1.61756e+00 1.61657e+02 247.332 -3.92664e+00 -9.40164e+00 0.00000e+00 0.00000e+00 8.84690e+01 247.332 7.31878e+01 67.332  0.9496 
1 1 1 3   10  17 o 4  7.64052e+00 1.66016e+00 1.23103e+02 333.432 8.36625e+00  -4.18371e+00 0.00000e+00 0.00000e+00 1.46488e+02 333.432 2.33850e+01 333.432 0.9449 
1 1 1 3   10  18 o 18 5.32776e+00 1.62408e+00 1.08874e+02 121.333 -3.26158e+00 5.35745e+00  0.00000e+00 0.00000e+00 7.32624e+01 121.333 3.56115e+01 301.333 0.9164 
1 1 1 3   11  0  o 19 2.55392e+01 4.63382e-01 9.25279e+02 159.942 -7.28440e+00 2.65961e+00  0.00000e+00 0.00000e+00 2.94047e+01 339.942 9.54683e+02 339.942 0.9331 
1 1 1 3   11  1  o 17 1.68491e+01 3.91067e-01 2.68119e+02 231.503 -1.31748e+00 -1.65647e+00 0.00000e+00 0.00000e+00 1.85453e+02 231.503 8.26657e+01 51.503  0.7160 
1 1 1 3   11  2  o 11 3.30890e+01 7.46347e-01 3.88125e+02 259.355 -1.07844e+00 -5.73757e+00 0.00000e+00 0.00000e+00 7.43698e+02 259.355 3.55574e+02 259.355 0.9098 
1 1 1 3   11  3  o 19 4.94157e+01 8.44704e-01 9.38262e+02 220.475 -2.21245e+01 -1.88794e+01 0.00000e+00 0.00000e+00 8.87384e+02 220.475 5.08784e+01 40.475  0.9827 
1 1 1 3   11  4  o 10 3.40933e+01 6.09445e-01 6.40000e+02 152.341 -1.54437e+01 8.09398e+00  0.00000e+00 0.00000e+00 6.04366e+02 152.341 3.56343e+01 332.341 0.9709 
1 1 1 3   11  5  o 10 1.47428e+01 3.65326e-01 1.08453e+02 339.600 1.26852e+00  -4.71766e-01 0.00000e+00 0.00000e+00 2.00620e+02 339.600 9.21664e+01 339.600 0.5577 
1 1 1 3   11  6  o 15 1.69011e+01 4.06315e-01 3.54000e+02 101.140 -1.05058e+00 5.33499e+00  0.00000e+00 0.00000e+00 2.19290e+02 101.140 1.34710e+02 281.140 0.9026 
1 1 1 3   11  7  o 13 2.96685e+01 5.78732e-01 5.91517e+02 202.908 -2.12016e+01 -8.95954e+00 0.00000e+00 0.00000e+00 4.98613e+02 202.908 9.29037e+01 22.908  0.9780 
1 1 1 3   11  8  o 6  3.24111e+01 6.30689e-01 5.64779e+02 297.244 1.13836e+01  -2.21077e+01 0.00000e+00 0.00000e+00 6.27731e+02 297.244 6.29522e+01 297.244 0.9797 
1 1 1 3   11  9  o 6  1.53244e+01 5.04722e-01 3.63122e+02 323.880 7.72504e+00  -5.63741e+00 0.00000e+00 0.00000e+00 1.81212e+02 323.880 1.81910e+02 143.880 0.9462 
1 1 1 3   11  10 o 5  4.52310e+01 8.19346e-01 9.72630e+02 215.602 -9.38187e+01 -6.71719e+01 0.00000e+00 0.00000e+00 7.17255e+02 215.602 2.55375e+02 35.602  0.9957 
1 1 1 3   11  11 o 9  1.08632e+01 7.48267e-01 2.28495e+02 128.923 -4.90437e+00 6.07301e+00  0.00000e+00 0.00000e+00 1.51854e+02 128.923 7.66411e+01 308.923 0.9336 
1 1 1 3   11  12 o 5  1.24305e+01 1.34185e+00 1.57069e+02 186.517 -8.28120e+00 -9.46073e-01 0.00000e+00 0.00000e+00 2.79945e+02 186.517 1.22876e+02 186.517 0.9379 
1 1 1 3   11  13 o 10 2.01009e+01 7.60678e-01 3.84449e+02 306.751 3.17250e+01  -4.24834e+01 0.00000e+00 0.00000e+00 3.61368e+02 306.751 2.30805e+01 126.751 0.9905 
1 1 1 3   11  14 o 16 8.18108e+00 1.18996e+00 1.21219e+02 80.087  1.31797e+00  7.54161e+00  0.00000e+00 0.00000e+00 1.64254e+02 80.087  4.30349e+01 80.087  0.9322 
1 1 1 3   11  15 o 12 7.25615e+00 1.37886e+00 1.48628e+02 307.960 5.70467e+00  -7.31217e+00 0.00000e+00 0.00000e+00 1.07700e+02 307.960 4.09274e+01 127.960 0.9444 
1 1 1 3   11  16 o 10 8.84544e+00 1.49613e+00 2.19748e+02 198.246 -1.76154e+01 -5.80734e+00 0.00000e+00 0.00000e+00 1.01792e+02 198.246 1.17956e+02 18.246  0.9727 
1 1 1 3   11  17 o 5  5.18248e+00 1.55052e+00 8.33615e+01 18.758  4.35150e+00  1.47777e+00  0.00000e+00 0.00000e+00 8.75240e+01 18.758  4.16245e+00 18.758  0.8831 
1 1 1 3   11  18 o 11 6.38738e+00 1.79199e+00 7.34849e+01 349.169 4.43393e+00  -8.48326e-01 0.00000e+00 0.00000e+00 1.36378e+02 349.169 6.28928e+01 349.169 0.8808 
1 1 1 3   12  0  o 5  3.33972e+01 5.81867e-01 8.06578e+02 221.382 -9.83666e+00 -8.66678e+00 0.00000e+00 0.00000e+00 4.00024e+02 221.382 4.06554e+02 41.382  0.9611 
1 1 1 3   12  1  f 0  2.25644e+01 4.76642e-01 5.75009e+02 352.827 5.79457e+00  -7.29222e-01 0.00000e+00 0.00000e+00 1.96798e+02 352.827 3.78211e+02 172.827 0.9098 
1 1 1 3   12  2  o 15 2.11570e+01 4.10770e-01 7.61622e+02 89.925  9.27015e-03  7.13117e+00  0.00000e+00 0.00000e+00 2.42784e+01 269.925 7.85900e+02 269.925 0.9270 
1 1 1 3   12  3  o 10 3.27093e+01 5.84123e-01 7.39374e+02 159.459 -1.39727e+01 5.23571e+00  0.00000e+00 0.00000e+00 4.48403e+02 159.459 2.90970e+02 339.458 0.9659 
1 1 1 3   12  4  o 1  9.10706e+00 3.23093e-01 7.76651e+01 270.609 5.95398e-03  -5.59690e-01 0.00000e+00 0.00000e+00 1.45800e+01 270.609 6.30851e+01 90.609  0.2694 
1 1 1 3   12  5  o 18 1.74535e+01 3.95716e-01 3.83329e+02 144.592 -4.24379e+00 3.01685e+00  0.00000e+00 0.00000e+00 2.05750e+02 144.592 1.77578e+02 324.591 0.8980 
1 1 1 3   12  6  o 6  1.49942e+01 3.96704e-01 3.44988e+02 176.985 -4.67128e+00 2.45996e-01  0.00000e+00 0.00000e+00 1.53855e+02 176.985 1.91133e+02 356.985 0.8853 
1 1 1 3   12  7  o 18 2.20181e+01 4.82267e-01 5.43087e+02 278.010 2.18389e+00  -1.55194e+01 0.00000e+00 0.00000e+00 2.57246e+02 278.010 2.85840e+02 98.010  0.9676 
1 1 1 3   12  8  o 7  3.12421e+01 6.15528e-01 3.71978e+02 263.141 -1.88245e+00 -1.56496e+01 0.00000e+00 0.00000e+00 7.63472e+02 263.141 3.91494e+02 263.141 0.9677 
1 1 1 3   12  9  o 19 1.44392e+01 5.04618e-01 3.40485e+02 103.910 -2.02939e+00 8.19412e+00  0.00000e+00 0.00000e+00 1.68369e+02 103.910 1.72116e+02 283.910 0.9388 
1 1 1 3   12  10 o 10 1.60532e+01 5.86374e-01 2.38153e+02 151.037 -8.72590e+00 4.82956e+00  0.00000e+00 0.00000e+00 3.33164e+02 151.037 9.50108e+01 151.037 0.9485 
1 1 1 3   12  11 o 15 2.31983e+01 6.45781e-01 3.09195e+02 221.549 -1.76007e+01 -1.55986e+01 0.00000e+00 0.00000e+00 5.42120e+02 221.549 2.32925e+02 221.549 0.9785 
1 1 1 3   12  12 o 6  2.20427e+01 6.79034e-01 3.84175e+02 329.712 3.49323e+01  -2.04028e+01 0.00000e+00 0.00000e+00 4.31745e+02 329.712 4.75698e+01 329.712 0.9876 
1 1 1 3   12  13 o 11 1.04772e+01 1.02668e+00 1.94049e+02 302.740 7.10401e+00  -1.10488e+01 0.00000e+00 0.00000e+00 1.83152e+02 302.740 1.08965e+01 122.740 0.9611 
1 1 1 3   12  14 o 19 1.06930e+01 1.02948e+00 1.87155e+02 70.108  5.53819e+00  1.53059e+01  0.00000e+00 0.00000e+00 2.00599e+02 70.108  1.34432e+01 70.108  0.9688 
1 1 1 3   12  15 o 1  5.29849e+00 1.36445e+00 8.87543e+01 224.737 -2.88949e+00 -2.86306e+00 0.00000e+00 0.00000e+00 8.28820e+01 224.737 5.87229e+00 44.737  0.8661 
1 1 1 3   12  16 o 1  5.95712e+00 1.47187e+00 1.62783e+02 197.273 -8.94723e+00 -2.78221e+00 0.00000e+00 0.00000e+00 4.76057e+01 197.273 1.15178e+02 17.273  0.9450 
1 1 1 3   12  17 f 0  4.99283e+00 1.49092e+00 8.80112e+01 204.190 -4.19588e+00 -1.88483e+00 0.00000e+00 0.00000e+00 7.66375e+01 204.190 1.13737e+01 24.190  0.8832 
1 1 1 3   12  18 o 18 4.21704e+00 1.42418e+00 5.16272e+01 15.183  2.56429e+00  6.95901e-01  0.00000e+00 0.00000e+00 7.12389e+01 15.183  1.96117e+01 15.183  0.7811 
1 1 1 3   13  0  o 1  1.78235e+01 3.54435e-01 5.03364e+02 135.404 -2.97715e+00 2.93550e+00  0.00000e+00 0.00000e+00 7.96312e+01 135.404 4.23733e+02 315.404 0.8701 
1 1 1 3   13  1  o 17 3.10805e+01 6.18175e-01 5.18021e+02 47.180  4.72593e+00  5.10000e+00  0.00000e+00 0.00000e+00 5.62802e+02 47.180  4.47804e+01 47.180  0.9250 
1 1 1 3   13  2  o 5  3.11408e+01 5.55273e-01 7.49126e+02 293.834 4.82468e+00  -1.09215e+01 0.00000e+00 0.00000e+00 3.71474e+02 293.834 3.77652e+02 113.834 0.9572 
1 1 1 3   13  3  o 10 4.64420e+01 7.97434e-01 8.64871e+02 353.501 3.20625e+01  -3.65256e+00 0.00000e+00 0.00000e+00 8.53816e+02 353.501 1.10545e+01 173.501 0.9844 
1 1 1 3   13  4  o 8  1.88525e+01 4.02363e-01 3.78571e+02 200.116 -5.14975e+00 -1.88620e+00 0.00000e+00 0.00000e+00 2.61739e+02 200.116 1.16832e+02 20.116  0.9035 
1 1 1 3   13  5  o 12 1.50721e+01 3.75471e-01 4.40156e+02 1.144   5.11754e+00  1.02186e-01  0.00000e+00 0.00000e+00 6.74496e+01 1.144   3.72706e+02 181.144 0.8961 
1 1 1 3   13  6  o 6  2.22036e+01 4.69861e-01 3.44363e+02 142.021 -5.41516e+00 4.22763e+00  0.00000e+00 0.00000e+00 4.26611e+02 142.021 8.22479e+01 142.021 0.9241 
1 1 1 3   13  7  o 12 3.20658e+01 6.12191e-01 7.56670e+02 296.608 1.41456e+01  -2.82377e+01 0.00000e+00 0.00000e+00 4.28704e+02 296.608 3.27966e+02 116.608 0.9840 
1 1 1 3   13  8  o 5  2.53628e+01 5.41052e-01 3.47190e+02 176.614 -1.19231e+01 7.05461e-01  0.00000e+00 0.00000e+00 5.64495e+02 176.614 2.17305e+02 176.614 0.9572 
1 1 1 3   13  9  o 10 2.98958e+01 6.23072e-01 4.51693e+02 72.267  8.60621e+00  2.69139e+01  0.00000e+00 0.00000e+00 6.50521e+02 72.267  1.98829e+02 72.267  0.9821 
1 1 1 3   13  10 o 18 2.83948e+01 9.08527e-01 2.40890e+02 304.657 9.90477e+00  -1.43274e+01 0.00000e+00 0.00000e+00 7.93479e+02 304.657 5.52589e+02 304.657 0.9709 
1 1 1 3   13  11 o 1  3.95274e+01 8.14207e-01 7.78623e+02 219.363 -7.67580e+01 -6.29662e+01 0.00000e+00 0.00000e+00 6.96255e+02 219.363 8.23679e+01 39.363  0.9950 
1 1 1 3   13  12 f 0  1.98438e+01 8.29651e-01 2.16453e+02 12.246  1.92353e+01  4.17485e+00  0.00000e+00 0.00000e+00 5.08152e+02 12.246  2.91699e+02 12.246  0.9743 
1 1 1 3   13  13 o 3  1.27444e+01 9.49016e-01 2.29932e+02 265.234 -1.60137e+00 -1.92069e+01 0.00000e+00 0.00000e+00 2.34873e+02 265.234 4.94088e+00 265.234 0.9737 
1 1 1 3   13  14 o 7  7.37602e+00 1.32846e+00 8.78213e+01 4.033   4.74788e+00  3.34761e-01  0.00000e+00 0.00000e+00 1.57201e+02 4.033   6.93797e+01 4.033   0.8875 
1 1 1 3   13  15 o 3  7.88473e+00 1.33985e+00 1.76470e+02 15.221  1.21989e+01  3.31911e+00  0.00000e+00 0.00000e+00 1.06515e+02 15.221  6.99550e+01 195.221 0.9596 
1 1 1 3   13  16 o 8  9.72927e+00 1.40166e+00 1.49948e+02 151.853 -1.28931e+01 6.89784e+00  0.00000e+00 0.00000e+00 2.00977e+02 151.853 5.10291e+01 151.853 0.9652 
1 1 1 3   13  17 o 19 9.07244e+00 1.74875e+00 1.48316e+02 83.082  1.45784e+00  1.20158e+01  0.00000e+00 0.00000e+00 1.76114e+02 83.082  2.77977e+01 83.082  0.9578 
1 1 1 3   13  18 o 8  1.42208e+01 1.79856e+00 2.50251e+02 80.622  5.55085e+00  3.36089e+01  0.00000e+00 0.00000e+00 2.72367e+02 80.622  2.21164e+01 80.622  0.9852 
1 1 1 3   14  0  o 8  2.04430e+01 4.39453e-01 4.21506e+02 19.143  3.62227e+00  1.25735e+00  0.00000e+00 0.00000e+00 2.36923e+02 19.143  1.84583e+02 199.143 0.8568 
1 1 1 3   14  1  o 8  3.07515e+01 7.68670e-01 7.01354e+02 205.698 -9.25125e+00 -4.45194e+00 0.00000e+00 0.00000e+00 3.96855e+02 205.698 3.04499e+02 25.698  0.9500 
1 1 1 3   14  2  o 8  3.46239e+01 6.07804e-01 7.61079e+02 298.798 6.29125e+00  -1.14448e+01 0.00000e+00 0.00000e+00 4.89706e+02 298.798 2.71373e+02 118.798 0.9609 
1 1 1 3   14  3  o 12 3.28089e+01 5.86874e-01 5.21427e+02 198.242 -1.28208e+01 -4.22564e+00 0.00000e+00 0.00000e+00 6.65353e+02 198.242 1.43926e+02 198.242 0.9622 
1 1 1 3   14  4  o 14 5.53300e+00 3.52249e-01 1.11015e+02 68.399  1.71310e-01  4.32654e-01  0.00000e+00 0.00000e+00 6.38890e+01 248.399 1.74904e+02 248.399 0.2266 
1 1 1 3   14  5  o 14 1.02781e+01 3.49155e-01 9.16111e+01 359.511 7.20006e-01  -6.14064e-03 0.00000e+00 0.00000e+00 3.91610e+01 359.511 5.24500e+01 179.511 0.3385 
1 1 1 3   14  6  o 5  1.15671e+01 3.82737e-01 1.84679e+02 10.814  2.24342e+00  4.28512e-01  0.00000e+00 0.00000e+00 1.36655e+02 10.814  4.80231e+01 190.814 0.7393 
1 1 1 3   14  7  o 11 3.64278e+01 6.76089e-01 5.87384e+02 279.049 3.99090e+00  -2.50594e+01 0.00000e+00 0.00000e+00 7.53791e+02 279.049 1.66407e+02 279.049 0.9801 
1 1 1 3   14  8  f 0  3.23678e+01 6.68505e-01 5.04756e+02 131.906 -1.47101e+01 1.63914e+01  0.00000e+00 0.00000e+00 6.82813e+02 131.906 1.78057e+02 131.906 0.9770 
1 1 1 3   14  9  o 2  3.89002e+01 7.43689e-01 5.05287e+02 315.394 2.90401e+01  -2.86437e+01 0.00000e+00 0.00000e+00 9.36918e+02 315.394 4.31631e+02 315.394 0.9877 
1 1 1 3   14  10 o 14 3.58954e+01 7.26641e-01 3.61826e+02 62.769  1.53375e+01  2.98043e+01  0.00000e+00 0.00000e+00 9.64736e+02 62.769  6.02910e+02 62.769  0.9850 
1 1 1 3   14  11 o 1  1.51012e+01 7.09361e-01 2.60637e+02 312.058 8.57616e+00  -9.50532e+00 0.00000e+00 0.00000e+00 2.83081e+02 312.058 2.24445e+01 312.058 0.9601 
1 1 1 3   14  12 o 1  1.74621e+01 7.05740e-01 3.34829e+02 286.249 7.60987e+00  -2.61104e+01 0.00000e+00 0.00000e+00 3.07486e+02 286.249 2.73431e+01 106.249 0.9814 
1 1 1 3   14  13 o 14 1.11518e+01 9.45978e-01 1.44655e+02 168.670 -1.09592e+01 2.19578e+00  0.00000e+00 0.00000e+00 2.53887e+02 168.670 1.09232e+02 168.670 0.9542 
1 1 1 3   14  14 o 2  8.86429e+00 1.17604e+00 1.11812e+02 218.865 -5.98069e+00 -4.81978e+00 0.00000e+00 0.00000e+00 1.97546e+02 218.865 8.57341e+01 218.865 0.9324 
1 1 1 3   14  15 o 9  5.53520e+00 1.39052e+00 1.09379e+02 266.968 -2.84070e-01 -5.36372e+00 0.00000e+00 0.00000e+00 7.72112e+01 266.968 3.21681e+01 86.968  0.9013 
1 1 1 3   14  16 o 14 8.99695e+00 1.55885e+00 1.66572e+02 150.488 -1.24953e+01 7.07282e+00  0.00000e+00 0.00000e+00 1.57706e+02 150.488 8.86607e+00 330.488 0.9645 
1 1 1 3   14  17 o 18 7.46739e+00 1.74961e+00 2.05310e+02 114.133 -5.63318e+00 1.25738e+01  0.00000e+00 0.00000e+00 6.31751e+01 114.133 1.42135e+02 294.133 0.9630 
1 1 1 3   14  18 o 11 4.25469e+00 1.43276e+00 5.71089e+01 208.755 -2.68498e+00 -1.47336e+00 0.00000e+00 0.00000e+00 7.21558e+01 208.755 1.50469e+01 208.755 0.8145 
1 1 1 3   15  0  o 19 2.57703e+01 5.94255e-01 4.49519e+02 203.474 -5.18908e+00 -2.25347e+00 0.00000e+00 0.00000e+00 4.28745e+02 203.474 2.07742e+01 23.474  0.9067 
1 1 1 3   15  1  o 3  2.88496e+01 7.32189e-01 5.52786e+02 171.749 -7.21706e+00 1.04653e+00  0.00000e+00 0.00000e+00 4.54349e+02 171.749 9.84376e+01 351.749 0.9287 
1 1 1 3   15  2  o 10 2.58198e+01 4.80418e-01 6.27515e+02 288.654 2.49077e+00  -7.37797e+00 0.00000e+00 0.00000e+00 2.78463e+02 288.654 3.49051e+02 108.654 0.9334 
1 1 1 3   15  3  o 2  8.61430e+00 3.15287e-01 2.89868e+02 93.713  -1.25166e-01 1.92865e+00  0.00000e+00 0.00000e+00 6.75931e+01 273.713 3.57461e+02 273.713 0.6864 
1 1 1 3   15  4  o 14 1.83056e+01 3.95108e-01 4.19833e+02 295.192 2.43984e+00  -5.18675e+00 0.00000e+00 0.00000e+00 2.04921e+02 295.192 2.14913e+02 115.192 0.9080 
1 1 1 3   15  5  o 1  1.23962e+01 3.61636e-01 3.11009e+02 2.530   3.32175e+00  1.46773e-01  0.00000e+00 0.00000e+00 7.63264e+01 2.530   2.34683e+02 182.530 0.8314 
1 1 1 3   15  6  o 12 2.41301e+01 4.95085e-01 5.43002e+02 52.218  8.51658e+00  1.09866e+01  0.00000e+00 0.00000e+00 3.30418e+02 52.218  2.12584e+02 232.218 0.9633 
1 1 1 3   15  7  o 11 1.65040e+01 4.37725e-01 3.73831e+02 207.795 -6.48523e+00 -3.41859e+00 0.00000e+00 0.00000e+00 2.02136e+02 207.795 1.71695e+02 27.795  0.9291 
1 1 1 3   15  8  o 15 1.72810e+01 5.22452e-01 1.30033e+02 130.844 -2.33910e+00 2.70569e+00  0.00000e+00 0.00000e+00 4.18307e+02 130.844 2.88274e+02 130.844 0.8450 
1 1 1 3   15  9  f 0  5.15070e+01 9.29105e-01 6.38889e+02 223.835 -4.85781e+01 -4.66419e+01 0.00000e+00 0.00000e+00 1.28007e+03 223.835 6.41185e+02 223.835 0.9925 
1 1 1 3   15  10 o 13 4.10582e+01 8.95301e-01 7.02662e+02 244.781 -3.29183e+01 -6.98963e+01 0.00000e+00 0.00000e+00 8.27789e+02 244.781 1.25127e+02 244.781 0.9935 
1 1 1 3   15  11 o 15 1.58332e+01 8.36843e-01 1.63554e+02 243.600 -3.99795e+00 -8.05389e+00 0.00000e+00 0.00000e+00 3.96118e+02 243.600 2.32564e+02 243.600 0.9426 
1 1 1 3   15  12 o 6  4.85584e+00 1.16963e+00 1.41832e+02 46.435  2.04908e+00  2.15439e+00  0.00000e+00 0.00000e+00 5.20915e+00 46.435  1.36623e+02 226.435 0.8080 
1 1 1 3   15  13 o 1  1.18248e+01 9.43838e-01 1.65207e+02 274.732 1.11579e+00  -1.34800e+01 0.00000e+00 0.00000e+00 2.60973e+02 274.732 9.57660e+01 274.732 0.9623 
1 1 1 3   15  14 o 19 1.59605e+01 8.69040e-01 2.71255e+02 131.216 -2.43031e+01 2.77452e+01  0.00000e+00 0.00000e+00 3.17944e+02 131.216 4.66890e+01 131.216 0.9863 
1 1 1 3   15  15 o 18 4.02737e+00 1.24545e+00 1.25550e+02 26.577  4.28042e+00  2.14133e+00  0.00000e+00 0.00000e+00 8.22445e+00 26.577  1.17325e+02 206.577 0.8882 
1 1 1 3   15  16 o 19 6.18953e+00 1.50013e+00 1.33834e+02 307.247 4.96118e+00  -6.52507e+00 0.00000e+00 0.00000e+00 8.28485e+01 307.247 5.09854e+01 127.247 0.9369 
1 1 1 3   15  17 o 11 7.22709e+00 1.68116e+00 5.97694e+01 200.626 -4.01880e+00 -1.51263e+00 0.00000e+00 0.00000e+00 1.76038e+02 200.626 1.16269e+02 200.626 0.8739 
1 1 1 3   15  18 o 5  1.04762e+01 1.97970e+00 2.09804e+02 22.176  1.78261e+01  7.26602e+00  0.00000e+00 0.00000e+00 1.70660e+02 22.176  3.91436e+01 202.176 0.9737 
1 1 1 3   16  0  o 15 3.49027e+01 6.10351e-01 5.27603e+02 97.620  -1.13960e+00 8.51879e+00  0.00000e+00 0.00000e+00 7.05406e+02 97.620  1.77803e+02 97.620  0.9399 
1 1 1 3   16  1  o 19 3.59262e+01 7.54437e-01 5.80293e+02 348.677 8.97389e+00  -1.79695e+00 0.00000e+00 0.00000e+00 6.94105e+02 348.677 1.13812e+02 348.677 0.9437 
1 1 1 3   16  2  o 15 1.83623e+01 4.84699e-01 1.94555e+02 92.538  -1.03389e-01 2.33287e+00  0.00000e+00 0.00000e+00 3.20248e+02 92.538  1.25693e+02 92.538  0.7458 
1 1 1 3   16  3  o 19 3.70118e+01 6.52631e-01 7.10051e+02 313.117 1.03769e+01  -1.10822e+01 0.00000e+00 0.00000e+00 6.34586e+02 313.117 7.54649e+01 133.117 0.9665 
1 1 1 3   16  4  f 0  7.81813e+00 3.34194e-01 1.23544e+02 191.335 -7.28886e-01 -1.46107e-01 0.00000e+00 0.00000e+00 2.12307e+01 11.335  1.44775e+02 11.335  0.3482 
1 1 1 3   16  5  o 5  1.44546e+01 4.88321e-01 2.72852e+01 358.665 3.36191e-01  -7.83462e-03 0.00000e+00 0.00000e+00 6.27835e+01 358.665 3.54983e+01 358.665 0.1658 
1 1 1 3   16  6  f 0  1.99488e+01 4.47643e-01 2.82040e+02 88.968  1.07018e-01  5.93829e+00  0.00000e+00 0.00000e+00 4.01081e+02 88.968  1.19041e+02 88.968  0.9114 
1 1 1 3   16  7  o 9  2.24361e+01 4.95210e-01 3.18740e+02 183.188 -8.43964e+00 -4.70140e-01 0.00000e+00 0.00000e+00 4.72464e+02 183.188 1.53723e+02 183.188 0.9388 
1 1 1 3   16  8  o 1  3.48457e+01 6.69548e-01 6.26425e+02 253.711 -9.66230e+00 -3.30667e+01 0.00000e+00 0.00000e+00 6.62876e+02 253.711 3.64517e+01 253.711 0.9854 
1 1 1 3   16  9  f 0  3.17327e+01 6.52333e-01 3.81411e+02 114.764 -1.05488e+01 2.28670e+01  0.00000e+00 0.00000e+00 7.85764e+02 114.764 4.04353e+02 114.764 0.9799 
1 1 1 3   16  10 o 1  2.86415e+01 6.41825e-01 5.59608e+02 272.424 1.84951e+00  -4.36833e+01 0.00000e+00 0.00000e+00 5.02579e+02 272.424 5.70291e+01 92.424  0.9885 
1 1 1 3   16  11 o 2  3.41553e+01 7.52299e-01 4.93459e+02 128.904 -3.70113e+01 4.58622e+01  0.00000e+00 0.00000e+00 7.76371e+02 128.904 2.82913e+02 128.904 0.9915 
1 1 1 3   16  12 o 19 1.76928e+01 7.17776e-01 2.53808e+02 193.152 -2.17859e+01 -5.09043e+00 0.00000e+00 0.00000e+00 3.94251e+02 193.152 1.40442e+02 193.152 0.9774 
1 1 1 3   16  13 o 7  4.46268e+00 1.21984e+00 1.74463e+02 12.161  4.88522e+00  1.05273e+00  0.00000e+00 0.00000e+00 2.51578e+01 192.161 1.99621e+02 192.161 0.8933 
1 1 1 3   16  14 o 13 1.76512e+01 8.46307e-01 2.90130e+02 158.033 -4.29183e+01 1.73113e+01  0.00000e+00 0.00000e+00 3.63294e+02 158.033 7.31640e+01 158.033 0.9891 
1 1 1 3   16  15 o 19 8.26044e+00 1.28786e+00 1.30303e+02 31.781  8.87406e+00  5.49806e+00  0.00000e+00 0.00000e+00 1.63420e+02 31.781  3.31177e+01 31.781  0.9508 
1 1 1 3   16  16 f 0  1.07566e+01 1.34693e+00 7.33503e+01 258.451 -1.69942e+00 -8.31645e+00 0.00000e+00 0.00000e+00 3.04102e+02 258.451 2.30752e+02 258.451 0.9391 
1 1 1 3   16  17 f 0  5.11985e+00 1.56013e+00 1.15462e+02 285.423 1.68482e+00  -6.10694e+00 0.00000e+00 0.00000e+00 5.98639e+01 285.423 5.55976e+01 105.423 0.9173 
1 1 1 3   16  18 f 0  7.40942e+00 1.89661e+00 6.28655e+01 91.925  -1.44598e-01 4.30218e+00  0.00000e+00 0.00000e+00 1.78747e+02 91.925  1.15881e+02 91.925  0.8743 
1 1 1 3   17  0  o 1  4.76330e+01 8.08519e-01 8.81630e+02 336.101 1.70990e+01  -7.57696e+00 0.00000e+00 0.00000e+00 8.60110e+02 336.101 2.15209e+01 156.101 0.9729 
1 1 1 3   17  1  o 7  3.96910e+01 8.29205e-01 8.52000e+02 348.235 1.66487e+01  -3.46762e+00 0.00000e+00 0.00000e+00 5.95363e+02 348.235 2.56637e+02 168.235 0.9701 
1 1 1 3   17  2  o 4  2.53342e+01 4.73642e-01 3.98723e+02 320.386 4.92654e+00  -4.07762e+00 0.00000e+00 0.00000e+00 4.75573e+02 320.386 7.68496e+01 320.386 0.9181 
1 1 1 3   17  3  o 10 1.57934e+01 4.11966e-01 4.16188e+02 285.295 9.81483e-01  -3.58886e+00 0.00000e+00 0.00000e+00 8.95075e+01 285.295 3.26681e+02 105.295 0.8519 
1 1 1 3   17  4  o 1  1.82983e+01 4.00855e-01 3.10762e+02 65.015  1.81877e+00  3.90312e+00  0.00000e+00 0.00000e+00 2.90552e+02 65.015  2.02098e+01 245.015 0.8743 
1 1 1 3   17  5  o 7  1.58680e+01 3.95064e-01 2.95405e+02 131.987 -2.65110e+00 2.94571e+00  0.00000e+00 0.00000e+00 2.18657e+02 131.987 7.67482e+01 311.987 0.8621 
1 1 1 3   17  6  o 18 2.59545e+01 5.21868e-01 3.83251e+02 119.403 -5.10606e+00 9.06056e+00  0.00000e+00 0.00000e+00 5.43742e+02 119.403 1.60490e+02 119.403 0.9506 
1 1 1 3   17  7  o 16 1.82825e+01 4.53684e-01 3.23222e+02 140.053 -5.58291e+00 4.67587e+00  0.00000e+00 0.00000e+00 3.14416e+02 140.053 8.80583e+00 320.053 0.9286 
1 1 1 3   17  8  o 7  1.51565e+01 4.81247e-01 3.86787e+02 134.069 -6.33329e+00 6.54262e+00  0.00000e+00 0.00000e+00 1.50084e+02 134.069 2.36703e+02 314.069 0.9434 
1 1 1 3   17  9  o 9  3.50709e+01 6.91726e-01 3.08417e+02 110.798 -7.95845e+00 2.09534e+01  0.00000e+00 0.00000e+00 9.78184e+02 110.798 6.69767e+02 110.798 0.9774 
1 1 1 3   17  10 o 19 1.35368e+01 7.22515e-01 1.57935e+02 303.695 3.21295e+00  -4.81850e+00 0.00000e+00 0.00000e+00 3.03689e+02 303.695 1.45755e+02 303.695 0.9090 
1 1 1 3   17  11 o 12 8.55682e+00 1.17347e+00 1.17836e+02 74.111  9.14856e-01  3.21406e+00  0.00000e+00 0.00000e+00 1.49233e+02 74.111  3.13969e+01 74.111  0.8324 
1 1 1 3   17  12 o 18 2.43713e+01 7.08747e-01 3.21153e+02 354.866 3.88086e+01  -3.48680e+00 0.00000e+00 0.00000e+00 5.80344e+02 354.866 2.59191e+02 354.866 0.9871 
1 1 1 3   17  13 o 8  2.14150e+01 7.63402e-01 4.14231e+02 249.132 -2.29049e+01 -6.00839e+01 0.00000e+00 0.00000e+00 3.81500e+02 249.132 3.27316e+01 69.132  0.9922 
1 1 1 3   17  14 o 15 1.28909e+01 1.23214e+00 1.96806e+02 54.207  1.17959e+01  1.63596e+01  0.00000e+00 0.00000e+00 2.73505e+02 54.207  7.66987e+01 54.207  0.9749 
1 1 1 3   17  15 o 17 8.64564e+00 1.39661e+00 1.24521e+02 239.870 -4.97482e+00 -8.57173e+00 0.00000e+00 0.00000e+00 1.82011e+02 239.870 5.74903e+01 239.870 0.9481 
1 1 1 3   17  16 o 7  8.46297e+00 1.50888e+00 9.27359e+01 137.698 -5.62253e+00 5.11652e+00  0.00000e+00 0.00000e+00 2.01878e+02 137.698 1.09142e+02 137.698 0.9317 
1 1 1 3   17  17 o 17 4.98705e+00 1.50463e+00 1.55447e+02 263.534 -9.68003e-01 -8.54151e+00 0.00000e+00 0.00000e+00 1.95354e+01 263.534 1.35912e+02 83.534  0.9399 
1 1 1 3   17  18 o 17 1.04810e+01 2.08106e+00 1.81938e+02 29.446  1.30830e+01  7.38578e+00  0.00000e+00 0.00000e+00 1.95715e+02 29.446  1.37762e+01 29.446  0.9661 
1 1 1 3   18  0  o 14 3.40777e+01 5.97010e-01 5.38885e+02 184.934 -9.33761e+00 -8.06057e-01 0.00000e+00 0.00000e+00 6.71471e+02 184.934 1.32586e+02 184.934 0.9450 
1 1 1 3   18  1  o 2  7.08536e+00 4.82247e-01 1.85460e+02 172.541 -6.32474e-01 8.28109e-02  0.00000e+00 0.00000e+00 1.04569e+02 352.541 2.90029e+02 352.541 0.3037 
1 1 1 3   18  2  o 11 4.24816e+01 7.33126e-01 8.67865e+02 247.407 -1.15611e+01 -2.77827e+01 0.00000e+00 0.00000e+00 7.02154e+02 247.407 1.65711e+02 67.407  0.9832 
1 1 1 3   18  3  o 19 1.70336e+01 4.55147e-01 2.12339e+02 101.687 -5.98786e-01 2.89471e+00  0.00000e+00 0.00000e+00 3.04121e+02 101.687 9.17820e+01 101.687 0.8067 
1 1 1 3   18  4  o 3  2.14351e+01 4.37819e-01 3.63105e+02 311.095 3.81262e+00  -4.37118e+00 0.00000e+00 0.00000e+00 3.69289e+02 311.095 6.18323e+00 311.095 0.9091 
1 1 1 3   18  5  o 4  2.55219e+01 5.05928e-01 4.28620e+02 197.954 -9.24123e+00 -2.99441e+00 0.00000e+00 0.00000e+00 4.79625e+02 197.954 5.10045e+01 197.954 0.9470 
1 1 1 3   18  6  o 6  1.91705e+01 4.44070e-01 3.70752e+02 3.852   7.37797e+00  4.96824e-01  0.00000e+00 0.00000e+00 2.98825e+02 3.852   7.19276e+01 183.852 0.9297 
1 1 1 3   18  7  o 9  2.61782e+01 6.94889e-01 4.33608e+02 209.458 -1.20546e+01 -6.80841e+00 0.00000e+00 0.00000e+00 5.13406e+02 209.458 7.97984e+01 209.458 0.9632 
1 1 1 3   18  8  o 14 3.76965e+01 7.08956e-01 8.65791e+02 247.783 -1.89590e+01 -4.64185e+01 0.00000e+00 0.00000e+00 5.35371e+02 247.783 3.30420e+02 67.783  0.9900 
1 1 1 3   18  9  o 16 1.57079e+01 5.39190e-01 3.40322e+02 42.163  8.63244e+00  7.81739e+00  0.00000e+00 0.00000e+00 2.23302e+02 42.163  1.17020e+02 222.163 0.9561 
1 1 1 3   18  10 o 5  1.89286e+01 6.33630e-01 2.25304e+02 259.804 -2.10699e+00 -1.17147e+01 0.00000e+00 0.00000e+00 4.54262e+02 259.804 2.28958e+02 259.804 0.9570 
1 1 1 3   18  11 o 8  3.49571e+01 8.69808e-01 5.53626e+02 49.177  4.24874e+01  4.91825e+01  0.00000e+00 0.00000e+00 7.46939e+02 49.177  1.93313e+02 49.177  0.9923 
1 1 1 3   18  12 o 4  5.06373e+00 1.22277e+00 6.78172e+01 275.246 1.52686e-01  -1.66306e+00 0.00000e+00 0.00000e+00 5.27592e+01 275.246 1.50580e+01 95.246  0.6354 
1 1 1 3   18  13 o 3  7.70734e+00 1.10563e+00 1.50066e+02 148.575 -6.57562e+00 4.01770e+00  0.00000e+00 0.00000e+00 1.19124e+02 148.575 3.09423e+01 328.575 0.9327 
1 1 1 3   18  14 o 19 7.51647e+00 1.25950e+00 1.44826e+02 288.890 2.77073e+00  -8.09736e+00 0.00000e+00 0.00000e+00 1.19471e+02 288.890 2.53547e+01 108.890 0.9396 
1 1 1 3   18  15 o 9  1.50526e+01 1.16884e+00 3.05430e+02 31.579  4.00625e+01  2.46265e+01  0.00000e+00 0.00000e+00 2.51418e+02 31.579  5.40114e+01 211.579 0.9893 
1 1 1 3   18  16 f 0  7.18838e+00 1.57564e+00 1.76848e+02 291.127 4.27690e+00  -1.10685e+01 0.00000e+00 0.00000e+00 8.01480e+01 291.127 9.67002e+01 111.127 0.9569 
1 1 1 3   18  17 o 5  8.87367e+00 1.75361e+00 1.66298e+02 206.023 -1.21454e+01 -5.92983e+00 0.00000e+00 0.00000e+00 1.52450e+02 206.023 1.38477e+01 26.023  0.9623 
1 1 1 3   18  18 o 7  1.15055e+01 1.94969e+00 1.55335e+02 16.790  1.46106e+01  4.40849e+00  0.00000e+00 0.00000e+00 2.59444e+02 16.790  1.04109e+02 16.790  0.9667 
1 1 1 3   19  0  o 16 1.35429e+01 3.47611e-01 3.99723e+02 48.904  1.74396e+00  1.99942e+00  0.00000e+00 0.00000e+00 2.39395e+00 228.904 4.02117e+02 228.904 0.7807 
1 1 1 3   19  1  o 11 1.93226e+01 4.13807e-01 4.40784e+02 322.190 4.41609e+00  -3.42673e+00 0.00000e+00 0.00000e+00 2.16795e+02 322.190 2.23989e+02 142.190 0.9055 
1 1 1 3   19  2  o 10 2.55998e+01 4.80207e-01 3.85690e+02 112.298 -2.97717e+00 7.25966e+00  0.00000e+00 0.00000e+00 5.12906e+02 112.298 1.27216e+02 112.298 0.9339 
1 1 1 3   19  3  o 1  7.26135e+00 4.00602e-01 5.00473e+02 59.147  1.48945e+00  2.49332e+00  0.00000e+00 0.00000e+00 2.81417e+02 239.147 7.81890e+02 239.147 0.8027 
1 1 1 3   19  4  o 2  2.86516e+01 5.37712e-01 5.61124e+02 228.509 -9.20157e+00 -1.04039e+01 0.00000e+00 0.00000e+00 4.76111e+02 228.509 8.50128e+01 48.509  0.9633 
1 1 1 3   19  5  o 10 7.60589e+00 4.01622e-01 6.30347e+01 186.308 -4.19634e-01 -4.63889e-02 0.00000e+00 0.00000e+00 4.01078e+00 6.308   6.70455e+01 6.308   0.2065 
1 1 1 3   19  6  o 4  2.87022e+01 5.59824e-01 4.74570e+02 197.078 -1.56872e+01 -4.81934e+00 0.00000e+00 0.00000e+00 5.70300e+02 197.078 9.57300e+01 197.078 0.9690 
1 1 1 3   19  7  o 8  5.01606e+01 8.85810e-01 1.07211e+03 332.969 6.17859e+01  -3.15233e+01 0.00000e+00 0.00000e+00 7.98126e+02 332.969 2.73984e+02 152.969 0.9928 
1 1 1 3   19  8  o 16 2.56611e+01 5.56371e-01 6.34003e+02 149.177 -2.15155e+01 1.28374e+01  0.00000e+00 0.00000e+00 3.09989e+02 149.177 3.24013e+02 329.177 0.9798 
1 1 1 3   19  9  o 19 2.99435e+01 7.53154e-01 3.93932e+02 327.381 2.13533e+01  -1.36662e+01 0.00000e+00 0.00000e+00 7.07426e+02 327.381 3.13493e+02 327.381 0.9801 
1 1 1 3   19  10 o 1  1.30946e+01 6.80592e-01 1.23238e+02 320.653 3.46559e+00  -2.84129e+00 0.00000e+00 0.00000e+00 3.08914e+02 320.653 1.85676e+02 320.653 0.8798 
1 1 1 3   19  11 o 9  5.48985e+00 1.17480e+00 2.19319e+02 59.353  1.98021e+00  3.34208e+00  0.00000e+00 0.00000e+00 4.25266e+01 239.353 2.61846e+02 239.353 0.8589 
1 1 1 3   19  12 o 13 1.30582e+01 7.89937e-01 3.25068e+02 192.741 -2.18321e+01 -4.93638e+00 0.00000e+00 0.00000e+00 1.53169e+02 192.741 1.71899e+02 12.741  0.9774 
1 1 1 3   19  13 o 2  5.67686e+00 1.25060e+00 1.11717e+02 208.562 -3.50285e+00 -1.90680e+00 0.00000e+00 0.00000e+00 7.17518e+01 208.562 3.99654e+01 28.562  0.8631 
1 1 1 3   19  14 f 0  6.23189e+00 1.36217e+00 1.71556e+02 288.577 2.60194e+00  -7.74156e+00 0.00000e+00 0.00000e+00 4.68601e+01 288.577 1.24696e+02 108.577 0.9366 
1 1 1 3   19  15 o 10 1.02612e+01 1.29094e+00 2.39955e+02 144.393 -2.00454e+01 1.43548e+01  0.00000e+00 0.00000e+00 1.35862e+02 144.393 1.04094e+02 324.393 0.9795 
1 1 1 3   19  16 o 10 8.27888e+00 1.59932e+00 1.03064e+02 152.371 -6.88935e+00 3.60611e+00  0.00000e+00 0.00000e+00 1.85605e+02 152.371 8.25407e+01 152.371 0.9333 
1 1 1 3   19  17 o 8  5.44214e+00 1.57640e+00 1.21286e+02 356.066 6.70409e+00  -4.60976e-01 0.00000e+00 0.00000e+00 6.60637e+01 356.066 5.52219e+01 176.066 0.9223 
1 1 1 3   19  18 o 7  1.14623e+01 1.92915e+00 2.25212e+02 204.040 -2.03796e+01 -9.09048e+00 0.00000e+00 0.00000e+00 1.92551e+02 204.040 3.26609e+01 24.040  0.9773 
1 1 1 3   20  0  o 5  2.53791e+01 4.68608e-01 4.91896e+02 156.448 -7.55028e+00 3.29108e+00  0.00000e+00 0.00000e+00 4.01903e+02 156.448 8.99930e+01 336.448 0.9372 
1 1 1 3   20  1  o 17 1.96282e+01 3.94471e-01 4.35861e+02 288.980 1.75837e+00  -5.11250e+00 0.00000e+00 0.00000e+00 2.29542e+02 288.980 2.06319e+02 108.980 0.9020 
1 1 1 3   20  2  o 10 1.35772e+01 3.32852e-01 2.43828e+02 310.566 1.66172e+00  -1.94110e+00 0.00000e+00 0.00000e+00 1.49532e+02 310.566 9.42963e+01 130.566 0.7709 
1 1 1 3   20  3  o 4  4.20896e+00 4.69607e-01 6.67868e+01 22.137  2.03214e-01  8.26701e-02  0.00000e+00 0.00000e+00 4.95388e+01 202.137 1.16326e+02 202.137 0.1090 
1 1 1 3   20  4  o 16 9.84550e+00 3.65061e-01 2.29473e+02 241.959 -9.05635e-01 -1.70028e+00 0.00000e+00 0.00000e+00 2.40818e+01 241.959 2.05391e+02 61.959  0.6853 
1 1 1 3   20  5  o 18 2.46196e+01 4.96497e-01 4.17435e+02 262.962 -1.20639e+00 -9.77171e+00 0.00000e+00 0.00000e+00 4.59285e+02 262.962 4.18499e+01 262.962 0.9478 
1 1 1 3   20  6  o 5  3.16177e+01 5.99717e-01 8.01642e+02 346.002 2.94045e+01  -7.33041e+00 0.00000e+00 0.00000e+00 3.66315e+02 346.002 4.35327e+02 166.002 0.9834 
1 1 1 3   20  7  o 14 7.29179e+00 6.76048e-01 1.62688e+02 278.667 2.31506e-01  -1.51879e+00 0.00000e+00 0.00000e+00 2.98148e+00 278.667 1.59707e+02 98.667  0.6050 
1 1 1 3   20  8  o 2  3.51758e+01 6.78425e-01 7.64550e+02 51.879  3.12039e+01  3.97661e+01  0.00000e+00 0.00000e+00 5.42891e+02 51.879  2.21659e+02 231.879 0.9901 
1 1 1 3   20  9  o 19 5.16502e+01 9.33571e-01 7.67443e+02 250.002 -2.87155e+01 -7.89018e+01 0.00000e+00 0.00000e+00 1.15926e+03 250.002 3.91816e+02 250.002 0.9940 
1 1 1 3   20  10 o 17 3.46401e+01 7.25350e-01 4.58255e+02 127.036 -2.85608e+01 3.78514e+01  0.00000e+00 0.00000e+00 8.27312e+02 127.036 3.69057e+02 127.036 0.9894 
1 1 1 3   20  11 o 11 1.25076e+01 7.64352e-01 2.32971e+02 270.444 8.67817e-02  -1.11958e+01 0.00000e+00 0.00000e+00 2.14485e+02 270.444 1.84861e+01 90.444  0.9542 
1 1 1 3   20  12 o 11 1.93349e+01 7.25872e-01 3.86257e+02 349.737 3.90520e+01  -7.07115e+00 0.00000e+00 0.00000e+00 3.29006e+02 349.737 5.72517e+01 169.737 0.9873 
1 1 1 3   20  13 o 17 9.25604e+00 1.08873e+00 1.26054e+02 14.786  7.41303e+00  1.95663e+00  0.00000e+00 0.00000e+00 1.97069e+02 14.786  7.10153e+01 14.786  0.9323 
1 1 1 3   20  14 o 8  8.83389e+00 1.17049e+00 1.03084e+02 288.797 2.40669e+00  -7.07070e+00 0.00000e+00 0.00000e+00 2.04465e+02 288.797 1.01381e+02 288.797 0.9304 
1 1 1 3   20  15 o 7  1.37822e+01 1.05293e+00 1.79917e+02 248.270 -1.02561e+01 -2.57328e+01 0.00000e+00 0.00000e+00 3.26001e+02 248.270 1.46085e+02 248.270 0.9818 
1 1 1 3   20  16 o 3  5.46788e+00 1.50771e+00 9.38553e+01 128.288 -3.04381e+00 3.85573e+00  0.00000e+00 0.00000e+00 8.82142e+01 128.288 5.64111e+00 308.288 0.8913 
1 1 1 3   20  17 o 5  7.12149e+00 1.70658e+00 1.20994e+02 211.151 -7.27982e+00 -4.40027e+00 0.00000e+00 0.00000e+00 1.28667e+02 211.151 7.67226e+00 211.151 0.9392 
1 1 1 3   20  18 o 13 7.22055e+00 1.99170e+00 1.17551e+02 283.286 1.66897e+00  -7.06771e+00 0.00000e+00 0.00000e+00 1.32411e+02 283.286 1.48602e+01 283.286 0.9283 
1 1 1 3   21  0  o 4  2.20765e+01 4.22637e-01 6.02293e+02 343.363 8.07728e+00  -2.41362e+00 0.00000e+00 0.00000e+00 1.76396e+02 343.363 4.25897e+02 163.363 0.9387 
1 1 1 3   21  1  o 9  2.89326e+01 5.26061e-01 4.99914e+02 271.432 2.94035e-01  -1.17584e+01 0.00000e+00 0.00000e+00 5.40084e+02 271.432 4.01698e+01 271.432 0.9565 
1 1 1 3   21  2  o 11 8.71377e+00 3.67725e-01 2.42513e+02 149.203 -1.04192e+00 6.21030e-01  0.00000e+00 0.00000e+00 7.32798e+01 329.203 3.15793e+02 329.203 0.5168 
1 1 1 3   21  3  o 4  2.12123e+01 5.20831e-01 3.86234e+02 149.765 -5.32258e+00 3.10211e+00  0.00000e+00 0.00000e+00 3.42999e+02 149.765 4.32355e+01 329.765 0.9148 
1 1 1 3   21  4  o 9  1.75681e+01 4.51639e-01 3.26768e+02 272.799 2.18118e-01  -4.46102e+00 0.00000e+00 0.00000e+00 2.53725e+02 272.799 7.30428e+01 92.799  0.8793 
1 1 1 3   21  5  o 16 2.02235e+01 4.44284e-01 2.62353e+02 250.015 -1.72145e+00 -4.73354e+00 0.00000e+00 0.00000e+00 4.17099e+02 250.015 1.54746e+02 250.015 0.8942 
1 1 1 3   21  6  o 1  1.81071e+01 4.99763e-01 4.95651e+02 235.723 -5.61635e+00 -8.24037e+00 0.00000e+00 0.00000e+00 1.49445e+02 235.723 3.46206e+02 55.723  0.9485 
1 1 1 3   21  7  o 14 2.42284e+01 5.19413e-01 3.96425e+02 60.462  6.07505e+00  1.07210e+01  0.00000e+00 0.00000e+00 4.75676e+02 60.462  7.92506e+01 60.462  0.9585 
1 1 1 3   21  8  o 11 1.32500e+01 4.90404e-01 2.70847e+02 234.386 -3.94418e+00 -5.50628e+00 0.00000e+00 0.00000e+00 1.88210e+02 234.386 8.26368e+01 54.386  0.9229 
1 1 1 3   21  9  o 16 1.92880e+01 5.89232e-01 3.88918e+02 48.808  1.09424e+01  1.25031e+01  0.00000e+00 0.00000e+00 3.12733e+02 48.808  7.61847e+01 228.808 0.9694 
1 1 1 3   21  10 o 7  2.53250e+01 6.37989e-01 4.46027e+02 228.032 -2.26587e+01 -2.51934e+01 0.00000e+00 0.00000e+00 4.89732e+02 228.032 4.37054e+01 228.032 0.9851 
1 1 1 3   21  11 o 2  1.17964e+01 1.25778e+00 1.34639e+02 170.293 -5.60175e+00 9.58252e-01  0.00000e+00 0.00000e+00 2.66520e+02 170.293 1.31881e+02 170.293 0.9071 
1 1 1 3   21  12 o 10 1.74032e+01 7.45533e-01 3.45122e+02 58.075  1.84941e+01  2.96836e+01  0.00000e+00 0.00000e+00 2.97520e+02 58.075  4.76023e+01 238.075 0.9856 
1 1 1 3   21  13 o 9  1.76465e+01 9.83057e-01 2.46851e+02 222.087 -2.29684e+01 -2.07443e+01 0.00000e+00 0.00000e+00 4.03109e+02 222.087 1.56259e+02 222.087 0.9837 
1 1 1 3   21  14 o 10 1.09499e+01 1.07757e+00 1.59067e+02 75.113  3.79668e+00  1.42825e+01  0.00000e+00 0.00000e+00 2.36521e+02 75.113  7.74541e+01 75.113  0.9656 
1 1 1 3   21  15 o 3  1.44553e+01 1.07944e+00 3.03586e+02 125.279 -2.79399e+01 3.94922e+01  0.00000e+00 0.00000e+00 2.31242e+02 125.279 7.23437e+01 305.279 0.9896 
1 1 1 3   21  16 o 5  4.26687e+00 1.33988e+00 8.88618e+01 207.041 -3.89556e+00 -1.98840e+00 0.00000e+00 0.00000e+00 5.08476e+01 207.041 3.80141e+01 27.041  0.8765 
1 1 1 3   21  17 o 4  1.19219e+01 1.59005e+00 2.14305e+02 213.016 -2.27481e+01 -1.47819e+01 0.00000e+00 0.00000e+00 2.22378e+02 213.016 8.07229e+00 213.016 0.9814 
1 1 1 3   21  18 o 18 5.76697e+00 1.79293e+00 6.49870e+01 25.666  3.28238e+00  1.57733e+00  0.00000e+00 0.00000e+00 1.17403e+02 25.666  5.24163e+01 25.666  0.8482 
1 1 1 3   22  0  o 10 2.21864e+01 4.25147e-01 5.62993e+02 354.044 1.01330e+01  -1.05715e+00 0.00000e+00 0.00000e+00 2.28620e+02 354.044 3.34373e+02 174.044 0.9496 
1 1 1 3   22  1  o 7  2.00083e+01 4.03556e-01 6.64510e+01 269.111 -1.62219e-02 -1.04490e+00 0.00000e+00 0.00000e+00 2.81004e+02 269.111 2.14553e+02 269.111 0.4621 
1 1 1 3   22  2  o 3  1.35462e+01 3.82141e-01 3.35037e+02 100.583 -4.64610e-01 2.48666e+00  0.00000e+00 0.00000e+00 5.60143e+01 100.583 2.79022e+02 280.583 0.7682 
1 1 1 3   22  3  o 9  1.77917e+01 4.18417e-01 3.98439e+02 39.015  4.05758e+00  3.28755e+00  0.00000e+00 0.00000e+00 2.02139e+02 39.015  1.96299e+02 219.015 0.8983 
1 1 1 3   22  4  f 0  5.07215e+00 4.19270e-01 1.86609e+02 327.550 6.12374e-01  -3.89374e-01 0.00000e+00 0.00000e+00 1.21643e+02 147.550 3.08253e+02 147.550 0.3409 
1 1 1 3   22  5  o 11 5.67883e+00 4.50769e-01 2.34786e+02 222.618 -8.90717e-01 -8.19567e-01 0.00000e+00 0.00000e+00 1.24701e+02 42.618  3.59487e+02 42.618  0.5160 
1 1 1 3   22  6  o 7  3.27508e+01 6.17841e-01 6.31193e+02 162.423 -2.16982e+01 6.87347e+00  0.00000e+00 0.00000e+00 5.71617e+02 162.423 5.95765e+01 342.423 0.9778 
1 1 1 3   22  7  o 8  2.52603e+01 6.47618e-01 4.78640e+02 353.741 1.52950e+01  -1.67756e+00 0.00000e+00 0.00000e+00 4.38532e+02 353.741 4.01079e+01 173.741 0.9669 
1 1 1 3   22  8  f 0  2.93247e+01 6.73427e-01 5.00815e+02 317.296 1.88629e+01  -1.74085e+01 0.00000e+00 0.00000e+00 5.78306e+02 317.296 7.74910e+01 317.296 0.9803 
1 1 1 3   22  9  o 9  4.59125e+01 8.48895e-01 4.58312e+02 160.255 -4.30978e+01 1.54697e+01  0.00000e+00 0.00000e+00 1.24553e+03 160.255 7.87219e+02 160.255 0.9890 
1 1 1 3   22  10 o 19 1.47547e+01 6.61155e-01 3.40785e+02 298.074 6.75335e+00  -1.26618e+01 0.00000e+00 0.00000e+00 1.92952e+02 298.074 1.47833e+02 118.074 0.9645 
1 1 1 3   22  11 o 12 1.18778e+01 7.99403e-01 2.19210e+02 157.032 -1.00518e+01 4.26018e+00  0.00000e+00 0.00000e+00 2.05130e+02 157.032 1.40803e+01 337.032 0.9530 
1 1 1 3   22  12 f 0  1.23695e+01 8.62545e-01 1.06921e+02 173.497 -7.48313e+00 8.52941e-01  0.00000e+00 0.00000e+00 3.24530e+02 173.497 2.17609e+02 173.497 0.9310 
1 1 1 3   22  13 f 0  9.97062e+00 1.02207e+00 1.54893e+02 333.381 9.69447e+00  -4.85868e+00 0.00000e+00 0.00000e+00 2.00755e+02 333.381 4.58627e+01 333.381 0.9527 
1 1 1 3   22  14 f 0  6.35942e+00 1.22280e+00 1.23435e+02 191.816 -6.18313e+00 -1.29350e+00 0.00000e+00 0.00000e+00 9.47510e+01 191.816 2.86841e+01 11.816  0.9170 
1 1 1 3   22  15 o 9  4.85684e+00 1.30343e+00 7.55849e+01 165.906 -3.53380e+00 8.87264e-01  0.00000e+00 0.00000e+00 7.84367e+01 165.906 2.85174e+00 165.906 0.8483 
1 1 1 3   22  16 o 13 4.08579e+00 1.28999e+00 1.22645e+02 312.325 4.00350e+00  -4.39596e+00 0.00000e+00 0.00000e+00 1.64709e+01 312.325 1.06174e+02 132.325 0.9115 
1 1 1 3   22  17 o 15 7.45151e+00 1.76906e+00 1.15826e+02 155.106 -7.41444e+00 3.44078e+00  0.00000e+00 0.00000e+00 1.44660e+02 155.106 2.88338e+01 155.106 0.9367 
1 1 1 3   22  18 o 19 5.93063e+00 1.82498e+00 1.44295e+02 313.590 5.67345e+00  -5.95979e+00 0.00000e+00 0.00000e+00 6.29254e+01 313.590 8.13692e+01 133.590 0.9371 
1 1 1 3   23  0  o 17 2.90060e+01 7.47656e-01 1.41644e+02 208.570 -2.81894e+00 -1.53504e+00 0.00000e+00 0.00000e+00 7.56781e+02 208.570 6.15137e+02 208.570 0.8244 
1 1 1 3   23  1  o 16 2.93465e+01 5.35085e-01 6.28881e+02 40.542  8.15417e+00  6.97456e+00  0.00000e+00 0.00000e+00 4.21123e+02 40.542  2.07757e+02 220.542 0.9522 
1 1 1 3   23  2  o 6  1.71781e+01 3.77241e-01 5.00110e+02 150.332 -5.98010e+00 3.40658e+00  0.00000e+00 0.00000e+00 9.64579e+01 150.332 4.03653e+02 330.332 0.9242 
1 1 1 3   23  3  o 7  6.47433e+00 3.47440e-01 2.09773e+02 298.970 4.97242e-01  -8.98163e-01 0.00000e+00 0.00000e+00 9.89012e+01 118.970 3.08674e+02 118.970 0.4557 
1 1 1 3   23  4  o 9  3.27713e+01 6.04578e-01 8.54180e+02 35.032  1.96555e+01  1.37795e+01  0.00000e+00 0.00000e+00 3.51186e+02 35.032  5.02994e+02 215.032 0.9789 
1 1 1 3   23  5  o 7  1.11492e+01 3.85089e-01 2.82987e+02 243.431 -1.26974e+00 -2.53908e+00 0.00000e+00 0.00000e+00 5.09647e+01 243.431 2.32022e+02 63.431  0.7973 
1 1 1 3   23  6  o 14 2.23964e+01 4.85254e-01 4.42258e+02 113.470 -5.19828e+00 1.19722e+01  0.00000e+00 0.00000e+00 3.66020e+02 113.470 7.62378e+01 293.470 0.9609 
1 1 1 3   23  7  o 5  2.17816e+01 5.01413e-01 3.99330e+02 297.057 5.24624e+00  -1.02711e+01 0.00000e+00 0.00000e+00 3.82223e+02 297.057 1.71070e+01 117.057 0.9556 
1 1 1 3   23  8  o 13 1.57815e+01 5.93599e-01 2.98700e+02 257.628 -1.76460e+00 -8.04452e+00 0.00000e+00 0.00000e+00 2.56442e+02 257.628 4.22581e+01 77.628  0.9372 
1 1 1 3   23  9  o 13 3.56212e+01 7.08336e-01 7.05130e+02 258.115 -1.25336e+01 -5.95539e+01 0.00000e+00 0.00000e+00 6.20364e+02 258.115 8.47659e+01 78.115  0.9917 
1 1 1 3   23  10 o 15 1.89894e+01 7.18069e-01 2.96231e+02 277.303 2.02677e+00  -1.58149e+01 0.00000e+00 0.00000e+00 3.93225e+02 277.303 9.69939e+01 277.303 0.9681 
1 1 1 3   23  11 o 5  3.48039e+01 7.64739e-01 5.87657e+02 123.648 -4.76066e+01 7.15233e+01  0.00000e+00 0.00000e+00 7.09304e+02 123.648 1.21647e+02 123.648 0.9942 
1 1 1 3   23  12 o 19 2.47327e+01 7.28963e-01 3.99810e+02 300.709 2.82799e+01  -4.76114e+01 0.00000e+00 0.00000e+00 5.18319e+02 300.709 1.18509e+02 300.709 0.9909 
1 1 1 3   23  13 o 12 1.93377e+01 8.12196e-01 3.08782e+02 114.151 -1.95137e+01 4.35200e+01  0.00000e+00 0.00000e+00 4.07548e+02 114.151 9.87662e+01 114.151 0.9895 
1 1 1 3   23  14 o 1  6.44400e+00 1.32711e+00 2.01458e+02 97.197  -1.36614e+00 1.08180e+01  0.00000e+00 0.00000e+00 2.82856e+01 97.197  1.73172e+02 277.197 0.9530 
1 1 1 3   23  15 o 15 1.19749e+01 1.17042e+00 1.31434e+02 306.725 9.48230e+00  -1.27101e+01 0.00000e+00 0.00000e+00 3.01866e+02 306.725 1.70432e+02 306.725 0.9679 
1 1 1 3   23  16 o 4  1.94729e+01 1.09393e+00 3.79629e+02 143.605 -7.71354e+01 5.68587e+01  0.00000e+00 0.00000e+00 3.43915e+02 143.605 3.57140e+01 323.605 0.9948 
1 1 1 3   23  17 o 3  7.52740e+00 1.76126e+00 1.72589e+02 28.928  1.08144e+01  5.97666e+00  0.00000e+00 0.00000e+00 9.67052e+01 28.928  7.58841e+01 208.928 0.9586 
1 1 1 3   23  18 o 18 6.37566e+00 1.86777e+00 1.04376e+02 223.960 -4.47634e+00 -4.31678e+00 0.00000e+00 0.00000e+00 1.13275e+02 223.960 8.89876e+00 223.960 0.9156 
1 1 1 3   24  0  o 17 2.94772e+01 5.41916e-01 5.68763e+02 66.504  3.87937e+00  8.92379e+00  0.00000e+00 0.00000e+00 4.80145e+02 66.504  8.86174e+01 246.504 0.9471 
1 1 1 3   24  1  o 3  1.41729e+01 3.40528e-01 2.79385e+02 129.093 -1.40717e+00 1.73198e+00  0.00000e+00 0.00000e+00 1.10617e+02 129.093 1.68768e+02 309.093 0.7324 
1 1 1 3   24  2  o 12 1.52590e+01 3.58575e-01 3.50664e+02 338.560 3.82777e+00  -1.50316e+00 0.00000e+00 0.00000e+00 1.46836e+02 338.560 2.03828e+02 158.560 0.8677 
1 1 1 3   24  3  o 12 2.94488e+01 5.49146e-01 4.74433e+02 121.680 -6.39030e+00 1.03550e+01  0.00000e+00 0.00000e+00 5.85568e+02 121.680 1.11136e+02 121.680 0.9580 
1 1 1 3   24  4  o 13 2.12420e+01 4.48535e-01 4.82497e+02 39.539  6.69902e+00  5.52994e+00  0.00000e+00 0.00000e+00 2.68113e+02 39.539  2.14384e+02 219.539 0.9405 
1 1 1 3   24  5  o 9  1.95398e+01 4.44477e-01 2.43505e+02 262.977 -6.18928e-01 -5.02451e+00 0.00000e+00 0.00000e+00 4.13283e+02 262.977 1.69778e+02 262.977 0.8948 
1 1 1 3   24  6  o 18 2.24487e+01 4.91319e-01 4.19383e+02 37.426  9.78550e+00  7.48858e+00  0.00000e+00 0.00000e+00 3.88732e+02 37.426  3.06509e+01 217.426 0.9585 
1 1 1 3   24  7  o 15 4.08231e+01 7.48740e-01 8.15311e+02 188.777 -4.30815e+01 -6.65199e+00 0.00000e+00 0.00000e+00 6.99734e+02 188.777 1.15577e+02 8.777   0.9885 
1 1 1 3   24  8  o 3  1.81352e+01 8.02074e-01 1.55727e+02 128.603 -2.97656e+00 3.72824e+00  0.00000e+00 0.00000e+00 4.48553e+02 128.603 2.92826e+02 128.603 0.8878 
1 1 1 3   24  9  o 13 2.00664e+01 8.21738e-01 2.26234e+02 155.178 -9.87711e+00 4.56850e+00  0.00000e+00 0.00000e+00 4.91146e+02 155.178 2.64912e+02 155.178 0.9529 
1 1 1 3   24  10 o 12 1.87744e+01 6.25305e-01 2.88955e+02 207.919 -1.53726e+01 -8.14607e+00 0.00000e+00 0.00000e+00 3.94556e+02 207.919 1.05601e+02 207.919 0.9708 
1 1 1 3   24  11 o 17 5.18439e+01 9.86978e-01 9.37038e+02 48.344  1.31177e+02  1.47457e+02  0.00000e+00 0.00000e+00 1.00120e+03 48.344  6.41644e+01 48.344  0.9975 
1 1 1 3   24  12 o 18 4.02753e+00 1.11303e+00 1.85615e+01 112.479 -1.50101e-01 3.62755e-01  0.00000e+00 0.00000e+00 1.04965e+01 112.479 8.06503e+00 292.479 0.1926 
1 1 1 3   24  13 f 0  1.98383e+01 8.01082e-01 2.88113e+02 19.564  4.30391e+01  1.52948e+01  0.00000e+00 0.00000e+00 4.46365e+02 19.564  1.58252e+02 19.564  0.9890 
1 1 1 3   24  14 o 18 6.71118e+00 1.34468e+00 1.11667e+02 162.363 -5.94727e+00 1.89083e+00  0.00000e+00 0.00000e+00 1.18288e+02 162.363 6.62059e+00 162.363 0.9159 
1 1 1 3   24  15 o 13 4.76040e+00 1.30293e+00 8.27450e+01 272.672 1.74076e-01  -3.73042e+00 0.00000e+00 0.00000e+00 6.89490e+01 272.672 1.37960e+01 92.672  0.8525 
1 1 1 3   24  16 o 9  1.05372e+01 1.44492e+00 2.02254e+02 96.890  -2.72415e+00 2.25457e+01  0.00000e+00 0.00000e+00 1.82540e+02 96.890  1.97133e+01 276.890 0.9777 
1 1 1 3   24  17 o 1  6.18489e+00 1.76514e+00 1.13610e+02 235.409 -3.83319e+00 -5.55829e+00 0.00000e+00 0.00000e+00 9.93356e+01 235.409 1.42748e+01 55.409  0.9227 
1 1 1 3   24  18 o 13 5.00924e+00 1.61209e+00 7.52956e+01 167.571 -4.11325e+00 9.06508e-01  0.00000e+00 0.00000e+00 8.74014e+01 167.571 1.21058e+01 167.571 0.8712 
1 1 1 3   25  0  o 12 2.39505e+01 7.43019e-01 5.80567e+02 42.053  5.77533e+00  5.20975e+00  0.00000e+00 0.00000e+00 2.59187e+02 42.053  3.21380e+02 222.053 0.9333 
1 1 1 3   25  1  o 18 1.86002e+01 3.91888e-01 3.21993e+02 254.647 -1.27958e+00 -4.66055e+00 0.00000e+00 0.00000e+00 2.99515e+02 254.647 2.24781e+01 74.647  0.8894 
1 1 1 3   25  2  o 13 2.01862e+01 4.16935e-01 3.58922e+02 107.046 -1.58884e+00 5.18189e+00  0.00000e+00 0.00000e+00 3.25407e+02 107.046 3.35144e+01 287.046 0.9023 
1 1 1 3   25  3  o 18 9.94543e+00 3.38821e-01 4.30842e+02 260.615 -5.98261e-01 -3.61958e+00 0.00000e+00 0.00000e+00 1.13438e+02 80.615  5.44280e+02 80.615  0.8495 
1 1 1 3   25  4  o 8  9.04417e+00 3.65492e-01 8.17259e+01 114.457 -2.72064e-01 5.98186e-01  0.00000e+00 0.00000e+00 2.42897e+01 114.457 5.74362e+01 294.457 0.3120 
1 1 1 3   25  5  o 15 2.19736e+01 4.73415e-01 4.75470e+02 17.909  1.04735e+01  3.38475e+00  0.00000e+00 0.00000e+00 3.11456e+02 17.909  1.64014e+02 197.909 0.9534 
1 1 1 3   25  6  o 3  1.67883e+01 6.32586e-01 1.27203e+02 302.646 1.36689e+00  -2.13354e+00 0.00000e+00 0.00000e+00 3.57385e+02 302.646 2.30182e+02 302.646 0.7686 
1 1 1 3   25  7  o 3  1.93474e+01 5.93587e-01 2.84090e+02 252.799 -2.20699e+00 -7.12911e+00 0.00000e+00 0.00000e+00 3.91690e+02 252.799 1.07600e+02 252.799 0.9304 
1 1 1 3   25  8  o 16 1.09679e+01 5.39680e-01 2.35151e+02 107.060 -1.30092e+00 4.23928e+00  0.00000e+00 0.00000e+00 1.26412e+02 107.060 1.08738e+02 287.060 0.8784 
1 1 1 3   25  9  o 8  3.49094e+01 7.04510e-01 5.49071e+02 124.895 -2.61217e+01 3.74518e+01  0.00000e+00 0.00000e+00 7.46151e+02 124.895 1.97079e+02 124.895 0.9890 
1 1 1 3   25  10 f 0  1.05695e+01 7.42507e-01 3.16154e+02 42.196  7.84202e+00  7.10983e+00  0.00000e+00 0.00000e+00 6.09703e+01 42.196  2.55184e+02 222.196 0.9515 
1 1 1 3   25  11 o 17 3.99868e+01 8.31314e-01 7.42947e+02 316.635 8.94494e+01  -8.44850e+01 0.00000e+00 0.00000e+00 7.49604e+02 316.635 6.65722e+00 316.635 0.9959 
1 1 1 3   25  12 o 6  3.13646e+01 7.69147e-01 5.43265e+02 188.475 -9.43472e+01 -1.40582e+01 0.00000e+00 0.00000e+00 6.25382e+02 188.475 8.21171e+01 188.475 0.9947 
1 1 1 3   25  13 o 9  1.17095e+01 9.76272e-01 2.36190e+02 3.798   1.99995e+01  1.32753e+00  0.00000e+00 0.00000e+00 1.91054e+02 3.798   4.51359e+01 183.798 0.9747 
1 1 1 3   25  14 f 0  6.73726e+00 1.40360e+00 2.65237e+02 202.901 -1.31942e+01 -5.57375e+00 0.00000e+00 0.00000e+00 2.21830e+01 22.901  2.87420e+02 22.901  0.9644 
1 1 1 3   25  15 f 0  5.94336e+00 1.38814e+00 1.43448e+02 37.818  6.57568e+00  5.10388e+00  0.00000e+00 0.00000e+00 6.48969e+01 37.818  7.85509e+01 217.818 0.9379 
1 1 1 3   25  16 o 17 6.62796e+00 1.57705e+00 1.18884e+02 341.884 7.42400e+00  -2.42880e+00 0.00000e+00 0.00000e+00 1.12215e+02 341.884 6.66912e+00 161.884 0.9336 
1 1 1 3   25  17 o 19 5.18064e+00 1.55700e+00 1.01223e+02 180.986 -5.74755e+00 -9.89636e-02 0.00000e+00 0.00000e+00 7.43529e+01 180.986 2.68704e+01 0.986   0.9083 
1 1 1 3   25  18 o 4  6.21290e+00 1.86084e+00 7.52564e+01 330.632 3.88752e+00  -2.18768e+00 0.00000e+00 0.00000e+00 1.28365e+02 330.632 5.31089e+01 330.632 0.8792 
1 1 1 3   26  0  o 7  1.80808e+01 3.88122e-01 4.49698e+02 40.642  4.95948e+00  4.25709e+00  0.00000e+00 0.00000e+00 1.75139e+02 40.642  2.74559e+02 220.642 0.9200 
1 1 1 3   26  1  o 17 1.55798e+01 3.58678e-01 4.39112e+02 280.818 1.00552e+00  -5.26216e+00 0.00000e+00 0.00000e+00 8.82846e+01 280.818 3.50827e+02 100.818 0.9011 
1 1 1 3   26  2  o 12 1.39803e+01 3.53162e-01 3.44488e+02 267.509 -1.60025e-01 -3.67821e+00 0.00000e+00 0.00000e+00 1.01988e+02 267.509 2.42500e+02 87.509  0.8501 
1 1 1 3   26  3  o 15 5.43600e+00 3.76401e-01 5.99260e+00 221.289 -1.90590e-02 -1.67370e-02 0.00000e+00 0.00000e+00 3.40280e+00 41.289  9.39540e+00 41.289  0.0127 
1 1 1 3   26  4  o 5  1.21373e+01 4.22292e-01 7.15984e+01 220.029 -6.41863e-01 -5.39142e-01 0.00000e+00 0.00000e+00 1.04464e+02 220.029 3.28659e+01 220.029 0.3862 
1 1 1 3   26  5  o 7  1.15864e+01 3.96913e-01 9.80681e+01 30.399  1.02204e+00  5.99595e-01  0.00000e+00 0.00000e+00 1.23039e+02 30.399  2.49713e+01 30.399  0.5081 
1 1 1 3   26  6  o 3  2.05005e+01 4.78817e-01 2.47513e+02 281.197 1.16552e+00  -5.88807e+00 0.00000e+00 0.00000e+00 4.54860e+02 281.197 2.07346e+02 281.197 0.9124 
1 1 1 3   26  7  o 14 3.97931e+01 7.36156e-01 7.39812e+02 80.935  6.24024e+00  3.91129e+01  0.00000e+00 0.00000e+00 7.35059e+02 80.935  4.75278e+00 260.935 0.9873 
1 1 1 3   26  8  o 12 9.75318e+00 5.64754e-01 4.66056e+02 108.597 -2.48505e+00 7.38538e+00  0.00000e+00 0.00000e+00 1.24404e+02 288.597 5.90460e+02 288.597 0.9334 
1 1 1 3   26  9  o 3  1.46878e+01 7.90677e-01 1.48436e+02 261.113 -8.87646e-01 -5.67714e+00 0.00000e+00 0.00000e+00 3.51976e+02 261.113 2.03540e+02 261.113 0.9082 
1 1 1 3   26  10 o 4  6.70261e+00 1.12688e+00 8.70049e+01 198.540 -1.62622e+00 -5.45379e-01 0.00000e+00 0.00000e+00 7.50993e+01 198.540 1.19056e+01 18.540  0.6450 
1 1 1 3   26  11 o 12 1.79870e+01 7.10631e-01 3.14254e+02 256.431 -5.74210e+00 -2.37922e+01 0.00000e+00 0.00000e+00 3.45909e+02 256.431 3.16549e+01 256.431 0.9794 
1 1 1 3   26  12 o 13 1.59470e+01 7.85084e-01 2.29803e+02 65.749  8.94417e+00  1.98544e+01  0.00000e+00 0.00000e+00 3.53600e+02 65.749  1.23797e+02 65.749  0.9768 
1 1 1 3   26  13 o 13 1.76541e+01 9.17126e-01 1.89061e+02 342.166 2.33326e+01  -7.50637e+00 0.00000e+00 0.00000e+00 4.58112e+02 342.166 2.69051e+02 342.166 0.9794 
1 1 1 3   26  14 o 15 1.74019e+01 9.31798e-01 2.82003e+02 82.579  6.34583e+00  4.87231e+01  0.00000e+00 0.00000e+00 3.62238e+02 82.579  8.02343e+01 82.579  0.9898 
1 1 1 3   26  15 o 16 6.26747e+00 1.43962e+00 3.89827e+01 214.077 -1.86623e+00 -1.26246e+00 0.00000e+00 0.00000e+00 1.33250e+02 214.077 9.42675e+01 214.077 0.7353 
1 1 1 3   26  16 o 6  7.32168e+00 1.60807e+00 1.62284e+02 51.329  7.22221e+00  9.02419e+00  0.00000e+00 0.00000e+00 9.90299e+01 51.329  6.32542e+01 231.329 0.9557 
1 1 1 3   26  17 o 6  6.72468e+00 1.81280e+00 1.18982e+02 120.866 -3.70846e+00 6.20485e+00  0.00000e+00 0.00000e+00 1.13859e+02 120.866 5.12241e+00 300.866 0.9280 
1 1 1 3   26  18 f 0  7.11279e+00 1.98945e+00 1.41599e+02 175.544 -8.79914e+00 6.85717e-01  0.00000e+00 0.00000e+00 1.08031e+02 175.544 3.35689e+01 355.544 0.9415 
1 1 1 3   27  0  o 8  1.60944e+01 3.67143e-01 5.16176e+02 28.935  5.58634e+00  3.08824e+00  0.00000e+00 0.00000e+00 3.87481e+01 28.935  4.77428e+02 208.935 0.9179 
1 1 1 3   27  1  o 13 1.50811e+01 3.55892e-01 4.93849e+02 199.120 -5.27870e+00 -1.83001e+00 0.00000e+00 0.00000e+00 1.91009e+01 199.120 4.74748e+02 19.120  0.9054 
1 1 1 3   27  2  o 7  1.35770e+01 5.59337e-01 8.63531e+01 21.918  8.09611e-01  3.25756e-01  0.00000e+00 0.00000e+00 1.17393e+02 21.918  3.10396e+01 21.918  0.3995 
1 1 1 3   27  3  o 1  1.87169e+01 4.14027e-01 3.08835e+02 28.080  3.89677e+00  2.07895e+00  0.00000e+00 0.00000e+00 3.08373e+02 28.080  4.62452e-01 208.080 0.8778 
1 1 1 3   27  4  o 1  1.11580e+01 4.45421e-01 2.22276e+02 249.839 -8.13362e-01 -2.21531e+00 0.00000e+00 0.00000e+00 9.15818e+01 249.839 1.30694e+02 69.839  0.7489 
1 1 1 3   27  5  o 9  2.66242e+01 5.32242e-01 4.12131e+02 333.499 1.18238e+01  -5.89526e+00 0.00000e+00 0.00000e+00 5.49153e+02 333.499 1.37022e+02 333.499 0.9614 
1 1 1 3   27  6  o 1  3.65625e+01 6.80376e-01 6.95946e+02 161.483 -2.95012e+01 9.88079e+00  0.00000e+00 0.00000e+00 6.54659e+02 161.483 4.12873e+01 341.483 0.9838 
1 1 1 3   27  7  o 14 6.30024e+00 5.89637e-01 2.32550e+01 306.588 1.38426e-01  -1.86473e-01 0.00000e+00 0.00000e+00 4.02306e+00 306.588 1.92320e+01 126.588 0.1153 
1 1 1 3   27  8  o 1  3.00406e+01 6.23546e-01 5.55005e+02 279.622 5.82618e+00  -3.43664e+01 0.00000e+00 0.00000e+00 5.55981e+02 279.622 9.76180e-01 279.622 0.9855 
1 1 1 3   27  9  o 12 1.71816e+01 5.67346e-01 2.99813e+02 300.605 6.99913e+00  -1.18325e+01 0.00000e+00 0.00000e+00 3.20769e+02 300.605 2.09554e+01 300.605 0.9629 
1 1 1 3   27  10 o 14 1.48845e+01 6.45169e-01 1.30421e+02 127.829 -3.79109e+00 4.88230e+00  0.00000e+00 0.00000e+00 3.80254e+02 127.829 2.49833e+02 127.829 0.9151 
1 1 1 3   27  11 o 5  6.29589e+00 1.14426e+00 9.37381e+01 165.933 -2.42757e+00 6.08263e-01  0.00000e+00 0.00000e+00 8.68131e+01 165.933 6.92497e+00 345.933 0.7653 
1 1 1 3   27  12 o 2  1.93917e+01 7.50432e-01 2.73354e+02 326.447 2.63406e+01  -1.74693e+01 0.00000e+00 0.00000e+00 4.41312e+02 326.447 1.67959e+02 326.447 0.9841 
1 1 1 3   27  13 o 8  1.16015e+01 9.80307e-01 2.15533e+02 176.513 -1.95321e+01 1.19019e+00  0.00000e+00 0.00000e+00 2.07438e+02 176.513 8.09422e+00 356.513 0.9741 
1 1 1 3   27  14 o 3  5.22936e+00 1.32961e+00 1.04276e+02 210.465 -4.02287e+00 -2.36631e+00 0.00000e+00 0.00000e+00 6.88252e+01 210.465 3.54504e+01 30.465  0.8850 
1 1 1 3   27  15 o 7  1.08382e+01 1.27028e+00 1.74651e+02 285.772 5.14639e+00  -1.82213e+01 0.00000e+00 0.00000e+00 2.19553e+02 285.772 4.49022e+01 285.772 0.9732 
1 1 1 3   27  16 o 12 6.71724e+00 1.63017e+00 8.51904e+01 157.063 -5.03645e+00 2.13134e+00  0.00000e+00 0.00000e+00 1.41369e+02 157.063 5.61786e+01 157.063 0.9032 
1 1 1 3   27  17 o 6  1.18990e+01 1.85316e+00 1.52019e+02 6.142   1.65783e+01  1.78405e+00  0.00000e+00 0.00000e+00 2.78392e+02 6.142   1.26373e+02 6.142   0.9695 
1 1 1 3   27  18 o 17 7.26199e+00 1.96677e+00 1.03833e+02 198.999 -6.39102e+00 -2.20045e+00 0.00000e+00 0.00000e+00 1.45932e+02 198.999 4.20986e+01 198.999 0.9227 
1 1 1 3   28  0  o 11 1.62414e+01 3.79039e-01 2.98077e+02 281.269 7.05701e-01  -3.54171e+00 0.00000e+00 0.00000e+00 2.18432e+02 281.269 7.96442e+01 101.269 0.8467 
1 1 1 3   28  1  o 10 5.12311e+00 3.17892e-01 1.91025e+02 248.093 -2.79227e-01 -6.94355e-01 0.00000e+00 0.00000e+00 1.23628e+02 68.093  3.14653e+02 68.093  0.3502 
1 1 1 3   28  2  o 2  9.17389e+00 3.27501e-01 2.63799e+02 20.568  1.94976e+00  7.31636e-01  0.00000e+00 0.00000e+00 1.88285e+01 200.568 2.82627e+02 200.568 0.7109 
1 1 1 3   28  3  o 7  1.57884e+01 3.88311e-01 3.60193e+02 268.950 -8.91004e-02 -4.86166e+00 0.00000e+00 0.00000e+00 1.67680e+02 268.950 1.92513e+02 88.950  0.8901 
1 1 1 3   28  4  o 16 2.33000e+01 6.89698e-01 4.17552e+02 294.460 3.63824e+00  -7.99801e+00 0.00000e+00 0.00000e+00 4.06158e+02 294.460 1.13935e+01 114.460 0.9412 
1 1 1 3   28  5  o 1  3.48124e+00 6.13759e-01 8.01134e+01 40.418  2.52811e-01  2.15295e-01  0.00000e+00 0.00000e+00 5.87016e+01 220.418 1.38815e+02 220.418 0.1638 
1 1 1 3   28  6  o 6  1.76067e+01 4.57519e-01 3.76032e+02 116.973 -3.92794e+00 7.71786e+00  0.00000e+00 0.00000e+00 2.45590e+02 116.973 1.30442e+02 296.973 0.9404 
1 1 1 3   28  7  o 5  1.78779e+01 6.41565e-01 1.62463e+02 26.563  4.01081e+00  2.00519e+00  0.00000e+00 0.00000e+00 4.27965e+02 26.563  2.65502e+02 26.563  0.8799 
1 1 1 3   28  8  f 0  1.17711e+01 5.46290e-01 1.78606e+02 75.783  1.07924e+00  4.25994e+00  0.00000e+00 0.00000e+00 2.08808e+02 75.783  3.02020e+01 75.783  0.8771 
1 1 1 3   28  9  o 2  6.90581e+00 8.49755e-01 1.75381e+02 251.550 -9.80584e-01 -2.93917e+00 0.00000e+00 0.00000e+00 3.62387e+01 251.550 1.39142e+02 71.550  0.8170 
1 1 1 3   28  10 o 9  2.21924e+01 6.28234e-01 5.38024e+02 95.800  -3.83461e+00 3.77476e+01  0.00000e+00 0.00000e+00 2.82932e+02 95.800  2.55093e+02 275.800 0.9867 
1 1 1 3   28  11 o 18 1.41965e+01 7.55582e-01 3.62683e+02 300.718 1.18125e+01  -1.98803e+01 0.00000e+00 0.00000e+00 1.57634e+02 300.718 2.05049e+02 120.718 0.9781 
1 1 1 3   28  12 o 3  2.45678e+01 7.38648e-01 4.36318e+02 213.477 -5.44899e+01 -3.60350e+01 0.00000e+00 0.00000e+00 4.76645e+02 213.477 4.03274e+01 213.477 0.9923 
1 1 1 3   28  13 o 16 2.00739e+01 7.84602e-01 3.27005e+02 282.876 1.22090e+01  -5.34084e+01 0.00000e+00 0.00000e+00 4.17366e+02 282.876 9.03611e+01 282.876 0.9908 
1 1 1 3   28  14 o 10 6.05913e+00 1.41319e+00 1.37098e+02 326.286 5.55122e+00  -3.70415e+00 0.00000e+00 0.00000e+00 7.17595e+01 326.286 6.53382e+01 146.286 0.9217 
1 1 1 3   28  15 o 8  9.03663e+00 1.39341e+00 1.18244e+02 111.387 -3.85872e+00 9.85283e+00  0.00000e+00 0.00000e+00 2.03076e+02 111.387 8.48321e+01 111.387 0.9515 
1 1 1 3   28  16 o 16 9.80619e+00 1.69540e+00 1.73060e+02 17.221  1.49651e+01  4.63857e+00  0.00000e+00 0.00000e+00 1.81207e+02 17.221  8.14646e+00 17.221  0.9675 
1 1 1 3   28  17 o 7  5.99763e+00 1.73709e+00 9.91827e+01 176.271 -5.88952e+00 3.83842e-01  0.00000e+00 0.00000e+00 1.04607e+02 176.271 5.42445e+00 176.271 0.9108 
1 1 1 3   28  18 o 2  4.68169e+00 1.59387e+00 9.38560e+01 81.780  7.23050e-01  5.00554e+00  0.00000e+00 0.00000e+00 6.22585e+01 81.780  3.15975e+01 261.780 0.8947 
1 1 1 3   29  0  f 0  1.43054e+01 3.57756e-01 2.82890e+02 172.577 -3.04982e+00 3.97351e-01  0.00000e+00 0.00000e+00 1.55202e+02 172.577 1.27687e+02 352.577 0.8154 
1 1 1 3   29  1  o 15 1.45919e+01 3.31840e-01 2.25957e+02 341.830 2.33441e+00  -7.66160e-01 0.00000e+00 0.00000e+00 1.90700e+02 341.830 3.52568e+01 161.830 0.7602 
1 1 1 3   29  2  o 8  4.08497e+01 7.22835e-01 7.37407e+02 302.391 1.25237e+01  -1.97408e+01 0.00000e+00 0.00000e+00 7.63760e+02 302.391 2.63533e+01 302.391 0.9784 
1 1 1 3   29  3  o 6  1.16173e+01 4.00356e-01 1.41600e+02 103.195 -3.35431e-01 1.43070e+00  0.00000e+00 0.00000e+00 1.15187e+02 103.195 2.64132e+01 283.195 0.5885 
1 1 1 3   29  4  o 9  1.07883e+01 4.27198e-01 1.82362e+02 92.967  -9.13099e-02 1.76148e+00  0.00000e+00 0.00000e+00 8.29914e+01 92.967  9.93706e+01 272.967 0.6549 
1 1 1 3   29  5  o 9  1.45418e+01 4.11928e-01 1.57597e+02 317.675 1.87469e+00  -1.70735e+00 0.00000e+00 0.00000e+00 2.62218e+02 317.675 1.04621e+02 317.675 0.7688 
1 1 1 3   29  6  o 16 1.11406e+01 4.42187e-01 1.35581e+02 213.614 -1.63655e+00 -1.08789e+00 0.00000e+00 0.00000e+00 1.53829e+02 213.614 1.82488e+01 213.614 0.6920 
1 1 1 3   29  7  o 3  1.80394e+01 6.37240e-01 2.79538e+02 31.596  6.59909e+00  4.05920e+00  0.00000e+00 0.00000e+00 3.52176e+02 31.596  7.26375e+01 31.596  0.9330 
1 1 1 3   29  8  o 10 1.25228e+01 5.45182e-01 1.57230e+02 203.162 -3.77664e+00 -1.61572e+00 0.00000e+00 0.00000e+00 2.50380e+02 203.162 9.31500e+01 203.162 0.8675 
1 1 1 3   29  9  o 10 2.47687e+01 6.03876e-01 5.15228e+02 125.995 -2.05283e+01 2.82604e+01  0.00000e+00 0.00000e+00 4.00311e+02 125.995 1.14918e+02 305.995 0.9856 
1 1 1 3   29  10 o 6  5.18815e+00 9.60521e-01 9.46426e+01 178.897 -1.55917e+00 3.00076e-02  0.00000e+00 0.00000e+00 2.40912e+01 178.897 7.05514e+01 358.897 0.6105 
1 1 1 3   29  11 o 1  1.89674e+01 6.88315e-01 4.34195e+02 259.325 -7.28953e+00 -3.86723e+01 0.00000e+00 0.00000e+00 2.67379e+02 259.325 1.66815e+02 79.325  0.9872 
1 1 1 3   29  12 o 14 1.09545e+01 8.98409e-01 2.51854e+02 342.613 1.70243e+01  -5.33079e+00 0.00000e+00 0.00000e+00 1.46678e+02 342.613 1.05176e+02 162.613 0.9716 
1 1 1 3   29  13 f 0  7.36349e+00 1.22116e+00 6.34294e+01 188.283 -3.38706e+00 -4.93122e-01 0.00000e+00 0.00000e+00 1.67200e+02 188.283 1.03771e+02 188.283 0.8370 
1 1 1 3   29  14 o 10 5.44863e+00 1.26387e+00 1.15755e+02 298.677 2.70458e+00  -4.94465e+00 0.00000e+00 0.00000e+00 6.89075e+01 298.677 4.68478e+01 118.677 0.9063 
1 1 1 3   29  15 o 17 7.71978e+00 1.44116e+00 8.27169e+01 0.990   6.19291e+00  1.06983e-01  0.00000e+00 0.00000e+00 1.81305e+02 0.990   9.85880e+01 0.990   0.9153 
1 1 1 3   29  16 o 18 4.15513e+00 1.34572e+00 8.35771e+01 187.104 -3.89150e+00 -4.85001e-01 0.00000e+00 0.00000e+00 4.99078e+01 187.104 3.36693e+01 7.104   0.8604 
1 1 1 3   29  17 o 5  4.53944e+00 1.49719e+00 1.14120e+02 25.548  5.58003e+00  2.66723e+00  0.00000e+00 0.00000e+00 4.08439e+01 25.548  7.32759e+01 205.548 0.9151 
1 1 1 3   29  18 o 14 5.95770e+00 1.92640e+00 1.37429e+02 199.583 -7.25792e+00 -2.58197e+00 0.00000e+00 0.00000e+00 6.96428e+01 199.583 6.77857e+01 19.583  0.9326 
1 1 1 3   30  0  o 16 2.50534e+01 6.12628e-01 4.98016e+02 42.684  7.97808e+00  7.35783e+00  0.00000e+00 0.00000e+00 3.98369e+02 42.684  9.96462e+01 222.684 0.9528 
1 1 1 3   30  1  o 16 3.37615e+01 5.62750e-01 6.52941e+02 273.068 1.00859e+00  -1.88178e+01 0.00000e+00 0.00000e+00 5.80914e+02 273.068 7.20263e+01 93.068  0.9731 
1 1 1 3   30  2  o 15 2.11247e+01 5.30135e-01 3.42956e+02 246.086 -2.24062e+00 -5.05284e+00 0.00000e+00 0.00000e+00 3.74537e+02 246.086 3.15810e+01 246.086 0.9043 
1 1 1 3   30  3  o 3  1.55460e+01 3.90758e-01 4.55775e+02 314.020 4.32884e+00  -4.47953e+00 0.00000e+00 0.00000e+00 7.89086e+01 314.020 3.76866e+02 134.020 0.9158 
1 1 1 3   30  4  o 19 7.09196e+00 4.54284e-01 2.17208e+02 32.006  1.38246e+00  8.64055e-01  0.00000e+00 0.00000e+00 5.02953e+01 212.006 2.67503e+02 212.006 0.6267 
1 1 1 3   30  5  o 8  2.03357e+01 4.61844e-01 2.54875e+02 85.758  5.04727e-01  6.80436e+00  0.00000e+00 0.00000e+00 4.50265e+02 85.758  1.95390e+02 85.758  0.9235 
1 1 1 3   30  6  o 7  2.05308e+01 5.42956e-01 1.42578e+02 237.843 -1.99006e+00 -3.16541e+00 0.00000e+00 0.00000e+00 5.14592e+02 237.843 3.72014e+02 237.843 0.8527 
1 1 1 3   30  7  o 7  1.07792e+01 7.12044e-01 2.82316e+02 290.867 2.03136e+00  -5.32886e+00 0.00000e+00 0.00000e+00 8.47880e+01 290.867 1.97528e+02 110.867 0.9075 
1 1 1 3   30  8  o 5  7.61465e+00 6.78699e-01 1.30731e+02 119.666 -1.06406e+00 1.86805e+00  0.00000e+00 0.00000e+00 7.52130e+01 119.666 5.55182e+01 299.666 0.7209 
1 1 1 3   30  9  o 8  6.16611e+00 9.17477e-01 1.74068e+02 281.983 5.93920e-01  -2.79829e+00 0.00000e+00 0.00000e+00 1.07205e+01 281.983 1.63347e+02 101.983 0.7991 
1 1 1 3   30  10 o 6  8.27393e+00 9.06276e-01 2.71027e+02 206.037 -6.94062e+00 -3.39078e+00 0.00000e+00 0.00000e+00 1.82807e+01 206.037 2.52746e+02 26.037  0.9328 
1 1 1 3   30  11 o 7  2.97625e+01 7.27688e-01 4.43528e+02 70.737  2.02382e+01  5.79109e+01  0.00000e+00 0.00000e+00 6.62384e+02 70.737  2.18856e+02 70.737  0.9918 
1 1 1 3   30  12 o 3  1.26887e+01 8.18643e-01 1.93254e+02 24.781  1.46003e+01  6.74034e+00  0.00000e+00 0.00000e+00 2.66826e+02 24.781  7.35724e+01 24.781  0.9684 
1 1 1 3   30  13 o 10 1.44105e+01 8.68284e-01 3.43450e+02 269.779 -1.63165e-01 -4.23296e+01 0.00000e+00 0.00000e+00 1.89363e+02 269.779 1.54087e+02 89.779  0.9881 
1 1 1 3   30  14 o 3  1.74170e+01 9.09905e-01 3.40479e+02 41.899  4.51870e+01  4.05425e+01  0.00000e+00 0.00000e+00 3.05398e+02 41.899  3.50815e+01 221.899 0.9917 
1 1 1 3   30  15 o 1  1.57180e+01 1.05411e+00 2.46144e+02 254.323 -1.22797e+01 -4.37550e+01 0.00000e+00 0.00000e+00 3.34642e+02 254.323 8.84980e+01 254.323 0.9889 
1 1 1 3   30  16 o 5  6.94455e+00 1.74611e+00 1.22079e+02 177.785 -7.58950e+00 2.93593e-01  0.00000e+00 0.00000e+00 1.19456e+02 177.785 2.62220e+00 357.785 0.9316 
1 1 1 3   30  17 o 11 5.65945e+00 1.70648e+00 1.52611e+02 115.246 -3.69530e+00 7.83670e+00  0.00000e+00 0.00000e+00 4.59009e+01 115.246 1.06711e+02 295.246 0.9404 
1 1 1 3   30  18 o 8  5.30642e+00 1.75497e+00 6.52726e+01 58.319  1.91651e+00  3.10540e+00  0.00000e+00 0.00000e+00 1.02517e+02 58.319  3.72442e+01 58.319  0.8485 
1 1 1 3   31  0  o 16 3.45957e+01 5.75991e-01 6.94309e+02 267.066 -1.04403e+00 -2.03702e+01 0.00000e+00 0.00000e+00 5.72511e+02 267.066 1.21798e+02 87.066  0.9752 
1 1 1 3   31  1  o 5  7.91788e+00 4.20394e-01 1.55067e+02 313.995 6.62306e-01  -6.85964e-01 0.00000e+00 0.00000e+00 2.73045e+01 133.995 1.82371e+02 133.995 0.4297 
1 1 1 3   31  2  o 5  1.09892e+01 4.02130e-01 3.70317e+02 131.031 -2.27975e+00 2.61971e+00  0.00000e+00 0.00000e+00 2.37882e+01 311.031 3.94105e+02 311.031 0.8397 
1 1 1 3   31  3  o 7  3.02595e+01 5.70859e-01 7.02900e+02 330.053 1.75063e+01  -1.00858e+01 0.00000e+00 0.00000e+00 4.04959e+02 330.053 2.97942e+02 150.053 0.9749 
1 1 1 3   31  4  o 1  2.81834e+01 5.49138e-01 5.65676e+02 138.933 -1.25281e+01 1.09161e+01  0.00000e+00 0.00000e+00 4.60256e+02 138.933 1.05420e+02 318.933 0.9694 
1 1 1 3   31  5  o 15 2.57572e+01 5.26318e-01 5.70032e+02 222.467 -1.41160e+01 -1.29201e+01 0.00000e+00 0.00000e+00 3.71385e+02 222.467 1.98647e+02 42.467  0.9735 
1 1 1 3   31  6  f 0  1.29227e+01 4.39092e-01 2.29077e+02 52.872  2.37048e+00  3.13119e+00  0.00000e+00 0.00000e+00 1.88407e+02 52.872  4.06697e+01 232.872 0.8607 
1 1 1 3   31  7  o 10 1.06358e+01 5.31975e-01 1.21865e+02 111.262 -8.26698e-01 2.12452e+00  0.00000e+00 0.00000e+00 1.72984e+02 111.262 5.11183e+01 111.262 0.7388 
1 1 1 3   31  8  o 7  1.47759e+01 5.36199e-01 1.96733e+02 183.173 -6.28886e+00 -3.48613e-01 0.00000e+00 0.00000e+00 3.11418e+02 183.173 1.14685e+02 183.173 0.9168 
1 1 1 3   31  9  o 12 4.41634e+01 8.36188e-01 7.00063e+02 122.872 -4.60534e+01 7.12638e+01  0.00000e+00 0.00000e+00 9.46194e+02 122.872 2.46132e+02 122.872 0.9941 
1 1 1 3   31  10 o 8  1.02406e+01 1.07905e+00 1.47150e+02 311.019 3.32187e+00  -3.81877e+00 0.00000e+00 0.00000e+00 1.96293e+02 311.019 4.91426e+01 311.019 0.8948 
1 1 1 3   31  11 o 2  1.35065e+01 7.68060e-01 2.65050e+02 344.993 1.59304e+01  -4.27070e+00 0.00000e+00 0.00000e+00 2.25335e+02 344.993 3.97153e+01 164.993 0.9692 
1 1 1 3   31  12 o 19 6.82901e+00 1.20062e+00 1.27602e+02 17.913  5.11382e+00  1.65299e+00  0.00000e+00 0.00000e+00 1.02863e+02 17.913  2.47393e+01 197.913 0.9014 
1 1 1 3   31  13 o 2  4.28555e+00 1.19305e+00 1.05972e+02 204.148 -3.19747e+00 -1.43354e+00 0.00000e+00 0.00000e+00 2.89305e+01 204.148 7.70415e+01 24.148  0.8413 
1 1 1 3   31  14 o 15 1.86642e+01 8.92387e-01 3.28667e+02 319.308 4.51115e+01  -3.87906e+01 0.00000e+00 0.00000e+00 3.63285e+02 319.308 3.46184e+01 319.308 0.9916 
1 1 1 3   31  15 o 5  7.64664e+00 1.61880e+00 1.79298e+02 206.738 -1.10657e+01 -5.57471e+00 0.00000e+00 0.00000e+00 9.46031e+01 206.738 8.46948e+01 26.738  0.9588 
1 1 1 3   31  16 o 17 5.93279e+00 1.69799e+00 1.04040e+02 136.531 -4.23289e+00 4.01247e+00  0.00000e+00 0.00000e+00 9.74251e+01 136.531 6.61496e+00 316.531 0.9097 
1 1 1 3   31  17 o 5  5.34256e+00 1.68158e+00 6.62260e+01 331.460 3.16553e+00  -1.72159e+00 0.00000e+00 0.00000e+00 1.02413e+02 331.460 3.61870e+01 331.460 0.8463 
1 1 1 3   31  18 o 14 8.20140e+00 2.25812e+00 1.49224e+02 144.975 -7.62706e+00 5.34546e+00  0.00000e+00 0.00000e+00 1.39467e+02 144.975 9.75722e+00 324.975 0.9447 
1 1 1 3   32  0  o 7  2.24333e+01 4.16020e-01 3.72825e+02 265.233 -5.36320e-01 -6.43079e+00 0.00000e+00 0.00000e+00 4.01140e+02 265.233 2.83147e+01 265.233 0.9189 
1 1 1 3   32  1  o 19 1.05171e+01 3.31838e-01 3.55411e+02 316.049 2.33119e+00  -2.24731e+00 0.00000e+00 0.00000e+00 2.91485e+01 136.049 3.84560e+02 136.049 0.8262 
1 1 1 3   32  2  o 16 1.21428e+01 3.83912e-01 1.45916e+02 242.297 -7.33520e-01 -1.39695e+00 0.00000e+00 0.00000e+00 1.34416e+02 242.297 1.15003e+01 62.297  0.6148 
1 1 1 3   32  3  o 9  7.35854e+00 3.70436e-01 2.50979e+02 339.752 1.57190e+00  -5.79857e-01 0.00000e+00 0.00000e+00 7.50748e+01 159.752 3.26054e+02 159.752 0.6366 
1 1 1 3   32  4  o 18 7.75847e+00 4.59720e-01 1.60778e+02 234.994 -8.63370e-01 -1.23275e+00 0.00000e+00 0.00000e+00 1.32395e+01 234.994 1.47538e+02 54.994  0.5974 
1 1 1 3   32  5  o 6  1.03014e+01 4.88296e-01 1.72949e+02 52.473  1.28555e+00  1.67372e+00  0.00000e+00 0.00000e+00 1.03599e+02 52.473  6.93501e+01 232.473 0.7151 
1 1 1 3   32  6  o 9  1.88922e+01 6.19526e-01 3.09977e+02 330.469 6.68630e+00  -3.78775e+00 0.00000e+00 0.00000e+00 3.51213e+02 330.469 4.12359e+01 330.469 0.9325 
1 1 1 3   32  7  o 5  2.57586e+01 5.60965e-01 6.53381e+02 311.687 1.95643e+01  -2.19682e+01 0.00000e+00 0.00000e+00 2.96574e+02 311.687 3.56807e+02 131.687 0.9829 
1 1 1 3   32  8  f 0  1.66261e+01 5.29374e-01 2.45787e+02 152.759 -8.05373e+00 4.14632e+00  0.00000e+00 0.00000e+00 3.42353e+02 152.759 9.65654e+01 152.759 0.9431 
1 1 1 3   32  9  o 8  2.36540e+01 6.13510e-01 4.59730e+02 312.857 2.22625e+01  -2.39931e+01 0.00000e+00 0.00000e+00 4.13519e+02 312.857 4.62113e+01 132.857 0.9846 
1 1 1 3   32  10 o 15 1.54511e+01 9.06868e-01 2.68111e+02 15.508  1.33334e+01  3.69968e+00  0.00000e+00 0.00000e+00 2.89628e+02 15.508  2.15180e+01 15.508  0.9632 
1 1 1 3   32  11 f 0  1.40089e+01 7.59994e-01 2.89127e+02 215.014 -1.64008e+01 -1.14900e+01 0.00000e+00 0.00000e+00 2.22348e+02 215.014 6.67788e+01 35.014  0.9747 
1 1 1 3   32  12 o 5  4.10760e+00 1.15325e+00 1.30083e+02 204.286 -3.19049e+00 -1.43966e+00 0.00000e+00 0.00000e+00 7.40830e-01 24.286  1.30824e+02 24.286  0.8411 
1 1 1 3   32  13 o 15 6.41732e+00 1.26694e+00 2.00180e+02 321.237 7.51862e+00  -6.03706e+00 0.00000e+00 0.00000e+00 2.70938e+01 321.237 1.73086e+02 141.237 0.9466 
1 1 1 3   32  14 o 17 1.42185e+01 9.64251e-01 2.65913e+02 240.804 -1.88068e+01 -3.36556e+01 0.00000e+00 0.00000e+00 2.58720e+02 240.804 7.19273e+00 60.804  0.9869 
1 1 1 3   32  15 o 6  7.08482e+00 1.56606e+00 7.86909e+01 111.019 -1.79605e+00 4.67415e+00  0.00000e+00 0.00000e+00 1.57806e+02 111.019 7.91152e+01 111.019 0.8936 
1 1 1 3   32  16 o 7  1.01037e+01 1.84117e+00 1.92675e+02 107.650 -5.11599e+00 1.60786e+01  0.00000e+00 0.00000e+00 1.73109e+02 107.650 1.95661e+01 287.650 0.9699 
1 1 1 3   32  17 o 18 6.94109e+00 2.01395e+00 7.30060e+01 39.582  3.25919e+00  2.69451e+00  0.00000e+00 0.00000e+00 1.52660e+02 39.582  7.96536e+01 39.582  0.8718 
1 1 1 3   32  18 o 13 5.18508e+00 1.71649e+00 7.12269e+01 149.025 -3.46564e+00 2.08029e+00  0.00000e+00 0.00000e+00 9.59026e+01 149.025 2.46757e+01 149.025 0.8651 
1 1 1 3   33  0  o 14 3.14104e+01 5.33696e-01 5.86194e+02 301.146 8.17224e+00  -1.35228e+01 0.00000e+00 0.00000e+00 5.55116e+02 301.146 3.10773e+01 121.146 0.9678 
1 1 1 3   33  1  o 19 7.52868e+00 3.20637e-01 3.58057e+02 321.390 1.78837e+00  -1.42814e+00 0.00000e+00 0.00000e+00 1.48898e+02 141.390 5.06955e+02 141.390 0.7399 
1 1 1 3   33  2  f 0  1.13612e+01 3.99493e-01 2.37780e+02 84.835  2.34232e-01  2.59110e+00  0.00000e+00 0.00000e+00 9.30911e+01 84.835  1.44689e+02 264.835 0.7756 
1 1 1 3   33  3  o 14 1.89865e+01 4.30128e-01 2.14044e+02 212.551 -3.65945e+00 -2.33587e+00 0.00000e+00 0.00000e+00 4.10071e+02 212.551 1.96027e+02 212.551 0.8755 
1 1 1 3   33  4  o 8  3.46057e+01 7.72039e-01 7.13985e+02 17.554  2.78772e+01  8.81841e+00  0.00000e+00 0.00000e+00 5.62816e+02 17.554  1.51169e+02 197.554 0.9827 
1 1 1 3   33  5  o 9  1.69884e+01 6.28130e-01 1.03041e+02 55.145  1.22508e+00  1.75908e+00  0.00000e+00 0.00000e+00 3.56110e+02 55.145  2.53070e+02 55.145  0.7200 
1 1 1 3   33  6  o 4  5.25177e+01 9.24438e-01 1.01936e+03 331.389 6.27823e+01  -3.42453e+01 0.00000e+00 0.00000e+00 9.37774e+02 331.389 8.15876e+01 151.389 0.9930 
1 1 1 3   33  7  o 18 1.13721e+01 5.05418e-01 2.10071e+02 202.181 -3.77454e+00 -1.53893e+00 0.00000e+00 0.00000e+00 1.59593e+02 202.181 5.04784e+01 22.181  0.8664 
1 1 1 3   33  8  o 2  2.49791e+01 5.80949e-01 4.66026e+02 218.623 -2.21838e+01 -1.77239e+01 0.00000e+00 0.00000e+00 4.54206e+02 218.623 1.18195e+01 38.623  0.9822 
1 1 1 3   33  9  o 3  1.53895e+01 6.24179e-01 2.93575e+02 312.188 8.68391e+00  -9.58118e+00 0.00000e+00 0.00000e+00 2.60622e+02 312.188 3.29528e+01 132.188 0.9605 
1 1 1 3   33  10 o 3  2.49663e+01 6.68477e-01 5.22613e+02 285.015 1.31066e+01  -4.88648e+01 0.00000e+00 0.00000e+00 4.03690e+02 285.015 1.18923e+02 105.015 0.9901 
1 1 1 3   33  11 o 9  2.94985e+01 8.20639e-01 4.49950e+02 76.907  1.57828e+01  6.78617e+01  0.00000e+00 0.00000e+00 6.46955e+02 76.907  1.97004e+02 76.907  0.9928 
1 1 1 3   33  12 o 17 1.43643e+01 7.98984e-01 1.90554e+02 39.045  1.52917e+01  1.24028e+01  0.00000e+00 0.00000e+00 3.33306e+02 39.045  1.42752e+02 39.045  0.9743 
1 1 1 3   33  13 o 15 1.27390e+01 9.05325e-01 2.85920e+02 203.064 -2.82546e+01 -1.20309e+01 0.00000e+00 0.00000e+00 1.82809e+02 203.064 1.03111e+02 23.064  0.9836 
1 1 1 3   33  14 o 19 1.49480e+01 9.72540e-01 2.23767e+02 261.112 -5.24439e+00 -3.35350e+01 0.00000e+00 0.00000e+00 3.26735e+02 261.112 1.02968e+02 261.112 0.9852 
1 1 1 3   33  15 o 11 1.13266e+01 1.46247e+00 2.15426e+02 282.284 4.91555e+00  -2.25752e+01 0.00000e+00 0.00000e+00 1.98410e+02 282.284 1.70156e+01 102.284 0.9781 
1 1 1 3   33  16 o 12 6.22346e+00 1.75466e+00 8.82422e+01 177.117 -4.80422e+00 2.41943e-01  0.00000e+00 0.00000e+00 1.18206e+02 177.117 2.99634e+01 177.117 0.8888 
1 1 1 3   33  17 o 6  7.28422e+00 2.02903e+00 1.47513e+02 125.768 -5.01200e+00 6.95737e+00  0.00000e+00 0.00000e+00 1.07748e+02 125.768 3.97646e+01 305.769 0.9397 
1 1 1 3   33  18 o 16 5.02086e+00 1.68898e+00 7.61511e+01 19.676  4.13145e+00  1.47735e+00  0.00000e+00 0.00000e+00 8.78801e+01 19.676  1.17290e+01 19.676  0.8769 
1 1 1 3   34  0  o 8  3.52139e+01 5.85510e-01 8.18136e+02 190.492 -2.52883e+01 -4.68312e+00 0.00000e+00 0.00000e+00 4.77838e+02 190.492 3.40298e+02 10.492  0.9804 
1 1 1 3   34  1  f 0  1.44080e+01 3.43545e-01 2.76928e+02 356.148 3.52323e+00  -2.37223e-01 0.00000e+00 0.00000e+00 1.78922e+02 356.148 9.80059e+01 176.148 0.8427 
1 1 1 3   34  2  o 18 1.95840e+01 4.68264e-01 3.55222e+02 332.396 5.83368e+00  -3.05034e+00 0.00000e+00 0.00000e+00 3.21641e+02 332.396 3.35804e+01 152.396 0.9206 
1 1 1 3   34  3  o 17 1.33935e+01 3.82451e-01 1.67744e+02 200.063 -2.22690e+00 -8.13285e-01 0.00000e+00 0.00000e+00 2.09472e+02 200.063 4.17274e+01 200.063 0.7502 
1 1 1 3   34  4  o 5  1.64952e+01 5.39756e-01 4.56443e+02 222.679 -6.09298e+00 -5.61836e+00 0.00000e+00 0.00000e+00 1.24131e+02 222.679 3.32312e+02 42.679  0.9376 
1 1 1 3   34  5  o 10 2.45295e+01 5.16113e-01 4.22056e+02 326.706 1.12887e+01  -7.41345e+00 0.00000e+00 0.00000e+00 4.63868e+02 326.706 4.18120e+01 326.706 0.9622 
1 1 1 3   34  6  o 15 2.14005e+01 5.02561e-01 3.30811e+02 186.895 -1.11673e+01 -1.35036e+00 0.00000e+00 0.00000e+00 4.35692e+02 186.895 1.04881e+02 186.895 0.9545 
1 1 1 3   34  7  o 15 1.44108e+01 4.94895e-01 2.19541e+02 260.270 -9.18808e-01 -5.35845e+00 0.00000e+00 0.00000e+00 2.68439e+02 260.270 4.88978e+01 260.270 0.9026 
1 1 1 3   34  8  o 17 1.34053e+01 7.50062e-01 1.90561e+02 5.425   6.04404e+00  5.74038e-01  0.00000e+00 0.00000e+00 2.68669e+02 5.425   7.81081e+01 5.425   0.9135 
1 1 1 3   34  9  o 7  7.71575e+00 9.38387e-01 1.56781e+02 316.192 2.42491e+00  -2.32607e+00 0.00000e+00 0.00000e+00 8.42948e+01 316.192 7.24857e+01 136.192 0.8335 
1 1 1 3   34  10 o 13 6.55471e+00 1.03722e+00 8.37369e+01 251.177 -7.17931e-01 -2.10613e+00 0.00000e+00 0.00000e+00 9.59247e+01 251.177 1.21878e+01 251.177 0.7315 
1 1 1 3   34  11 o 14 9.98577e+00 8.87111e-01 1.28714e+02 123.447 -4.02715e+00 6.09664e+00  0.00000e+00 0.00000e+00 2.18642e+02 123.447 8.99284e+01 123.447 0.9288 
1 1 1 3   34  12 o 8  1.77977e+01 7.79924e-01 3.09898e+02 215.056 -3.25356e+01 -2.28291e+01 0.00000e+00 0.00000e+00 3.47828e+02 215.056 3.79305e+01 215.056 0.9873 
1 1 1 3   34  13 f 0  5.74676e+00 1.17768e+00 1.92876e+02 42.529  6.62161e+00  6.07378e+00  0.00000e+00 0.00000e+00 9.74489e+00 42.529  1.83131e+02 222.529 0.9426 
1 1 1 3   34  14 o 19 3.82169e+00 1.17581e+00 5.14587e+01 281.465 3.81334e-01  -1.88012e+00 0.00000e+00 0.00000e+00 4.62389e+01 281.465 5.21977e+00 101.465 0.6839 
1 1 1 3   34  15 f 0  6.20671e+00 1.61673e+00 1.89051e+02 12.809  1.02259e+01  2.32490e+00  0.00000e+00 0.00000e+00 3.14274e+01 12.809  1.57623e+02 192.809 0.9511 
1 1 1 3   34  16 f 0  5.70392e+00 1.61729e+00 8.72786e+01 48.444  3.37240e+00  3.80424e+00  0.00000e+00 0.00000e+00 1.03301e+02 48.444  1.60225e+01 48.444  0.8953 
1 1 1 3   34  17 o 8  5.24603e+00 1.68543e+00 1.19446e+02 282.629 1.42458e+00  -6.35828e+00 0.00000e+00 0.00000e+00 6.04527e+01 282.629 5.89935e+01 102.629 0.9197 
1 1 1 3   34  18 o 10 4.87563e+00 1.56655e+00 7.42847e+01 176.986 -4.39740e+00 2.31549e-01  0.00000e+00 0.00000e+00 8.50765e+01 176.986 1.07918e+01 176.986 0.8774 
1 1 1 3   35  0  o 5  1.91699e+01 3.97758e-01 3.41719e+02 114.639 -2.39968e+00 5.23183e+00  0.00000e+00 0.00000e+00 3.11935e+02 114.639 2.97844e+01 294.639 0.9084 
1 1 1 3   35  1  o 16 2.11981e+01 4.12187e-01 2.47507e+02 23.892  4.58596e+00  2.03148e+00  0.00000e+00 0.00000e+00 4.63715e+02 23.892  2.16208e+02 23.892  0.8937 
1 1 1 3   35  2  o 4  1.71892e+01 4.03796e-01 4.46617e+02 89.876  1.49116e-02  6.91572e+00  0.00000e+00 0.00000e+00 1.50013e+02 89.876  2.96604e+02 269.876 0.9246 
1 1 1 3   35  3  o 6  1.84898e+01 3.98855e-01 2.74899e+02 125.005 -3.03104e+00 4.32790e+00  0.00000e+00 0.00000e+00 3.49498e+02 125.005 7.45987e+01 125.005 0.8996 
1 1 1 3   35  4  o 16 2.09894e+01 5.59613e-01 5.83836e+02 319.555 1.21984e+01  -1.03980e+01 0.00000e+00 0.00000e+00 1.79044e+02 319.555 4.04792e+02 139.555 0.9683 
1 1 1 3   35  5  o 6  1.48703e+01 4.25929e-01 2.90768e+02 127.832 -3.40918e+00 4.38999e+00  0.00000e+00 0.00000e+00 2.14248e+02 127.832 7.65199e+01 307.832 0.9049 
1 1 1 3   35  6  o 9  2.53391e+01 5.42233e-01 5.52760e+02 64.918  9.18257e+00  1.96189e+01  0.00000e+00 0.00000e+00 3.75816e+02 64.918  1.76944e+02 244.918 0.9766 
1 1 1 3   35  7  o 17 1.40142e+01 5.74173e-01 3.40473e+02 214.680 -8.21581e+00 -5.68458e+00 0.00000e+00 0.00000e+00 1.58183e+02 214.680 1.82290e+02 34.680  0.9486 
1 1 1 3   35  8  f 0  1.80813e+01 6.30615e-01 2.43596e+02 324.004 9.49729e+00  -6.89914e+00 0.00000e+00 0.00000e+00 4.04887e+02 324.004 1.61291e+02 324.004 0.9564 
1 1 1 3   35  9  o 16 1.45949e+01 6.32610e-01 2.76912e+02 330.481 1.12474e+01  -6.36848e+00 0.00000e+00 0.00000e+00 2.48563e+02 330.481 2.83491e+01 150.481 0.9605 
1 1 1 3   35  10 o 9  3.11442e+01 7.18467e-01 5.33715e+02 216.961 -5.60276e+01 -4.21596e+01 0.00000e+00 0.00000e+00 6.24826e+02 216.961 9.11115e+01 216.961 0.9928 
1 1 1 3   35  11 o 12 2.49110e+01 7.01487e-01 4.14814e+02 315.638 4.32200e+01  -4.22682e+01 0.00000e+00 0.00000e+00 5.10300e+02 315.638 9.54858e+01 315.638 0.9917 
1 1 1 3   35  12 o 15 1.37518e+01 8.35144e-01 2.63106e+02 166.090 -2.45221e+01 6.07318e+00  0.00000e+00 0.00000e+00 2.41278e+02 166.090 2.18287e+01 346.090 0.9800 
1 1 1 3   35  13 o 15 7.13482e+00 1.28037e+00 6.43649e+01 201.622 -3.36481e+00 -1.33371e+00 0.00000e+00 0.00000e+00 1.61692e+02 201.622 9.73270e+01 201.622 0.8471 
1 1 1 3   35  14 o 7  8.79315e+00 1.48395e+00 2.22712e+02 340.022 1.62372e+01  -5.90279e+00 0.00000e+00 0.00000e+00 9.62804e+01 340.022 1.26432e+02 160.022 0.9706 
1 1 1 3   35  15 o 6  9.82673e+00 1.63861e+00 1.06663e+02 250.733 -3.16753e+00 -9.06177e+00 0.00000e+00 0.00000e+00 2.40661e+02 250.733 1.33998e+02 250.733 0.9464 
1 1 1 3   35  16 f 0  5.19591e+00 1.64522e+00 3.40337e+01 186.492 -1.67969e+00 -1.91140e-01 0.00000e+00 0.00000e+00 9.00238e+01 186.492 5.59901e+01 186.492 0.6398 
1 1 1 3   35  17 o 3  6.19374e+00 1.87109e+00 1.23244e+02 348.844 6.89786e+00  -1.36028e+00 0.00000e+00 0.00000e+00 9.05608e+01 348.844 3.26832e+01 168.844 0.9259 
1 1 1 3   35  18 o 14 5.14082e+00 1.59547e+00 6.34335e+01 11.197  3.79186e+00  7.50629e-01  0.00000e+00 0.00000e+00 1.00887e+02 11.197  3.74539e+01 11.197  0.8581 
1 1 1 3   36  0  o 6  2.61303e+01 4.27610e-01 6.74632e+02 76.139  4.01028e+00  1.62520e+01  0.00000e+00 0.00000e+00 2.76356e+02 76.139  3.98276e+02 256.139 0.9697 
1 1 1 3   36  1  o 2  3.14020e+01 5.38375e-01 7.36700e+02 288.457 6.63699e+00  -1.98851e+01 0.00000e+00 0.00000e+00 4.13551e+02 288.457 3.23150e+02 108.457 0.9758 
1 1 1 3   36  2  o 8  2.30016e+01 4.39709e-01 5.09147e+02 30.195  1.07338e+01  6.24594e+00  0.00000e+00 0.00000e+00 3.18747e+02 30.195  1.90400e+02 210.195 0.9589 
1 1 1 3   36  3  o 7  5.69274e+00 3.90162e-01 8.28989e+01 354.973 5.64307e-01  -4.96333e-02 0.00000e+00 0.00000e+00 2.46792e+01 174.973 1.07578e+02 174.973 0.2725 
1 1 1 3   36  4  o 15 2.10900e+01 6.09413e-01 1.74948e+02 87.072  2.23346e-01  4.36665e+00  0.00000e+00 0.00000e+00 5.18823e+02 87.072  3.43876e+02 87.072  0.8765 
1 1 1 3   36  5  o 17 1.71863e+01 5.07867e-01 3.74316e+02 279.259 1.31840e+00  -8.08713e+00 0.00000e+00 0.00000e+00 2.29890e+02 279.259 1.44425e+02 99.259  0.9368 
1 1 1 3   36  6  o 12 2.76104e+01 6.51054e-01 3.34728e+02 276.658 2.01881e+00  -1.72942e+01 0.00000e+00 0.00000e+00 6.70980e+02 276.658 3.36251e+02 276.658 0.9708 
1 1 1 3   36  7  o 11 4.97869e+01 8.95224e-01 1.02301e+03 45.928  7.26058e+01  7.49979e+01  0.00000e+00 0.00000e+00 8.35458e+02 45.928  1.87553e+02 225.928 0.9952 
1 1 1 3   36  8  o 11 2.95675e+01 6.36196e-01 4.15167e+02 243.533 -1.45251e+01 -2.91757e+01 0.00000e+00 0.00000e+00 6.76349e+02 243.533 2.61183e+02 243.533 0.9845 
1 1 1 3   36  9  o 6  2.67369e+01 8.19101e-01 3.95519e+02 74.399  8.64579e+00  3.09640e+01  0.00000e+00 0.00000e+00 5.90895e+02 74.399  1.95376e+02 74.399  0.9843 
1 1 1 3   36  10 o 3  1.34975e+01 8.39852e-01 2.96397e+02 218.090 -1.30271e+01 -1.02110e+01 0.00000e+00 0.00000e+00 1.93748e+02 218.090 1.02649e+02 38.090  0.9693 
1 1 1 3   36  11 o 17 1.58139e+01 7.35291e-01 2.61482e+02 128.669 -1.44309e+01 1.80326e+01  0.00000e+00 0.00000e+00 3.17692e+02 128.669 5.62101e+01 128.669 0.9781 
1 1 1 3   36  12 o 12 1.71666e+01 7.79623e-01 2.34023e+02 9.536   2.94956e+01  4.95469e+00  0.00000e+00 0.00000e+00 3.97562e+02 9.536   1.63539e+02 9.536   0.9831 
1 1 1 3   36  13 o 9  5.59580e+00 1.21218e+00 9.07641e+01 91.931  -1.38488e-01 4.10676e+00  0.00000e+00 0.00000e+00 9.07996e+01 91.931  3.54756e-02 91.931  0.8676 
1 1 1 3   36  14 o 19 4.93764e+00 1.38890e+00 1.08836e+02 41.014  3.86938e+00  3.36526e+00  0.00000e+00 0.00000e+00 5.65529e+01 41.014  5.22830e+01 221.014 0.8963 
1 1 1 3   36  15 o 1  4.63796e+00 1.42479e+00 8.09290e+01 1.719   3.80290e+00  1.14134e-01  0.00000e+00 0.00000e+00 6.72528e+01 1.719   1.36762e+01 181.719 0.8556 
1 1 1 3   36  16 o 8  6.29301e+00 1.79741e+00 1.12574e+02 42.489  4.83032e+00  4.42453e+00  0.00000e+00 0.00000e+00 1.03483e+02 42.489  9.09134e+00 222.489 0.9201 
1 1 1 3   36  17 o 3  4.97969e+00 1.64000e+00 9.95557e+01 344.923 5.07604e+00  -1.36746e+00 0.00000e+00 0.00000e+00 6.73390e+01 344.923 3.22167e+01 164.923 0.8990 
1 1 1 3   36  18 o 6  4.41039e+00 1.46316e+00 4.97015e+01 80.975  4.47052e-01  2.81448e+00  0.00000e+00 0.00000e+00 8.14174e+01 80.975  3.17159e+01 80.975  0.7982 
1 1 1 3   37  0  o 16 1.86345e+01 3.50863e-01 3.84609e+02 170.770 -6.38778e+00 1.03801e+00  0.00000e+00 0.00000e+00 2.58164e+02 170.770 1.26445e+02 350.770 0.9191 
1 1 1 3   37  1  o 12 1.40996e+01 3.44691e-01 1.50561e+02 6.148   2.25699e+00  2.43113e-01  0.00000e+00 0.00000e+00 2.39715e+02 6.148   8.91539e+01 6.148   0.7375 
1 1 1 3   37  2  o 10 1.69294e+01 4.17297e-01 2.76178e+02 178.389 -4.88058e+00 1.37265e-01  0.00000e+00 0.00000e+00 2.89720e+02 178.389 1.35422e+01 178.389 0.8906 
1 1 1 3   37  3  o 5  7.12077e+00 3.70818e-01 2.27574e+02 131.440 -1.18792e+00 1.34555e+00  0.00000e+00 0.00000e+00 5.09022e+01 311.440 2.78476e+02 311.440 0.6610 
1 1 1 3   37  4  o 16 1.54576e+01 5.07992e-01 1.93839e+02 81.583  5.39832e-01  3.64814e+00  0.00000e+00 0.00000e+00 2.99454e+02 81.583  1.05615e+02 81.583  0.8503 
1 1 1 3   37  5  o 11 4.46255e+01 8.00822e-01 8.43874e+02 359.395 4.91695e+01  -5.19107e-01 0.00000e+00 0.00000e+00 8.13504e+02 359.395 3.03707e+01 179.395 0.9898 
1 1 1 3   37  6  o 2  2.10929e+01 5.63499e-01 3.04768e+02 171.510 -1.11836e+01 1.66946e+00  0.00000e+00 0.00000e+00 4.50691e+02 171.510 1.45923e+02 171.510 0.9547 
1 1 1 3   37  7  o 17 2.58560e+01 5.77918e-01 4.78446e+02 312.769 1.82521e+01  -1.97320e+01 0.00000e+00 0.00000e+00 4.73064e+02 312.769 5.38138e+00 132.769 0.9812 
1 1 1 3   37  8  o 9  3.59032e+01 1.04301e+00 5.07310e+02 176.086 -4.56228e+01 3.12142e+00  0.00000e+00 0.00000e+00 8.23978e+02 176.086 3.16667e+02 176.086 0.9890 
1 1 1 3   37  9  o 18 1.29719e+01 6.64432e-01 1.84100e+02 128.013 -4.66755e+00 5.97136e+00  0.00000e+00 0.00000e+00 2.68740e+02 128.013 8.46400e+01 128.013 0.9315 
1 1 1 3   37  10 o 4  1.37483e+01 7.25855e-01 1.70765e+02 178.761 -1.01353e+01 2.19261e-01  0.00000e+00 0.00000e+00 3.18144e+02 178.761 1.47378e+02 178.761 0.9493 
1 1 1 3   37  11 o 1  2.19553e+01 7.10585e-01 4.07654e+02 177.377 -5.04895e+01 2.31304e+00  0.00000e+00 0.00000e+00 4.06189e+02 177.377 1.46479e+00 357.377 0.9901 
1 1 1 3   37  12 o 4  5.67075e+00 1.18050e+00 8.54203e+01 264.534 -3.31513e-01 -3.46481e+00 0.00000e+00 0.00000e+00 9.28392e+01 264.534 7.41892e+00 264.534 0.8401 
1 1 1 3   37  13 o 6  4.74707e+00 1.16557e+00 1.47493e+02 341.661 5.45663e+00  -1.80867e+00 0.00000e+00 0.00000e+00 1.37382e+01 341.661 1.33754e+02 161.662 0.9083 
1 1 1 3   37  14 o 16 1.11120e+01 1.40467e+00 2.06955e+02 191.503 -2.12945e+01 -4.33345e+00 0.00000e+00 0.00000e+00 1.98614e+02 191.503 8.34083e+00 11.503  0.9767 
1 1 1 3   37  15 o 9  7.44959e+00 1.66936e+00 1.02719e+02 198.798 -6.35291e+00 -2.16240e+00 0.00000e+00 0.00000e+00 1.53793e+02 198.798 5.10737e+01 198.798 0.9222 
1 1 1 3   37  16 o 2  5.80864e+00 1.78226e+00 1.26152e+02 355.715 6.58038e+00  -4.93093e-01 0.00000e+00 0.00000e+00 7.33900e+01 355.715 5.27616e+01 175.715 0.9208 
1 1 1 3   37  17 o 3  4.36653e+00 1.46419e+00 1.39169e+02 277.439 9.70183e-01  -7.43041e+00 0.00000e+00 0.00000e+00 1.23114e+01 277.439 1.26857e+02 97.439  0.9307 
1 1 1 3   37  18 o 12 6.49731e+00 1.74898e+00 9.22634e+01 201.087 -6.19008e+00 -2.38699e+00 0.00000e+00 0.00000e+00 1.30635e+02 201.087 3.83714e+01 201.087 0.9212 
1 1 1 3   38  0  o 14 1.46149e+01 3.19724e-01 1.96546e+02 253.022 -8.91685e-01 -2.92065e+00 0.00000e+00 0.00000e+00 2.49808e+02 253.022 5.32625e+01 253.022 0.8139 
1 1 1 3   38  1  o 7  1.81367e+01 3.72734e-01 3.75117e+02 45.494  5.02410e+00  5.11147e+00  0.00000e+00 0.00000e+00 2.56082e+02 45.494  1.19035e+02 225.494 0.9274 
1 1 1 3   38  2  o 13 2.22834e+01 4.34111e-01 2.95277e+02 9.754   7.80734e+00  1.34217e+00  0.00000e+00 0.00000e+00 4.86295e+02 9.754   1.91019e+02 9.754   0.9346 
1 1 1 3   38  3  o 4  2.45607e+01 4.91001e-01 3.24064e+02 133.887 -7.24488e+00 7.53186e+00  0.00000e+00 0.00000e+00 5.52392e+02 133.887 2.28328e+02 133.887 0.9509 
1 1 1 3   38  4  o 19 9.45226e+00 4.10159e-01 2.76094e+02 358.193 3.41382e+00  -1.07687e-01 0.00000e+00 0.00000e+00 2.06335e+01 358.193 2.55461e+02 178.193 0.8366 
1 1 1 3   38  5  o 6  2.14653e+01 5.57165e-01 2.75898e+02 90.214  -2.99562e-02 8.02337e+00  0.00000e+00 0.00000e+00 4.77467e+02 90.214  2.01569e+02 90.214  0.9354 
1 1 1 3   38  6  o 16 1.32431e+01 4.68026e-01 1.89910e+02 22.622  4.07112e+00  1.69648e+00  0.00000e+00 0.00000e+00 2.46070e+02 22.622  5.61590e+01 22.622  0.8776 
1 1 1 3   38  7  o 10 2.12908e+01 5.36997e-01 5.27939e+02 129.375 -1.54508e+01 1.88266e+01  0.00000e+00 0.00000e+00 2.53919e+02 129.375 2.74020e+02 309.375 0.9793 
1 1 1 3   38  8  o 12 1.75163e+01 5.65239e-01 3.67644e+02 214.695 -1.44898e+01 -1.00315e+01 0.00000e+00 0.00000e+00 2.70100e+02 214.695 9.75441e+01 34.695  0.9712 
1 1 1 3   38  9  o 17 6.84498e+00 9.48647e-01 2.84145e+02 83.643  6.85132e-01  6.14945e+00  0.00000e+00 0.00000e+00 4.93983e+01 263.643 3.33543e+02 263.643 0.9152 
1 1 1 3   38  10 o 13 1.88496e+01 6.64310e-01 5.30835e+02 290.352 1.58132e+01  -4.26290e+01 0.00000e+00 0.00000e+00 1.67389e+02 290.352 3.63446e+02 110.352 0.9889 
1 1 1 3   38  11 o 11 9.77592e+00 9.21167e-01 1.23113e+02 88.695  1.58485e-01  6.95932e+00  0.00000e+00 0.00000e+00 2.15451e+02 88.695  9.23383e+01 88.695  0.9251 
1 1 1 3   38  12 o 6  8.28698e+00 1.04142e+00 1.56589e+02 359.448 9.23157e+00  -8.88859e-02 0.00000e+00 0.00000e+00 1.36159e+02 359.448 2.04304e+01 179.448 0.9442 
1 1 1 3   38  13 o 8  7.59768e+00 1.40588e+00 1.56540e+02 308.602 6.02045e+00  -7.54110e+00 0.00000e+00 0.00000e+00 1.12394e+02 308.602 4.41459e+01 128.602 0.9467 
1 1 1 3   38  14 o 4  5.43898e+00 1.45622e+00 1.25595e+02 167.356 -5.88482e+00 1.32020e+00  0.00000e+00 0.00000e+00 5.99164e+01 167.356 6.56788e+01 347.356 0.9128 
1 1 1 3   38  15 o 15 7.64217e+00 1.75168e+00 1.74167e+02 26.052  1.08240e+01  5.29142e+00  0.00000e+00 0.00000e+00 9.90501e+01 26.052  7.51165e+01 206.052 0.9576 
1 1 1 3   38  16 o 14 1.11177e+01 2.03800e+00 1.92239e+02 14.431  1.59979e+01  4.11677e+00  0.00000e+00 0.00000e+00 2.09752e+02 14.431  1.75129e+01 14.431  0.9692 
1 1 1 3   38  17 o 13 7.41625e+00 1.73487e+00 1.02441e+02 348.593 7.27724e+00  -1.46832e+00 0.00000e+00 0.00000e+00 1.54623e+02 348.593 5.21814e+01 348.593 0.9300 
1 1 1 3   38  18 o 17 5.92641e+00 1.67976e+00 8.21802e+01 165.465 -5.45623e+00 1.41461e+00  0.00000e+00 0.00000e+00 1.17825e+02 165.465 3.56449e+01 165.465 0.9063 
1 1 1 3   39  0  o 4  1.16438e+01 3.06594e-01 1.04118e+02 12.441  1.23810e+00  2.73152e-01  0.00000e+00 0.00000e+00 1.28877e+02 12.441  2.47589e+01 12.441  0.5333 
1 1 1 3   39  1  o 1  4.47244e+01 7.01963e-01 9.19766e+02 119.198 -2.06611e+01 3.69712e+01  0.00000e+00 0.00000e+00 7.38572e+02 119.198 1.81193e+02 299.198 0.9881 
1 1 1 3   39  2  o 10 1.90053e+01 4.02449e-01 5.06009e+02 309.854 6.84139e+00  -8.19560e+00 0.00000e+00 0.00000e+00 1.72909e+02 309.854 3.33100e+02 129.854 0.9519 
1 1 1 3   39  3  o 7  4.65882e+01 7.56788e-01 8.13497e+02 66.591  1.77850e+01  4.10805e+01  0.00000e+00 0.00000e+00 9.15072e+02 66.591  1.01575e+02 66.591  0.9888 
1 1 1 3   39  4  o 7  2.98932e+01 5.41525e-01 4.37375e+02 249.187 -6.01586e+00 -1.58260e+01 0.00000e+00 0.00000e+00 6.50609e+02 249.187 2.13234e+02 249.187 0.9700 
1 1 1 3   39  5  o 12 1.92219e+01 4.71651e-01 1.93679e+02 146.868 -4.95518e+00 3.23420e+00  0.00000e+00 0.00000e+00 4.63299e+02 146.868 2.69620e+02 146.868 0.9111 
1 1 1 3   39  6  o 18 1.54652e+01 5.05377e-01 1.74103e+02 144.671 -3.74506e+00 2.65447e+00  0.00000e+00 0.00000e+00 3.38046e+02 144.671 1.63943e+02 144.671 0.8829 
1 1 1 3   39  7  f 0  1.93281e+01 5.21414e-01 2.60048e+02 100.232 -1.97841e+00 1.09599e+01  0.00000e+00 0.00000e+00 4.31353e+02 100.232 1.71306e+02 100.232 0.9540 
1 1 1 3   39  8  o 10 2.87890e+01 6.41483e-01 4.12070e+02 24.536  3.00413e+01  1.37136e+01  0.00000e+00 0.00000e+00 6.50599e+02 24.536  2.38529e+02 24.536  0.9847 
1 1 1 3   39  9  o 18 1.60807e+01 6.33256e-01 4.24641e+02 272.424 1.02185e+00  -2.41411e+01 0.00000e+00 0.00000e+00 1.65289e+02 272.424 2.59352e+02 92.424  0.9791 
1 1 1 3   39  10 o 7  1.10808e+01 7.66254e-01 1.01716e+02 317.742 3.94460e+00  -3.58402e+00 0.00000e+00 0.00000e+00 2.71993e+02 317.742 1.70277e+02 317.742 0.9005 
1 1 1 3   39  11 o 19 3.15257e+01 8.61657e-01 6.15240e+02 115.749 -5.02184e+01 1.04118e+02  0.00000e+00 0.00000e+00 5.59733e+02 115.749 5.55072e+01 295.749 0.9957 
1 1 1 3   39  12 o 3  6.43366e+00 1.17192e+00 4.34114e+01 358.118 2.06056e+00  -6.77107e-02 0.00000e+00 0.00000e+00 1.26911e+02 358.118 8.34998e+01 358.118 0.7076 
1 1 1 3   39  13 f 0  5.88702e+00 1.38547e+00 1.15895e+02 234.541 -3.19390e+00 -4.48454e+00 0.00000e+00 0.00000e+00 8.30563e+01 234.541 3.28383e+01 54.541  0.9039 
1 1 1 3   39  14 o 5  1.35043e+01 1.21151e+00 2.44129e+02 166.518 -3.41827e+01 8.19535e+00  0.00000e+00 0.00000e+00 2.53171e+02 166.518 9.04202e+00 166.518 0.9857 
1 1 1 3   39  15 o 5  6.10422e+00 1.69302e+00 1.07429e+02 153.372 -5.41184e+00 2.71334e+00  0.00000e+00 0.00000e+00 1.00671e+02 153.372 6.75725e+00 333.372 0.9132 
1 1 1 3   39  16 o 17 6.84146e+00 1.74664e+00 7.53710e+01 84.173  5.03599e-01  4.93512e+00  0.00000e+00 0.00000e+00 1.52381e+02 84.173  7.70099e+01 84.173  0.8925 
1 1 1 3   39  17 o 11 7.30419e+00 1.72455e+00 1.33143e+02 283.476 2.30418e+00  -9.61533e+00 0.00000e+00 0.00000e+00 1.24913e+02 283.476 8.23002e+00 103.476 0.9480 
1 1 1 3   39  18 o 15 6.70519e+00 1.82762e+00 8.29267e+01 117.042 -2.63891e+00 5.16979e+00  0.00000e+00 0.00000e+00 1.44059e+02 117.042 6.11323e+01 117.042 0.9092 
1 1 1 3   40  0  o 14 1.35743e+01 3.13837e-01 4.80433e+02 102.416 -1.69026e+00 7.67770e+00  0.00000e+00 0.00000e+00 4.75038e+00 282.416 4.85183e+02 282.416 0.9340 
1 1 1 3   40  1  o 8  1.31092e+01 4.66594e-01 1.00608e+02 138.781 -1.18407e+00 1.03728e+00  0.00000e+00 0.00000e+00 2.01366e+02 138.781 1.00758e+02 138.781 0.6139 
1 1 1 3   40  2  o 10 3.79649e+01 6.13255e-01 6.09648e+02 14.953  2.93243e+01  7.83185e+00  0.00000e+00 0.00000e+00 7.91196e+02 14.953  1.81548e+02 14.953  0.9834 
1 1 1 3   40  3  o 13 3.54070e+01 6.05237e-01 6.65854e+02 137.012 -2.11791e+01 1.97418e+01  0.00000e+00 0.00000e+00 6.39490e+02 137.012 2.63645e+01 317.012 0.9826 
1 1 1 3   40  4  o 3  1.23139e+01 3.91788e-01 1.49454e+02 230.538 -1.49238e+00 -1.81288e+00 0.00000e+00 0.00000e+00 1.95838e+02 230.538 4.63835e+01 230.538 0.7474 
1 1 1 3   40  5  f 0  1.46126e+01 5.14382e-01 7.45711e+01 56.261  9.35468e-01  1.40063e+00  0.00000e+00 0.00000e+00 2.75417e+02 56.261  2.00846e+02 56.261  0.6385 
1 1 1 3   40  6  o 15 3.49996e+01 6.75102e-01 5.62272e+02 122.192 -1.78769e+01 2.83966e+01  0.00000e+00 0.00000e+00 7.30617e+02 122.192 1.68345e+02 122.192 0.9850 
1 1 1 3   40  7  o 3  1.50656e+01 6.93936e-01 1.12920e+02 260.067 -7.09937e-01 -4.05394e+00 0.00000e+00 0.00000e+00 3.77275e+02 260.067 2.64356e+02 260.067 0.8678 
1 1 1 3   40  8  o 5  2.64857e+01 6.18830e-01 5.96507e+02 45.056  3.35199e+01  3.35859e+01  0.00000e+00 0.00000e+00 3.85666e+02 45.056  2.10840e+02 225.056 0.9894 
1 1 1 3   40  9  o 2  3.32851e+01 7.21100e-01 5.89625e+02 183.404 -6.67958e+01 -3.97331e+00 0.00000e+00 0.00000e+00 6.48060e+02 183.404 5.84349e+01 183.404 0.9925 
1 1 1 3   40  10 o 19 6.39905e+00 1.07274e+00 2.01723e+02 337.065 5.23366e+00  -2.21453e+00 0.00000e+00 0.00000e+00 1.56552e+01 337.065 1.86068e+02 157.065 0.9071 
1 1 1 3   40  11 o 10 8.97114e+00 1.18318e+00 6.95228e+01 234.036 -2.20777e+00 -3.04270e+00 0.00000e+00 0.00000e+00 2.17091e+02 234.036 1.47568e+02 234.036 0.8536 
1 1 1 3   40  12 o 19 1.14818e+01 8.77639e-01 1.65777e+02 63.966  6.80329e+00  1.39277e+01  0.00000e+00 0.00000e+00 2.49626e+02 63.966  8.38496e+01 63.966  0.9672 
1 1 1 3   40  13 o 14 4.43292e+00 1.27482e+00 4.88819e+01 188.617 -1.87612e+00 -2.84316e-01 0.00000e+00 0.00000e+00 6.38389e+01 188.617 1.49569e+01 188.617 0.6802 
1 1 1 3   40  14 o 10 1.08526e+01 1.23135e+00 1.47202e+02 112.595 -6.47133e+00 1.55503e+01  0.00000e+00 0.00000e+00 2.45987e+02 112.595 9.87855e+01 112.595 0.9698 
1 1 1 3   40  15 o 1  5.51680e+00 1.58939e+00 1.06442e+02 9.959   5.69401e+00  9.99787e-01  0.00000e+00 0.00000e+00 8.07113e+01 9.959   2.57308e+01 189.959 0.9088 
1 1 1 3   40  16 o 6  7.38553e+00 1.93327e+00 1.85243e+02 7.302   1.15981e+01  1.48624e+00  0.00000e+00 0.00000e+00 7.81601e+01 7.302   1.07083e+02 187.302 0.9562 
1 1 1 3   40  17 f 0  7.03271e+00 1.75954e+00 5.75405e+01 178.205 -4.06064e+00 1.27246e-01  0.00000e+00 0.00000e+00 1.69380e+02 178.205 1.11840e+02 178.205 0.8659 
1 1 1 3   40  18 o 15 1.10255e+01 1.94900e+00 1.80704e+02 57.323  1.02100e+01  1.59177e+01  0.00000e+00 0.00000e+00 2.18755e+02 57.323  3.80510e+01 57.323  0.9732 
1 1 1 3   41  0  o 10 1.10535e+01 4.44538e-01 3.55510e+01 322.197 3.43962e-01  -2.66837e-01 0.00000e+00 0.00000e+00 5.26313e+01 322.197 1.70803e+01 322.197 0.2127 
1 1 1 3   41  1  o 17 2.36759e+01 4.31954e-01 4.71941e+02 321.869 9.67719e+00  -7.59641e+00 0.00000e+00 0.00000e+00 3.79394e+02 321.869 9.25468e+01 141.869 0.9585 
1 1 1 3   41  2  o 7  1.55503e+01 3.62850e-01 7.25786e+02 351.449 1.33321e+01  -2.00457e+00 0.00000e+00 0.00000e+00 1.64448e+02 171.449 8.90234e+02 171.449 0.9622 
1 1 1 3   41  3  o 6  2.04736e+01 4.55055e-01 4.62324e+02 354.301 1.23101e+01  -1.22844e+00 0.00000e+00 0.00000e+00 2.74041e+02 354.301 1.88283e+02 174.301 0.9587 
1 1 1 3   41  4  o 15 1.24042e+01 4.95571e-01 2.32525e+02 311.405 2.51140e+00  -2.84813e+00 0.00000e+00 0.00000e+00 1.65436e+02 311.405 6.70892e+01 131.405 0.8552 
1 1 1 3   41  5  o 9  2.02167e+01 5.08895e-01 2.54095e+02 49.622  6.29162e+00  7.39844e+00  0.00000e+00 0.00000e+00 4.64008e+02 49.622  2.09913e+02 49.622  0.9470 
1 1 1 3   41  6  o 11 2.53059e+01 6.23448e-01 4.85013e+02 272.000 8.92777e-01  -2.55638e+01 0.00000e+00 0.00000e+00 4.45196e+02 272.000 3.98178e+01 92.000  0.9803 
1 1 1 3   41  7  o 5  1.55496e+01 5.93489e-01 3.60429e+02 117.927 -6.28539e+00 1.18573e+01  0.00000e+00 0.00000e+00 2.00347e+02 117.927 1.60082e+02 297.928 0.9620 
1 1 1 3   41  8  o 2  2.27304e+01 5.92469e-01 2.96473e+02 201.731 -1.79052e+01 -7.13662e+00 0.00000e+00 0.00000e+00 5.32975e+02 201.731 2.36502e+02 201.731 0.9737 
1 1 1 3   41  9  o 16 2.80133e+01 6.69855e-01 4.54139e+02 234.645 -2.85626e+01 -4.02584e+01 0.00000e+00 0.00000e+00 5.84587e+02 234.645 1.30449e+02 234.645 0.9898 
1 1 1 3   41  10 o 8  1.90639e+01 6.63483e-01 3.16522e+02 277.125 3.75152e+00  -3.00135e+01 0.00000e+00 0.00000e+00 3.85403e+02 277.125 6.88806e+01 277.125 0.9833 
1 1 1 3   41  11 o 2  2.10922e+01 6.99200e-01 3.07440e+02 224.912 -3.18390e+01 -3.17415e+01 0.00000e+00 0.00000e+00 4.73097e+02 224.912 1.65656e+02 224.912 0.9888 
1 1 1 3   41  12 o 16 1.41878e+01 8.21317e-01 1.82223e+02 276.747 2.63306e+00  -2.22569e+01 0.00000e+00 0.00000e+00 3.36463e+02 276.747 1.54240e+02 276.747 0.9774 
1 1 1 3   41  13 o 17 5.47246e+00 1.47391e+00 6.07717e+01 23.288  2.38929e+00  1.02837e+00  0.00000e+00 0.00000e+00 9.78738e+01 23.288  3.71021e+01 23.288  0.7756 
1 1 1 3   41  14 o 19 1.55388e+01 8.94202e-01 2.29539e+02 78.837  8.14021e+00  4.12505e+01  0.00000e+00 0.00000e+00 3.43927e+02 78.837  1.14388e+02 78.837  0.9880 
1 1 1 3   41  15 o 14 7.30044e+00 1.68954e+00 1.03009e+02 188.661 -6.89458e+00 -1.05020e+00 0.00000e+00 0.00000e+00 1.49101e+02 188.661 4.60923e+01 188.661 0.9252 
1 1 1 3   41  16 o 7  4.66880e+00 1.40733e+00 4.35034e+01 63.878  1.07810e+00  2.19851e+00  0.00000e+00 0.00000e+00 8.86992e+01 63.878  4.51957e+01 63.878  0.7593 
1 1 1 3   41  17 o 14 9.71869e+00 1.68959e+00 1.57987e+02 137.353 -1.19787e+01 1.10330e+01  0.00000e+00 0.00000e+00 1.92830e+02 137.353 3.48435e+01 137.353 0.9688 
1 1 1 3   41  18 f 0  6.99011e+00 1.85510e+00 6.14772e+01 87.946  1.56837e-01  4.37208e+00  0.00000e+00 0.00000e+00 1.66600e+02 87.946  1.05123e+02 87.946  0.8765 
1 1 1 3   42  0  o 7  2.56620e+01 4.26885e-01 5.11762e+02 86.139  1.16307e+00  1.72332e+01  0.00000e+00 0.00000e+00 4.22496e+02 86.139  8.92662e+01 266.139 0.9706 
1 1 1 3   42  1  f 0  1.09114e+01 3.29435e-01 3.72824e+02 59.763  2.68276e+00  4.60268e+00  0.00000e+00 0.00000e+00 4.25369e+00 239.763 3.77078e+02 239.763 0.9005 
1 1 1 3   42  2  o 16 2.19736e+01 4.23697e-01 3.63182e+02 93.426  -5.88698e-01 9.83266e+00  0.00000e+00 0.00000e+00 4.18088e+02 93.426  5.49056e+01 93.426  0.9478 
1 1 1 3   42  3  o 16 6.58988e+00 3.98493e-01 1.38926e+02 196.625 -1.12717e+00 -3.36555e-01 0.00000e+00 0.00000e+00 1.39924e+01 16.625  1.52918e+02 16.625  0.5054 
1 1 1 3   42  4  o 15 1.09784e+01 4.18594e-01 2.75982e+02 53.394  2.45114e+00  3.29979e+00  0.00000e+00 0.00000e+00 8.12997e+01 53.394  1.94683e+02 233.394 0.8676 
1 1 1 3   42  5  o 13 3.07194e+01 6.12062e-01 5.65609e+02 217.935 -2.39862e+01 -1.86966e+01 0.00000e+00 0.00000e+00 5.67355e+02 217.935 1.74620e+00 217.935 0.9834 
1 1 1 3   42  6  o 7  2.30559e+01 5.37166e-01 3.24346e+02 302.931 8.47477e+00  -1.30842e+01 0.00000e+00 0.00000e+00 5.11926e+02 302.931 1.87581e+02 302.931 0.9674 
1 1 1 3   42  7  o 8  2.45828e+01 5.73312e-01 4.62947e+02 119.427 -1.49120e+01 2.64356e+01  0.00000e+00 0.00000e+00 4.43218e+02 119.427 1.97297e+01 299.427 0.9834 
1 1 1 3   42  8  o 5  3.21791e+01 6.83896e-01 4.90037e+02 219.826 -3.85907e+01 -3.21820e+01 0.00000e+00 0.00000e+00 7.03712e+02 219.826 2.13675e+02 219.826 0.9900 
1 1 1 3   42  9  o 19 1.50319e+01 6.48323e-01 3.52363e+02 252.977 -6.61619e+00 -2.16096e+01 0.00000e+00 0.00000e+00 1.98084e+02 252.977 1.54279e+02 72.977  0.9776 
1 1 1 3   42  10 o 12 1.53634e+01 6.86115e-01 3.09360e+02 131.968 -1.70205e+01 1.89242e+01  0.00000e+00 0.00000e+00 2.54427e+02 131.968 5.49333e+01 311.968 0.9802 
1 1 1 3   42  11 o 10 8.86137e+00 9.26235e-01 1.60145e+02 53.050  5.93025e+00  7.88398e+00  0.00000e+00 0.00000e+00 1.54165e+02 53.050  5.98031e+00 233.050 0.9479 
1 1 1 3   42  12 o 2  4.18616e+00 1.15879e+00 8.88552e+01 25.339  2.62390e+00  1.24250e+00  0.00000e+00 0.00000e+00 3.67912e+01 25.339  5.20641e+01 205.339 0.8026 
1 1 1 3   42  13 o 14 6.22327e+00 1.21349e+00 1.52765e+02 40.228  6.61396e+00  5.59470e+00  0.00000e+00 0.00000e+00 6.59582e+01 40.228  8.68068e+01 220.228 0.9404 
1 1 1 3   42  14 o 2  4.88392e+00 1.49077e+00 1.18377e+02 32.854  4.56754e+00  2.94967e+00  0.00000e+00 0.00000e+00 4.62660e+01 32.854  7.21110e+01 212.854 0.9026 
1 1 1 3   42  15 o 2  6.22825e+00 1.70782e+00 8.30614e+01 116.372 -2.09804e+00 4.23171e+00  0.00000e+00 0.00000e+00 1.23003e+02 116.372 3.99413e+01 116.372 0.8865 
1 1 1 3   42  16 o 15 1.08680e+01 1.34975e+00 2.10426e+02 36.801  2.19507e+01  1.64215e+01  0.00000e+00 0.00000e+00 1.87368e+02 36.801  2.30578e+01 216.800 0.9816 
1 1 1 3   42  17 o 13 3.67169e+00 1.23325e+00 8.62384e+01 174.284 -4.58945e+00 4.59377e-01  0.00000e+00 0.00000e+00 3.46223e+01 174.284 5.16160e+01 354.284 0.8835 
1 1 1 3   42  18 o 8  1.23807e+01 1.81774e+00 1.92802e+02 310.795 1.67716e+01  -1.94332e+01 0.00000e+00 0.00000e+00 2.58946e+02 310.795 6.61441e+01 310.795 0.9803 
1 1 1 3   43  0  o 12 3.08973e+01 4.87672e-01 7.08532e+02 311.616 1.72855e+01  -1.94580e+01 0.00000e+00 0.00000e+00 4.27773e+02 311.616 2.80759e+02 131.616 0.9806 
1 1 1 3   43  1  o 12 5.40780e+01 7.81557e-01 1.04729e+03 290.360 2.30978e+01  -6.22416e+01 0.00000e+00 0.00000e+00 9.65723e+02 290.360 8.15715e+01 110.360 0.9924 
1 1 1 3   43  2  o 18 3.25342e+01 5.47722e-01 7.96199e+02 77.379  7.38218e+00  3.29694e+01  0.00000e+00 0.00000e+00 4.05926e+02 77.379  3.90273e+02 257.379 0.9851 
1 1 1 3   43  3  o 1  5.15572e+00 4.49583e-01 1.00359e+02 66.860  2.69723e-01  6.31132e-01  0.00000e+00 0.00000e+00 3.76200e+01 246.860 1.37979e+02 246.860 0.3244 
1 1 1 3   43  4  o 10 6.05309e+00 4.63833e-01 9.22929e+01 196.825 -8.47321e-01 -2.56218e-01 0.00000e+00 0.00000e+00 5.22934e-01 16.825  9.28158e+01 16.825  0.4042 
1 1 1 3   43  5  o 10 1.29776e+01 5.56827e-01 2.35208e+02 358.382 5.20651e+00  -1.47061e-01 0.00000e+00 0.00000e+00 2.01799e+02 358.382 3.34094e+01 178.382 0.8980 
1 1 1 3   43  6  o 1  2.59681e+01 5.32337e-01 5.10580e+02 185.331 -2.86378e+01 -2.67236e+00 0.00000e+00 0.00000e+00 4.45898e+02 185.331 6.46817e+01 5.331   0.9825 
1 1 1 3   43  7  o 13 1.87625e+01 5.36288e-01 2.68826e+02 36.193  1.06197e+01  7.77034e+00  0.00000e+00 0.00000e+00 4.07123e+02 36.193  1.38297e+02 36.193  0.9612 
1 1 1 3   43  8  o 17 1.16859e+01 6.37610e-01 2.41955e+02 62.240  4.06335e+00  7.71986e+00  0.00000e+00 0.00000e+00 1.69970e+02 62.240  7.19850e+01 242.240 0.9408 
1 1 1 3   43  9  o 13 7.28073e+00 9.35773e-01 1.65986e+02 37.979  3.90101e+00  3.04548e+00  0.00000e+00 0.00000e+00 7.72969e+01 37.979  8.86895e+01 217.979 0.8922 
1 1 1 3   43  10 o 2  2.57619e+01 6.87534e-01 3.86163e+02 124.813 -3.33707e+01 4.79913e+01  0.00000e+00 0.00000e+00 5.69958e+02 124.813 1.83795e+02 124.813 0.9914 
1 1 1 3   43  11 o 7  3.53341e+01 8.00451e-01 6.01490e+02 109.720 -5.15207e+01 1.43734e+02  0.00000e+00 0.00000e+00 7.16227e+02 109.720 1.14737e+02 109.720 0.9967 
1 1 1 3   43  12 o 18 6.92657e+00 1.18224e+00 7.15974e+01 331.343 3.36539e+00  -1.83919e+00 0.00000e+00 0.00000e+00 1.50343e+02 331.343 7.87456e+01 331.343 0.8569 
1 1 1 3   43  13 o 8  4.00680e+00 1.14990e+00 4.03470e+01 27.057  1.27372e+00  6.50588e-01  0.00000e+00 0.00000e+00 4.62611e+01 27.057  5.91411e+00 27.057  0.5784 
1 1 1 3   43  14 o 3  1.06641e+01 1.52492e+00 1.67572e+02 356.837 1.65442e+01  -9.14260e-01 0.00000e+00 0.00000e+00 2.18454e+02 356.837 5.08822e+01 356.837 0.9693 
1 1 1 3   43  15 o 7  4.65802e+00 1.41862e+00 1.35968e+02 109.789 -2.32202e+00 6.45358e+00  0.00000e+00 0.00000e+00 2.46225e+01 109.789 1.11345e+02 289.789 0.9239 
1 1 1 3   43  16 o 19 4.51417e+00 1.34817e+00 1.61369e+01 248.601 -3.38916e-01 -8.64858e-01 0.00000e+00 0.00000e+00 5.46580e+01 248.601 3.85211e+01 248.601 0.4206 
1 1 1 3   43  17 o 6  4.80872e+00 1.47820e+00 5.65739e+01 265.436 -2.69994e-01 -3.38203e+00 0.00000e+00 0.00000e+00 9.30544e+01 265.436 3.64806e+01 265.436 0.8353 
1 1 1 3   43  18 o 13 6.60381e+00 1.89391e+00 1.76205e+02 38.087  9.32160e+00  7.30571e+00  0.00000e+00 0.00000e+00 5.89454e+01 38.087  1.17260e+02 218.087 0.9568 
1 1 1 3   44  0  o 5  3.71584e+01 5.63650e-01 7.20588e+02 357.531 3.28304e+01  -1.41574e+00 0.00000e+00 0.00000e+00 6.51482e+02 357.531 6.91057e+01 177.531 0.9847 
1 1 1 3   44  1  o 11 2.54735e+01 4.33916e-01 5.95155e+02 102.154 -3.90963e+00 1.81535e+01  0.00000e+00 0.00000e+00 3.34098e+02 102.154 2.61057e+02 282.154 0.9727 
1 1 1 3   44  2  o 16 3.81934e+01 6.20170e-01 8.56983e+02 164.484 -4.02959e+01 1.11869e+01  0.00000e+00 0.00000e+00 5.58212e+02 164.484 2.98771e+02 344.484 0.9880 
1 1 1 3   44  3  o 6  3.39612e+01 5.73753e-01 5.26528e+02 307.333 1.47315e+01  -1.93151e+01 0.00000e+00 0.00000e+00 7.20633e+02 307.333 1.94104e+02 307.333 0.9792 
1 1 1 3   44  4  o 8  3.11862e+01 5.44850e-01 5.10443e+02 119.544 -1.20796e+01 2.13120e+01  0.00000e+00 0.00000e+00 6.34912e+02 119.544 1.24469e+02 119.544 0.9794 
1 1 1 3   44  5  o 17 3.64870e+01 6.24159e-01 6.12883e+02 235.765 -2.15130e+01 -3.16141e+01 0.00000e+00 0.00000e+00 7.37152e+02 235.765 1.24269e+02 235.765 0.9868 
1 1 1 3   44  6  o 14 3.29828e+01 5.88215e-01 6.12088e+02 328.917 3.82034e+01  -2.30301e+01 0.00000e+00 0.00000e+00 6.10366e+02 328.917 1.72233e+00 148.917 0.9887 
1 1 1 3   44  7  o 13 1.22852e+01 7.65309e-01 1.89356e+02 341.020 5.93647e+00  -2.04178e+00 0.00000e+00 0.00000e+00 2.32584e+02 341.020 4.32285e+01 341.020 0.9165 
1 1 1 3   44  8  o 13 2.31100e+01 6.04017e-01 3.70458e+02 114.076 -1.11216e+01 2.48902e+01  0.00000e+00 0.00000e+00 4.79282e+02 114.076 1.08824e+02 114.076 0.9815 
1 1 1 3   44  9  o 2  3.16303e+01 7.06990e-01 5.08269e+02 244.443 -3.00705e+01 -6.28833e+01 0.00000e+00 0.00000e+00 6.67696e+02 244.443 1.59427e+02 244.443 0.9928 
1 1 1 3   44  10 o 9  5.38234e+00 1.00686e+00 1.53558e+02 258.993 -8.41290e-01 -4.32506e+00 0.00000e+00 0.00000e+00 2.32295e+01 258.993 1.30328e+02 78.993  0.8775 
1 1 1 3   44  11 o 2  3.10225e+01 7.24776e-01 5.93090e+02 33.597  1.09591e+02  7.28024e+01  0.00000e+00 0.00000e+00 5.63084e+02 33.597  3.00056e+01 213.596 0.9962 
1 1 1 3   44  12 o 15 1.40479e+01 1.16965e+00 2.13632e+02 107.919 -7.51042e+00 2.32270e+01  0.00000e+00 0.00000e+00 3.00740e+02 107.919 8.71077e+01 107.919 0.9793 
1 1 1 3   44  13 o 18 5.84062e+00 1.20255e+00 1.47893e+02 82.209  1.08561e+00  7.93449e+00  0.00000e+00 0.00000e+00 5.62267e+01 82.209  9.16659e+01 262.209 0.9353 
1 1 1 3   44  14 o 14 4.97323e+00 1.48512e+00 6.79310e+01 26.032  2.94815e+00  1.43998e+00  0.00000e+00 0.00000e+00 8.59728e+01 26.032  1.80418e+01 26.032  0.8288 
1 1 1 3   44  15 o 3  1.33219e+01 1.36906e+00 1.96576e+02 329.177 2.50470e+01  -1.49444e+01 0.00000e+00 0.00000e+00 2.91875e+02 329.177 9.52989e+01 329.177 0.9827 
1 1 1 3   44  16 o 18 4.14899e+00 1.30342e+00 5.69984e+01 160.030 -3.01656e+00 1.09617e+00  0.00000e+00 0.00000e+00 7.05082e+01 160.030 1.35098e+01 160.030 0.8244 
1 1 1 3   44  17 o 5  8.31650e+00 1.75077e+00 1.20931e+02 59.440  5.42817e+00  9.19310e+00  0.00000e+00 0.00000e+00 1.73948e+02 59.440  5.30169e+01 59.440  0.9519 
1 1 1 3   44  18 o 11 8.24857e+00 2.00150e+00 1.11915e+02 321.724 7.02175e+00  -5.54074e+00 0.00000e+00 0.00000e+00 1.77323e+02 321.724 6.54072e+01 321.724 0.9423 
1 1 1 3   45  0  o 14 2.70567e+01 4.47662e-01 3.94838e+02 194.181 -1.35062e+01 -3.41290e+00 0.00000e+00 0.00000e+00 5.82545e+02 194.181 1.87707e+02 194.181 0.9634 
1 1 1 3   45  1  o 19 1.89605e+01 4.06820e-01 2.73888e+02 294.425 2.79070e+00  -6.14486e+00 0.00000e+00 0.00000e+00 3.82087e+02 294.425 1.08199e+02 294.425 0.9226 
1 1 1 3   45  2  f 0  5.07257e+01 7.90920e-01 7.37281e+02 246.868 -1.92739e+01 -4.51171e+01 0.00000e+00 0.00000e+00 1.14544e+03 246.868 4.08161e+02 246.868 0.9898 
1 1 1 3   45  3  o 8  1.98474e+01 4.85405e-01 5.41339e+02 122.591 -9.22003e+00 1.44219e+01  0.00000e+00 0.00000e+00 1.80836e+02 122.591 3.60502e+02 302.591 0.9703 
1 1 1 3   45  4  o 15 3.71018e+01 6.21102e-01 5.90219e+02 256.870 -9.32308e+00 -3.99692e+01 0.00000e+00 0.00000e+00 7.83869e+02 256.870 1.93650e+02 256.870 0.9877 
1 1 1 3   45  5  o 17 2.82643e+01 5.95376e-01 6.05298e+02 28.835  3.13064e+01  1.72356e+01  0.00000e+00 0.00000e+00 4.39384e+02 28.835  1.65914e+02 208.835 0.9859 
1 1 1 3   45  6  o 11 4.23910e+01 7.62915e-01 7.30031e+02 169.694 -7.33076e+01 1.33306e+01  0.00000e+00 0.00000e+00 8.48145e+02 169.694 1.18114e+02 169.694 0.9933 
1 1 1 3   45  7  o 14 1.26511e+01 4.96073e-01 2.37985e+02 202.714 -7.79026e+00 -3.26095e+00 0.00000e+00 0.00000e+00 2.07044e+02 202.714 3.09401e+01 22.714  0.9388 
1 1 1 3   45  8  o 5  3.29117e+01 6.65454e-01 5.87063e+02 157.636 -5.83290e+01 2.39987e+01  0.00000e+00 0.00000e+00 6.35945e+02 157.636 4.88825e+01 157.636 0.9920 
1 1 1 3   45  9  o 6  2.48264e+01 6.15096e-01 4.10082e+02 357.620 4.65451e+01  -1.93411e+00 0.00000e+00 0.00000e+00 5.09475e+02 357.620 9.93927e+01 357.620 0.9892 
1 1 1 3   45  10 o 6  4.67792e+00 1.04217e+00 1.09618e+02 157.562 -2.52289e+00 1.04181e+00  0.00000e+00 0.00000e+00 2.83109e+01 157.562 8.13071e+01 337.562 0.7878 
1 1 1 3   45  11 o 10 2.11061e+01 7.51096e-01 3.57185e+02 44.858  4.00339e+01  3.98362e+01  0.00000e+00 0.00000e+00 4.25305e+02 44.858  6.81200e+01 44.858  0.9911 
1 1 1 3   45  12 o 7  6.20214e+00 1.16782e+00 5.29087e+01 12.528  2.63127e+00  5.84668e-01  0.00000e+00 0.00000e+00 1.29034e+02 12.528  7.61250e+01 12.528  0.7847 
1 1 1 3   45  13 o 10 5.40414e+00 1.39343e+00 1.13558e+02 311.612 3.60723e+00  -4.06118e+00 0.00000e+00 0.00000e+00 6.86643e+01 311.612 4.48941e+01 131.612 0.9025 
1 1 1 3   45  14 o 6  7.07692e+00 1.60741e+00 1.25169e+02 137.398 -5.72278e+00 5.26265e+00  0.00000e+00 0.00000e+00 1.21417e+02 137.398 3.75267e+00 317.398 0.9333 
1 1 1 3   45  15 o 1  6.32896e+00 1.39823e+00 1.21999e+02 170.151 -8.17087e+00 1.41851e+00  0.00000e+00 0.00000e+00 9.93804e+01 170.151 2.26185e+01 350.151 0.9376 
1 1 1 3   45  16 o 13 6.78215e+00 1.58535e+00 1.44858e+02 23.060  9.79029e+00  4.16780e+00  0.00000e+00 0.00000e+00 9.57592e+01 23.060  4.90990e+01 203.060 0.9518 
1 1 1 3   45  17 o 5  4.56777e+00 1.43618e+00 3.68855e+01 99.843  -3.79178e-01 2.18538e+00  0.00000e+00 0.00000e+00 8.73860e+01 99.843  5.05004e+01 99.843  0.7305 
1 1 1 3   45  18 o 12 3.71916e+00 1.28664e+00 6.43728e+01 156.080 -3.74878e+00 1.66275e+00  0.00000e+00 0.00000e+00 5.56425e+01 156.080 8.73035e+00 336.080 0.8673 
1 1 1 3   46  0  o 3  4.09498e+01 6.11215e-01 8.13030e+02 224.637 -3.01819e+01 -2.98021e+01 0.00000e+00 0.00000e+00 7.04002e+02 224.637 1.09029e+02 44.637  0.9881 
1 1 1 3   46  1  o 9  9.39619e+00 4.05314e-01 1.90373e+02 100.591 -4.19114e-01 2.24140e+00  0.00000e+00 0.00000e+00 6.99171e+01 100.591 1.20456e+02 280.591 0.7388 
1 1 1 3   46  2  o 2  2.77302e+01 4.95063e-01 5.73943e+02 143.241 -1.73430e+01 1.29548e+01  0.00000e+00 0.00000e+00 4.41500e+02 143.241 1.32443e+02 323.241 0.9766 
1 1 1 3   46  3  o 16 5.42880e+00 4.98953e-01 5.23336e+01 276.575 5.03616e-02  -4.36947e-01 0.00000e+00 0.00000e+00 8.61814e+00 96.575  6.09517e+01 96.575  0.2148 
1 1 1 3   46  4  o 18 4.08822e+01 6.68787e-01 7.39945e+02 48.994  3.38051e+01  3.88799e+01  0.00000e+00 0.00000e+00 7.77802e+02 48.994  3.78576e+01 48.994  0.9902 
1 1 1 3   46  5  o 11 8.24580e+00 4.67523e-01 1.75092e+02 190.027 -2.97293e+00 -5.25640e-01 0.00000e+00 0.00000e+00 7.57005e+01 190.027 9.93914e+01 10.027  0.8114 
1 1 1 3   46  6  o 16 1.01906e+01 4.77937e-01 2.35159e+02 351.743 5.70647e+00  -8.28124e-01 0.00000e+00 0.00000e+00 1.11833e+02 351.743 1.23326e+02 171.743 0.9086 
1 1 1 3   46  7  o 16 8.66487e+00 6.49643e-01 1.00101e+02 346.932 2.52715e+00  -5.86601e-01 0.00000e+00 0.00000e+00 1.51457e+02 346.932 5.13558e+01 346.932 0.7749 
1 1 1 3   46  8  o 15 4.85555e+00 9.31195e-01 4.04751e+01 182.510 -6.72115e-01 -2.94671e-02 0.00000e+00 0.00000e+00 1.74797e+01 182.510 2.29954e+01 2.510   0.3187 
1 1 1 3   46  9  o 6  1.34518e+01 6.84725e-01 1.81646e+02 109.702 -3.93851e+00 1.09983e+01  0.00000e+00 0.00000e+00 2.99913e+02 109.702 1.18267e+02 109.702 0.9562 
1 1 1 3   46  10 f 0  1.92688e+01 6.21930e-01 2.54903e+02 226.073 -2.07452e+01 -2.15368e+01 0.00000e+00 0.00000e+00 4.54007e+02 226.073 1.99105e+02 226.073 0.9831 
1 1 1 3   46  11 o 11 7.65606e+00 1.03622e+00 1.84085e+02 343.549 1.01439e+01  -2.99528e+00 0.00000e+00 0.00000e+00 8.83755e+01 343.549 9.57093e+01 163.549 0.9515 
1 1 1 3   46  12 o 1  7.41977e+00 1.06727e+00 1.12296e+02 357.049 7.08115e+00  -3.65049e-01 0.00000e+00 0.00000e+00 1.44680e+02 357.049 3.23839e+01 357.049 0.9265 
1 1 1 3   46  13 o 8  4.56512e+00 1.28933e+00 5.49287e+01 11.730  2.37624e+00  4.93393e-01  0.00000e+00 0.00000e+00 7.41344e+01 11.730  1.92056e+01 11.730  0.7568 
1 1 1 3   46  14 o 7  3.77162e+00 1.20594e+00 1.03342e+02 342.270 4.30864e+00  -1.37753e+00 0.00000e+00 0.00000e+00 2.07006e+01 342.270 8.26413e+01 162.270 0.8810 
1 1 1 3   46  15 o 13 3.39513e+00 1.09036e+00 9.13657e+01 80.319  7.31918e-01  4.29057e+00  0.00000e+00 0.00000e+00 1.95526e+01 80.319  7.18131e+01 260.319 0.8758 
1 1 1 3   46  16 o 14 9.89919e+00 1.48706e+00 1.27093e+02 336.395 1.34869e+01  -5.89367e+00 0.00000e+00 0.00000e+00 2.29093e+02 336.395 1.02000e+02 336.395 0.9654 
1 1 1 3   46  17 o 2  1.12438e+01 1.65447e+00 1.11234e+02 246.134 -5.78782e+00 -1.30822e+01 0.00000e+00 0.00000e+00 2.92547e+02 246.134 1.81313e+02 246.134 0.9644 
1 1 1 3   46  18 o 16 7.96742e+00 1.72858e+00 9.62704e+01 245.853 -3.84502e+00 -8.57660e+00 0.00000e+00 0.00000e+00 1.83894e+02 245.853 8.76240e+01 245.853 0.9452 
1 1 1 3   47  0  o 12 3.71941e+01 5.67611e-01 5.60713e+02 15.398  2.64843e+01  7.29413e+00  0.00000e+00 0.00000e+00 8.07927e+02 15.398  2.47213e+02 15.398  0.9816 
1 1 1 3   47  1  o 10 4.01815e+01 6.05804e-01 7.50867e+02 74.194  1.11564e+01  3.94099e+01  0.00000e+00 0.00000e+00 7.37006e+02 74.194  1.38616e+01 254.194 0.9877 
1 1 1 3   47  2  o 3  2.47602e+01 4.60083e-01 5.56985e+02 305.585 1.27751e+01  -1.78542e+01 0.00000e+00 0.00000e+00 3.49893e+02 305.585 2.07092e+02 125.585 0.9770 
1 1 1 3   47  3  o 3  1.96829e+01 4.81471e-01 4.09518e+02 214.757 -1.25331e+01 -8.69680e+00 0.00000e+00 0.00000e+00 3.03769e+02 214.757 1.05749e+02 34.757  0.9666 
1 1 1 3   47  4  o 16 3.49351e+01 5.93888e-01 5.68996e+02 49.294  2.22126e+01  2.58188e+01  0.00000e+00 0.00000e+00 7.21203e+02 49.294  1.52207e+02 49.294  0.9852 
1 1 1 3   47  5  o 12 1.56958e+01 4.33458e-01 2.69749e+02 251.702 -2.89446e+00 -8.75297e+00 0.00000e+00 0.00000e+00 2.85643e+02 251.702 1.58936e+01 251.702 0.9441 
1 1 1 3   47  6  o 4  2.32678e+01 4.92472e-01 4.00535e+02 146.221 -2.07229e+01 1.38616e+01  0.00000e+00 0.00000e+00 4.53685e+02 146.221 5.31508e+01 146.221 0.9797 
1 1 1 3   47  7  o 1  1.72950e+01 5.47959e-01 3.66259e+02 95.226  -1.65037e+00 1.80441e+01  0.00000e+00 0.00000e+00 2.63499e+02 95.226  1.02760e+02 275.226 0.9720 
1 1 1 3   47  8  o 1  1.11836e+01 5.93952e-01 1.79328e+02 121.421 -3.59286e+00 5.88125e+00  0.00000e+00 0.00000e+00 2.07784e+02 121.421 2.84558e+01 121.421 0.9243 
1 1 1 3   47  9  o 8  1.24888e+01 6.14068e-01 2.05234e+02 340.701 1.13761e+01  -3.98369e+00 0.00000e+00 0.00000e+00 2.42438e+02 340.701 3.72038e+01 340.701 0.9576 
1 1 1 3   47  10 f 0  1.24690e+01 6.72231e-01 2.97131e+02 128.245 -1.41157e+01 1.79092e+01  0.00000e+00 0.00000e+00 1.59072e+02 128.245 1.38059e+02 308.245 0.9778 
1 1 1 3   47  11 o 2  7.40421e+00 1.06736e+00 1.42043e+02 356.904 7.40861e+00  -4.00764e-01 0.00000e+00 0.00000e+00 1.15455e+02 356.904 2.65874e+01 176.904 0.9299 
1 1 1 3   47  12 o 14 5.99097e+00 1.12590e+00 1.93472e+02 162.762 -1.00734e+01 3.12559e+00  0.00000e+00 0.00000e+00 1.95487e+01 162.762 1.73924e+02 342.762 0.9513 
1 1 1 3   47  13 o 8  1.50080e+01 1.16290e+00 3.16944e+02 329.356 4.34793e+01  -2.57584e+01 0.00000e+00 0.00000e+00 2.38054e+02 329.356 7.88895e+01 149.356 0.9901 
1 1 1 3   47  14 o 8  4.37625e+00 1.35202e+00 4.91266e+01 159.469 -2.12228e+00 7.94777e-01  0.00000e+00 0.00000e+00 7.12570e+01 159.469 2.21305e+01 159.469 0.7370 
1 1 1 3   47  15 o 12 8.53322e+00 1.34029e+00 1.41707e+02 356.068 1.37704e+01  -9.46550e-01 0.00000e+00 0.00000e+00 1.64799e+02 356.068 2.30920e+01 356.068 0.9631 
1 1 1 3   47  16 o 14 3.99508e+00 1.26443e+00 6.60644e+01 257.536 -7.25807e-01 -3.28373e+00 0.00000e+00 0.00000e+00 5.80442e+01 257.536 8.02020e+00 77.536  0.8336 
1 1 1 3   47  17 o 11 7.62309e+00 1.84651e+00 7.33684e+01 163.754 -5.50769e+00 1.60489e+00  0.00000e+00 0.00000e+00 1.84367e+02 163.754 1.10999e+02 163.754 0.9081 
1 1 1 3   47  18 o 3  1.15833e+01 1.95792e+00 1.14418e+02 358.952 1.36323e+01  -2.49475e-01 0.00000e+00 0.00000e+00 3.00338e+02 358.952 1.85920e+02 358.952 0.9626 
1 1 1 3   48  0  o 7  4.24680e+01 6.32885e-01 7.12228e+02 291.415 1.49121e+01  -3.80216e+01 0.00000e+00 0.00000e+00 8.59908e+02 291.415 1.47680e+02 291.415 0.9877 
1 1 1 3   48  1  o 3  2.78853e+01 4.64641e-01 5.55204e+02 65.050  1.04083e+01  2.23712e+01  0.00000e+00 0.00000e+00 4.68656e+02 65.050  8.65475e+01 245.050 0.9795 
1 1 1 3   48  2  o 16 4.32296e+01 6.87938e-01 8.85315e+02 307.717 3.59539e+01  -4.64906e+01 0.00000e+00 0.00000e+00 7.21325e+02 307.717 1.63991e+02 127.717 0.9915 
1 1 1 3   48  3  o 6  7.34387e+00 4.94441e-01 1.89384e+02 71.459  7.76637e-01  2.31568e+00  0.00000e+00 0.00000e+00 1.94401e+01 71.459  1.69944e+02 251.459 0.7586 
1 1 1 3   48  4  o 14 8.07990e+00 4.45452e-01 1.00758e+02 239.905 -8.58947e-01 -1.48203e+00 0.00000e+00 0.00000e+00 9.44365e+01 239.905 6.32114e+00 59.905  0.6445 
1 1 1 3   48  5  o 4  2.29565e+01 4.84542e-01 3.97805e+02 339.910 1.90272e+01  -6.95928e+00 0.00000e+00 0.00000e+00 4.40987e+02 339.910 4.31819e+01 339.910 0.9750 
1 1 1 3   48  6  o 9  2.28546e+01 5.11312e-01 4.66538e+02 330.443 2.55018e+01  -1.44616e+01 0.00000e+00 0.00000e+00 3.75024e+02 330.443 9.15134e+01 150.443 0.9828 
1 1 1 3   48  7  o 8  2.92508e+01 5.71548e-01 5.55361e+02 229.980 -3.24278e+01 -3.86186e+01 0.00000e+00 0.00000e+00 5.29360e+02 229.980 2.60012e+01 49.980  0.9900 
1 1 1 3   48  8  o 15 5.34406e+00 9.74463e-01 2.24236e+01 304.499 2.53194e-01  -3.68416e-01 0.00000e+00 0.00000e+00 2.12214e+01 304.499 1.20224e+00 124.499 0.2181 
1 1 1 3   48  9  o 2  1.24819e+01 7.02370e-01 1.39973e+02 75.519  2.17749e+00  8.43101e+00  0.00000e+00 0.00000e+00 2.99507e+02 75.519  1.59534e+02 75.519  0.9407 
1 1 1 3   48  10 o 16 4.58444e+00 1.05424e+00 3.41216e+01 296.254 4.30535e-01  -8.72881e-01 0.00000e+00 0.00000e+00 4.08027e+01 296.254 6.68113e+00 296.254 0.4368 
1 1 1 3   48  11 o 9  9.59342e+00 9.16580e-01 1.69157e+02 180.695 -1.29061e+01 -1.56675e-01 0.00000e+00 0.00000e+00 1.75376e+02 180.695 6.21891e+00 180.695 0.9604 
1 1 1 3   48  12 o 5  5.52791e+00 1.34573e+00 1.15158e+02 282.874 1.16405e+00  -5.09323e+00 0.00000e+00 0.00000e+00 7.04233e+01 282.874 4.47349e+01 102.874 0.8983 
1 1 1 3   48  13 o 8  4.76514e+00 1.37681e+00 6.40942e+01 196.212 -2.68910e+00 -7.81856e-01 0.00000e+00 0.00000e+00 7.72219e+01 196.212 1.31277e+01 196.212 0.7941 
1 1 1 3   48  14 o 1  9.44373e+00 1.09583e+00 9.92817e+01 309.460 7.05682e+00  -8.57268e+00 0.00000e+00 0.00000e+00 2.36897e+02 309.460 1.37615e+02 309.460 0.9538 
1 1 1 3   48  15 o 4  1.05107e+01 1.26221e+00 1.22572e+02 335.374 1.50870e+01  -6.91578e+00 0.00000e+00 0.00000e+00 2.57394e+02 335.374 1.34822e+02 335.374 0.9694 
1 1 1 3   48  16 o 12 5.30785e+00 1.41891e+00 8.92930e+01 287.141 1.71112e+00  -5.54775e+00 0.00000e+00 0.00000e+00 9.05308e+01 287.141 1.23787e+00 287.141 0.9092 
1 1 1 3   48  17 o 16 6.38963e+00 1.69688e+00 8.56130e+01 147.356 -5.10718e+00 3.27174e+00  0.00000e+00 0.00000e+00 1.31652e+02 147.356 4.60385e+01 147.356 0.9134 
1 1 1 3   48  18 o 8  5.83157e+00 1.77344e+00 8.37643e+01 225.443 -3.88530e+00 -3.94580e+00 0.00000e+00 0.00000e+00 1.12419e+02 225.443 2.86542e+01 225.443 0.9045 
1 1 1 3   49  0  o 13 2.85323e+01 4.71840e-01 5.41775e+02 9.199   2.41765e+01  3.91533e+00  0.00000e+00 0.00000e+00 5.05444e+02 9.199   3.63306e+01 189.199 0.9794 
1 1 1 3   49  1  o 17 2.79050e+01 4.67144e-01 4.75431e+02 315.799 1.47256e+01  -1.43206e+01 0.00000e+00 0.00000e+00 5.44649e+02 315.799 6.92179e+01 315.799 0.9753 
1 1 1 3   49  2  o 18 1.47986e+01 3.75555e-01 2.68300e+02 115.755 -3.26913e+00 6.77611e+00  0.00000e+00 0.00000e+00 2.48062e+02 115.755 2.02379e+01 295.755 0.9310 
1 1 1 3   49  3  o 17 2.59845e+01 6.15597e-01 4.47649e+02 224.082 -1.41981e+01 -1.37505e+01 0.00000e+00 0.00000e+00 5.01270e+02 224.082 5.36209e+01 224.082 0.9744 
1 1 1 3   49  4  o 9  1.27360e+01 4.50504e-01 1.50360e+02 165.665 -3.88442e+00 9.92648e-01  0.00000e+00 0.00000e+00 2.61964e+02 165.665 1.11604e+02 165.665 0.8639 
1 1 1 3   49  5  o 6  1.28256e+01 5.33040e-01 2.62607e+02 102.272 -1.74519e+00 8.02302e+00  0.00000e+00 0.00000e+00 1.87677e+02 102.272 7.49301e+01 282.272 0.9370 
1 1 1 3   49  6  o 1  1.48182e+01 4.69381e-01 2.33575e+02 105.822 -2.65637e+00 9.37344e+00  0.00000e+00 0.00000e+00 2.92234e+02 105.822 5.86583e+01 105.822 0.9472 
1 1 1 3   49  7  o 4  8.17975e+00 6.18207e-01 1.75686e+02 159.931 -4.29872e+00 1.57048e+00  0.00000e+00 0.00000e+00 9.46768e+01 159.931 8.10089e+01 339.931 0.8825 
1 1 1 3   49  8  o 18 2.16852e+01 5.35455e-01 4.78470e+02 32.194  3.76467e+01  2.37017e+01  0.00000e+00 0.00000e+00 3.24225e+02 32.194  1.54245e+02 212.194 0.9887 
1 1 1 3   49  9  o 5  2.21393e+01 5.70162e-01 4.86980e+02 208.510 -5.14154e+01 -2.79274e+01 0.00000e+00 0.00000e+00 3.34455e+02 208.510 1.52525e+02 28.510  0.9914 
1 1 1 3   49  10 o 17 1.29927e+01 7.38329e-01 2.13911e+02 359.421 1.90925e+01  -1.92946e-01 0.00000e+00 0.00000e+00 2.59204e+02 359.421 4.52937e+01 359.421 0.9735 
1 1 1 3   49  11 o 12 6.92700e+00 1.01413e+00 1.73413e+02 303.809 5.22486e+00  -7.80214e+00 0.00000e+00 0.00000e+00 7.13654e+01 303.809 1.02047e+02 123.809 0.9452 
1 1 1 3   49  12 o 12 1.53901e+01 1.03275e+00 3.36849e+02 266.695 -2.87997e+00 -4.98750e+01 0.00000e+00 0.00000e+00 2.32427e+02 266.695 1.04422e+02 86.695  0.9899 
1 1 1 3   49  13 o 3  1.19554e+01 1.26038e+00 2.82015e+02 115.973 -1.53680e+01 3.15466e+01  0.00000e+00 0.00000e+00 1.58012e+02 115.973 1.24003e+02 295.973 0.9856 
1 1 1 3   49  14 o 8  3.96717e+00 1.15587e+00 5.06363e+01 335.579 2.33993e+00  -1.06246e+00 0.00000e+00 0.00000e+00 6.37051e+01 335.579 1.30688e+01 335.579 0.7724 
1 1 1 3   49  15 o 1  6.74238e+00 1.43816e+00 1.47849e+02 31.722  9.37628e+00  5.79586e+00  0.00000e+00 0.00000e+00 9.18634e+01 31.722  5.59859e+01 211.722 0.9535 
1 1 1 3   49  16 o 10 1.12069e+01 1.46810e+00 1.67119e+02 291.205 8.33519e+00  -2.14835e+01 0.00000e+00 0.00000e+00 2.41244e+02 291.205 7.41253e+01 291.205 0.9781 
1 1 1 3   49  17 o 2  5.86446e+00 1.66246e+00 6.82327e+01 161.629 -4.29167e+00 1.42519e+00  0.00000e+00 0.00000e+00 1.24079e+02 161.629 5.58460e+01 161.629 0.8810 
1 1 1 3   49  18 o 14 6.05008e+00 1.76103e+00 9.98610e+01 13.006  6.96560e+00  1.60892e+00  0.00000e+00 0.00000e+00 1.08740e+02 13.006  8.87900e+00 13.006  0.9272 
1 1 1 3   50  0  o 6  2.51488e+01 4.34916e-01 4.24757e+02 156.721 -1.51315e+01 6.51008e+00  0.00000e+00 0.00000e+00 4.88527e+02 156.721 6.37695e+01 156.721 0.9692 
1 1 1 3   50  1  o 19 2.04479e+01 4.48351e-01 3.63143e+02 160.601 -1.32520e+01 4.66661e+00  0.00000e+00 0.00000e+00 3.75335e+02 160.601 1.21926e+01 160.601 0.9637 
1 1 1 3   50  2  o 2  3.12106e+01 5.37091e-01 5.59697e+02 52.483  1.86143e+01  2.42434e+01  0.00000e+00 0.00000e+00 5.90640e+02 52.483  3.09438e+01 52.483  0.9835 
1 1 1 3   50  3  o 2  5.30163e+01 9.06967e-01 8.87546e+02 227.229 -5.38049e+01 -5.81637e+01 0.00000e+00 0.00000e+00 1.08662e+03 227.229 1.99077e+02 227.229 0.9937 
1 1 1 3   50  4  o 13 1.15413e+01 4.13004e-01 1.97958e+02 98.057  -6.97890e-01 4.93030e+00  0.00000e+00 0.00000e+00 1.88188e+02 98.057  9.76985e+00 278.057 0.8929 
1 1 1 3   50  5  o 5  1.54907e+01 5.38102e-01 2.99504e+02 284.637 3.13902e+00  -1.20192e+01 0.00000e+00 0.00000e+00 2.56984e+02 284.637 4.25207e+01 104.637 0.9589 
1 1 1 3   50  6  o 9  2.59762e+01 5.22865e-01 5.24144e+02 171.839 -4.07416e+01 5.84240e+00  0.00000e+00 0.00000e+00 4.36954e+02 171.839 8.71896e+01 351.839 0.9878 
1 1 1 3   50  7  o 7  2.57474e+01 5.43156e-01 3.23958e+02 122.829 -1.49029e+01 2.30987e+01  0.00000e+00 0.00000e+00 6.22493e+02 122.829 2.98534e+02 122.829 0.9816 
1 1 1 3   50  8  o 12 6.33481e+00 8.35737e-01 1.65690e+02 10.828  4.39519e+00  8.40627e-01  0.00000e+00 0.00000e+00 4.28936e+01 10.828  1.22796e+02 190.828 0.8796 
1 1 1 3   50  9  o 5  9.08201e+00 7.13899e-01 2.30511e+02 273.527 7.52224e-01  -1.22039e+01 0.00000e+00 0.00000e+00 9.51216e+01 273.527 1.35389e+02 93.527  0.9582 
1 1 1 3   50  10 o 11 7.95047e+00 9.51784e-01 1.13556e+02 219.486 -4.80099e+00 -3.95567e+00 0.00000e+00 0.00000e+00 1.58727e+02 219.486 4.51707e+01 219.486 0.9157 
1 1 1 3   50  11 o 8  4.11995e+00 1.01028e+00 1.04237e+02 177.250 -3.51290e+00 1.68711e-01  0.00000e+00 0.00000e+00 2.54403e+01 177.250 7.87966e+01 357.250 0.8420 
1 1 1 3   50  12 o 5  7.06673e+00 1.38184e+00 1.24808e+02 73.142  2.07944e+00  6.86255e+00  0.00000e+00 0.00000e+00 1.20040e+02 73.142  4.76853e+00 253.142 0.9274 
1 1 1 3   50  13 o 1  1.30540e+01 1.21263e+00 1.90743e+02 24.392  2.33130e+01  1.05715e+01  0.00000e+00 0.00000e+00 2.87034e+02 24.392  9.62909e+01 24.392  0.9803 
1 1 1 3   50  14 o 13 5.82430e+00 1.24116e+00 7.72459e+01 38.404  4.21511e+00  3.34134e+00  0.00000e+00 0.00000e+00 1.18653e+02 38.404  4.14071e+01 38.404  0.9015 
1 1 1 3   50  15 o 3  7.38759e+00 1.49971e+00 1.82340e+02 232.586 -9.19832e+00 -1.20249e+01 0.00000e+00 0.00000e+00 8.38252e+01 232.586 9.85151e+01 52.586  0.9664 
1 1 1 3   50  16 o 14 6.18329e+00 1.62553e+00 1.38445e+02 245.875 -3.66451e+00 -8.18268e+00 0.00000e+00 0.00000e+00 7.86365e+01 245.875 5.98085e+01 65.875  0.9425 
1 1 1 3   50  17 o 16 7.09665e+00 1.76011e+00 1.29524e+02 117.832 -4.71194e+00 8.92484e+00  0.00000e+00 0.00000e+00 1.21151e+02 117.832 8.37265e+00 297.832 0.9491 
1 1 1 3   51  0  o 13 2.09080e+01 3.97959e-01 5.75794e+02 291.290 7.71231e+00  -1.97914e+01 0.00000e+00 0.00000e+00 1.88872e+02 291.290 3.86922e+02 111.290 0.9762 
1 1 1 3   51  1  o 10 3.22042e+01 5.17969e-01 5.77934e+02 232.004 -2.00699e+01 -2.56917e+01 0.00000e+00 0.00000e+00 6.10079e+02 232.004 3.21445e+01 232.004 0.9845 
1 1 1 3   51  2  o 18 1.95369e+01 4.16332e-01 2.95120e+02 28.910  8.61071e+00  4.75525e+00  0.00000e+00 0.00000e+00 3.98661e+02 28.910  1.03540e+02 28.910  0.9477 
1 1 1 3   51  3  o 2  2.74855e+01 5.03052e-01 5.92162e+02 0.672   3.40191e+01  3.98875e-01  0.00000e+00 0.00000e+00 4.22447e+02 0.672   1.69715e+02 180.672 0.9852 
1 1 1 3   51  4  o 10 1.17076e+01 4.90985e-01 1.62234e+02 217.324 -3.34950e+00 -2.55384e+00 0.00000e+00 0.00000e+00 2.19905e+02 217.324 5.76709e+01 217.324 0.8712 
1 1 1 3   51  5  o 16 2.54302e+01 6.12081e-01 4.14863e+02 47.266  1.86109e+01  2.01443e+01  0.00000e+00 0.00000e+00 5.20216e+02 47.266  1.05353e+02 47.266  0.9816 
1 1 1 3   51  6  o 11 3.67546e+01 6.38563e-01 6.95007e+02 286.415 2.05666e+01  -6.98093e+01 0.00000e+00 0.00000e+00 6.72029e+02 286.415 2.29783e+01 106.416 0.9931 
1 1 1 3   51  7  o 18 1.61661e+01 5.61791e-01 1.90675e+02 9.039   1.08020e+01  1.71851e+00  0.00000e+00 0.00000e+00 3.86238e+02 9.039   1.95563e+02 9.039   0.9531 
1 1 1 3   51  8  o 6  4.32139e+01 7.44276e-01 6.81464e+02 234.088 -7.77405e+01 -1.07347e+02 0.00000e+00 0.00000e+00 9.29867e+02 234.088 2.48403e+02 234.088 0.9962 
1 1 1 3   51  9  o 13 2.59473e+01 6.78288e-01 3.42905e+02 253.528 -1.41934e+01 -4.80030e+01 0.00000e+00 0.00000e+00 6.18138e+02 253.528 2.75234e+02 253.528 0.9900 
1 1 1 3   51  10 o 19 1.30638e+01 6.95698e-01 1.85993e+02 129.779 -1.11823e+01 1.34313e+01  0.00000e+00 0.00000e+00 2.88359e+02 129.779 1.02366e+02 129.779 0.9710 
1 1 1 3   51  11 o 18 7.96003e+00 9.93948e-01 2.01184e+02 17.012  1.25816e+01  3.84959e+00  0.00000e+00 0.00000e+00 8.48003e+01 17.012  1.16384e+02 197.012 0.9612 
1 1 1 3   51  12 o 16 3.34309e+00 1.07674e+00 1.20073e+02 157.812 -3.57383e+00 1.45757e+00  0.00000e+00 0.00000e+00 1.29360e+01 337.812 1.33009e+02 337.812 0.8579 
1 1 1 3   51  13 o 4  7.91314e+00 1.07577e+00 1.80236e+02 255.064 -4.25487e+00 -1.59503e+01 0.00000e+00 0.00000e+00 1.06081e+02 255.064 7.41553e+01 75.064  0.9692 
1 1 1 3   51  14 o 8  9.24107e+00 1.22762e+00 1.35401e+02 180.300 -1.51344e+01 -7.93852e-02 0.00000e+00 0.00000e+00 1.97748e+02 180.300 6.23478e+01 180.300 0.9664 
1 1 1 3   51  15 o 6  4.88115e+00 1.31026e+00 9.44992e+01 324.113 4.71050e+00  -3.40826e+00 0.00000e+00 0.00000e+00 7.09638e+01 324.113 2.35354e+01 144.113 0.9094 
1 1 1 3   51  16 o 18 5.91751e+00 1.55003e+00 6.78367e+01 215.495 -3.72513e+00 -2.65662e+00 0.00000e+00 0.00000e+00 1.26670e+02 215.495 5.88336e+01 215.495 0.8825 
1 1 1 3   51  17 o 16 4.08376e+00 1.33733e+00 2.36902e+01 263.552 -1.62522e-01 -1.43796e+00 0.00000e+00 0.00000e+00 6.48748e+01 263.552 4.11846e+01 263.552 0.5828 
1 1 1 3   52  0  o 8  1.93067e+01 3.88674e-01 2.54411e+02 147.163 -7.07367e+00 4.56507e+00  0.00000e+00 0.00000e+00 4.24410e+02 147.163 1.70000e+02 147.163 0.9386 
1 1 1 3   52  1  o 1  3.49904e+01 5.50098e-01 6.21401e+02 24.024  3.37509e+01  1.50435e+01  0.00000e+00 0.00000e+00 6.71616e+02 24.024  5.02148e+01 24.024  0.9864 
1 1 1 3   52  2  o 13 3.20309e+01 5.94951e-01 5.90425e+02 29.567  3.44019e+01  1.95168e+01  0.00000e+00 0.00000e+00 5.94343e+02 29.567  3.91780e+00 29.567  0.9873 
1 1 1 3   52  3  f 0  1.97738e+01 4.33871e-01 4.57383e+02 234.287 -1.15178e+01 -1.60211e+01 0.00000e+00 0.00000e+00 2.64396e+02 234.287 1.92987e+02 54.287  0.9743 
1 1 1 3   52  4  o 3  1.18345e+01 4.24377e-01 5.81796e+01 85.249  1.39605e-01  1.67984e+00  0.00000e+00 0.00000e+00 2.25011e+02 85.249  1.66831e+02 85.249  0.6388 
1 1 1 3   52  5  o 16 2.48913e+01 6.09154e-01 5.69614e+02 303.446 2.13255e+01  -3.22854e+01 0.00000e+00 0.00000e+00 3.50553e+02 303.446 2.19062e+02 123.446 0.9870 
1 1 1 3   52  6  o 13 1.66067e+01 4.72656e-01 3.38112e+02 169.697 -1.78280e+01 3.24070e+00  0.00000e+00 0.00000e+00 2.66342e+02 169.697 7.17698e+01 349.697 0.9720 
1 1 1 3   52  7  f 0  9.53751e+00 6.58274e-01 2.33092e+02 113.944 -3.08269e+00 6.94218e+00  0.00000e+00 0.00000e+00 9.95469e+01 113.944 1.33545e+02 293.944 0.9316 
1 1 1 3   52  8  f 0  2.39280e+01 5.57993e-01 2.55841e+02 200.726 -2.77166e+01 -1.04878e+01 0.00000e+00 0.00000e+00 6.24387e+02 200.726 3.68547e+02 200.726 0.9830 
1 1 1 3   52  9  o 14 5.18144e+00 9.90716e-01 7.57178e+01 59.628  1.13214e+00  1.93183e+00  0.00000e+00 0.00000e+00 6.64345e+01 59.628  9.28338e+00 239.628 0.7334 
1 1 1 3   52  10 o 3  2.31617e+01 6.86848e-01 4.35107e+02 37.752  6.04569e+01  4.68134e+01  0.00000e+00 0.00000e+00 4.25260e+02 37.752  9.84654e+00 217.752 0.9934 
1 1 1 3   52  11 o 13 8.94207e+00 1.10501e+00 1.71127e+02 250.390 -4.26848e+00 -1.19807e+01 0.00000e+00 0.00000e+00 1.49637e+02 250.390 2.14901e+01 70.390  0.9598 
1 1 1 3   52  12 o 15 9.42357e+00 1.28994e+00 1.07964e+02 124.355 -5.13317e+00 7.50957e+00  0.00000e+00 0.00000e+00 2.24058e+02 124.355 1.16094e+02 124.355 0.9433 
1 1 1 3   52  13 o 1  1.25588e+01 8.62460e-01 1.84004e+02 255.643 -7.31607e+00 -2.85830e+01 0.00000e+00 0.00000e+00 2.76754e+02 255.643 9.27501e+01 255.643 0.9829 
1 1 1 3   52  14 o 9  1.30602e+01 1.01756e+00 2.04372e+02 10.654  3.54448e+01  6.66794e+00  0.00000e+00 0.00000e+00 2.75971e+02 10.654  7.15996e+01 10.654  0.9860 
1 1 1 3   52  15 o 2  5.34878e+00 1.33060e+00 8.04439e+01 131.397 -3.45392e+00 3.91811e+00  0.00000e+00 0.00000e+00 9.86408e+01 131.397 1.81969e+01 131.397 0.8983 
1 1 1 3   52  16 o 12 4.32848e+00 1.37115e+00 1.61875e+02 356.331 9.07865e+00  -5.82114e-01 0.00000e+00 0.00000e+00 9.81504e+00 176.331 1.71690e+02 176.331 0.9433 
1 1 1 3   52  17 o 3  4.08466e+00 1.33935e+00 8.33366e+01 183.600 -4.99503e+00 -3.14235e-01 0.00000e+00 0.00000e+00 5.24576e+01 183.600 3.08791e+01 3.600   0.8935 
1 1 1 3   53  0  o 4  2.24971e+01 4.17764e-01 4.06516e+02 30.323  1.35718e+01  7.93813e+00  0.00000e+00 0.00000e+00 4.08863e+02 30.323  2.34645e+00 30.323  0.9677 
1 1 1 3   53  1  o 15 1.56470e+01 3.73881e-01 2.34539e+02 72.767  2.29326e+00  7.39305e+00  0.00000e+00 0.00000e+00 3.12289e+02 72.767  7.77501e+01 72.767  0.9330 
1 1 1 3   53  2  o 9  2.97354e+01 5.02291e-01 5.04967e+02 232.183 -1.92284e+01 -2.47743e+01 0.00000e+00 0.00000e+00 5.91004e+02 232.183 8.60370e+01 232.183 0.9839 
1 1 1 3   53  3  o 4  4.19870e+01 6.84418e-01 6.37562e+02 46.015  4.08915e+01  4.23670e+01  0.00000e+00 0.00000e+00 9.21794e+02 46.015  2.84232e+02 46.015  0.9915 
1 1 1 3   53  4  o 12 2.31410e+01 4.77725e-01 4.01601e+02 220.240 -1.90387e+01 -1.61115e+01 0.00000e+00 0.00000e+00 4.47586e+02 220.240 4.59851e+01 220.240 0.9797 
1 1 1 3   53  5  o 19 2.90254e+01 6.58392e-01 4.45028e+02 282.303 7.64271e+00  -3.50422e+01 0.00000e+00 0.00000e+00 6.26687e+02 282.303 1.81659e+02 282.303 0.9860 
1 1 1 3   53  6  o 18 8.88891e+00 6.14512e-01 4.99390e+01 206.222 -1.26956e+00 -6.25296e-01 0.00000e+00 0.00000e+00 1.41247e+02 206.222 9.13082e+01 206.222 0.5745 
1 1 1 3   53  7  o 5  1.12623e+01 5.53423e-01 3.77271e+02 177.162 -1.82584e+01 9.05098e-01  0.00000e+00 0.00000e+00 3.25890e+01 177.162 3.44682e+02 357.162 0.9723 
1 1 1 3   53  8  o 9  3.89920e+01 6.98638e-01 6.41960e+02 198.333 -1.10325e+02 -3.65562e+01 0.00000e+00 0.00000e+00 8.10759e+02 198.333 1.68799e+02 198.333 0.9957 
1 1 1 3   53  9  o 9  3.00045e+01 7.11154e-01 5.37567e+02 172.129 -9.77701e+01 1.35165e+01  0.00000e+00 0.00000e+00 5.79000e+02 172.129 4.14325e+01 172.129 0.9949 
1 1 1 3   53  10 o 13 1.41548e+01 6.79507e-01 3.15585e+02 272.055 1.31405e+00  -3.66138e+01 0.00000e+00 0.00000e+00 2.06334e+02 272.055 1.09251e+02 92.055  0.9863 
1 1 1 3   53  11 o 2  1.17338e+01 9.40305e-01 2.78739e+02 74.291  7.84233e+00  2.78840e+01  0.00000e+00 0.00000e+00 1.52075e+02 74.291  1.26663e+02 254.291 0.9826 
1 1 1 3   53  12 o 1  8.63621e+00 1.23180e+00 1.36775e+02 12.669  1.09743e+01  2.46687e+00  0.00000e+00 0.00000e+00 1.71055e+02 12.669  3.42799e+01 12.669  0.9545 
1 1 1 3   53  13 o 8  4.45178e+00 1.11436e+00 1.34835e+02 282.613 1.54209e+00  -6.89172e+00 0.00000e+00 0.00000e+00 1.90515e+01 282.613 1.15783e+02 102.613 0.9262 
1 1 1 3   53  14 o 12 4.61914e+00 1.24533e+00 4.67530e+01 89.165  3.76357e-02  2.58170e+00  0.00000e+00 0.00000e+00 8.65189e+01 89.165  3.97660e+01 89.165  0.7736 
1 1 1 3   53  15 o 6  5.93329e+00 1.37771e+00 1.02571e+02 6.416   7.57173e+00  8.51473e-01  0.00000e+00 0.00000e+00 1.03473e+02 6.416   9.01725e-01 6.416   0.9319 
1 1 1 3   53  16 o 17 6.93853e+00 1.59519e+00 1.30080e+02 150.500 -8.95785e+00 5.06806e+00  0.00000e+00 0.00000e+00 1.15387e+02 150.500 1.46927e+01 330.500 0.9501 
1 1 1 3   53  17 o 11 7.93808e+00 1.77693e+00 9.20418e+01 270.655 8.98979e-02  -7.86140e+00 0.00000e+00 0.00000e+00 1.83797e+02 270.655 9.17549e+01 270.655 0.9340 
1 1 1 3   54  0  o 9  4.01692e+01 6.11754e-01 6.61136e+02 44.371  3.95007e+01  3.86427e+01  0.00000e+00 0.00000e+00 8.29512e+02 44.371  1.68376e+02 44.371  0.9909 
1 1 1 3   54  1  o 15 2.52446e+01 5.09764e-01 3.65870e+02 155.214 -1.75067e+01 8.08418e+00  0.00000e+00 0.00000e+00 5.54765e+02 155.214 1.88895e+02 155.214 0.9737 
1 1 1 3   54  2  o 12 1.17602e+01 4.24614e-01 9.28669e+01 27.402  2.11031e+00  1.09400e+00  0.00000e+00 0.00000e+00 2.37893e+02 27.402  1.45026e+02 27.402  0.7509 
1 1 1 3   54  3  o 13 2.19825e+01 4.57337e-01 4.25621e+02 251.374 -7.31473e+00 -2.17030e+01 0.00000e+00 0.00000e+00 3.79507e+02 251.374 4.61142e+01 71.374  0.9779 
1 1 1 3   54  4  f 0  2.00507e+01 4.57695e-01 2.92571e+02 169.604 -1.51086e+01 2.77187e+00  0.00000e+00 0.00000e+00 4.33447e+02 169.604 1.40877e+02 169.604 0.9669 
1 1 1 3   54  5  o 9  2.07727e+01 5.23529e-01 3.79690e+02 103.861 -5.43585e+00 2.20296e+01  0.00000e+00 0.00000e+00 3.80779e+02 103.861 1.08899e+00 103.861 0.9777 
1 1 1 3   54  6  o 3  5.99743e+00 7.23978e-01 1.49820e+02 331.547 2.56779e+00  -1.39148e+00 0.00000e+00 0.00000e+00 3.06782e+01 331.547 1.19142e+02 151.547 0.8039 
1 1 1 3   54  7  o 11 3.11670e+01 5.97070e-01 6.78190e+02 2.159   8.99069e+01  3.38879e+00  0.00000e+00 0.00000e+00 4.81742e+02 2.159   1.96447e+02 182.159 0.9944 
1 1 1 3   54  8  o 1  8.43750e+00 8.01914e-01 1.90419e+02 97.211  -1.06186e+00 8.39227e+00  0.00000e+00 0.00000e+00 1.05959e+02 97.211  8.44597e+01 277.211 0.9389 
1 1 1 3   54  9  o 14 1.22045e+01 7.00343e-01 2.46986e+02 284.365 5.01496e+00  -1.95810e+01 0.00000e+00 0.00000e+00 1.97999e+02 284.365 4.89876e+01 104.365 0.9749 
1 1 1 3   54  10 o 13 1.28029e+01 7.06622e-01 1.75069e+02 172.430 -1.70929e+01 2.27167e+00  0.00000e+00 0.00000e+00 2.89419e+02 172.430 1.14350e+02 172.430 0.9706 
1 1 1 3   54  11 o 8  1.06230e+01 9.77503e-01 1.60609e+02 5.022   1.48668e+01  1.30651e+00  0.00000e+00 0.00000e+00 2.22743e+02 5.022   6.21335e+01 5.022   0.9659 
1 1 1 3   54  12 o 15 7.68540e+00 9.83980e-01 1.00311e+02 155.683 -7.77398e+00 3.51279e+00  0.00000e+00 0.00000e+00 1.69272e+02 155.683 6.89617e+01 155.683 0.9394 
1 1 1 3   54  13 o 13 1.16592e+01 8.79307e-01 2.05766e+02 271.891 1.02175e+00  -3.09460e+01 0.00000e+00 0.00000e+00 2.22218e+02 271.891 1.64517e+01 271.891 0.9837 
1 1 1 3   54  14 o 17 1.01666e+01 1.11959e+00 7.83349e+01 295.158 4.48559e+00  -9.55051e+00 0.00000e+00 0.00000e+00 2.82331e+02 295.158 2.03996e+02 295.158 0.9514 
1 1 1 3   54  15 o 17 4.40852e+00 1.28827e+00 8.42578e+01 228.319 -3.38654e+00 -3.80356e+00 0.00000e+00 0.00000e+00 6.28390e+01 228.319 2.14188e+01 48.319  0.8955 
1 1 1 3   54  16 f 0  1.04881e+01 1.60758e+00 8.50502e+01 249.863 -3.50469e+00 -9.55786e+00 0.00000e+00 0.00000e+00 2.85717e+02 249.863 2.00667e+02 249.863 0.9495 
1 1 1 3   54  17 o 12 5.31215e+00 1.53993e+00 8.95082e+01 38.242  4.93623e+00  3.89034e+00  0.00000e+00 0.00000e+00 9.16018e+01 38.242  2.09354e+00 38.242  0.9166 
1 1 1 3   55  0  o 10 2.41888e+01 4.39082e-01 3.80701e+02 77.575  4.32080e+00  1.96112e+01  0.00000e+00 0.00000e+00 5.02177e+02 77.575  1.21476e+02 77.575  0.9748 
1 1 1 3   55  1  o 1  5.07351e+01 7.45332e-01 8.37857e+02 247.278 -3.51907e+01 -8.40374e+01 0.00000e+00 0.00000e+00 1.05159e+03 247.278 2.13730e+02 247.278 0.9945 
1 1 1 3   55  2  o 17 3.14760e+01 5.21296e-01 4.97607e+02 137.674 -2.56129e+01 2.33269e+01  0.00000e+00 0.00000e+00 6.63984e+02 137.674 1.66377e+02 137.674 0.9855 
1 1 1 3   55  3  o 9  6.77787e+00 5.08028e-01 1.58483e+02 0.541   2.57773e+00  2.43266e-02  0.00000e+00 0.00000e+00 3.77671e+01 0.541   1.20716e+02 180.541 0.7732 
1 1 1 3   55  4  o 16 5.57407e+01 8.76479e-01 1.04126e+03 145.848 -1.28323e+02 8.70499e+01  0.00000e+00 0.00000e+00 1.03914e+03 145.848 2.11972e+00 325.848 0.9968 
1 1 1 3   55  5  o 6  1.16965e+01 4.81799e-01 2.56391e+02 274.461 7.53863e-01  -9.66321e+00 0.00000e+00 0.00000e+00 1.58258e+02 274.461 9.81328e+01 94.461  0.9469 
1 1 1 3   55  6  o 11 1.35945e+01 5.46289e-01 1.41037e+02 57.666  3.64230e+00  5.75397e+00  0.00000e+00 0.00000e+00 3.28799e+02 57.666  1.87762e+02 57.666  0.9233 
1 1 1 3   55  7  o 10 6.88050e+00 7.07293e-01 1.16677e+02 185.299 -3.45606e+00 -3.20519e-01 0.00000e+00 0.00000e+00 9.94834e+01 185.299 1.71936e+01 5.299   0.8396 
1 1 1 3   55  8  f 0  2.88803e+01 6.74646e-01 4.97688e+02 191.789 -8.27487e+01 -1.72703e+01 0.00000e+00 0.00000e+00 5.76231e+02 191.789 7.85431e+01 191.789 0.9941 
1 1 1 3   55  9  o 15 1.79108e+01 6.32198e-01 3.56082e+02 95.590  -4.34621e+00 4.44079e+01  0.00000e+00 0.00000e+00 3.06095e+02 95.590  4.99872e+01 275.590 0.9887 
1 1 1 3   55  10 o 5  9.93782e+00 9.33184e-01 1.02379e+02 245.164 -3.42515e+00 -7.40041e+00 0.00000e+00 0.00000e+00 2.45466e+02 245.164 1.43087e+02 245.164 0.9365 
1 1 1 3   55  11 o 7  4.52755e+00 1.20039e+00 6.19093e+01 68.792  8.82610e-01  2.27452e+00  0.00000e+00 0.00000e+00 6.63380e+01 68.792  4.42873e+00 68.792  0.7583 
1 1 1 3   55  12 o 16 1.09395e+01 8.61816e-01 2.26750e+02 207.862 -2.64665e+01 -1.39909e+01 0.00000e+00 0.00000e+00 1.74781e+02 207.862 5.19688e+01 27.862  0.9832 
1 1 1 3   55  13 o 10 3.72621e+00 1.09116e+00 8.18931e+01 43.506  2.72184e+00  2.58350e+00  0.00000e+00 0.00000e+00 3.67350e+01 43.506  4.51581e+01 223.506 0.8533 
1 1 1 3   55  14 o 19 4.86106e+00 1.22968e+00 8.70651e+01 189.411 -4.91400e+00 -8.14509e-01 0.00000e+00 0.00000e+00 7.47693e+01 189.411 1.22958e+01 9.411   0.8929 
1 1 1 3   55  15 o 13 7.28071e+00 1.45484e+00 7.04691e+01 307.200 3.65186e+00  -4.81108e+00 0.00000e+00 0.00000e+00 1.77170e+02 307.200 1.06700e+02 307.200 0.9130 
1 1 1 3   55  16 o 6  4.33658e+00 1.37594e+00 8.50546e+01 357.559 5.08896e+00  -2.16941e-01 0.00000e+00 0.00000e+00 5.95037e+01 357.559 2.55509e+01 177.559 0.8955 
1 1 1 3   55  17 o 3  3.62944e+00 1.23446e+00 5.79133e+01 204.230 -3.36309e+00 -1.51352e+00 0.00000e+00 0.00000e+00 5.68700e+01 204.230 1.04328e+00 24.230  0.8504 
1 1 1 3   56  0  o 3  2.32571e+01 4.29654e-01 4.98013e+02 255.768 -6.33354e+00 -2.49711e+01 0.00000e+00 0.00000e+00 3.55625e+02 255.768 1.42388e+02 75.768  0.9804 
1 1 1 3   56  1  o 1  2.80877e+00 6.68369e-01 1.56480e+02 57.000  5.25492e-01  8.09194e-01  0.00000e+00 0.00000e+00 1.10860e+02 237.000 2.67340e+02 237.000 0.4338 
1 1 1 3   56  2  o 15 2.18870e+01 4.31019e-01 2.81114e+02 232.180 -9.10650e+00 -1.17317e+01 0.00000e+00 0.00000e+00 5.10307e+02 232.180 2.29193e+02 232.180 0.9657 
1 1 1 3   56  3  o 7  3.42707e+01 5.90623e-01 7.07182e+02 123.404 -3.47115e+01 5.26344e+01  0.00000e+00 0.00000e+00 5.65752e+02 123.404 1.41430e+02 303.404 0.9920 
1 1 1 3   56  4  o 1  2.33701e+01 4.85191e-01 5.19598e+02 146.269 -3.06252e+01 2.04484e+01  0.00000e+00 0.00000e+00 3.43373e+02 146.269 1.76225e+02 326.269 0.9863 
1 1 1 3   56  5  o 1  1.45492e+01 5.02319e-01 2.53997e+02 341.773 1.09120e+01  -3.59341e+00 0.00000e+00 0.00000e+00 2.66342e+02 341.773 1.23447e+01 341.773 0.9554 
1 1 1 3   56  6  o 18 5.06800e+00 8.00143e-01 1.59021e+02 68.990  9.73804e-01  2.53558e+00  0.00000e+00 0.00000e+00 9.83034e+00 248.990 1.68852e+02 248.990 0.7866 
1 1 1 3   56  7  o 5  1.50975e+01 5.17684e-01 1.82895e+02 152.240 -1.12363e+01 5.91409e+00  0.00000e+00 0.00000e+00 3.59242e+02 152.240 1.76347e+02 152.240 0.9598 
1 1 1 3   56  8  o 6  1.57029e+01 6.15916e-01 2.78112e+02 312.908 1.68818e+01  -1.81617e+01 0.00000e+00 0.00000e+00 2.97232e+02 312.908 1.91205e+01 312.908 0.9796 
1 1 1 3   56  9  f 0  3.13946e+00 9.10058e-01 7.42074e+01 228.930 -1.07222e+00 -1.23042e+00 0.00000e+00 0.00000e+00 6.00052e-01 48.930  7.48074e+01 48.930  0.6271 
1 1 1 3   56  10 o 11 4.02415e+00 1.02339e+00 1.51703e+02 260.364 -8.33835e-01 -4.91101e+00 0.00000e+00 0.00000e+00 1.74214e+01 80.364  1.69124e+02 80.364  0.8929 
1 1 1 3   56  11 o 12 1.09937e+01 9.72769e-01 1.86056e+02 207.077 -1.79381e+01 -9.17038e+00 0.00000e+00 0.00000e+00 2.14234e+02 207.077 2.81774e+01 207.077 0.9749 
1 1 1 3   56  12 o 7  5.75826e+00 1.06926e+00 1.68132e+02 356.026 1.01570e+01  -7.05526e-01 0.00000e+00 0.00000e+00 3.59678e+01 356.026 1.32164e+02 176.026 0.9495 
1 1 1 3   56  13 o 9  1.07482e+01 9.25791e-01 1.16649e+02 144.341 -1.32550e+01 9.51045e+00  0.00000e+00 0.00000e+00 2.71812e+02 144.341 1.55162e+02 144.341 0.9688 
1 1 1 3   56  14 o 5  9.38558e+00 1.12388e+00 1.16212e+02 246.158 -5.67677e+00 -1.28452e+01 0.00000e+00 0.00000e+00 2.20966e+02 246.158 1.04754e+02 246.158 0.9637 
1 1 1 3   56  15 f 0  3.17502e+00 1.06591e+00 3.83603e+01 331.526 1.53501e+00  -8.32528e-01 0.00000e+00 0.00000e+00 3.86768e+01 331.526 3.16494e-01 331.526 0.6514 
1 1 1 3   56  16 o 2  1.36214e+01 1.33440e+00 2.04197e+02 181.642 -3.92820e+01 -1.12582e+00 0.00000e+00 0.00000e+00 2.96278e+02 181.642 9.20814e+01 181.642 0.9872 
1 1 1 3   56  17 o 5  4.55204e+00 1.44668e+00 1.09758e+02 46.159  5.20419e+00  5.41910e+00  0.00000e+00 0.00000e+00 4.78074e+01 46.159  6.19510e+01 226.159 0.9309 
1 1 1 3   57  0  o 14 2.29000e+01 4.27927e-01 3.69133e+02 257.594 -4.44639e+00 -2.02125e+01 0.00000e+00 0.00000e+00 4.67098e+02 257.594 9.79657e+01 257.594 0.9755 
1 1 1 3   57  1  o 12 4.09224e+01 6.26617e-01 6.32402e+02 172.538 -6.13409e+01 8.03469e+00  0.00000e+00 0.00000e+00 8.87133e+02 172.538 2.54731e+02 172.538 0.9919 
1 1 1 3   57  2  o 9  9.61789e+00 4.13678e-01 2.55806e+02 241.903 -3.11226e+00 -5.82945e+00 0.00000e+00 0.00000e+00 7.57703e+01 241.903 1.80036e+02 61.903  0.9209 
1 1 1 3   57  3  o 2  1.78869e+01 4.45867e-01 3.20155e+02 251.774 -4.92669e+00 -1.49615e+01 0.00000e+00 0.00000e+00 3.27840e+02 251.774 7.68509e+00 251.774 0.9677 
1 1 1 3   57  4  o 7  3.45267e+01 6.02725e-01 5.95782e+02 57.369  3.16842e+01  4.94849e+01  0.00000e+00 0.00000e+00 6.85588e+02 57.369  8.98060e+01 57.369  0.9915 
1 1 1 3   57  5  o 2  3.94421e+01 6.72139e-01 6.13760e+02 163.354 -7.32525e+01 2.19010e+01  0.00000e+00 0.00000e+00 8.52739e+02 163.354 2.38979e+02 163.354 0.9934 
1 1 1 3   57  6  o 16 3.34299e+01 6.19246e-01 5.81818e+02 71.436  2.64486e+01  7.87550e+01  0.00000e+00 0.00000e+00 6.61529e+02 71.436  7.97114e+01 71.436  0.9940 
1 1 1 3   57  7  o 2  3.05356e+01 6.77013e-01 6.09871e+02 0.828   8.68986e+01  1.25517e+00  0.00000e+00 0.00000e+00 5.25819e+02 0.828   8.40524e+01 180.827 0.9942 
1 1 1 3   57  8  o 14 1.41629e+01 6.10127e-01 2.56673e+02 341.185 2.10058e+01  -7.15698e+00 0.00000e+00 0.00000e+00 2.60882e+02 341.185 4.20833e+00 341.185 0.9772 
1 1 1 3   57  9  o 8  3.41885e+01 8.22224e-01 4.66521e+02 227.838 -7.49339e+01 -8.27523e+01 0.00000e+00 0.00000e+00 8.05732e+02 227.838 3.39211e+02 227.838 0.9955 
1 1 1 3   57  10 o 5  9.86946e+00 9.09118e-01 9.21080e+01 297.692 3.55723e+00  -6.77771e+00 0.00000e+00 0.00000e+00 2.51642e+02 297.692 1.59534e+02 297.692 0.9322 
1 1 1 3   57  11 o 8  1.43821e+01 6.82013e-01 2.45766e+02 281.775 7.50842e+00  -3.60181e+01 0.00000e+00 0.00000e+00 2.83970e+02 281.775 3.82045e+01 281.775 0.9863 
1 1 1 3   57  12 o 19 3.22417e+00 9.49118e-01 7.28731e+01 198.064 -2.68010e+00 -8.74111e-01 0.00000e+00 0.00000e+00 2.28720e+01 198.064 5.00012e+01 18.064  0.7957 
1 1 1 3   57  13 o 17 1.01354e+01 9.49503e-01 1.58085e+02 262.518 -2.97791e+00 -2.26745e+01 0.00000e+00 0.00000e+00 2.11587e+02 262.518 5.35019e+01 262.518 0.9779 
1 1 1 3   57  14 o 11 7.79922e+00 1.28658e+00 1.58000e+02 54.618  9.05384e+00  1.27486e+01  0.00000e+00 0.00000e+00 1.23239e+02 54.618  3.47605e+01 234.618 0.9675 
1 1 1 3   57  15 o 6  1.20733e+01 1.20965e+00 2.24481e+02 225.063 -2.71317e+01 -2.71915e+01 0.00000e+00 0.00000e+00 2.19279e+02 225.063 5.20282e+00 45.063  0.9869 
1 1 1 3   57  16 o 11 4.40905e+00 1.34119e+00 6.46828e+01 326.458 3.52247e+00  -2.33518e+00 0.00000e+00 0.00000e+00 7.83382e+01 326.458 1.36554e+01 326.458 0.8717 
1 1 1 3   57  17 o 14 3.71966e+00 1.24420e+00 7.21782e+01 33.151  4.09967e+00  2.67775e+00  0.00000e+00 0.00000e+00 5.10341e+01 33.151  2.11441e+01 213.151 0.8909 
1 1 1 3   58  0  o 8  1.83677e+01 3.94910e-01 3.20197e+02 326.570 1.32142e+01  -8.72302e+00 0.00000e+00 0.00000e+00 3.45170e+02 326.570 2.49736e+01 326.570 0.9679 
1 1 1 3   58  1  o 5  6.92160e+00 4.62251e-01 1.69127e+02 61.401  1.50109e+00  2.75334e+00  0.00000e+00 0.00000e+00 4.31999e+01 61.401  1.25927e+02 241.401 0.8196 
1 1 1 3   58  2  o 4  1.73240e+01 4.12345e-01 1.95087e+02 158.738 -8.24827e+00 3.20958e+00  0.00000e+00 0.00000e+00 4.15556e+02 158.738 2.20469e+02 158.738 0.9417 
1 1 1 3   58  3  o 9  4.05102e+01 6.71743e-01 6.49442e+02 61.199  3.51098e+01  6.38612e+01  0.00000e+00 0.00000e+00 8.56411e+02 61.199  2.06968e+02 61.199  0.9931 
1 1 1 3   58  4  o 5  8.47577e+00 5.04511e-01 1.43140e+02 351.032 3.85833e+00  -6.08874e-01 0.00000e+00 0.00000e+00 1.29607e+02 351.032 1.35333e+01 171.032 0.8598 
1 1 1 3   58  5  f 0  2.40584e+01 5.13098e-01 4.91118e+02 196.638 -4.03469e+01 -1.20572e+01 0.00000e+00 0.00000e+00 3.98409e+02 196.638 9.27097e+01 16.638  0.9881 
1 1 1 3   58  6  o 12 7.46336e+00 7.11499e-01 1.29061e+02 163.537 -3.87996e+00 1.14654e+00  0.00000e+00 0.00000e+00 1.12541e+02 163.537 1.65193e+01 343.537 0.8653 
1 1 1 3   58  7  o 16 3.19173e+01 6.97315e-01 5.03476e+02 334.898 7.24501e+01  -3.39409e+01 0.00000e+00 0.00000e+00 6.82820e+02 334.898 1.79344e+02 334.898 0.9937 
1 1 1 3   58  8  o 10 2.92045e+01 6.83093e-01 4.90921e+02 196.185 -8.45978e+01 -2.45545e+01 0.00000e+00 0.00000e+00 5.94812e+02 196.185 1.03891e+02 196.185 0.9943 
1 1 1 3   58  9  o 2  1.02692e+01 8.28676e-01 1.95216e+02 104.794 -3.76182e+00 1.42439e+01  0.00000e+00 0.00000e+00 1.75328e+02 104.794 1.98875e+01 284.794 0.9654 
1 1 1 3   58  10 o 10 4.06988e+00 1.09273e+00 1.19163e+02 226.419 -2.79150e+00 -2.93328e+00 0.00000e+00 0.00000e+00 1.24115e+01 226.419 1.06752e+02 46.419  0.8654 
1 1 1 3   58  11 o 16 1.13559e+01 7.38616e-01 1.94897e+02 225.834 -1.56606e+01 -1.61232e+01 0.00000e+00 0.00000e+00 2.19569e+02 225.834 2.46719e+01 225.834 0.9775 
1 1 1 3   58  12 o 19 7.68553e+00 1.00112e+00 1.74763e+02 92.807  -7.88216e-01 1.60785e+01  0.00000e+00 0.00000e+00 1.02977e+02 92.807  7.17862e+01 272.807 0.9684 
1 1 1 3   58  13 o 3  2.87577e+00 9.31642e-01 5.92178e+01 134.826 -1.68829e+00 1.69857e+00  0.00000e+00 0.00000e+00 2.15440e+01 134.826 3.76738e+01 314.826 0.7531 
1 1 1 3   58  14 o 7  3.40733e+00 1.08801e+00 1.41850e+02 296.339 2.89776e+00  -5.85302e+00 0.00000e+00 0.00000e+00 2.50438e+01 116.339 1.66894e+02 116.339 0.9199 
1 1 1 3   58  15 o 16 5.43405e+00 1.38747e+00 1.00964e+02 115.510 -2.95074e+00 6.18356e+00  0.00000e+00 0.00000e+00 8.59750e+01 115.510 1.49894e+01 295.510 0.9238 
1 1 1 3   58  16 o 7  5.76507e+00 1.44187e+00 6.81384e+01 100.729 -9.71271e-01 5.12621e+00  0.00000e+00 0.00000e+00 1.24525e+02 100.729 5.63861e+01 100.729 0.8982 
1 1 1 3   58  17 o 9  4.83113e+00 1.49662e+00 1.00740e+02 60.252  3.38694e+00  5.92637e+00  0.00000e+00 0.00000e+00 6.51197e+01 60.252  3.56202e+01 240.252 0.9235 
1 1 1 3   59  0  o 19 7.76519e+00 4.14226e-01 1.94931e+02 53.905  2.33729e+00  3.20577e+00  0.00000e+00 0.00000e+00 5.56217e+01 53.905  1.39309e+02 233.905 0.8623 
1 1 1 3   59  1  o 16 2.02891e+01 4.19379e-01 4.66919e+02 28.406  2.29863e+01  1.24315e+01  0.00000e+00 0.00000e+00 2.77707e+02 28.406  1.89211e+02 208.405 0.9807 
1 1 1 3   59  2  o 1  1.15401e+01 4.11149e-01 5.93665e+01 226.284 -1.33427e+00 -1.39544e+00 0.00000e+00 0.00000e+00 2.36934e+02 226.284 1.77568e+02 226.284 0.6861 
1 1 1 3   59  3  o 16 1.85460e+01 4.48081e-01 3.40817e+02 195.698 -1.75338e+01 -4.92785e+00 0.00000e+00 0.00000e+00 3.33915e+02 195.698 6.90241e+00 15.698  0.9721 
1 1 1 3   59  4  f 0  8.26216e+00 5.26406e-01 1.27868e+02 303.521 1.86903e+00  -2.82148e+00 0.00000e+00 0.00000e+00 1.30239e+02 303.521 2.37106e+00 303.521 0.8348 
1 1 1 3   59  5  o 16 3.76061e+01 6.53802e-01 6.34310e+02 123.462 -4.49537e+01 6.80143e+01  0.00000e+00 0.00000e+00 7.64053e+02 123.462 1.29743e+02 123.462 0.9938 
1 1 1 3   59  6  o 5  1.03470e+01 5.43856e-01 3.58548e+02 301.888 8.60112e+00  -1.38248e+01 0.00000e+00 0.00000e+00 1.64171e+01 301.888 3.42131e+02 121.888 0.9688 
1 1 1 3   59  7  o 3  5.53222e+00 8.96831e-01 1.70343e+02 283.510 1.13657e+00  -4.73065e+00 0.00000e+00 0.00000e+00 1.38179e+01 283.510 1.56525e+02 103.510 0.8902 
1 1 1 3   59  8  o 1  8.53158e+00 7.56032e-01 2.14964e+02 357.488 1.21520e+01  -5.33183e-01 0.00000e+00 0.00000e+00 9.05719e+01 357.488 1.24392e+02 177.488 0.9580 
1 1 1 3   59  9  o 4  1.47162e+01 7.11142e-01 3.40084e+02 46.930  2.63185e+01  2.81543e+01  0.00000e+00 0.00000e+00 2.02662e+02 46.930  1.37421e+02 226.930 0.9869 
1 1 1 3   59  10 o 2  5.53897e+00 1.10138e+00 1.12059e+02 205.260 -4.71442e+00 -2.22444e+00 0.00000e+00 0.00000e+00 7.37471e+01 205.260 3.83123e+01 25.260  0.8981 
1 1 1 3   59  11 o 19 1.05945e+01 7.32857e-01 1.86518e+02 151.657 -1.91270e+01 1.03175e+01  0.00000e+00 0.00000e+00 1.99788e+02 151.657 1.32701e+01 151.657 0.9767 
1 1 1 3   59  12 f 0  9.00150e+00 9.10848e-01 1.81718e+02 269.140 -3.07349e-01 -2.04686e+01 0.00000e+00 0.00000e+00 1.45823e+02 269.140 3.58948e+01 89.140  0.9753 
1 1 1 3   59  13 f 0  4.65109e+00 1.14087e+00 8.31549e+01 283.345 1.13186e+00  -4.77120e+00 0.00000e+00 0.00000e+00 7.13820e+01 283.345 1.17729e+01 103.345 0.8911 
1 1 1 3   59  14 f 0  3.37395e+00 1.06899e+00 7.12559e+01 289.132 1.14917e+00  -3.31266e+00 0.00000e+00 0.00000e+00 3.45243e+01 289.132 3.67316e+01 109.132 0.8414 
1 1 1 3   59  15 o 9  1.59986e+01 1.01578e+00 1.84347e+02 98.550  -6.69704e+00 4.45474e+01  0.00000e+00 0.00000e+00 4.04658e+02 98.550  2.20310e+02 98.550  0.9888 
1 1 1 3   59  16 f 0  6.89054e+00 1.64756e+00 6.99252e+01 148.961 -4.92349e+00 2.96291e+00  0.00000e+00 0.00000e+00 1.62885e+02 148.961 9.29600e+01 148.961 0.9082 
1 1 1 3   59  17 o 15 3.93556e+00 1.32278e+00 8.33317e+01 216.631 -4.46396e+00 -3.31896e+00 0.00000e+00 0.00000e+00 4.90457e+01 216.631 3.42860e+01 36.631  0.9050 
1 1 1 3   60  0  o 3  2.22191e+01 4.29147e-01 3.38360e+02 25.275  1.86839e+01  8.82178e+00  0.00000e+00 0.00000e+00 4.72585e+02 25.275  1.34226e+02 25.275  0.9755 
1 1 1 3   60  1  o 2  2.29074e+01 4.70704e-01 4.05002e+02 243.489 -1.16301e+01 -2.33151e+01 0.00000e+00 0.00000e+00 4.35531e+02 243.489 3.05291e+01 243.489 0.9806 
1 1 1 3   60  2  o 11 2.55287e+01 4.73017e-01 5.18566e+02 41.459  2.99891e+01  2.64937e+01  0.00000e+00 0.00000e+00 4.24679e+02 41.459  9.38862e+01 221.459 0.9874 
1 1 1 3   60  3  o 17 6.73575e+00 5.57676e-01 1.43975e+02 315.415 2.21561e+00  -2.18372e+00 0.00000e+00 0.00000e+00 6.21562e+01 315.415 8.18183e+01 135.415 0.8179 
1 1 1 3   60  4  o 4  1.73616e+01 5.13859e-01 3.72019e+02 201.398 -1.98264e+01 -7.76922e+00 0.00000e+00 0.00000e+00 2.62114e+02 201.398 1.09905e+02 21.398  0.9762 
1 1 1 3   60  5  o 3  1.04950e+01 5.09243e-01 3.64611e+02 149.012 -1.41572e+01 8.50236e+00  0.00000e+00 0.00000e+00 1.59149e+01 149.012 3.48696e+02 329.012 0.9692 
1 1 1 3   60  6  o 18 4.64685e+00 8.87618e-01 1.48014e+02 181.976 -3.19042e+00 -1.10049e-01 0.00000e+00 0.00000e+00 4.93678e+00 1.976   1.52951e+02 1.976   0.8233 
1 1 1 3   60  7  o 7  1.60145e+01 6.24658e-01 1.89719e+02 155.330 -1.56748e+01 7.19953e+00  0.00000e+00 0.00000e+00 3.91443e+02 155.330 2.01724e+02 155.330 0.9706 
1 1 1 3   60  8  o 2  5.29593e+00 9.80087e-01 1.33547e+02 250.028 -1.65664e+00 -4.55849e+00 0.00000e+00 0.00000e+00 4.25855e+01 250.028 9.09619e+01 70.028  0.8898 
1 1 1 3   60  9  o 4  1.17367e+01 7.64970e-01 1.17498e+02 21.678  1.05872e+01  4.20854e+00  0.00000e+00 0.00000e+00 3.01305e+02 21.678  1.83806e+02 21.678  0.9551 
1 1 1 3   60  10 o 19 5.63220e+00 9.42520e-01 7.95847e+01 30.956  3.39818e+00  2.03828e+00  0.00000e+00 0.00000e+00 1.01741e+02 30.956  2.21559e+01 30.956  0.8621 
1 1 1 3   60  11 o 18 1.39249e+01 6.86936e-01 1.85422e+02 219.339 -2.46466e+01 -2.02013e+01 0.00000e+00 0.00000e+00 3.26117e+02 219.339 1.40695e+02 219.339 0.9842 
1 1 1 3   60  12 o 19 3.12661e+00 9.38850e-01 1.20284e+02 156.793 -4.41609e+00 1.89338e+00  0.00000e+00 0.00000e+00 1.66351e+01 336.793 1.36919e+02 336.793 0.8887 
1 1 1 3   60  13 o 11 7.81790e+00 1.10927e+00 1.16123e+02 71.879  3.63402e+00  1.11044e+01  0.00000e+00 0.00000e+00 1.62565e+02 71.879  4.64418e+01 71.879  0.9562 
1 1 1 3   60  14 o 11 3.14050e+00 9.86632e-01 4.96481e+01 178.128 -2.42796e+00 7.93513e-02  0.00000e+00 0.00000e+00 3.89275e+01 178.128 1.07207e+01 358.128 0.7571 
1 1 1 3   60  15 o 1  4.45195e+00 1.34762e+00 1.28914e+02 67.290  2.88421e+00  6.89164e+00  0.00000e+00 0.00000e+00 2.52855e+01 67.290  1.03628e+02 247.290 0.9304 
1 1 1 3   60  16 o 6  6.09617e+00 1.51282e+00 6.44593e+01 153.043 -4.58205e+00 2.33030e+00  0.00000e+00 0.00000e+00 1.38829e+02 153.043 7.43695e+01 153.043 0.8965 
1 1 1 3   60  17 o 9  3.54188e+00 1.20884e+00 5.73211e+01 314.217 2.61731e+00  -2.68980e+00 0.00000e+00 0.00000e+00 5.49937e+01 314.217 2.32738e+00 134.217 0.8533 
1 1 1 3   61  0  o 2  1.61960e+01 3.93758e-01 1.46710e+02 359.254 7.22168e+00  -9.40203e-02 0.00000e+00 0.00000e+00 4.15492e+02 359.254 2.68782e+02 359.254 0.9279 
1 1 1 3   61  1  o 10 9.26437e+00 4.57418e-01 2.14521e+01 121.982 -3.18146e-01 5.09492e-01  0.00000e+00 0.00000e+00 7.82132e+01 121.982 5.67611e+01 121.982 0.2876 
1 1 1 3   61  2  o 16 5.77737e+01 8.47093e-01 1.05568e+03 44.725  1.36050e+02  1.34751e+02  0.00000e+00 0.00000e+00 1.10014e+03 44.725  4.44555e+01 44.725  0.9974 
1 1 1 3   61  3  o 15 3.86192e+01 6.51100e-01 5.80248e+02 201.906 -6.59885e+01 -2.65358e+01 0.00000e+00 0.00000e+00 8.54365e+02 201.906 2.74117e+02 201.906 0.9929 
1 1 1 3   61  4  o 17 2.02290e+01 5.56557e-01 2.88749e+02 66.566  8.22344e+00  1.89726e+01  0.00000e+00 0.00000e+00 4.49449e+02 66.566  1.60699e+02 66.566  0.9755 
1 1 1 3   61  5  o 2  7.51173e+00 5.87555e-01 9.57583e+01 262.866 -3.80052e-01 -3.03636e+00 0.00000e+00 0.00000e+00 1.33032e+02 262.866 3.72742e+01 262.866 0.8143 
1 1 1 3   61  6  o 18 7.74421e+00 6.78056e-01 1.05289e+02 67.633  1.44360e+00  3.50824e+00  0.00000e+00 0.00000e+00 1.42336e+02 67.633  3.70468e+01 67.633  0.8551 
1 1 1 3   61  7  o 16 8.33773e+00 6.81897e-01 2.10381e+02 126.193 -5.86294e+00 8.01283e+00  0.00000e+00 0.00000e+00 8.51772e+01 126.193 1.25203e+02 306.193 0.9482 
1 1 1 3   61  8  o 19 1.28378e+01 7.05823e-01 2.97562e+02 319.746 2.13157e+01  -1.80479e+01 0.00000e+00 0.00000e+00 1.73538e+02 319.746 1.24024e+02 139.746 0.9819 
1 1 1 3   61  9  o 6  4.29559e+00 1.01899e+00 5.05853e+01 261.461 -2.63890e-01 -1.75750e+00 0.00000e+00 0.00000e+00 5.49349e+01 261.461 4.34958e+00 261.461 0.6576 
1 1 1 3   61  10 o 12 1.08851e+01 6.62028e-01 2.09352e+02 120.537 -1.20302e+01 2.03934e+01  0.00000e+00 0.00000e+00 1.88413e+02 120.537 2.09393e+01 300.537 0.9786 
1 1 1 3   61  11 o 15 5.26524e+00 9.88507e-01 1.45941e+02 234.018 -5.18406e+00 -7.13989e+00 0.00000e+00 0.00000e+00 3.90626e+01 234.018 1.06878e+02 54.018  0.9415 
1 1 1 3   61  12 o 16 7.77917e+00 9.40642e-01 1.64910e+02 248.919 -5.79808e+00 -1.50408e+01 0.00000e+00 0.00000e+00 1.16090e+02 248.919 4.88197e+01 68.919  0.9685 
1 1 1 3   61  13 o 8  1.42446e+01 8.48152e-01 2.85543e+02 344.756 5.75049e+01  -1.56715e+01 0.00000e+00 0.00000e+00 2.40940e+02 344.756 4.46032e+01 164.756 0.9916 
1 1 1 3   61  14 o 3  6.88863e+00 1.36276e+00 1.83663e+02 174.643 -1.59283e+01 1.49354e+00  0.00000e+00 0.00000e+00 6.47711e+01 174.643 1.18892e+02 354.643 0.9682 
1 1 1 3   61  15 o 16 3.83399e+00 1.16325e+00 1.33121e+02 3.142   7.68676e+00  4.21990e-01  0.00000e+00 0.00000e+00 4.15924e-02 183.142 1.33163e+02 183.142 0.9326 
1 1 1 3   61  16 f 0  5.62630e+00 1.52893e+00 2.10707e+01 86.351  9.77989e-02  1.53368e+00  0.00000e+00 0.00000e+00 1.05537e+02 86.351  8.44664e+01 86.351  0.6051 
1 1 1 3   61  17 o 19 6.33384e+00 1.73305e+00 8.80630e+01 151.705 -5.90515e+00 3.17892e+00  0.00000e+00 0.00000e+00 1.28943e+02 151.705 4.08797e+01 151.705 0.9221 
1 1 1 3   62  0  o 6  1.00311e+01 4.11685e-01 2.08538e+02 344.594 5.80454e+00  -1.59944e+00 0.00000e+00 0.00000e+00 1.33886e+02 344.594 7.46517e+01 164.594 0.9127 
1 1 1 3   62  1  o 12 2.41798e+01 4.56241e-01 3.31693e+02 107.579 -7.83177e+00 2.47200e+01  0.00000e+00 0.00000e+00 5.55148e+02 107.579 2.23455e+02 107.579 0.9805 
1 1 1 3   62  2  o 3  4.29831e+01 6.64620e-01 6.69919e+02 332.188 7.82555e+01  -4.12805e+01 0.00000e+00 0.00000e+00 9.28817e+02 332.188 2.58898e+02 332.188 0.9943 
1 1 1 3   62  3  o 3  1.38201e+01 4.45057e-01 2.65480e+02 177.493 -1.21258e+01 5.30845e-01  0.00000e+00 0.00000e+00 2.29690e+02 177.493 3.57902e+01 357.493 0.9579 
1 1 1 3   62  4  f 0  2.58275e+01 6.43809e-01 3.60504e+02 290.512 1.26511e+01  -3.38155e+01 0.00000e+00 0.00000e+00 5.92017e+02 290.512 2.31513e+02 290.512 0.9861 
1 1 1 3   62  5  o 4  1.49868e+01 5.40052e-01 3.25198e+02 156.368 -1.95966e+01 8.57441e+00  0.00000e+00 0.00000e+00 2.21987e+02 156.368 1.03211e+02 336.368 0.9763 
1 1 1 3   62  6  o 17 1.37183e+01 5.61219e-01 1.55007e+02 271.669 3.36497e-01  -1.15503e+01 0.00000e+00 0.00000e+00 3.35171e+02 271.669 1.80165e+02 271.669 0.9557 
1 1 1 3   62  7  o 3  6.00969e+00 8.40738e-01 7.50484e+01 203.031 -2.48205e+00 -1.05515e+00 0.00000e+00 0.00000e+00 1.01247e+02 203.031 2.61982e+01 203.031 0.7848 
1 1 1 3   62  8  o 11 1.67428e+01 6.84786e-01 3.84440e+02 284.829 1.25094e+01  -4.72481e+01 0.00000e+00 0.00000e+00 2.34724e+02 284.829 1.49716e+02 104.829 0.9897 
1 1 1 3   62  9  o 18 1.53999e+01 7.02801e-01 2.94229e+02 129.235 -2.54728e+01 3.11939e+01  0.00000e+00 0.00000e+00 2.73774e+02 129.235 2.04549e+01 309.235 0.9875 
1 1 1 3   62  10 o 1  6.94020e+00 8.25159e-01 1.41011e+02 242.205 -4.72042e+00 -8.95491e+00 0.00000e+00 0.00000e+00 1.04936e+02 242.205 3.60752e+01 62.205  0.9492 
1 1 1 3   62  11 o 12 1.41090e+01 6.62598e-01 2.80793e+02 187.844 -5.07502e+01 -6.99158e+00 0.00000e+00 0.00000e+00 2.40503e+02 187.844 4.02897e+01 7.844   0.9902 
1 1 1 3   62  12 o 3  1.25298e+01 7.75168e-01 2.40123e+02 21.518  3.97855e+01  1.56865e+01  0.00000e+00 0.00000e+00 2.21642e+02 21.518  1.84816e+01 201.518 0.9882 
1 1 1 3   62  13 o 2  4.98844e+00 1.16841e+00 7.79754e+01 172.109 -4.68959e+00 6.50004e-01  0.00000e+00 0.00000e+00 8.68952e+01 172.109 8.91986e+00 172.109 0.8868 
1 1 1 3   62  14 o 15 9.57783e+00 1.20178e+00 1.86025e+02 323.893 2.08839e+01  -1.52327e+01 0.00000e+00 0.00000e+00 1.63700e+02 323.893 2.23250e+01 143.893 0.9805 
1 1 1 3   62  15 o 4  5.61340e+00 1.39774e+00 1.19295e+02 119.172 -4.25301e+00 7.61845e+00  0.00000e+00 0.00000e+00 7.72354e+01 119.172 4.20593e+01 299.172 0.9408 
1 1 1 3   62  16 o 7  8.26725e+00 1.53417e+00 1.26413e+02 334.982 1.21506e+01  -5.67059e+00 0.00000e+00 0.00000e+00 1.69289e+02 334.982 4.28756e+01 334.982 0.9620 
1 1 1 3   62  17 o 8  3.92622e+00 1.30888e+00 7.07431e+01 66.478  1.90161e+00  4.36889e+00  0.00000e+00 0.00000e+00 5.87234e+01 66.478  1.20196e+01 246.478 0.8876 
1 1 1 3   63  0  o 18 2.28938e+01 4.43208e-01 3.35377e+02 141.166 -1.86611e+01 1.50224e+01  0.00000e+00 0.00000e+00 5.02688e+02 141.166 1.67312e+02 141.166 0.9789 
1 1 1 3   63  1  o 10 2.21849e+01 4.43988e-01 4.06361e+02 4.888   2.79635e+01  2.39149e+00  0.00000e+00 0.00000e+00 4.08412e+02 4.888   2.05089e+00 4.888   0.9820 
1 1 1 3   63  2  o 2  2.78737e+01 4.99621e-01 3.79640e+02 49.455  2.27352e+01  2.65774e+01  0.00000e+00 0.00000e+00 6.47825e+02 49.455  2.68184e+02 49.455  0.9856 
1 1 1 3   63  3  o 12 2.85615e+01 5.38300e-01 6.11550e+02 139.365 -4.57793e+01 3.92856e+01  0.00000e+00 0.00000e+00 4.47726e+02 139.365 1.63825e+02 319.365 0.9917 
1 1 1 3   63  4  o 2  2.09254e+01 5.92265e-01 3.30709e+02 9.807   2.90946e+01  5.02925e+00  0.00000e+00 0.00000e+00 4.38439e+02 9.807   1.07730e+02 9.807   0.9829 
1 1 1 3   63  5  o 17 2.40454e+01 5.91595e-01 3.80442e+02 84.957  3.87787e+00  4.39417e+01  0.00000e+00 0.00000e+00 5.08357e+02 84.957  1.27914e+02 84.957  0.9886 
1 1 1 3   63  6  o 8  1.68044e+01 5.61809e-01 4.46199e+02 49.353  2.91153e+01  3.39126e+01  0.00000e+00 0.00000e+00 1.74907e+02 49.353  2.71292e+02 229.353 0.9887 
1 1 1 3   63  7  f 0  1.77622e+01 6.33551e-01 3.58289e+02 294.910 1.81566e+01  -3.90972e+01 0.00000e+00 0.00000e+00 2.97760e+02 294.910 6.05285e+01 114.910 0.9883 
1 1 1 3   63  8  o 19 1.23121e+01 7.04338e-01 1.68458e+02 82.193  2.29809e+00  1.67613e+01  0.00000e+00 0.00000e+00 2.77697e+02 82.193  1.09239e+02 82.193  0.9700 
1 1 1 3   63  9  o 11 1.10706e+01 6.15961e-01 1.43928e+02 181.271 -1.52371e+01 -3.38072e-01 0.00000e+00 0.00000e+00 2.55688e+02 181.271 1.11760e+02 181.271 0.9666 
1 1 1 3   63  10 o 5  1.33261e+01 6.21193e-01 2.50266e+02 92.682  -1.74447e+00 3.72353e+01  0.00000e+00 0.00000e+00 2.40433e+02 92.682  9.83372e+00 272.682 0.9865 
1 1 1 3   63  11 o 10 7.24106e+00 8.95094e-01 8.36638e+01 302.398 3.98453e+00  -6.27908e+00 0.00000e+00 0.00000e+00 1.67599e+02 302.398 8.39350e+01 302.398 0.9301 
1 1 1 3   63  12 o 4  5.38340e+00 1.08182e+00 1.14568e+02 45.380  5.16393e+00  5.23293e+00  0.00000e+00 0.00000e+00 7.19568e+01 45.380  4.26107e+01 225.380 0.9293 
1 1 1 3   63  13 o 1  6.02442e+00 1.07540e+00 1.34400e+02 284.843 2.93149e+00  -1.10613e+01 0.00000e+00 0.00000e+00 8.00349e+01 284.843 5.43647e+01 104.843 0.9553 
1 1 1 3   63  14 o 7  1.57204e+01 9.63221e-01 2.77922e+02 5.433   6.92273e+01  6.58375e+00  0.00000e+00 0.00000e+00 3.03209e+02 5.433   2.52867e+01 5.433   0.9928 
1 1 1 3   63  15 o 10 8.58840e+00 1.41506e+00 1.45121e+02 139.276 -1.22886e+01 1.05790e+01  0.00000e+00 0.00000e+00 1.64410e+02 139.276 1.92892e+01 139.276 0.9687 
1 1 1 3   63  16 o 5  4.49524e+00 1.37204e+00 6.41145e+01 140.990 -3.36512e+00 2.72596e+00  0.00000e+00 0.00000e+00 8.21341e+01 140.990 1.80197e+01 140.990 0.8751 
1 1 1 3   63  17 o 17 6.13231e+00 1.67478e+00 1.06523e+02 53.798  5.28879e+00  7.22578e+00  0.00000e+00 0.00000e+00 1.08128e+02 53.798  1.60531e+00 53.798  0.9424 
1 1 1 3   64  0  f 0  1.33311e+01 4.01163e-01 1.25444e+02 32.983  4.50677e+00  2.92486e+00  0.00000e+00 0.00000e+00 3.23830e+02 32.983  1.98386e+02 32.983  0.9014 
1 1 1 3   64  1  o 13 2.27757e+01 4.47219e-01 4.10000e+02 118.210 -1.46174e+01 2.72495e+01  0.00000e+00 0.00000e+00 4.27755e+02 118.210 1.77544e+01 118.210 0.9837 
1 1 1 3   64  2  o 9  1.18631e+01 4.41425e-01 1.80785e+02 278.471 1.12861e+00  -7.57810e+00 0.00000e+00 0.00000e+00 2.32764e+02 278.471 5.19786e+01 278.471 0.9323 
1 1 1 3   64  3  o 15 1.11485e+01 4.74313e-01 1.72454e+02 210.472 -6.50827e+00 -3.82941e+00 0.00000e+00 0.00000e+00 2.15742e+02 210.472 4.32884e+01 210.472 0.9312 
1 1 1 3   64  4  o 2  1.36656e+01 5.44023e-01 3.65164e+02 243.955 -9.63170e+00 -1.97083e+01 0.00000e+00 0.00000e+00 1.33993e+02 243.955 2.31172e+02 63.955  0.9769 
1 1 1 3   64  5  o 8  3.97655e+00 9.10933e-01 5.98491e+01 198.502 -1.01635e+00 -3.40108e-01 0.00000e+00 0.00000e+00 1.02025e+01 198.502 4.96466e+01 18.502  0.4712 
1 1 1 3   64  6  o 11 2.73156e+01 6.35746e-01 4.26752e+02 71.174  2.14658e+01  6.29613e+01  0.00000e+00 0.00000e+00 5.86466e+02 71.174  1.59715e+02 71.174  0.9925 
1 1 1 3   64  7  o 13 4.53924e+00 9.58823e-01 1.16814e+02 265.052 -3.15157e-01 -3.64003e+00 0.00000e+00 0.00000e+00 2.71393e+01 265.052 8.96749e+01 85.052  0.8487 
1 1 1 3   64  8  o 11 1.46718e+01 6.57914e-01 2.31546e+02 225.378 -2.02297e+01 -2.04984e+01 0.00000e+00 0.00000e+00 3.06877e+02 225.378 7.53305e+01 225.378 0.9825 
1 1 1 3   64  9  o 15 2.33184e+01 5.87872e-01 3.11561e+02 227.872 -4.73593e+01 -5.23625e+01 0.00000e+00 0.00000e+00 5.52896e+02 227.872 2.41336e+02 227.872 0.9929 
1 1 1 3   64  10 o 18 1.08061e+01 7.16315e-01 1.47850e+02 1.688   1.62828e+01  4.79808e-01  0.00000e+00 0.00000e+00 2.42855e+02 1.688   9.50046e+01 1.688   0.9688 
1 1 1 3   64  11 o 11 1.15670e+01 7.18334e-01 1.79991e+02 76.555  6.08085e+00  2.54361e+01  0.00000e+00 0.00000e+00 2.43135e+02 76.555  6.31439e+01 76.555  0.9807 
1 1 1 3   64  12 o 18 7.38015e+00 9.87335e-01 1.11542e+02 289.083 3.76521e+00  -1.08835e+01 0.00000e+00 0.00000e+00 1.51352e+02 289.083 3.98106e+01 289.083 0.9555 
1 1 1 3   64  13 o 11 5.56388e+00 1.19777e+00 6.97693e+01 170.908 -5.13305e+00 8.21457e-01  0.00000e+00 0.00000e+00 1.16327e+02 170.908 4.65574e+01 170.908 0.8978 
1 1 1 3   64  14 f 0  3.24930e+00 1.05178e+00 3.19566e+01 71.806  4.68150e-01  1.42442e+00  0.00000e+00 0.00000e+00 4.01376e+01 71.806  8.18099e+00 71.806  0.5960 
1 1 1 3   64  15 o 3  8.03382e+00 1.46167e+00 9.60418e+01 359.969 9.97497e+00  -5.46088e-03 0.00000e+00 0.00000e+00 1.87418e+02 359.969 9.13761e+01 359.969 0.9485 
1 1 1 3   64  16 o 4  6.00928e+00 1.54644e+00 8.22763e+01 229.580 -4.38373e+00 -5.14726e+00 0.00000e+00 0.00000e+00 1.23834e+02 229.580 4.15580e+01 229.580 0.9228 
1 1 1 3   65  0  o 18 1.58801e+01 4.07403e-01 2.81937e+02 208.379 -1.41150e+01 -7.62536e+00 0.00000e+00 0.00000e+00 2.92891e+02 208.379 1.09537e+01 208.379 0.9683 
1 1 1 3   65  1  o 19 6.20735e+00 5.53384e-01 1.94584e+02 282.831 9.49841e-01  -4.17046e+00 0.00000e+00 0.00000e+00 8.10236e+00 282.831 1.86482e+02 102.830 0.8734 
1 1 1 3   65  2  o 4  2.57788e+01 5.17993e-01 4.78503e+02 92.997  -2.53010e+00 4.83195e+01  0.00000e+00 0.00000e+00 4.75276e+02 92.997  3.22746e+00 272.997 0.9896 
1 1 1 3   65  3  o 5  3.75154e+01 6.44199e-01 6.10094e+02 308.503 6.03511e+01  -7.58630e+01 0.00000e+00 0.00000e+00 7.85194e+02 308.503 1.75100e+02 308.503 0.9948 
1 1 1 3   65  4  o 18 2.62790e+01 6.09583e-01 4.26707e+02 34.414  4.21256e+01  2.88594e+01  0.00000e+00 0.00000e+00 5.45995e+02 34.414  1.19288e+02 34.414  0.9902 
1 1 1 3   65  5  o 16 1.21859e+01 5.65338e-01 2.84058e+02 27.008  1.67309e+01  8.52766e+00  0.00000e+00 0.00000e+00 1.59110e+02 27.008  1.24948e+02 207.008 0.9730 
1 1 1 3   65  6  o 2  3.81250e+00 9.67918e-01 9.24874e+01 150.899 -1.76117e+00 9.80300e-01  0.00000e+00 0.00000e+00 7.28563e+00 150.899 8.52018e+01 330.899 0.7003 
1 1 1 3   65  7  o 2  1.05417e+01 6.90584e-01 1.04835e+02 307.933 4.97773e+00  -6.38648e+00 0.00000e+00 0.00000e+00 2.63797e+02 307.933 1.58962e+02 307.933 0.9360 
1 1 1 3   65  8  o 3  9.59802e+00 7.51813e-01 1.62676e+02 241.311 -6.28437e+00 -1.14841e+01 0.00000e+00 0.00000e+00 1.81793e+02 241.311 1.91170e+01 241.311 0.9610 
1 1 1 3   65  9  o 2  4.13298e+00 8.70805e-01 7.17480e+01 62.859  1.34746e+00  2.62848e+00  0.00000e+00 0.00000e+00 5.26852e+01 62.859  1.90628e+01 242.859 0.8065 
1 1 1 3   65  10 o 9  9.10058e+00 7.49625e-01 1.81007e+02 79.559  3.42279e+00  1.85751e+01  0.00000e+00 0.00000e+00 1.49453e+02 79.559  3.15535e+01 259.559 0.9732 
1 1 1 3   65  11 o 12 1.36871e+01 6.97136e-01 1.67978e+02 248.864 -1.12761e+01 -2.91685e+01 0.00000e+00 0.00000e+00 3.34241e+02 248.864 1.66263e+02 248.864 0.9839 
1 1 1 3   65  12 o 13 7.77902e+00 9.67185e-01 1.58217e+02 145.872 -1.41572e+01 9.59520e+00  0.00000e+00 0.00000e+00 1.23118e+02 145.872 3.50989e+01 325.872 0.9703 
1 1 1 3   65  13 o 12 2.56070e+00 8.68882e-01 4.87609e+00 48.968  1.24161e-01  1.42669e-01  0.00000e+00 0.00000e+00 4.10369e+00 48.968  7.72401e-01 228.968 0.0941 
1 1 1 3   65  14 o 2  1.11272e+01 1.13048e+00 2.09473e+02 262.013 -4.82078e+00 -3.43600e+01 0.00000e+00 0.00000e+00 1.98692e+02 262.013 1.07809e+01 82.013  0.9855 
1 1 1 3   65  15 o 16 5.89995e+00 1.42695e+00 1.10915e+02 355.605 9.07831e+00  -6.97712e-01 0.00000e+00 0.00000e+00 9.61000e+01 355.605 1.48154e+01 175.605 0.9434 
1 1 1 3   65  16 o 1  5.12661e+00 1.38505e+00 7.26649e+01 94.549  -4.66891e-01 5.86875e+00  0.00000e+00 0.00000e+00 1.00818e+02 94.549  2.81528e+01 94.549  0.9106 
1 1 1 3   66  0  o 2  1.29127e+01 4.09984e-01 2.82522e+02 271.326 2.92858e-01  -1.26537e+01 0.00000e+00 0.00000e+00 1.80624e+02 271.326 1.01898e+02 91.326  0.9596 
1 1 1 3   66  1  o 7  6.95279e+00 5.18214e-01 1.14100e+02 225.680 -2.17132e+00 -2.22349e+00 0.00000e+00 0.00000e+00 9.83985e+01 225.680 1.57016e+01 45.680  0.8177 
1 1 1 3   66  2  o 10 2.41845e+01 4.74040e-01 5.04696e+02 258.999 -1.00455e+01 -5.16756e+01 0.00000e+00 0.00000e+00 3.90697e+02 258.999 1.13998e+02 78.999  0.9905 
1 1 1 3   66  3  o 10 4.41376e+00 7.58256e-01 1.66784e+02 358.259 3.15780e+00  -9.59505e-02 0.00000e+00 0.00000e+00 3.13170e+01 178.260 1.98101e+02 178.260 0.8211 
1 1 1 3   66  4  o 14 1.08962e+01 5.62438e-01 1.51241e+02 160.687 -7.33446e+00 2.57037e+00  0.00000e+00 0.00000e+00 2.28826e+02 160.687 7.75852e+01 160.687 0.9333 
1 1 1 3   66  5  o 9  3.92944e+00 8.73741e-01 7.76613e+01 291.715 6.17310e-01  -1.55004e+00 0.00000e+00 0.00000e+00 1.55982e+01 291.715 6.20631e+01 111.715 0.6351 
1 1 1 3   66  6  o 6  8.67681e+00 8.08285e-01 1.80800e+02 269.518 -8.67504e-02 -1.03125e+01 0.00000e+00 0.00000e+00 1.27238e+02 269.518 5.35625e+01 89.518  0.9502 
1 1 1 3   66  7  o 11 8.97608e+00 7.33492e-01 1.59958e+02 8.987   1.06524e+01  1.68469e+00  0.00000e+00 0.00000e+00 1.59368e+02 8.987   5.90401e-01 188.987 0.9524 
1 1 1 3   66  8  o 8  1.88728e+01 5.42239e-01 3.28521e+02 181.325 -5.70410e+01 -1.31945e+00 0.00000e+00 0.00000e+00 3.69965e+02 181.325 4.14440e+01 181.325 0.9912 
1 1 1 3   66  9  o 19 7.17640e+00 7.37063e-01 1.30263e+02 179.356 -9.50977e+00 1.06956e-01  0.00000e+00 0.00000e+00 1.23089e+02 179.356 7.17471e+00 359.356 0.9459 
1 1 1 3   66  10 o 13 1.05748e+01 6.78900e-01 2.04234e+02 180.710 -2.66661e+01 -3.30676e-01 0.00000e+00 0.00000e+00 1.82808e+02 180.710 2.14257e+01 0.710   0.9811 
1 1 1 3   66  11 o 2  2.61020e+00 8.14494e-01 8.73076e+01 189.470 -3.02766e+00 -5.05007e-01 0.00000e+00 0.00000e+00 7.98622e+00 9.470   9.52939e+01 9.470   0.8150 
1 1 1 3   66  12 o 16 6.56657e+00 1.05997e+00 1.20595e+02 288.461 3.29541e+00  -9.87134e+00 0.00000e+00 0.00000e+00 1.12041e+02 288.461 8.55417e+00 108.461 0.9507 
1 1 1 3   66  13 o 19 4.27392e+00 1.14433e+00 5.60479e+01 253.854 -9.29143e-01 -3.20954e+00 0.00000e+00 0.00000e+00 7.64383e+01 253.854 2.03904e+01 253.854 0.8324 
1 1 1 3   66  14 o 12 4.04140e+00 1.18746e+00 5.68173e+01 350.975 3.36276e+00  -5.34087e-01 0.00000e+00 0.00000e+00 6.89164e+01 350.975 1.20991e+01 350.975 0.8360 
1 1 1 3   66  15 o 14 4.74114e+00 1.33678e+00 9.44728e+01 172.204 -6.35279e+00 8.69793e-01  0.00000e+00 0.00000e+00 6.74354e+01 172.204 2.70374e+01 352.204 0.9183 
1 1 1 3   66  16 o 2  4.39712e+00 1.32410e+00 6.61329e+01 54.154  2.91227e+00  4.03110e+00  0.00000e+00 0.00000e+00 7.97261e+01 54.154  1.35931e+01 54.154  0.8928 
1 1 1 3   67  0  o 3  1.49253e+01 4.07488e-01 2.76775e+02 19.826  1.68536e+01  6.07640e+00  0.00000e+00 0.00000e+00 2.65169e+02 19.826  1.16066e+01 199.826 0.9717 
1 1 1 3   67  1  o 6  2.50621e+01 4.73063e-01 3.27774e+02 135.386 -2.51842e+01 2.48473e+01  0.00000e+00 0.00000e+00 5.95520e+02 135.386 2.67745e+02 135.386 0.9858 
1 1 1 3   67  2  f 0  1.12737e+01 4.48632e-01 2.42250e+02 91.408  -2.97365e-01 1.20985e+01  0.00000e+00 0.00000e+00 1.61284e+02 91.408  8.09655e+01 271.408 0.9578 
1 1 1 3   67  3  o 1  2.27090e+01 5.36808e-01 4.22113e+02 344.880 4.48787e+01  -1.21257e+01 0.00000e+00 0.00000e+00 4.17395e+02 344.880 4.71846e+00 164.880 0.9892 
1 1 1 3   67  4  o 19 1.92500e+01 5.43746e-01 3.44857e+02 310.189 2.33319e+01  -2.76200e+01 0.00000e+00 0.00000e+00 3.64474e+02 310.189 1.96167e+01 310.189 0.9861 
1 1 1 3   67  5  f 0  2.66453e+01 6.20657e-01 4.41719e+02 143.221 -5.38259e+01 4.02365e+01  0.00000e+00 0.00000e+00 5.46395e+02 143.221 1.04676e+02 143.221 0.9925 
1 1 1 3   67  6  o 10 1.77443e+01 6.78731e-01 3.46301e+02 255.296 -1.08174e+01 -4.12231e+01 0.00000e+00 0.00000e+00 3.08713e+02 255.296 3.75883e+01 75.296  0.9882 
1 1 1 3   67  7  o 17 1.57868e+01 6.33723e-01 2.43791e+02 128.465 -1.97776e+01 2.48951e+01  0.00000e+00 0.00000e+00 3.36415e+02 128.465 9.26236e+01 128.465 0.9841 
1 1 1 3   67  8  o 11 4.93397e+00 8.38526e-01 6.19192e+01 147.280 -2.20400e+00 1.41601e+00  0.00000e+00 0.00000e+00 8.12762e+01 147.280 1.93570e+01 147.280 0.7774 
1 1 1 3   67  9  o 7  1.56970e+01 5.69411e-01 3.12145e+02 58.101  2.77385e+01  4.45655e+01  0.00000e+00 0.00000e+00 2.68017e+02 58.101  4.41289e+01 238.101 0.9904 
1 1 1 3   67  10 o 4  4.37858e+00 9.61204e-01 1.09215e+02 326.469 4.61656e+00  -3.05920e+00 0.00000e+00 0.00000e+00 3.85139e+01 326.469 7.07006e+01 146.469 0.9045 
1 1 1 3   67  11 o 18 6.34590e+00 9.27162e-01 1.03099e+02 169.913 -8.13498e+00 1.44709e+00  0.00000e+00 0.00000e+00 1.18665e+02 169.913 1.55659e+01 169.913 0.9374 
1 1 1 3   67  12 o 9  4.56704e+00 1.10987e+00 1.29329e+02 245.103 -3.19898e+00 -6.89264e+00 0.00000e+00 0.00000e+00 2.92060e+01 245.103 1.00123e+02 65.103  0.9317 
1 1 1 3   67  13 o 2  6.63142e+00 1.15629e+00 1.02069e+02 88.428  2.61506e-01  9.53102e+00  0.00000e+00 0.00000e+00 1.31521e+02 88.428  2.94519e+01 88.428  0.9460 
1 1 1 3   67  14 o 3  8.63677e+00 1.22613e+00 1.53229e+02 96.714  -2.18108e+00 1.85267e+01  0.00000e+00 0.00000e+00 1.59399e+02 96.714  6.17040e+00 96.714  0.9728 
1 1 1 3   67  15 o 17 4.02152e+00 1.24025e+00 1.42540e+01 144.116 -7.49259e-01 5.42059e-01  0.00000e+00 0.00000e+00 4.84109e+01 144.116 3.41569e+01 144.116 0.4191 
1 1 1 3   67  16 o 12 4.74187e+00 1.44839e+00 1.00822e+02 28.011  6.14155e+00  3.26697e+00  0.00000e+00 0.00000e+00 6.21319e+01 28.011  3.86903e+01 208.010 0.9250 
1 1 1 3   68  0  o 4  1.12904e+01 4.23319e-01 1.69958e+02 312.796 5.79076e+00  -6.25423e+00 0.00000e+00 0.00000e+00 2.26295e+02 312.796 5.63366e+01 312.796 0.9394 
1 1 1 3   68  1  o 4  6.41137e+00 5.68127e-01 1.31484e+02 348.761 3.62240e+00  -7.19803e-01 0.00000e+00 0.00000e+00 7.22875e+01 348.761 5.91961e+01 168.761 0.8506 
1 1 1 3   68  2  o 5  7.97750e+00 4.95945e-01 1.14213e+02 267.026 -2.17610e-01 -4.18846e+00 0.00000e+00 0.00000e+00 1.45302e+02 267.026 3.10889e+01 267.026 0.8706 
1 1 1 3   68  3  o 2  2.02846e+01 5.15818e-01 3.74994e+02 148.975 -3.08131e+01 1.85325e+01  0.00000e+00 0.00000e+00 3.72331e+02 148.975 2.66265e+00 328.975 0.9860 
1 1 1 3   68  4  o 13 1.43466e+01 5.32693e-01 2.32264e+02 210.884 -1.71038e+01 -1.02301e+01 0.00000e+00 0.00000e+00 2.90127e+02 210.884 5.78631e+01 210.884 0.9746 
1 1 1 3   68  5  o 6  5.49155e+00 8.67621e-01 1.37853e+02 344.466 4.33864e+00  -1.20601e+00 0.00000e+00 0.00000e+00 4.27591e+01 344.466 9.50944e+01 164.466 0.8804 
1 1 1 3   68  6  o 10 1.19477e+01 7.15368e-01 1.82120e+02 128.400 -9.86215e+00 1.24429e+01  0.00000e+00 0.00000e+00 2.49812e+02 128.400 6.76923e+01 128.400 0.9680 
1 1 1 3   68  7  o 5  5.45205e+00 7.67182e-01 1.72835e+02 249.779 -2.68980e+00 -7.30233e+00 0.00000e+00 0.00000e+00 1.71633e+01 249.779 1.55672e+02 69.779  0.9333 
1 1 1 3   68  8  o 17 1.50537e+01 5.38688e-01 2.91379e+02 119.994 -2.15320e+01 3.73039e+01  0.00000e+00 0.00000e+00 2.63941e+02 119.994 2.74381e+01 299.994 0.9883 
1 1 1 3   68  9  f 0  5.07047e+00 8.44179e-01 3.21725e+01 188.951 -1.68382e+00 -2.65206e-01 0.00000e+00 0.00000e+00 8.94309e+01 188.951 5.72584e+01 188.951 0.6428 
1 1 1 3   68  10 o 12 3.03208e+00 8.60471e-01 6.35713e+01 151.497 -2.10938e+00 1.14542e+00  0.00000e+00 0.00000e+00 2.16543e+01 151.497 4.19170e+01 331.497 0.7537 
1 1 1 3   68  11 o 8  7.81131e+00 8.66466e-01 8.59260e+01 59.412  4.56471e+00  7.72228e+00  0.00000e+00 0.00000e+00 1.88487e+02 59.412  1.02561e+02 59.412  0.9425 
1 1 1 3   68  12 o 12 7.07312e+00 1.04934e+00 6.44706e+01 230.257 -4.00961e+00 -4.82218e+00 0.00000e+00 0.00000e+00 1.76985e+02 230.257 1.12514e+02 230.257 0.9164 
1 1 1 3   68  13 o 5  4.39010e+00 1.15683e+00 8.95684e+01 173.568 -5.62394e+00 6.34000e-01  0.00000e+00 0.00000e+00 5.86216e+01 173.568 3.09468e+01 353.568 0.9067 
1 1 1 3   68  14 o 3  3.23445e+00 1.05321e+00 6.53457e+01 52.948  2.03198e+00  2.69141e+00  0.00000e+00 0.00000e+00 3.50252e+01 52.948  3.03205e+01 232.948 0.8341 
1 1 1 3   68  15 o 15 4.17663e+00 1.20786e+00 7.50673e+01 326.700 4.29277e+00  -2.81977e+00 0.00000e+00 0.00000e+00 6.41144e+01 326.700 1.09529e+01 146.700 0.8964 
1 1 1 3   68  16 o 13 3.36925e+00 1.12890e+00 2.12409e+01 98.711  -2.14264e-01 1.39839e+00  0.00000e+00 0.00000e+00 5.06327e+01 98.711  2.93918e+01 98.711  0.5743 
1 1 1 3   69  0  o 12 1.34509e+01 4.18893e-01 1.82467e+02 194.849 -1.09936e+01 -2.91479e+00 0.00000e+00 0.00000e+00 2.97367e+02 194.849 1.14900e+02 194.849 0.9550 
1 1 1 3   69  1  o 5  2.63642e+00 7.21907e-01 2.70243e+01 52.106  2.07829e-01  2.67029e-01  0.00000e+00 0.00000e+00 1.05947e+01 232.106 3.76190e+01 232.106 0.1668 
1 1 1 3   69  2  o 18 6.41674e+00 5.79189e-01 2.56281e+02 287.054 2.26997e+00  -7.39990e+00 0.00000e+00 0.00000e+00 3.26241e+01 107.054 2.88905e+02 107.054 0.9330 
1 1 1 3   69  3  o 7  2.62632e+01 5.66519e-01 4.45089e+02 168.980 -6.22041e+01 1.21135e+01  0.00000e+00 0.00000e+00 5.28285e+02 168.980 8.31961e+01 168.980 0.9921 
1 1 1 3   69  4  o 10 1.31348e+01 5.34906e-01 2.12264e+02 359.579 1.61017e+01  -1.18289e-01 0.00000e+00 0.00000e+00 2.62896e+02 359.579 5.06325e+01 359.579 0.9684 
1 1 1 3   69  5  o 18 2.19579e+01 6.12503e-01 3.91220e+02 320.597 4.50797e+01  -3.70321e+01 0.00000e+00 0.00000e+00 4.21825e+02 320.597 3.06045e+01 320.597 0.9914 
1 1 1 3   69  6  o 14 1.59153e+01 6.23911e-01 1.92644e+02 130.796 -1.53752e+01 1.78149e+01  0.00000e+00 0.00000e+00 3.88882e+02 130.796 1.96238e+02 130.796 0.9785 
1 1 1 3   69  7  f 0  1.03944e+01 5.35704e-01 1.51498e+02 175.202 -1.44906e+01 1.21632e+00  0.00000e+00 0.00000e+00 2.22943e+02 175.202 7.14449e+01 175.202 0.9650 
1 1 1 3   69  8  o 8  1.75496e+01 5.44112e-01 2.73420e+02 22.981  4.32687e+01  1.83495e+01  0.00000e+00 0.00000e+00 3.74491e+02 22.981  1.01071e+02 22.981  0.9893 
1 1 1 3   69  9  o 4  4.32810e+00 8.99427e-01 4.11518e+01 75.806  4.54877e-01  1.79844e+00  0.00000e+00 0.00000e+00 6.74213e+01 75.806  2.62695e+01 75.806  0.6725 
1 1 1 3   69  10 f 0  1.40457e+01 6.31170e-01 3.16128e+02 274.493 4.49335e+00  -5.71855e+01 0.00000e+00 0.00000e+00 2.02997e+02 274.493 1.13132e+02 94.493  0.9912 
1 1 1 3   69  11 f 0  1.62892e+01 7.39709e-01 3.33837e+02 149.002 -6.44074e+01 3.86970e+01  0.00000e+00 0.00000e+00 2.69153e+02 149.002 6.46831e+01 329.002 0.9933 
1 1 1 3   69  12 o 14 9.93587e+00 9.22568e-01 1.76560e+02 137.351 -1.98314e+01 1.82673e+01  0.00000e+00 0.00000e+00 1.86573e+02 137.351 1.00123e+01 137.351 0.9813 
1 1 1 3   69  13 f 0  3.99390e+00 1.13267e+00 1.04926e+02 307.910 3.71289e+00  -4.76773e+00 0.00000e+00 0.00000e+00 3.08011e+01 307.910 7.41250e+01 127.910 0.9130 
1 1 1 3   69  14 o 10 2.69811e+00 9.29416e-01 2.70851e+01 5.992   1.28730e+00  1.35124e-01  0.00000e+00 0.00000e+00 2.72117e+01 5.992   1.26636e-01 5.992   0.5410 
1 1 1 3   69  15 o 12 6.03349e+00 1.47689e+00 5.18336e+01 141.141 -3.23784e+00 2.60875e+00  0.00000e+00 0.00000e+00 1.43109e+02 141.141 9.12752e+01 141.141 0.8693 
1 1 1 3   69  16 o 2  7.39966e+00 1.65345e+00 1.47372e+02 1.197   1.39548e+01  2.91468e-01  0.00000e+00 0.00000e+00 1.17386e+02 1.197   2.99865e+01 181.196 0.9635 
1 1 1 3   70  0  o 1  2.86667e+01 5.06747e-01 4.93887e+02 182.635 -6.70666e+01 -3.08675e+00 0.00000e+00 0.00000e+00 5.68747e+02 182.635 7.48602e+01 182.635 0.9925 
1 1 1 3   70  1  o 6  1.55641e+01 4.27606e-01 1.90917e+02 295.753 6.14735e+00  -1.27432e+01 0.00000e+00 0.00000e+00 3.69485e+02 295.753 1.78568e+02 295.753 0.9640 
1 1 1 3   70  2  o 18 1.39972e+01 5.28119e-01 3.45535e+02 256.033 -6.36487e+00 -2.55911e+01 0.00000e+00 0.00000e+00 1.67284e+02 256.033 1.78251e+02 76.033  0.9809 
1 1 1 3   70  3  o 2  5.11437e+00 7.47922e-01 6.52090e+01 43.174  1.35675e+00  1.27293e+00  0.00000e+00 0.00000e+00 6.34415e+01 43.174  1.76744e+00 223.174 0.6735 
1 1 1 3   70  4  o 18 1.34821e+01 4.83294e-01 2.48539e+02 242.393 -9.58579e+00 -1.83302e+01 0.00000e+00 0.00000e+00 2.42659e+02 242.393 5.88086e+00 62.393  0.9755 
1 1 1 3   70  5  o 3  1.24151e+01 6.47254e-01 1.65071e+02 185.676 -1.50008e+01 -1.49103e+00 0.00000e+00 0.00000e+00 2.82881e+02 185.676 1.17810e+02 185.676 0.9662 
1 1 1 3   70  6  o 10 8.94155e+00 6.81241e-01 1.83799e+02 73.893  3.73250e+00  1.29253e+01  0.00000e+00 0.00000e+00 1.37367e+02 73.893  4.64329e+01 253.893 0.9621 
1 1 1 3   70  7  o 3  1.19568e+01 5.20966e-01 1.91513e+02 299.794 1.04893e+01  -1.83199e+01 0.00000e+00 0.00000e+00 2.44057e+02 299.794 5.25445e+01 299.794 0.9760 
1 1 1 3   70  8  o 2  9.86648e+00 6.08437e-01 1.87260e+02 118.009 -9.12688e+00 1.71584e+01  0.00000e+00 0.00000e+00 1.71268e+02 118.009 1.59923e+01 298.009 0.9739 
1 1 1 3   70  9  o 15 6.58290e+00 7.83259e-01 1.09361e+02 124.210 -4.83452e+00 7.11121e+00  0.00000e+00 0.00000e+00 1.21405e+02 124.210 1.20436e+01 124.210 0.9399 
1 1 1 3   70  10 o 12 4.53648e+00 9.29991e-01 1.04249e+02 261.818 -8.35122e-01 -5.80793e+00 0.00000e+00 0.00000e+00 4.96882e+01 261.818 5.45611e+01 81.818  0.9103 
1 1 1 3   70  11 f 0  9.91663e+00 8.01152e-01 1.94321e+02 71.193  9.28421e+00  2.72608e+01  0.00000e+00 0.00000e+00 1.68695e+02 71.193  2.56259e+01 251.193 0.9825 
1 1 1 3   70  12 o 14 1.09494e+01 8.40806e-01 1.85059e+02 309.438 2.10555e+01  -2.55987e+01 0.00000e+00 0.00000e+00 2.16474e+02 309.438 3.14158e+01 309.438 0.9848 
1 1 1 3   70  13 o 12 3.52495e+00 1.04010e+00 1.56872e+01 179.377 -8.58000e-01 9.33223e-03  0.00000e+00 0.00000e+00 3.59759e+01 179.377 2.02887e+01 179.377 0.3938 
1 1 1 3   70  14 o 3  7.19119e+00 1.40395e+00 1.10269e+02 159.758 -9.75341e+00 3.59673e+00  0.00000e+00 0.00000e+00 1.43947e+02 159.758 3.36780e+01 159.758 0.9506 
1 1 1 3   70  15 o 10 4.34846e+00 1.27487e+00 1.03005e+02 322.978 5.54574e+00  -4.18229e+00 0.00000e+00 0.00000e+00 4.64497e+01 322.978 5.65551e+01 142.978 0.9249 
1 1 1 3   70  16 o 10 3.56191e+00 1.19565e+00 4.82771e+01 326.900 2.71695e+00  -1.77112e+00 0.00000e+00 0.00000e+00 6.10235e+01 326.900 1.27464e+01 326.900 0.8265 
1 1 1 3   71  0  o 1  1.36687e+01 4.92664e-01 2.74518e+02 170.170 -1.87715e+01 3.25234e+00  0.00000e+00 0.00000e+00 2.22298e+02 170.170 5.22207e+01 350.170 0.9734 
1 1 1 3   71  1  o 9  1.09331e+01 4.41581e-01 1.69352e+02 309.694 6.49156e+00  -7.82083e+00 0.00000e+00 0.00000e+00 2.18296e+02 309.694 4.89435e+01 309.694 0.9495 
1 1 1 3   71  2  o 9  9.45097e+00 5.21689e-01 1.11023e+02 275.446 5.95913e-01  -6.25000e+00 0.00000e+00 0.00000e+00 2.12446e+02 275.446 1.01423e+02 275.446 0.9165 
1 1 1 3   71  3  o 14 2.07025e+01 5.22680e-01 4.16336e+02 19.456  4.69107e+01  1.65710e+01  0.00000e+00 0.00000e+00 3.48967e+02 19.456  6.73689e+01 199.456 0.9899 
1 1 1 3   71  4  o 11 1.19001e+01 6.03327e-01 2.79953e+02 167.064 -2.20961e+01 5.07508e+00  0.00000e+00 0.00000e+00 1.54488e+02 167.064 1.25465e+02 347.064 0.9777 
1 1 1 3   71  5  o 7  7.99183e+00 7.06205e-01 1.62153e+02 284.326 2.29914e+00  -9.00296e+00 0.00000e+00 0.00000e+00 1.19676e+02 284.326 4.24770e+01 104.326 0.9446 
1 1 1 3   71  6  o 12 4.88316e+00 7.33246e-01 9.66510e+01 147.245 -3.30415e+00 2.12574e+00  0.00000e+00 0.00000e+00 6.02364e+01 147.245 3.64146e+01 327.245 0.8607 
1 1 1 3   71  7  f 0  2.49441e+01 5.59573e-01 4.39217e+02 264.380 -1.03678e+01 -1.05360e+02 0.00000e+00 0.00000e+00 4.87200e+02 264.380 4.79821e+01 264.380 0.9953 
1 1 1 3   71  8  o 7  3.24769e+00 7.55117e-01 8.32210e+01 273.898 1.87560e-01  -2.75276e+00 0.00000e+00 0.00000e+00 1.25458e+01 273.898 7.06752e+01 93.898  0.7905 
1 1 1 3   71  9  f 0  1.32593e+01 6.05430e-01 2.99013e+02 27.593  4.63605e+01  2.42294e+01  0.00000e+00 0.00000e+00 1.90664e+02 27.593  1.08349e+02 207.593 0.9904 
1 1 1 3   71  10 o 12 6.56825e+00 8.45746e-01 8.60414e+01 67.532  2.73465e+00  6.61252e+00  0.00000e+00 0.00000e+00 1.40955e+02 67.532  5.49132e+01 67.532  0.9272 
1 1 1 3   71  11 o 6  2.82052e+00 8.89209e-01 1.36848e+02 247.595 -2.10685e+00 -5.11027e+00 0.00000e+00 0.00000e+00 4.18289e+01 67.595  1.78677e+02 67.595  0.9043 
1 1 1 3   71  12 o 16 7.74709e+00 1.00984e+00 1.41878e+02 300.007 7.74423e+00  -1.34094e+01 0.00000e+00 0.00000e+00 1.37077e+02 300.007 4.80101e+00 120.007 0.9672 
1 1 1 3   71  13 o 8  5.90466e+00 1.24104e+00 5.19049e+01 241.193 -2.05152e+00 -3.73057e+00 0.00000e+00 0.00000e+00 1.39830e+02 241.193 8.79252e+01 241.193 0.8727 
1 1 1 3   71  14 o 19 5.16079e+00 1.27532e+00 8.31562e+01 154.834 -5.72180e+00 2.68832e+00  0.00000e+00 0.00000e+00 9.28158e+01 154.834 9.65968e+00 154.834 0.9171 
1 1 1 3   71  15 o 13 4.85915e+00 1.38973e+00 7.93008e+01 327.567 4.82180e+00  -3.06395e+00 0.00000e+00 0.00000e+00 8.45561e+01 327.567 5.25535e+00 327.567 0.9077 
1 1 1 3   71  16 o 5  4.14525e+00 1.29963e+00 3.15398e+01 19.904  2.35375e+00  8.52225e-01  0.00000e+00 0.00000e+00 8.62310e+01 19.904  5.46912e+01 19.904  0.7654 
1 1 1 3   72  0  o 19 1.20921e+01 4.98526e-01 2.38031e+02 268.848 -3.47268e-01 -1.72676e+01 0.00000e+00 0.00000e+00 2.00138e+02 268.848 3.78932e+01 88.848  0.9706 
1 1 1 3   72  1  o 16 2.16431e+01 6.39309e-01 3.51671e+02 358.245 4.30915e+01  -1.32059e+00 0.00000e+00 0.00000e+00 4.46984e+02 358.245 9.53130e+01 358.245 0.9883 
1 1 1 3   72  2  o 6  1.47188e+01 5.39218e-01 3.30458e+02 160.336 -2.64128e+01 9.43864e+00  0.00000e+00 0.00000e+00 2.09224e+02 160.336 1.21234e+02 340.336 0.9820 
1 1 1 3   72  3  f 0  1.30585e+01 5.85785e-01 6.79907e+01 337.312 5.09678e+00  -2.13078e+00 0.00000e+00 0.00000e+00 3.72896e+02 337.312 3.04905e+02 337.312 0.9043 
1 1 1 3   72  4  o 4  7.34174e+00 7.42698e-01 1.30609e+02 298.612 3.31867e+00  -6.08393e+00 0.00000e+00 0.00000e+00 1.22854e+02 298.612 7.75456e+00 118.612 0.9247 
1 1 1 3   72  5  o 14 1.32028e+01 5.99448e-01 2.25445e+02 130.786 -1.49497e+01 1.73282e+01  0.00000e+00 0.00000e+00 2.56492e+02 130.786 3.10470e+01 130.786 0.9779 
1 1 1 3   72  6  o 14 1.61390e+01 4.95675e-01 2.91472e+02 310.327 2.83081e+01  -3.33484e+01 0.00000e+00 0.00000e+00 3.03899e+02 310.327 1.24264e+01 310.327 0.9885 
1 1 1 3   72  7  o 15 7.69865e+00 6.43796e-01 1.13354e+02 148.662 -7.16061e+00 4.36023e+00  0.00000e+00 0.00000e+00 1.56158e+02 148.662 4.28037e+01 148.662 0.9383 
1 1 1 3   72  8  o 17 7.78325e+00 6.66500e-01 1.57071e+02 179.058 -1.34708e+01 2.21497e-01  0.00000e+00 0.00000e+00 1.22227e+02 179.058 3.48437e+01 359.058 0.9621 
1 1 1 3   72  9  o 12 1.08705e+01 6.23525e-01 1.58341e+02 293.756 8.54904e+00  -1.94236e+01 0.00000e+00 0.00000e+00 2.37264e+02 293.756 7.89228e+01 293.756 0.9761 
1 1 1 3   72  10 o 12 8.31242e+00 7.54290e-01 1.36616e+02 218.092 -1.21081e+01 -9.49115e+00 0.00000e+00 0.00000e+00 1.62899e+02 218.092 2.62836e+01 218.092 0.9669 
1 1 1 3   72  11 o 13 9.89380e+00 8.20256e-01 1.32737e+02 356.207 1.94424e+01  -1.28914e+00 0.00000e+00 0.00000e+00 2.26174e+02 356.207 9.34364e+01 356.207 0.9740 
1 1 1 3   72  12 o 17 7.10155e+00 1.10075e+00 1.57906e+02 221.608 -1.19928e+01 -1.06506e+01 0.00000e+00 0.00000e+00 9.80600e+01 221.608 5.98462e+01 41.608  0.9683 
1 1 1 3   72  13 o 1  4.19951e+00 1.16101e+00 5.63201e+01 11.097  3.50392e+00  6.87237e-01  0.00000e+00 0.00000e+00 7.56405e+01 11.097  1.93204e+01 11.097  0.8447 
1 1 1 3   72  14 o 1  4.47493e+00 1.26445e+00 9.30633e+01 63.954  2.86743e+00  5.86718e+00  0.00000e+00 0.00000e+00 5.99573e+01 63.954  3.31060e+01 243.954 0.9199 
1 1 1 3   72  15 f 0  5.26741e+00 1.45419e+00 2.29623e+01 216.028 -1.46254e+00 -1.06370e+00 0.00000e+00 0.00000e+00 1.06890e+02 216.028 8.39275e+01 216.028 0.6637 
1 1 1 3   72  16 o 9  3.78306e+00 1.22360e+00 5.16760e+01 114.309 -1.56523e+00 3.46516e+00  0.00000e+00 0.00000e+00 6.84358e+01 114.309 1.67598e+01 114.309 0.8555 
1 1 1 3   73  0  o 4  1.38834e+01 4.96870e-01 3.09062e+02 68.920  8.94192e+00  2.31976e+01  0.00000e+00 0.00000e+00 1.98617e+02 68.920  1.10444e+02 248.920 0.9797 
1 1 1 3   73  1  o 6  1.24643e+01 6.10492e-01 2.43980e+02 304.634 9.86391e+00  -1.42804e+01 0.00000e+00 0.00000e+00 2.07693e+02 304.634 3.62870e+01 124.634 0.9707 
1 1 1 3   73  2  o 8  1.46924e+01 5.77518e-01 1.85806e+02 283.283 3.91100e+00  -1.65667e+01 0.00000e+00 0.00000e+00 3.46306e+02 283.283 1.60500e+02 283.283 0.9702 
1 1 1 3   73  3  o 3  2.67356e+01 6.10062e-01 4.59897e+02 207.285 -7.67831e+01 -3.96049e+01 0.00000e+00 0.00000e+00 5.32327e+02 207.285 7.24307e+01 207.285 0.9942 
1 1 1 3   73  4  o 7  3.43225e+01 7.71580e-01 5.35174e+02 114.787 -5.54513e+01 1.20082e+02  0.00000e+00 0.00000e+00 7.41086e+02 114.787 2.05911e+02 114.787 0.9962 
1 1 1 3   73  5  o 12 5.90046e+00 8.27173e-01 1.01117e+02 270.841 6.56651e-02  -4.47090e+00 0.00000e+00 0.00000e+00 9.25495e+01 270.841 8.56785e+00 90.841  0.8795 
1 1 1 3   73  6  o 18 6.12709e+00 6.56244e-01 1.71794e+02 167.185 -9.20644e+00 2.09420e+00  0.00000e+00 0.00000e+00 4.43506e+01 167.185 1.27444e+02 347.185 0.9455 
1 1 1 3   73  7  o 2  7.93243e+00 6.08173e-01 1.65093e+02 212.943 -1.17668e+01 -7.62476e+00 0.00000e+00 0.00000e+00 1.20045e+02 212.943 4.50476e+01 32.943  0.9637 
1 1 1 3   73  8  o 1  1.28823e+01 5.62893e-01 2.81085e+02 325.602 3.43816e+01  -2.35394e+01 0.00000e+00 0.00000e+00 1.93483e+02 325.602 8.76020e+01 145.602 0.9879 
1 1 1 3   73  9  o 6  6.45612e+00 8.23484e-01 1.13786e+02 46.794  6.09303e+00  6.48706e+00  0.00000e+00 0.00000e+00 1.12908e+02 46.794  8.78072e-01 226.794 0.9420 
1 1 1 3   73  10 o 13 2.88091e+00 8.84665e-01 8.79430e+01 240.712 -1.64222e+00 -2.92784e+00 0.00000e+00 0.00000e+00 1.49514e+00 240.712 8.64479e+01 60.712  0.8333 
1 1 1 3   73  11 o 9  7.62118e+00 9.36928e-01 8.37243e+01 115.487 -4.00754e+00 8.40670e+00  0.00000e+00 0.00000e+00 1.84371e+02 115.487 1.00647e+02 115.487 0.9447 
1 1 1 3   73  12 o 10 2.72195e+00 9.00326e-01 6.99640e+01 323.298 2.36477e+00  -1.76279e+00 0.00000e+00 0.00000e+00 1.17022e+01 323.298 5.82619e+01 143.298 0.8062 
1 1 1 3   73  13 o 7  1.44331e+01 8.68867e-01 2.31991e+02 279.145 8.80723e+00  -5.47099e+01 0.00000e+00 0.00000e+00 2.99941e+02 279.145 6.79497e+01 279.145 0.9909 
1 1 1 3   73  14 o 10 6.15884e+00 1.35970e+00 1.36523e+02 189.100 -1.16315e+01 -1.86313e+00 0.00000e+00 0.00000e+00 8.24332e+01 189.100 5.40903e+01 9.100   0.9566 
1 1 1 3   73  15 o 7  4.06943e+00 1.26262e+00 9.63780e+01 332.493 6.26823e+00  -3.26400e+00 0.00000e+00 0.00000e+00 4.36082e+01 332.493 5.27698e+01 152.493 0.9263 
1 1 1 3   73  16 o 7  3.47047e+00 1.12624e+00 4.56571e+01 113.478 -1.36064e+00 3.13252e+00  0.00000e+00 0.00000e+00 6.20726e+01 113.478 1.64155e+01 113.478 0.8366 
1 1 1 3   74  0  o 19 5.32415e+00 8.34368e-01 1.35653e+02 88.857  8.61789e-02  4.32013e+00  0.00000e+00 0.00000e+00 3.81645e+01 88.857  9.74881e+01 268.857 0.8748 
1 1 1 3   74  1  o 2  1.15988e+01 6.44764e-01 1.83905e+02 81.750  1.88694e+00  1.30135e+01  0.00000e+00 0.00000e+00 2.32182e+02 81.750  4.82768e+01 81.750  0.9612 
1 1 1 3   74  2  o 16 1.58908e+01 6.16967e-01 3.28711e+02 122.089 -1.88124e+01 3.00027e+01  0.00000e+00 0.00000e+00 2.55943e+02 122.089 7.27684e+01 302.089 0.9858 
1 1 1 3   74  3  o 15 4.60916e+00 7.69643e-01 1.28538e+02 293.918 1.72186e+00  -3.88236e+00 0.00000e+00 0.00000e+00 2.15325e+01 293.918 1.07005e+02 113.918 0.8724 
1 1 1 3   74  4  o 10 3.04883e+01 7.03562e-01 5.89777e+02 261.504 -2.00356e+01 -1.34130e+02 0.00000e+00 0.00000e+00 5.43789e+02 261.504 4.59878e+01 81.504  0.9963 
1 1 1 3   74  5  o 7  9.23822e+00 5.23823e-01 1.28994e+02 199.284 -9.88276e+00 -3.45789e+00 0.00000e+00 0.00000e+00 1.98808e+02 199.284 6.98134e+01 199.284 0.9510 
1 1 1 3   74  6  o 3  6.63187e+00 6.47709e-01 1.94870e+02 337.609 1.13227e+01  -4.66473e+00 0.00000e+00 0.00000e+00 4.22005e+01 337.609 1.52670e+02 157.609 0.9583 
1 1 1 3   74  7  o 12 4.04333e+00 8.54271e-01 8.01850e+01 56.032  1.85604e+00  2.75505e+00  0.00000e+00 0.00000e+00 4.51585e+01 56.032  3.50266e+01 236.032 0.8312 
1 1 1 3   74  8  o 13 6.42183e+00 7.54136e-01 1.16017e+02 42.727  6.59792e+00  6.09407e+00  0.00000e+00 0.00000e+00 1.09649e+02 42.727  6.36799e+00 222.727 0.9426 
1 1 1 3   74  9  o 7  3.90736e+00 8.86793e-01 9.29109e+01 297.946 2.13687e+00  -4.02794e+00 0.00000e+00 0.00000e+00 3.55294e+01 297.946 5.73815e+01 117.946 0.8821 
1 1 1 3   74  10 o 18 1.20513e+01 6.88256e-01 2.16234e+02 102.016 -8.73050e+00 4.10182e+01  0.00000e+00 0.00000e+00 2.27287e+02 102.016 1.10535e+01 102.016 0.9880 
1 1 1 3   74  11 o 11 1.24058e+01 7.38304e-01 1.88319e+02 358.543 3.93549e+01  -1.00122e+00 0.00000e+00 0.00000e+00 2.67646e+02 358.543 7.93269e+01 358.543 0.9872 
1 1 1 3   74  12 o 3  8.00776e+00 1.15378e+00 1.58908e+02 211.374 -1.56495e+01 -9.54257e+00 0.00000e+00 0.00000e+00 1.30804e+02 211.374 2.81041e+01 31.374  0.9723 
1 1 1 3   74  13 o 7  6.04996e+00 1.24655e+00 1.34297e+02 15.409  1.10440e+01  3.04380e+00  0.00000e+00 0.00000e+00 8.06128e+01 15.409  5.36846e+01 195.409 0.9553 
1 1 1 3   74  14 o 11 2.99263e+00 1.00176e+00 3.72776e+01 248.615 -7.80614e-01 -1.99343e+00 0.00000e+00 0.00000e+00 4.27424e+01 248.615 5.46479e+00 248.615 0.7196 
1 1 1 3   74  15 o 9  4.08995e+00 1.29460e+00 3.88246e+01 341.963 2.48013e+00  -8.07621e-01 0.00000e+00 0.00000e+00 7.90616e+01 341.963 4.02370e+01 341.963 0.7763 
1 1 1 3   75  0  o 12 4.99273e+00 8.33160e-01 3.14867e+01 310.820 6.70056e-01  -7.75705e-01 0.00000e+00 0.00000e+00 5.33072e+01 310.820 2.18205e+01 310.820 0.4552 
1 1 1 3   75  1  o 3  4.66160e+00 8.75583e-01 5.97753e+01 338.834 1.73450e+00  -6.71586e-01 0.00000e+00 0.00000e+00 5.73560e+01 338.834 2.41933e+00 158.834 0.6734 
1 1 1 3   75  2  f 0  1.46581e+01 7.54237e-01 1.77503e+02 311.045 1.22965e+01  -1.41230e+01 0.00000e+00 0.00000e+00 3.54658e+02 311.045 1.77155e+02 311.045 0.9729 
1 1 1 3   75  3  f 0  6.69745e+00 9.28814e-01 1.96577e+02 100.955 -1.70623e+00 8.81470e+00  0.00000e+00 0.00000e+00 3.89735e+01 100.955 1.57604e+02 280.955 0.9425 
1 1 1 3   75  4  o 16 8.67021e+00 9.01237e-01 2.71670e+02 164.599 -1.67177e+01 4.60521e+00  0.00000e+00 0.00000e+00 4.23494e+01 164.599 2.29321e+02 344.599 0.9707 
1 1 1 3   75  5  o 17 7.82353e+00 5.51820e-01 1.16355e+02 312.898 5.68877e+00  -6.12223e+00 0.00000e+00 0.00000e+00 1.57438e+02 312.898 4.10834e+01 312.898 0.9381 
1 1 1 3   75  6  o 3  1.63712e+01 5.03977e-01 2.79164e+02 142.851 -3.60023e+01 2.72767e+01  0.00000e+00 0.00000e+00 3.24631e+02 142.851 4.54670e+01 142.851 0.9889 
1 1 1 3   75  7  o 13 6.11857e+00 6.85405e-01 5.73104e+01 279.904 6.61952e-01  -3.79141e+00 0.00000e+00 0.00000e+00 1.38307e+02 279.904 8.09965e+01 279.904 0.8574 
1 1 1 3   75  8  o 16 3.12988e+00 8.34107e-01 7.12413e+01 62.385  1.25915e+00  2.40702e+00  0.00000e+00 0.00000e+00 2.05286e+01 62.385  5.07127e+01 242.385 0.7866 
1 1 1 3   75  9  o 6  4.43617e+00 9.61661e-01 8.83530e+01 190.478 -4.87154e+00 -9.00928e-01 0.00000e+00 0.00000e+00 5.91344e+01 190.478 2.92186e+01 10.478  0.8923 
1 1 1 3   75  10 o 10 4.71992e+00 9.95589e-01 4.37072e+01 314.921 1.98204e+00  -1.98750e+00 0.00000e+00 0.00000e+00 9.59720e+01 314.921 5.22649e+01 314.921 0.7946 
1 1 1 3   75  11 o 1  1.07147e+01 7.75172e-01 1.86309e+02 343.819 2.92653e+01  -8.49181e+00 0.00000e+00 0.00000e+00 2.05922e+02 343.819 1.96133e+01 343.819 0.9835 
1 1 1 3   75  12 o 10 8.47109e+00 1.00696e+00 1.07924e+02 268.720 -3.16842e-01 -1.41858e+01 0.00000e+00 0.00000e+00 1.95893e+02 268.720 8.79687e+01 268.720 0.9641 
1 1 1 3   75  13 o 19 1.07710e+01 1.02205e+00 1.93729e+02 237.181 -1.89049e+01 -2.93138e+01 0.00000e+00 0.00000e+00 2.00922e+02 237.181 7.19237e+00 237.181 0.9856 
1 1 1 3   75  14 o 15 4.04177e+00 1.22893e+00 1.30127e+02 240.467 -4.19985e+00 -7.41312e+00 0.00000e+00 0.00000e+00 1.09196e+01 240.467 1.19207e+02 60.467  0.9393 
1 1 1 3   75  15 o 13 4.38058e+00 1.31477e+00 3.74968e+01 45.903  1.93655e+00  1.99860e+00  0.00000e+00 0.00000e+00 9.13879e+01 45.903  5.38911e+01 45.903  0.7926 
1 1 1 3   76  0  o 15 1.83518e+01 4.99323e-01 3.96576e+02 7.377   5.42647e+01  7.02537e+00  0.00000e+00 0.00000e+00 2.81718e+02 7.377   1.14857e+02 187.377 0.9908 
1 1 1 3   76  1  o 1  5.24596e+00 8.46701e-01 2.37486e+02 304.365 4.99126e+00  -7.29909e+00 0.00000e+00 0.00000e+00 5.32014e+01 124.365 2.90688e+02 124.365 0.9416 
1 1 1 3   76  2  o 2  1.13368e+01 7.49808e-01 2.75452e+02 213.842 -1.84053e+01 -1.23407e+01 0.00000e+00 0.00000e+00 1.37841e+02 213.842 1.37611e+02 33.842  0.9772 
1 1 1 3   76  3  o 12 6.03113e+00 9.98911e-01 8.39239e+01 325.658 3.16431e+00  -2.16196e+00 0.00000e+00 0.00000e+00 1.08845e+02 325.658 2.49206e+01 325.658 0.8568 
1 1 1 3   76  4  o 15 7.19303e+00 7.86393e-01 1.08073e+02 73.822  1.80097e+00  6.20791e+00  0.00000e+00 0.00000e+00 1.38517e+02 73.822  3.04436e+01 73.822  0.9190 
1 1 1 3   76  5  o 7  8.49619e+00 8.40111e-01 2.17500e+02 120.967 -8.14189e+00 1.35679e+01  0.00000e+00 0.00000e+00 8.92003e+01 120.967 1.28300e+02 300.967 0.9679 
1 1 1 3   76  6  o 13 3.21755e+00 7.53735e-01 4.33503e+01 128.994 -8.89368e-01 1.09851e+00  0.00000e+00 0.00000e+00 2.55160e+01 128.994 1.78343e+01 308.994 0.5740 
1 1 1 3   76  7  o 12 8.43240e+00 6.01380e-01 1.76956e+02 210.121 -1.47258e+01 -8.54356e+00 0.00000e+00 0.00000e+00 1.28017e+02 210.121 4.89393e+01 30.121  0.9702 
1 1 1 3   76  8  o 11 6.31140e+00 7.66381e-01 1.46757e+02 211.625 -9.28808e+00 -5.71966e+00 0.00000e+00 0.00000e+00 7.73899e+01 211.625 6.93670e+01 31.625  0.9530 
1 1 1 3   76  9  o 4  4.81977e+00 9.15762e-01 6.62237e+01 341.701 3.84516e+00  -1.27159e+00 0.00000e+00 0.00000e+00 8.91556e+01 341.701 2.29319e+01 341.701 0.8654 
1 1 1 3   76  10 o 17 2.76812e+00 8.29529e-01 3.56200e+01 16.869  1.38735e+00  4.20685e-01  0.00000e+00 0.00000e+00 2.45164e+01 16.869  1.11037e+01 196.869 0.5835 
1 1 1 3   76  11 o 7  5.44233e+00 1.07015e+00 7.61749e+01 238.359 -2.96626e+00 -4.81395e+00 0.00000e+00 0.00000e+00 1.07450e+02 238.359 3.12752e+01 238.359 0.9066 
1 1 1 3   76  12 o 9  3.58399e+00 1.04027e+00 2.88242e+01 3.691   1.49759e+00  9.65957e-02  0.00000e+00 0.00000e+00 5.06635e+01 3.691   2.18393e+01 3.691   0.5963 
1 1 1 3   76  13 f 0  8.13027e+00 1.21355e+00 1.12766e+02 305.213 8.19100e+00  -1.16058e+01 0.00000e+00 0.00000e+00 1.78591e+02 305.213 6.58252e+01 305.213 0.9641 
1 1 1 3   76  14 o 5  5.02170e+00 1.36036e+00 1.17509e+02 153.459 -7.69659e+00 3.84418e+00  0.00000e+00 0.00000e+00 5.78120e+01 153.459 5.96968e+01 333.459 0.9399 
1 1 1 3   76  15 o 14 5.53996e+00 1.45531e+00 9.67154e+01 249.485 -2.81502e+00 -7.52319e+00 0.00000e+00 0.00000e+00 9.56385e+01 249.485 1.07699e+00 69.485  0.9355 
1 1 1 3   77  0  o 10 6.72839e+00 6.62645e-01 1.72089e+02 100.166 -1.47386e+00 8.21924e+00  0.00000e+00 0.00000e+00 6.33041e+01 100.166 1.08785e+02 280.166 0.9381 
1 1 1 3   77  1  o 13 1.75398e+01 6.19356e-01 2.78073e+02 345.554 3.42499e+01  -8.82295e+00 0.00000e+00 0.00000e+00 3.66819e+02 345.554 8.87457e+01 345.554 0.9858 
1 1 1 3   77  2  o 16 8.09303e+00 8.62836e-01 1.10997e+02 54.831  4.06587e+00  5.77034e+00  0.00000e+00 0.00000e+00 1.68588e+02 54.831  5.75908e+01 54.831  0.9262 
1 1 1 3   77  3  o 1  5.96132e+00 9.44429e-01 5.86631e+01 216.448 -2.21903e+00 -1.63887e+00 0.00000e+00 0.00000e+00 1.17087e+02 216.448 5.84234e+01 216.448 0.7904 
1 1 1 3   77  4  o 15 1.21965e+01 5.92057e-01 2.32655e+02 199.796 -2.43102e+01 -8.75054e+00 0.00000e+00 0.00000e+00 2.13322e+02 199.796 1.93323e+01 19.797  0.9805 
1 1 1 3   77  5  o 15 6.77760e+00 8.63917e-01 1.22354e+02 217.859 -5.92529e+00 -4.60588e+00 0.00000e+00 0.00000e+00 1.12882e+02 217.859 9.47230e+00 37.859  0.9308 
1 1 1 3   77  6  o 8  3.68349e+00 8.82365e-01 4.45515e+01 0.786   1.66420e+00  2.28431e-02  0.00000e+00 0.00000e+00 4.25422e+01 0.786   2.00935e+00 180.786 0.6342 
1 1 1 3   77  7  o 18 2.06458e+00 6.71672e-01 5.26730e+01 39.344  9.85418e-01  8.07820e-01  0.00000e+00 0.00000e+00 1.14925e+01 219.344 6.41655e+01 219.344 0.5352 
1 1 1 3   77  8  o 6  1.70364e+01 5.60622e-01 3.36705e+02 114.912 -3.18408e+01 6.85564e+01  0.00000e+00 0.00000e+00 2.93830e+02 114.912 4.28756e+01 294.912 0.9934 
1 1 1 3   77  9  f 0  1.57716e+01 5.90219e-01 2.48406e+02 18.273  5.52128e+01  1.82306e+01  0.00000e+00 0.00000e+00 3.33911e+02 18.273  8.55045e+01 18.273  0.9914 
1 1 1 3   77  10 o 19 3.34411e+00 9.47883e-01 3.60614e+01 292.177 6.35856e-01  -1.55994e+00 0.00000e+00 0.00000e+00 4.34320e+01 292.177 7.37059e+00 292.177 0.6386 
1 1 1 3   77  11 o 10 6.65813e+00 9.69413e-01 1.26999e+02 208.967 -1.14042e+01 -6.31300e+00 0.00000e+00 0.00000e+00 1.11030e+02 208.967 1.59690e+01 28.967  0.9608 
1 1 1 3   77  12 o 10 5.92619e+00 1.06506e+00 7.11263e+01 33.078  5.40624e+00  3.52134e+00  0.00000e+00 0.00000e+00 1.31359e+02 33.078  6.02332e+01 33.078  0.9189 
1 1 1 3   77  13 o 6  1.08838e+01 1.05935e+00 1.49737e+02 210.733 -2.39284e+01 -1.42266e+01 0.00000e+00 0.00000e+00 2.47391e+02 210.733 9.76541e+01 210.733 0.9819 
1 1 1 3   77  14 o 5  5.43238e+00 1.39564e+00 8.04453e+01 229.644 -4.17980e+00 -4.91885e+00 0.00000e+00 0.00000e+00 1.04926e+02 229.644 2.44809e+01 229.644 0.9189 
1 1 1 3   77  15 o 16 5.06639e+00 1.38508e+00 1.05539e+02 307.600 5.35843e+00  -6.95795e+00 0.00000e+00 0.00000e+00 7.14081e+01 307.600 3.41310e+01 127.600 0.9412 
1 1 1 3   78  0  o 2  1.01754e+01 5.84594e-01 1.60011e+02 278.159 1.92885e+00  -1.34540e+01 0.00000e+00 0.00000e+00 2.05165e+02 278.159 4.51545e+01 278.159 0.9625 
1 1 1 3   78  1  o 16 9.96506e+00 6.74642e-01 2.30294e+02 66.669  7.44029e+00  1.72504e+01  0.00000e+00 0.00000e+00 1.31280e+02 66.669  9.90140e+01 246.669 0.9730 
1 1 1 3   78  2  o 17 1.10728e+01 7.50536e-01 1.74196e+02 82.011  2.22326e+00  1.58411e+01  0.00000e+00 0.00000e+00 2.25604e+02 82.011  5.14077e+01 82.011  0.9682 
1 1 1 3   78  3  o 15 3.77207e+00 7.87828e-01 2.32126e+01 199.818 -7.18649e-01 -2.58983e-01 0.00000e+00 0.00000e+00 2.69404e+01 199.818 3.72785e+00 199.818 0.3565 
1 1 1 3   78  4  o 6  3.77443e+00 7.88203e-01 4.75647e+01 104.207 -3.82281e-01 1.50995e+00  0.00000e+00 0.00000e+00 3.82922e+01 104.207 9.27252e+00 284.207 0.6100 
1 1 1 3   78  5  o 9  9.44006e+00 7.36787e-01 1.75466e+02 117.826 -8.00699e+00 1.51701e+01  0.00000e+00 0.00000e+00 1.66054e+02 117.826 9.41153e+00 297.826 0.9704 
1 1 1 3   78  6  o 15 7.68879e+00 7.42002e-01 1.87611e+02 247.278 -6.00880e+00 -1.43487e+01 0.00000e+00 0.00000e+00 8.96054e+01 247.278 9.80056e+01 67.278  0.9673 
1 1 1 3   78  7  o 19 2.84512e+00 8.21592e-01 2.94929e+01 111.170 -3.71434e-01 9.59103e-01  0.00000e+00 0.00000e+00 1.88939e+01 111.170 1.05990e+01 291.170 0.4564 
1 1 1 3   78  8  o 12 9.72928e+00 6.52846e-01 2.38782e+02 76.985  7.21779e+00  3.12270e+01  0.00000e+00 0.00000e+00 1.17938e+02 76.985  1.20844e+02 256.985 0.9843 
1 1 1 3   78  9  o 10 7.59055e+00 7.71752e-01 1.13340e+02 325.806 1.10467e+01  -7.50552e+00 0.00000e+00 0.00000e+00 1.58502e+02 325.806 4.51618e+01 325.806 0.9618 
1 1 1 3   78  10 o 10 7.81020e+00 8.63117e-01 1.77276e+02 176.879 -1.95610e+01 1.06645e+00  0.00000e+00 0.00000e+00 1.05889e+02 176.879 7.13866e+01 356.879 0.9741 
1 1 1 3   78  11 o 1  8.16460e+00 9.62150e-01 1.30173e+02 7.641   1.57825e+01  2.11725e+00  0.00000e+00 0.00000e+00 1.63846e+02 7.641   3.36721e+01 7.641   0.9681 
1 1 1 3   78  12 o 11 3.69393e+00 1.09496e+00 6.18604e+01 176.958 -3.32612e+00 1.76737e-01  0.00000e+00 0.00000e+00 5.23649e+01 176.958 9.49550e+00 356.958 0.8318 
1 1 1 3   78  13 o 17 5.74275e+00 1.30444e+00 5.58418e+01 127.648 -2.98060e+00 3.86365e+00  0.00000e+00 0.00000e+00 1.34162e+02 127.648 7.83205e+01 127.648 0.8905 
1 1 1 3   78  14 o 16 3.49102e+00 1.12662e+00 4.46443e+01 234.114 -1.74577e+00 -2.41293e+00 0.00000e+00 0.00000e+00 6.01298e+01 234.114 1.54855e+01 234.114 0.8084 
1 1 1 3   78  15 o 6  5.92270e+00 1.47589e+00 1.00419e+02 143.294 -7.77554e+00 5.79697e+00  0.00000e+00 0.00000e+00 1.07651e+02 143.294 7.23167e+00 143.294 0.9470 
1 1 1 3   79  0  o 3  2.25348e+01 6.06675e-01 3.45120e+02 282.030 1.38555e+01  -6.50173e+01 0.00000e+00 0.00000e+00 4.88619e+02 282.030 1.43498e+02 282.030 0.9924 
1 1 1 3   79  1  o 6  2.87813e+01 7.66056e-01 4.79284e+02 14.034  1.10353e+02  2.75842e+01  0.00000e+00 0.00000e+00 5.89033e+02 14.034  1.09749e+02 14.034  0.9956 
1 1 1 3   79  2  o 6  5.63051e+00 8.54702e-01 7.67316e+01 114.860 -1.48080e+00 3.19588e+00  0.00000e+00 0.00000e+00 1.00081e+02 114.860 2.33491e+01 114.860 0.8423 
1 1 1 3   79  3  o 16 1.87734e+01 5.75011e-01 3.18009e+02 248.367 -2.00543e+01 -5.05658e+01 0.00000e+00 0.00000e+00 3.75446e+02 248.367 5.74365e+01 248.367 0.9908 
1 1 1 3   79  4  o 11 6.83944e+00 6.93470e-01 1.33675e+02 121.745 -4.55510e+00 7.36229e+00  0.00000e+00 0.00000e+00 1.06081e+02 121.745 2.75946e+01 301.745 0.9403 
1 1 1 3   79  5  o 16 3.38443e+00 1.13726e+00 3.13592e+01 181.031 -9.81788e-01 -1.76617e-02 0.00000e+00 0.00000e+00 2.41408e+01 181.031 7.21844e+00 1.031   0.4400 
1 1 1 3   79  6  o 12 8.73112e+00 6.83161e-01 1.93448e+02 53.287  1.12521e+01  1.50888e+01  0.00000e+00 0.00000e+00 1.23155e+02 53.287  7.02931e+01 233.287 0.9731 
1 1 1 3   79  7  o 6  3.62358e+00 9.20696e-01 5.27798e+01 80.374  3.56395e-01  2.10131e+00  0.00000e+00 0.00000e+00 4.41748e+01 80.374  8.60499e+00 260.374 0.7182 
1 1 1 3   79  8  o 6  7.20808e+00 9.16523e-01 1.36798e+02 102.146 -2.54856e+00 1.18419e+01  0.00000e+00 0.00000e+00 1.20317e+02 102.146 1.64801e+01 282.146 0.9578 
1 1 1 3   79  9  o 14 6.71697e+00 9.51482e-01 2.10370e+02 254.713 -5.18078e+00 -1.89546e+01 0.00000e+00 0.00000e+00 3.32387e+01 254.713 1.77131e+02 74.713  0.9742 
1 1 1 3   79  10 o 2  5.02315e+00 1.03491e+00 7.92437e+01 178.601 -5.36601e+00 1.31067e-01  0.00000e+00 0.00000e+00 8.92147e+01 178.601 9.97104e+00 178.601 0.9013 
1 1 1 3   79  11 o 19 6.90383e+00 1.02763e+00 1.59652e+02 18.465  1.69429e+01  5.65760e+00  0.00000e+00 0.00000e+00 8.98151e+01 18.465  6.98369e+01 198.465 0.9716 
1 1 1 3   79  12 o 6  7.49599e+00 1.12699e+00 1.21936e+02 216.772 -1.11618e+01 -8.34170e+00 0.00000e+00 0.00000e+00 1.46495e+02 216.772 2.45591e+01 216.772 0.9634 
1 1 1 3   79  13 o 19 3.11664e+00 1.02029e+00 6.31648e+01 163.122 -3.33817e+00 1.01282e+00  0.00000e+00 0.00000e+00 3.41392e+01 163.122 2.90256e+01 343.122 0.8405 
1 1 1 3   79  14 o 11 3.56648e+00 1.12146e+00 5.47061e+01 250.154 -1.33985e+00 -3.71230e+00 0.00000e+00 0.00000e+00 5.93366e+01 250.154 4.63051e+00 250.154 0.8614 
1 1 1 3   79  15 o 14 3.15318e+00 1.05410e+00 3.72195e+01 99.949  -4.57700e-01 2.60937e+00  0.00000e+00 0.00000e+00 5.40401e+01 99.949  1.68206e+01 99.949  0.7803 
1 1 1 3   80  0  o 13 1.71910e+01 6.36359e-01 1.77354e+02 93.992  -1.91918e+00 2.74981e+01  0.00000e+00 0.00000e+00 4.51642e+02 93.992  2.74288e+02 93.992  0.9817 
1 1 1 3   80  1  o 15 1.01016e+01 6.91886e-01 2.54620e+02 289.604 7.69230e+00  -2.15978e+01 0.00000e+00 0.00000e+00 1.13606e+02 289.604 1.41013e+02 109.604 0.9779 
1 1 1 3   80  2  o 10 1.29037e+01 5.79624e-01 2.62288e+02 22.939  2.83806e+01  1.20111e+01  0.00000e+00 0.00000e+00 2.10835e+02 22.939  5.14536e+01 202.939 0.9836 
1 1 1 3   80  3  o 8  2.60890e+00 7.37788e-01 9.32869e+01 318.243 1.68051e+00  -1.50030e+00 0.00000e+00 0.00000e+00 2.17913e+01 138.243 1.15078e+02 138.243 0.7352 
1 1 1 3   80  4  o 2  1.42830e+01 5.81889e-01 2.28722e+02 196.673 -3.37111e+01 -1.00963e+01 0.00000e+00 0.00000e+00 2.95999e+02 196.673 6.72772e+01 196.673 0.9857 
1 1 1 3   80  5  o 10 7.87506e+00 8.86580e-01 1.27645e+02 98.626  -1.55407e+00 1.02448e+01  0.00000e+00 0.00000e+00 1.51279e+02 98.626  2.36334e+01 98.626  0.9504 
1 1 1 3   80  6  f 0  5.70394e+00 8.22845e-01 1.23493e+02 73.386  2.36868e+00  7.93864e+00  0.00000e+00 0.00000e+00 7.57471e+01 73.386  4.77463e+01 253.386 0.9375 
1 1 1 3   80  7  o 6  9.59227e+00 8.25224e-01 8.86070e+01 64.690  4.39388e+00  9.29109e+00  0.00000e+00 0.00000e+00 2.50822e+02 64.690  1.62215e+02 64.690  0.9500 
1 1 1 3   80  8  o 6  8.90757e+00 8.94795e-01 1.60596e+02 216.137 -1.55912e+01 -1.13849e+01 0.00000e+00 0.00000e+00 1.62364e+02 216.137 1.76849e+00 216.137 0.9737 
1 1 1 3   80  9  o 11 1.03078e+01 8.40512e-01 1.79354e+02 260.786 -4.32906e+00 -2.66870e+01 0.00000e+00 0.00000e+00 1.97135e+02 260.786 1.77812e+01 260.786 0.9813 
1 1 1 3   80  10 o 17 9.96219e+00 9.37096e-01 1.40793e+02 103.122 -4.66390e+00 2.00070e+01  0.00000e+00 0.00000e+00 2.20688e+02 103.122 7.98943e+01 103.122 0.9753 
1 1 1 3   80  11 o 1  5.57220e+00 1.11510e+00 1.06053e+02 254.512 -2.34120e+00 -8.44901e+00 0.00000e+00 0.00000e+00 8.89373e+01 254.512 1.71159e+01 74.512  0.9411 
1 1 1 3   80  12 o 16 1.59297e+01 8.00458e-01 2.46896e+02 104.827 -1.89200e+01 7.14745e+01  0.00000e+00 0.00000e+00 3.41056e+02 104.827 9.41597e+01 104.827 0.9932 
1 1 1 3   80  13 o 18 8.02605e+00 1.21157e+00 1.15204e+02 324.986 1.23764e+01  -8.67053e+00 0.00000e+00 0.00000e+00 1.72826e+02 324.986 5.76215e+01 324.986 0.9663 
1 1 1 3   80  14 o 18 3.42814e+00 1.10672e+00 4.60269e+01 116.316 -1.33250e+00 2.69421e+00  0.00000e+00 0.00000e+00 5.70756e+01 116.316 1.10487e+01 116.316 0.8104 
1 1 1 3   80  15 o 9  4.73865e+00 1.34027e+00 4.85722e+01 34.210  3.57469e+00  2.43028e+00  0.00000e+00 0.00000e+00 1.05163e+02 34.210  5.65911e+01 34.210  0.8749 
1 1 1 3   81  0  o 14 1.24673e+01 8.12848e-01 2.30081e+02 299.827 1.23066e+01  -2.14650e+01 0.00000e+00 0.00000e+00 2.25002e+02 299.827 5.07921e+00 119.827 0.9796 
1 1 1 3   81  1  o 3  8.54972e+00 6.94388e-01 9.25614e+01 134.701 -4.94354e+00 4.99539e+00  0.00000e+00 0.00000e+00 2.02427e+02 134.701 1.09866e+02 134.701 0.9258 
1 1 1 3   81  2  o 10 7.60469e+00 5.63341e-01 9.42673e+01 16.717  6.61564e+00  1.98695e+00  0.00000e+00 0.00000e+00 1.67738e+02 16.717  7.34706e+01 16.717  0.9245 
1 1 1 3   81  3  o 3  1.61374e+01 5.13173e-01 3.21983e+02 145.708 -4.22627e+01 2.88215e+01  0.00000e+00 0.00000e+00 2.73489e+02 145.708 4.84936e+01 325.707 0.9902 
1 1 1 3   81  4  o 2  9.75890e+00 5.48849e-01 1.81911e+02 44.769  1.40555e+01  1.39425e+01  0.00000e+00 0.00000e+00 1.72426e+02 44.769  9.48474e+00 224.769 0.9744 
1 1 1 3   81  5  o 12 3.54178e+00 8.47478e-01 7.43760e+01 46.515  1.92187e+00  2.02626e+00  0.00000e+00 0.00000e+00 3.03194e+01 46.515  4.40565e+01 226.515 0.7934 
1 1 1 3   81  6  o 13 5.94882e+00 8.48280e-01 6.24385e+01 111.129 -1.62102e+00 4.19472e+00  0.00000e+00 0.00000e+00 1.32612e+02 111.129 7.01739e+01 111.129 0.8802 
1 1 1 3   81  7  o 18 7.88692e+00 1.23877e+00 1.62671e+02 78.116  2.83707e+00  1.34818e+01  0.00000e+00 0.00000e+00 1.20159e+02 78.116  4.25116e+01 258.116 0.9630 
1 1 1 3   81  8  o 7  6.15897e+00 9.93448e-01 1.40474e+02 21.754  9.97667e+00  3.98116e+00  0.00000e+00 0.00000e+00 7.78524e+01 21.754  6.26217e+01 201.754 0.9522 
1 1 1 3   81  9  f 0  4.64756e+00 1.06271e+00 1.06042e+02 99.890  -1.11480e+00 6.39414e+00  0.00000e+00 0.00000e+00 5.29540e+01 99.890  5.30883e+01 279.890 0.9194 
1 1 1 3   81  10 o 10 6.95028e+00 1.11498e+00 1.16778e+02 64.368  4.99336e+00  1.04069e+01  0.00000e+00 0.00000e+00 1.30267e+02 64.368  1.34885e+01 64.368  0.9557 
1 1 1 3   81  11 o 13 7.30907e+00 1.24711e+00 1.94779e+02 7.705   1.95297e+01  2.64227e+00  0.00000e+00 0.00000e+00 6.99481e+01 7.705   1.24831e+02 187.705 0.9743 
1 1 1 3   81  12 o 9  6.43818e+00 1.34795e+00 1.05758e+02 213.038 -7.77648e+00 -5.05736e+00 0.00000e+00 0.00000e+00 1.20155e+02 213.038 1.43973e+01 213.038 0.9445 
1 1 1 3   81  13 o 3  7.54086e+00 1.30171e+00 9.47309e+01 107.015 -3.15932e+00 1.03237e+01  0.00000e+00 0.00000e+00 1.71956e+02 107.015 7.72249e+01 107.015 0.9525 
1 1 1 3   81  14 o 3  3.74380e+00 1.17955e+00 4.41814e+01 63.332  1.40692e+00  2.80120e+00  0.00000e+00 0.00000e+00 6.96483e+01 63.332  2.54668e+01 63.332  0.8195 
1 1 1 3   82  0  o 8  2.60053e+00 7.49081e-01 4.51207e+01 168.067 -1.05917e+00 2.23842e-01  0.00000e+00 0.00000e+00 8.86703e-01 168.067 4.42340e+01 348.067 0.4749 
1 1 1 3   82  1  o 10 4.74738e+00 8.22473e-01 6.11001e+01 294.891 1.11783e+00  -2.40915e+00 0.00000e+00 0.00000e+00 7.70302e+01 294.891 1.59301e+01 294.891 0.7809 
1 1 1 3   82  2  o 15 1.45218e+01 5.01165e-01 2.72799e+02 295.410 1.67754e+01  -3.53123e+01 0.00000e+00 0.00000e+00 2.61302e+02 295.410 1.14972e+01 115.410 0.9871 
1 1 1 3   82  3  o 2  2.27401e+00 6.85990e-01 1.17321e+02 143.837 -2.21842e+00 1.62142e+00  0.00000e+00 0.00000e+00 5.04343e+01 323.837 1.67755e+02 323.837 0.7895 
1 1 1 3   82  4  f 0  8.12771e+00 6.02348e-01 1.30365e+02 113.806 -4.79405e+00 1.08664e+01  0.00000e+00 0.00000e+00 1.59386e+02 113.806 2.90203e+01 113.806 0.9569 
1 1 1 3   82  5  o 14 8.44277e+00 6.03990e-01 2.50636e+02 74.821  6.99944e+00  2.57999e+01  0.00000e+00 0.00000e+00 5.79065e+01 74.821  1.92729e+02 254.821 0.9811 
1 1 1 3   82  6  o 11 3.78017e+00 9.34654e-01 7.19290e+01 223.052 -2.39709e+00 -2.23937e+00 0.00000e+00 0.00000e+00 4.47391e+01 223.052 2.71899e+01 43.052  0.8288 
1 1 1 3   82  7  o 5  1.19801e+01 1.03072e+00 2.36405e+02 346.439 3.21835e+01  -7.76274e+00 0.00000e+00 0.00000e+00 2.02831e+02 346.439 3.35733e+01 166.439 0.9848 
1 1 1 3   82  8  o 3  4.67769e+00 1.04234e+00 4.03472e+01 252.209 -7.66763e-01 -2.38950e+00 0.00000e+00 0.00000e+00 9.30130e+01 252.209 5.26658e+01 252.209 0.7660 
1 1 1 3   82  9  o 14 1.00873e+01 8.76869e-01 2.04572e+02 249.647 -1.00832e+01 -2.71817e+01 0.00000e+00 0.00000e+00 1.64175e+02 249.647 4.03963e+01 69.647  0.9826 
1 1 1 3   82  10 o 12 4.00284e+00 1.11245e+00 1.09010e+02 11.086  6.19016e+00  1.21295e+00  0.00000e+00 0.00000e+00 2.74684e+01 11.086  8.15417e+01 191.086 0.9169 
1 1 1 3   82  11 o 17 4.35765e+00 1.13233e+00 8.11716e+01 92.822  -2.55489e-01 5.18366e+00  0.00000e+00 0.00000e+00 6.42037e+01 92.822  1.69679e+01 272.822 0.8976 
1 1 1 3   82  12 f 0  8.28808e+00 1.29441e+00 1.21168e+02 4.806   1.45432e+01  1.22284e+00  0.00000e+00 0.00000e+00 1.75950e+02 4.806   5.47812e+01 4.806   0.9651 
1 1 1 3   82  13 o 16 5.56600e+00 1.49059e+00 5.44115e+01 184.226 -4.14905e+00 -3.06549e-01 0.00000e+00 0.00000e+00 1.25223e+02 184.226 7.08118e+01 184.226 0.8694 
1 1 1 3   82  14 o 13 3.25793e+00 1.08307e+00 4.79944e+01 47.695  2.13969e+00  2.35106e+00  0.00000e+00 0.00000e+00 5.13935e+01 47.695  3.39907e+00 47.695  0.8224 
1 1 1 3   83  0  o 5  6.19383e+00 7.11549e-01 9.70699e+01 221.865 -4.21779e+00 -3.77978e+00 0.00000e+00 0.00000e+00 1.12124e+02 221.865 1.50540e+01 221.865 0.9068 
1 1 1 3   83  1  o 16 1.41848e+01 4.62792e-01 2.27709e+02 235.145 -2.04024e+01 -2.92948e+01 0.00000e+00 0.00000e+00 2.93214e+02 235.145 6.55051e+01 235.145 0.9859 
1 1 1 3   83  2  o 5  1.25573e+01 5.00602e-01 2.22778e+02 30.053  2.60395e+01  1.50660e+01  0.00000e+00 0.00000e+00 2.37147e+02 30.053  1.43688e+01 30.053  0.9832 
1 1 1 3   83  3  o 7  4.82930e+00 7.45635e-01 9.77108e+01 17.795  4.58907e+00  1.47299e+00  0.00000e+00 0.00000e+00 6.22147e+01 17.795  3.54962e+01 197.795 0.8890 
1 1 1 3   83  4  o 10 9.52557e+00 5.54756e-01 2.16518e+02 37.079  1.89615e+01  1.43295e+01  0.00000e+00 0.00000e+00 1.30725e+02 37.079  8.57924e+01 217.079 0.9787 
1 1 1 3   83  5  o 13 9.32655e+00 5.79136e-01 1.51250e+02 223.249 -1.36401e+01 -1.28309e+01 0.00000e+00 0.00000e+00 1.86668e+02 223.249 3.54178e+01 223.249 0.9729 
1 1 1 3   83  6  f 0  1.20237e+01 5.75849e-01 1.54059e+02 334.569 2.35311e+01  -1.11888e+01 0.00000e+00 0.00000e+00 2.84933e+02 334.569 1.30874e+02 334.569 0.9806 
1 1 1 3   83  7  o 4  9.14245e+00 1.15607e+00 1.66437e+02 84.825  1.63211e+00  1.80225e+01  0.00000e+00 0.00000e+00 1.64322e+02 84.825  2.11509e+00 264.825 0.9720 
1 1 1 3   83  8  o 4  1.49083e+01 8.22344e-01 2.13640e+02 292.520 1.80069e+01  -4.34288e+01 0.00000e+00 0.00000e+00 3.35157e+02 292.520 1.21517e+02 292.520 0.9893 
1 1 1 3   83  9  o 18 3.35988e+00 9.81177e-01 1.78412e+01 9.305   8.19161e-01  1.34211e-01  0.00000e+00 0.00000e+00 3.00176e+01 9.305   1.21765e+01 9.305   0.3830 
1 1 1 3   83  10 o 15 4.75647e+00 1.20318e+00 9.29001e+01 268.423 -1.69884e-01 -6.16995e+00 0.00000e+00 0.00000e+00 6.88946e+01 268.423 2.40056e+01 88.423  0.9150 
1 1 1 3   83  11 o 3  3.65844e+00 1.10925e+00 1.00377e+02 201.189 -4.94038e+00 -1.91516e+00 0.00000e+00 0.00000e+00 2.19529e+01 201.189 7.84237e+01 21.189  0.8999 
1 1 1 3   83  12 o 1  6.16594e+00 1.43853e+00 9.47281e+01 357.847 8.04552e+00  -3.02475e-01 0.00000e+00 0.00000e+00 1.19521e+02 357.847 2.47934e+01 357.847 0.9357 
1 1 1 3   83  13 f 0  4.33047e+00 1.33267e+00 6.70994e+01 215.749 -3.82356e+00 -2.75247e+00 0.00000e+00 0.00000e+00 7.53303e+01 215.749 8.23091e+00 215.749 0.8862 
1 1 1 3   83  14 o 5  3.64647e+00 1.20986e+00 5.10359e+01 29.727  3.07984e+00  1.75865e+00  0.00000e+00 0.00000e+00 6.30345e+01 29.727  1.19985e+01 29.727  0.8435 
1 1 1 3   84  0  o 1  6.55172e+00 6.62827e-01 1.21522e+02 147.958 -6.98819e+00 4.37388e+00  0.00000e+00 0.00000e+00 1.07135e+02 147.958 1.43870e+01 327.958 0.9372 
1 1 1 3   84  1  o 13 1.53893e+01 4.58382e-01 3.07049e+02 223.087 -3.92298e+01 -3.66941e+01 0.00000e+00 0.00000e+00 2.60704e+02 223.087 4.63448e+01 43.087  0.9906 
1 1 1 3   84  2  o 3  1.57509e+01 4.73560e-01 3.32903e+02 61.066  2.76546e+01  5.00271e+01  0.00000e+00 0.00000e+00 2.48537e+02 61.066  8.43660e+01 241.066 0.9912 
1 1 1 3   84  3  o 11 1.86244e+01 5.32206e-01 2.87383e+02 226.491 -3.92441e+01 -4.13420e+01 0.00000e+00 0.00000e+00 4.00095e+02 226.491 1.12711e+02 226.491 0.9912 
1 1 1 3   84  4  o 10 7.65715e+00 6.13930e-01 1.01856e+02 3.517   9.79678e+00  6.02191e-01  0.00000e+00 0.00000e+00 1.68336e+02 3.517   6.64799e+01 3.517   0.9476 
1 1 1 3   84  5  o 2  1.53865e+01 5.44787e-01 3.10335e+02 351.048 5.92786e+01  -9.33783e+00 0.00000e+00 0.00000e+00 2.57737e+02 351.048 5.25980e+01 171.048 0.9916 
1 1 1 3   84  6  o 8  3.54932e+00 8.51143e-01 9.75177e+01 157.837 -4.25241e+00 1.73214e+00  0.00000e+00 0.00000e+00 1.91382e+01 157.837 7.83796e+01 337.837 0.8830 
1 1 1 3   84  7  o 3  7.04377e+00 9.50236e-01 1.16101e+02 228.648 -6.83884e+00 -7.77023e+00 0.00000e+00 0.00000e+00 1.33019e+02 228.648 1.69183e+01 228.648 0.9504 
1 1 1 3   84  8  o 2  3.88904e+00 9.46103e-01 5.36200e+01 52.425  1.77931e+00  2.31255e+00  0.00000e+00 0.00000e+00 6.26591e+01 52.425  9.03911e+00 52.425  0.8037 
1 1 1 3   84  9  o 5  4.76307e+00 1.11779e+00 1.20947e+02 238.010 -4.05541e+00 -6.49255e+00 0.00000e+00 0.00000e+00 4.41618e+01 238.010 7.67856e+01 58.010  0.9322 
1 1 1 3   84  10 o 13 7.90445e+00 1.13381e+00 1.12585e+02 135.039 -9.05897e+00 9.04657e+00  0.00000e+00 0.00000e+00 1.69496e+02 135.039 5.69111e+01 135.039 0.9601 
1 1 1 3   84  11 o 15 5.58563e+00 1.28120e+00 8.26583e+01 357.120 6.35070e+00  -3.19472e-01 0.00000e+00 0.00000e+00 1.07746e+02 357.120 2.50880e+01 357.120 0.9176 
1 1 1 3   84  12 o 16 3.99847e+00 1.22899e+00 8.71401e+01 50.592  3.39428e+00  4.13111e+00  0.00000e+00 0.00000e+00 4.65951e+01 50.592  4.05450e+01 230.592 0.9008 
1 1 1 3   84  13 o 9  4.29916e+00 1.31780e+00 4.25147e+01 256.346 -7.40415e-01 -3.04790e+00 0.00000e+00 0.00000e+00 8.82241e+01 256.346 4.57094e+01 256.346 0.8196 
1 1 1 3   84  14 o 9  2.81249e+00 9.83095e-01 4.59910e+01 123.782 -1.80438e+00 2.69714e+00  0.00000e+00 0.00000e+00 4.02066e+01 123.782 5.78443e+00 303.782 0.8266 
1 1 1 3   85  0  o 8  7.16728e+00 5.28347e-01 1.48006e+02 263.511 -1.29145e+00 -1.13546e+01 0.00000e+00 0.00000e+00 1.06868e+02 263.511 4.11380e+01 83.511  0.9552 
1 1 1 3   85  1  o 6  1.29769e+01 4.64193e-01 2.14756e+02 154.899 -2.91835e+01 1.36712e+01  0.00000e+00 0.00000e+00 2.60847e+02 154.899 4.60911e+01 154.899 0.9844 
1 1 1 3   85  2  o 19 7.08788e+00 5.46901e-01 1.39931e+02 221.634 -7.86930e+00 -6.99511e+00 0.00000e+00 0.00000e+00 1.11111e+02 221.634 2.88196e+01 41.634  0.9513 
1 1 1 3   85  3  o 1  8.15309e+00 5.42563e-01 1.60374e+02 281.385 3.13123e+00  -1.55506e+01 0.00000e+00 0.00000e+00 1.33454e+02 281.385 2.69204e+01 101.385 0.9679 
1 1 1 3   85  4  o 3  3.29668e+00 7.58672e-01 1.15505e+02 351.630 4.71204e+00  -6.93317e-01 0.00000e+00 0.00000e+00 6.57136e+00 171.630 1.22076e+02 171.630 0.8876 
1 1 1 3   85  5  o 5  8.50252e+00 6.27221e-01 1.67666e+02 148.060 -1.56180e+01 9.73662e+00  0.00000e+00 0.00000e+00 1.40101e+02 148.060 2.75650e+01 328.060 0.9724 
1 1 1 3   85  6  o 10 3.21371e+00 8.39860e-01 1.02321e+02 220.421 -3.27907e+00 -2.79276e+00 0.00000e+00 0.00000e+00 2.25342e+00 220.421 1.00067e+02 40.421  0.8744 
1 1 1 3   85  7  o 13 1.10774e+01 7.34781e-01 2.23289e+02 297.618 1.76230e+01  -3.36836e+01 0.00000e+00 0.00000e+00 1.83387e+02 297.618 3.99025e+01 117.618 0.9868 
1 1 1 3   85  8  o 15 9.71556e+00 7.06400e-01 1.66787e+02 71.875  7.62760e+00  2.33026e+01  0.00000e+00 0.00000e+00 1.87110e+02 71.875  2.03229e+01 71.875  0.9794 
1 1 1 3   85  9  o 3  3.75479e+00 9.42432e-01 3.31332e+01 291.125 7.01296e-01  -1.81508e+00 0.00000e+00 0.00000e+00 6.30016e+01 291.125 2.98683e+01 291.125 0.6887 
1 1 1 3   85  10 o 3  5.32185e+00 1.24138e+00 7.76982e+01 357.982 5.33644e+00  -1.88013e-01 0.00000e+00 0.00000e+00 1.00427e+02 357.982 2.27290e+01 357.982 0.9007 
1 1 1 3   85  11 o 3  3.41927e+00 1.06871e+00 4.55155e+01 141.306 -1.96784e+00 1.57620e+00  0.00000e+00 0.00000e+00 5.19266e+01 141.306 6.41112e+00 141.306 0.7673 
1 1 1 3   85  12 o 18 5.24573e+00 1.36747e+00 1.51170e+02 286.235 3.22846e+00  -1.10868e+01 0.00000e+00 0.00000e+00 3.49158e+01 286.235 1.16254e+02 106.235 0.9557 
1 1 1 3   85  13 o 9  5.64064e+00 1.48879e+00 8.91383e+01 50.429  4.52137e+00  5.47099e+00  0.00000e+00 0.00000e+00 1.04747e+02 50.429  1.56087e+01 50.429  0.9266 
1 1 1 3   85  14 o 19 5.87139e+00 1.65559e+00 1.16570e+02 197.917 -8.84055e+00 -2.85832e+00 0.00000e+00 0.00000e+00 8.90098e+01 197.917 2.75598e+01 17.917  0.9445 
1 1 1 3   86  0  o 6  1.61626e+01 4.51739e-01 3.16827e+02 168.606 -5.42560e+01 1.09342e+01  0.00000e+00 0.00000e+00 2.79289e+02 168.606 3.75383e+01 348.606 0.9909 
1 1 1 3   86  1  o 8  7.29071e+00 5.28296e-01 1.55465e+02 97.734  -1.76811e+00 1.30193e+01  0.00000e+00 0.00000e+00 1.05381e+02 97.734  5.00839e+01 277.734 0.9612 
1 1 1 3   86  2  f 0  6.92068e+00 5.84258e-01 1.50509e+02 266.747 -7.09409e-01 -1.24820e+01 0.00000e+00 0.00000e+00 9.65828e+01 266.747 5.39266e+01 86.747  0.9591 
1 1 1 3   86  3  o 3  5.68801e+00 6.43842e-01 6.72020e+01 214.137 -4.12078e+00 -2.79391e+00 0.00000e+00 0.00000e+00 1.21846e+02 214.137 5.46443e+01 214.137 0.8929 
1 1 1 3   86  4  o 4  4.18764e+00 7.30784e-01 1.05722e+02 207.294 -5.13499e+00 -2.64972e+00 0.00000e+00 0.00000e+00 3.59232e+01 207.294 6.97986e+01 27.294  0.9088 
1 1 1 3   86  5  o 16 3.53965e+00 8.21109e-01 8.42875e+01 181.027 -3.86388e+00 -6.93004e-02 0.00000e+00 0.00000e+00 2.87465e+01 181.027 5.55410e+01 1.028   0.8581 
1 1 1 3   86  6  o 6  8.30058e+00 6.47542e-01 1.22619e+02 298.150 6.98417e+00  -1.30527e+01 0.00000e+00 0.00000e+00 1.75595e+02 298.150 5.29759e+01 298.150 0.9656 
1 1 1 3   86  7  o 19 2.49485e+00 7.76198e-01 7.99011e+01 158.531 -2.79328e+00 1.09855e+00  0.00000e+00 0.00000e+00 4.72524e+00 338.531 8.46263e+01 338.531 0.8101 
1 1 1 3   86  8  o 7  4.43803e+00 9.54141e-01 1.27021e+02 269.814 -2.57516e-02 -7.92051e+00 0.00000e+00 0.00000e+00 2.72012e+01 269.814 9.98196e+01 89.814  0.9346 
1 1 1 3   86  9  o 11 6.55684e+00 9.19529e-01 1.31543e+02 74.530  3.52280e+00  1.27285e+01  0.00000e+00 0.00000e+00 1.02750e+02 74.530  2.87928e+01 254.530 0.9614 
1 1 1 3   86  10 o 17 2.65046e+00 8.67974e-01 3.31386e+01 78.170  3.08699e-01  1.47380e+00  0.00000e+00 0.00000e+00 2.57022e+01 78.170  7.43637e+00 258.170 0.5976 
1 1 1 3   86  11 o 3  5.87882e+00 1.15981e+00 7.86204e+01 227.153 -5.04767e+00 -5.44193e+00 0.00000e+00 0.00000e+00 1.24386e+02 227.153 4.57656e+01 227.153 0.9300 
1 1 1 3   86  12 o 11 4.90117e+00 1.16577e+00 4.94961e+01 342.599 3.85938e+00  -1.20953e+00 0.00000e+00 0.00000e+00 1.07873e+02 342.599 5.83774e+01 342.599 0.8652 
1 1 1 3   86  13 f 0  8.57191e+00 1.45687e+00 9.36003e+01 314.679 8.51048e+00  -8.60643e+00 0.00000e+00 0.00000e+00 2.10875e+02 314.679 1.17274e+02 314.679 0.9578 
1 1 1 3   86  14 o 17 3.80646e+00 1.24766e+00 7.48686e+01 120.906 -2.94376e+00 4.91742e+00  0.00000e+00 0.00000e+00 5.32187e+01 120.906 2.16499e+01 300.906 0.9080 
1 1 1 3   87  0  o 8  2.94372e+00 6.40575e-01 3.93656e+01 131.164 -9.00787e-01 1.03026e+00  0.00000e+00 0.00000e+00 2.21860e+01 131.164 1.71796e+01 311.164 0.5619 
1 1 1 3   87  1  o 4  4.21912e+00 7.43957e-01 5.30741e+01 129.018 -1.70299e+00 2.10168e+00  0.00000e+00 0.00000e+00 7.02718e+01 129.018 1.71977e+01 129.018 0.7856 
1 1 1 3   87  2  o 16 6.78595e+00 5.75827e-01 1.29393e+02 237.638 -6.24581e+00 -9.85639e+00 0.00000e+00 0.00000e+00 1.12076e+02 237.638 1.73168e+01 57.638  0.9561 
1 1 1 3   87  3  o 15 5.84998e+00 6.11548e-01 9.21596e+01 316.328 4.81459e+00  -4.59642e+00 0.00000e+00 0.00000e+00 1.08452e+02 316.328 1.62923e+01 316.328 0.9215 
1 1 1 3   87  4  o 2  4.01585e+00 7.93153e-01 3.83942e+01 104.284 -4.95986e-01 1.94816e+00  0.00000e+00 0.00000e+00 6.61294e+01 104.284 2.77352e+01 104.284 0.6995 
1 1 1 3   87  5  o 10 6.37643e+00 6.61127e-01 9.48103e+01 74.840  2.13470e+00  7.87888e+00  0.00000e+00 0.00000e+00 1.27382e+02 74.840  3.25722e+01 74.840  0.9366 
1 1 1 3   87  6  o 17 7.07500e+00 6.85218e-01 1.14797e+02 167.048 -1.27397e+01 2.92995e+00  0.00000e+00 0.00000e+00 1.38099e+02 167.048 2.33022e+01 167.048 0.9610 
1 1 1 3   87  7  o 6  5.83048e+00 8.06012e-01 7.31024e+01 176.666 -6.35406e+00 3.70175e-01  0.00000e+00 0.00000e+00 1.25868e+02 176.666 5.27658e+01 176.666 0.9177 
1 1 1 3   87  8  o 1  6.93832e+00 8.67949e-01 1.55481e+02 308.579 1.01955e+01  -1.27811e+01 0.00000e+00 0.00000e+00 9.44315e+01 308.579 6.10497e+01 128.579 0.9689 
1 1 1 3   87  9  o 7  4.92279e+00 9.98881e-01 9.28293e+01 2.570   7.52397e+00  3.37675e-01  0.00000e+00 0.00000e+00 7.74836e+01 2.570   1.53458e+01 182.570 0.9310 
1 1 1 3   87  10 o 4  8.78511e+00 9.48232e-01 1.48322e+02 192.720 -2.01232e+01 -4.54227e+00 0.00000e+00 0.00000e+00 1.69972e+02 192.720 2.16500e+01 192.720 0.9755 
1 1 1 3   87  11 o 12 9.85555e+00 9.50978e-01 1.99952e+02 272.619 1.68563e+00  -3.68561e+01 0.00000e+00 0.00000e+00 1.60927e+02 272.619 3.90251e+01 92.619  0.9864 
1 1 1 3   87  12 o 13 3.30963e+00 1.04703e+00 3.13329e+01 258.037 -4.13757e-01 -1.95275e+00 0.00000e+00 0.00000e+00 5.42706e+01 258.037 2.29377e+01 258.037 0.6971 
1 1 1 3   87  13 o 10 3.78195e+00 1.21889e+00 3.77039e+01 126.489 -1.54287e+00 2.08594e+00  0.00000e+00 0.00000e+00 7.09583e+01 126.489 3.32544e+01 126.489 0.7749 
1 1 1 3   87  14 o 4  6.21803e+00 1.67551e+00 1.25384e+02 151.370 -9.27141e+00 5.06123e+00  0.00000e+00 0.00000e+00 9.38127e+01 151.370 3.15717e+01 331.370 0.9514 
1 1 1 3   88  0  o 8  9.23043e+00 4.80049e-01 1.10640e+02 302.107 7.39198e+00  -1.17805e+01 0.00000e+00 0.00000e+00 2.20169e+02 302.107 1.09529e+02 302.107 0.9633 
1 1 1 3   88  1  o 7  1.35337e+01 4.71257e-01 2.32517e+02 178.592 -4.28507e+01 1.05334e+00  0.00000e+00 0.00000e+00 2.65107e+02 178.592 3.25893e+01 178.592 0.9883 
1 1 1 3   88  2  o 16 1.25164e+01 5.09219e-01 2.54938e+02 334.110 3.63918e+01  -1.76630e+01 0.00000e+00 0.00000e+00 2.04965e+02 334.110 4.99730e+01 154.110 0.9876 
1 1 1 3   88  3  o 14 3.23951e+00 7.89104e-01 6.63334e+01 99.887  -4.51491e-01 2.59044e+00  0.00000e+00 0.00000e+00 2.74832e+01 99.887  3.88502e+01 279.887 0.7784 
1 1 1 3   88  4  f 0  2.80853e+00 7.65651e-01 5.50179e+01 352.680 2.10312e+00  -2.70162e-01 0.00000e+00 0.00000e+00 1.98540e+01 352.680 3.51639e+01 172.680 0.7166 
1 1 1 3   88  5  o 18 3.30721e+00 8.04384e-01 4.47932e+01 270.019 6.57492e-04  -2.02980e+00 0.00000e+00 0.00000e+00 4.16395e+01 270.019 3.15370e+00 90.019  0.7026 
1 1 1 3   88  6  o 1  7.48874e+00 6.53260e-01 7.25442e+01 327.246 7.29750e+00  -4.69458e+00 0.00000e+00 0.00000e+00 1.89375e+02 327.246 1.16831e+02 327.246 0.9405 
1 1 1 3   88  7  o 8  1.01847e+01 6.48798e-01 2.09999e+02 231.372 -2.06353e+01 -2.58234e+01 0.00000e+00 0.00000e+00 1.62879e+02 231.372 4.71194e+01 51.372  0.9848 
1 1 1 3   88  8  o 4  8.34506e+00 7.76443e-01 1.69181e+02 37.397  1.91428e+01  1.46341e+01  0.00000e+00 0.00000e+00 1.34463e+02 37.397  3.47178e+01 217.397 0.9790 
1 1 1 3   88  9  o 8  3.04266e+00 9.04953e-01 4.26185e+01 127.419 -1.32205e+00 1.72796e+00  0.00000e+00 0.00000e+00 3.92905e+01 127.419 3.32796e+00 307.419 0.7246 
1 1 1 3   88  10 o 5  7.10119e+00 1.00646e+00 1.44830e+02 247.008 -6.59022e+00 -1.55318e+01 0.00000e+00 0.00000e+00 1.10926e+02 247.008 3.39042e+01 67.008  0.9699 
1 1 1 3   88  11 o 12 3.16176e+00 9.86116e-01 9.46335e+00 155.824 -4.98200e-01 2.23652e-01  0.00000e+00 0.00000e+00 2.14403e+01 155.824 1.19769e+01 155.824 0.2634 
1 1 1 3   88  12 f 0  5.60232e+00 1.24989e+00 1.20557e+02 157.899 -1.08351e+01 4.39999e+00  0.00000e+00 0.00000e+00 7.81559e+01 157.899 4.24009e+01 337.899 0.9562 
1 1 1 3   88  13 o 14 2.86252e+00 9.72890e-01 8.34969e+01 303.345 3.06446e+00  -4.65731e+00 0.00000e+00 0.00000e+00 1.25556e+01 303.345 7.09413e+01 123.344 0.9052 
1 1 1 3   88  14 o 14 4.43377e+00 1.31735e+00 9.75626e+01 271.232 1.78232e-01  -8.29093e+00 0.00000e+00 0.00000e+00 5.64312e+01 271.232 4.11313e+01 91.231  0.9376 
1 1 1 3   89  0  o 7  5.02117e+00 6.65647e-01 7.57322e+01 293.965 1.87510e+00  -4.21841e+00 0.00000e+00 0.00000e+00 8.92942e+01 293.965 1.35620e+01 293.965 0.8837 
1 1 1 3   89  1  o 12 1.08219e+01 4.88027e-01 2.35613e+02 154.782 -3.24128e+01 1.52647e+01  0.00000e+00 0.00000e+00 1.61270e+02 154.782 7.43427e+01 334.782 0.9859 
1 1 1 3   89  2  o 4  1.29974e+01 4.74485e-01 1.69627e+02 229.606 -1.92161e+01 -2.25837e+01 0.00000e+00 0.00000e+00 3.05625e+02 229.606 1.35999e+02 229.606 0.9830 
1 1 1 3   89  3  o 9  9.15683e+00 5.12202e-01 1.59366e+02 106.680 -6.02185e+00 2.00977e+01  0.00000e+00 0.00000e+00 1.73020e+02 106.680 1.36539e+01 106.680 0.9759 
1 1 1 3   89  4  o 18 4.95701e+00 7.51223e-01 5.22133e+01 317.480 2.58434e+00  -2.36975e+00 0.00000e+00 0.00000e+00 1.02920e+02 317.480 5.07065e+01 317.480 0.8414 
1 1 1 3   89  5  o 18 8.11650e+00 5.91818e-01 8.22283e+01 348.880 1.09298e+01  -2.14825e+00 0.00000e+00 0.00000e+00 2.05719e+02 348.880 1.23491e+02 348.880 0.9540 
1 1 1 3   89  6  o 19 4.87093e+00 8.17460e-01 1.09125e+02 144.612 -6.43438e+00 4.57065e+00  0.00000e+00 0.00000e+00 6.00784e+01 144.612 4.90470e+01 324.612 0.9343 
1 1 1 3   89  7  o 19 9.29737e+00 6.37851e-01 1.91745e+02 349.803 2.83490e+01  -5.09930e+00 0.00000e+00 0.00000e+00 1.47779e+02 349.803 4.39663e+01 169.803 0.9825 
1 1 1 3   89  8  o 8  3.63702e+00 9.25683e-01 7.47177e+01 301.223 2.15123e+00  -3.54884e+00 0.00000e+00 0.00000e+00 4.27253e+01 301.223 3.19924e+01 121.223 0.8691 
1 1 1 3   89  9  o 7  2.57303e+00 8.19294e-01 9.99686e+01 317.958 3.41576e+00  -3.08013e+00 0.00000e+00 0.00000e+00 1.55655e+01 137.958 1.15534e+02 137.958 0.8832 
1 1 1 3   89  10 o 13 2.70595e+00 8.79191e-01 3.92918e+01 159.319 -1.84392e+00 6.96051e-01  0.00000e+00 0.00000e+00 3.03196e+01 159.319 8.97223e+00 339.319 0.6929 
1 1 1 3   89  11 o 9  1.31203e+01 8.62118e-01 1.95479e+02 171.920 -5.32132e+01 7.55442e+00  0.00000e+00 0.00000e+00 2.86805e+02 171.920 9.13265e+01 171.920 0.9907 
1 1 1 3   89  12 o 14 2.88553e+00 9.49953e-01 2.65885e+01 12.023  1.75101e+00  3.72928e-01  0.00000e+00 0.00000e+00 4.40517e+01 12.023  1.74632e+01 12.023  0.6601 
1 1 1 3   89  13 o 12 1.16373e+01 1.13401e+00 1.58644e+02 55.886  2.26177e+01  3.33887e+01  0.00000e+00 0.00000e+00 2.67254e+02 55.886  1.08610e+02 55.886  0.9875 
1 1 1 3   90  0  o 3  2.60446e+00 7.13657e-01 3.31595e+01 20.165  1.08888e+00  3.99881e-01  0.00000e+00 0.00000e+00 1.52836e+01 20.165  1.78759e+01 200.165 0.5002 
1 1 1 3   90  1  o 3  1.29464e+01 4.80359e-01 2.32022e+02 284.584 1.09056e+01  -4.19158e+01 0.00000e+00 0.00000e+00 2.43832e+02 284.584 1.18106e+01 284.584 0.9884 
1 1 1 3   90  2  o 14 7.57862e+00 5.72614e-01 1.02061e+02 107.142 -3.22028e+00 1.04402e+01  0.00000e+00 0.00000e+00 1.66553e+02 107.142 6.44919e+01 107.142 0.9531 
1 1 1 3   90  3  o 6  3.95948e+00 7.38657e-01 6.08275e+01 20.395  2.96646e+00  1.10294e+00  0.00000e+00 0.00000e+00 6.01287e+01 20.395  6.98798e-01 200.395 0.8215 
1 1 1 3   90  4  o 19 6.97586e+00 6.20643e-01 9.25751e+01 273.100 5.11964e-01  -9.45378e+00 0.00000e+00 0.00000e+00 1.52709e+02 273.100 6.01340e+01 273.100 0.9456 
1 1 1 3   90  5  o 7  3.39587e+00 7.94435e-01 1.10784e+02 117.035 -2.57486e+00 5.04584e+00  0.00000e+00 0.00000e+00 3.70413e+00 117.035 1.07080e+02 297.035 0.9068 
1 1 1 3   90  6  o 9  2.92886e+00 7.51037e-01 8.90141e+01 324.871 3.39755e+00  -2.39037e+00 0.00000e+00 0.00000e+00 5.61280e+00 324.871 8.34013e+01 144.871 0.8692 
1 1 1 3   90  7  o 7  6.14595e+00 8.14019e-01 1.32625e+02 171.994 -1.25384e+01 1.76357e+00  0.00000e+00 0.00000e+00 8.65461e+01 171.994 4.60792e+01 351.994 0.9597 
1 1 1 3   90  8  o 7  9.87100e+00 7.04901e-01 1.49839e+02 269.566 -2.18112e-01 -2.87986e+01 0.00000e+00 0.00000e+00 2.10421e+02 269.566 6.05826e+01 269.566 0.9825 
1 1 1 3   90  9  o 17 4.32396e+00 1.04479e+00 4.70465e+01 138.732 -2.48243e+00 2.17841e+00  0.00000e+00 0.00000e+00 8.62339e+01 138.732 3.91874e+01 138.732 0.8301 
1 1 1 3   90  10 o 14 2.59208e+00 8.44611e-01 3.43915e+01 160.229 -1.64812e+00 5.92402e-01  0.00000e+00 0.00000e+00 2.83753e+01 160.229 6.01623e+00 340.229 0.6524 
1 1 1 3   90  11 o 6  3.34175e+00 1.03074e+00 8.58311e+01 94.595  -4.22093e-01 5.25242e+00  0.00000e+00 0.00000e+00 2.56495e+01 94.595  6.01816e+01 274.594 0.8993 
1 1 1 3   90  12 o 8  3.25665e+00 1.02121e+00 1.93037e+01 185.116 -1.27380e+00 -1.14034e-01 0.00000e+00 0.00000e+00 4.54781e+01 185.116 2.61744e+01 185.116 0.5365 
1 1 1 3   90  13 o 7  3.19649e+00 1.04573e+00 5.96997e+01 46.984  3.01807e+00  3.23472e+00  0.00000e+00 0.00000e+00 4.42912e+01 46.984  1.54086e+01 226.984 0.8781 
1 1 1 3   91  0  o 18 3.24356e+00 7.62624e-01 5.73348e+01 108.389 -8.05936e-01 2.42430e+00  0.00000e+00 0.00000e+00 3.56109e+01 108.389 2.17239e+01 288.389 0.7708 
1 1 1 3   91  1  o 4  4.83611e+00 7.50485e-01 8.46109e+01 164.617 -5.44124e+00 1.49705e+00  0.00000e+00 0.00000e+00 7.83654e+01 164.617 6.24550e+00 344.617 0.9064 
1 1 1 3   91  2  o 5  7.67596e+00 5.45738e-01 1.98781e+02 68.206  8.23465e+00  2.05944e+01  0.00000e+00 0.00000e+00 8.00982e+01 68.206  1.18683e+02 248.206 0.9772 
1 1 1 3   91  3  o 7  9.29554e+00 5.45264e-01 1.42542e+02 133.441 -1.36986e+01 1.44650e+01  0.00000e+00 0.00000e+00 1.94262e+02 133.441 5.17199e+01 133.441 0.9746 
1 1 1 3   91  4  o 15 5.49040e+00 7.11952e-01 7.57756e+01 356.749 6.60404e+00  -3.75089e-01 0.00000e+00 0.00000e+00 1.12197e+02 356.749 3.64213e+01 356.749 0.9210 
1 1 1 3   91  5  o 2  3.87783e+00 7.97656e-01 7.01970e+01 325.137 3.34559e+00  -2.33070e+00 0.00000e+00 0.00000e+00 5.46869e+01 325.137 1.55101e+01 145.137 0.8664 
1 1 1 3   91  6  o 12 4.34269e+00 9.37294e-01 4.20504e+01 200.616 -2.60285e+00 -9.79181e-01 0.00000e+00 0.00000e+00 8.58248e+01 200.616 4.37743e+01 200.616 0.7924 
1 1 1 3   91  7  f 0  1.21320e+01 5.98836e-01 2.43446e+02 304.418 3.08337e+01  -4.50012e+01 0.00000e+00 0.00000e+00 2.03117e+02 304.418 4.03288e+01 124.418 0.9908 
1 1 1 3   91  8  o 7  1.08010e+01 6.86707e-01 2.21123e+02 112.670 -1.73230e+01 4.14728e+01  0.00000e+00 0.00000e+00 1.75522e+02 112.670 4.56010e+01 292.670 0.9888 
1 1 1 3   91  9  o 14 9.20360e+00 8.15329e-01 1.47911e+02 276.806 2.96669e+00  -2.48555e+01 0.00000e+00 0.00000e+00 1.86864e+02 276.806 3.89531e+01 276.806 0.9798 
1 1 1 3   91  10 o 13 4.20741e+00 1.09628e+00 7.32165e+01 117.158 -2.49258e+00 4.85879e+00  0.00000e+00 0.00000e+00 6.77738e+01 117.158 5.44268e+00 297.158 0.9031 
1 1 1 3   91  11 o 7  8.07552e+00 1.08418e+00 1.31826e+02 112.370 -7.58868e+00 1.84387e+01  0.00000e+00 0.00000e+00 1.60063e+02 112.370 2.82375e+01 112.370 0.9746 
1 1 1 3   91  12 o 12 2.60404e+00 8.85567e-01 2.38085e+01 304.457 8.68475e-01  -1.26568e+00 0.00000e+00 0.00000e+00 3.45539e+01 304.457 1.07455e+01 304.457 0.6047 
1 1 1 3   91  13 o 15 3.98001e+00 1.18983e+00 3.38851e+01 312.333 1.92741e+00  -2.11576e+00 0.00000e+00 0.00000e+00 8.39451e+01 312.333 5.00600e+01 312.333 0.7992 
1 1 1 3   92  0  o 2  3.75394e+00 7.00859e-01 1.00469e+02 70.458  1.74095e+00  4.90499e+00  0.00000e+00 0.00000e+00 2.48073e+01 70.458  7.56620e+01 250.458 0.8979 
1 1 1 3   92  1  o 5  1.15545e+01 4.94427e-01 2.32235e+02 343.404 3.78422e+01  -1.12784e+01 0.00000e+00 0.00000e+00 1.91763e+02 343.404 4.04716e+01 163.404 0.9873 
1 1 1 3   92  2  o 18 3.76187e+00 7.27903e-01 1.00385e+02 157.098 -4.90933e+00 2.07398e+00  0.00000e+00 0.00000e+00 2.55313e+01 157.098 7.48541e+01 337.098 0.9005 
1 1 1 3   92  3  o 9  6.32194e+00 6.58992e-01 1.37771e+02 309.781 9.06051e+00  -1.08821e+01 0.00000e+00 0.00000e+00 8.87539e+01 309.781 4.90172e+01 129.781 0.9640 
1 1 1 3   92  4  f 0  9.88706e+00 5.42973e-01 1.49112e+02 27.129  2.16135e+01  1.10739e+01  0.00000e+00 0.00000e+00 2.10699e+02 27.129  6.15867e+01 27.129  0.9792 
1 1 1 3   92  5  o 17 5.12548e+00 8.12505e-01 3.31077e+01 304.532 1.49002e+00  -2.16540e+00 0.00000e+00 0.00000e+00 1.15126e+02 304.532 8.20180e+01 304.532 0.7783 
1 1 1 3   92  6  o 7  5.99799e+00 8.53024e-01 7.49888e+01 298.186 3.44468e+00  -6.42797e+00 0.00000e+00 0.00000e+00 1.31951e+02 298.186 5.69624e+01 298.186 0.9287 
1 1 1 3   92  7  o 12 6.68210e+00 7.95743e-01 1.37974e+02 179.576 -1.50073e+01 1.10972e-01  0.00000e+00 0.00000e+00 1.01793e+02 179.576 3.61809e+01 359.576 0.9661 
1 1 1 3   92  8  o 19 2.59246e+00 8.10852e-01 3.87758e+01 320.317 1.38976e+00  -1.15310e+00 0.00000e+00 0.00000e+00 2.50580e+01 320.317 1.37179e+01 140.317 0.6632 
1 1 1 3   92  9  o 19 5.98145e+00 9.81683e-01 1.04908e+02 144.788 -8.78677e+00 6.20105e+00  0.00000e+00 0.00000e+00 1.06502e+02 144.788 1.59399e+00 144.788 0.9523 
1 1 1 3   92  10 o 6  9.32873e+00 8.86763e-01 1.34589e+02 15.177  2.34270e+01  6.35483e+00  0.00000e+00 0.00000e+00 2.04276e+02 15.177  6.96875e+01 15.177  0.9792 
1 1 1 3   92  11 o 14 5.13706e+00 1.16415e+00 9.85508e+01 99.882  -1.61211e+00 9.25404e+00  0.00000e+00 0.00000e+00 8.14772e+01 99.882  1.70736e+01 279.882 0.9452 
1 1 1 3   92  12 o 17 5.21838e+00 1.28238e+00 6.53981e+01 65.579  2.47700e+00  5.45531e+00  0.00000e+00 0.00000e+00 1.11002e+02 65.579  4.56042e+01 65.579  0.9122 
1 1 1 3   92  13 f 0  5.01249e+00 1.30581e+00 8.97373e+01 264.580 -7.95503e-01 -8.38487e+00 0.00000e+00 0.00000e+00 8.44924e+01 264.580 5.24490e+00 84.580  0.9386 
1 1 1 3   93  0  o 16 5.42621e+00 6.83188e-01 1.54322e+02 222.226 -8.89012e+00 -8.06837e+00 0.00000e+00 0.00000e+00 3.87075e+01 222.226 1.15614e+02 42.226  0.9574 
1 1 1 3   93  1  o 2  2.38025e+00 7.00772e-01 1.63446e+01 81.102  8.42778e-02  5.38288e-01  0.00000e+00 0.00000e+00 6.89892e+00 81.102  9.44570e+00 261.102 0.2628 
1 1 1 3   93  2  o 2  6.61052e+00 6.25394e-01 1.30320e+02 76.935  3.20669e+00  1.38186e+01  0.00000e+00 0.00000e+00 1.06509e+02 76.935  2.38105e+01 256.935 0.9641 
1 1 1 3   93  3  o 16 2.17930e+00 6.73824e-01 7.87945e+01 25.515  2.45340e+00  1.17100e+00  0.00000e+00 0.00000e+00 1.50766e+01 205.515 9.38711e+01 205.515 0.7868 
1 1 1 3   93  4  o 14 9.07907e+00 5.76039e-01 1.30507e+02 54.524  1.12577e+01  1.57970e+01  0.00000e+00 0.00000e+00 1.98023e+02 54.524  6.75164e+01 54.524  0.9739 
1 1 1 3   93  5  o 11 4.25925e+00 7.74727e-01 9.99363e+01 187.786 -6.96930e+00 -9.52894e-01 0.00000e+00 0.00000e+00 4.65734e+01 187.786 5.33630e+01 7.786   0.9259 
1 1 1 3   93  6  f 0  6.51630e+00 7.95814e-01 8.90528e+01 355.478 9.77740e+00  -7.73191e-01 0.00000e+00 0.00000e+00 1.40287e+02 355.478 5.12337e+01 355.478 0.9476 
1 1 1 3   93  7  f 0  3.14401e+00 8.79563e-01 1.67329e+02 258.368 -1.76951e+00 -8.59585e+00 0.00000e+00 0.00000e+00 5.74533e+01 78.368  2.24783e+02 78.368  0.9412 
1 1 1 3   93  8  o 11 5.69195e+00 9.38779e-01 1.01713e+02 318.608 7.52809e+00  -6.63510e+00 0.00000e+00 0.00000e+00 9.87489e+01 318.608 2.96422e+00 138.608 0.9488 
1 1 1 3   93  9  o 5  8.06684e+00 9.17123e-01 1.36203e+02 141.467 -1.62549e+01 1.29452e+01  0.00000e+00 0.00000e+00 1.55823e+02 141.467 1.96200e+01 141.467 0.9756 
1 1 1 3   93  10 o 1  5.00861e+00 1.11206e+00 6.55746e+01 221.228 -4.33885e+00 -3.80215e+00 0.00000e+00 0.00000e+00 1.03208e+02 221.228 3.76335e+01 221.228 0.9086 
1 1 1 3   93  11 o 4  2.82045e+00 8.84022e-01 8.84381e+01 16.759  5.88219e+00  1.77139e+00  0.00000e+00 0.00000e+00 7.17563e+00 16.759  8.12625e+01 196.759 0.9145 
1 1 1 3   93  12 o 6  3.30578e+00 1.03098e+00 9.03569e+01 23.635  6.73846e+00  2.94881e+00  0.00000e+00 0.00000e+00 2.34536e+01 23.635  6.69033e+01 203.635 0.9293 
1 1 1 3   93  13 o 13 2.62151e+00 8.98254e-01 3.73104e+01 172.070 -2.76859e+00 3.85630e-01  0.00000e+00 0.00000e+00 3.97170e+01 172.070 2.40655e+00 172.070 0.7936 
1 1 1 3   94  0  o 18 1.43290e+01 4.79209e-01 2.65000e+02 14.953  6.34976e+01  1.69584e+01  0.00000e+00 0.00000e+00 2.63213e+02 14.953  1.78682e+00 194.953 0.9924 
1 1 1 3   94  1  o 8  6.66813e+00 6.29230e-01 1.46743e+02 255.445 -3.93649e+00 -1.51614e+01 0.00000e+00 0.00000e+00 9.29361e+01 255.445 5.38073e+01 75.445  0.9675 
1 1 1 3   94  2  o 19 9.59465e+00 5.26017e-01 1.55343e+02 67.176  9.65108e+00  2.29324e+01  0.00000e+00 0.00000e+00 1.93871e+02 67.176  3.85280e+01 67.176  0.9797 
1 1 1 3   94  3  o 16 1.27320e+01 5.22448e-01 2.69670e+02 210.669 -4.91645e+01 -2.91560e+01 0.00000e+00 0.00000e+00 1.99170e+02 210.669 7.04996e+01 30.669  0.9912 
1 1 1 3   94  4  o 19 6.70968e+00 7.05680e-01 1.40389e+02 341.713 1.35137e+01  -4.46589e+00 0.00000e+00 0.00000e+00 9.99313e+01 341.713 4.04573e+01 161.713 0.9642 
1 1 1 3   94  5  o 6  4.13552e+00 8.85291e-01 9.01362e+01 94.742  -4.91190e-01 5.92101e+00  0.00000e+00 0.00000e+00 4.98579e+01 94.742  4.02784e+01 274.742 0.9114 
1 1 1 3   94  6  o 16 2.61985e+00 7.98855e-01 5.35205e+01 156.272 -2.08912e+00 9.18276e-01  0.00000e+00 0.00000e+00 1.83771e+01 156.272 3.51433e+01 336.272 0.7391 
1 1 1 3   94  7  o 7  6.19437e+00 8.18035e-01 8.66410e+01 1.977   8.76563e+00  3.02618e-01  0.00000e+00 0.00000e+00 1.29775e+02 1.977   4.31341e+01 1.977   0.9411 
1 1 1 3   94  8  o 17 5.42543e+00 1.00140e+00 1.32742e+02 208.212 -1.04604e+01 -5.61169e+00 0.00000e+00 0.00000e+00 5.99197e+01 208.212 7.28224e+01 28.212  0.9569 
1 1 1 3   94  9  o 5  1.00314e+01 8.05620e-01 1.50455e+02 140.899 -2.40714e+01 1.95628e+01  0.00000e+00 0.00000e+00 2.15615e+02 140.899 6.51597e+01 140.899 0.9837 
1 1 1 3   94  10 o 8  5.32057e+00 1.13922e+00 1.17437e+02 359.865 1.06126e+01  -2.50072e-02 0.00000e+00 0.00000e+00 7.03031e+01 359.865 4.71335e+01 179.865 0.9517 
1 1 1 3   94  11 o 5  4.11051e+00 1.12837e+00 8.32612e+01 343.886 6.15494e+00  -1.77811e+00 0.00000e+00 0.00000e+00 5.66166e+01 343.886 2.66447e+01 163.886 0.9182 
1 1 1 3   94  12 o 4  3.48656e+00 1.05759e+00 5.03819e+01 292.061 1.48501e+00  -3.66420e+00 0.00000e+00 0.00000e+00 6.08944e+01 292.061 1.05125e+01 292.061 0.8617 
1 1 1 3   94  13 o 14 3.03474e+00 1.00771e+00 7.46222e+01 151.543 -5.32568e+00 2.88645e+00  0.00000e+00 0.00000e+00 2.79595e+01 151.543 4.66628e+01 331.543 0.9132 
1 1 1 3   95  0  f 0  4.08016e+00 7.37589e-01 1.64325e+01 171.747 -1.01498e+00 1.47224e-01  0.00000e+00 0.00000e+00 5.25706e+01 171.747 3.61381e+01 171.747 0.4554 
1 1 1 3   95  1  f 0  4.67161e+00 7.56478e-01 6.22758e+01 306.676 2.63474e+00  -3.53784e+00 0.00000e+00 0.00000e+00 9.00036e+01 306.676 2.77278e+01 306.676 0.8777 
1 1 1 3   95  2  o 10 2.44651e+00 7.23187e-01 5.48677e+01 182.569 -2.07105e+00 -9.29351e-02 0.00000e+00 0.00000e+00 9.59603e+00 182.569 4.52717e+01 2.569   0.7094 
1 1 1 3   95  3  o 17 9.92040e+00 5.41359e-01 1.62619e+02 40.932  2.10864e+01  1.82861e+01  0.00000e+00 0.00000e+00 1.99167e+02 40.932  3.65472e+01 40.932  0.9819 
1 1 1 3   95  4  o 4  4.96093e+00 7.85042e-01 1.03379e+02 306.821 4.66749e+00  -6.23441e+00 0.00000e+00 0.00000e+00 6.85844e+01 306.821 3.47947e+01 126.821 0.9334 
1 1 1 3   95  5  o 15 6.76991e+00 7.00546e-01 9.82541e+01 32.022  9.97274e+00  6.23690e+00  0.00000e+00 0.00000e+00 1.42186e+02 32.022  4.39320e+01 32.022  0.9565 
1 1 1 3   95  6  o 7  3.58209e+00 9.09622e-01 9.25479e+01 14.315  5.58409e+00  1.42489e+00  0.00000e+00 0.00000e+00 2.82649e+01 14.315  6.42830e+01 194.315 0.9085 
1 1 1 3   95  7  o 4  3.52484e+00 8.78346e-01 6.35335e+01 2.860   3.81283e+00  1.90489e-01  0.00000e+00 0.00000e+00 4.84621e+01 2.860   1.50714e+01 182.860 0.8561 
1 1 1 3   95  8  o 18 1.14035e+01 7.20106e-01 1.63676e+02 151.686 -3.27911e+01 1.76668e+01  0.00000e+00 0.00000e+00 2.53683e+02 151.686 9.00076e+01 151.686 0.9865 
1 1 1 3   95  9  o 17 2.67542e+00 8.63552e-01 3.07601e+01 29.232  1.41979e+00  7.94523e-01  0.00000e+00 0.00000e+00 3.13508e+01 29.232  5.90689e-01 29.232  0.6260 
1 1 1 3   95  10 o 19 3.15809e+00 9.80525e-01 5.24535e+01 102.844 -7.45299e-01 3.26886e+00  0.00000e+00 0.00000e+00 4.50656e+01 102.844 7.38790e+00 282.844 0.8330 
1 1 1 3   95  11 o 11 5.81495e+00 1.19009e+00 1.23958e+02 321.930 1.08907e+01  -8.53036e+00 0.00000e+00 0.00000e+00 8.35431e+01 321.930 4.04152e+01 141.930 0.9632 
1 1 1 3   95  12 o 2  4.10858e+00 1.18461e+00 5.18404e+01 248.799 -1.67592e+00 -4.32059e+00 0.00000e+00 0.00000e+00 8.26664e+01 248.799 3.08260e+01 248.799 0.8841 
1 1 1 3   95  13 o 6  3.85001e+00 1.14880e+00 5.71975e+01 67.133  1.95034e+00  4.62455e+00  0.00000e+00 0.00000e+00 7.01414e+01 67.133  1.29438e+01 67.133  0.8938 
1 1 1 3   96  0  o 7  4.05318e+00 7.36447e-01 1.37853e+02 321.977 6.76729e+00  -5.29162e+00 0.00000e+00 0.00000e+00 3.58017e+00 321.977 1.34273e+02 141.977 0.9399 
1 1 1 3   96  1  o 1  9.75474e+00 5.22678e-01 1.72409e+02 211.657 -2.38070e+01 -1.46791e+01 0.00000e+00 0.00000e+00 1.83257e+02 211.657 1.08480e+01 211.657 0.9820 
1 1 1 3   96  2  o 6  7.64946e+00 5.90706e-01 1.20434e+02 16.485  1.39353e+01  4.12391e+00  0.00000e+00 0.00000e+00 1.53651e+02 16.485  3.32174e+01 16.485  0.9650 
1 1 1 3   96  3  o 10 1.01063e+01 5.47129e-01 2.30156e+02 190.636 -3.81668e+01 -7.16781e+00 0.00000e+00 0.00000e+00 1.40234e+02 190.636 8.99210e+01 10.636  0.9870 
1 1 1 3   96  4  o 19 7.19395e+00 7.30543e-01 1.87081e+02 42.869  1.58938e+01  1.47534e+01  0.00000e+00 0.00000e+00 7.37774e+01 42.869  1.13304e+02 222.869 0.9767 
1 1 1 3   96  5  o 2  6.43257e+00 7.72548e-01 1.14382e+02 183.408 -1.20965e+01 -7.20397e-01 0.00000e+00 0.00000e+00 1.14330e+02 183.408 5.17110e-02 3.408   0.9578 
1 1 1 3   96  6  o 14 3.46500e+00 8.99608e-01 6.28106e+01 337.278 3.37633e+00  -1.41389e+00 0.00000e+00 0.00000e+00 4.63777e+01 337.278 1.64329e+01 157.278 0.8491 
1 1 1 3   96  7  f 0  2.43733e+00 7.68783e-01 9.15036e+01 173.960 -3.85980e+00 4.08398e-01  0.00000e+00 0.00000e+00 1.38397e+01 353.960 1.05343e+02 353.960 0.8588 
1 1 1 3   96  8  o 15 3.27046e+00 9.34107e-01 8.32953e+01 40.819  3.85458e+00  3.32942e+00  0.00000e+00 0.00000e+00 2.53329e+01 40.819  5.79625e+01 220.819 0.8955 
1 1 1 3   96  9  o 4  6.81992e+00 9.64746e-01 8.80867e+01 142.421 -9.29703e+00 7.15424e+00  0.00000e+00 0.00000e+00 1.53739e+02 142.421 6.56521e+01 142.421 0.9564 
1 1 1 3   96  10 o 10 5.17922e+00 1.13676e+00 5.17273e+01 91.140  -1.03248e-01 5.18947e+00  0.00000e+00 0.00000e+00 1.20559e+02 91.140  6.88317e+01 91.140  0.8976 
1 1 1 3   96  11 o 2  7.22989e+00 1.29389e+00 6.94052e+01 335.220 7.92095e+00  -3.65659e+00 0.00000e+00 0.00000e+00 1.82537e+02 335.220 1.13132e+02 335.220 0.9408 
1 1 1 3   96  12 o 15 2.49629e+00 8.49664e-01 2.98917e+01 224.045 -1.52545e+00 -1.47545e+00 0.00000e+00 0.00000e+00 3.63521e+01 224.045 6.46041e+00 224.045 0.7169 
1 1 1 3   96  13 o 1  2.73398e+00 9.25823e-01 3.82089e+01 345.246 3.21471e+00  -8.46597e-01 0.00000e+00 0.00000e+00 4.58777e+01 345.246 7.66881e+00 345.246 0.8314 
1 1 1 3   97  0  o 13 7.24154e+00 5.99706e-01 1.39024e+02 142.180 -1.24898e+01 9.69491e+00  0.00000e+00 0.00000e+00 1.21120e+02 142.180 1.79039e+01 322.180 0.9678 
1 1 1 3   97  1  o 9  1.06867e+01 5.08745e-01 1.42254e+02 282.512 6.08356e+00  -2.74139e+01 0.00000e+00 0.00000e+00 2.47318e+02 282.512 1.05064e+02 282.512 0.9820 
1 1 1 3   97  2  f 0  1.21865e+01 5.10893e-01 2.31116e+02 112.199 -1.79653e+01 4.40242e+01  0.00000e+00 0.00000e+00 2.16488e+02 112.199 1.46278e+01 292.199 0.9894 
1 1 1 3   97  3  o 6  9.48434e+00 5.67186e-01 1.47682e+02 324.366 1.96042e+01  -1.40526e+01 0.00000e+00 0.00000e+00 1.97008e+02 324.366 4.93252e+01 324.366 0.9790 
1 1 1 3   97  4  o 18 4.55944e+00 8.21264e-01 9.86100e+01 182.198 -7.65405e+00 -2.93822e-01 0.00000e+00 0.00000e+00 5.91560e+01 182.198 3.94540e+01 2.198   0.9322 
1 1 1 3   97  5  o 14 1.14818e+01 5.74685e-01 2.51229e+02 324.010 4.82909e+01  -3.50731e+01 0.00000e+00 0.00000e+00 1.71294e+02 324.010 7.99347e+01 144.010 0.9916 
1 1 1 3   97  6  o 6  4.07787e+00 8.90880e-01 4.01240e+01 303.869 1.54474e+00  -2.30155e+00 0.00000e+00 0.00000e+00 7.96481e+01 303.869 3.95241e+01 303.869 0.7916 
1 1 1 3   97  7  o 11 5.74615e+00 9.59490e-01 1.30662e+02 298.379 6.11821e+00  -1.13254e+01 0.00000e+00 0.00000e+00 7.40289e+01 298.379 5.66327e+01 118.379 0.9603 
1 1 1 3   97  8  o 4  3.32540e+00 9.87731e-01 7.61581e+01 98.773  -7.05593e-01 4.57186e+00  0.00000e+00 0.00000e+00 3.28373e+01 98.773  4.33208e+01 278.773 0.8839 
1 1 1 3   97  9  f 0  5.78933e+00 1.02675e+00 1.02658e+02 190.720 -1.07521e+01 -2.03558e+00 0.00000e+00 0.00000e+00 1.01878e+02 190.720 7.79765e-01 10.720  0.9532 
1 1 1 3   97  10 o 12 2.48638e+00 8.26866e-01 1.89707e+01 297.380 5.61069e-01  -1.08331e+00 0.00000e+00 0.00000e+00 2.88322e+01 297.380 9.86147e+00 297.380 0.5189 
1 1 1 3   97  11 o 7  1.00169e+01 1.04863e+00 1.57751e+02 317.699 2.82986e+01  -2.57508e+01 0.00000e+00 0.00000e+00 2.08292e+02 317.699 5.05411e+01 317.699 0.9868 
1 1 1 3   97  12 o 4  6.29583e+00 1.27006e+00 1.39450e+02 182.337 -1.75871e+01 -7.17849e-01 0.00000e+00 0.00000e+00 8.68302e+01 182.337 5.26194e+01 2.337   0.9712 
1 1 1 3   98  0  o 3  6.87980e+00 6.16151e-01 1.13722e+02 168.750 -1.24715e+01 2.48076e+00  0.00000e+00 0.00000e+00 1.31318e+02 168.750 1.75966e+01 168.750 0.9598 
1 1 1 3   98  1  o 6  8.63786e+00 5.64210e-01 1.56535e+02 102.172 -5.27269e+00 2.44455e+01  0.00000e+00 0.00000e+00 1.57549e+02 102.172 1.01309e+00 102.172 0.9798 
1 1 1 3   98  2  o 2  1.31416e+01 5.21677e-01 2.03658e+02 317.410 3.44501e+01  -3.16674e+01 0.00000e+00 0.00000e+00 2.78816e+02 317.410 7.51576e+01 317.410 0.9893 
1 1 1 3   98  3  f 0  2.35368e+00 7.24262e-01 3.59891e+01 147.457 -1.24693e+00 7.95694e-01  0.00000e+00 0.00000e+00 1.56282e+01 147.457 2.03609e+01 327.457 0.5909 
1 1 1 3   98  4  o 8  3.29175e+00 7.45912e-01 2.37457e+01 272.180 5.40054e-02  -1.41900e+00 0.00000e+00 0.00000e+00 4.65793e+01 272.180 2.28336e+01 272.180 0.5757 
1 1 1 3   98  5  o 2  8.46700e+00 6.59712e-01 1.89269e+02 91.121  -5.51670e-01 2.81916e+01  0.00000e+00 0.00000e+00 1.19250e+02 91.121  7.00191e+01 271.121 0.9821 
1 1 1 3   98  6  o 1  5.33300e+00 8.26119e-01 9.66620e+01 219.615 -6.71899e+00 -5.56146e+00 0.00000e+00 0.00000e+00 8.94476e+01 219.615 7.21447e+00 39.615  0.9408 
1 1 1 3   98  7  f 0  9.17856e+00 7.18324e-01 1.91575e+02 94.295  -2.67444e+00 3.56098e+01  0.00000e+00 0.00000e+00 1.43999e+02 94.295  4.75763e+01 274.295 0.9859 
1 1 1 3   98  8  o 18 2.87039e+00 9.32845e-01 6.37900e+01 282.972 7.71773e-01  -3.35037e+00 0.00000e+00 0.00000e+00 2.53595e+01 282.972 3.84305e+01 102.972 0.8378 
1 1 1 3   98  9  f 0  2.10085e+00 7.20392e-01 6.84363e+01 8.242   3.44821e+00  4.99490e-01  0.00000e+00 0.00000e+00 3.02118e+00 188.242 7.14575e+01 188.242 0.8403 
1 1 1 3   98  10 o 17 2.37209e+00 7.99437e-01 2.12364e+01 67.687  4.98113e-01  1.21372e+00  0.00000e+00 0.00000e+00 2.67439e+01 67.687  5.50745e+00 67.687  0.5461 
1 1 1 3   98  11 o 13 3.88782e+00 1.11297e+00 4.02306e+01 230.797 -2.11803e+00 -2.59673e+00 0.00000e+00 0.00000e+00 7.96495e+01 230.797 3.94188e+01 230.797 0.8329 
1 1 1 3   98  12 f 0  3.36015e+00 1.05724e+00 3.40494e+01 2.763   3.02295e+00  1.45893e-01  0.00000e+00 0.00000e+00 6.68893e+01 2.763   3.28399e+01 2.763   0.8119 
1 1 1 3   99  0  o 17 2.86529e+00 7.76979e-01 3.25887e+01 103.180 -3.64333e-01 1.55584e+00  0.00000e+00 0.00000e+00 3.32536e+01 103.180 6.64906e-01 103.180 0.6194 
1 1 1 3   99  1  o 12 5.70974e+00 7.16368e-01 8.53901e+01 329.274 7.37765e+00  -4.38498e+00 0.00000e+00 0.00000e+00 1.13694e+02 329.274 2.83038e+01 329.274 0.9398 
1 1 1 3   99  2  o 16 8.98025e+00 5.84396e-01 2.03867e+02 63.452  1.55808e+01  3.11848e+01  0.00000e+00 0.00000e+00 1.24505e+02 63.452  7.93626e+01 243.452 0.9856 
1 1 1 3   99  3  o 7  1.44231e+01 5.25401e-01 2.54932e+02 156.218 -6.75718e+01 2.97768e+01  0.00000e+00 0.00000e+00 2.76543e+02 156.218 2.16109e+01 156.218 0.9932 
1 1 1 3   99  4  o 5  8.74086e+00 6.36230e-01 1.75950e+02 301.305 1.50159e+01  -2.46924e+01 0.00000e+00 0.00000e+00 1.42653e+02 301.305 3.32967e+01 121.305 0.9825 
1 1 1 3   99  5  o 5  4.49968e+00 9.01183e-01 8.38916e+01 38.818  4.94996e+00  3.98245e+00  0.00000e+00 0.00000e+00 6.92433e+01 38.818  1.46484e+01 218.818 0.9175 
1 1 1 3   99  6  o 14 5.29166e+00 8.94165e-01 1.00409e+02 290.907 3.32691e+00  -8.70927e+00 0.00000e+00 0.00000e+00 8.49819e+01 290.907 1.54274e+01 110.907 0.9447 
1 1 1 3   99  7  o 16 6.50552e+00 8.71661e-01 1.33004e+02 189.939 -1.64390e+01 -2.88071e+00 0.00000e+00 0.00000e+00 1.00838e+02 189.939 3.21658e+01 9.939   0.9696 
1 1 1 3   99  8  o 18 4.14268e+00 1.12464e+00 9.47131e+01 96.637  -7.89440e-01 6.78487e+00  0.00000e+00 0.00000e+00 4.70875e+01 96.637  4.76256e+01 276.637 0.9236 
1 1 1 3   99  9  f 0  2.84503e+00 8.90592e-01 8.14959e+00 208.869 -4.66505e-01 -2.57194e-01 0.00000e+00 0.00000e+00 1.89725e+01 208.869 1.08229e+01 208.869 0.2573 
1 1 1 3   99  10 o 3  7.11830e+00 1.09986e+00 1.31484e+02 100.482 -3.41562e+00 1.84609e+01  0.00000e+00 0.00000e+00 1.24983e+02 100.482 6.50045e+00 280.482 0.9730 
1 1 1 3   99  11 o 16 3.91623e+00 9.44330e-01 5.88580e+01 224.254 -4.41439e+00 -4.30089e+00 0.00000e+00 0.00000e+00 7.37358e+01 224.254 1.48778e+01 224.254 0.9148 
1 1 1 3   99  12 o 3  4.49050e+00 1.24442e+00 5.36954e+01 282.072 1.04876e+00  -4.90389e+00 0.00000e+00 0.00000e+00 9.47492e+01 282.072 4.10538e+01 282.072 0.8937 
1 1 1 3   100 0  o 11 9.23760e+00 5.59564e-01 1.73501e+02 149.147 -2.64298e+01 1.57882e+01  0.00000e+00 0.00000e+00 1.63488e+02 149.147 1.00124e+01 329.147 0.9836 
1 1 1 3   100 1  o 17 3.35539e+00 8.10351e-01 1.02623e+02 33.055  4.66942e+00  3.03872e+00  0.00000e+00 0.00000e+00 1.00249e+01 33.055  9.25984e+01 213.055 0.9051 
1 1 1 3   100 2  o 19 3.27029e+00 8.14757e-01 2.86701e+01 190.844 -1.61454e+00 -3.09280e-01 0.00000e+00 0.00000e+00 4.77187e+01 190.844 1.90485e+01 190.844 0.6297 
1 1 1 3   100 3  o 17 8.34232e+00 6.06220e-01 1.40752e+02 177.463 -2.23500e+01 9.90302e-01  0.00000e+00 0.00000e+00 1.61675e+02 177.463 2.09234e+01 177.463 0.9774 
1 1 1 3   100 4  o 1  1.51013e+01 5.50219e-01 2.79990e+02 342.337 8.21099e+01  -2.61458e+01 0.00000e+00 0.00000e+00 2.76817e+02 342.337 3.17354e+00 162.337 0.9942 
1 1 1 3   100 5  o 5  1.02538e+01 6.34605e-01 2.26474e+02 134.560 -3.01836e+01 3.06504e+01  0.00000e+00 0.00000e+00 1.49308e+02 134.560 7.71660e+01 314.560 0.9883 
1 1 1 3   100 6  o 18 2.90014e+00 8.56574e-01 1.75344e+01 127.676 -5.73359e-01 7.42482e-01  0.00000e+00 0.00000e+00 2.80562e+01 127.676 1.05218e+01 127.676 0.4240 
1 1 1 3   100 7  o 8  1.41449e+01 6.31480e-01 1.82917e+02 67.034  2.29027e+01  5.40444e+01  0.00000e+00 0.00000e+00 3.36857e+02 67.034  1.53940e+02 67.034  0.9914 
1 1 1 3   100 8  o 4  4.68746e+00 1.14305e+00 7.63535e+01 160.147 -5.70177e+00 2.05869e+00  0.00000e+00 0.00000e+00 8.22658e+01 160.147 5.91231e+00 160.147 0.9133 
1 1 1 3   100 9  o 17 9.21262e+00 8.86887e-01 1.40498e+02 329.084 2.73847e+01  -1.63995e+01 0.00000e+00 0.00000e+00 1.95314e+02 329.084 5.48159e+01 329.084 0.9842 
1 1 1 3   100 10 o 14 7.83195e+00 1.03452e+00 1.49324e+02 186.642 -2.57017e+01 -2.99270e+00 0.00000e+00 0.00000e+00 1.34949e+02 186.642 1.43749e+01 6.642   0.9805 
1 1 1 3   100 11 o 19 2.46842e+00 8.37021e-01 6.75147e+01 314.230 3.34028e+00  -3.43131e+00 0.00000e+00 0.00000e+00 1.36095e+01 314.230 5.39052e+01 134.230 0.8882 
1 1 1 3   100 12 o 11 4.86984e+00 1.24224e+00 8.53102e+01 315.266 6.69272e+00  -6.63093e+00 0.00000e+00 0.00000e+00 8.49251e+01 315.266 3.85099e-01 135.266 0.9453 
1 1 1 3   101 0  o 16 5.50956e+00 7.52438e-01 1.28029e+02 206.766 -1.13874e+01 -5.74368e+00 0.00000e+00 0.00000e+00 6.80712e+01 206.766 5.99576e+01 26.766  0.9600 
1 1 1 3   101 1  o 10 7.94874e+00 5.80558e-01 1.48566e+02 214.924 -1.99791e+01 -1.39498e+01 0.00000e+00 0.00000e+00 1.40066e+02 214.924 8.49977e+00 34.924  0.9793 
1 1 1 3   101 2  o 11 5.45551e+00 7.60035e-01 7.76438e+01 15.919  7.21867e+00  2.05889e+00  0.00000e+00 0.00000e+00 1.10655e+02 15.919  3.30108e+01 15.919  0.9308 
1 1 1 3   101 3  o 8  9.01286e+00 6.13039e-01 1.90520e+02 346.593 2.98966e+01  -7.12601e+00 0.00000e+00 0.00000e+00 1.38199e+02 346.593 5.23202e+01 166.593 0.9836 
1 1 1 3   101 4  o 10 9.40503e+00 6.19291e-01 1.86676e+02 200.852 -3.38532e+01 -1.28946e+01 0.00000e+00 0.00000e+00 1.57189e+02 200.852 2.94866e+01 20.852  0.9861 
1 1 1 3   101 5  o 18 4.73510e+00 9.09786e-01 1.35659e+02 58.868  5.86495e+00  9.71025e+00  0.00000e+00 0.00000e+00 3.19530e+01 58.868  1.03706e+02 238.868 0.9549 
1 1 1 3   101 6  o 12 2.42425e+00 7.84941e-01 2.98499e+01 61.441  7.03781e-01  1.29301e+00  0.00000e+00 0.00000e+00 2.30874e+01 61.441  6.76253e+00 241.441 0.5892 
1 1 1 3   101 7  o 6  3.96428e+00 9.46665e-01 4.21688e+01 213.789 -2.77149e+00 -1.85457e+00 0.00000e+00 0.00000e+00 8.00406e+01 213.789 3.78717e+01 213.789 0.8320 
1 1 1 3   101 8  f 0  5.29372e+00 1.16013e+00 6.51704e+01 116.540 -2.72605e+00 5.45806e+00  0.00000e+00 0.00000e+00 1.14030e+02 116.540 4.88595e+01 116.540 0.9139 
1 1 1 3   101 9  o 18 5.92399e+00 1.03174e+00 1.04935e+02 329.117 1.15324e+01  -6.89730e+00 0.00000e+00 0.00000e+00 1.06080e+02 329.117 1.14570e+00 329.117 0.9620 
1 1 1 3   101 10 o 17 4.58300e+00 1.15947e+00 5.89151e+01 255.392 -1.45213e+00 -5.57160e+00 0.00000e+00 0.00000e+00 9.51639e+01 255.392 3.62488e+01 255.392 0.9084 
1 1 1 3   101 11 o 18 5.72965e+00 1.22160e+00 8.03571e+01 80.286  1.64436e+00  9.60622e+00  0.00000e+00 0.00000e+00 1.20394e+02 80.286  4.00369e+01 80.286  0.9472 
1 1 1 3   101 12 f 0  4.54874e+00 1.22370e+00 8.96266e+01 241.494 -4.68043e+00 -8.61823e+00 0.00000e+00 0.00000e+00 6.97133e+01 241.494 1.99133e+01 61.494  0.9476 
1 1 1 3   102 0  o 5  7.00822e+00 6.62779e-01 1.34351e+02 288.937 5.81005e+00  -1.69343e+01 0.00000e+00 0.00000e+00 1.18060e+02 288.937 1.62907e+01 108.937 0.9717 
1 1 1 3   102 1  o 9  3.08961e+00 8.12089e-01 4.86752e+01 131.339 -1.75094e+00 1.99036e+00  0.00000e+00 0.00000e+00 4.07133e+01 131.339 7.96187e+00 311.338 0.7805 
1 1 1 3   102 2  o 7  2.19029e+00 6.95926e-01 5.56066e+01 243.478 -1.03704e+00 -2.07796e+00 0.00000e+00 0.00000e+00 4.82132e+00 243.478 5.07852e+01 63.478  0.7442 
1 1 1 3   102 3  o 9  1.11851e+01 5.59925e-01 1.97361e+02 90.443  -3.62020e-01 4.68326e+01  0.00000e+00 0.00000e+00 2.12824e+02 90.443  1.54631e+01 90.443  0.9893 
1 1 1 3   102 4  o 1  1.23140e+01 5.77816e-01 2.01459e+02 169.860 -4.94030e+01 8.83565e+00  0.00000e+00 0.00000e+00 2.50412e+02 169.860 4.89532e+01 169.860 0.9900 
1 1 1 3   102 5  o 14 6.59605e+00 8.10195e-01 1.11989e+02 305.655 8.30022e+00  -1.15700e+01 0.00000e+00 0.00000e+00 1.23721e+02 305.655 1.17326e+01 305.655 0.9642 
1 1 1 3   102 6  o 3  5.10957e+00 8.65079e-01 8.25152e+01 93.796  -5.80660e-01 8.75089e+00  0.00000e+00 0.00000e+00 9.56655e+01 93.796  1.31503e+01 93.796  0.9411 
1 1 1 3   102 7  o 4  4.16878e+00 9.89618e-01 1.07490e+02 323.198 6.90789e+00  -5.16814e+00 0.00000e+00 0.00000e+00 3.76873e+01 323.198 6.98023e+01 143.198 0.9401 
1 1 1 3   102 8  o 18 4.44260e+00 1.01942e+00 1.25133e+02 126.383 -7.02326e+00 9.53221e+00  0.00000e+00 0.00000e+00 3.22702e+01 126.383 9.28625e+01 306.382 0.9568 
1 1 1 3   102 9  o 13 4.93610e+00 1.10105e+00 6.71006e+01 323.685 5.34958e+00  -3.93179e+00 0.00000e+00 0.00000e+00 1.01227e+02 323.685 3.41259e+01 323.685 0.9213 
1 1 1 3   102 10 o 7  3.57745e+00 1.01298e+00 4.84870e+01 137.095 -3.26190e+00 3.03162e+00  0.00000e+00 0.00000e+00 6.78499e+01 137.095 1.93629e+01 137.095 0.8789 
1 1 1 3   102 11 o 4  2.79406e+00 9.03304e-01 6.40198e+01 19.632  4.99818e+00  1.78295e+00  0.00000e+00 0.00000e+00 2.89747e+01 19.632  3.50451e+01 199.632 0.9000 
1 1 1 3   102 12 o 9  3.58593e+00 1.10795e+00 9.38104e+01 210.362 -7.84302e+00 -4.59457e+00 0.00000e+00 0.00000e+00 3.12001e+01 210.362 6.26103e+01 30.362  0.9433 
1 1 1 3   103 0  o 5  6.72091e+00 7.10140e-01 4.95466e+01 22.993  5.79457e+00  2.45884e+00  0.00000e+00 0.00000e+00 1.78763e+02 22.993  1.29217e+02 22.993  0.9167 
1 1 1 3   103 1  o 17 3.11760e+00 8.37817e-01 9.81904e+01 166.672 -5.19007e+00 1.22959e+00  0.00000e+00 0.00000e+00 5.86165e+00 166.672 9.23287e+01 346.672 0.9006 
1 1 1 3   103 2  o 10 3.42933e+00 8.62795e-01 6.47356e+01 191.070 -3.94914e+00 -7.72655e-01 0.00000e+00 0.00000e+00 4.51297e+01 191.070 1.96059e+01 11.070  0.8644 
1 1 1 3   103 3  o 9  5.92727e+00 7.44322e-01 2.77909e+01 19.631  2.90153e+00  1.03497e+00  0.00000e+00 0.00000e+00 1.51404e+02 19.631  1.23613e+02 19.631  0.8158 
1 1 1 3   103 4  f 0  9.35462e+00 6.39819e-01 8.41057e+01 130.407 -1.05950e+01 1.24460e+01  0.00000e+00 0.00000e+00 2.51765e+02 130.407 1.67660e+02 130.407 0.9689 
1 1 1 3   103 5  o 10 6.22457e+00 8.46149e-01 8.11812e+01 32.720  8.32407e+00  5.34808e+00  0.00000e+00 0.00000e+00 1.37458e+02 32.720  5.62772e+01 32.720  0.9480 
1 1 1 3   103 6  o 2  2.44536e+00 7.82587e-01 6.69285e+01 66.255  1.46903e+00  3.33945e+00  0.00000e+00 0.00000e+00 9.93004e+00 66.255  5.69984e+01 246.255 0.8485 
1 1 1 3   103 7  o 15 3.21935e+00 9.10187e-01 6.86894e+01 131.844 -3.14078e+00 3.50735e+00  0.00000e+00 0.00000e+00 3.69569e+01 131.844 3.17325e+01 311.844 0.8861 
1 1 1 3   103 8  o 10 3.02031e+00 8.94220e-01 6.57216e+01 81.975  6.78410e-01  4.81201e+00  0.00000e+00 0.00000e+00 3.37935e+01 81.975  3.19281e+01 261.975 0.8900 
1 1 1 3   103 9  o 10 3.79631e+00 1.04254e+00 1.01331e+02 331.527 7.43181e+00  -4.03053e+00 0.00000e+00 0.00000e+00 3.05624e+01 331.527 7.07683e+01 151.527 0.9389 
1 1 1 3   103 10 o 3  2.19152e+00 7.46547e-01 3.25456e+01 325.135 2.00350e+00  -1.39586e+00 0.00000e+00 0.00000e+00 2.89400e+01 325.135 3.60556e+00 145.135 0.7585 
1 1 1 3   103 11 o 6  4.27557e+00 1.12546e+00 6.79023e+01 60.799  3.30038e+00  5.90510e+00  0.00000e+00 0.00000e+00 7.79597e+01 60.799  1.00573e+01 60.799  0.9228 
1 1 1 3   104 0  o 2  8.31773e+00 6.38307e-01 1.54364e+02 232.773 -1.43749e+01 -1.89196e+01 0.00000e+00 0.00000e+00 1.47220e+02 232.773 7.14351e+00 52.773  0.9787 
1 1 1 3   104 1  o 6  8.03890e+00 6.02349e-01 1.13398e+02 268.662 -3.99448e-01 -1.71046e+01 0.00000e+00 0.00000e+00 1.75599e+02 268.662 6.22004e+01 268.662 0.9703 
1 1 1 3   104 2  o 8  3.09679e+00 8.47397e-01 8.57063e+01 130.875 -3.13357e+00 3.62072e+00  0.00000e+00 0.00000e+00 1.62073e+01 130.875 6.94989e+01 310.875 0.8882 
1 1 1 3   104 3  o 13 1.24658e+01 5.53075e-01 1.62933e+02 69.833  1.51618e+01  4.12816e+01  0.00000e+00 0.00000e+00 2.93635e+02 69.833  1.30702e+02 69.833  0.9886 
1 1 1 3   104 4  o 7  4.18474e+00 9.21763e-01 8.67302e+01 280.637 1.26127e+00  -6.71579e+00 0.00000e+00 0.00000e+00 5.64562e+01 280.637 3.02740e+01 100.637 0.9236 
1 1 1 3   104 5  o 3  4.47742e+00 9.28972e-01 7.35552e+01 30.760  5.36686e+00  3.19424e+00  0.00000e+00 0.00000e+00 7.83602e+01 30.760  4.80508e+00 30.760  0.9160 
1 1 1 3   104 6  o 11 2.71126e+00 8.17926e-01 3.36842e+01 315.764 1.41689e+00  -1.37958e+00 0.00000e+00 0.00000e+00 3.60018e+01 315.764 2.31762e+00 315.764 0.6941 
1 1 1 3   104 7  f 0  2.74767e+00 8.68860e-01 1.01063e+02 66.465  2.59070e+00  5.94814e+00  0.00000e+00 0.00000e+00 7.54556e+00 246.465 1.08609e+02 246.465 0.9193 
1 1 1 3   104 8  o 19 4.42581e+00 9.29357e-01 7.05159e+01 332.789 6.45580e+00  -3.31934e+00 0.00000e+00 0.00000e+00 8.15396e+01 332.789 1.10237e+01 332.789 0.9283 
1 1 1 3   104 9  o 13 3.14165e+00 9.49128e-01 9.93672e+01 240.605 -3.96045e+00 -7.03012e+00 0.00000e+00 0.00000e+00 9.39690e+00 240.605 8.99703e+01 60.605  0.9358 
1 1 1 3   104 10 o 5  3.72743e+00 1.06491e+00 5.59125e+01 336.165 4.64927e+00  -2.05395e+00 0.00000e+00 0.00000e+00 6.74839e+01 336.165 1.15715e+01 336.165 0.8953 
1 1 1 3   104 11 o 5  2.54945e+00 8.49237e-01 1.49840e+01 197.150 -1.28559e+00 -3.96719e-01 0.00000e+00 0.00000e+00 3.73602e+01 197.150 2.23762e+01 197.150 0.5555 
1 1 1 3   105 0  o 18 7.66885e+00 6.26986e-01 1.31026e+02 81.535  2.98808e+00  2.00764e+01  0.00000e+00 0.00000e+00 1.45906e+02 81.535  1.48795e+01 81.535  0.9750 
1 1 1 3   105 1  o 19 2.90049e+00 7.85745e-01 4.34037e+01 334.463 2.15269e+00  -1.02847e+00 0.00000e+00 0.00000e+00 3.73818e+01 334.463 6.02188e+00 154.463 0.7520 
1 1 1 3   105 2  o 9  9.29312e+00 5.92077e-01 1.38744e+02 101.094 -5.27041e+00 2.68783e+01  0.00000e+00 0.00000e+00 1.99129e+02 101.094 6.03849e+01 101.094 0.9816 
1 1 1 3   105 3  o 1  1.12256e+01 5.88029e-01 1.95334e+02 297.115 2.28405e+01  -4.46063e+01 0.00000e+00 0.00000e+00 2.16278e+02 297.115 2.09437e+01 297.115 0.9900 
1 1 1 3   105 4  o 2  6.07760e+00 8.06479e-01 1.40509e+02 86.689  1.06708e+00  1.84444e+01  0.00000e+00 0.00000e+00 7.83974e+01 86.689  6.21118e+01 266.689 0.9725 
1 1 1 3   105 5  o 12 4.32663e+00 9.82764e-01 4.13766e+01 266.247 -2.27644e-01 -3.47086e+00 0.00000e+00 0.00000e+00 9.31965e+01 266.247 5.18199e+01 266.247 0.8400 
1 1 1 3   105 6  o 11 3.46665e+00 9.34784e-01 3.39918e+01 167.119 -2.40300e+00 5.49535e-01  0.00000e+00 0.00000e+00 6.36935e+01 167.119 2.97017e+01 167.119 0.7611 
1 1 1 3   105 7  o 11 5.89346e+00 9.50042e-01 6.14323e+01 93.948  -5.83896e-01 8.46074e+00  0.00000e+00 0.00000e+00 1.43398e+02 93.948  8.19656e+01 93.948  0.9390 
1 1 1 3   105 8  o 3  2.57244e+00 8.28819e-01 3.00190e+01 42.782  1.40834e+00  1.30331e+00  0.00000e+00 0.00000e+00 3.50813e+01 42.782  5.06222e+00 42.782  0.6840 
1 1 1 3   105 9  o 17 6.79916e+00 1.05803e+00 7.46311e+01 306.900 7.48937e+00  -9.97488e+00 0.00000e+00 0.00000e+00 1.66530e+02 306.900 9.18984e+01 306.900 0.9590 
1 1 1 3   105 10 o 14 2.02085e+00 7.03121e-01 1.94335e+01 311.094 9.82343e-01  -1.12633e+00 0.00000e+00 0.00000e+00 2.49995e+01 311.094 5.56609e+00 311.094 0.5948 
1 1 1 3   105 11 o 2  3.53325e+00 1.04232e+00 3.02210e+01 142.693 -2.44272e+00 1.86129e+00  0.00000e+00 0.00000e+00 7.61875e+01 142.693 4.59665e+01 142.693 0.8151 
1 1 1 3   106 0  o 11 5.53312e+00 7.65063e-01 1.21764e+02 198.813 -1.26154e+01 -4.29787e+00 0.00000e+00 0.00000e+00 7.52564e+01 198.813 4.65071e+01 18.813  0.9617 
1 1 1 3   106 1  o 18 2.92864e+00 8.24893e-01 4.01709e+01 282.045 4.68797e-01  -2.19704e+00 0.00000e+00 0.00000e+00 3.94659e+01 282.045 7.05021e-01 102.045 0.7344 
1 1 1 3   106 2  o 15 3.29269e+00 8.09075e-01 5.64836e+01 114.619 -1.56429e+00 3.41367e+00  0.00000e+00 0.00000e+00 4.75668e+01 114.619 8.91679e+00 294.619 0.8534 
1 1 1 3   106 3  f 0  3.30097e+00 8.50086e-01 3.95043e+01 21.034  2.56055e+00  9.84644e-01  0.00000e+00 0.00000e+00 5.69416e+01 21.034  1.74373e+01 21.034  0.7891 
1 1 1 3   106 4  o 18 1.26176e+01 5.89976e-01 2.09553e+02 248.490 -2.21896e+01 -5.63018e+01 0.00000e+00 0.00000e+00 2.53733e+02 248.490 4.41803e+01 248.490 0.9917 
1 1 1 3   106 5  o 5  3.28728e+00 9.06395e-01 7.95534e+01 104.337 -1.29467e+00 5.06542e+00  0.00000e+00 0.00000e+00 2.97765e+01 104.337 4.97769e+01 284.337 0.8984 
1 1 1 3   106 6  o 19 8.81607e+00 7.71161e-01 1.50609e+02 12.350  3.25601e+01  7.12927e+00  0.00000e+00 0.00000e+00 1.70749e+02 12.350  2.01398e+01 12.350  0.9849 
1 1 1 3   106 7  o 5  2.77814e+00 8.61883e-01 5.88719e+01 287.964 1.25146e+00  -3.85973e+00 0.00000e+00 0.00000e+00 3.01160e+01 287.964 2.87558e+01 107.964 0.8657 
1 1 1 3   106 8  o 3  2.07816e+00 7.18049e-01 3.04709e+01 110.379 -7.23287e-01 1.94709e+00  0.00000e+00 0.00000e+00 2.41077e+01 110.379 6.36316e+00 290.379 0.7100 
1 1 1 3   106 9  o 7  4.33596e+00 1.01329e+00 9.07328e+01 157.143 -9.56569e+00 4.03225e+00  0.00000e+00 0.00000e+00 6.16533e+01 157.143 2.90794e+01 337.143 0.9505 
1 1 1 3   106 10 o 15 3.71966e+00 1.05594e+00 5.47573e+01 309.855 3.25735e+00  -3.90196e+00 0.00000e+00 0.00000e+00 6.83115e+01 309.855 1.35542e+01 309.855 0.8953 
1 1 1 3   106 11 o 19 3.03780e+00 9.73524e-01 5.56791e+01 302.456 2.94834e+00  -4.63584e+00 0.00000e+00 0.00000e+00 4.57235e+01 302.456 9.95556e+00 122.456 0.9037 
1 1 1 3   107 0  o 2  5.28504e+00 8.18108e-01 1.08819e+02 59.685  5.78171e+00  9.88811e+00  0.00000e+00 0.00000e+00 7.80569e+01 59.685  3.07618e+01 239.685 0.9553 
1 1 1 3   107 1  o 1  1.54915e+01 5.52115e-01 2.16788e+02 118.302 -3.76412e+01 6.99002e+01  0.00000e+00 0.00000e+00 3.53041e+02 118.302 1.36253e+02 118.302 0.9937 
1 1 1 3   107 2  o 14 1.01672e+01 6.09441e-01 1.47608e+02 319.596 2.78139e+01  -2.36746e+01 0.00000e+00 0.00000e+00 2.23578e+02 319.596 7.59699e+01 319.596 0.9862 
1 1 1 3   107 3  o 6  1.97827e+00 6.65271e-01 6.83418e+01 176.482 -2.97120e+00 1.82667e-01  0.00000e+00 0.00000e+00 9.15329e+00 356.482 7.74951e+01 356.482 0.8083 
1 1 1 3   107 4  o 2  8.37637e+00 7.00944e-01 1.47690e+02 69.673  1.00248e+01  2.70617e+01  0.00000e+00 0.00000e+00 1.56931e+02 69.673  9.24073e+00 69.673  0.9825 
1 1 1 3   107 5  o 5  3.67491e+00 9.33228e-01 7.20506e+01 196.607 -5.30576e+00 -1.58241e+00 0.00000e+00 0.00000e+00 5.09627e+01 196.607 2.10879e+01 16.607  0.9045 
1 1 1 3   107 6  o 9  3.00636e+00 8.93928e-01 3.54066e+01 194.231 -2.53029e+00 -6.41737e-01 0.00000e+00 0.00000e+00 5.09667e+01 194.231 1.55600e+01 194.231 0.7765 
1 1 1 3   107 7  o 6  3.15854e+00 9.64310e-01 5.96283e+01 214.559 -3.47204e+00 -2.39153e+00 0.00000e+00 0.00000e+00 4.21740e+01 214.559 1.74543e+01 34.559  0.8713 
1 1 1 3   107 8  o 13 7.19555e+00 9.94063e-01 1.03876e+02 12.231  1.73752e+01  3.76636e+00  0.00000e+00 0.00000e+00 1.54601e+02 12.231  5.07249e+01 12.231  0.9715 
1 1 1 3   107 9  o 18 3.78014e+00 1.04275e+00 4.86227e+01 315.426 3.26092e+00  -3.21274e+00 0.00000e+00 0.00000e+00 7.46934e+01 315.426 2.60707e+01 315.426 0.8826 
1 1 1 3   107 10 o 5  5.27639e+00 1.19869e+00 8.11358e+01 192.358 -9.92509e+00 -2.17460e+00 0.00000e+00 0.00000e+00 1.03947e+02 192.358 2.28112e+01 192.358 0.9494 
1 1 1 3   108 0  o 18 1.10721e+01 6.05950e-01 1.90969e+02 113.485 -1.93419e+01 4.45145e+01  0.00000e+00 0.00000e+00 2.14487e+02 113.485 2.35178e+01 113.485 0.9896 
1 1 1 3   108 1  o 5  6.89830e+00 7.94638e-01 9.24259e+01 340.933 1.24222e+01  -4.29351e+00 0.00000e+00 0.00000e+00 1.52943e+02 340.933 6.05169e+01 340.933 0.9612 
1 1 1 3   108 2  o 9  3.55254e+00 8.72895e-01 4.50503e+01 147.911 -2.84652e+00 1.78488e+00  0.00000e+00 0.00000e+00 6.45213e+01 147.911 1.94710e+01 147.911 0.8334 
1 1 1 3   108 3  o 15 4.43204e+00 8.87239e-01 5.28953e+01 23.151  4.46093e+00  1.90741e+00  0.00000e+00 0.00000e+00 9.30475e+01 23.151  4.01522e+01 23.151  0.8898 
1 1 1 3   108 4  o 6  7.05308e+00 7.67652e-01 1.33026e+02 178.016 -2.06918e+01 7.16762e-01  0.00000e+00 0.00000e+00 1.21575e+02 178.016 1.14510e+01 358.016 0.9755 
1 1 1 3   108 5  o 2  8.42053e+00 8.22326e-01 1.79150e+02 331.056 3.28158e+01  -1.81480e+01 0.00000e+00 0.00000e+00 1.28202e+02 331.056 5.09479e+01 151.056 0.9866 
1 1 1 3   108 6  o 3  9.37752e+00 7.99645e-01 1.60518e+02 294.842 1.64675e+01  -3.55703e+01 0.00000e+00 0.00000e+00 1.81895e+02 294.842 2.13764e+01 294.842 0.9872 
1 1 1 3   108 7  o 16 3.50040e+00 9.75773e-01 5.23949e+01 22.513  3.93781e+00  1.63216e+00  0.00000e+00 0.00000e+00 6.05961e+01 22.513  8.20118e+00 22.513  0.8729 
1 1 1 3   108 8  o 1  6.36670e+00 1.06514e+00 1.05011e+02 139.856 -1.21968e+01 1.02867e+01  0.00000e+00 0.00000e+00 1.22844e+02 139.856 1.78331e+01 139.856 0.9681 
1 1 1 3   108 9  o 9  2.57818e+00 8.43612e-01 4.21387e+01 145.747 -2.96270e+00 2.01743e+00  0.00000e+00 0.00000e+00 3.84002e+01 145.747 3.73848e+00 325.747 0.8454 
1 1 1 3   108 10 o 5  4.12039e+00 1.10594e+00 8.76077e+01 351.529 9.57972e+00  -1.42669e+00 0.00000e+00 0.00000e+00 5.64932e+01 351.529 3.11145e+01 171.529 0.9469 
1 1 1 3   109 0  o 5  3.69420e+00 8.50296e-01 1.75306e+01 13.119  1.34225e+00  3.12827e-01  0.00000e+00 0.00000e+00 5.96192e+01 13.119  4.20886e+01 13.119  0.5646 
1 1 1 3   109 1  o 12 3.21442e+00 8.40462e-01 4.90256e+01 85.735  2.48745e-01  3.33525e+00  0.00000e+00 0.00000e+00 4.99799e+01 85.735  9.54290e-01 85.735  0.8325 
1 1 1 3   109 2  o 4  2.51411e+00 7.72366e-01 3.51261e+01 319.365 1.49401e+00  -1.28209e+00 0.00000e+00 0.00000e+00 2.92919e+01 319.365 5.83423e+00 139.365 0.6926 
1 1 1 3   109 3  o 3  3.04910e+00 8.56146e-01 5.65914e+01 68.822  1.29996e+00  3.35531e+00  0.00000e+00 0.00000e+00 3.88480e+01 68.822  1.77435e+01 248.822 0.8461 
1 1 1 3   109 4  o 18 9.30072e+00 6.76270e-01 1.18911e+02 328.770 2.53610e+01  -1.53772e+01 0.00000e+00 0.00000e+00 2.19288e+02 328.770 1.00377e+02 328.770 0.9830 
1 1 1 3   109 5  o 18 5.32820e+00 9.53157e-01 6.97726e+01 280.849 1.63236e+00  -8.51762e+00 0.00000e+00 0.00000e+00 1.15561e+02 280.849 4.57880e+01 280.849 0.9404 
1 1 1 3   109 6  o 13 7.57527e+00 8.43519e-01 1.05465e+02 132.793 -1.33536e+01 1.44239e+01  0.00000e+00 0.00000e+00 1.67434e+02 132.793 6.19689e+01 132.793 0.9742 
1 1 1 3   109 7  o 4  2.96255e+00 9.10924e-01 6.57885e+01 257.315 -1.09539e+00 -4.86676e+00 0.00000e+00 0.00000e+00 3.20250e+01 257.315 3.37636e+01 77.315  0.8931 
1 1 1 3   109 8  o 16 5.46045e+00 1.08573e+00 5.13310e+01 7.427   6.87821e+00  8.96642e-01  0.00000e+00 0.00000e+00 1.35290e+02 7.427   8.39594e+01 7.427   0.9248 
1 1 1 3   109 9  o 4  7.63151e+00 1.04565e+00 7.40003e+01 320.126 1.09186e+01  -9.12097e+00 0.00000e+00 0.00000e+00 1.97817e+02 320.126 1.23817e+02 320.126 0.9642 
1 1 1 3   109 10 o 9  2.71252e+00 8.65192e-01 6.70907e+01 128.904 -4.05506e+00 5.02478e+00  0.00000e+00 0.00000e+00 2.49450e+01 128.904 4.21457e+01 308.904 0.9189 
1 1 1 3   110 0  o 7  7.37800e+00 7.08562e-01 1.50259e+02 8.232   2.48581e+01  3.59628e+00  0.00000e+00 0.00000e+00 1.17098e+02 8.232   3.31610e+01 188.232 0.9799 
1 1 1 3   110 1  o 3  4.58900e+00 8.80672e-01 1.09554e+02 359.186 1.02067e+01  -1.45008e-01 0.00000e+00 0.00000e+00 5.16261e+01 359.186 5.79275e+01 179.186 0.9497 
1 1 1 3   110 2  o 7  7.98668e+00 6.77774e-01 1.48172e+02 76.026  7.11550e+00  2.85936e+01  0.00000e+00 0.00000e+00 1.42162e+02 76.026  6.00999e+00 256.026 0.9829 
1 1 1 3   110 3  o 12 4.64605e+00 8.44811e-01 9.52138e+01 302.134 5.59962e+00  -8.91493e+00 0.00000e+00 0.00000e+00 6.82398e+01 302.134 2.69740e+01 122.134 0.9513 
1 1 1 3   110 4  o 15 4.54178e+00 9.54648e-01 6.94084e+01 44.742  5.20027e+00  5.15371e+00  0.00000e+00 0.00000e+00 8.66173e+01 44.742  1.72089e+01 44.742  0.9290 
1 1 1 3   110 5  o 12 6.18667e+00 9.00766e-01 1.10479e+02 244.980 -6.87573e+00 -1.47317e+01 0.00000e+00 0.00000e+00 1.11122e+02 244.980 6.42979e-01 244.980 0.9687 
1 1 1 3   110 6  o 15 4.01709e+00 9.89274e-01 6.67358e+01 170.912 -6.08153e+00 9.72845e-01  0.00000e+00 0.00000e+00 6.91058e+01 170.912 2.37002e+00 170.912 0.9148 
1 1 1 3   110 7  o 1  3.99700e+00 1.08521e+00 3.28140e+01 324.730 2.56325e+00  -1.81284e+00 0.00000e+00 0.00000e+00 8.82829e+01 324.730 5.54689e+01 324.730 0.8198 
1 1 1 3   110 8  o 16 6.58985e+00 1.00948e+00 7.00927e+01 124.649 -6.81648e+00 9.86296e+00  0.00000e+00 0.00000e+00 1.62980e+02 124.649 9.28871e+01 124.649 0.9573 
1 1 1 3   110 9  o 19 6.09815e+00 1.07009e+00 6.42245e+01 49.236  7.06124e+00  8.19085e+00  0.00000e+00 0.00000e+00 1.50299e+02 49.236  8.60741e+01 49.236  0.9526 
1 1 1 3   111 0  o 17 6.50289e+00 7.53652e-01 1.31048e+02 336.542 1.85019e+01  -8.02871e+00 0.00000e+00 0.00000e+00 1.03323e+02 336.542 2.77250e+01 156.542 0.9749 
1 1 1 3   111 1  o 15 3.22048e+00 8.56481e-01 4.09970e+01 204.750 -2.64849e+00 -1.22096e+00 0.00000e+00 0.00000e+00 5.46893e+01 204.750 1.36924e+01 204.750 0.8036 
1 1 1 3   111 2  o 7  2.27575e+00 7.26944e-01 2.20738e+01 296.897 5.88077e-01  -1.15930e+00 0.00000e+00 0.00000e+00 2.35864e+01 296.897 1.51264e+00 296.897 0.5426 
1 1 1 3   111 3  o 11 6.26895e+00 8.25780e-01 8.60661e+01 111.914 -5.18917e+00 1.28996e+01  0.00000e+00 0.00000e+00 1.37218e+02 111.914 5.11521e+01 111.914 0.9633 
1 1 1 3   111 4  o 15 6.37341e+00 8.77605e-01 1.16478e+02 348.113 1.77948e+01  -3.74560e+00 0.00000e+00 0.00000e+00 1.12570e+02 348.113 3.90831e+00 168.113 0.9721 
1 1 1 3   111 5  o 2  6.26566e+00 8.71893e-01 1.08495e+02 165.712 -1.62272e+01 4.13264e+00  0.00000e+00 0.00000e+00 1.16082e+02 165.712 7.58787e+00 165.712 0.9697 
1 1 1 3   111 6  o 5  1.36227e+01 7.19447e-01 2.01589e+02 49.342  5.37059e+01  6.25318e+01  0.00000e+00 0.00000e+00 2.98787e+02 49.342  9.71988e+01 49.342  0.9939 
1 1 1 3   111 7  o 12 5.19141e+00 1.00957e+00 1.26659e+02 236.045 -9.02625e+00 -1.34049e+01 0.00000e+00 0.00000e+00 5.91085e+01 236.045 6.75504e+01 56.045  0.9685 
1 1 1 3   111 8  f 0  3.61150e+00 1.01150e+00 9.87732e+01 353.462 1.00506e+01  -1.15184e+00 0.00000e+00 0.00000e+00 2.78362e+01 353.462 7.09370e+01 173.462 0.9492 
1 1 1 3   111 9  o 14 3.71414e+00 1.05434e+00 3.26843e+01 348.748 3.37949e+00  -6.72368e-01 0.00000e+00 0.00000e+00 8.22525e+01 348.748 4.95681e+01 348.748 0.8382 
1 1 1 3   112 0  o 19 4.31761e+00 8.52288e-01 4.76980e+01 79.516  9.09762e-01  4.91618e+00  0.00000e+00 0.00000e+00 9.48596e+01 79.516  4.71616e+01 79.516  0.8934 
1 1 1 3   112 1  o 5  3.57683e+00 7.59243e-01 6.13601e+01 310.758 3.89283e+00  -4.51650e+00 0.00000e+00 0.00000e+00 5.91819e+01 310.758 2.17814e+00 130.758 0.9118 
1 1 1 3   112 2  o 16 2.39600e+00 7.68665e-01 8.58226e+01 36.325  4.48202e+00  3.29543e+00  0.00000e+00 0.00000e+00 5.67432e+00 216.325 9.14969e+01 216.325 0.9050 
1 1 1 3   112 3  f 0  3.27444e+00 9.05837e-01 1.72179e+01 68.900  4.86179e-01  1.25998e+00  0.00000e+00 0.00000e+00 5.01893e+01 68.900  3.29713e+01 68.900  0.5570 
1 1 1 3   112 4  o 11 3.60817e+00 9.25004e-01 6.86650e+01 279.107 9.05329e-01  -5.64740e+00 0.00000e+00 0.00000e+00 5.23872e+01 279.107 1.62777e+01 99.108  0.9078 
1 1 1 3   112 5  o 4  2.75206e+00 8.27112e-01 5.23099e+01 120.477 -2.17116e+00 3.68927e+00  0.00000e+00 0.00000e+00 3.65221e+01 120.477 1.57877e+01 300.477 0.8735 
1 1 1 3   112 6  o 3  2.42198e+00 7.92669e-01 4.33474e+01 350.667 3.18493e+00  -5.23445e-01 0.00000e+00 0.00000e+00 3.05175e+01 350.667 1.28299e+01 170.667 0.8255 
1 1 1 3   112 7  o 14 3.52123e+00 9.81850e-01 9.57355e+01 230.822 -5.68221e+00 -6.97266e+00 0.00000e+00 0.00000e+00 2.68608e+01 230.822 6.88748e+01 50.822  0.9427 
1 1 1 3   112 8  o 13 2.59777e+00 8.53244e-01 3.12946e+01 124.270 -1.48216e+00 2.17522e+00  0.00000e+00 0.00000e+00 4.33885e+01 124.270 1.20939e+01 124.270 0.7786 
1 1 1 3   112 9  o 19 2.83888e+00 9.18263e-01 3.79793e+01 39.512  2.88227e+00  2.37693e+00  0.00000e+00 0.00000e+00 5.13458e+01 39.512  1.33666e+01 39.512  0.8525 
1 1 1 3   113 0  o 19 3.56928e+00 7.71963e-01 6.30592e+01 206.996 -4.90711e+00 -2.49983e+00 0.00000e+00 0.00000e+00 5.61485e+01 206.996 6.91073e+00 26.996  0.9040 
1 1 1 3   113 1  o 17 3.69162e+00 9.11835e-01 1.14870e+02 61.916  4.40988e+00  8.26443e+00  0.00000e+00 0.00000e+00 1.40353e+01 61.916  1.00835e+02 241.916 0.9450 
1 1 1 3   113 2  o 5  7.77998e+00 7.19682e-01 1.31105e+02 267.247 -1.33870e+00 -2.78438e+01 0.00000e+00 0.00000e+00 1.51172e+02 267.247 2.00673e+01 267.247 0.9819 
1 1 1 3   113 3  o 18 3.58797e+00 9.31618e-01 4.77584e+01 217.038 -3.14179e+00 -2.37080e+00 0.00000e+00 0.00000e+00 6.63914e+01 217.038 1.86330e+01 217.038 0.8610 
1 1 1 3   113 4  o 8  2.75500e+00 8.17361e-01 9.67047e+01 344.528 6.79235e+00  -1.88014e+00 0.00000e+00 0.00000e+00 2.44246e+00 164.528 9.91472e+01 164.528 0.9261 
1 1 1 3   113 5  o 19 6.84399e+00 8.56518e-01 9.31230e+01 112.000 -6.54275e+00 1.61941e+01  0.00000e+00 0.00000e+00 1.52353e+02 112.000 5.92305e+01 112.000 0.9709 
1 1 1 3   113 6  o 11 7.12078e+00 9.24371e-01 9.23855e+01 334.791 1.58031e+01  -7.43939e+00 0.00000e+00 0.00000e+00 1.62964e+02 334.791 7.05787e+01 334.791 0.9709 
1 1 1 3   113 7  o 4  5.46234e+00 1.05426e+00 9.56035e+01 220.474 -1.01372e+01 -8.64990e+00 0.00000e+00 0.00000e+00 9.83607e+01 220.474 2.75717e+00 220.474 0.9617 
1 1 1 3   113 8  o 13 3.20265e+00 9.25552e-01 3.95435e+01 3.207   4.25562e+00  2.38427e-01  0.00000e+00 0.00000e+00 6.36433e+01 3.207   2.40997e+01 3.207   0.8729 
1 1 1 3   114 0  o 15 2.09826e+00 6.93166e-01 2.00278e+01 93.051  -6.21698e-02 1.16621e+00  0.00000e+00 0.00000e+00 1.89327e+01 93.051  1.09510e+00 273.051 0.5027 
1 1 1 3   114 1  o 7  3.29365e+00 8.89592e-01 8.00023e+01 284.312 1.60459e+00  -6.28961e+00 0.00000e+00 0.00000e+00 3.18517e+01 284.312 4.81505e+01 104.312 0.9194 
1 1 1 3   114 2  o 12 7.73544e+00 7.28410e-01 1.42661e+02 353.117 2.93199e+01  -3.53932e+00 0.00000e+00 0.00000e+00 1.38205e+02 353.117 4.45562e+00 173.117 0.9829 
1 1 1 3   114 3  o 3  4.52088e+00 8.79980e-01 8.07760e+01 115.506 -3.95486e+00 8.28941e+00  0.00000e+00 0.00000e+00 7.68476e+01 115.506 3.92841e+00 295.506 0.9439 
1 1 1 3   114 4  o 3  3.46308e+00 9.32613e-01 4.14721e+01 81.791  5.14728e-01  3.56816e+00  0.00000e+00 0.00000e+00 6.67921e+01 81.791  2.53200e+01 81.791  0.8464 
1 1 1 3   114 5  o 19 3.32730e+00 9.33334e-01 5.77556e+01 296.403 2.44293e+00  -4.92063e+00 0.00000e+00 0.00000e+00 5.32871e+01 296.403 4.46848e+00 116.403 0.9037 
1 1 1 3   114 6  o 7  6.06990e+00 9.55890e-01 7.13113e+01 231.477 -7.37216e+00 -9.26051e+00 0.00000e+00 0.00000e+00 1.43113e+02 231.477 7.18016e+01 231.477 0.9568 
1 1 1 3   114 7  o 17 3.73744e+00 1.01534e+00 9.36112e+01 58.979  4.94621e+00  8.22499e+00  0.00000e+00 0.00000e+00 3.69453e+01 58.979  5.66659e+01 238.979 0.9464 
1 1 1 3   114 8  o 2  3.34529e+00 9.72372e-01 3.36400e+01 207.399 -3.14267e+00 -1.62897e+00 0.00000e+00 0.00000e+00 7.04372e+01 207.399 3.67972e+01 207.399 0.8432 
1 1 1 3   115 0  o 8  2.43650e+00 7.70953e-01 4.54926e+01 341.883 2.80241e+00  -9.16865e-01 0.00000e+00 0.00000e+00 2.70293e+01 341.883 1.84633e+01 161.883 0.8061 
1 1 1 3   115 1  o 6  6.59115e+00 8.00482e-01 1.04469e+02 330.348 1.60650e+01  -9.14561e+00 0.00000e+00 0.00000e+00 1.32246e+02 330.348 2.77770e+01 330.348 0.9726 
1 1 1 3   115 2  o 10 2.35550e+00 7.42228e-01 2.91981e+01 151.587 -1.94128e+00 1.05020e+00  0.00000e+00 0.00000e+00 3.42153e+01 151.587 5.01723e+00 151.587 0.7290 
1 1 1 3   115 3  o 8  4.33651e+00 8.37038e-01 5.77421e+01 90.244  -2.90988e-02 6.82053e+00  0.00000e+00 0.00000e+00 9.01378e+01 90.244  3.23957e+01 90.244  0.9235 
1 1 1 3   115 4  o 19 2.00870e+00 6.80091e-01 6.87418e+01 311.239 3.08704e+00  -3.52150e+00 0.00000e+00 0.00000e+00 3.06757e+00 131.239 7.18094e+01 131.239 0.8855 
1 1 1 3   115 5  o 4  4.60163e+00 1.00519e+00 8.74355e+01 47.227  7.31776e+00  7.90984e+00  0.00000e+00 0.00000e+00 7.43618e+01 47.227  1.30738e+01 227.227 0.9524 
1 1 1 3   115 6  o 13 2.88809e+00 9.00575e-01 5.81589e+01 65.951  2.18409e+00  4.89437e+00  0.00000e+00 0.00000e+00 3.78982e+01 65.951  2.02607e+01 245.951 0.9011 
1 1 1 3   115 7  o 9  2.94180e+00 8.86182e-01 5.11270e+01 276.035 5.57134e-01  -5.27005e+00 0.00000e+00 0.00000e+00 4.65583e+01 276.035 4.56867e+00 96.035  0.8999 
1 1 1 3   115 8  o 19 2.09506e+00 7.20685e-01 2.20898e+01 254.396 -5.48359e-01 -1.96345e+00 0.00000e+00 0.00000e+00 3.23170e+01 254.396 1.02272e+01 254.396 0.7040 
1 1 1 3   116 0  o 14 8.06267e+00 7.27114e-01 9.57489e+01 36.290  1.95701e+01  1.43705e+01  0.00000e+00 0.00000e+00 1.95667e+02 36.290  9.99181e+01 36.290  0.9792 
1 1 1 3   116 1  o 17 5.58187e+00 8.48590e-01 9.44486e+01 234.261 -8.70835e+00 -1.21014e+01 0.00000e+00 0.00000e+00 1.04574e+02 234.261 1.01252e+01 234.261 0.9659 
1 1 1 3   116 2  o 13 1.98891e+00 6.71848e-01 5.13203e+01 284.593 8.22320e-01  -3.15854e+00 0.00000e+00 0.00000e+00 9.45591e+00 284.593 4.18644e+01 104.593 0.8277 
1 1 1 3   116 3  o 19 5.80678e+00 8.80948e-01 9.26761e+01 48.912  1.00271e+01  1.14991e+01  0.00000e+00 0.00000e+00 1.14535e+02 48.912  2.18589e+01 48.912  0.9667 
1 1 1 3   116 4  o 3  2.82320e+00 8.14265e-01 4.85182e+01 338.060 4.11387e+00  -1.65707e+00 0.00000e+00 0.00000e+00 4.30189e+01 338.060 5.49933e+00 158.060 0.8784 
1 1 1 3   116 5  o 15 2.77171e+00 8.54970e-01 5.11547e+01 257.402 -1.00906e+00 -4.51504e+00 0.00000e+00 0.00000e+00 3.92657e+01 257.402 1.18890e+01 77.402  0.8839 
1 1 1 3   116 6  o 6  5.87022e+00 1.00089e+00 1.15162e+02 103.488 -4.38762e+00 1.82927e+01  0.00000e+00 0.00000e+00 9.56013e+01 103.488 1.95606e+01 283.488 0.9730 
1 1 1 3   116 7  o 18 2.80769e+00 8.81478e-01 1.57664e+01 221.053 -1.11195e+00 -9.68401e-01 0.00000e+00 0.00000e+00 4.53167e+01 221.053 2.95503e+01 221.053 0.5898 
1 1 1 3   116 8  o 14 2.98755e+00 9.30951e-01 5.16395e+01 212.213 -4.52248e+00 -2.84934e+00 0.00000e+00 0.00000e+00 4.76017e+01 212.213 4.03778e+00 32.213  0.9008 
1 1 1 3   117 0  o 5  4.62721e+00 8.44172e-01 9.00638e+01 254.628 -3.33165e+00 -1.21187e+01 0.00000e+00 0.00000e+00 7.37419e+01 254.628 1.63219e+01 74.628  0.9594 
1 1 1 3   117 1  o 7  9.07796e+00 7.07686e-01 1.24895e+02 153.038 -3.45178e+01 1.75587e+01  0.00000e+00 0.00000e+00 2.05761e+02 153.038 8.08665e+01 153.038 0.9870 
1 1 1 3   117 2  o 1  4.27939e+00 8.99996e-01 3.63169e+01 273.862 2.91204e-01  -4.31396e+00 0.00000e+00 0.00000e+00 1.01858e+02 273.862 6.55410e+01 273.862 0.8749 
1 1 1 3   117 3  o 10 3.33395e+00 8.84984e-01 5.54071e+01 337.099 4.67836e+00  -1.97636e+00 0.00000e+00 0.00000e+00 5.47307e+01 337.099 6.76460e-01 157.099 0.8952 
1 1 1 3   117 4  o 15 3.80398e+00 8.28869e-01 6.88883e+01 83.699  8.87411e-01  8.03643e+00  0.00000e+00 0.00000e+00 6.24883e+01 83.699  6.40004e+00 263.699 0.9359 
1 1 1 3   117 5  o 8  3.34354e+00 8.73777e-01 8.51887e+01 279.444 1.39141e+00  -8.36452e+00 0.00000e+00 0.00000e+00 3.06494e+01 279.444 5.45393e+01 99.444  0.9390 
1 1 1 3   117 6  o 1  3.45180e+00 9.48920e-01 5.73642e+01 160.642 -6.12074e+00 2.15046e+00  0.00000e+00 0.00000e+00 5.96887e+01 160.642 2.32456e+00 160.642 0.9193 
1 1 1 3   117 7  o 10 4.75449e+00 1.05747e+00 7.31727e+01 233.608 -6.11889e+00 -8.30186e+00 0.00000e+00 0.00000e+00 9.34254e+01 233.608 2.02527e+01 233.608 0.9502 
1 1 1 3   118 0  o 14 2.74446e+00 8.16596e-01 4.00867e+01 357.574 3.51638e+00  -1.48948e-01 0.00000e+00 0.00000e+00 4.51683e+01 357.574 5.08156e+00 357.574 0.8421 
1 1 1 3   118 1  o 11 5.32743e+00 9.10201e-01 1.06742e+02 180.315 -1.52970e+01 -8.40303e-02 0.00000e+00 0.00000e+00 8.32596e+01 180.315 2.34825e+01 0.315   0.9667 
1 1 1 3   118 2  o 6  5.26472e+00 9.15018e-01 8.77393e+01 311.416 8.95058e+00  -1.01467e+01 0.00000e+00 0.00000e+00 9.91698e+01 311.416 1.14305e+01 311.416 0.9623 
1 1 1 3   118 3  o 10 5.76839e+00 9.08931e-01 9.89768e+01 182.098 -1.63116e+01 -5.97606e-01 0.00000e+00 0.00000e+00 1.07204e+02 182.098 8.22674e+00 182.098 0.9689 
1 1 1 3   118 4  o 15 4.64828e+00 9.43446e-01 9.04236e+01 5.552   1.27467e+01  1.23897e+00  0.00000e+00 0.00000e+00 7.42066e+01 5.552   1.62170e+01 185.552 0.9601 
1 1 1 3   118 5  o 6  6.14627e+00 1.00074e+00 1.26338e+02 207.375 -2.05491e+01 -1.06401e+01 0.00000e+00 0.00000e+00 9.53992e+01 207.375 3.09385e+01 27.375  0.9781 
1 1 1 3   118 6  o 4  5.56398e+00 1.02960e+00 9.85254e+01 69.405  5.68691e+00  1.51335e+01  0.00000e+00 0.00000e+00 1.00194e+02 69.405  1.66884e+00 69.405  0.9686 
1 1 1 3   118 7  o 14 2.65333e+00 8.55594e-01 4.13152e+01 26.422  3.72257e+00  1.84967e+00  0.00000e+00 0.00000e+00 4.37132e+01 26.422  2.39795e+00 26.422  0.8693 
1 1 1 3   119 0  o 7  3.77319e+00 9.07509e-01 8.95439e+01 44.657  6.80755e+00  6.72656e+00  0.00000e+00 0.00000e+00 4.21145e+01 44.657  4.74294e+01 224.657 0.9462 
1 1 1 3   119 1  o 9  4.06581e+00 9.13699e-01 8.49175e+01 270.802 1.37656e-01  -9.83286e+00 0.00000e+00 0.00000e+00 5.71873e+01 270.802 2.77302e+01 90.802  0.9477 
1 1 1 3   119 2  o 7  3.17848e+00 8.85355e-01 7.54564e+01 118.437 -3.61143e+00 6.66894e+00  0.00000e+00 0.00000e+00 3.37420e+01 118.437 4.17144e+01 298.437 0.9315 
1 1 1 3   119 3  o 3  2.54424e+00 7.97927e-01 3.83969e+01 227.743 -2.33385e+00 -2.56875e+00 0.00000e+00 0.00000e+00 4.03793e+01 227.743 1.98241e+00 227.743 0.8396 
1 1 1 3   119 4  o 16 2.12759e+00 7.13157e-01 2.12025e+01 233.621 -1.07102e+00 -1.45381e+00 0.00000e+00 0.00000e+00 3.08265e+01 233.621 9.62391e+00 233.621 0.6631 
1 1 1 3   119 5  o 3  2.94463e+00 8.87791e-01 7.42209e+01 127.382 -4.53402e+00 5.93417e+00  0.00000e+00 0.00000e+00 2.67945e+01 127.382 4.74265e+01 307.382 0.9304 
1 1 1 3   119 6  o 16 2.72430e+00 8.55672e-01 3.60402e+01 291.566 1.36736e+00  -3.45961e+00 0.00000e+00 0.00000e+00 4.95039e+01 291.566 1.34637e+01 291.566 0.8518 
1 1 1 3   119 7  o 18 2.57464e+00 8.27690e-01 4.52636e+01 131.244 -3.33173e+00 3.79993e+00  0.00000e+00 0.00000e+00 3.96190e+01 131.244 5.64461e+00 311.244 0.8946 
1 1 1 3   120 0  o 9  4.01019e+00 9.51883e-01 4.15591e+01 122.867 -2.55580e+00 3.95571e+00  0.00000e+00 0.00000e+00 8.94480e+01 122.867 4.78888e+01 122.867 0.8862 
1 1 1 3   120 1  o 7  4.30439e+00 8.22793e-01 6.30138e+01 257.057 -2.10435e+00 -9.15656e+00 0.00000e+00 0.00000e+00 8.69801e+01 257.057 2.39663e+01 257.057 0.9452 
1 1 1 3   120 2  o 9  2.22675e+00 6.93013e-01 2.06625e+01 131.212 -1.06823e+00 1.21971e+00  0.00000e+00 0.00000e+00 3.06266e+01 131.212 9.96410e+00 131.212 0.6247 
1 1 1 3   120 3  o 13 3.07813e+00 8.64558e-01 2.95614e+01 187.435 -3.07022e+00 -4.00667e-01 0.00000e+00 0.00000e+00 6.31382e+01 187.435 3.35767e+01 187.435 0.8169 
1 1 1 3   120 4  o 16 5.61553e+00 9.71621e-01 7.56846e+01 101.439 -2.62520e+00 1.29743e+01  0.00000e+00 0.00000e+00 1.23348e+02 101.439 4.76631e+01 101.439 0.9615 
1 1 1 3   120 5  o 4  2.54122e+00 8.10102e-01 8.09119e+01 31.245  6.91451e+00  4.19493e+00  0.00000e+00 0.00000e+00 6.75574e+00 31.245  7.41561e+01 211.245 0.9360 
1 1 1 3   120 6  o 5  2.37587e+00 7.79617e-01 2.58757e+01 200.547 -2.38856e+00 -8.95268e-01 0.00000e+00 0.00000e+00 4.15759e+01 200.547 1.57002e+01 200.547 0.7704 
1 1 1 3   120 7  o 18 4.08793e+00 1.07049e+00 6.58287e+01 339.941 7.45131e+00  -2.72077e+00 0.00000e+00 0.00000e+00 7.49324e+01 339.941 9.10364e+00 339.941 0.9347 
1 1 1 3   121 0  o 7  3.39344e+00 8.98868e-01 5.62120e+01 312.418 3.97852e+00  -4.35423e+00 0.00000e+00 0.00000e+00 5.76821e+01 312.418 1.47010e+00 312.418 0.9107 
1 1 1 3   121 1  o 15 6.05191e+00 8.62032e-01 1.05131e+02 40.162  1.55973e+01  1.31632e+01  0.00000e+00 0.00000e+00 1.12380e+02 40.162  7.24900e+00 40.162  0.9752 
1 1 1 3   121 2  o 15 7.46137e+00 8.09404e-01 7.63320e+01 286.691 6.01878e+00  -2.00736e+01 0.00000e+00 0.00000e+00 1.92025e+02 286.691 1.15693e+02 286.691 0.9758 
1 1 1 3   121 3  o 3  6.13166e+00 9.22312e-01 1.01760e+02 100.665 -3.79990e+00 2.01780e+01  0.00000e+00 0.00000e+00 1.18652e+02 100.665 1.68923e+01 100.665 0.9753 
1 1 1 3   121 4  o 15 2.86545e+00 8.61949e-01 4.63650e+01 164.831 -4.75007e+00 1.28783e+00  0.00000e+00 0.00000e+00 4.77785e+01 164.831 1.41350e+00 164.831 0.8915 
1 1 1 3   121 5  o 15 3.33846e+00 9.41143e-01 5.65229e+01 315.330 4.38320e+00  -4.33295e+00 0.00000e+00 0.00000e+00 5.60097e+01 315.330 5.13194e-01 135.330 0.9148 
1 1 1 3   121 6  o 2  3.73428e+00 9.98136e-01 8.00955e+01 168.223 -1.01633e+01 2.11902e+00  0.00000e+00 0.00000e+00 5.06664e+01 168.223 2.94292e+01 348.223 0.9505 
1 1 1 3   122 0  f 0  5.74455e+00 8.84845e-01 1.27125e+02 38.542  2.01534e+01  1.60546e+01  0.00000e+00 0.00000e+00 8.03558e+01 38.542  4.67691e+01 218.541 0.9804 
1 1 1 3   122 1  o 18 4.15985e+00 8.69149e-01 6.04066e+01 285.206 2.36613e+00  -8.70525e+00 0.00000e+00 0.00000e+00 8.40936e+01 285.206 2.36870e+01 285.206 0.9428 
1 1 1 3   122 2  o 17 2.70781e+00 8.33813e-01 4.35281e+01 215.678 -3.36229e+00 -2.41413e+00 0.00000e+00 0.00000e+00 4.31367e+01 215.678 3.91480e-01 35.678  0.8687 
1 1 1 3   122 3  o 3  2.67977e+00 8.17705e-01 5.79005e+01 169.186 -5.94651e+00 1.13584e+00  0.00000e+00 0.00000e+00 3.22598e+01 169.186 2.56407e+01 349.186 0.9132 
1 1 1 3   122 4  o 8  2.55993e+00 8.02526e-01 2.56734e+01 65.200  1.11167e+00  2.40587e+00  0.00000e+00 0.00000e+00 4.79242e+01 65.200  2.22508e+01 65.200  0.7804 
1 1 1 3   122 5  o 19 2.56012e+00 8.00087e-01 5.28567e+01 296.427 2.46840e+00  -4.96676e+00 0.00000e+00 0.00000e+00 3.24543e+01 296.427 2.04024e+01 116.427 0.9047 
1 1 1 3   122 6  o 5  2.32685e+00 7.77340e-01 3.08708e+01 9.048   2.95835e+00  4.71107e-01  0.00000e+00 0.00000e+00 3.85081e+01 9.048   7.63729e+00 9.048   0.8097 
1 1 1 3   123 0  o 10 4.31955e+00 9.58051e-01 7.65216e+01 301.691 5.55217e+00  -8.99287e+00 0.00000e+00 0.00000e+00 7.48330e+01 301.691 1.68862e+00 121.691 0.9514 
1 1 1 3   123 1  o 17 2.50812e+00 7.82492e-01 3.65675e+01 106.796 -1.03241e+00 3.42040e+00  0.00000e+00 0.00000e+00 4.14737e+01 106.796 4.90618e+00 106.796 0.8448 
1 1 1 3   123 2  o 6  3.68230e+00 9.51624e-01 6.27277e+01 238.043 -4.07159e+00 -6.52668e+00 0.00000e+00 0.00000e+00 6.37487e+01 238.043 1.02104e+00 238.043 0.9325 
1 1 1 3   123 3  o 14 2.63297e+00 8.02653e-01 3.39410e+01 92.101  -1.32103e-01 3.60009e+00  0.00000e+00 0.00000e+00 4.81269e+01 92.101  1.41858e+01 92.101  0.8463 
1 1 1 3   123 4  o 8  2.89601e+00 8.51186e-01 2.51088e+01 319.414 2.24776e+00  -1.92561e+00 0.00000e+00 0.00000e+00 6.09563e+01 319.414 3.58475e+01 319.414 0.8070 
1 1 1 3   123 5  o 8  1.99854e+00 6.83830e-01 4.53905e+01 221.870 -3.98260e+00 -3.56969e+00 0.00000e+00 0.00000e+00 2.09047e+01 221.870 2.44857e+01 41.871  0.9009 
1 1 1 3   124 0  o 18 6.87021e+00 8.63647e-01 1.07281e+02 220.935 -2.08993e+01 -1.81259e+01 0.00000e+00 0.00000e+00 1.41032e+02 220.935 3.37509e+01 220.935 0.9818 
1 1 1 3   124 1  o 9  1.96881e+00 6.60173e-01 9.75046e+00 78.928  1.75931e-01  8.99054e-01  0.00000e+00 0.00000e+00 2.03957e+01 78.928  1.06452e+01 78.928  0.4159 
1 1 1 3   124 2  o 14 2.13558e+00 7.13774e-01 7.72922e+00 312.048 4.66423e-01  -5.17137e-01 0.00000e+00 0.00000e+00 1.81143e+01 312.048 1.03851e+01 312.048 0.3287 
1 1 1 3   124 3  o 9  2.47806e+00 7.84727e-01 2.56205e+01 296.683 1.26320e+00  -2.51349e+00 0.00000e+00 0.00000e+00 4.69277e+01 296.683 2.13072e+01 296.683 0.7952 
1 1 1 3   124 4  o 3  2.85681e+00 8.51509e-01 6.01372e+01 36.022  5.58463e+00  4.06068e+00  0.00000e+00 0.00000e+00 3.70906e+01 36.022  2.30466e+01 216.022 0.9245 
1 1 1 3   125 0  o 4  4.86114e+00 9.65569e-01 5.98386e+01 212.435 -8.65373e+00 -5.49925e+00 0.00000e+00 0.00000e+00 1.10102e+02 212.435 5.02630e+01 212.435 0.9499 
1 1 1 3   125 1  o 15 3.14194e+00 8.81908e-01 6.45130e+01 32.768  6.67346e+00  4.29542e+00  0.00000e+00 0.00000e+00 4.35766e+01 32.768  2.09364e+01 212.768 0.9347 
1 1 1 3   125 2  o 10 3.23372e+00 8.95413e-01 5.89646e+01 326.225 5.78705e+00  -3.87038e+00 0.00000e+00 0.00000e+00 5.11444e+01 326.225 7.82029e+00 146.225 0.9251 
1 1 1 3   125 3  o 19 2.02598e+00 6.84835e-01 2.98967e+01 77.929  6.27890e-01  2.93617e+00  0.00000e+00 0.00000e+00 3.05161e+01 77.929  6.19419e-01 77.929  0.8102 
1 1 1 3   126 0  o 15 2.93439e+00 8.36763e-01 5.54760e+01 200.385 -6.53299e+00 -2.42766e+00 0.00000e+00 0.00000e+00 4.44036e+01 200.385 1.10724e+01 20.385  0.9252 
1 1 1 3   126 1  o 1  2.40873e+00 7.70158e-01 3.58191e+01 353.303 3.81730e+00  -4.48247e-01 0.00000e+00 0.00000e+00 4.01523e+01 353.303 4.33321e+00 353.303 0.8572 
1 1 1 3   126 2  o 10 2.39351e+00 7.67462e-01 1.73117e+01 44.046  1.55066e+00  1.49984e+00  0.00000e+00 0.00000e+00 4.62719e+01 44.046  2.89602e+01 44.046  0.7220 
1 1 1 3   127 0  o 8  3.55421e+00 9.43493e-01 4.47102e+01 309.992 3.49134e+00  -4.16196e+00 0.00000e+00 0.00000e+00 7.32628e+01 309.992 2.85526e+01 309.992 0.9025 
1 1 1 3   127 1  o 7  3.01916e+00 8.75748e-01 3.93613e+01 88.979  7.49633e-02  4.20475e+00  0.00000e+00 0.00000e+00 5.73577e+01 88.979  1.79964e+01 88.979  0.8710 
1 1 1 3   128 0  o 11 2.12321e+00 6.98550e-01 5.44395e+01 154.984 -5.74639e+00 2.68156e+00  0.00000e+00 0.00000e+00 1.71677e+01 154.984 3.72718e+01 334.984 0.9174 
1 1 1 3   128 1  f 0  2.31182e+00 7.45536e-01 1.83416e+01 291.090 6.40589e-01  -1.66096e+00 0.00000e+00 0.00000e+00 3.76029e+01 291.090 1.92613e+01 291.090 0.6582 
1 1 1 4   0   0  o 18 1.77110e+01 5.81721e-01 4.05447e+02 180.000 -1.76085e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.22594e+02 180.000 1.82854e+02 0.000   0.9426 
1 1 1 4   0   1  o 7  4.01682e+01 1.11963e+00 5.95152e+01 180.000 -5.44238e-01 0.00000e+00  0.00000e+00 0.00000e+00 6.90388e+02 180.000 6.30873e+02 180.000 0.4962 
1 1 1 4   0   2  o 19 1.07617e+01 6.71046e-01 5.05292e+02 180.000 -1.29742e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.56618e+02 0.000   6.61910e+02 0.000   0.8611 
1 1 1 4   0   3  o 8  1.46143e+01 5.50668e-01 5.41627e+01 180.000 -2.32764e-01 0.00000e+00  0.00000e+00 0.00000e+00 7.15729e+01 180.000 1.74102e+01 180.000 0.2286 
1 1 1 4   0   4  o 5  1.92645e+01 6.48073e-01 5.55550e+02 0.000   3.95926e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.68768e+02 0.000   3.86782e+02 180.000 0.9993 
1 1 1 4   0   5  o 5  1.31968e+01 5.70736e-01 2.34422e+02 180.000 -1.32603e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.96665e+02 180.000 3.77575e+01 0.000   0.8683 
1 1 1 4   0   6  o 15 1.42093e+01 6.22507e-01 2.17736e+02 0.000   1.63677e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.77743e+02 0.000   6.00067e+01 0.000   0.9270 
1 1 1 4   0   7  o 14 2.77603e+01 8.06301e-01 6.99098e+02 0.000   1.14644e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.44860e+02 0.000   3.54238e+02 180.000 1.0000 
1 1 1 4   0   8  o 10 3.62416e+01 9.91071e-01 6.54876e+02 180.000 -1.87210e+01 0.00000e+00  0.00000e+00 0.00000e+00 7.07629e+02 180.000 5.27532e+01 180.000 1.0000 
1 1 1 4   0   9  o 13 1.13685e+01 7.95353e-01 3.30957e+02 0.000   3.93404e+00  0.00000e+00  0.00000e+00 0.00000e+00 9.59605e+01 0.000   2.34996e+02 180.000 0.9992 
1 1 1 4   0   10 o 19 1.44474e+01 9.17190e-01 2.17521e+02 0.000   4.28768e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.25002e+02 0.000   1.07481e+02 0.000   0.9996 
1 1 1 4   0   11 o 6  1.44932e+01 1.02597e+00 4.07594e+02 0.000   1.03584e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.36591e+02 0.000   2.71003e+02 180.000 1.0000 
1 1 1 4   0   12 o 5  1.10904e+01 1.34153e+00 2.80365e+02 180.000 -7.47705e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.35829e+02 180.000 1.44536e+02 0.000   1.0000 
1 1 1 4   0   13 o 5  1.22137e+01 1.44753e+00 2.62970e+02 180.000 -1.09644e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.95104e+02 180.000 6.78664e+01 0.000   1.0000 
1 1 1 4   0   14 o 9  1.61762e+01 1.30661e+00 1.71329e+02 180.000 -1.22393e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.34954e+02 180.000 2.63624e+02 180.000 1.0000 
1 1 1 4   0   15 o 11 9.95619e+00 2.40084e+00 1.56734e+02 180.000 -6.19161e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.16150e+02 180.000 5.94151e+01 180.000 1.0000 
1 1 1 4   0   16 o 13 5.74034e+00 2.86424e+00 4.07306e+01 180.000 -8.51022e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.07841e+02 180.000 6.71108e+01 180.000 0.6916 
1 1 1 4   0   17 o 12 1.02300e+01 2.98342e+00 1.61502e+02 180.000 -6.30288e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.21012e+02 180.000 5.95099e+01 180.000 1.0000 
1 1 1 4   1   0  o 2  4.25239e+01 8.31403e-01 6.72068e+02 75.680  3.44484e+00  1.34950e+01  0.00000e+00 0.00000e+00 8.69135e+02 75.680  1.97067e+02 75.680  0.9634 
1 1 1 4   1   1  o 12 2.94827e+01 6.01715e-01 6.11088e+02 311.992 5.49323e+00  -6.10248e+00 0.00000e+00 0.00000e+00 4.28271e+02 311.992 1.82818e+02 131.992 0.9370 
1 1 1 4   1   2  o 11 2.75920e+01 8.11265e-01 4.88619e+02 316.670 4.65671e+00  -4.39293e+00 0.00000e+00 0.00000e+00 4.64654e+02 316.670 2.39656e+01 136.670 0.9182 
1 1 1 4   1   3  o 3  4.14952e+01 8.22266e-01 6.84573e+02 153.416 -1.48431e+01 7.42757e+00  0.00000e+00 0.00000e+00 8.29010e+02 153.416 1.44437e+02 153.416 0.9694 
1 1 1 4   1   4  o 4  2.24787e+01 5.07535e-01 4.83733e+02 292.777 3.11102e+00  -7.40931e+00 0.00000e+00 0.00000e+00 3.07527e+02 292.777 1.76205e+02 112.777 0.9355 
1 1 1 4   1   5  o 14 1.27031e+01 3.99781e-01 1.90751e+02 212.542 -1.75068e+00 -1.11710e+00 0.00000e+00 0.00000e+00 1.48556e+02 212.542 4.21944e+01 32.542  0.7100 
1 1 1 4   1   6  o 10 3.65764e+01 7.18785e-01 7.20742e+02 66.946  1.08511e+01  2.54967e+01  0.00000e+00 0.00000e+00 6.30023e+02 66.946  9.07193e+01 246.946 0.9818 
1 1 1 4   1   7  o 6  2.35436e+01 5.19811e-01 3.82387e+02 267.309 -4.99965e-01 -1.06363e+01 0.00000e+00 0.00000e+00 4.60336e+02 267.309 7.79494e+01 267.309 0.9518 
1 1 1 4   1   8  o 3  3.13454e+01 6.36752e-01 4.68256e+02 186.046 -2.30826e+01 -2.44485e+00 0.00000e+00 0.00000e+00 6.84501e+02 186.046 2.16244e+02 186.046 0.9782 
1 1 1 4   1   9  o 12 1.57277e+01 5.37971e-01 3.64223e+02 206.160 -1.07629e+01 -5.28665e+00 0.00000e+00 0.00000e+00 2.01638e+02 206.160 1.62585e+02 26.160  0.9573 
1 1 1 4   1   10 o 11 4.97536e+01 9.33015e-01 8.16786e+02 56.452  5.98981e+01  9.03324e+01  0.00000e+00 0.00000e+00 1.04360e+03 56.452  2.26817e+02 56.452  0.9954 
1 1 1 4   1   11 o 10 2.12851e+01 6.99134e-01 2.10081e+02 31.139  1.34546e+01  8.12895e+00  0.00000e+00 0.00000e+00 5.63273e+02 31.139  3.53192e+02 31.139  0.9677 
1 1 1 4   1   12 o 4  9.89167e+00 1.02655e+00 1.93214e+02 262.732 -1.14678e+00 -8.99246e+00 0.00000e+00 0.00000e+00 1.56879e+02 262.732 3.63349e+01 82.732  0.9431 
1 1 1 4   1   13 o 1  1.54238e+01 8.72379e-01 3.00606e+02 201.128 -3.06512e+01 -1.18445e+01 0.00000e+00 0.00000e+00 2.68988e+02 201.128 3.16186e+01 21.128  0.9847 
1 1 1 4   1   14 o 11 8.26643e+00 1.33325e+00 1.83716e+02 327.746 9.83880e+00  -6.20875e+00 0.00000e+00 0.00000e+00 1.12478e+02 327.746 7.12383e+01 147.746 0.9560 
1 1 1 4   1   15 o 3  8.42381e+00 1.41698e+00 1.54246e+02 141.233 -9.23951e+00 7.42006e+00  0.00000e+00 0.00000e+00 1.47629e+02 141.233 6.61664e+00 321.233 0.9568 
1 1 1 4   1   16 o 3  7.89669e+00 1.74061e+00 1.68854e+02 10.104  1.11903e+01  1.99408e+00  0.00000e+00 0.00000e+00 1.13352e+02 10.104  5.55018e+01 190.104 0.9549 
1 1 1 4   1   17 o 6  7.25723e+00 1.74905e+00 8.50055e+01 258.237 -1.19714e+00 -5.74883e+00 0.00000e+00 0.00000e+00 1.62020e+02 258.237 7.70147e+01 258.237 0.9103 
1 1 1 4   2   0  o 9  2.83206e+01 6.70716e-01 4.59721e+02 283.186 1.44410e+00  -6.16350e+00 0.00000e+00 0.00000e+00 5.17485e+02 283.186 5.77644e+01 283.186 0.9172 
1 1 1 4   2   1  o 15 2.90075e+01 5.94856e-01 6.25328e+02 93.640  -5.22700e-01 8.21746e+00  0.00000e+00 0.00000e+00 3.97478e+02 93.640  2.27850e+02 273.640 0.9372 
1 1 1 4   2   2  o 7  1.47328e+01 4.36902e-01 4.00550e+02 290.451 1.37682e+00  -3.69199e+00 0.00000e+00 0.00000e+00 7.68575e+01 290.451 3.23693e+02 110.452 0.8612 
1 1 1 4   2   3  o 13 1.78054e+01 4.29793e-01 5.46318e+02 32.113  4.82943e+00  3.03108e+00  0.00000e+00 0.00000e+00 6.16609e+01 32.113  4.84657e+02 212.113 0.9075 
1 1 1 4   2   4  f 0  1.70893e+01 4.28496e-01 4.28178e+02 287.004 1.58066e+00  -5.16891e+00 0.00000e+00 0.00000e+00 1.51807e+02 287.004 2.76371e+02 107.004 0.9020 
1 1 1 4   2   5  o 17 1.71193e+01 4.44868e-01 2.19562e+02 178.241 -3.21493e+00 9.87288e-02  0.00000e+00 0.00000e+00 3.11649e+02 178.241 9.20870e+01 178.241 0.8248 
1 1 1 4   2   6  o 17 2.17794e+01 5.01023e-01 4.01216e+02 218.365 -7.23565e+00 -5.72766e+00 0.00000e+00 0.00000e+00 3.72266e+02 218.365 2.89498e+01 38.365  0.9442 
1 1 1 4   2   7  o 14 4.41566e+01 8.44753e-01 7.81708e+02 44.319  2.89129e+01  2.82335e+01  0.00000e+00 0.00000e+00 8.58168e+02 44.319  7.64605e+01 44.319  0.9875 
1 1 1 4   2   8  o 17 4.46783e+01 8.22750e-01 4.03236e+02 110.890 -1.00748e+01 2.63970e+01  0.00000e+00 0.00000e+00 1.24644e+03 110.890 8.43204e+02 110.890 0.9821 
1 1 1 4   2   9  o 10 3.54878e+01 7.14636e-01 5.68679e+02 228.959 -2.74934e+01 -3.15822e+01 0.00000e+00 0.00000e+00 7.48979e+02 228.959 1.80300e+02 228.959 0.9880 
1 1 1 4   2   10 o 10 2.96186e+01 6.81937e-01 3.40191e+02 289.516 9.16292e+00  -2.58520e+01 0.00000e+00 0.00000e+00 7.51975e+02 289.516 4.11784e+02 289.516 0.9816 
1 1 1 4   2   11 o 8  2.25379e+01 6.95585e-01 4.22144e+02 344.016 3.21586e+01  -9.21163e+00 0.00000e+00 0.00000e+00 4.11352e+02 344.016 1.07911e+01 164.016 0.9849 
1 1 1 4   2   12 o 1  3.09724e+01 7.76707e-01 4.80181e+02 195.101 -7.09395e+01 -1.91418e+01 0.00000e+00 0.00000e+00 6.74193e+02 195.101 1.94012e+02 195.101 0.9932 
1 1 1 4   2   13 o 12 5.34851e+00 1.32329e+00 1.60578e+02 271.840 1.72712e-01  -5.37591e+00 0.00000e+00 0.00000e+00 2.02542e+01 271.840 1.40323e+02 91.840  0.9015 
1 1 1 4   2   14 o 16 6.45599e+00 1.38874e+00 1.15324e+02 103.783 -1.32992e+00 5.42131e+00  0.00000e+00 0.00000e+00 1.03739e+02 103.783 1.15848e+01 283.783 0.9053 
1 1 1 4   2   15 o 19 1.02887e+01 1.30385e+00 2.37715e+02 158.091 -2.18422e+01 8.78432e+00  0.00000e+00 0.00000e+00 1.39349e+02 158.091 9.83666e+01 338.091 0.9785 
1 1 1 4   2   16 o 6  6.68229e+00 1.66465e+00 1.72630e+02 293.555 4.09875e+00  -9.40187e+00 0.00000e+00 0.00000e+00 6.49199e+01 293.555 1.07710e+02 113.555 0.9499 
1 1 1 4   2   17 o 10 4.56248e+00 1.47294e+00 7.97011e+01 76.277  9.75504e-01  3.99486e+00  0.00000e+00 0.00000e+00 6.83274e+01 76.277  1.13737e+01 256.277 0.8677 
1 1 1 4   3   0  o 5  1.48264e+01 4.25195e-01 1.27216e+02 316.909 6.66376e-01  -6.23397e-01 0.00000e+00 0.00000e+00 1.03996e+02 316.909 2.32203e+01 136.909 0.4145 
1 1 1 4   3   1  o 19 1.84236e+01 4.24650e-01 4.40360e+02 81.764  5.24858e-01  3.62607e+00  0.00000e+00 0.00000e+00 1.48306e+02 81.764  2.92054e+02 261.764 0.8492 
1 1 1 4   3   2  o 12 2.81955e+01 6.76560e-01 2.80647e+02 14.277  5.07694e+00  1.29195e+00  0.00000e+00 0.00000e+00 6.72734e+02 14.277  3.92087e+02 14.277  0.8986 
1 1 1 4   3   3  o 13 6.21813e+00 3.61087e-01 7.48143e+01 96.047  -2.86356e-02 2.70329e-01  0.00000e+00 0.00000e+00 4.33028e+01 276.047 1.18117e+02 276.047 0.1347 
1 1 1 4   3   4  o 11 1.75471e+01 4.32660e-01 4.37971e+02 47.127  3.85280e+00  4.14997e+00  0.00000e+00 0.00000e+00 1.60699e+02 47.127  2.77272e+02 227.126 0.9068 
1 1 1 4   3   5  o 7  1.90594e+01 4.50032e-01 5.04932e+02 58.665  4.27581e+00  7.02278e+00  0.00000e+00 0.00000e+00 1.66970e+02 58.665  3.37962e+02 238.665 0.9371 
1 1 1 4   3   6  f 0  3.39720e+01 6.77075e-01 5.35014e+02 276.108 2.03221e+00  -1.89899e+01 0.00000e+00 0.00000e+00 7.08912e+02 276.108 1.73898e+02 276.108 0.9735 
1 1 1 4   3   7  o 14 3.25213e+01 6.64011e-01 4.35008e+02 30.818  1.43007e+01  8.53108e+00  0.00000e+00 0.00000e+00 7.50669e+02 30.818  3.15661e+02 30.818  0.9695 
1 1 1 4   3   8  o 12 3.36847e+01 6.67733e-01 7.93868e+02 253.033 -1.23163e+01 -4.03668e+01 0.00000e+00 0.00000e+00 4.57400e+02 253.033 3.36469e+02 73.033  0.9881 
1 1 1 4   3   9  o 11 2.62116e+01 6.06564e-01 6.34073e+02 204.558 -3.15304e+01 -1.44081e+01 0.00000e+00 0.00000e+00 3.36675e+02 204.558 2.97398e+02 24.558  0.9855 
1 1 1 4   3   10 o 16 3.23157e+01 7.05540e-01 2.02377e+02 94.852  -1.50299e+00 1.77053e+01  0.00000e+00 0.00000e+00 9.76904e+02 94.852  7.74527e+02 94.852  0.9714 
1 1 1 4   3   11 o 6  2.24185e+01 7.06088e-01 4.47764e+02 238.683 -1.83218e+01 -3.01142e+01 0.00000e+00 0.00000e+00 3.81963e+02 238.683 6.58008e+01 58.683  0.9857 
1 1 1 4   3   12 o 7  2.74050e+01 7.98085e-01 3.59090e+02 30.056  4.19379e+01  2.42673e+01  0.00000e+00 0.00000e+00 6.58666e+02 30.056  2.99577e+02 30.056  0.9896 
1 1 1 4   3   13 o 17 2.14681e+01 8.24134e-01 3.23941e+02 238.490 -2.60365e+01 -4.24715e+01 0.00000e+00 0.00000e+00 4.73084e+02 238.490 1.49143e+02 238.490 0.9899 
1 1 1 4   3   14 o 14 1.53979e+01 9.55708e-01 2.31898e+02 142.302 -2.47028e+01 1.90911e+01  0.00000e+00 0.00000e+00 3.35889e+02 142.302 1.03992e+02 142.302 0.9839 
1 1 1 4   3   15 o 17 4.36977e+00 1.28831e+00 1.04391e+02 251.720 -1.38721e+00 -4.19942e+00 0.00000e+00 0.00000e+00 3.93027e+01 251.720 6.50881e+01 71.720  0.8780 
1 1 1 4   3   16 o 16 5.92107e+00 1.62650e+00 8.93420e+01 348.589 4.70850e+00  -9.50363e-01 0.00000e+00 0.00000e+00 1.07561e+02 348.589 1.82186e+01 348.589 0.8886 
1 1 1 4   3   17 o 17 6.98602e+00 1.74517e+00 7.78543e+01 160.986 -4.73433e+00 1.63143e+00  0.00000e+00 0.00000e+00 1.55557e+02 160.986 7.77027e+01 160.986 0.8936 
1 1 1 4   4   0  o 9  3.75811e+01 8.59177e-01 9.83797e+02 252.158 -5.39720e+00 -1.67679e+01 0.00000e+00 0.00000e+00 3.89242e+02 252.158 5.94555e+02 72.158  0.9712 
1 1 1 4   4   1  o 19 4.20052e+01 9.77596e-01 6.10029e+02 257.898 -2.38845e+00 -1.11388e+01 0.00000e+00 0.00000e+00 8.99338e+02 257.898 2.89310e+02 257.898 0.9550 
1 1 1 4   4   2  o 17 3.68927e+01 8.50963e-01 7.26637e+02 173.596 -1.74537e+01 1.95911e+00  0.00000e+00 0.00000e+00 6.21399e+02 173.596 1.05239e+02 353.596 0.9711 
1 1 1 4   4   3  o 19 2.85249e+01 5.95607e-01 5.37944e+02 67.953  3.34044e+00  8.24833e+00  0.00000e+00 0.00000e+00 4.73132e+02 67.953  6.48117e+01 247.953 0.9420 
1 1 1 4   4   4  o 7  2.32587e+01 4.93643e-01 6.05663e+02 143.420 -8.69252e+00 6.45092e+00  0.00000e+00 0.00000e+00 2.27990e+02 143.420 3.77672e+02 323.420 0.9526 
1 1 1 4   4   5  o 14 2.13364e+01 4.80240e-01 5.23274e+02 350.553 9.38513e+00  -1.56166e+00 0.00000e+00 0.00000e+00 2.35985e+02 350.553 2.87290e+02 170.553 0.9459 
1 1 1 4   4   6  o 10 2.99301e+01 6.14305e-01 4.99585e+02 183.785 -1.56825e+01 -1.03742e+00 0.00000e+00 0.00000e+00 5.89789e+02 183.785 9.02036e+01 183.785 0.9676 
1 1 1 4   4   7  o 6  2.95156e+01 6.21102e-01 2.94015e+02 144.836 -8.73531e+00 6.15397e+00  0.00000e+00 0.00000e+00 7.62644e+02 144.836 4.68628e+02 144.836 0.9520 
1 1 1 4   4   8  f 0  1.75398e+01 4.93662e-01 6.05100e+02 175.889 -1.67959e+01 1.20723e+00  0.00000e+00 0.00000e+00 3.44044e+01 175.889 5.70695e+02 355.889 0.9698 
1 1 1 4   4   9  o 2  2.67368e+01 6.10027e-01 5.47001e+02 214.165 -2.52256e+01 -1.71208e+01 0.00000e+00 0.00000e+00 4.41168e+02 214.165 1.05833e+02 34.165  0.9835 
1 1 1 4   4   10 o 17 3.07248e+01 7.11063e-01 5.56992e+02 90.701  -5.68741e-01 4.64614e+01  0.00000e+00 0.00000e+00 5.84695e+02 90.701  2.77031e+01 90.701  0.9892 
1 1 1 4   4   11 o 15 8.62908e+00 9.75861e-01 7.53724e+01 73.792  6.18736e-01  2.12861e+00  0.00000e+00 0.00000e+00 1.61254e+02 73.792  8.58815e+01 73.792  0.7303 
1 1 1 4   4   12 o 14 1.89584e+01 7.74647e-01 2.32281e+02 44.127  1.56101e+01  1.51416e+01  0.00000e+00 0.00000e+00 4.62610e+02 44.127  2.30329e+02 44.127  0.9767 
1 1 1 4   4   13 o 17 1.22356e+01 1.21686e+00 1.99851e+02 277.663 2.10827e+00  -1.56693e+01 0.00000e+00 0.00000e+00 2.44273e+02 277.663 4.44225e+01 277.663 0.9678 
1 1 1 4   4   14 o 12 7.85350e+00 1.32521e+00 1.36047e+02 157.055 -7.55731e+00 3.19939e+00  0.00000e+00 0.00000e+00 1.39731e+02 157.055 3.68394e+00 157.055 0.9369 
1 1 1 4   4   15 o 9  1.21672e+01 1.23951e+00 2.08891e+02 73.302  7.24135e+00  2.41400e+01  0.00000e+00 0.00000e+00 2.37659e+02 73.302  2.87681e+01 73.302  0.9800 
1 1 1 4   4   16 o 11 6.81073e+00 1.66914e+00 1.90456e+02 263.550 -1.29215e+00 -1.14299e+01 0.00000e+00 0.00000e+00 5.30749e+01 263.550 1.37381e+02 83.550  0.9555 
1 1 1 4   4   17 o 17 1.06203e+01 1.80617e+00 2.28707e+02 120.119 -1.08173e+01 1.86465e+01  0.00000e+00 0.00000e+00 1.59073e+02 120.119 6.96341e+01 300.119 0.9765 
1 1 1 4   5   0  o 6  2.55162e+01 6.14034e-01 4.35223e+02 18.785  4.96066e+00  1.68732e+00  0.00000e+00 0.00000e+00 4.27393e+02 18.785  7.83019e+00 198.785 0.8987 
1 1 1 4   5   1  o 3  2.20872e+01 4.80684e-01 1.94948e+02 231.576 -1.18315e+00 -1.49150e+00 0.00000e+00 0.00000e+00 3.71235e+02 231.576 1.76287e+02 231.576 0.6813 
1 1 1 4   5   2  o 3  1.90854e+01 4.40262e-01 2.94876e+02 16.111  3.53335e+00  1.02058e+00  0.00000e+00 0.00000e+00 3.15433e+02 16.111  2.05575e+01 16.111  0.8499 
1 1 1 4   5   3  o 11 3.67290e+01 7.38845e-01 7.58011e+02 357.201 1.59897e+01  -7.81813e-01 0.00000e+00 0.00000e+00 5.80092e+02 357.201 1.77919e+02 177.201 0.9682 
1 1 1 4   5   4  o 10 2.03585e+01 4.53039e-01 3.84905e+02 62.779  2.74403e+00  5.33454e+00  0.00000e+00 0.00000e+00 3.13931e+02 62.779  7.09737e+01 242.779 0.9123 
1 1 1 4   5   5  o 6  1.24717e+01 3.83355e-01 2.09236e+02 9.123   2.19263e+00  3.52096e-01  0.00000e+00 0.00000e+00 1.33689e+02 9.123   7.55473e+01 189.123 0.7309 
1 1 1 4   5   6  o 1  2.84918e+01 5.92159e-01 6.46202e+02 192.416 -1.88410e+01 -4.14790e+00 0.00000e+00 0.00000e+00 3.97325e+02 192.416 2.48876e+02 12.416  0.9737 
1 1 1 4   5   7  o 10 1.15442e+01 4.45891e-01 3.07070e+02 161.848 -4.16119e+00 1.36424e+00  0.00000e+00 0.00000e+00 7.35061e+01 161.848 2.33564e+02 341.848 0.8767 
1 1 1 4   5   8  o 12 3.45379e+01 7.09039e-01 7.27325e+02 314.412 2.76526e+01  -2.82263e+01 0.00000e+00 0.00000e+00 5.54548e+02 314.412 1.72777e+02 134.412 0.9873 
1 1 1 4   5   9  o 12 3.09792e+01 6.60543e-01 4.27716e+02 70.807  9.05260e+00  2.60064e+01  0.00000e+00 0.00000e+00 7.15153e+02 70.807  2.87437e+02 70.807  0.9817 
1 1 1 4   5   10 o 11 2.52180e+01 6.46987e-01 3.73154e+02 81.240  3.90714e+00  2.53549e+01  0.00000e+00 0.00000e+00 5.55498e+02 81.240  1.82344e+02 81.240  0.9803 
1 1 1 4   5   11 o 7  1.94347e+01 6.95738e-01 3.47570e+02 291.991 8.88260e+00  -2.19956e+01 0.00000e+00 0.00000e+00 3.66584e+02 291.991 1.90135e+01 291.991 0.9787 
1 1 1 4   5   12 o 18 1.84763e+01 7.58011e-01 2.96185e+02 325.518 2.23179e+01  -1.53282e+01 0.00000e+00 0.00000e+00 3.84234e+02 325.518 8.80493e+01 325.518 0.9814 
1 1 1 4   5   13 o 14 1.11920e+01 1.02819e+00 2.17637e+02 157.988 -1.53872e+01 6.22055e+00  0.00000e+00 0.00000e+00 1.89256e+02 157.988 2.83814e+01 337.988 0.9694 
1 1 1 4   5   14 o 17 1.39459e+01 1.01674e+00 2.39649e+02 2.900   2.86045e+01  1.44907e+00  0.00000e+00 0.00000e+00 2.73815e+02 2.900   3.41659e+01 2.900   0.9824 
1 1 1 4   5   15 o 10 4.79946e+00 1.28555e+00 8.19116e+01 211.480 -3.25380e+00 -1.99237e+00 0.00000e+00 0.00000e+00 7.19566e+01 211.480 9.95494e+00 31.480  0.8560 
1 1 1 4   5   16 o 1  6.88402e+00 1.63308e+00 8.22791e+01 16.717  4.90690e+00  1.47376e+00  0.00000e+00 0.00000e+00 1.48587e+02 16.717  6.63077e+01 16.717  0.8962 
1 1 1 4   5   17 o 5  5.08497e+00 1.53814e+00 7.69841e+01 319.950 3.12371e+00  -2.62572e+00 0.00000e+00 0.00000e+00 8.77729e+01 319.950 1.07888e+01 319.950 0.8666 
1 1 1 4   6   0  o 9  3.49257e+01 8.07282e-01 4.81497e+02 336.472 7.14601e+00  -3.11135e+00 0.00000e+00 0.00000e+00 7.44909e+02 336.472 2.63412e+02 336.472 0.9335 
1 1 1 4   6   1  o 16 2.77751e+01 5.74495e-01 5.78812e+02 341.147 7.91651e+00  -2.70311e+00 0.00000e+00 0.00000e+00 4.01566e+02 341.147 1.77245e+02 161.147 0.9382 
1 1 1 4   6   2  o 5  1.75429e+01 4.21311e-01 3.71183e+02 149.381 -3.62307e+00 2.14433e+00  0.00000e+00 0.00000e+00 2.03827e+02 149.381 1.67357e+02 329.381 0.8711 
1 1 1 4   6   3  o 7  1.58498e+01 3.88749e-01 2.95508e+02 292.519 1.02785e+00  -2.47912e+00 0.00000e+00 0.00000e+00 1.71798e+02 292.519 1.23710e+02 112.519 0.7836 
1 1 1 4   6   4  o 9  3.13397e+01 6.14385e-01 2.47319e+02 342.136 5.60467e+00  -1.80635e+00 0.00000e+00 0.00000e+00 8.26385e+02 342.136 5.79067e+02 342.136 0.9106 
1 1 1 4   6   5  o 11 2.10890e+01 4.74969e-01 1.95785e+02 156.562 -3.20932e+00 1.39130e+00  0.00000e+00 0.00000e+00 4.71429e+02 156.562 2.75645e+02 156.562 0.8410 
1 1 1 4   6   6  o 9  2.93894e+01 6.04704e-01 4.95414e+02 144.493 -1.23898e+01 8.83991e+00  0.00000e+00 0.00000e+00 5.73060e+02 144.493 7.76451e+01 144.493 0.9666 
1 1 1 4   6   7  o 9  1.99899e+01 4.96295e-01 4.14222e+02 40.356  7.77619e+00  6.60776e+00  0.00000e+00 0.00000e+00 2.99644e+02 40.356  1.14578e+02 220.356 0.9497 
1 1 1 4   6   8  o 3  3.54854e+01 7.20907e-01 6.54609e+02 15.322  3.45307e+01  9.46099e+00  0.00000e+00 0.00000e+00 6.60636e+02 15.322  6.02721e+00 15.322  0.9859 
1 1 1 4   6   9  o 10 3.62965e+01 7.29992e-01 4.85091e+02 58.997  1.87644e+01  3.12254e+01  0.00000e+00 0.00000e+00 8.60068e+02 58.997  3.74977e+02 58.997  0.9862 
1 1 1 4   6   10 o 11 1.96360e+01 6.20006e-01 3.39946e+02 289.245 6.16010e+00  -1.76446e+01 0.00000e+00 0.00000e+00 3.77647e+02 289.245 3.77005e+01 289.245 0.9729 
1 1 1 4   6   11 o 16 1.36995e+01 7.52949e-01 2.99550e+02 42.503  1.03031e+01  9.44196e+00  0.00000e+00 0.00000e+00 1.96051e+02 42.503  1.03499e+02 222.503 0.9635 
1 1 1 4   6   12 f 0  2.64539e+01 7.56324e-01 4.06965e+02 107.374 -1.58986e+01 5.08125e+01  0.00000e+00 0.00000e+00 5.76365e+02 107.374 1.69400e+02 107.374 0.9906 
1 1 1 4   6   13 o 15 9.17204e+00 1.79106e+00 1.15755e+02 139.661 -4.32433e+00 3.67240e+00  0.00000e+00 0.00000e+00 1.96221e+02 139.661 8.04661e+01 139.661 0.9070 
1 1 1 4   6   14 o 3  5.61965e+00 1.37646e+00 1.82556e+02 239.974 -3.86372e+00 -6.68528e+00 0.00000e+00 0.00000e+00 1.39045e+01 239.974 1.68651e+02 59.974  0.9328 
1 1 1 4   6   15 o 9  5.65840e+00 1.51095e+00 1.31797e+02 283.624 1.52928e+00  -6.30990e+00 0.00000e+00 0.00000e+00 6.30333e+01 283.624 6.87636e+01 103.624 0.9194 
1 1 1 4   6   16 o 3  5.00992e+00 1.51583e+00 7.13921e+01 150.908 -3.01510e+00 1.67763e+00  0.00000e+00 0.00000e+00 8.58035e+01 150.908 1.44114e+01 150.908 0.8385 
1 1 1 4   6   17 o 17 7.11579e+00 1.86414e+00 9.58414e+01 278.170 8.30566e-01  -5.78552e+00 0.00000e+00 0.00000e+00 1.46239e+02 278.170 5.03979e+01 278.170 0.9099 
1 1 1 4   7   0  o 14 2.99070e+01 6.08673e-01 6.80056e+02 310.261 5.99922e+00  -7.08380e+00 0.00000e+00 0.00000e+00 3.82528e+02 310.261 2.97528e+02 130.261 0.9445 
1 1 1 4   7   1  o 5  4.50093e+01 8.80831e-01 9.57604e+02 319.483 1.67090e+01  -1.42792e+01 0.00000e+00 0.00000e+00 6.96775e+02 319.483 2.60828e+02 139.483 0.9770 
1 1 1 4   7   2  o 5  2.84155e+01 5.58073e-01 5.21235e+02 207.286 -8.39071e+00 -4.32814e+00 0.00000e+00 0.00000e+00 4.89587e+02 207.286 3.16479e+01 27.286  0.9455 
1 1 1 4   7   3  o 6  2.97106e+01 5.83248e-01 7.27604e+02 8.792   1.21069e+01  1.87256e+00  0.00000e+00 0.00000e+00 3.43626e+02 8.792   3.83977e+02 188.792 0.9583 
1 1 1 4   7   4  o 18 2.79773e+01 5.62172e-01 4.83652e+02 280.691 1.89743e+00  -1.00502e+01 0.00000e+00 0.00000e+00 5.16087e+02 280.691 3.24353e+01 280.691 0.9498 
1 1 1 4   7   5  o 11 2.27121e+01 4.96259e-01 4.06532e+02 39.072  6.42628e+00  5.21725e+00  0.00000e+00 0.00000e+00 3.94471e+02 39.072  1.20616e+01 219.072 0.9375 
1 1 1 4   7   6  o 9  1.44888e+01 4.28086e-01 2.75718e+02 165.846 -4.05389e+00 1.02230e+00  0.00000e+00 0.00000e+00 1.98467e+02 165.846 7.72512e+01 345.846 0.8701 
1 1 1 4   7   7  o 7  2.56588e+01 5.66119e-01 5.89895e+02 223.145 -1.35664e+01 -1.27151e+01 0.00000e+00 0.00000e+00 3.48655e+02 223.145 2.41240e+02 43.145  0.9727 
1 1 1 4   7   8  o 8  2.77807e+01 6.15078e-01 3.56592e+02 135.051 -1.08381e+01 1.08190e+01  0.00000e+00 0.00000e+00 6.53059e+02 135.051 2.96467e+02 135.051 0.9668 
1 1 1 4   7   9  o 7  3.76685e+01 7.74796e-01 5.70639e+02 288.782 1.42710e+01  -4.19634e+01 0.00000e+00 0.00000e+00 8.28848e+02 288.782 2.58208e+02 288.782 0.9887 
1 1 1 4   7   10 o 5  8.46521e+00 8.28421e-01 2.79209e+02 195.960 -6.25899e+00 -1.78999e+00 0.00000e+00 0.00000e+00 1.32120e+01 195.960 2.65997e+02 15.960  0.9196 
1 1 1 4   7   11 o 12 3.80880e+01 8.13265e-01 6.48429e+02 191.109 -8.19889e+01 -1.60983e+01 0.00000e+00 0.00000e+00 7.73012e+02 191.109 1.24583e+02 191.109 0.9940 
1 1 1 4   7   12 o 9  3.51568e+01 8.18730e-01 5.90943e+02 216.511 -8.79059e+01 -6.50742e+01 0.00000e+00 0.00000e+00 7.22267e+02 216.511 1.31324e+02 216.511 0.9954 
1 1 1 4   7   13 f 0  8.77065e+00 1.19855e+00 3.63892e+01 177.754 -2.07104e+00 8.12377e-02  0.00000e+00 0.00000e+00 1.96930e+02 177.754 1.60540e+02 177.754 0.7093 
1 1 1 4   7   14 o 12 7.25209e+00 1.47549e+00 1.84114e+02 281.898 2.01276e+00  -9.55251e+00 0.00000e+00 0.00000e+00 7.33544e+01 281.898 1.10760e+02 101.898 0.9473 
1 1 1 4   7   15 o 4  5.87077e+00 1.48246e+00 7.30714e+01 52.903  2.35845e+00  3.11875e+00  0.00000e+00 0.00000e+00 1.16004e+02 52.903  4.29330e+01 52.903  0.8600 
1 1 1 4   7   16 o 7  1.15313e+01 1.49742e+00 2.00593e+02 18.293  2.13971e+01  7.07371e+00  0.00000e+00 0.00000e+00 2.21234e+02 18.293  2.06402e+01 18.293  0.9776 
1 1 1 4   7   17 o 11 4.05196e+00 1.35772e+00 3.41901e+01 318.135 1.19689e+00  -1.07258e+00 0.00000e+00 0.00000e+00 5.99711e+01 318.135 2.57810e+01 318.135 0.6215 
1 1 1 4   8   0  o 14 5.28753e+01 1.02542e+00 1.18859e+03 96.195  -3.01747e+00 2.77967e+01  0.00000e+00 0.00000e+00 7.64509e+02 96.195  4.24079e+02 276.195 0.9820 
1 1 1 4   8   1  o 4  2.52777e+01 5.33325e-01 5.89025e+02 77.457  1.62755e+00  7.31522e+00  0.00000e+00 0.00000e+00 2.96028e+02 77.457  2.92997e+02 257.457 0.9307 
1 1 1 4   8   2  o 3  4.87708e+01 8.93911e-01 1.03371e+03 143.940 -2.54687e+01 1.85450e+01  0.00000e+00 0.00000e+00 7.71893e+02 143.940 2.61820e+02 323.940 0.9840 
1 1 1 4   8   3  o 3  1.15941e+01 3.58587e-01 1.29349e+02 263.786 -9.12674e-02 -8.38253e-01 0.00000e+00 0.00000e+00 3.99457e+01 263.786 8.94031e+01 83.786  0.3881 
1 1 1 4   8   4  o 5  1.55632e+01 3.97166e-01 3.63540e+02 274.035 2.99548e-01  -4.24671e+00 0.00000e+00 0.00000e+00 1.47470e+02 274.035 2.16070e+02 94.035  0.8727 
1 1 1 4   8   5  o 8  2.06083e+01 4.69158e-01 5.14073e+02 207.385 -8.40076e+00 -4.35184e+00 0.00000e+00 0.00000e+00 2.18986e+02 207.385 2.95088e+02 27.385  0.9456 
1 1 1 4   8   6  o 17 2.75166e+01 5.76378e-01 7.14181e+02 280.128 3.59627e+00  -2.01318e+01 0.00000e+00 0.00000e+00 2.95138e+02 280.128 4.19043e+02 100.128 0.9752 
1 1 1 4   8   7  o 5  2.30597e+01 5.35635e-01 2.85463e+02 206.926 -7.20314e+00 -3.65847e+00 0.00000e+00 0.00000e+00 5.26061e+02 206.926 2.40598e+02 206.926 0.9359 
1 1 1 4   8   8  o 11 2.45574e+01 5.74851e-01 4.75587e+02 20.952  1.68617e+01  6.45624e+00  0.00000e+00 0.00000e+00 4.21628e+02 20.952  5.39585e+01 200.951 0.9719 
1 1 1 4   8   9  o 13 1.57147e+01 6.33901e-01 2.10579e+02 228.108 -4.79683e+00 -5.34775e+00 0.00000e+00 0.00000e+00 3.37156e+02 228.108 1.26577e+02 228.108 0.9275 
1 1 1 4   8   10 o 17 3.39959e+01 7.30691e-01 4.58637e+02 240.371 -2.13842e+01 -3.75981e+01 0.00000e+00 0.00000e+00 8.03486e+02 240.371 3.44848e+02 240.371 0.9884 
1 1 1 4   8   11 o 13 1.45035e+01 7.71238e-01 1.72468e+02 351.809 8.40620e+00  -1.20996e+00 0.00000e+00 0.00000e+00 3.38915e+02 351.809 1.66447e+02 351.809 0.9391 
1 1 1 4   8   12 o 14 2.04794e+01 7.53803e-01 3.40254e+02 342.353 3.52876e+01  -1.12255e+01 0.00000e+00 0.00000e+00 4.17768e+02 342.353 7.75145e+01 342.353 0.9864 
1 1 1 4   8   13 o 15 1.85021e+01 8.27186e-01 3.51632e+02 78.428  9.32507e+00  4.55429e+01  0.00000e+00 0.00000e+00 3.34723e+02 78.428  1.69096e+01 258.428 0.9892 
1 1 1 4   8   14 o 13 1.34195e+01 1.02423e+00 2.79538e+02 12.825  3.16208e+01  7.19855e+00  0.00000e+00 0.00000e+00 2.15564e+02 12.825  6.39739e+01 192.825 0.9845 
1 1 1 4   8   15 o 14 5.72289e+00 1.46599e+00 6.86955e+01 343.908 3.47080e+00  -1.00127e+00 0.00000e+00 0.00000e+00 1.12782e+02 343.908 4.40868e+01 343.908 0.8468 
1 1 1 4   8   16 o 4  6.28852e+00 1.61721e+00 1.72803e+02 258.749 -1.91379e+00 -9.62090e+00 0.00000e+00 0.00000e+00 5.01764e+01 258.749 1.22626e+02 78.750  0.9476 
1 1 1 4   8   17 o 4  6.21176e+00 1.77248e+00 1.45974e+02 57.731  4.38144e+00  6.93899e+00  0.00000e+00 0.00000e+00 7.16255e+01 57.731  7.43489e+01 237.731 0.9369 
1 1 1 4   9   0  o 12 2.70845e+01 5.61551e-01 6.45042e+02 326.615 7.63121e+00  -5.02897e+00 0.00000e+00 0.00000e+00 3.16299e+02 326.615 3.28742e+02 146.615 0.9436 
1 1 1 4   9   1  o 3  1.12737e+01 3.32098e-01 4.92789e+02 33.773  2.28321e+00  1.52695e+00  0.00000e+00 0.00000e+00 1.57998e+02 213.773 6.50787e+02 213.773 0.7894 
1 1 1 4   9   2  o 9  2.83884e+01 5.57023e-01 4.36991e+02 356.558 7.66349e+00  -4.60913e-01 0.00000e+00 0.00000e+00 5.58872e+02 356.558 1.21881e+02 356.558 0.9324 
1 1 1 4   9   3  o 14 3.32292e+01 6.38454e-01 6.69569e+02 136.670 -1.32500e+01 1.24993e+01  0.00000e+00 0.00000e+00 5.45821e+02 136.670 1.23748e+02 316.670 0.9722 
1 1 1 4   9   4  o 8  1.75816e+01 4.21006e-01 5.30010e+02 43.816  5.02032e+00  4.81704e+00  0.00000e+00 0.00000e+00 8.18673e+01 43.816  4.48143e+02 223.816 0.9251 
1 1 1 4   9   5  o 12 1.75619e+01 4.36222e-01 1.67520e+02 332.739 2.32556e+00  -1.19832e+00 0.00000e+00 0.00000e+00 3.45833e+02 332.739 1.78313e+02 332.739 0.7771 
1 1 1 4   9   6  o 15 2.98157e+01 6.11490e-01 2.25902e+02 41.952  5.19270e+00  4.66770e+00  0.00000e+00 0.00000e+00 8.11760e+02 41.952  5.85858e+02 41.952  0.9253 
1 1 1 4   9   7  o 7  3.68618e+01 7.31423e-01 4.45273e+02 252.901 -5.87827e+00 -1.91087e+01 0.00000e+00 0.00000e+00 9.05682e+02 252.901 4.60409e+02 252.901 0.9747 
1 1 1 4   9   8  o 6  4.72301e+01 9.04487e-01 1.00807e+03 26.267  6.49869e+01  3.20725e+01  0.00000e+00 0.00000e+00 7.55062e+02 26.267  2.53005e+02 206.267 0.9931 
1 1 1 4   9   9  o 17 2.27627e+01 5.88907e-01 4.91866e+02 274.714 1.99990e+00  -2.42521e+01 0.00000e+00 0.00000e+00 3.45734e+02 274.714 1.46131e+02 94.714  0.9792 
1 1 1 4   9   10 o 19 3.31624e+01 7.23150e-01 4.42246e+02 300.263 2.04991e+01  -3.51323e+01 0.00000e+00 0.00000e+00 7.87980e+02 300.263 3.45733e+02 300.263 0.9876 
1 1 1 4   9   11 o 15 2.01978e+01 8.49040e-01 1.92812e+02 354.979 1.30570e+01  -1.14705e+00 0.00000e+00 0.00000e+00 5.35960e+02 354.979 3.43148e+02 354.979 0.9611 
1 1 1 4   9   12 o 1  2.02965e+01 8.89507e-01 2.80235e+02 237.015 -1.60846e+01 -2.47826e+01 0.00000e+00 0.00000e+00 4.68355e+02 237.015 1.88120e+02 237.015 0.9829 
1 1 1 4   9   13 f 0  1.16502e+01 1.35057e+00 1.49583e+02 28.549  9.34796e+00  5.08580e+00  0.00000e+00 0.00000e+00 2.66243e+02 28.549  1.16659e+02 28.549  0.9518 
1 1 1 4   9   14 o 15 8.93702e+00 1.27104e+00 2.24344e+02 32.248  1.34226e+01  8.46856e+00  0.00000e+00 0.00000e+00 9.98484e+01 32.248  1.24496e+02 212.248 0.9680 
1 1 1 4   9   15 o 19 8.60163e+00 1.37126e+00 1.77934e+02 229.771 -9.52010e+00 -1.12539e+01 0.00000e+00 0.00000e+00 1.33059e+02 229.771 4.48755e+01 49.771  0.9655 
1 1 1 4   9   16 o 12 5.47335e+00 1.52295e+00 6.84340e+01 25.710  3.20600e+00  1.54362e+00  0.00000e+00 0.00000e+00 1.04443e+02 25.710  3.60085e+01 25.710  0.8441 
1 1 1 4   9   17 o 4  5.07996e+00 1.61349e+00 7.18869e+01 344.389 3.50121e+00  -9.78257e-01 0.00000e+00 0.00000e+00 8.91468e+01 344.389 1.72599e+01 344.389 0.8479 
1 1 1 4   10  0  o 8  3.29962e+01 6.24082e-01 6.82565e+02 46.434  7.92712e+00  8.33430e+00  0.00000e+00 0.00000e+00 5.03340e+02 46.434  1.79225e+02 226.434 0.9555 
1 1 1 4   10  1  o 19 1.05086e+01 5.18181e-01 2.26855e+02 331.100 1.00898e+00  -5.56980e-01 0.00000e+00 0.00000e+00 3.00497e+01 151.100 2.56905e+02 151.100 0.4978 
1 1 1 4   10  2  o 15 2.32129e+01 4.80501e-01 4.09719e+02 284.756 1.97338e+00  -7.49236e+00 0.00000e+00 0.00000e+00 4.05127e+02 284.756 4.59216e+00 104.756 0.9330 
1 1 1 4   10  3  o 19 2.93504e+01 5.76910e-01 4.54116e+02 325.613 8.90660e+00  -6.09545e+00 0.00000e+00 0.00000e+00 5.97655e+02 325.613 1.43540e+02 325.613 0.9525 
1 1 1 4   10  4  o 4  1.40079e+01 3.73112e-01 2.45265e+02 212.207 -2.54086e+00 -1.60048e+00 0.00000e+00 0.00000e+00 1.81701e+02 212.207 6.35641e+01 32.207  0.8102 
1 1 1 4   10  5  o 11 1.29853e+01 3.83336e-01 4.60698e+02 358.678 5.29472e+00  -1.22216e-01 0.00000e+00 0.00000e+00 2.11684e+01 178.678 4.81866e+02 178.678 0.8998 
1 1 1 4   10  6  o 4  3.24144e+01 6.19042e-01 5.24906e+02 27.487  1.55925e+01  8.11235e+00  0.00000e+00 0.00000e+00 6.58991e+02 27.487  1.34086e+02 27.487  0.9711 
1 1 1 4   10  7  o 7  1.95017e+01 4.78603e-01 3.00940e+02 213.625 -6.40076e+00 -4.25661e+00 0.00000e+00 0.00000e+00 3.82837e+02 213.625 8.18969e+01 213.625 0.9325 
1 1 1 4   10  8  f 0  2.49122e+01 5.62422e-01 3.77907e+02 59.724  7.31806e+00  1.25353e+01  0.00000e+00 0.00000e+00 5.25682e+02 59.724  1.47774e+02 59.724  0.9649 
1 1 1 4   10  9  o 19 3.08298e+01 7.20561e-01 6.13571e+02 256.505 -9.51632e+00 -3.96523e+01 0.00000e+00 0.00000e+00 5.30607e+02 256.505 8.29640e+01 76.505  0.9877 
1 1 1 4   10  10 o 14 2.98156e+01 7.06908e-01 4.33673e+02 130.265 -2.31852e+01 2.73727e+01  0.00000e+00 0.00000e+00 6.70499e+02 130.265 2.36826e+02 130.265 0.9860 
1 1 1 4   10  11 o 10 2.85883e+01 7.66594e-01 4.80355e+02 318.849 3.50681e+01  -3.06472e+01 0.00000e+00 0.00000e+00 5.81340e+02 318.849 1.00985e+02 318.849 0.9892 
1 1 1 4   10  12 o 16 1.48795e+01 8.28654e-01 2.84494e+02 187.343 -2.20128e+01 -2.83677e+00 0.00000e+00 0.00000e+00 2.61095e+02 187.343 2.33989e+01 7.343   0.9772 
1 1 1 4   10  13 o 1  1.95165e+01 8.47344e-01 3.51971e+02 338.795 4.47404e+01  -1.73581e+01 0.00000e+00 0.00000e+00 3.72224e+02 338.795 2.02530e+01 338.795 0.9895 
1 1 1 4   10  14 o 9  6.88426e+00 1.34163e+00 2.17901e+02 10.697  1.13531e+01  2.14461e+00  0.00000e+00 0.00000e+00 2.86546e+01 10.697  1.89247e+02 190.697 0.9557 
1 1 1 4   10  15 o 10 7.45152e+00 1.44406e+00 1.59120e+02 190.152 -1.08362e+01 -1.94036e+00 0.00000e+00 0.00000e+00 1.06929e+02 190.152 5.21909e+01 10.152  0.9534 
1 1 1 4   10  16 o 6  6.88495e+00 1.70555e+00 6.43530e+01 131.211 -2.50944e+00 2.86544e+00  0.00000e+00 0.00000e+00 1.56108e+02 131.211 9.17550e+01 131.211 0.8558 
1 1 1 4   10  17 o 13 4.56594e+00 1.46784e+00 6.39371e+01 96.612  -3.85736e-01 3.32790e+00  0.00000e+00 0.00000e+00 7.82392e+01 96.612  1.43020e+01 96.612  0.8329 
1 1 1 4   11  0  o 18 3.77321e+01 6.99729e-01 8.57694e+02 241.168 -7.76916e+00 -1.41134e+01 0.00000e+00 0.00000e+00 5.16777e+02 241.168 3.40917e+02 61.168  0.9684 
1 1 1 4   11  1  o 12 1.59950e+01 4.34439e-01 2.97435e+02 239.153 -1.62138e+00 -2.71480e+00 0.00000e+00 0.00000e+00 1.96746e+02 239.153 1.00688e+02 59.153  0.8213 
1 1 1 4   11  2  o 19 1.56140e+01 3.66376e-01 8.49260e+01 91.481  -2.74749e-02 1.06236e+00  0.00000e+00 0.00000e+00 1.90087e+02 91.481  1.05161e+02 91.481  0.4682 
1 1 1 4   11  3  o 10 3.07101e+01 5.68763e-01 3.99400e+02 192.214 -9.58351e+00 -2.07454e+00 0.00000e+00 0.00000e+00 6.95364e+02 192.214 2.95964e+02 192.214 0.9475 
1 1 1 4   11  4  o 1  1.17936e+01 3.56632e-01 2.23121e+02 69.850  7.85523e-01  2.14070e+00  0.00000e+00 0.00000e+00 1.04677e+02 69.850  1.18444e+02 249.849 0.7388 
1 1 1 4   11  5  o 18 1.16648e+01 3.85300e-01 1.09806e+02 93.209  -6.31284e-02 1.12589e+00  0.00000e+00 0.00000e+00 1.05106e+02 93.209  4.70068e+00 273.209 0.4898 
1 1 1 4   11  6  o 3  2.37457e+01 5.05096e-01 3.83016e+02 201.411 -1.02081e+01 -4.00277e+00 0.00000e+00 0.00000e+00 4.68282e+02 201.411 8.52659e+01 201.411 0.9532 
1 1 1 4   11  7  o 19 5.55383e+01 9.78029e-01 9.54979e+02 108.470 -2.15756e+01 6.45931e+01  0.00000e+00 0.00000e+00 1.11787e+03 108.470 1.62892e+02 108.470 0.9926 
1 1 1 4   11  8  o 3  8.54216e+00 5.43932e-01 2.03961e+02 188.889 -3.26396e+00 -5.10476e-01 0.00000e+00 0.00000e+00 6.25909e+01 188.889 1.41370e+02 8.889   0.8301 
1 1 1 4   11  9  o 13 1.76031e+01 5.89356e-01 4.00098e+02 2.789   1.52513e+01  7.43070e-01  0.00000e+00 0.00000e+00 2.39302e+02 2.789   1.60796e+02 182.789 0.9667 
1 1 1 4   11  10 o 18 2.98881e+01 6.86878e-01 5.73101e+02 225.712 -3.59058e+01 -3.68094e+01 0.00000e+00 0.00000e+00 5.38514e+02 225.712 3.45871e+01 45.712  0.9902 
1 1 1 4   11  11 o 3  7.85925e+00 1.09391e+00 2.17171e+02 215.560 -5.11699e+00 -3.65804e+00 0.00000e+00 0.00000e+00 5.32833e+01 215.560 1.63887e+02 35.560  0.9166 
1 1 1 4   11  12 o 10 1.73276e+01 7.86519e-01 3.01746e+02 116.879 -1.24648e+01 2.45920e+01  0.00000e+00 0.00000e+00 3.36503e+02 116.879 3.47569e+01 116.879 0.9817 
1 1 1 4   11  13 o 12 1.08463e+01 1.09541e+00 1.44713e+02 349.374 1.01285e+01  -1.90027e+00 0.00000e+00 0.00000e+00 2.41741e+02 349.374 9.70282e+01 349.374 0.9502 
1 1 1 4   11  14 o 8  7.51591e+00 1.44461e+00 1.05065e+02 119.249 -2.85246e+00 5.09365e+00  0.00000e+00 0.00000e+00 1.51169e+02 119.249 4.61043e+01 119.249 0.9098 
1 1 1 4   11  15 o 6  4.61836e+00 1.34628e+00 3.73812e+01 302.922 9.14181e-01  -1.41190e+00 0.00000e+00 0.00000e+00 7.29584e+01 302.922 3.55772e+01 302.922 0.6380 
1 1 1 4   11  16 o 4  4.81702e+00 1.42798e+00 1.58083e+02 133.896 -5.27549e+00 5.48280e+00  0.00000e+00 0.00000e+00 9.85629e+00 133.896 1.48227e+02 313.896 0.9318 
1 1 1 4   11  17 o 10 5.60300e+00 1.70660e+00 4.53110e+01 180.436 -2.50531e+00 -1.90703e-02 0.00000e+00 0.00000e+00 1.15056e+02 180.436 6.97449e+01 180.436 0.7656 
1 1 1 4   12  0  o 19 4.13175e+01 8.59074e-01 9.06726e+02 73.751  5.07443e+00  1.74108e+01  0.00000e+00 0.00000e+00 6.03861e+02 73.751  3.02865e+02 253.751 0.9720 
1 1 1 4   12  1  o 1  2.68696e+01 8.99942e-01 7.64189e+02 153.981 -1.18921e+01 5.80494e+00  0.00000e+00 0.00000e+00 2.07604e+02 153.981 5.56585e+02 333.981 0.9614 
1 1 1 4   12  2  o 12 5.12126e+00 3.44603e-01 1.55533e+02 203.088 -5.76443e-01 -2.45731e-01 0.00000e+00 0.00000e+00 9.79494e+01 23.088  2.53482e+02 23.088  0.2989 
1 1 1 4   12  3  o 1  1.18839e+01 4.01771e-01 3.07005e+02 157.217 -2.65892e+00 1.11678e+00  0.00000e+00 0.00000e+00 5.11149e+01 157.217 2.55890e+02 337.217 0.8010 
1 1 1 4   12  4  o 8  5.06230e+00 4.18127e-01 1.39571e+02 345.378 5.86494e-01  -1.53011e-01 0.00000e+00 0.00000e+00 8.43544e+01 165.378 2.23925e+02 165.378 0.2899 
1 1 1 4   12  5  o 11 1.63765e+01 4.13279e-01 3.24984e+02 236.322 -2.84164e+00 -4.26438e+00 0.00000e+00 0.00000e+00 2.27058e+02 236.322 9.79263e+01 56.322  0.8962 
1 1 1 4   12  6  o 9  2.35832e+01 5.06600e-01 3.77388e+02 109.441 -3.55728e+00 1.00785e+01  0.00000e+00 0.00000e+00 4.66950e+02 109.441 8.95615e+01 109.441 0.9520 
1 1 1 4   12  7  o 6  1.70500e+01 4.66655e-01 2.95630e+02 229.610 -4.26017e+00 -5.00749e+00 0.00000e+00 0.00000e+00 2.94433e+02 229.610 1.19749e+00 49.610  0.9205 
1 1 1 4   12  8  o 19 2.10230e+01 5.24494e-01 4.19972e+02 310.463 1.08500e+01  -1.27201e+01 0.00000e+00 0.00000e+00 3.46222e+02 310.463 7.37498e+01 130.463 0.9696 
1 1 1 4   12  9  f 0  3.60358e+01 7.25851e-01 7.02536e+02 71.651  1.71298e+01  5.16466e+01  0.00000e+00 0.00000e+00 6.38976e+02 71.651  6.35595e+01 251.651 0.9908 
1 1 1 4   12  10 o 7  3.05774e+01 8.27305e-01 3.00822e+02 291.716 1.00820e+01  -2.53151e+01 0.00000e+00 0.00000e+00 8.26341e+02 291.716 5.25519e+02 291.716 0.9815 
1 1 1 4   12  11 o 15 2.82962e+01 7.25355e-01 5.35468e+02 281.390 1.15506e+01  -5.73384e+01 0.00000e+00 0.00000e+00 5.17661e+02 281.390 1.78069e+01 101.390 0.9914 
1 1 1 4   12  12 o 7  9.16756e+00 1.11691e+00 1.67286e+02 234.463 -4.83548e+00 -6.76985e+00 0.00000e+00 0.00000e+00 1.55294e+02 234.463 1.19917e+01 54.463  0.9378 
1 1 1 4   12  13 o 7  2.15688e+01 8.23229e-01 3.36456e+02 280.411 9.19183e+00  -5.00283e+01 0.00000e+00 0.00000e+00 4.64330e+02 280.411 1.27873e+02 280.411 0.9901 
1 1 1 4   12  14 o 3  5.52026e+00 1.37650e+00 1.07301e+02 163.186 -4.31348e+00 1.30348e+00  0.00000e+00 0.00000e+00 7.48404e+01 163.186 3.24601e+01 343.186 0.8805 
1 1 1 4   12  15 o 5  4.15901e+00 1.25410e+00 8.52603e+01 260.598 -5.89521e-01 -3.56023e+00 0.00000e+00 0.00000e+00 4.65833e+01 260.598 3.86771e+01 80.598  0.8466 
1 1 1 4   12  16 o 5  8.87479e+00 1.68000e+00 2.23889e+02 27.925  1.65822e+01  8.78895e+00  0.00000e+00 0.00000e+00 9.91983e+01 27.925  1.24691e+02 207.925 0.9730 
1 1 1 4   12  17 o 11 5.09362e+00 1.59022e+00 7.29561e+01 324.449 3.20995e+00  -2.29394e+00 0.00000e+00 0.00000e+00 9.10708e+01 324.449 1.81147e+01 324.449 0.8614 
1 1 1 4   13  0  o 19 2.95158e+01 5.37892e-01 5.26643e+02 142.532 -8.19942e+00 6.28445e+00  0.00000e+00 0.00000e+00 5.28304e+02 142.532 1.66083e+00 142.532 0.9503 
1 1 1 4   13  1  o 1  3.09316e+01 6.74139e-01 6.96923e+02 24.219  1.24225e+01  5.58794e+00  0.00000e+00 0.00000e+00 4.23047e+02 24.219  2.73876e+02 204.219 0.9626 
1 1 1 4   13  2  o 8  1.01892e+01 3.37534e-01 1.09826e+02 53.233  5.16798e-01  6.91651e-01  0.00000e+00 0.00000e+00 4.19270e+01 53.233  6.78986e+01 233.233 0.3959 
1 1 1 4   13  3  o 8  2.23093e+01 5.45379e-01 3.78221e+02 35.332  5.27816e+00  3.74153e+00  0.00000e+00 0.00000e+00 3.93132e+02 35.332  1.49109e+01 35.332  0.9191 
1 1 1 4   13  4  o 6  1.80227e+01 4.11788e-01 5.32359e+02 154.819 -7.37706e+00 3.46847e+00  0.00000e+00 0.00000e+00 1.02548e+02 154.819 4.29811e+02 334.819 0.9365 
1 1 1 4   13  5  o 19 1.88124e+01 4.36900e-01 3.10865e+02 67.394  2.15014e+00  5.16385e+00  0.00000e+00 0.00000e+00 3.29887e+02 67.394  1.90222e+01 67.394  0.9055 
1 1 1 4   13  6  o 15 2.65604e+01 5.43045e-01 2.45733e+02 233.534 -4.63542e+00 -6.27217e+00 0.00000e+00 0.00000e+00 6.86680e+02 233.534 4.40948e+02 233.534 0.9335 
1 1 1 4   13  7  o 1  1.96254e+01 4.90762e-01 4.57209e+02 353.781 1.16004e+01  -1.26416e+00 0.00000e+00 0.00000e+00 2.48297e+02 353.781 2.08912e+02 173.781 0.9561 
1 1 1 4   13  8  o 11 3.46357e+01 6.81389e-01 4.29739e+02 85.110  2.38118e+00  2.78335e+01  0.00000e+00 0.00000e+00 8.48571e+02 85.110  4.18832e+02 85.110  0.9819 
1 1 1 4   13  9  o 9  3.15095e+01 6.68205e-01 6.17069e+02 257.717 -9.13935e+00 -4.19782e+01 0.00000e+00 0.00000e+00 5.52973e+02 257.717 6.40962e+01 77.717  0.9883 
1 1 1 4   13  10 o 14 3.52637e+01 7.47972e-01 6.73112e+02 344.415 6.81025e+01  -1.89958e+01 0.00000e+00 0.00000e+00 6.41890e+02 344.415 3.12223e+01 164.415 0.9929 
1 1 1 4   13  11 o 13 1.60931e+01 7.63068e-01 2.37772e+02 303.683 8.14946e+00  -1.22272e+01 0.00000e+00 0.00000e+00 3.45417e+02 303.683 1.07645e+02 303.683 0.9653 
1 1 1 4   13  12 o 16 1.51363e+01 8.20607e-01 1.99693e+02 2.270   1.73811e+01  6.88835e-01  0.00000e+00 0.00000e+00 3.51630e+02 2.270   1.51938e+02 2.270   0.9708 
1 1 1 4   13  13 o 1  1.79598e+01 8.49738e-01 2.96958e+02 77.028  8.79929e+00  3.81985e+01  0.00000e+00 0.00000e+00 3.67820e+02 77.028  7.08620e+01 77.028  0.9872 
1 1 1 4   13  14 o 9  1.63510e+01 9.65976e-01 3.16074e+02 316.901 3.32414e+01  -3.11053e+01 0.00000e+00 0.00000e+00 2.89850e+02 316.901 2.62239e+01 136.901 0.9890 
1 1 1 4   13  15 o 13 1.02877e+01 1.39419e+00 1.81014e+02 166.650 -1.72159e+01 4.08568e+00  0.00000e+00 0.00000e+00 1.93150e+02 166.650 1.21365e+01 166.650 0.9713 
1 1 1 4   13  16 o 6  1.35005e+01 1.42834e+00 1.57624e+02 315.791 1.67142e+01  -1.62592e+01 0.00000e+00 0.00000e+00 3.36540e+02 315.791 1.78916e+02 315.791 0.9783 
1 1 1 4   13  17 o 3  1.39855e+01 1.66643e+00 2.52791e+02 79.128  6.74506e+00  3.51203e+01  0.00000e+00 0.00000e+00 2.62668e+02 79.128  9.87702e+00 79.128  0.9859 
1 1 1 4   14  0  o 19 2.30292e+01 4.43491e-01 5.45247e+02 45.916  5.65603e+00  5.83984e+00  0.00000e+00 0.00000e+00 2.65717e+02 45.916  2.79530e+02 225.916 0.9363 
1 1 1 4   14  1  o 19 2.17953e+01 6.09247e-01 4.70231e+01 333.398 5.65470e-01  -2.83195e-01 0.00000e+00 0.00000e+00 2.00062e+02 333.398 1.53039e+02 333.398 0.3014 
1 1 1 4   14  2  o 14 1.82536e+01 3.93712e-01 2.50158e+02 34.112  2.19083e+00  1.48396e+00  0.00000e+00 0.00000e+00 2.85430e+02 34.112  3.52719e+01 34.112  0.7800 
1 1 1 4   14  3  o 14 5.75068e+00 5.46923e-01 1.54022e+02 120.334 -3.37977e-01 5.77593e-01  0.00000e+00 0.00000e+00 8.54085e+01 300.334 2.39430e+02 300.334 0.3172 
1 1 1 4   14  4  f 0  1.75509e+01 4.09183e-01 4.54684e+02 314.324 4.35043e+00  -4.45436e+00 0.00000e+00 0.00000e+00 1.49878e+02 314.324 3.04806e+02 134.324 0.9157 
1 1 1 4   14  5  o 13 2.10738e+01 4.62791e-01 2.51488e+02 78.316  1.01947e+00  4.92981e+00  0.00000e+00 0.00000e+00 4.57245e+02 78.316  2.05757e+02 78.316  0.8942 
1 1 1 4   14  6  o 8  2.79619e+01 5.60092e-01 5.71884e+02 17.156  1.69603e+01  5.23570e+00  0.00000e+00 0.00000e+00 4.49559e+02 17.156  1.22325e+02 197.156 0.9714 
1 1 1 4   14  7  o 1  3.59977e+01 6.82791e-01 8.16048e+02 191.039 -3.68210e+01 -7.18345e+00 0.00000e+00 0.00000e+00 5.19163e+02 191.039 2.96885e+02 11.039  0.9866 
1 1 1 4   14  8  o 1  4.93787e+01 8.94986e-01 1.08787e+03 32.628  7.84590e+01  5.02304e+01  0.00000e+00 0.00000e+00 7.58038e+02 32.628  3.29829e+02 212.628 0.9946 
1 1 1 4   14  9  o 4  1.03590e+01 7.95437e-01 1.81424e+02 207.536 -3.64862e+00 -1.90225e+00 0.00000e+00 0.00000e+00 1.56325e+02 207.536 2.50982e+01 27.536  0.8678 
1 1 1 4   14  10 o 7  9.31999e+00 8.09482e-01 1.28383e+02 279.631 5.92158e-01  -3.48947e+00 0.00000e+00 0.00000e+00 1.66729e+02 279.631 3.83462e+01 279.631 0.8431 
1 1 1 4   14  11 o 11 1.92649e+01 7.65468e-01 2.82472e+02 254.825 -6.01046e+00 -2.21599e+01 0.00000e+00 0.00000e+00 4.24761e+02 254.825 1.42289e+02 254.825 0.9780 
1 1 1 4   14  12 o 17 3.14385e+01 7.82906e-01 4.74931e+02 317.109 6.32892e+01  -5.87934e+01 0.00000e+00 0.00000e+00 6.97713e+02 317.109 2.22783e+02 317.109 0.9942 
1 1 1 4   14  13 o 14 1.24075e+01 1.00373e+00 2.90041e+02 208.948 -2.22487e+01 -1.23061e+01 0.00000e+00 0.00000e+00 1.65931e+02 208.948 1.24111e+02 28.948  0.9801 
1 1 1 4   14  14 o 16 1.17812e+01 1.18259e+00 1.47850e+02 353.330 1.41413e+01  -1.65375e+00 0.00000e+00 0.00000e+00 2.77794e+02 353.330 1.29944e+02 353.330 0.9642 
1 1 1 4   14  15 o 4  1.13062e+01 1.31527e+00 1.76464e+02 350.168 1.94094e+01  -3.36371e+00 0.00000e+00 0.00000e+00 2.35982e+02 350.168 5.95185e+01 350.168 0.9743 
1 1 1 4   14  16 o 5  6.50398e+00 1.67994e+00 1.69194e+02 0.414   1.03897e+01  7.51199e-02  0.00000e+00 0.00000e+00 6.21170e+01 0.414   1.07077e+02 180.414 0.9506 
1 1 1 4   14  17 o 3  3.60789e+00 1.24999e+00 8.08099e+01 181.258 -3.81854e+00 -8.38614e-02 0.00000e+00 0.00000e+00 3.46652e+01 181.258 4.61447e+01 1.258   0.8562 
1 1 1 4   15  0  o 12 3.75383e+01 6.57253e-01 7.01982e+02 246.301 -6.65146e+00 -1.51530e+01 0.00000e+00 0.00000e+00 6.66434e+02 246.301 3.55487e+01 66.301  0.9693 
1 1 1 4   15  1  o 18 9.99728e+00 3.47450e-01 2.67958e+02 21.516  2.01204e+00  7.93214e-01  0.00000e+00 0.00000e+00 3.82567e+00 21.516  2.64133e+02 201.516 0.7228 
1 1 1 4   15  2  o 4  1.67395e+01 3.82082e-01 1.92574e+02 40.968  1.38216e+00  1.20013e+00  0.00000e+00 0.00000e+00 2.27970e+02 40.968  3.53964e+01 40.968  0.6679 
1 1 1 4   15  3  o 14 1.25231e+01 4.55031e-01 2.05629e+02 204.326 -1.74860e+00 -7.90483e-01 0.00000e+00 0.00000e+00 1.16590e+02 204.326 8.90391e+01 24.326  0.6840 
1 1 1 4   15  4  o 6  3.10696e+01 5.83441e-01 6.39628e+02 100.391 -2.76091e+00 1.50567e+01  0.00000e+00 0.00000e+00 4.90194e+02 100.391 1.49434e+02 280.391 0.9668 
1 1 1 4   15  5  o 5  2.42213e+01 5.01810e-01 7.03495e+02 224.931 -1.09868e+01 -1.09603e+01 0.00000e+00 0.00000e+00 1.77612e+02 224.931 5.25884e+02 44.931  0.9672 
1 1 1 4   15  6  o 13 2.78208e+01 5.61886e-01 3.73763e+02 346.039 1.11525e+01  -2.77252e+00 0.00000e+00 0.00000e+00 6.25788e+02 346.039 2.52025e+02 346.039 0.9554 
1 1 1 4   15  7  o 12 3.12331e+01 6.22546e-01 4.91860e+02 131.737 -1.30457e+01 1.46230e+01  0.00000e+00 0.00000e+00 6.51971e+02 131.737 1.60111e+02 131.737 0.9741 
1 1 1 4   15  8  o 17 2.65929e+01 5.86908e-01 5.21496e+02 334.500 2.19817e+01  -1.04848e+01 0.00000e+00 0.00000e+00 4.57217e+02 334.500 6.42783e+01 154.500 0.9792 
1 1 1 4   15  9  o 1  1.02618e+01 9.45592e-01 1.51531e+02 136.030 -2.42047e+00 2.33501e+00  0.00000e+00 0.00000e+00 1.69862e+02 136.030 1.83310e+01 136.030 0.8336 
1 1 1 4   15  10 f 0  2.66904e+01 7.96912e-01 3.34914e+02 238.195 -1.33136e+01 -2.14686e+01 0.00000e+00 0.00000e+00 6.47380e+02 238.195 3.12467e+02 238.195 0.9800 
1 1 1 4   15  11 o 5  1.28269e+01 7.92383e-01 1.43860e+02 310.410 5.02263e+00  -5.89956e+00 0.00000e+00 0.00000e+00 3.05371e+02 310.410 1.61512e+02 310.410 0.9330 
1 1 1 4   15  12 o 14 1.22135e+01 1.14317e+00 1.90573e+02 14.600  1.16930e+01  3.04572e+00  0.00000e+00 0.00000e+00 2.48237e+02 14.600  5.76644e+01 14.600  0.9577 
1 1 1 4   15  13 o 18 1.00420e+01 1.08054e+00 1.97265e+02 260.901 -2.16516e+00 -1.35194e+01 0.00000e+00 0.00000e+00 1.65220e+02 260.901 3.20454e+01 80.901  0.9628 
1 1 1 4   15  14 o 12 4.82645e+00 1.32998e+00 1.15593e+02 67.421  1.79916e+00  4.32668e+00  0.00000e+00 0.00000e+00 4.45494e+01 67.421  7.10434e+01 247.421 0.8855 
1 1 1 4   15  15 o 7  1.46848e+01 1.14218e+00 2.47520e+02 92.802  -1.81464e+00 3.70727e+01  0.00000e+00 0.00000e+00 2.94841e+02 92.802  4.73211e+01 92.802  0.9864 
1 1 1 4   15  16 o 14 5.45717e+00 1.56400e+00 8.02379e+01 284.708 1.10673e+00  -4.21620e+00 0.00000e+00 0.00000e+00 9.86161e+01 284.708 1.83782e+01 284.708 0.8760 
1 1 1 4   15  17 o 6  3.83249e+00 1.29053e+00 5.80032e+01 116.634 -1.27269e+00 2.53769e+00  0.00000e+00 0.00000e+00 5.62224e+01 116.634 1.78074e+00 296.634 0.7973 
1 1 1 4   16  0  f 0  3.64123e+01 6.40573e-01 8.20120e+02 357.312 2.43523e+01  -1.14324e+00 0.00000e+00 0.00000e+00 5.20847e+02 357.312 2.99274e+02 177.312 0.9793 
1 1 1 4   16  1  o 13 3.25573e+01 6.52904e-01 6.73796e+02 252.931 -5.04477e+00 -1.64298e+01 0.00000e+00 0.00000e+00 5.14566e+02 252.931 1.59230e+02 72.931  0.9705 
1 1 1 4   16  2  o 12 1.17256e+01 3.36282e-01 2.85019e+02 121.213 -9.63629e-01 1.59035e+00  0.00000e+00 0.00000e+00 1.19406e+01 121.213 2.73078e+02 301.213 0.6733 
1 1 1 4   16  3  f 0  5.77363e+00 4.72397e-01 2.90955e+02 309.916 8.28189e-01  -9.89953e-01 0.00000e+00 0.00000e+00 1.73686e+02 129.916 4.64640e+02 129.916 0.5400 
1 1 1 4   16  4  o 1  1.22783e+01 3.76364e-01 1.80769e+02 358.067 1.69563e+00  -5.72331e-02 0.00000e+00 0.00000e+00 1.15308e+02 358.067 6.54605e+01 178.067 0.6411 
1 1 1 4   16  5  o 12 7.86491e+00 4.10503e-01 2.24320e+02 171.708 -1.58121e+00 2.30444e-01  0.00000e+00 0.00000e+00 4.11031e+01 351.708 2.65424e+02 351.708 0.6194 
1 1 1 4   16  6  o 3  3.97282e+01 7.26075e-01 7.30668e+02 313.636 2.19446e+01  -2.30150e+01 0.00000e+00 0.00000e+00 7.39507e+02 313.636 8.83928e+00 313.636 0.9841 
1 1 1 4   16  7  o 17 2.26160e+01 5.19063e-01 5.21482e+02 285.932 4.12844e+00  -1.44623e+01 0.00000e+00 0.00000e+00 2.99953e+02 285.932 2.21529e+02 105.932 0.9662 
1 1 1 4   16  8  o 18 1.58818e+01 5.14271e-01 2.95845e+02 58.226  4.34524e+00  7.01512e+00  0.00000e+00 0.00000e+00 2.63591e+02 58.226  3.22542e+01 238.225 0.9373 
1 1 1 4   16  9  o 6  2.72232e+01 6.30564e-01 5.56669e+02 201.920 -3.42876e+01 -1.37973e+01 0.00000e+00 0.00000e+00 4.52129e+02 201.920 1.04541e+02 21.920  0.9864 
1 1 1 4   16  10 o 1  4.72317e+01 9.08556e-01 7.49202e+02 79.641  1.77696e+01  9.72107e+01  0.00000e+00 0.00000e+00 1.01548e+03 79.641  2.66273e+02 79.641  0.9949 
1 1 1 4   16  11 o 1  3.53112e+01 7.99319e-01 6.78243e+02 349.654 9.86772e+01  -1.80141e+01 0.00000e+00 0.00000e+00 6.40527e+02 349.654 3.77161e+01 169.654 0.9950 
1 1 1 4   16  12 o 15 3.19260e+01 8.00036e-01 4.99365e+02 203.854 -8.08179e+01 -3.57365e+01 0.00000e+00 0.00000e+00 6.91518e+02 203.854 1.92153e+02 203.854 0.9943 
1 1 1 4   16  13 o 11 1.33040e+01 9.81217e-01 1.72006e+02 17.109  1.67237e+01  5.14782e+00  0.00000e+00 0.00000e+00 3.12313e+02 17.109  1.40307e+02 17.109  0.9710 
1 1 1 4   16  14 o 7  1.01831e+01 1.21447e+00 1.75351e+02 359.820 1.57108e+01  -4.93203e-02 0.00000e+00 0.00000e+00 1.93830e+02 359.820 1.84790e+01 359.820 0.9676 
1 1 1 4   16  15 o 5  2.38690e+01 1.00127e+00 3.77992e+02 279.162 1.55576e+01  -9.64635e+01 0.00000e+00 0.00000e+00 5.11069e+02 279.162 1.33078e+02 279.162 0.9949 
1 1 1 4   16  16 o 13 4.40134e+00 1.43071e+00 7.31330e+01 89.011  5.97478e-02  3.45972e+00  0.00000e+00 0.00000e+00 6.50125e+01 89.011  8.12053e+00 269.011 0.8390 
1 1 1 4   16  17 o 15 5.83108e+00 1.67901e+00 1.11563e+02 189.285 -6.42588e+00 -1.05052e+00 0.00000e+00 0.00000e+00 8.88779e+01 189.285 2.26852e+01 9.285   0.9196 
1 1 1 4   16  18 o 2  9.37269e+00 2.24268e+00 8.99741e+01 199.322 -5.89817e+00 -2.06803e+00 0.00000e+00 0.00000e+00 2.30672e+02 199.322 1.40698e+02 199.322 0.9161 
1 1 1 4   17  0  o 11 2.72279e+01 5.04124e-01 6.39639e+02 229.816 -8.94230e+00 -1.05878e+01 0.00000e+00 0.00000e+00 3.46607e+02 229.816 2.93032e+02 49.816  0.9632 
1 1 1 4   17  1  o 1  2.37830e+01 5.12331e-01 5.16625e+02 90.514  -6.47313e-02 7.21384e+00  0.00000e+00 0.00000e+00 3.13319e+02 90.514  2.03305e+02 270.514 0.9278 
1 1 1 4   17  2  o 2  1.24248e+01 3.41013e-01 7.08286e+01 170.311 -6.99005e-01 1.19339e-01  0.00000e+00 0.00000e+00 8.52557e+01 170.311 1.44272e+01 170.311 0.3340 
1 1 1 4   17  3  o 1  1.49791e+01 4.59780e-01 5.19355e+02 169.399 -5.78605e+00 1.08297e+00  0.00000e+00 0.00000e+00 6.33978e+00 349.399 5.25695e+02 349.399 0.9106 
1 1 1 4   17  4  o 14 1.19833e+01 3.73092e-01 3.16150e+02 185.404 -3.24801e+00 -3.07252e-01 0.00000e+00 0.00000e+00 5.68825e+01 185.404 2.59268e+02 5.404   0.8277 
1 1 1 4   17  5  o 6  1.68612e+01 4.81257e-01 2.60234e+02 77.384  8.60951e-01  3.84674e+00  0.00000e+00 0.00000e+00 2.85881e+02 77.384  2.56470e+01 77.384  0.8613 
1 1 1 4   17  6  o 17 2.04745e+01 4.82052e-01 4.74982e+02 81.997  1.78361e+00  1.26864e+01  0.00000e+00 0.00000e+00 2.64176e+02 81.997  2.10807e+02 261.997 0.9601 
1 1 1 4   17  7  o 19 2.90604e+01 5.94757e-01 4.97515e+02 202.337 -1.76814e+01 -7.26490e+00 0.00000e+00 0.00000e+00 5.65933e+02 202.337 6.84177e+01 202.337 0.9735 
1 1 1 4   17  8  o 12 3.27169e+01 6.61176e-01 6.51578e+02 154.436 -3.28170e+01 1.56976e+01  0.00000e+00 0.00000e+00 5.60908e+02 154.436 9.06702e+01 334.436 0.9862 
1 1 1 4   17  9  f 0  2.25263e+01 7.03230e-01 2.56005e+02 208.943 -1.22288e+01 -6.76260e+00 0.00000e+00 0.00000e+00 5.59368e+02 208.943 3.03363e+02 208.943 0.9635 
1 1 1 4   17  10 o 16 1.55966e+01 6.90054e-01 2.65127e+02 59.560  6.69968e+00  1.14012e+01  0.00000e+00 0.00000e+00 2.97942e+02 59.560  3.28152e+01 59.560  0.9614 
1 1 1 4   17  11 o 13 3.07521e+01 7.58257e-01 4.63601e+02 254.880 -1.56129e+01 -5.77822e+01 0.00000e+00 0.00000e+00 6.80930e+02 254.880 2.17329e+02 254.880 0.9916 
1 1 1 4   17  12 o 12 2.68269e+01 1.45911e+00 3.47330e+02 14.561  4.32217e+01  1.12267e+01  0.00000e+00 0.00000e+00 6.47683e+02 14.561  3.00353e+02 14.561  0.9887 
1 1 1 4   17  13 o 19 1.96021e+01 8.47433e-01 3.34005e+02 214.108 -4.28919e+01 -2.90492e+01 0.00000e+00 0.00000e+00 3.93751e+02 214.108 5.97462e+01 214.108 0.9903 
1 1 1 4   17  14 o 14 1.35728e+01 1.08223e+00 2.62142e+02 334.751 2.97770e+01  -1.40431e+01 0.00000e+00 0.00000e+00 2.38580e+02 334.751 2.35612e+01 154.751 0.9847 
1 1 1 4   17  15 o 11 7.29401e+00 1.59908e+00 1.12989e+02 52.881  4.09318e+00  5.40847e+00  0.00000e+00 0.00000e+00 1.39064e+02 52.881  2.60750e+01 52.881  0.9230 
1 1 1 4   17  16 o 16 5.11366e+00 1.50383e+00 7.82644e+01 278.810 6.31455e-01  -4.07398e+00 0.00000e+00 0.00000e+00 8.77940e+01 278.810 9.52956e+00 278.810 0.8681 
1 1 1 4   17  17 o 14 5.43261e+00 1.63554e+00 7.05144e+01 176.570 -3.98878e+00 2.39057e-01  0.00000e+00 0.00000e+00 1.04796e+02 176.570 3.42811e+01 176.570 0.8634 
1 1 1 4   17  18 o 9  4.78178e+00 1.59242e+00 4.86022e+01 71.869  8.18053e-01  2.49822e+00  0.00000e+00 0.00000e+00 9.03762e+01 71.869  4.17740e+01 71.869  0.7783 
1 1 1 4   18  0  o 13 1.26724e+01 3.68477e-01 1.68827e+02 261.727 -2.38644e-01 -1.64125e+00 0.00000e+00 0.00000e+00 1.32788e+02 261.727 3.60386e+01 81.727  0.6329 
1 1 1 4   18  1  o 18 1.56895e+01 4.57147e-01 3.41883e+02 8.803   3.03619e+00  4.70210e-01  0.00000e+00 0.00000e+00 1.39128e+02 8.803   2.02755e+02 188.803 0.8152 
1 1 1 4   18  2  o 18 1.27506e+01 3.46138e-01 3.19515e+02 235.129 -1.83783e+00 -2.63732e+00 0.00000e+00 0.00000e+00 7.59651e+01 235.129 2.43550e+02 55.129  0.8247 
1 1 1 4   18  3  o 3  1.52783e+01 4.27171e-01 3.56503e+02 39.876  3.11546e+00  2.60276e+00  0.00000e+00 0.00000e+00 1.41002e+02 39.876  2.15500e+02 219.876 0.8658 
1 1 1 4   18  4  o 12 1.86385e+01 4.28652e-01 2.84881e+02 280.595 8.31100e-01  -4.44318e+00 0.00000e+00 0.00000e+00 3.32627e+02 280.595 4.77458e+01 280.595 0.8809 
1 1 1 4   18  5  o 8  4.41573e+01 7.89033e-01 9.72324e+02 18.533  4.30460e+01  1.44304e+01  0.00000e+00 0.00000e+00 6.69818e+02 18.533  3.02506e+02 198.533 0.9889 
1 1 1 4   18  6  o 8  2.50774e+01 5.34374e-01 5.20970e+02 229.843 -1.10301e+01 -1.30721e+01 0.00000e+00 0.00000e+00 3.93908e+02 229.843 1.27062e+02 49.843  0.9703 
1 1 1 4   18  7  o 10 3.30772e+01 6.45913e-01 4.99586e+02 232.831 -1.31339e+01 -1.73229e+01 0.00000e+00 0.00000e+00 7.14827e+02 232.831 2.15241e+02 232.831 0.9767 
1 1 1 4   18  8  o 17 3.08199e+01 7.32184e-01 5.10409e+02 69.708  9.25268e+00  2.50237e+01  0.00000e+00 0.00000e+00 6.25834e+02 69.708  1.15425e+02 69.708  0.9811 
1 1 1 4   18  9  o 4  2.66101e+01 6.27296e-01 3.42599e+02 61.968  1.02835e+01  1.93147e+01  0.00000e+00 0.00000e+00 6.33891e+02 61.968  2.91292e+02 61.968  0.9769 
1 1 1 4   18  10 o 4  1.47537e+01 7.65797e-01 3.99930e+02 280.263 3.33337e+00  -1.84096e+01 0.00000e+00 0.00000e+00 1.39042e+02 280.263 2.60888e+02 100.263 0.9729 
1 1 1 4   18  11 o 19 2.31556e+01 7.13007e-01 4.95803e+02 120.054 -2.42218e+01 4.18628e+01  0.00000e+00 0.00000e+00 3.64219e+02 120.054 1.31584e+02 300.054 0.9896 
1 1 1 4   18  12 o 17 1.18116e+01 9.46252e-01 3.29223e+02 252.380 -6.39910e+00 -2.01485e+01 0.00000e+00 0.00000e+00 1.03229e+02 252.380 2.25994e+02 72.380  0.9761 
1 1 1 4   18  13 o 8  1.39009e+01 9.71593e-01 2.26320e+02 272.711 1.13758e+00  -2.40207e+01 0.00000e+00 0.00000e+00 2.83847e+02 272.711 5.75273e+01 272.711 0.9790 
1 1 1 4   18  14 o 12 9.65915e+00 1.28627e+00 9.26499e+01 326.756 6.30421e+00  -4.13221e+00 0.00000e+00 0.00000e+00 2.44277e+02 326.756 1.51627e+02 326.756 0.9311 
1 1 1 4   18  15 f 0  1.24745e+01 1.24690e+00 1.33779e+02 116.566 -7.82422e+00 1.56481e+01  0.00000e+00 0.00000e+00 3.19669e+02 116.566 1.85890e+02 116.566 0.9710 
1 1 1 4   18  16 o 3  4.98877e+00 1.49603e+00 5.77316e+01 60.451  1.47656e+00  2.60457e+00  0.00000e+00 0.00000e+00 9.33396e+01 60.451  3.56080e+01 60.451  0.8095 
1 1 1 4   18  17 o 7  4.72652e+00 1.54038e+00 1.02649e+02 307.385 3.26373e+00  -4.27104e+00 0.00000e+00 0.00000e+00 5.65900e+01 307.385 4.60586e+01 127.385 0.9014 
1 1 1 4   18  18 o 12 5.12868e+00 1.64048e+00 5.52381e+01 142.618 -2.48867e+00 1.90151e+00  0.00000e+00 0.00000e+00 1.01664e+02 142.618 4.64260e+01 142.618 0.8193 
1 1 1 4   19  0  o 11 1.92237e+01 5.00357e-01 1.46231e+02 71.437  5.16764e-01  1.53878e+00  0.00000e+00 0.00000e+00 3.05653e+02 71.437  1.59421e+02 71.437  0.6252 
1 1 1 4   19  1  o 13 2.09019e+01 4.74613e-01 4.43479e+02 239.031 -2.66382e+00 -4.43873e+00 0.00000e+00 0.00000e+00 2.61859e+02 239.031 1.81621e+02 59.031  0.8973 
1 1 1 4   19  2  o 10 1.32349e+01 3.53819e-01 6.71588e+01 87.921  2.45605e-02  6.76704e-01  0.00000e+00 0.00000e+00 9.23917e+01 87.921  2.52329e+01 87.921  0.3205 
1 1 1 4   19  3  o 2  2.83000e+01 5.39709e-01 7.16038e+02 184.252 -1.74580e+01 -1.29812e+00 0.00000e+00 0.00000e+00 3.17444e+02 184.252 3.98594e+02 4.252   0.9710 
1 1 1 4   19  4  o 10 8.28491e+00 3.90653e-01 4.40646e+02 34.782  2.68469e+00  1.86463e+00  0.00000e+00 0.00000e+00 1.82650e+02 214.782 6.23296e+02 214.782 0.8280 
1 1 1 4   19  5  o 10 3.21819e+01 6.12197e-01 4.09270e+02 187.657 -1.37723e+01 -1.85146e+00 0.00000e+00 0.00000e+00 7.56478e+02 187.657 3.47208e+02 187.657 0.9633 
1 1 1 4   19  6  o 1  2.59500e+01 5.45637e-01 3.70881e+02 186.192 -1.14135e+01 -1.23821e+00 0.00000e+00 0.00000e+00 5.61236e+02 186.192 1.90355e+02 186.192 0.9554 
1 1 1 4   19  7  o 4  2.13191e+01 5.11724e-01 2.91292e+02 102.942 -1.89660e+00 8.25313e+00  0.00000e+00 0.00000e+00 4.61124e+02 102.942 1.69832e+02 102.942 0.9390 
1 1 1 4   19  8  o 5  3.55586e+01 6.99341e-01 5.12367e+02 68.884  1.11142e+01  2.87791e+01  0.00000e+00 0.00000e+00 8.01959e+02 68.884  2.89591e+02 68.884  0.9837 
1 1 1 4   19  9  o 17 9.27731e+00 7.11881e-01 1.10756e+02 285.373 6.49399e-01  -2.36199e+00 0.00000e+00 0.00000e+00 1.53884e+02 285.373 4.31275e+01 285.373 0.7594 
1 1 1 4   19  10 o 12 1.50432e+01 6.82173e-01 3.14284e+02 81.397  2.25418e+00  1.48993e+01  0.00000e+00 0.00000e+00 2.31472e+02 81.397  8.28128e+01 261.397 0.9662 
1 1 1 4   19  11 o 11 1.25873e+01 1.35804e+00 2.45746e+02 16.633  1.12737e+01  3.36793e+00  0.00000e+00 0.00000e+00 2.06102e+02 16.633  3.96439e+01 196.633 0.9565 
1 1 1 4   19  12 o 14 1.90858e+01 8.19799e-01 3.34545e+02 302.343 1.89766e+01  -2.99687e+01 0.00000e+00 0.00000e+00 3.71175e+02 302.343 3.66305e+01 302.343 0.9858 
1 1 1 4   19  13 o 13 2.17619e+01 8.20749e-01 3.72304e+02 352.898 6.05901e+01  -7.54914e+00 0.00000e+00 0.00000e+00 4.36759e+02 352.898 6.44544e+01 352.898 0.9918 
1 1 1 4   19  14 o 13 8.84613e+00 1.33985e+00 1.32444e+02 195.447 -9.29642e+00 -2.56890e+00 0.00000e+00 0.00000e+00 1.81264e+02 195.447 4.88202e+01 195.447 0.9466 
1 1 1 4   19  15 o 10 5.31859e+00 1.49455e+00 9.27086e+01 116.877 -2.06078e+00 4.06610e+00  0.00000e+00 0.00000e+00 8.29002e+01 116.877 9.80840e+00 296.877 0.8820 
1 1 1 4   19  16 o 17 1.29578e+01 1.47877e+00 1.93813e+02 317.839 1.95355e+01  -1.76896e+01 0.00000e+00 0.00000e+00 2.81584e+02 317.839 8.77706e+01 317.839 0.9808 
1 1 1 4   19  17 o 13 4.50927e+00 1.48552e+00 2.93324e+01 157.188 -1.34708e+00 5.66600e-01  0.00000e+00 0.00000e+00 6.94982e+01 157.188 4.01657e+01 157.188 0.5864 
1 1 1 4   20  0  o 10 2.53639e+01 6.08174e-01 3.44140e+02 280.575 8.99232e-01  -4.81648e+00 0.00000e+00 0.00000e+00 5.05582e+02 280.575 1.61442e+02 280.575 0.8910 
1 1 1 4   20  1  o 8  1.88716e+01 4.01300e-01 5.43868e+02 334.228 7.44921e+00  -3.59653e+00 0.00000e+00 0.00000e+00 1.21396e+02 334.228 4.22472e+02 154.228 0.9374 
1 1 1 4   20  2  o 18 2.12001e+01 4.36979e-01 4.17345e+02 311.529 4.37401e+00  -4.93895e+00 0.00000e+00 0.00000e+00 3.16734e+02 311.529 1.00611e+02 131.529 0.9207 
1 1 1 4   20  3  o 16 1.02264e+01 3.58255e-01 2.61802e+02 265.795 -1.67429e-01 -2.27707e+00 0.00000e+00 0.00000e+00 2.24898e+01 265.795 2.39312e+02 85.795  0.7392 
1 1 1 4   20  4  o 2  1.91111e+01 4.36254e-01 3.49038e+02 25.824  5.31480e+00  2.57201e+00  0.00000e+00 0.00000e+00 3.05569e+02 25.824  4.34687e+01 205.824 0.9108 
1 1 1 4   20  5  o 11 2.24599e+01 4.87781e-01 3.23271e+02 220.740 -5.76621e+00 -4.96666e+00 0.00000e+00 0.00000e+00 4.63626e+02 220.740 1.40355e+02 220.740 0.9318 
1 1 1 4   20  6  o 6  4.47180e+01 8.05047e-01 9.60837e+02 266.273 -3.28768e+00 -5.04763e+01 0.00000e+00 0.00000e+00 7.03611e+02 266.273 2.57226e+02 86.273  0.9901 
1 1 1 4   20  7  o 19 1.11741e+01 4.92520e-01 1.87469e+02 348.248 2.78851e+00  -5.80121e-01 0.00000e+00 0.00000e+00 1.47725e+02 348.248 3.97438e+01 168.248 0.7981 
1 1 1 4   20  8  o 17 1.78772e+01 5.38925e-01 3.22334e+02 231.949 -6.10557e+00 -7.80055e+00 0.00000e+00 0.00000e+00 3.14525e+02 231.949 7.80830e+00 51.949  0.9481 
1 1 1 4   20  9  o 19 2.91672e+01 6.56487e-01 4.27220e+02 296.846 1.50022e+01  -2.96404e+01 0.00000e+00 0.00000e+00 6.51710e+02 296.846 2.24490e+02 296.846 0.9848 
1 1 1 4   20  10 o 18 2.26185e+01 6.49438e-01 4.44828e+02 222.530 -2.29160e+01 -2.10206e+01 0.00000e+00 0.00000e+00 3.90619e+02 222.530 5.42087e+01 42.530  0.9838 
1 1 1 4   20  11 o 8  1.61366e+01 7.32387e-01 2.94149e+02 193.525 -1.99600e+01 -4.80116e+00 0.00000e+00 0.00000e+00 2.96474e+02 193.525 2.32496e+00 193.525 0.9753 
1 1 1 4   20  12 o 13 1.63811e+01 8.29197e-01 1.87611e+02 113.380 -7.19819e+00 1.66501e+01  0.00000e+00 0.00000e+00 4.09610e+02 113.380 2.21999e+02 113.380 0.9720 
1 1 1 4   20  13 o 11 4.50544e+00 1.26678e+00 8.77035e+01 70.025  8.97739e-01  2.46981e+00  0.00000e+00 0.00000e+00 4.37252e+01 70.025  4.39782e+01 250.024 0.7782 
1 1 1 4   20  14 o 5  9.44834e+00 1.24813e+00 1.45773e+02 330.575 1.06432e+01  -6.00311e+00 0.00000e+00 0.00000e+00 1.93349e+02 330.575 4.75754e+01 330.575 0.9582 
1 1 1 4   20  15 o 3  9.47567e+00 1.42475e+00 1.74607e+02 105.987 -4.23427e+00 1.47790e+01  0.00000e+00 0.00000e+00 1.68352e+02 105.987 6.25517e+00 285.987 0.9669 
1 1 1 4   20  16 o 1  8.97976e+00 1.54854e+00 1.07384e+02 266.935 -5.17022e-01 -9.65515e+00 0.00000e+00 0.00000e+00 2.10611e+02 266.935 1.03228e+02 266.935 0.9468 
1 1 1 4   20  17 o 6  4.90905e+00 1.59810e+00 3.59650e+01 64.372  7.86761e-01  1.64006e+00  0.00000e+00 0.00000e+00 8.61617e+01 64.372  5.01966e+01 64.372  0.6657 
1 1 1 4   21  0  o 19 4.31427e+00 3.39792e-01 2.03291e+02 299.592 3.51047e-01  -6.18163e-01 0.00000e+00 0.00000e+00 1.48997e+02 119.592 3.52288e+02 119.592 0.3347 
1 1 1 4   21  1  o 4  2.88198e+01 5.37309e-01 4.06002e+02 109.251 -3.02834e+00 8.67118e+00  0.00000e+00 0.00000e+00 6.16872e+02 109.251 2.10871e+02 109.251 0.9439 
1 1 1 4   21  2  o 3  2.68016e+01 5.14561e-01 3.96261e+02 218.444 -6.35904e+00 -5.04806e+00 0.00000e+00 0.00000e+00 5.47331e+02 218.444 1.51070e+02 218.444 0.9362 
1 1 1 4   21  3  o 9  2.32379e+01 4.72992e-01 3.82865e+02 142.633 -5.50042e+00 4.20038e+00  0.00000e+00 0.00000e+00 4.25141e+02 142.633 4.22755e+01 142.633 0.9246 
1 1 1 4   21  4  o 10 1.07842e+01 3.91309e-01 1.27976e+02 219.016 -1.03416e+00 -8.37917e-01 0.00000e+00 0.00000e+00 9.56688e+01 219.016 3.23071e+01 39.016  0.5515 
1 1 1 4   21  5  o 5  2.48806e+01 5.17695e-01 5.84507e+02 130.579 -9.83550e+00 1.14836e+01  0.00000e+00 0.00000e+00 3.19490e+02 130.579 2.65017e+02 310.579 0.9663 
1 1 1 4   21  6  o 18 4.26028e+01 8.65985e-01 7.85629e+02 244.119 -1.78438e+01 -3.67780e+01 0.00000e+00 0.00000e+00 7.96196e+02 244.119 1.05667e+01 244.119 0.9877 
1 1 1 4   21  7  o 17 1.55466e+01 4.86882e-01 4.23474e+02 7.217   1.04365e+01  1.32162e+00  0.00000e+00 0.00000e+00 1.32317e+02 7.217   2.91158e+02 187.217 0.9512 
1 1 1 4   21  8  o 16 2.91266e+01 6.26701e-01 6.35440e+02 229.409 -2.06006e+01 -2.40429e+01 0.00000e+00 0.00000e+00 4.41490e+02 229.409 1.93950e+02 49.409  0.9841 
1 1 1 4   21  9  o 1  3.00808e+01 7.72847e-01 4.54536e+02 102.295 -7.68290e+00 3.52512e+01  0.00000e+00 0.00000e+00 6.59495e+02 102.295 2.04959e+02 102.295 0.9860 
1 1 1 4   21  10 o 17 2.71803e+01 7.25552e-01 4.01062e+02 175.456 -3.33136e+01 2.64733e+00  0.00000e+00 0.00000e+00 6.03985e+02 175.456 2.02923e+02 175.456 0.9849 
1 1 1 4   21  11 o 13 2.09765e+01 9.40768e-01 2.79757e+02 139.109 -1.86255e+01 1.61287e+01  0.00000e+00 0.00000e+00 4.91244e+02 139.109 2.11488e+02 139.109 0.9795 
1 1 1 4   21  12 o 12 1.08671e+01 9.70187e-01 2.18260e+02 248.570 -4.96607e+00 -1.26523e+01 0.00000e+00 0.00000e+00 1.74017e+02 248.570 4.42429e+01 68.570  0.9625 
1 1 1 4   21  13 o 4  1.28133e+01 9.87328e-01 1.68013e+02 349.649 1.65611e+01  -3.02481e+00 0.00000e+00 0.00000e+00 2.97767e+02 349.649 1.29754e+02 349.649 0.9698 
1 1 1 4   21  14 o 6  4.32537e+00 1.28900e+00 5.75175e+01 200.455 -2.03115e+00 -7.57615e-01 0.00000e+00 0.00000e+00 5.97012e+01 200.455 2.18374e+00 200.455 0.7235 
1 1 1 4   21  15 o 16 7.16995e+00 1.60788e+00 9.98054e+01 87.567  2.57198e-01  6.05379e+00  0.00000e+00 0.00000e+00 1.45291e+02 87.567  4.54856e+01 87.567  0.9133 
1 1 1 4   21  16 o 18 1.21750e+01 1.57159e+00 1.99979e+02 262.299 -3.22606e+00 -2.38585e+01 0.00000e+00 0.00000e+00 2.45817e+02 262.299 4.58384e+01 262.299 0.9790 
1 1 1 4   21  17 o 17 5.06145e+00 1.60574e+00 4.95821e+01 84.883  2.41884e-01  2.70103e+00  0.00000e+00 0.00000e+00 9.91212e+01 84.883  4.95391e+01 84.883  0.7862 
1 1 1 4   22  0  o 9  5.14638e+00 3.27273e-01 1.69006e+02 212.719 -5.77954e-01 -3.71316e-01 0.00000e+00 0.00000e+00 1.06186e+02 32.719  2.75192e+02 32.719  0.3247 
1 1 1 4   22  1  o 12 1.16783e+01 3.36372e-01 3.56125e+02 82.689  4.00934e-01  3.12524e+00  0.00000e+00 0.00000e+00 4.17962e+00 82.689  3.51946e+02 262.689 0.8205 
1 1 1 4   22  2  o 17 1.67849e+01 3.88977e-01 1.85630e+02 67.344  9.01090e-01  2.15875e+00  0.00000e+00 0.00000e+00 2.85415e+02 67.344  9.97842e+01 67.344  0.7463 
1 1 1 4   22  3  f 0  2.95172e+00 5.37615e-01 7.38842e+01 42.855  1.22393e-01  1.13557e-01  0.00000e+00 0.00000e+00 6.46507e+01 222.855 1.38535e+02 222.855 0.0832 
1 1 1 4   22  4  o 7  2.26718e+01 4.79683e-01 4.32437e+02 332.814 8.30915e+00  -4.26769e+00 0.00000e+00 0.00000e+00 3.73033e+02 332.814 5.94037e+01 152.814 0.9449 
1 1 1 4   22  5  o 1  2.36642e+01 5.05004e-01 4.06262e+02 40.124  8.86537e+00  7.47161e+00  0.00000e+00 0.00000e+00 4.44154e+02 40.124  3.78923e+01 40.124  0.9559 
1 1 1 4   22  6  o 5  8.39031e+00 4.82692e-01 2.83070e+02 95.036  -2.56422e-01 2.90957e+00  0.00000e+00 0.00000e+00 2.95074e+01 275.036 3.12577e+02 275.036 0.8040 
1 1 1 4   22  7  o 10 2.04000e+01 5.12152e-01 4.44857e+02 105.651 -3.89115e+00 1.38887e+01  0.00000e+00 0.00000e+00 2.94727e+02 105.651 1.50130e+02 285.651 0.9647 
1 1 1 4   22  8  o 16 2.56989e+01 5.95689e-01 4.50205e+02 129.642 -1.54557e+01 1.86552e+01  0.00000e+00 0.00000e+00 4.95161e+02 129.642 4.49562e+01 129.642 0.9791 
1 1 1 4   22  9  o 7  3.29020e+01 6.98330e-01 5.10769e+02 252.767 -1.29133e+01 -4.16322e+01 0.00000e+00 0.00000e+00 7.10662e+02 252.767 1.99893e+02 252.767 0.9885 
1 1 1 4   22  10 o 2  3.49418e+01 9.64070e-01 4.10727e+02 83.480  5.03386e+00  4.40457e+01  0.00000e+00 0.00000e+00 8.86141e+02 83.480  4.75413e+02 83.480  0.9887 
1 1 1 4   22  11 o 10 2.82091e+01 7.43048e-01 6.22783e+02 2.639   7.91626e+01  3.64884e+00  0.00000e+00 0.00000e+00 4.29003e+02 2.639   1.93780e+02 182.639 0.9937 
1 1 1 4   22  12 o 5  5.08760e+00 1.26811e+00 1.41062e+02 129.617 -2.49197e+00 3.01044e+00  0.00000e+00 0.00000e+00 2.30029e+01 129.617 1.18060e+02 309.617 0.8599 
1 1 1 4   22  13 o 2  8.93041e+00 1.17868e+00 1.97096e+02 304.608 7.35874e+00  -1.06639e+01 0.00000e+00 0.00000e+00 1.24427e+02 304.608 7.26682e+01 124.608 0.9606 
1 1 1 4   22  14 o 2  6.11559e+00 1.34437e+00 7.27820e+01 86.994  1.93210e-01  3.67942e+00  0.00000e+00 0.00000e+00 1.21962e+02 86.994  4.91804e+01 86.994  0.8502 
1 1 1 4   22  15 o 13 9.00232e+00 1.55959e+00 2.46709e+02 212.649 -1.69847e+01 -1.08828e+01 0.00000e+00 0.00000e+00 8.17680e+01 212.649 1.64941e+02 32.649  0.9749 
1 1 1 4   22  16 o 17 3.89093e+00 1.29321e+00 8.85471e+01 121.173 -2.07780e+00 3.43449e+00  0.00000e+00 0.00000e+00 3.71871e+01 121.173 5.13600e+01 301.173 0.8641 
1 1 1 4   22  17 o 19 9.49436e+00 2.08010e+00 1.53320e+02 274.959 1.00459e+00  -1.15769e+01 0.00000e+00 0.00000e+00 1.85827e+02 274.959 3.25070e+01 274.959 0.9560 
1 1 1 4   23  0  o 2  1.26853e+01 3.32673e-01 1.12746e+02 180.438 -1.08585e+00 -8.31056e-03 0.00000e+00 0.00000e+00 1.14243e+02 180.438 1.49660e+00 180.438 0.4760 
1 1 1 4   23  1  o 18 2.32262e+01 5.15300e-01 4.45594e+02 79.856  1.34641e+00  7.52532e+00  0.00000e+00 0.00000e+00 3.68360e+02 79.856  7.72345e+01 259.856 0.9321 
1 1 1 4   23  2  o 13 1.46639e+01 3.71214e-01 2.56173e+02 272.381 1.35594e-01  -3.26090e+00 0.00000e+00 0.00000e+00 2.00214e+02 272.381 5.59589e+01 92.381  0.8277 
1 1 1 4   23  3  o 9  2.37049e+01 6.18585e-01 3.81908e+02 296.561 3.47109e+00  -6.94339e+00 0.00000e+00 0.00000e+00 4.49843e+02 296.561 6.79349e+01 296.561 0.9332 
1 1 1 4   23  4  o 15 2.52853e+01 5.16082e-01 5.64676e+02 194.993 -1.25519e+01 -3.36156e+00 0.00000e+00 0.00000e+00 3.48670e+02 194.993 2.16006e+02 14.993  0.9607 
1 1 1 4   23  5  o 18 2.89486e+01 5.70839e-01 4.36067e+02 10.237  1.48452e+01  2.68093e+00  0.00000e+00 0.00000e+00 6.15521e+02 10.237  1.79455e+02 10.237  0.9663 
1 1 1 4   23  6  o 14 1.50378e+01 4.57581e-01 2.75222e+02 339.466 5.07769e+00  -1.90185e+00 0.00000e+00 0.00000e+00 2.34809e+02 339.466 4.04129e+01 159.466 0.9023 
1 1 1 4   23  7  o 11 3.06042e+01 6.19282e-01 4.77272e+02 136.109 -1.62836e+01 1.56650e+01  0.00000e+00 0.00000e+00 6.47058e+02 136.109 1.69786e+02 136.109 0.9776 
1 1 1 4   23  8  o 1  1.86426e+01 6.36522e-01 1.54761e+02 309.243 3.80263e+00  -4.65536e+00 0.00000e+00 0.00000e+00 4.84339e+02 309.243 3.29579e+02 309.243 0.9125 
1 1 1 4   23  9  o 7  2.63291e+01 6.38282e-01 4.74931e+02 37.210  2.58918e+01  1.96602e+01  0.00000e+00 0.00000e+00 4.98511e+02 37.210  2.35803e+01 37.210  0.9845 
1 1 1 4   23  10 o 2  2.61637e+01 6.92865e-01 4.82521e+02 15.909  3.84030e+01  1.09460e+01  0.00000e+00 0.00000e+00 4.87249e+02 15.909  4.72817e+00 15.909  0.9874 
1 1 1 4   23  11 o 14 1.05414e+01 1.18963e+00 1.56674e+02 215.743 -5.62225e+00 -4.04633e+00 0.00000e+00 0.00000e+00 2.09066e+02 215.743 5.23914e+01 215.743 0.9247 
1 1 1 4   23  12 o 17 2.32702e+01 7.87220e-01 4.29730e+02 93.680  -3.87951e+00 6.03227e+01  0.00000e+00 0.00000e+00 4.35658e+02 93.680  5.92775e+00 93.680  0.9917 
1 1 1 4   23  13 o 15 4.70914e+00 1.21979e+00 6.09918e+01 29.026  1.84476e+00  1.02368e+00  0.00000e+00 0.00000e+00 6.51965e+01 29.026  4.20466e+00 29.026  0.7150 
1 1 1 4   23  14 o 10 6.55426e+00 1.51520e+00 9.86128e+01 297.521 2.29594e+00  -4.40641e+00 0.00000e+00 0.00000e+00 1.20511e+02 297.521 2.18981e+01 297.521 0.8927 
1 1 1 4   23  15 o 9  8.43728e+00 1.56724e+00 1.11715e+02 140.331 -6.55789e+00 5.43842e+00  0.00000e+00 0.00000e+00 1.84900e+02 140.331 7.31844e+01 140.331 0.9393 
1 1 1 4   23  16 o 18 6.17962e+00 1.61160e+00 1.37595e+02 80.174  1.40616e+00  8.11882e+00  0.00000e+00 0.00000e+00 7.89850e+01 80.174  5.86105e+01 260.174 0.9372 
1 1 1 4   23  17 o 12 4.53501e+00 1.50940e+00 1.29972e+02 217.489 -5.53918e+00 -4.24866e+00 0.00000e+00 0.00000e+00 2.68225e+01 217.489 1.03149e+02 37.489  0.9253 
1 1 1 4   24  0  o 10 1.21220e+01 4.12675e-01 2.68186e+02 67.137  9.35117e-01  2.21776e+00  0.00000e+00 0.00000e+00 7.56046e+01 67.137  1.92581e+02 247.137 0.7545 
1 1 1 4   24  1  o 11 1.61960e+01 4.75053e-01 1.81950e+02 339.221 2.08531e+00  -7.91276e-01 0.00000e+00 0.00000e+00 2.63882e+02 339.221 8.19316e+01 339.221 0.7322 
1 1 1 4   24  2  o 7  2.43219e+01 4.83534e-01 6.14505e+02 347.337 1.24131e+01  -2.78893e+00 0.00000e+00 0.00000e+00 2.63239e+02 347.337 3.51266e+02 167.337 0.9599 
1 1 1 4   24  3  o 13 1.82758e+01 4.23418e-01 3.74364e+02 252.722 -1.72332e+00 -5.54029e+00 0.00000e+00 0.00000e+00 2.50362e+02 252.722 1.24002e+02 72.722  0.9092 
1 1 1 4   24  4  o 11 5.96866e+00 4.63489e-01 1.37665e+02 186.187 -7.36370e-01 -7.98276e-02 0.00000e+00 0.00000e+00 5.97832e+01 6.187   1.97448e+02 6.187   0.3471 
1 1 1 4   24  5  o 1  3.78821e+01 6.98477e-01 6.90459e+02 41.568  2.15929e+01  1.91495e+01  0.00000e+00 0.00000e+00 7.08708e+02 41.568  1.82492e+01 41.568  0.9825 
1 1 1 4   24  6  o 1  1.04560e+01 5.46267e-01 2.75857e+02 12.136  3.66887e+00  7.88975e-01  0.00000e+00 0.00000e+00 5.94796e+01 12.136  2.16377e+02 192.136 0.8533 
1 1 1 4   24  7  o 3  2.26393e+01 5.34434e-01 3.75572e+02 318.775 9.87989e+00  -8.65670e+00 0.00000e+00 0.00000e+00 4.42082e+02 318.775 6.65102e+01 318.775 0.9611 
1 1 1 4   24  8  o 15 1.73979e+01 5.43847e-01 2.37277e+02 252.895 -2.53713e+00 -8.24468e+00 0.00000e+00 0.00000e+00 3.77143e+02 252.895 1.39866e+02 252.895 0.9401 
1 1 1 4   24  9  o 12 1.27781e+01 1.06623e+00 1.44802e+02 118.720 -2.34359e+00 4.27715e+00  0.00000e+00 0.00000e+00 2.82475e+02 118.720 1.37673e+02 118.720 0.8905 
1 1 1 4   24  10 o 12 2.05960e+01 6.84034e-01 4.24780e+02 210.277 -2.46903e+01 -1.44143e+01 0.00000e+00 0.00000e+00 3.34670e+02 210.277 9.01108e+01 30.277  0.9824 
1 1 1 4   24  11 o 11 2.73074e+01 9.14061e-01 4.03737e+02 208.765 -4.47726e+01 -2.45788e+01 0.00000e+00 0.00000e+00 6.10705e+02 208.765 2.06968e+02 208.765 0.9902 
1 1 1 4   24  12 o 18 2.16523e+01 7.78455e-01 3.52165e+02 93.104  -2.73852e+00 5.04954e+01  0.00000e+00 0.00000e+00 4.51678e+02 93.104  9.95132e+01 93.104  0.9901 
1 1 1 4   24  13 f 0  6.97334e+00 1.59541e+00 1.18955e+02 278.535 7.88322e-01  -5.25299e+00 0.00000e+00 0.00000e+00 1.16277e+02 278.535 2.67794e+00 98.535  0.9001 
1 1 1 4   24  14 o 17 7.14408e+00 1.49579e+00 1.38164e+02 225.302 -5.60479e+00 -5.66423e+00 0.00000e+00 0.00000e+00 1.11986e+02 225.302 2.61781e+01 45.302  0.9350 
1 1 1 4   24  15 o 10 3.17704e+01 1.01476e+00 5.19972e+02 78.752  3.85929e+01  1.94052e+02  0.00000e+00 0.00000e+00 6.65970e+02 78.752  1.45998e+02 78.752  0.9975 
1 1 1 4   24  16 o 8  1.51374e+01 1.56636e+00 2.44777e+02 287.809 1.12838e+01  -3.51254e+01 0.00000e+00 0.00000e+00 3.13544e+02 287.809 6.87672e+01 287.809 0.9864 
1 1 1 4   24  17 o 19 5.31587e+00 1.61335e+00 8.70319e+01 239.841 -2.56705e+00 -4.41789e+00 0.00000e+00 0.00000e+00 9.08973e+01 239.841 3.86538e+00 239.841 0.8959 
1 1 1 4   25  0  o 9  3.32158e+01 6.77094e-01 7.58333e+02 113.466 -7.56609e+00 1.74292e+01  0.00000e+00 0.00000e+00 4.56865e+02 113.466 3.01468e+02 293.466 0.9733 
1 1 1 4   25  1  o 13 2.70026e+01 5.14556e-01 4.54887e+02 96.156  -1.14996e+00 1.06612e+01  0.00000e+00 0.00000e+00 5.11656e+02 96.156  5.67683e+01 96.156  0.9522 
1 1 1 4   25  2  o 4  7.76922e+00 4.09906e-01 2.47267e+02 43.094  1.08883e+00  1.01868e+00  0.00000e+00 0.00000e+00 7.37926e+01 223.094 3.21060e+02 223.094 0.5939 
1 1 1 4   25  3  o 8  8.42375e+00 3.70060e-01 1.60040e+02 64.953  5.07535e-01  1.08611e+00  0.00000e+00 0.00000e+00 2.24299e+00 64.953  1.57797e+02 244.953 0.5124 
1 1 1 4   25  4  o 4  2.93348e+01 5.69571e-01 6.92037e+02 315.362 1.53678e+01  -1.51749e+01 0.00000e+00 0.00000e+00 3.84925e+02 315.362 3.07112e+02 135.362 0.9766 
1 1 1 4   25  5  o 14 3.13953e+01 7.74795e-01 3.87008e+02 84.162  1.35106e+00  1.32131e+01  0.00000e+00 0.00000e+00 7.47790e+02 84.162  3.60783e+02 84.162  0.9616 
1 1 1 4   25  6  o 3  3.79145e+01 7.05616e-01 9.22188e+02 217.964 -3.51687e+01 -2.74416e+01 0.00000e+00 0.00000e+00 4.86683e+02 217.964 4.35505e+02 37.964  0.9887 
1 1 1 4   25  7  o 4  3.65109e+01 7.00654e-01 5.84359e+02 316.938 2.93150e+01  -2.73962e+01 0.00000e+00 0.00000e+00 7.70294e+02 316.938 1.85935e+02 316.938 0.9875 
1 1 1 4   25  8  o 11 3.77618e+01 7.38340e-01 5.44178e+02 127.197 -2.67955e+01 3.53056e+01  0.00000e+00 0.00000e+00 8.58166e+02 127.197 3.13987e+02 127.197 0.9887 
1 1 1 4   25  9  o 7  1.16505e+01 9.73747e-01 2.12331e+02 337.970 6.08915e+00  -2.46389e+00 0.00000e+00 0.00000e+00 1.90305e+02 337.970 2.20252e+01 157.970 0.9204 
1 1 1 4   25  10 o 4  9.21727e+00 9.44575e-01 1.31417e+02 219.317 -3.21843e+00 -2.63587e+00 0.00000e+00 0.00000e+00 1.69361e+02 219.317 3.79442e+01 219.317 0.8694 
1 1 1 4   25  11 o 7  1.15246e+01 8.68188e-01 1.79943e+02 211.098 -8.10505e+00 -4.88888e+00 0.00000e+00 0.00000e+00 2.28889e+02 211.098 4.89457e+01 211.098 0.9456 
1 1 1 4   25  12 o 15 3.40361e+01 8.35647e-01 6.03071e+02 328.733 1.14789e+02  -6.97009e+01 0.00000e+00 0.00000e+00 6.68360e+02 328.733 6.52882e+01 328.733 0.9963 
1 1 1 4   25  13 o 10 1.32065e+01 1.04235e+00 3.02537e+02 165.355 -3.14143e+01 8.20914e+00  0.00000e+00 0.00000e+00 1.84663e+02 165.355 1.17873e+02 345.355 0.9845 
1 1 1 4   25  14 o 9  6.42820e+00 1.45148e+00 1.07610e+02 304.789 3.24685e+00  -4.67353e+00 0.00000e+00 0.00000e+00 1.10790e+02 304.789 3.17969e+00 304.789 0.9073 
1 1 1 4   25  15 o 1  1.09942e+01 1.43079e+00 1.76122e+02 71.814  5.89020e+00  1.79298e+01  0.00000e+00 0.00000e+00 2.24236e+02 71.814  4.81143e+01 71.814  0.9731 
1 1 1 4   25  16 f 0  6.60875e+00 1.69431e+00 1.61022e+02 51.391  6.12973e+00  7.67600e+00  0.00000e+00 0.00000e+00 7.31500e+01 51.391  8.78724e+01 231.391 0.9476 
1 1 1 4   25  17 o 17 5.72893e+00 1.75531e+00 3.92415e+01 261.648 -3.17370e-01 -2.16185e+00 0.00000e+00 0.00000e+00 1.16131e+02 261.648 7.68893e+01 261.648 0.7259 
1 1 1 4   26  0  o 1  2.40491e+01 4.67839e-01 4.25973e+02 12.655  8.72448e+00  1.95888e+00  0.00000e+00 0.00000e+00 4.25764e+02 12.655  2.09325e-01 192.655 0.9423 
1 1 1 4   26  1  o 19 1.91709e+01 4.11500e-01 1.97267e+02 21.136  3.02016e+00  1.16755e+00  0.00000e+00 0.00000e+00 3.98086e+02 21.136  2.00819e+02 21.136  0.8261 
1 1 1 4   26  2  o 4  6.37323e+00 4.37212e-01 2.76313e+02 91.753  -4.10641e-02 1.34203e+00  0.00000e+00 0.00000e+00 1.43400e+02 271.753 4.19713e+02 271.753 0.5548 
1 1 1 4   26  3  o 5  1.60381e+01 4.03259e-01 4.05407e+02 82.183  8.53510e-01  6.21714e+00  0.00000e+00 0.00000e+00 1.47131e+02 82.183  2.58276e+02 262.183 0.9164 
1 1 1 4   26  4  o 12 1.41051e+01 4.08780e-01 4.02500e+02 157.403 -5.53891e+00 2.30528e+00  0.00000e+00 0.00000e+00 8.12530e+01 157.403 3.21247e+02 337.403 0.9124 
1 1 1 4   26  5  o 17 2.79288e+01 5.60847e-01 7.09913e+02 73.917  7.19811e+00  2.49657e+01  0.00000e+00 0.00000e+00 3.19437e+02 73.917  3.90476e+02 253.917 0.9806 
1 1 1 4   26  6  o 11 3.99822e+01 7.37385e-01 7.24995e+02 204.798 -3.33597e+01 -1.54128e+01 0.00000e+00 0.00000e+00 7.56957e+02 204.798 3.19622e+01 204.798 0.9863 
1 1 1 4   26  7  o 12 1.84251e+01 6.63165e-01 2.94841e+02 155.531 -9.27382e+00 4.22022e+00  0.00000e+00 0.00000e+00 3.62512e+02 155.531 6.76720e+01 155.531 0.9496 
1 1 1 4   26  8  o 4  3.34653e+01 6.85903e-01 4.23899e+02 88.120  1.00343e+00  3.05775e+01  0.00000e+00 0.00000e+00 8.12347e+02 88.120  3.88448e+02 88.120  0.9835 
1 1 1 4   26  9  o 14 2.68614e+01 7.40694e-01 5.13370e+02 329.465 3.29249e+01  -1.94211e+01 0.00000e+00 0.00000e+00 4.81908e+02 329.465 3.14622e+01 149.465 0.9868 
1 1 1 4   26  10 o 7  2.95164e+01 8.09918e-01 6.73535e+02 93.032  -3.65644e+00 6.90349e+01  0.00000e+00 0.00000e+00 4.26205e+02 93.032  2.47330e+02 273.032 0.9927 
1 1 1 4   26  11 o 18 6.09258e+00 1.25207e+00 1.19414e+02 181.416 -3.09528e+00 -7.64965e-02 0.00000e+00 0.00000e+00 6.72788e+01 181.416 5.21352e+01 1.416   0.8169 
1 1 1 4   26  12 o 5  1.87418e+01 8.36758e-01 2.99414e+02 291.428 1.38475e+01  -3.52842e+01 0.00000e+00 0.00000e+00 3.93932e+02 291.428 9.45179e+01 291.428 0.9867 
1 1 1 4   26  13 o 2  2.28033e+01 8.56017e-01 3.64936e+02 145.730 -5.90094e+01 4.02086e+01  0.00000e+00 0.00000e+00 4.83503e+02 145.730 1.18567e+02 145.730 0.9930 
1 1 1 4   26  14 o 4  1.20104e+01 1.19598e+00 2.15380e+02 357.041 2.24899e+01  -1.16243e+00 0.00000e+00 0.00000e+00 2.24250e+02 357.041 8.87015e+00 357.041 0.9775 
1 1 1 4   26  15 o 1  1.62972e+01 1.33663e+00 2.51839e+02 63.923  1.89842e+01  3.87906e+01  0.00000e+00 0.00000e+00 3.50870e+02 63.923  9.90313e+01 63.923  0.9884 
1 1 1 4   26  16 o 13 1.31827e+01 1.67560e+00 2.80881e+02 287.631 1.07392e+01  -3.37903e+01 0.00000e+00 0.00000e+00 2.05003e+02 287.631 7.58785e+01 107.631 0.9858 
1 1 1 4   26  17 o 3  5.98111e+00 1.86940e+00 7.07970e+01 140.873 -2.96799e+00 2.41432e+00  0.00000e+00 0.00000e+00 1.20572e+02 140.873 4.97747e+01 140.873 0.8565 
1 1 1 4   27  0  o 10 2.19184e+01 4.42916e-01 5.37798e+02 309.750 6.44021e+00  -7.74347e+00 0.00000e+00 0.00000e+00 2.43919e+02 309.750 2.93879e+02 129.750 0.9490 
1 1 1 4   27  1  o 17 6.78535e+00 3.84248e-01 1.73651e+02 160.152 -8.62997e-01 3.11514e-01  0.00000e+00 0.00000e+00 6.74524e+01 340.152 2.41103e+02 340.152 0.4164 
1 1 1 4   27  2  o 10 6.89665e+00 5.44135e-01 8.27534e+01 72.481  1.46402e-01  4.63782e-01  0.00000e+00 0.00000e+00 2.15059e+01 252.481 1.04259e+02 252.481 0.2363 
1 1 1 4   27  3  o 1  2.22604e+01 5.36394e-01 4.88955e+02 339.390 9.68152e+00  -3.64104e+00 0.00000e+00 0.00000e+00 3.06280e+02 339.390 1.82675e+02 159.390 0.9504 
1 1 1 4   27  4  o 1  8.64198e+00 4.54457e-01 2.07401e+02 121.995 -9.90946e-01 1.58617e+00  0.00000e+00 0.00000e+00 1.19546e+01 121.995 1.95446e+02 301.995 0.6753 
1 1 1 4   27  5  o 7  2.86741e+01 5.72135e-01 6.37765e+02 283.997 5.26990e+00  -2.11415e+01 0.00000e+00 0.00000e+00 4.14895e+02 283.997 2.22870e+02 103.997 0.9768 
1 1 1 4   27  6  f 0  4.76502e+01 9.08430e-01 1.02766e+03 92.716  -3.02846e+00 6.38378e+01  0.00000e+00 0.00000e+00 7.48850e+02 92.716  2.78810e+02 272.716 0.9921 
1 1 1 4   27  7  o 10 1.07131e+01 5.40515e-01 2.34185e+02 238.507 -2.30271e+00 -3.75875e+00 0.00000e+00 0.00000e+00 1.19014e+02 238.507 1.15171e+02 58.507  0.8776 
1 1 1 4   27  8  o 18 1.74641e+01 7.61324e-01 2.98256e+02 130.196 -7.38312e+00 8.73802e+00  0.00000e+00 0.00000e+00 3.28291e+02 130.196 3.00348e+01 130.196 0.9552 
1 1 1 4   27  9  o 6  1.44383e+01 7.24303e-01 2.60464e+02 305.635 6.06581e+00  -8.46155e+00 0.00000e+00 0.00000e+00 2.54876e+02 305.635 5.58852e+00 125.636 0.9507 
1 1 1 4   27  10 o 15 2.73869e+01 7.28189e-01 4.82484e+02 36.748  3.61117e+01  2.69642e+01  0.00000e+00 0.00000e+00 5.33833e+02 36.748  5.13495e+01 36.748  0.9888 
1 1 1 4   27  11 o 19 3.21091e+01 1.50950e+00 5.22708e+02 251.296 -2.30352e+01 -6.80393e+01 0.00000e+00 0.00000e+00 6.73299e+02 251.296 1.50591e+02 251.296 0.9930 
1 1 1 4   27  12 o 2  3.01692e+01 8.24900e-01 3.61099e+02 192.402 -7.58779e+01 -1.66854e+01 0.00000e+00 0.00000e+00 7.62641e+02 192.402 4.01542e+02 192.402 0.9935 
1 1 1 4   27  13 o 18 1.26118e+01 1.05184e+00 2.02349e+02 340.965 1.94982e+01  -6.72702e+00 0.00000e+00 0.00000e+00 2.58580e+02 340.965 5.62307e+01 340.965 0.9754 
1 1 1 4   27  14 o 14 6.48153e+00 1.48176e+00 5.58626e+01 82.207  4.03603e-01  2.94900e+00  0.00000e+00 0.00000e+00 1.40283e+02 82.207  8.44202e+01 82.207  0.8082 
1 1 1 4   27  15 o 15 4.37999e+00 1.30805e+00 8.40609e+01 23.513  3.46538e+00  1.50770e+00  0.00000e+00 0.00000e+00 5.59667e+01 23.513  2.80942e+01 203.513 0.8545 
1 1 1 4   27  16 o 16 7.45362e+00 1.77732e+00 8.12938e+01 348.633 5.34825e+00  -1.07520e+00 0.00000e+00 0.00000e+00 1.70328e+02 348.633 8.90345e+01 348.633 0.9030 
1 1 1 4   27  17 o 5  4.73747e+00 1.59255e+00 8.84565e+01 224.965 -3.24037e+00 -3.23639e+00 0.00000e+00 0.00000e+00 6.77381e+01 224.965 2.07184e+01 44.965  0.8826 
1 1 1 4   28  0  o 15 5.27307e+00 3.51111e-01 1.29493e+02 198.936 -5.01974e-01 -1.72212e-01 0.00000e+00 0.00000e+00 7.86798e+01 18.936  2.08172e+02 18.936  0.2564 
1 1 1 4   28  1  o 2  3.15310e+01 5.82429e-01 6.18336e+02 127.930 -9.13060e+00 1.17160e+01  0.00000e+00 0.00000e+00 5.26127e+02 127.930 9.22089e+01 307.930 0.9657 
1 1 1 4   28  2  o 19 1.38865e+01 4.44716e-01 1.00529e+02 326.918 1.04386e+00  -6.80020e-01 0.00000e+00 0.00000e+00 1.74408e+02 326.918 7.38787e+01 326.918 0.5267 
1 1 1 4   28  3  o 16 3.31048e+01 6.18785e-01 8.17093e+02 32.357  2.06765e+01  1.30998e+01  0.00000e+00 0.00000e+00 4.01543e+02 32.357  4.15550e+02 212.357 0.9794 
1 1 1 4   28  4  o 7  2.50244e+01 5.85280e-01 4.70606e+02 297.602 6.56890e+00  -1.25640e+01 0.00000e+00 0.00000e+00 4.36146e+02 297.602 3.44600e+01 117.602 0.9641 
1 1 1 4   28  5  o 18 2.09840e+01 4.85733e-01 2.57993e+02 129.636 -4.09224e+00 4.94043e+00  0.00000e+00 0.00000e+00 4.66231e+02 129.636 2.08238e+02 129.636 0.9184 
1 1 1 4   28  6  o 15 2.25537e+01 5.91701e-01 5.32263e+02 255.954 -3.96505e+00 -1.58490e+01 0.00000e+00 0.00000e+00 2.88825e+02 255.954 2.43437e+02 75.954  0.9689 
1 1 1 4   28  7  o 3  4.59968e+01 8.39892e-01 8.45905e+02 173.441 -6.53686e+01 7.51650e+00  0.00000e+00 0.00000e+00 8.68820e+02 173.441 2.29153e+01 173.441 0.9924 
1 1 1 4   28  8  o 2  2.09025e+01 5.77992e-01 4.91259e+02 333.610 2.03478e+01  -1.00962e+01 0.00000e+00 0.00000e+00 2.76248e+02 333.610 2.15011e+02 153.610 0.9777 
1 1 1 4   28  9  o 9  4.16523e+01 8.15853e-01 7.96733e+02 179.457 -9.82534e+01 9.31091e-01  0.00000e+00 0.00000e+00 7.58966e+02 179.457 3.77675e+01 359.457 0.9949 
1 1 1 4   28  10 o 6  3.13822e+01 9.69651e-01 4.82842e+02 306.825 3.01126e+01  -4.02162e+01 0.00000e+00 0.00000e+00 6.83008e+02 306.825 2.00165e+02 306.825 0.9900 
1 1 1 4   28  11 o 19 2.94076e+01 8.55110e-01 4.81670e+02 67.792  2.60799e+01  6.38817e+01  0.00000e+00 0.00000e+00 6.13311e+02 67.792  1.31641e+02 67.792  0.9927 
1 1 1 4   28  12 o 2  9.07982e+00 1.15796e+00 2.20454e+02 60.168  6.51111e+00  1.13541e+01  0.00000e+00 0.00000e+00 1.06649e+02 60.168  1.13805e+02 240.168 0.9610 
1 1 1 4   28  13 o 19 7.61913e+00 1.29407e+00 8.88710e+01 86.373  3.18654e-01  5.02725e+00  0.00000e+00 0.00000e+00 1.66388e+02 86.373  7.75166e+01 86.373  0.8942 
1 1 1 4   28  14 o 4  4.45850e+00 1.28936e+00 8.83360e+01 173.449 -3.49940e+00 4.01863e-01  0.00000e+00 0.00000e+00 5.22590e+01 173.449 3.60769e+01 353.449 0.8423 
1 1 1 4   28  15 o 18 1.01539e+01 1.60081e+00 2.32297e+02 13.419  2.02201e+01  4.82435e+00  0.00000e+00 0.00000e+00 1.38333e+02 13.419  9.39636e+01 193.419 0.9756 
1 1 1 4   28  16 o 1  1.28249e+01 1.77821e+00 2.00243e+02 134.515 -1.55609e+01 1.58267e+01  0.00000e+00 0.00000e+00 2.68263e+02 134.515 6.80198e+01 134.515 0.9772 
1 1 1 4   28  17 o 19 4.63822e+00 1.57516e+00 1.36892e+02 17.574  6.38525e+00  2.02230e+00  0.00000e+00 0.00000e+00 2.28384e+01 17.574  1.14054e+02 197.574 0.9220 
1 1 1 4   29  0  o 10 1.93664e+01 4.16176e-01 2.26712e+02 164.861 -3.22777e+00 8.73277e-01  0.00000e+00 0.00000e+00 3.79128e+02 164.861 1.52415e+02 164.861 0.8325 
1 1 1 4   29  1  o 17 1.99011e+01 4.26870e-01 5.46126e+02 19.323  8.75598e+00  3.07029e+00  0.00000e+00 0.00000e+00 1.60256e+02 19.323  3.85871e+02 199.323 0.9445 
1 1 1 4   29  2  o 5  1.42848e+01 4.51531e-01 2.88189e+02 313.407 2.48567e+00  -2.62786e+00 0.00000e+00 0.00000e+00 1.66551e+02 313.407 1.21638e+02 133.407 0.8470 
1 1 1 4   29  3  o 9  1.86528e+01 4.36089e-01 4.27406e+02 40.261  5.45583e+00  4.62043e+00  0.00000e+00 0.00000e+00 2.22590e+02 40.261  2.04816e+02 220.261 0.9272 
1 1 1 4   29  4  o 19 1.48058e+01 5.56337e-01 1.32047e+02 324.284 1.89437e+00  -1.36202e+00 0.00000e+00 0.00000e+00 2.82815e+02 324.284 1.50768e+02 324.284 0.7456 
1 1 1 4   29  5  o 17 1.73549e+01 5.21976e-01 1.59204e+02 40.303  2.59105e+00  2.19758e+00  0.00000e+00 0.00000e+00 3.85724e+02 40.303  2.26519e+02 40.303  0.8356 
1 1 1 4   29  6  o 12 1.61603e+01 5.87641e-01 3.47960e+02 112.319 -2.89217e+00 7.04532e+00  0.00000e+00 0.00000e+00 2.17817e+02 112.319 1.30143e+02 292.319 0.9318 
1 1 1 4   29  7  o 15 7.45459e+00 6.48087e-01 2.89897e+02 200.115 -3.44633e+00 -1.26222e+00 0.00000e+00 0.00000e+00 5.20173e+01 20.115  3.41914e+02 20.115  0.8495 
1 1 1 4   29  8  o 15 1.69879e+01 5.68922e-01 2.25970e+02 36.752  7.51082e+00  5.60910e+00  0.00000e+00 0.00000e+00 3.76902e+02 36.752  1.50932e+02 36.752  0.9451 
1 1 1 4   29  9  o 7  2.01497e+01 8.50867e-01 3.62481e+02 192.168 -2.00798e+01 -4.32967e+00 0.00000e+00 0.00000e+00 3.75257e+02 192.168 1.27767e+01 192.168 0.9753 
1 1 1 4   29  10 o 16 3.42768e+01 7.66480e-01 6.06105e+02 357.460 7.96831e+01  -3.53429e+00 0.00000e+00 0.00000e+00 6.71957e+02 357.460 6.58514e+01 357.460 0.9937 
1 1 1 4   29  11 o 17 5.17561e+00 1.24570e+00 1.62638e+02 44.913  2.88015e+00  2.87146e+00  0.00000e+00 0.00000e+00 5.47022e+00 44.913  1.57167e+02 224.913 0.8661 
1 1 1 4   29  12 o 13 1.52236e+01 8.60213e-01 2.91160e+02 199.114 -2.97254e+01 -1.03017e+01 0.00000e+00 0.00000e+00 2.70341e+02 199.114 2.08196e+01 19.114  0.9840 
1 1 1 4   29  13 o 15 5.25033e+00 1.38049e+00 7.14872e+01 289.741 9.54294e-01  -2.65928e+00 0.00000e+00 0.00000e+00 8.51126e+01 289.741 1.36253e+01 289.741 0.7962 
1 1 1 4   29  14 o 1  5.78708e+00 1.39111e+00 1.39656e+02 196.498 -6.87590e+00 -2.03646e+00 0.00000e+00 0.00000e+00 6.12642e+01 196.498 7.83915e+01 16.498  0.9274 
1 1 1 4   29  15 o 4  4.75759e+00 1.44651e+00 1.24824e+02 16.730  5.57200e+00  1.67483e+00  0.00000e+00 0.00000e+00 3.70372e+01 16.730  8.77872e+01 196.730 0.9094 
1 1 1 4   29  16 o 17 4.54734e+00 1.47958e+00 8.02977e+01 86.828  2.24667e-01  4.05418e+00  0.00000e+00 0.00000e+00 6.68722e+01 86.828  1.34255e+01 266.828 0.8658 
1 1 1 4   29  17 o 5  7.08211e+00 1.79487e+00 7.27695e+01 212.066 -4.01678e+00 -2.51642e+00 0.00000e+00 0.00000e+00 1.61843e+02 212.066 8.90734e+01 212.066 0.8870 
1 1 1 4   30  0  o 6  6.49804e+00 3.59299e-01 1.36402e+02 251.428 -2.40453e-01 -7.15652e-01 0.00000e+00 0.00000e+00 5.02356e+01 71.428  1.86637e+02 71.428  0.3529 
1 1 1 4   30  1  o 3  2.36934e+01 6.77351e-01 3.31840e+02 304.145 3.91682e+00  -5.77526e+00 0.00000e+00 0.00000e+00 4.92003e+02 304.145 1.60163e+02 304.145 0.9253 
1 1 1 4   30  2  o 3  2.72896e+01 6.72096e-01 4.07462e+02 163.294 -1.01016e+01 3.03187e+00  0.00000e+00 0.00000e+00 5.68210e+02 163.294 1.60749e+02 163.294 0.9513 
1 1 1 4   30  3  o 19 1.66773e+01 4.19127e-01 3.81608e+02 86.543  4.06548e-01  6.72999e+00  0.00000e+00 0.00000e+00 1.96597e+02 86.543  1.85010e+02 266.543 0.9225 
1 1 1 4   30  4  o 13 2.88002e+01 7.16814e-01 6.33267e+02 165.734 -1.94281e+01 4.94001e+00  0.00000e+00 0.00000e+00 4.21680e+02 165.734 2.11588e+02 345.734 0.9747 
1 1 1 4   30  5  o 17 4.05938e+01 7.41705e-01 7.11959e+02 22.435  3.46801e+01  1.43186e+01  0.00000e+00 0.00000e+00 7.92896e+02 22.435  8.09365e+01 22.435  0.9866 
1 1 1 4   30  6  o 18 1.60382e+01 4.84952e-01 2.67423e+02 60.688  3.34374e+00  5.95555e+00  0.00000e+00 0.00000e+00 2.89066e+02 60.688  2.16434e+01 60.688  0.9236 
1 1 1 4   30  7  o 17 2.02755e+01 5.40352e-01 3.27783e+02 204.430 -1.03948e+01 -4.72182e+00 0.00000e+00 0.00000e+00 3.99604e+02 204.430 7.18216e+01 204.430 0.9551 
1 1 1 4   30  8  o 1  3.16136e+01 6.66942e-01 5.54826e+02 81.658  6.08623e+00  4.15061e+01  0.00000e+00 0.00000e+00 6.17985e+02 81.658  6.31592e+01 81.658  0.9880 
1 1 1 4   30  9  o 19 3.56691e+01 7.50412e-01 6.10249e+02 142.506 -4.88156e+01 3.74491e+01  0.00000e+00 0.00000e+00 7.17671e+02 142.506 1.07422e+02 142.506 0.9918 
1 1 1 4   30  10 o 10 1.00706e+01 9.77326e-01 1.59758e+02 308.224 4.07502e+00  -5.17392e+00 0.00000e+00 0.00000e+00 1.88083e+02 308.224 2.83248e+01 308.224 0.9206 
1 1 1 4   30  11 o 13 2.17990e+01 7.41975e-01 3.81966e+02 221.019 -3.66513e+01 -3.18823e+01 0.00000e+00 0.00000e+00 4.27069e+02 221.019 4.51033e+01 221.019 0.9897 
1 1 1 4   30  12 o 9  1.14599e+01 9.76298e-01 3.42894e+02 86.606  1.57701e+00  2.65878e+01  0.00000e+00 0.00000e+00 7.84955e+01 86.606  2.64399e+02 266.606 0.9810 
1 1 1 4   30  13 o 5  7.48550e+00 1.47383e+00 8.36316e+01 2.059   4.53169e+00  1.62885e-01  0.00000e+00 0.00000e+00 1.63492e+02 2.059   7.98608e+01 2.059   0.8813 
1 1 1 4   30  14 o 9  1.08665e+01 1.70768e+00 2.20548e+02 272.025 6.69037e-01  -1.89190e+01 0.00000e+00 0.00000e+00 1.75332e+02 272.025 4.52164e+01 92.025  0.9732 
1 1 1 4   30  15 o 3  1.33117e+01 1.48251e+00 1.92083e+02 85.160  2.15713e+00  2.54742e+01  0.00000e+00 0.00000e+00 2.96023e+02 85.160  1.03939e+02 85.160  0.9802 
1 1 1 4   30  16 o 16 1.35054e+01 1.78724e+00 2.41599e+02 339.806 2.81499e+01  -1.03540e+01 0.00000e+00 0.00000e+00 2.54710e+02 339.806 1.31110e+01 339.806 0.9832 
1 1 1 4   30  17 o 7  5.41904e+00 1.80187e+00 7.07996e+01 115.737 -1.60466e+00 3.32873e+00  0.00000e+00 0.00000e+00 1.01361e+02 115.737 3.05611e+01 115.737 0.8507 
1 1 1 4   31  0  o 12 3.33460e+01 6.23157e-01 6.64291e+02 232.782 -1.18646e+01 -1.56207e+01 0.00000e+00 0.00000e+00 5.56169e+02 232.782 1.08122e+02 52.782  0.9742 
1 1 1 4   31  1  o 4  1.93621e+01 4.26319e-01 2.57855e+02 304.192 2.46100e+00  -3.62239e+00 0.00000e+00 0.00000e+00 3.79957e+02 304.192 1.22102e+02 304.192 0.8767 
1 1 1 4   31  2  o 17 2.01346e+01 4.43286e-01 5.39237e+02 26.827  8.79152e+00  4.44604e+00  0.00000e+00 0.00000e+00 1.77888e+02 26.827  3.61349e+02 206.827 0.9478 
1 1 1 4   31  3  o 1  4.04321e+01 7.29548e-01 7.36280e+02 177.018 -3.08596e+01 1.60734e+00  0.00000e+00 0.00000e+00 7.58301e+02 177.018 2.20217e+01 177.018 0.9837 
1 1 1 4   31  4  o 10 1.97534e+01 5.74170e-01 2.88977e+02 346.924 7.30039e+00  -1.69557e+00 0.00000e+00 0.00000e+00 4.01827e+02 346.924 1.12851e+02 346.924 0.9307 
1 1 1 4   31  5  o 4  2.62335e+01 5.49990e-01 4.53965e+02 229.130 -1.01166e+01 -1.16914e+01 0.00000e+00 0.00000e+00 4.99255e+02 229.130 4.52896e+01 229.130 0.9671 
1 1 1 4   31  6  o 7  9.52754e+00 5.71296e-01 2.69692e+02 282.558 8.65220e-01  -3.88420e+00 0.00000e+00 0.00000e+00 3.90832e+01 282.558 2.30609e+02 102.558 0.8627 
1 1 1 4   31  7  o 11 2.22347e+01 5.58188e-01 2.75029e+02 12.445  1.25347e+01  2.76626e+00  0.00000e+00 0.00000e+00 5.26815e+02 12.445  2.51786e+02 12.445  0.9602 
1 1 1 4   31  8  o 12 1.48136e+01 5.89369e-01 3.65766e+02 306.790 8.68237e+00  -1.16101e+01 0.00000e+00 0.00000e+00 1.70878e+02 306.790 1.94888e+02 126.790 0.9649 
1 1 1 4   31  9  o 1  1.97967e+01 6.84556e-01 3.17459e+02 274.073 1.42361e+00  -1.99907e+01 0.00000e+00 0.00000e+00 4.06769e+02 274.073 8.93101e+01 274.073 0.9747 
1 1 1 4   31  10 o 1  8.92844e+00 9.54294e-01 1.51162e+02 214.243 -4.56833e+00 -3.10968e+00 0.00000e+00 0.00000e+00 1.51747e+02 214.243 5.85110e-01 214.243 0.9043 
1 1 1 4   31  11 o 5  3.78356e+00 1.10902e+00 3.61652e+01 106.005 -1.97372e-01 6.88104e-01  0.00000e+00 0.00000e+00 1.16188e+01 106.005 2.45463e+01 286.005 0.3368 
1 1 1 4   31  12 o 14 6.12824e+00 1.27898e+00 7.35501e+01 265.612 -2.14561e-01 -2.79620e+00 0.00000e+00 0.00000e+00 1.08907e+02 265.612 3.53570e+01 265.612 0.7944 
1 1 1 4   31  13 o 7  1.18573e+01 9.94790e-01 2.27576e+02 24.399  2.14330e+01  9.72211e+00  0.00000e+00 0.00000e+00 2.07006e+02 24.399  2.05702e+01 204.399 0.9785 
1 1 1 4   31  14 o 2  3.99354e+00 1.27175e+00 9.37194e+01 191.924 -3.57616e+00 -7.55162e-01 0.00000e+00 0.00000e+00 3.31610e+01 191.924 6.05584e+01 11.924  0.8488 
1 1 1 4   31  15 o 19 9.83773e+00 1.72282e+00 6.46371e+01 355.064 5.53283e+00  -4.77792e-01 0.00000e+00 0.00000e+00 2.68302e+02 355.064 2.03665e+02 355.064 0.9048 
1 1 1 4   31  16 o 7  3.88830e+00 1.36348e+00 1.01684e+02 61.136  2.14903e+00  3.89881e+00  0.00000e+00 0.00000e+00 2.60387e+01 61.136  7.56454e+01 241.136 0.8789 
1 1 1 4   31  17 o 11 5.35027e+00 1.74844e+00 9.23507e+01 72.049  1.50578e+00  4.64797e+00  0.00000e+00 0.00000e+00 8.55973e+01 72.049  6.75344e+00 252.050 0.8907 
1 1 1 4   32  0  o 6  3.61849e+01 6.61046e-01 6.71209e+02 10.469  2.28652e+01  4.22495e+00  0.00000e+00 0.00000e+00 6.58600e+02 10.469  1.26092e+01 190.469 0.9783 
1 1 1 4   32  1  o 9  1.55831e+01 3.87540e-01 3.50167e+02 245.152 -2.18030e+00 -4.70815e+00 0.00000e+00 0.00000e+00 1.75357e+02 245.152 1.74810e+02 65.152  0.8976 
1 1 1 4   32  2  o 12 9.52214e+00 4.67523e-01 1.93517e+02 200.673 -1.84344e+00 -6.95597e-01 0.00000e+00 0.00000e+00 5.43746e+01 200.673 1.39143e+02 20.673  0.6928 
1 1 1 4   32  3  o 18 1.72194e+01 4.25657e-01 4.14528e+02 240.512 -4.24401e+00 -7.50499e+00 0.00000e+00 0.00000e+00 1.93725e+02 240.512 2.20803e+02 60.512  0.9401 
1 1 1 4   32  4  o 8  5.02278e+01 1.06907e+00 8.57619e+02 133.530 -3.78653e+01 3.98600e+01  0.00000e+00 0.00000e+00 1.01235e+03 133.530 1.54735e+02 133.530 0.9909 
1 1 1 4   32  5  o 16 5.22664e+01 1.03131e+00 1.07740e+03 229.559 -4.58124e+01 -5.37510e+01 0.00000e+00 0.00000e+00 8.72234e+02 229.559 2.05171e+02 49.559  0.9929 
1 1 1 4   32  6  o 1  3.86115e+01 7.27886e-01 6.10869e+02 4.971   3.59793e+01  3.12945e+00  0.00000e+00 0.00000e+00 8.19246e+02 4.971   2.08377e+02 4.971   0.9861 
1 1 1 4   32  7  o 1  3.39229e+01 6.80531e-01 5.37402e+02 164.158 -3.64396e+01 1.03403e+01  0.00000e+00 0.00000e+00 7.19590e+02 164.158 1.82188e+02 164.158 0.9867 
1 1 1 4   32  8  o 6  2.17855e+01 5.87160e-01 4.43477e+02 43.403  1.87258e+01  1.77100e+01  0.00000e+00 0.00000e+00 3.58372e+02 43.403  8.51046e+01 223.403 0.9804 
1 1 1 4   32  9  o 9  2.68729e+01 8.79962e-01 3.33537e+02 298.932 1.31256e+01  -2.37454e+01 0.00000e+00 0.00000e+00 6.56208e+02 298.932 3.22671e+02 298.932 0.9814 
1 1 1 4   32  10 o 10 1.14746e+01 8.36445e-01 1.57728e+02 253.614 -2.11633e+00 -7.19704e+00 0.00000e+00 0.00000e+00 2.42908e+02 253.614 8.51807e+01 253.614 0.9307 
1 1 1 4   32  11 o 8  1.46240e+01 7.97598e-01 2.58782e+02 72.202  6.40455e+00  1.99503e+01  0.00000e+00 0.00000e+00 2.76298e+02 72.202  1.75166e+01 72.202  0.9758 
1 1 1 4   32  12 o 12 1.24718e+01 9.82044e-01 3.12632e+02 138.807 -2.08283e+01 1.82292e+01  0.00000e+00 0.00000e+00 1.46224e+02 138.807 1.66408e+02 318.807 0.9818 
1 1 1 4   32  13 o 11 1.63448e+01 9.35235e-01 3.01502e+02 351.392 4.33496e+01  -6.56246e+00 0.00000e+00 0.00000e+00 3.03626e+02 351.392 2.12371e+00 351.392 0.9885 
1 1 1 4   32  14 o 7  1.24750e+01 1.34162e+00 1.90353e+02 117.350 -1.06588e+01 2.06066e+01  0.00000e+00 0.00000e+00 2.66377e+02 117.350 7.60243e+01 117.350 0.9782 
1 1 1 4   32  15 o 8  1.47923e+01 1.47941e+00 2.20562e+02 317.937 2.38378e+01  -2.15111e+01 0.00000e+00 0.00000e+00 3.23990e+02 317.937 1.03428e+02 317.937 0.9843 
1 1 1 4   32  16 o 7  9.68628e+00 2.25688e+00 1.21126e+02 265.093 -7.01777e-01 -8.17419e+00 0.00000e+00 0.00000e+00 2.18021e+02 265.093 9.68946e+01 265.093 0.9369 
1 1 1 4   32  17 o 15 4.96256e+00 1.67627e+00 1.52647e+02 246.034 -3.29186e+00 -7.40560e+00 0.00000e+00 0.00000e+00 2.08105e+01 246.034 1.31837e+02 66.034  0.9361 
1 1 1 4   33  0  o 4  2.71195e+01 5.29979e-01 4.27451e+02 227.290 -7.43013e+00 -8.04908e+00 0.00000e+00 0.00000e+00 5.43588e+02 227.290 1.16137e+02 227.290 0.9532 
1 1 1 4   33  1  o 3  6.56668e+00 4.25901e-01 3.44053e+01 146.189 -1.69765e-01 1.13695e-01  0.00000e+00 0.00000e+00 9.33278e+00 326.189 4.37380e+01 326.189 0.1016 
1 1 1 4   33  2  o 12 2.20253e+01 4.69149e-01 5.24566e+02 163.486 -1.16938e+01 3.46687e+00  0.00000e+00 0.00000e+00 2.68269e+02 163.486 2.56297e+02 343.486 0.9581 
1 1 1 4   33  3  o 8  1.67947e+01 6.10748e-01 3.53313e+02 304.818 4.03118e+00  -5.79614e+00 0.00000e+00 0.00000e+00 2.31123e+02 304.818 1.22190e+02 124.818 0.9262 
1 1 1 4   33  4  o 12 1.25179e+01 4.51884e-01 3.31789e+02 113.431 -1.95738e+00 4.51650e+00  0.00000e+00 0.00000e+00 8.75039e+01 113.431 2.44285e+02 293.431 0.8916 
1 1 1 4   33  5  o 3  1.17167e+01 4.66426e-01 2.96719e+02 58.549  2.40412e+00  3.93064e+00  0.00000e+00 0.00000e+00 9.21095e+01 58.549  2.04609e+02 238.549 0.8834 
1 1 1 4   33  6  o 11 1.42194e+01 5.80694e-01 2.97938e+02 14.846  7.71732e+00  2.04564e+00  0.00000e+00 0.00000e+00 2.01467e+02 14.846  9.64707e+01 194.846 0.9351 
1 1 1 4   33  7  o 7  2.67028e+01 5.98484e-01 2.69478e+02 209.397 -1.30482e+01 -7.35149e+00 0.00000e+00 0.00000e+00 6.99138e+02 209.397 4.29660e+02 209.397 0.9660 
1 1 1 4   33  8  o 15 2.53334e+01 6.18358e-01 4.62509e+02 14.471  2.95177e+01  7.61794e+00  0.00000e+00 0.00000e+00 4.72749e+02 14.471  1.02402e+01 14.471  0.9835 
1 1 1 4   33  9  o 19 5.28713e+01 9.84727e-01 8.97482e+02 188.608 -1.44665e+02 -2.19005e+01 0.00000e+00 0.00000e+00 1.07975e+03 188.608 1.82266e+02 188.608 0.9966 
1 1 1 4   33  10 o 9  3.37102e+01 7.62557e-01 5.78158e+02 3.610   8.37677e+01  5.28442e+00  0.00000e+00 0.00000e+00 6.78748e+02 3.610   1.00591e+02 3.610   0.9940 
1 1 1 4   33  11 o 17 3.36848e+00 1.05282e+00 8.08691e+01 192.610 -1.41305e+00 -3.16121e-01 0.00000e+00 0.00000e+00 7.24118e+00 12.610  8.81102e+01 12.610  0.5830 
1 1 1 4   33  12 o 15 2.63738e+01 7.99276e-01 4.77025e+02 214.947 -8.25740e+01 -5.77046e+01 0.00000e+00 0.00000e+00 5.06320e+02 214.947 2.92947e+01 214.947 0.9950 
1 1 1 4   33  13 o 14 8.98382e+00 1.23728e+00 2.10328e+02 27.902  1.33673e+01  7.07806e+00  0.00000e+00 0.00000e+00 1.14787e+02 27.902  9.55407e+01 207.902 0.9664 
1 1 1 4   33  14 f 0  1.05140e+01 1.53891e+00 8.81025e+01 32.030  6.93850e+00  4.34079e+00  0.00000e+00 0.00000e+00 2.80488e+02 32.030  1.92386e+02 32.030  0.9368 
1 1 1 4   33  15 o 12 1.65979e+01 1.23940e+00 3.60335e+02 344.008 6.34303e+01  -1.81781e+01 0.00000e+00 0.00000e+00 2.55655e+02 344.008 1.04680e+02 164.009 0.9924 
1 1 1 4   33  16 o 14 5.39658e+00 1.74225e+00 5.34357e+01 220.168 -2.03203e+00 -1.71523e+00 0.00000e+00 0.00000e+00 1.04110e+02 220.168 5.06741e+01 220.168 0.7813 
1 1 1 4   33  17 o 13 5.17298e+00 1.55022e+00 3.58496e+01 11.985  2.11043e+00  4.48007e-01  0.00000e+00 0.00000e+00 1.03597e+02 11.985  6.77479e+01 11.985  0.7220 
1 1 1 4   34  0  o 18 2.48642e+01 5.01766e-01 4.06069e+02 236.536 -5.00871e+00 -7.57764e+00 0.00000e+00 0.00000e+00 4.74827e+02 236.536 6.87578e+01 236.536 0.9432 
1 1 1 4   34  1  o 6  1.55182e+01 3.91570e-01 7.93463e+01 189.989 -1.29298e+00 -2.27726e-01 0.00000e+00 0.00000e+00 2.39152e+02 189.989 1.59806e+02 189.989 0.5464 
1 1 1 4   34  2  f 0  2.36636e+01 6.28897e-01 3.58087e+02 261.085 -1.36177e+00 -8.68112e+00 0.00000e+00 0.00000e+00 4.78681e+02 261.085 1.20594e+02 261.085 0.9413 
1 1 1 4   34  3  o 5  1.59149e+01 4.18170e-01 2.14271e+02 273.505 2.30142e-01  -3.75770e+00 0.00000e+00 0.00000e+00 2.96227e+02 273.505 8.19566e+01 273.505 0.8538 
1 1 1 4   34  4  o 14 1.60122e+01 4.41878e-01 2.39988e+02 352.761 4.68817e+00  -5.95516e-01 0.00000e+00 0.00000e+00 2.93326e+02 352.761 5.33374e+01 352.761 0.8866 
1 1 1 4   34  5  o 10 5.81055e+01 1.01556e+00 9.24354e+02 45.544  5.02786e+01  5.12417e+01  0.00000e+00 0.00000e+00 1.24295e+03 45.544  3.18599e+02 45.544  0.9930 
1 1 1 4   34  6  o 14 3.26182e+01 6.49099e-01 5.75963e+02 103.286 -7.55269e+00 3.19858e+01  0.00000e+00 0.00000e+00 6.30247e+02 103.286 5.42843e+01 103.286 0.9847 
1 1 1 4   34  7  f 0  1.27618e+01 6.64075e-01 1.29885e+02 289.247 1.18035e+00  -3.38057e+00 0.00000e+00 0.00000e+00 2.75108e+02 289.247 1.45223e+02 289.247 0.8452 
1 1 1 4   34  8  o 5  1.13980e+01 6.57079e-01 1.56232e+02 205.109 -4.39792e+00 -2.06098e+00 0.00000e+00 0.00000e+00 2.24516e+02 205.109 6.82832e+01 205.109 0.8900 
1 1 1 4   34  9  o 9  2.76063e+01 6.82275e-01 4.68061e+02 327.607 3.45140e+01  -2.18975e+01 0.00000e+00 0.00000e+00 5.55031e+02 327.607 8.69703e+01 327.607 0.9877 
1 1 1 4   34  10 o 12 1.54621e+01 9.91440e-01 3.86762e+02 128.510 -1.62093e+01 2.03708e+01  0.00000e+00 0.00000e+00 1.81914e+02 128.510 2.04848e+02 308.510 0.9806 
1 1 1 4   34  11 o 5  2.12903e+01 7.22340e-01 4.02224e+02 250.089 -1.75203e+01 -4.83710e+01 0.00000e+00 0.00000e+00 3.88116e+02 250.089 1.41078e+01 70.089  0.9902 
1 1 1 4   34  12 o 13 1.59217e+01 8.33488e-01 2.99046e+02 308.227 2.21434e+01  -2.81116e+01 0.00000e+00 0.00000e+00 2.89114e+02 308.227 9.93253e+00 128.227 0.9859 
1 1 1 4   34  13 o 7  9.89757e+00 1.32654e+00 2.27907e+02 124.036 -1.06007e+01 1.56951e+01  0.00000e+00 0.00000e+00 1.32791e+02 124.036 9.51164e+01 304.036 0.9732 
1 1 1 4   34  14 o 11 1.37334e+01 1.32056e+00 3.10737e+02 7.887   3.98179e+01  5.51598e+00  0.00000e+00 0.00000e+00 1.96740e+02 7.887   1.13996e+02 187.887 0.9875 
1 1 1 4   34  15 o 12 4.53674e+00 1.48599e+00 3.36710e+01 201.047 -1.51026e+00 -5.81145e-01 0.00000e+00 0.00000e+00 7.21916e+01 201.047 3.85205e+01 201.047 0.6240 
1 1 1 4   34  16 o 15 1.07347e+01 2.06532e+00 1.55846e+02 204.230 -1.20532e+01 -5.42459e+00 0.00000e+00 0.00000e+00 2.29761e+02 204.230 7.39151e+01 204.230 0.9614 
1 1 1 4   34  17 o 10 5.19400e+00 1.62585e+00 4.95482e+01 243.047 -1.22104e+00 -2.40133e+00 0.00000e+00 0.00000e+00 1.02578e+02 243.047 5.30302e+01 243.047 0.7845 
1 1 1 4   35  0  o 5  1.95244e+01 4.53888e-01 4.24208e+02 194.385 -8.51039e+00 -2.18273e+00 0.00000e+00 0.00000e+00 2.65982e+02 194.385 1.58226e+02 14.385  0.9412 
1 1 1 4   35  1  o 16 2.09111e+01 4.50773e-01 2.26975e+02 111.066 -1.78992e+00 4.64684e+00  0.00000e+00 0.00000e+00 4.74369e+02 111.066 2.47395e+02 111.066 0.8929 
1 1 1 4   35  2  o 6  1.38866e+01 4.49485e-01 2.27122e+02 204.860 -3.43958e+00 -1.59371e+00 0.00000e+00 0.00000e+00 2.18865e+02 204.860 8.25665e+00 24.860  0.8550 
1 1 1 4   35  3  o 16 1.33794e+01 5.65533e-01 2.08725e+02 137.439 -2.69136e+00 2.47145e+00  0.00000e+00 0.00000e+00 2.17854e+02 137.439 9.12926e+00 137.439 0.8488 
1 1 1 4   35  4  o 10 5.37722e+00 5.27240e-01 3.82944e+01 24.327  2.44599e-01  1.10579e-01  0.00000e+00 0.00000e+00 1.14262e+01 204.327 4.97206e+01 204.327 0.1330 
1 1 1 4   35  5  o 13 3.52814e+01 6.73019e-01 5.62857e+02 253.521 -7.59496e+00 -2.56753e+01 0.00000e+00 0.00000e+00 7.37275e+02 253.521 1.74418e+02 253.521 0.9811 
1 1 1 4   35  6  o 9  1.84233e+01 7.29445e-01 1.00280e+02 139.505 -2.38602e+00 2.03747e+00  0.00000e+00 0.00000e+00 4.66788e+02 139.505 3.66508e+02 139.505 0.8197 
1 1 1 4   35  7  o 14 2.46713e+01 5.84320e-01 3.21537e+02 164.828 -1.69730e+01 4.60260e+00  0.00000e+00 0.00000e+00 5.77967e+02 164.828 2.56430e+02 164.828 0.9711 
1 1 1 4   35  8  o 15 8.82049e+00 7.41149e-01 1.74778e+02 33.817  3.55037e+00  2.37826e+00  0.00000e+00 0.00000e+00 1.14317e+02 33.817  6.04605e+01 213.817 0.8733 
1 1 1 4   35  9  o 4  1.58557e+01 6.68385e-01 3.20382e+02 96.211  -1.79493e+00 1.64932e+01  0.00000e+00 0.00000e+00 2.56282e+02 96.211  6.40998e+01 276.211 0.9694 
1 1 1 4   35  10 o 14 3.42965e+00 1.04862e+00 3.19896e+01 220.611 -3.77541e-01 -3.23722e-01 0.00000e+00 0.00000e+00 9.55909e-01 40.611  3.29455e+01 40.611  0.2413 
1 1 1 4   35  11 o 9  1.00352e+01 1.26706e+00 1.66306e+02 269.046 -1.51283e-01 -9.08850e+00 0.00000e+00 0.00000e+00 1.88523e+02 269.046 2.22178e+01 269.046 0.9433 
1 1 1 4   35  12 o 12 1.25127e+01 9.27988e-01 2.30531e+02 132.807 -1.55984e+01 1.68404e+01  0.00000e+00 0.00000e+00 2.27922e+02 132.807 2.60888e+00 312.807 0.9780 
1 1 1 4   35  13 o 15 1.38444e+01 1.14988e+00 2.07184e+02 266.578 -1.52037e+00 -2.54243e+01 0.00000e+00 0.00000e+00 3.00898e+02 266.578 9.37140e+01 266.578 0.9802 
1 1 1 4   35  14 o 8  9.59890e+00 1.49407e+00 1.86828e+02 357.364 1.55185e+01  -7.14496e-01 0.00000e+00 0.00000e+00 1.60575e+02 357.364 2.62528e+01 177.364 0.9673 
1 1 1 4   35  15 o 9  1.18947e+01 1.87033e+00 2.36532e+02 290.342 8.24816e+00  -2.22480e+01 0.00000e+00 0.00000e+00 1.98736e+02 290.342 3.77966e+01 110.342 0.9787 
1 1 1 4   35  16 o 4  1.14989e+01 2.12022e+00 1.70671e+02 127.693 -9.16385e+00 1.18594e+01  0.00000e+00 0.00000e+00 2.44343e+02 127.693 7.36721e+01 127.693 0.9660 
1 1 1 4   35  17 o 4  6.14857e+00 1.79026e+00 1.14222e+02 106.519 -1.94457e+00 6.55666e+00  0.00000e+00 0.00000e+00 9.77823e+01 106.519 1.64399e+01 286.519 0.9237 
1 1 1 4   36  0  o 7  3.38970e+01 5.75491e-01 6.96464e+02 252.044 -7.58412e+00 -2.34030e+01 0.00000e+00 0.00000e+00 5.50331e+02 252.044 1.46133e+02 72.044  0.9795 
1 1 1 4   36  1  o 8  1.11585e+01 3.51105e-01 1.16686e+02 30.952  1.15829e+00  6.94659e-01  0.00000e+00 0.00000e+00 1.16740e+02 30.952  5.43168e-02 30.952  0.5570 
1 1 1 4   36  2  o 1  1.27674e+01 3.89714e-01 2.37761e+02 324.192 2.73287e+00  -1.97159e+00 0.00000e+00 0.00000e+00 1.62188e+02 324.192 7.55730e+01 144.192 0.8340 
1 1 1 4   36  3  o 15 4.91682e+01 9.66306e-01 1.02170e+03 162.709 -5.61652e+01 1.74840e+01  0.00000e+00 0.00000e+00 8.09348e+02 162.709 2.12347e+02 342.709 0.9915 
1 1 1 4   36  4  o 17 4.56235e+01 8.16184e-01 8.63206e+02 227.893 -3.35298e+01 -3.70996e+01 0.00000e+00 0.00000e+00 8.33152e+02 227.893 3.00538e+01 47.893  0.9900 
1 1 1 4   36  5  o 2  2.59399e+01 5.56283e-01 3.19362e+02 47.026  8.94244e+00  9.59827e+00  0.00000e+00 0.00000e+00 6.16908e+02 47.026  2.97546e+02 47.026  0.9611 
1 1 1 4   36  6  f 0  1.22809e+01 5.02693e-01 1.25362e+02 131.583 -1.75941e+00 1.98286e+00  0.00000e+00 0.00000e+00 2.34528e+02 131.583 1.09165e+02 131.583 0.7805 
1 1 1 4   36  7  o 15 1.58697e+01 5.39821e-01 2.07863e+02 95.496  -7.74184e-01 8.04655e+00  0.00000e+00 0.00000e+00 3.49708e+02 95.496  1.41845e+02 95.496  0.9359 
1 1 1 4   36  8  o 10 1.57702e+01 7.46631e-01 1.82472e+02 22.997  7.90892e+00  3.35673e+00  0.00000e+00 0.00000e+00 3.73767e+02 22.997  1.91294e+02 22.997  0.9399 
1 1 1 4   36  9  o 18 4.94407e+00 1.08291e+00 1.93799e+02 312.726 2.18616e+00  -2.36699e+00 0.00000e+00 0.00000e+00 4.07530e+01 132.726 2.34552e+02 132.726 0.8252 
1 1 1 4   36  10 o 10 1.40392e+01 7.35622e-01 1.98525e+02 167.514 -1.29140e+01 2.85961e+00  0.00000e+00 0.00000e+00 3.07623e+02 167.514 1.09098e+02 167.514 0.9614 
1 1 1 4   36  11 o 2  2.03575e+01 7.30554e-01 3.18631e+02 154.825 -3.93170e+01 1.84803e+01  0.00000e+00 0.00000e+00 4.35557e+02 154.825 1.16926e+02 154.825 0.9884 
1 1 1 4   36  12 o 9  4.65875e+00 1.18909e+00 1.12527e+02 212.878 -3.22873e+00 -2.08700e+00 0.00000e+00 0.00000e+00 3.70830e+01 212.878 7.54443e+01 32.878  0.8573 
1 1 1 4   36  13 o 14 1.23001e+01 1.22594e+00 2.07359e+02 330.833 1.99258e+01  -1.11212e+01 0.00000e+00 0.00000e+00 2.42929e+02 330.833 3.55692e+01 330.833 0.9778 
1 1 1 4   36  14 o 2  1.26976e+01 1.39255e+00 2.12171e+02 4.180   2.61712e+01  1.91293e+00  0.00000e+00 0.00000e+00 2.53748e+02 4.180   4.15775e+01 4.180   0.9808 
1 1 1 4   36  15 o 17 4.32486e+00 1.44016e+00 5.35456e+00 158.457 -2.30156e-01 9.08584e-02  0.00000e+00 0.00000e+00 1.44983e+01 158.457 9.14372e+00 158.457 0.1228 
1 1 1 4   36  16 o 4  6.96729e+00 1.99660e+00 8.59481e+01 242.758 -2.25282e+00 -4.37568e+00 0.00000e+00 0.00000e+00 1.46096e+02 242.758 6.01483e+01 242.758 0.8915 
1 1 1 4   36  17 o 5  6.72215e+00 1.87552e+00 6.86549e+01 245.244 -1.79790e+00 -3.89882e+00 0.00000e+00 0.00000e+00 1.50619e+02 245.244 8.19638e+01 245.244 0.8739 
1 1 1 4   37  0  o 15 2.67547e+01 4.84520e-01 5.31197e+02 197.827 -1.62930e+01 -5.23949e+00 0.00000e+00 0.00000e+00 4.43621e+02 197.827 8.75761e+01 17.827  0.9703 
1 1 1 4   37  1  o 5  3.06403e+01 5.94192e-01 5.67487e+02 294.703 8.65829e+00  -1.88219e+01 0.00000e+00 0.00000e+00 5.55067e+02 294.703 1.24194e+01 114.703 0.9756 
1 1 1 4   37  2  o 16 3.19983e+01 6.05085e-01 4.96455e+02 50.240  1.33362e+01  1.60291e+01  0.00000e+00 0.00000e+00 6.76124e+02 50.240  1.79668e+02 50.240  0.9757 
1 1 1 4   37  3  o 16 1.95650e+01 4.56448e-01 3.28437e+02 215.438 -6.45477e+00 -4.59359e+00 0.00000e+00 0.00000e+00 3.58296e+02 215.438 2.98587e+01 215.438 0.9346 
1 1 1 4   37  4  o 17 2.79538e+01 5.66717e-01 5.43774e+02 326.443 1.67795e+01  -1.11300e+01 0.00000e+00 0.00000e+00 4.79630e+02 326.443 6.41442e+01 146.443 0.9748 
1 1 1 4   37  5  o 15 4.74108e+01 8.51647e-01 8.84381e+02 180.047 -6.39394e+01 -5.21676e-02 0.00000e+00 0.00000e+00 8.81968e+02 180.047 2.41286e+00 0.047   0.9921 
1 1 1 4   37  6  o 7  3.80754e+01 7.26070e-01 6.61469e+02 305.839 2.50958e+01  -3.47467e+01 0.00000e+00 0.00000e+00 7.51279e+02 305.839 8.98100e+01 305.839 0.9883 
1 1 1 4   37  7  o 4  1.59501e+01 5.49325e-01 1.86307e+02 114.309 -2.94686e+00 6.52380e+00  0.00000e+00 0.00000e+00 3.68841e+02 114.309 1.82533e+02 114.309 0.9273 
1 1 1 4   37  8  o 10 2.07621e+01 6.10290e-01 3.48556e+02 38.130  1.70982e+01  1.34213e+01  0.00000e+00 0.00000e+00 4.12394e+02 38.130  6.38381e+01 38.130  0.9767 
1 1 1 4   37  9  o 3  3.04522e+01 8.03246e-01 4.92560e+02 188.066 -5.02198e+01 -7.11665e+00 0.00000e+00 0.00000e+00 6.38418e+02 188.066 1.45858e+02 188.066 0.9901 
1 1 1 4   37  10 o 1  2.27443e+01 6.88448e-01 4.07384e+02 37.011  3.44672e+01  2.59837e+01  0.00000e+00 0.00000e+00 4.35486e+02 37.011  2.81018e+01 37.011  0.9883 
1 1 1 4   37  11 o 4  5.95387e+00 1.12166e+00 6.27764e+01 332.710 2.03314e+00  -1.04895e+00 0.00000e+00 0.00000e+00 1.02300e+02 332.710 3.95232e+01 332.710 0.7398 
1 1 1 4   37  12 o 17 1.25464e+01 9.69444e-01 1.96438e+02 250.708 -6.45991e+00 -1.84552e+01 0.00000e+00 0.00000e+00 2.61333e+02 250.708 6.48947e+01 250.708 0.9741 
1 1 1 4   37  13 o 18 1.21362e+01 1.18987e+00 1.93655e+02 210.518 -1.78328e+01 -1.05120e+01 0.00000e+00 0.00000e+00 2.49545e+02 210.518 5.58899e+01 210.518 0.9755 
1 1 1 4   37  14 o 2  7.35950e+00 1.48426e+00 1.33255e+02 339.434 8.27633e+00  -3.10522e+00 0.00000e+00 0.00000e+00 1.25986e+02 339.434 7.26900e+00 159.434 0.9416 
1 1 1 4   37  15 o 13 5.66613e+00 1.70705e+00 1.21251e+02 283.779 1.50255e+00  -6.12696e+00 0.00000e+00 0.00000e+00 7.29615e+01 283.779 4.82896e+01 103.779 0.9169 
1 1 1 4   37  16 f 0  5.88095e+00 1.68798e+00 1.02399e+02 42.874  4.45170e+00  4.13296e+00  0.00000e+00 0.00000e+00 9.82722e+01 42.874  4.12635e+00 222.874 0.9135 
1 1 1 4   37  17 o 1  5.71246e+00 1.75603e+00 7.43202e+01 56.954  2.34909e+00  3.61098e+00  0.00000e+00 0.00000e+00 1.12099e+02 56.954  3.77789e+01 56.954  0.8744 
1 1 1 4   38  0  o 13 1.61453e+01 4.73478e-01 2.62672e+02 103.018 -1.06070e+00 4.58781e+00  0.00000e+00 0.00000e+00 2.74507e+02 103.018 1.18347e+01 103.018 0.8862 
1 1 1 4   38  1  o 12 2.96731e+01 5.26721e-01 6.56443e+02 143.060 -1.71457e+01 1.28923e+01  0.00000e+00 0.00000e+00 4.31507e+02 143.060 2.24936e+02 323.059 0.9764 
1 1 1 4   38  2  o 16 2.98018e+01 5.33830e-01 5.79122e+02 71.404  6.56223e+00  1.95034e+01  0.00000e+00 0.00000e+00 5.12487e+02 71.404  6.66353e+01 251.404 0.9754 
1 1 1 4   38  3  o 19 1.81119e+01 4.43459e-01 3.38459e+02 209.305 -6.99529e+00 -3.92637e+00 0.00000e+00 0.00000e+00 2.97779e+02 209.305 4.06801e+01 29.305  0.9354 
1 1 1 4   38  4  o 19 2.40577e+01 5.23193e-01 3.88999e+02 9.611   1.21464e+01  2.05684e+00  0.00000e+00 0.00000e+00 4.76922e+02 9.611   8.79228e+01 9.611   0.9585 
1 1 1 4   38  5  o 10 4.45739e+01 8.10744e-01 9.90903e+02 274.612 6.62201e+00  -8.20956e+01 0.00000e+00 0.00000e+00 6.72530e+02 274.612 3.18373e+02 94.612  0.9939 
1 1 1 4   38  6  f 0  1.67853e+01 5.04279e-01 2.23459e+02 17.345  7.50257e+00  2.34319e+00  0.00000e+00 0.00000e+00 3.65104e+02 17.345  1.41645e+02 17.345  0.9340 
1 1 1 4   38  7  o 4  2.59860e+01 5.96175e-01 5.85489e+02 277.515 4.76602e+00  -3.61263e+01 0.00000e+00 0.00000e+00 3.76335e+02 277.515 2.09153e+02 97.515  0.9862 
1 1 1 4   38  8  o 14 2.18458e+01 6.19804e-01 5.25373e+02 218.212 -2.57439e+01 -2.02672e+01 0.00000e+00 0.00000e+00 2.81687e+02 218.212 2.43686e+02 38.212  0.9846 
1 1 1 4   38  9  o 3  2.58816e+01 6.76674e-01 4.48718e+02 222.147 -3.33839e+01 -3.02148e+01 0.00000e+00 0.00000e+00 5.11185e+02 222.147 6.24672e+01 222.147 0.9888 
1 1 1 4   38  10 o 7  2.41148e+01 7.00865e-01 3.88874e+02 353.052 4.64091e+01  -5.65554e+00 0.00000e+00 0.00000e+00 5.05505e+02 353.052 1.16630e+02 353.052 0.9892 
1 1 1 4   38  11 o 7  1.43073e+01 7.80054e-01 1.96360e+02 42.870  1.40546e+01  1.30468e+01  0.00000e+00 0.00000e+00 3.25614e+02 42.870  1.29254e+02 42.870  0.9736 
1 1 1 4   38  12 o 8  1.13960e+01 1.11998e+00 1.24180e+02 311.566 7.43543e+00  -8.38479e+00 0.00000e+00 0.00000e+00 2.83124e+02 311.566 1.58944e+02 311.566 0.9543 
1 1 1 4   38  13 o 16 4.36991e+00 1.29469e+00 1.03415e+02 42.035  2.96066e+00  2.66905e+00  0.00000e+00 0.00000e+00 3.77429e+01 42.035  6.56718e+01 222.035 0.8630 
1 1 1 4   38  14 o 19 5.51158e+00 1.61342e+00 1.26704e+02 233.633 -3.65311e+00 -4.96103e+00 0.00000e+00 0.00000e+00 6.18941e+01 233.633 6.48095e+01 53.634  0.9148 
1 1 1 4   38  15 o 12 4.76586e+00 1.53398e+00 8.30468e+01 352.689 3.96722e+00  -5.09002e-01 0.00000e+00 0.00000e+00 7.07806e+01 352.689 1.22661e+01 172.689 0.8635 
1 1 1 4   38  16 o 2  4.98338e+00 1.53250e+00 7.82100e+01 233.774 -2.47160e+00 -3.37380e+00 0.00000e+00 0.00000e+00 8.37535e+01 233.774 5.54349e+00 233.774 0.8702 
1 1 1 4   38  17 o 19 4.07724e+00 1.37927e+00 3.06991e+01 43.754  1.17987e+00  1.12962e+00  0.00000e+00 0.00000e+00 6.47667e+01 43.754  3.40676e+01 43.754  0.6274 
1 1 1 4   39  0  o 5  5.56082e+00 6.15648e-01 4.64414e+01 233.507 -2.01746e-01 -2.72718e-01 0.00000e+00 0.00000e+00 1.15320e+01 53.507  5.79735e+01 53.507  0.1672 
1 1 1 4   39  1  o 5  3.32179e+01 5.72835e-01 7.98483e+02 218.106 -2.72637e+01 -2.13824e+01 0.00000e+00 0.00000e+00 4.30601e+02 218.106 3.67881e+02 38.106  0.9855 
1 1 1 4   39  2  f 0  2.16884e+01 4.41559e-01 4.34402e+02 2.128   1.11317e+01  4.13651e-01  0.00000e+00 0.00000e+00 3.42518e+02 2.128   9.18834e+01 182.128 0.9540 
1 1 1 4   39  3  o 7  2.63158e+01 5.38370e-01 5.17915e+02 73.791  4.88101e+00  1.67905e+01  0.00000e+00 0.00000e+00 4.41543e+02 73.791  7.63717e+01 253.791 0.9710 
1 1 1 4   39  4  o 19 3.94425e+01 7.29100e-01 6.76938e+02 280.194 6.36081e+00  -3.53716e+01 0.00000e+00 0.00000e+00 7.83279e+02 280.194 1.06341e+02 280.194 0.9860 
1 1 1 4   39  5  o 18 2.51000e+01 5.57482e-01 3.85023e+02 212.222 -1.43519e+01 -9.04554e+00 0.00000e+00 0.00000e+00 5.29101e+02 212.222 1.44078e+02 212.222 0.9701 
1 1 1 4   39  6  o 17 1.70563e+01 5.91603e-01 4.17474e+02 45.564  1.03743e+01  1.05805e+01  0.00000e+00 0.00000e+00 2.00767e+02 45.564  2.16707e+02 225.564 0.9656 
1 1 1 4   39  7  o 7  2.37577e+01 5.81903e-01 2.78238e+02 141.084 -1.37178e+01 1.10753e+01  0.00000e+00 0.00000e+00 5.87671e+02 141.084 3.09433e+02 141.084 0.9712 
1 1 1 4   39  8  o 5  1.73175e+01 6.97104e-01 3.13555e+02 157.979 -1.60274e+01 6.48218e+00  0.00000e+00 0.00000e+00 3.17062e+02 157.979 3.50720e+00 157.979 0.9706 
1 1 1 4   39  9  o 4  2.65337e+01 6.86976e-01 3.83079e+02 115.594 -1.86599e+01 3.89560e+01  0.00000e+00 0.00000e+00 6.00434e+02 115.594 2.17355e+02 115.594 0.9884 
1 1 1 4   39  10 f 0  2.20185e+01 7.59866e-01 3.28691e+02 328.281 3.26180e+01  -2.01605e+01 0.00000e+00 0.00000e+00 4.85893e+02 328.281 1.57202e+02 328.281 0.9869 
1 1 1 4   39  11 f 0  6.20767e+00 1.12887e+00 1.24485e+02 66.043  2.06876e+00  4.65596e+00  0.00000e+00 0.00000e+00 8.38156e+01 66.043  4.06694e+01 246.043 0.8955 
1 1 1 4   39  12 o 14 4.91391e+00 1.32985e+00 1.30999e+02 119.264 -2.31208e+00 4.12607e+00  0.00000e+00 0.00000e+00 3.21763e+01 119.264 9.88222e+01 299.264 0.8867 
1 1 1 4   39  13 o 15 7.10754e+00 1.49528e+00 1.34339e+02 277.232 9.25573e-01  -7.29355e+00 0.00000e+00 0.00000e+00 1.12856e+02 277.232 2.14824e+01 97.232  0.9293 
1 1 1 4   39  14 o 5  8.42078e+00 1.80017e+00 9.46995e+01 219.961 -4.89470e+00 -4.10141e+00 0.00000e+00 0.00000e+00 1.94416e+02 219.961 9.97169e+01 219.961 0.9180 
1 1 1 4   39  15 o 7  1.01541e+01 1.71891e+00 2.32881e+02 275.667 2.12546e+00  -2.14189e+01 0.00000e+00 0.00000e+00 1.37701e+02 275.667 9.51802e+01 95.667  0.9765 
1 1 1 4   39  16 o 7  5.79544e+00 1.55241e+00 9.40037e+01 177.074 -6.08485e+00 3.10995e-01  0.00000e+00 0.00000e+00 1.03768e+02 177.074 9.76427e+00 177.074 0.9138 
1 1 1 4   39  17 o 9  6.94589e+00 1.92198e+00 7.29283e+01 84.432  4.49879e-01  4.61454e+00  0.00000e+00 0.00000e+00 1.56238e+02 84.432  8.33100e+01 84.432  0.8842 
1 1 1 4   40  0  o 5  8.07486e+00 4.51241e-01 9.11470e+01 226.318 -6.63271e-01 -6.94517e-01 0.00000e+00 0.00000e+00 3.98471e+01 226.318 5.12999e+01 46.318  0.4322 
1 1 1 4   40  1  o 7  4.39753e+01 7.20178e-01 1.03049e+03 54.204  3.12457e+01  4.33290e+01  0.00000e+00 0.00000e+00 6.04930e+02 54.204  4.25557e+02 234.204 0.9906 
1 1 1 4   40  2  o 11 2.35567e+01 6.41513e-01 2.37900e+02 59.048  3.51439e+00  5.85993e+00  0.00000e+00 0.00000e+00 5.78982e+02 59.048  3.41082e+02 59.048  0.9236 
1 1 1 4   40  3  o 3  8.33654e+00 5.24849e-01 2.11811e+02 42.689  1.65215e+00  1.52399e+00  0.00000e+00 0.00000e+00 1.80972e+01 42.689  1.93714e+02 222.689 0.7345 
1 1 1 4   40  4  o 12 1.56247e+01 5.91276e-01 3.27416e+02 231.053 -5.08429e+00 -6.29051e+00 0.00000e+00 0.00000e+00 2.21629e+02 231.053 1.05787e+02 51.053  0.9360 
1 1 1 4   40  5  o 7  1.73049e+01 5.56143e-01 3.55219e+02 319.055 7.93355e+00  -6.88310e+00 0.00000e+00 0.00000e+00 2.62650e+02 319.055 9.25686e+01 139.055 0.9511 
1 1 1 4   40  6  o 17 1.47446e+01 6.01565e-01 3.94426e+02 30.140  1.08866e+01  6.32096e+00  0.00000e+00 0.00000e+00 1.36522e+02 30.140  2.57905e+02 210.140 0.9594 
1 1 1 4   40  7  o 12 1.63297e+01 5.60885e-01 2.93491e+02 233.777 -7.38582e+00 -1.00831e+01 0.00000e+00 0.00000e+00 2.94212e+02 233.777 7.21324e-01 233.777 0.9591 
1 1 1 4   40  8  o 8  3.28879e+01 7.11855e-01 6.02315e+02 182.825 -6.07318e+01 -2.99675e+00 0.00000e+00 0.00000e+00 6.21210e+02 182.825 1.88947e+01 182.825 0.9917 
1 1 1 4   40  9  o 18 1.46521e+01 7.46168e-01 2.59090e+02 327.278 1.34124e+01  -8.61774e+00 0.00000e+00 0.00000e+00 2.72830e+02 327.278 1.37401e+01 327.278 0.9681 
1 1 1 4   40  10 o 13 1.55503e+01 7.44466e-01 2.55400e+02 74.338  6.24543e+00  2.22758e+01  0.00000e+00 0.00000e+00 3.14739e+02 74.338  5.93394e+01 74.338  0.9781 
1 1 1 4   40  11 o 8  1.01278e+01 9.60554e-01 2.44225e+02 7.198   1.69913e+01  2.14584e+00  0.00000e+00 0.00000e+00 1.23968e+02 7.198   1.20257e+02 187.198 0.9704 
1 1 1 4   40  12 o 8  1.42282e+01 1.04088e+00 2.60227e+02 248.398 -1.10463e+01 -2.78962e+01 0.00000e+00 0.00000e+00 2.63596e+02 248.398 3.36933e+00 248.398 0.9832 
1 1 1 4   40  13 o 9  5.43349e+00 1.42760e+00 9.85391e+01 68.953  1.61980e+00  4.20939e+00  0.00000e+00 0.00000e+00 8.05249e+01 68.953  1.80142e+01 248.953 0.8806 
1 1 1 4   40  14 f 0  5.73970e+00 1.63861e+00 1.12998e+02 103.142 -1.31864e+00 5.64762e+00  0.00000e+00 0.00000e+00 8.21478e+01 103.142 3.08502e+01 283.142 0.9091 
1 1 1 4   40  15 f 0  5.25018e+00 1.57161e+00 6.39627e+01 314.725 2.34460e+00  -2.36722e+00 0.00000e+00 0.00000e+00 9.92409e+01 314.725 3.52782e+01 314.725 0.8318 
1 1 1 4   40  16 o 10 6.46323e+00 1.74125e+00 1.23805e+02 19.860  7.63966e+00  2.75955e+00  0.00000e+00 0.00000e+00 1.02156e+02 19.860  2.16494e+01 199.860 0.9363 
1 1 1 4   40  17 o 10 5.34886e+00 1.68289e+00 8.06733e+01 101.256 -9.12352e-01 4.58417e+00  0.00000e+00 0.00000e+00 9.59874e+01 101.256 1.53141e+01 101.256 0.8852 
1 1 1 4   41  0  o 2  2.06886e+01 4.23166e-01 5.01893e+02 150.228 -1.06585e+01 6.09723e+00  0.00000e+00 0.00000e+00 2.42297e+02 150.228 2.59595e+02 330.228 0.9584 
1 1 1 4   41  1  o 10 1.02450e+01 4.36543e-01 1.48485e+02 328.721 1.59856e+00  -9.71119e-01 0.00000e+00 0.00000e+00 1.11223e+02 328.721 3.72612e+01 148.721 0.6753 
1 1 1 4   41  2  o 13 1.52890e+01 3.91497e-01 2.34436e+02 308.603 2.91123e+00  -3.64641e+00 0.00000e+00 0.00000e+00 2.73528e+02 308.603 3.90911e+01 308.603 0.8850 
1 1 1 4   41  3  o 15 3.33249e+01 7.57547e-01 4.80247e+02 59.747  1.05362e+01  1.80642e+01  0.00000e+00 0.00000e+00 7.40522e+02 59.747  2.60275e+02 59.747  0.9758 
1 1 1 4   41  4  o 1  4.84862e+01 8.63488e-01 7.66070e+02 261.906 -7.96204e+00 -5.59867e+01 0.00000e+00 0.00000e+00 1.03790e+03 261.906 2.71831e+02 261.906 0.9911 
1 1 1 4   41  5  o 7  1.29616e+01 4.78404e-01 1.58405e+02 142.577 -2.80674e+00 2.14771e+00  0.00000e+00 0.00000e+00 2.51661e+02 142.577 9.32559e+01 142.577 0.8429 
1 1 1 4   41  6  o 6  3.77649e+01 7.27226e-01 6.96702e+02 244.944 -2.44681e+01 -5.23394e+01 0.00000e+00 0.00000e+00 7.08237e+02 244.944 1.15356e+01 244.944 0.9913 
1 1 1 4   41  7  o 14 1.86833e+01 5.62341e-01 2.94773e+02 21.948  1.39916e+01  5.63833e+00  0.00000e+00 0.00000e+00 3.82568e+02 21.948  8.77948e+01 21.948  0.9663 
1 1 1 4   41  8  o 2  1.92147e+01 6.19710e-01 2.02906e+02 121.822 -6.54473e+00 1.05464e+01  0.00000e+00 0.00000e+00 4.88135e+02 121.822 2.85229e+02 121.822 0.9588 
1 1 1 4   41  9  o 1  1.20852e+01 9.53485e-01 8.56612e+01 118.869 -2.09887e+00 3.80695e+00  0.00000e+00 0.00000e+00 3.11132e+02 118.869 2.25471e+02 118.869 0.8757 
1 1 1 4   41  10 o 12 9.62844e+00 8.85690e-01 1.12390e+02 156.445 -5.41447e+00 2.36050e+00  0.00000e+00 0.00000e+00 2.16317e+02 156.445 1.03927e+02 156.445 0.9109 
1 1 1 4   41  11 o 14 3.94611e+00 1.19836e+00 5.34010e+01 290.532 4.71202e-01  -1.25813e+00 0.00000e+00 0.00000e+00 2.86413e+01 290.532 2.47598e+01 110.532 0.5550 
1 1 1 4   41  12 o 4  1.33969e+01 1.04012e+00 2.51327e+02 150.086 -2.48249e+01 1.42830e+01  0.00000e+00 0.00000e+00 2.41431e+02 150.086 9.89550e+00 330.086 0.9824 
1 1 1 4   41  13 o 9  1.30743e+01 1.25759e+00 2.37045e+02 62.176  1.31048e+01  2.48298e+01  0.00000e+00 0.00000e+00 2.43383e+02 62.176  6.33775e+00 62.176  0.9820 
1 1 1 4   41  14 o 17 6.40855e+00 1.64830e+00 8.14238e+01 347.313 4.37797e+00  -9.85542e-01 0.00000e+00 0.00000e+00 1.29450e+02 347.313 4.80259e+01 347.313 0.8800 
1 1 1 4   41  15 o 14 1.11080e+01 1.51639e+00 1.19251e+02 192.836 -1.36031e+01 -3.09952e+00 0.00000e+00 0.00000e+00 2.80652e+02 192.836 1.61401e+02 192.836 0.9635 
1 1 1 4   41  16 o 19 9.94166e+00 1.59300e+00 2.06516e+02 140.508 -1.70876e+01 1.40817e+01  0.00000e+00 0.00000e+00 1.56196e+02 140.508 5.03200e+01 320.508 0.9772 
1 1 1 4   41  17 o 11 5.69568e+00 1.74345e+00 1.64246e+02 354.647 9.92854e+00  -9.30208e-01 0.00000e+00 0.00000e+00 3.72813e+01 354.647 1.26965e+02 174.648 0.9485 
1 1 1 4   42  0  f 0  2.33326e+01 8.31581e-01 4.77810e+02 230.896 -8.51380e+00 -1.04747e+01 0.00000e+00 0.00000e+00 3.64754e+02 230.896 1.13056e+02 50.896  0.9622 
1 1 1 4   42  1  o 13 1.34630e+01 3.97864e-01 2.97404e+02 333.875 4.69170e+00  -2.30102e+00 0.00000e+00 0.00000e+00 1.56557e+02 333.875 1.40846e+02 153.875 0.8984 
1 1 1 4   42  2  f 0  4.04436e+01 6.76400e-01 8.54469e+02 68.855  1.58147e+01  4.08897e+01  0.00000e+00 0.00000e+00 6.46234e+02 68.855  2.08235e+02 248.855 0.9885 
1 1 1 4   42  3  o 15 1.49591e+01 4.88714e-01 3.20800e+02 138.563 -4.87592e+00 4.30432e+00  0.00000e+00 0.00000e+00 1.95538e+02 138.563 1.25262e+02 318.563 0.9195 
1 1 1 4   42  4  o 17 6.29009e+00 5.35895e-01 1.18135e+02 337.751 1.29701e+00  -5.30582e-01 0.00000e+00 0.00000e+00 1.66252e+01 337.751 1.01510e+02 157.751 0.5708 
1 1 1 4   42  5  o 3  2.59381e+01 5.68977e-01 4.33220e+02 305.337 1.36212e+01  -1.92113e+01 0.00000e+00 0.00000e+00 5.19359e+02 305.337 8.61392e+01 305.337 0.9785 
1 1 1 4   42  6  o 4  2.42305e+01 5.71807e-01 4.86246e+02 276.593 3.30080e+00  -2.85577e+01 0.00000e+00 0.00000e+00 4.07028e+02 276.593 7.92180e+01 96.593  0.9825 
1 1 1 4   42  7  o 18 2.04671e+01 5.73874e-01 3.43225e+02 125.531 -1.14178e+01 1.59888e+01  0.00000e+00 0.00000e+00 4.04801e+02 125.531 6.15764e+01 125.531 0.9742 
1 1 1 4   42  8  o 18 1.26918e+01 6.68517e-01 2.41162e+02 269.350 -1.13449e-01 -1.00011e+01 0.00000e+00 0.00000e+00 2.10373e+02 269.350 3.07887e+01 89.350  0.9486 
1 1 1 4   42  9  o 10 2.33967e+01 6.67493e-01 3.99527e+02 234.603 -2.46589e+01 -3.47029e+01 0.00000e+00 0.00000e+00 4.67268e+02 234.603 6.77409e+01 234.603 0.9882 
1 1 1 4   42  10 o 4  2.04537e+01 8.56941e-01 3.45094e+02 329.317 3.35139e+01  -1.98860e+01 0.00000e+00 0.00000e+00 4.11509e+02 329.317 6.64155e+01 329.317 0.9871 
1 1 1 4   42  11 o 7  8.64280e+00 1.19885e+00 1.40568e+02 34.381  6.69607e+00  4.58163e+00  0.00000e+00 0.00000e+00 1.62504e+02 34.381  2.19361e+01 34.381  0.9362 
1 1 1 4   42  12 o 13 2.14146e+01 1.03779e+00 3.92863e+02 153.319 -6.46290e+01 3.24779e+01  0.00000e+00 0.00000e+00 4.03267e+02 153.319 1.04048e+01 153.319 0.9931 
1 1 1 4   42  13 f 0  6.96679e+00 1.60529e+00 2.19666e+02 342.038 1.16595e+01  -3.77980e+00 0.00000e+00 0.00000e+00 3.01201e+01 342.038 1.89546e+02 162.038 0.9583 
1 1 1 4   42  14 o 8  7.04384e+00 1.75893e+00 5.53035e+01 14.555  3.12187e+00  8.10576e-01  0.00000e+00 0.00000e+00 1.62067e+02 14.555  1.06763e+02 14.555  0.8254 
1 1 1 4   42  15 o 10 4.11914e+00 1.31400e+00 7.68997e+00 334.291 3.21208e-01  -1.54650e-01 0.00000e+00 0.00000e+00 1.93159e+01 334.291 1.16260e+01 334.291 0.1755 
1 1 1 4   42  16 o 2  5.97356e+00 1.67321e+00 8.88323e+01 282.117 1.15573e+00  -5.38320e+00 0.00000e+00 0.00000e+00 1.12753e+02 282.117 2.39205e+01 282.117 0.9039 
1 1 1 4   42  17 o 5  5.54244e+00 1.74140e+00 1.02415e+02 318.423 4.51245e+00  -4.00314e+00 0.00000e+00 0.00000e+00 8.63093e+01 318.423 1.61056e+01 138.423 0.9129 
1 1 1 4   43  0  o 5  2.83502e+01 5.15744e-01 4.52164e+02 53.733  9.83488e+00  1.34046e+01  0.00000e+00 0.00000e+00 5.79163e+02 53.733  1.27000e+02 53.733  0.9694 
1 1 1 4   43  1  o 4  1.19544e+01 3.68247e-01 2.34220e+02 121.849 -1.89384e+00 3.04861e+00  0.00000e+00 0.00000e+00 1.45162e+02 121.849 8.90578e+01 301.849 0.8456 
1 1 1 4   43  2  o 2  3.52103e+01 6.06964e-01 4.98720e+02 131.432 -1.52688e+01 1.72996e+01  0.00000e+00 0.00000e+00 7.93843e+02 131.432 2.95123e+02 131.432 0.9781 
1 1 1 4   43  3  o 10 1.26126e+01 4.84801e-01 1.12530e+02 338.627 2.09422e+00  -8.19560e-01 0.00000e+00 0.00000e+00 2.35261e+02 338.627 1.22731e+02 338.627 0.7347 
1 1 1 4   43  4  o 9  4.78831e+01 8.58845e-01 1.00171e+03 136.815 -6.04018e+01 5.66922e+01  0.00000e+00 0.00000e+00 7.84495e+02 136.815 2.17214e+02 316.815 0.9939 
1 1 1 4   43  5  o 18 2.31247e+01 5.40709e-01 4.75614e+02 166.050 -2.23084e+01 5.54154e+00  0.00000e+00 0.00000e+00 3.73081e+02 166.050 1.02532e+02 346.050 0.9780 
1 1 1 4   43  6  o 3  1.44458e+01 6.21026e-01 1.97892e+02 208.828 -5.99465e+00 -3.29935e+00 0.00000e+00 0.00000e+00 3.02772e+02 208.828 1.04881e+02 208.828 0.9237 
1 1 1 4   43  7  o 16 3.31788e+01 6.91281e-01 6.40235e+02 188.268 -6.27965e+01 -9.12495e+00 0.00000e+00 0.00000e+00 5.94487e+02 188.268 4.57485e+01 8.268   0.9921 
1 1 1 4   43  8  o 4  1.95804e+01 6.28590e-01 3.28862e+02 318.398 1.70250e+01  -1.51166e+01 0.00000e+00 0.00000e+00 3.89090e+02 318.398 6.02270e+01 318.398 0.9778 
1 1 1 4   43  9  o 6  1.83675e+01 6.69856e-01 2.23351e+02 268.830 -4.01635e-01 -1.96706e+01 0.00000e+00 0.00000e+00 4.47449e+02 268.830 2.24097e+02 268.830 0.9742 
1 1 1 4   43  10 o 10 2.15376e+01 6.92856e-01 3.52505e+02 40.394  3.48722e+01  2.96726e+01  0.00000e+00 0.00000e+00 4.45662e+02 40.394  9.31574e+01 40.394  0.9890 
1 1 1 4   43  11 o 15 8.48669e+00 1.31228e+00 8.13222e+01 97.581  -6.26658e-01 4.70854e+00  0.00000e+00 0.00000e+00 2.00688e+02 97.581  1.19365e+02 97.581  0.8872 
1 1 1 4   43  12 o 3  1.34647e+01 1.07976e+00 1.61886e+02 336.568 1.69574e+01  -7.34936e+00 0.00000e+00 0.00000e+00 3.28299e+02 336.568 1.66412e+02 336.568 0.9726 
1 1 1 4   43  13 o 19 9.66462e+00 1.53581e+00 2.65053e+02 102.704 -4.84340e+00 2.14843e+01  0.00000e+00 0.00000e+00 8.81926e+01 102.704 1.76860e+02 282.704 0.9770 
1 1 1 4   43  14 o 4  6.32103e+00 1.70119e+00 6.67539e+01 16.807  3.57287e+00  1.07917e+00  0.00000e+00 0.00000e+00 1.34673e+02 16.807  6.79186e+01 16.807  0.8524 
1 1 1 4   43  15 f 0  4.90000e+00 1.42188e+00 1.91854e+02 223.956 -7.79542e+00 -7.51630e+00 0.00000e+00 0.00000e+00 1.74687e+01 43.956  2.09323e+02 43.956  0.9526 
1 1 1 4   43  16 o 15 1.40316e+01 1.50492e+00 2.06910e+02 41.417  2.39882e+01  2.11615e+01  0.00000e+00 0.00000e+00 3.08615e+02 41.417  1.01705e+02 41.417  0.9842 
1 1 1 4   43  17 o 15 4.83021e+00 1.51200e+00 7.73500e+01 213.175 -3.95466e+00 -2.58542e+00 0.00000e+00 0.00000e+00 8.23699e+01 213.175 5.01992e+00 213.175 0.8866 
1 1 1 4   44  0  o 18 3.49028e+01 5.97486e-01 3.84588e+02 161.431 -1.61588e+01 5.42840e+00  0.00000e+00 0.00000e+00 8.85963e+02 161.431 5.01374e+02 161.431 0.9702 
1 1 1 4   44  1  o 11 4.17966e+01 6.90348e-01 6.92418e+02 29.008  3.32452e+01  1.84342e+01  0.00000e+00 0.00000e+00 8.55240e+02 29.008  1.62822e+02 29.008  0.9868 
1 1 1 4   44  2  o 13 1.56835e+01 4.48404e-01 2.52502e+02 85.295  4.40755e-01  5.35482e+00  0.00000e+00 0.00000e+00 2.78013e+02 85.295  2.55116e+01 85.295  0.9014 
1 1 1 4   44  3  o 8  1.75815e+01 5.73640e-01 1.00338e+02 37.656  2.14852e+00  1.65795e+00  0.00000e+00 0.00000e+00 4.18518e+02 37.656  3.18179e+02 37.656  0.7864 
1 1 1 4   44  4  f 0  1.75877e+01 4.55142e-01 3.16252e+02 17.082  9.08633e+00  2.79224e+00  0.00000e+00 0.00000e+00 3.08002e+02 17.082  8.25041e+00 197.082 0.9458 
1 1 1 4   44  5  o 3  2.41305e+01 6.20072e-01 4.31892e+02 352.217 2.23656e+01  -3.05704e+00 0.00000e+00 0.00000e+00 4.53242e+02 352.217 2.13506e+01 352.217 0.9776 
1 1 1 4   44  6  o 7  9.29744e+00 5.93569e-01 3.01972e+02 163.556 -7.17980e+00 2.11905e+00  0.00000e+00 0.00000e+00 2.26141e+01 163.556 2.79358e+02 343.556 0.9306 
1 1 1 4   44  7  o 6  2.43110e+01 6.02931e-01 4.49668e+02 287.166 9.21840e+00  -2.98425e+01 0.00000e+00 0.00000e+00 4.47435e+02 287.166 2.23333e+00 107.166 0.9839 
1 1 1 4   44  8  o 16 1.44430e+01 6.51584e-01 3.11042e+02 81.702  2.22164e+00  1.52329e+01  0.00000e+00 0.00000e+00 2.12608e+02 81.702  9.84340e+01 261.702 0.9670 
1 1 1 4   44  9  o 14 2.22374e+01 7.74353e-01 3.63212e+02 106.371 -1.05176e+01 3.58022e+01  0.00000e+00 0.00000e+00 4.59043e+02 106.371 9.58312e+01 106.371 0.9865 
1 1 1 4   44  10 o 10 1.87499e+01 7.03207e-01 2.63684e+02 14.629  2.93405e+01  7.65853e+00  0.00000e+00 0.00000e+00 4.27120e+02 14.629  1.63436e+02 14.629  0.9834 
1 1 1 4   44  11 o 12 6.76708e+00 1.24500e+00 1.58264e+02 309.406 4.55359e+00  -5.54252e+00 0.00000e+00 0.00000e+00 7.67577e+01 309.406 8.15058e+01 129.406 0.9274 
1 1 1 4   44  12 o 3  1.33484e+01 9.47414e-01 1.95336e+02 36.140  2.04647e+01  1.49449e+01  0.00000e+00 0.00000e+00 2.94310e+02 36.140  9.89745e+01 36.140  0.9801 
1 1 1 4   44  13 o 5  7.27198e+00 1.64701e+00 1.47188e+02 21.024  8.35939e+00  3.21287e+00  0.00000e+00 0.00000e+00 1.09154e+02 21.024  3.80338e+01 201.024 0.9424 
1 1 1 4   44  14 o 19 6.57273e+00 1.58731e+00 5.43706e+01 272.890 1.67199e-01  -3.31174e+00 0.00000e+00 0.00000e+00 1.49770e+02 272.890 9.53995e+01 272.890 0.8309 
1 1 1 4   44  15 o 6  5.11528e+00 1.46786e+00 5.10183e+01 157.320 -2.55361e+00 1.06714e+00  0.00000e+00 0.00000e+00 1.00163e+02 157.320 4.91449e+01 157.320 0.7912 
1 1 1 4   44  16 o 5  6.20089e+00 1.72678e+00 1.07076e+02 160.908 -6.34875e+00 2.19745e+00  0.00000e+00 0.00000e+00 1.06371e+02 160.908 7.04308e-01 340.908 0.9222 
1 1 1 4   44  17 o 10 7.66977e+00 1.86444e+00 1.67661e+02 287.877 3.99493e+00  -1.23855e+01 0.00000e+00 0.00000e+00 1.07145e+02 287.877 6.05164e+01 107.877 0.9608 
1 1 1 4   45  0  o 4  7.66873e+00 5.28744e-01 2.44772e+02 148.135 -2.09575e+00 1.30270e+00  0.00000e+00 0.00000e+00 2.57109e+01 328.135 2.70483e+02 328.135 0.7614 
1 1 1 4   45  1  o 12 2.23319e+01 5.60553e-01 4.27047e+02 338.236 1.20037e+01  -4.79245e+00 0.00000e+00 0.00000e+00 3.77762e+02 338.236 4.92857e+01 158.236 0.9605 
1 1 1 4   45  2  o 14 1.54134e+01 4.06127e-01 3.16197e+02 172.190 -7.66495e+00 1.05137e+00  0.00000e+00 0.00000e+00 2.23375e+02 172.190 9.28223e+01 352.190 0.9329 
1 1 1 4   45  3  o 15 2.23735e+01 5.58834e-01 5.21965e+02 285.127 5.72980e+00  -2.11963e+01 0.00000e+00 0.00000e+00 2.98221e+02 285.127 2.23744e+02 105.127 0.9770 
1 1 1 4   45  4  o 19 2.25262e+01 4.89399e-01 4.19623e+02 147.545 -1.36986e+01 8.71199e+00  0.00000e+00 0.00000e+00 3.99137e+02 147.545 2.04867e+01 327.545 0.9687 
1 1 1 4   45  5  o 3  3.76456e+01 8.67014e-01 6.91608e+02 136.218 -4.09386e+01 3.92343e+01  0.00000e+00 0.00000e+00 7.08244e+02 136.218 1.66363e+01 136.218 0.9911 
1 1 1 4   45  6  o 11 3.51700e+01 7.01792e-01 5.78942e+02 6.668   5.22778e+01  6.11196e+00  0.00000e+00 0.00000e+00 7.27719e+02 6.668   1.48777e+02 6.668   0.9905 
1 1 1 4   45  7  o 15 2.24151e+01 6.00684e-01 4.01283e+02 59.637  1.45716e+01  2.48729e+01  0.00000e+00 0.00000e+00 4.24615e+02 59.637  2.33318e+01 59.637  0.9825 
1 1 1 4   45  8  o 14 1.59874e+01 6.35454e-01 2.49163e+02 125.007 -8.88137e+00 1.26807e+01  0.00000e+00 0.00000e+00 3.30524e+02 125.007 8.13617e+01 125.007 0.9671 
1 1 1 4   45  9  o 2  8.65738e+00 1.18609e+00 9.51936e+01 252.496 -1.14046e+00 -3.61626e+00 0.00000e+00 0.00000e+00 1.82219e+02 252.496 8.70258e+01 252.496 0.8550 
1 1 1 4   45  10 o 7  1.52527e+01 8.87952e-01 2.43073e+02 200.289 -2.25165e+01 -8.32406e+00 0.00000e+00 0.00000e+00 3.16287e+02 200.289 7.32137e+01 200.289 0.9789 
1 1 1 4   45  11 o 17 7.37638e+00 1.30325e+00 1.50544e+02 329.405 6.74874e+00  -3.99035e+00 0.00000e+00 0.00000e+00 1.07387e+02 329.405 4.31569e+01 149.405 0.9339 
1 1 1 4   45  12 o 6  1.55639e+01 1.13826e+00 2.94207e+02 333.879 3.66695e+01  -1.79810e+01 0.00000e+00 0.00000e+00 2.81070e+02 333.879 1.31363e+01 153.879 0.9877 
1 1 1 4   45  13 o 8  1.46692e+01 1.29055e+00 2.15236e+02 329.730 2.60432e+01  -1.51999e+01 0.00000e+00 0.00000e+00 3.24229e+02 329.730 1.08993e+02 329.730 0.9833 
1 1 1 4   45  14 o 4  6.03652e+00 1.46341e+00 5.21708e+01 193.546 -3.00252e+00 -7.23367e-01 0.00000e+00 0.00000e+00 1.32007e+02 193.546 7.98364e+01 193.546 0.8163 
1 1 1 4   45  15 o 4  9.43924e+00 1.61288e+00 1.41442e+02 240.636 -6.78848e+00 -1.20654e+01 0.00000e+00 0.00000e+00 1.98121e+02 240.636 5.66789e+01 240.636 0.9632 
1 1 1 4   45  16 o 16 5.12804e+00 1.47304e+00 4.74913e+01 58.792  1.49218e+00  2.46311e+00  0.00000e+00 0.00000e+00 1.05743e+02 58.792  5.82512e+01 58.792  0.8007 
1 1 1 4   45  17 o 6  4.30950e+00 1.42397e+00 9.12360e+01 93.470  -3.20035e-01 5.27750e+00  0.00000e+00 0.00000e+00 5.33299e+01 93.470  3.79061e+01 273.470 0.8996 
1 1 1 4   46  0  o 10 4.53216e+01 7.16103e-01 8.08213e+02 219.332 -4.48305e+01 -3.67357e+01 0.00000e+00 0.00000e+00 8.77117e+02 219.332 6.89040e+01 219.332 0.9913 
1 1 1 4   46  1  o 15 5.81370e+01 9.25548e-01 1.13137e+03 68.712  3.72182e+01  9.55166e+01  0.00000e+00 0.00000e+00 1.03903e+03 68.712  9.23356e+01 248.712 0.9951 
1 1 1 4   46  2  f 0  5.59819e+01 8.97333e-01 8.65263e+02 251.308 -2.35452e+01 -6.95915e+01 0.00000e+00 0.00000e+00 1.22075e+03 251.308 3.55490e+02 251.308 0.9932 
1 1 1 4   46  3  o 18 1.34700e+01 5.08611e-01 1.45227e+02 236.233 -1.86413e+00 -2.78811e+00 0.00000e+00 0.00000e+00 2.75800e+02 236.233 1.30573e+02 236.233 0.8331 
1 1 1 4   46  4  o 17 1.83555e+01 4.58713e-01 3.24591e+02 7.916   1.23781e+01  1.72116e+00  0.00000e+00 0.00000e+00 3.35897e+02 7.916   1.13063e+01 7.916   0.9591 
1 1 1 4   46  5  o 6  3.73516e+01 8.68497e-01 6.03862e+02 79.527  9.81707e+00  5.31099e+01  0.00000e+00 0.00000e+00 7.84262e+02 79.527  1.80400e+02 79.527  0.9907 
1 1 1 4   46  6  o 1  1.14266e+01 7.16094e-01 1.38880e+02 357.165 4.29565e+00  -2.12754e-01 0.00000e+00 0.00000e+00 2.35761e+02 357.165 9.68807e+01 357.165 0.8742 
1 1 1 4   46  7  f 0  2.62256e+01 6.27872e-01 4.30379e+02 185.488 -3.46602e+01 -3.32995e+00 0.00000e+00 0.00000e+00 5.38781e+02 185.488 1.08402e+02 185.488 0.9855 
1 1 1 4   46  8  o 1  5.94816e+00 1.02657e+00 1.87210e+02 280.974 8.58964e-01  -4.42953e+00 0.00000e+00 0.00000e+00 9.15856e+00 280.974 1.78052e+02 100.974 0.8807 
1 1 1 4   46  9  o 2  9.92685e+00 8.15084e-01 1.34217e+02 334.301 6.31186e+00  -3.03757e+00 0.00000e+00 0.00000e+00 2.10087e+02 334.301 7.58703e+01 334.301 0.9256 
1 1 1 4   46  10 o 11 1.24541e+01 9.42200e-01 2.33781e+02 89.658  1.14700e-01  1.91898e+01  0.00000e+00 0.00000e+00 2.20389e+02 89.658  1.33918e+01 269.658 0.9736 
1 1 1 4   46  11 o 4  1.20030e+01 9.91147e-01 2.41219e+02 321.442 1.78440e+01  -1.42230e+01 0.00000e+00 0.00000e+00 1.98202e+02 321.442 4.30167e+01 141.443 0.9778 
1 1 1 4   46  12 o 13 5.69327e+00 1.38993e+00 1.68642e+02 229.436 -5.20962e+00 -6.08592e+00 0.00000e+00 0.00000e+00 3.06159e+01 229.436 1.38026e+02 49.436  0.9353 
1 1 1 4   46  13 o 12 5.28978e+00 1.39508e+00 1.31938e+02 301.192 3.51928e+00  -5.81278e+00 0.00000e+00 0.00000e+00 5.06807e+01 301.192 8.12577e+01 121.192 0.9232 
1 1 1 4   46  14 o 12 8.72196e+00 1.45807e+00 1.40836e+02 338.479 1.23023e+01  -4.85112e+00 0.00000e+00 0.00000e+00 1.72538e+02 338.479 3.17020e+01 338.479 0.9614 
1 1 1 4   46  15 o 17 5.22721e+00 1.46942e+00 1.12203e+02 165.424 -6.16203e+00 1.60228e+00  0.00000e+00 0.00000e+00 6.69395e+01 165.424 4.52634e+01 345.424 0.9177 
1 1 1 4   46  16 o 1  1.05526e+01 1.56669e+00 9.36649e+01 76.761  2.60590e+00  1.10760e+01  0.00000e+00 0.00000e+00 2.82381e+02 76.761  1.88716e+02 76.761  0.9550 
1 1 1 4   46  17 o 12 8.06281e+00 1.90654e+00 1.39480e+02 135.830 -7.69938e+00 7.47955e+00  0.00000e+00 0.00000e+00 1.46764e+02 135.830 7.28358e+00 135.830 0.9522 
1 1 1 4   47  0  o 6  2.76898e+01 4.93120e-01 4.69884e+02 7.181   2.00093e+01  2.52103e+00  0.00000e+00 0.00000e+00 5.42572e+02 7.181   7.26877e+01 7.181   0.9749 
1 1 1 4   47  1  o 14 1.13811e+01 5.61379e-01 1.78814e+02 183.331 -3.12956e+00 -1.82131e-01 0.00000e+00 0.00000e+00 1.71039e+02 183.331 7.77517e+00 3.331   0.8195 
1 1 1 4   47  2  o 16 4.21074e+01 7.03866e-01 6.61936e+02 254.666 -1.28843e+01 -4.69863e+01 0.00000e+00 0.00000e+00 9.01375e+02 254.666 2.39438e+02 254.666 0.9897 
1 1 1 4   47  3  o 16 4.18657e+01 7.07901e-01 7.70938e+02 65.920  2.24717e+01  5.02826e+01  0.00000e+00 0.00000e+00 7.85292e+02 65.920  1.43542e+01 65.920  0.9909 
1 1 1 4   47  4  o 14 1.50420e+01 4.54222e-01 4.19940e+02 175.609 -1.31581e+01 1.01026e+00  0.00000e+00 0.00000e+00 1.22499e+02 175.609 2.97440e+02 355.609 0.9613 
1 1 1 4   47  5  o 12 1.28567e+01 5.85543e-01 3.49695e+02 276.730 1.26350e+00  -1.07078e+01 0.00000e+00 0.00000e+00 1.09596e+02 276.730 2.40099e+02 96.730  0.9524 
1 1 1 4   47  6  o 7  2.31900e+01 6.87243e-01 2.41052e+02 79.836  2.73557e+00  1.52582e+01  0.00000e+00 0.00000e+00 6.00066e+02 79.836  3.59014e+02 79.836  0.9672 
1 1 1 4   47  7  o 1  1.66585e+01 5.91068e-01 4.10017e+02 261.309 -3.28444e+00 -2.14871e+01 0.00000e+00 0.00000e+00 2.00010e+02 261.309 2.10007e+02 81.309  0.9767 
1 1 1 4   47  8  o 12 1.21336e+01 6.77815e-01 2.70844e+02 118.554 -6.62716e+00 1.21781e+01  0.00000e+00 0.00000e+00 1.67218e+02 118.554 1.03626e+02 298.554 0.9632 
1 1 1 4   47  9  o 14 1.50121e+01 8.14579e-01 3.05302e+02 347.971 2.58078e+01  -5.49899e+00 0.00000e+00 0.00000e+00 2.46408e+02 347.971 5.88940e+01 167.972 0.9809 
1 1 1 4   47  10 o 19 3.66605e+00 1.12458e+00 6.67699e+01 189.658 -1.59214e+00 -2.70940e-01 0.00000e+00 0.00000e+00 1.88115e+01 189.658 4.79585e+01 9.658   0.6233 
1 1 1 4   47  11 o 7  1.38807e+01 9.52414e-01 2.21858e+02 217.798 -2.02951e+01 -1.57411e+01 0.00000e+00 0.00000e+00 2.87537e+02 217.798 6.56789e+01 217.798 0.9803 
1 1 1 4   47  12 o 7  4.69581e+00 1.37150e+00 3.90380e+01 301.285 7.78033e-01  -1.28040e+00 0.00000e+00 0.00000e+00 6.56200e+01 301.285 2.65821e+01 301.285 0.5957 
1 1 1 4   47  13 o 1  7.84392e+00 1.55564e+00 2.05512e+02 165.603 -1.35842e+01 3.48711e+00  0.00000e+00 0.00000e+00 7.71249e+01 165.603 1.28387e+02 345.603 0.9637 
1 1 1 4   47  14 o 11 4.29853e+00 1.26431e+00 9.51568e+01 245.761 -1.98306e+00 -4.40446e+00 0.00000e+00 0.00000e+00 4.76826e+01 245.761 4.74742e+01 65.761  0.8893 
1 1 1 4   47  15 o 19 4.26135e+00 1.29574e+00 9.92723e+01 171.196 -5.33765e+00 8.26736e-01  0.00000e+00 0.00000e+00 4.42392e+01 171.196 5.50331e+01 351.195 0.9019 
1 1 1 4   47  16 o 3  4.66642e+00 1.43383e+00 4.67683e+01 41.432  1.93526e+00  1.70810e+00  0.00000e+00 0.00000e+00 8.79111e+01 41.432  4.11428e+01 41.432  0.7736 
1 1 1 4   47  17 o 12 4.98297e+00 1.58981e+00 8.65635e+01 137.194 -3.91274e+00 3.62396e+00  0.00000e+00 0.00000e+00 8.07254e+01 137.194 5.83810e+00 317.194 0.9006 
1 1 1 4   48  0  o 17 3.98665e+01 6.45077e-01 7.01862e+02 272.915 2.67770e+00  -5.25889e+01 0.00000e+00 0.00000e+00 7.78922e+02 272.915 7.70607e+01 272.915 0.9905 
1 1 1 4   48  1  o 17 2.18042e+01 7.74842e-01 3.86202e+02 206.157 -1.40741e+01 -6.91206e+00 0.00000e+00 0.00000e+00 4.05070e+02 206.157 1.88683e+01 206.157 0.9676 
1 1 1 4   48  2  o 19 1.81599e+01 4.32058e-01 3.30629e+02 8.019   1.02040e+01  1.43756e+00  0.00000e+00 0.00000e+00 3.16582e+02 8.019   1.40472e+01 188.019 0.9502 
1 1 1 4   48  3  o 14 2.09633e+01 4.71354e-01 4.14760e+02 54.859  1.05268e+01  1.49552e+01  0.00000e+00 0.00000e+00 3.49746e+02 54.859  6.50134e+01 234.859 0.9723 
1 1 1 4   48  4  f 0  2.64061e+01 5.32578e-01 2.76267e+02 268.105 -5.36206e-01 -1.62059e+01 0.00000e+00 0.00000e+00 6.83108e+02 268.105 4.06841e+02 268.105 0.9687 
1 1 1 4   48  5  o 19 2.14972e+01 6.16310e-01 3.76832e+02 135.406 -1.53543e+01 1.51380e+01  0.00000e+00 0.00000e+00 4.10455e+02 135.406 3.36235e+01 135.406 0.9765 
1 1 1 4   48  6  o 17 2.11185e+01 5.70590e-01 4.84876e+02 144.003 -2.37990e+01 1.72893e+01  0.00000e+00 0.00000e+00 2.93412e+02 144.003 1.91463e+02 324.003 0.9829 
1 1 1 4   48  7  o 10 1.53513e+01 6.11373e-01 3.04294e+02 334.123 1.49094e+01  -7.23214e+00 0.00000e+00 0.00000e+00 2.53544e+02 334.123 5.07506e+01 154.123 0.9693 
1 1 1 4   48  8  f 0  2.15254e+01 6.47640e-01 4.09525e+02 62.316  1.78272e+01  3.39785e+01  0.00000e+00 0.00000e+00 3.86589e+02 62.316  2.29358e+01 242.316 0.9869 
1 1 1 4   48  9  o 18 6.25734e+00 1.30461e+00 9.24781e+01 138.904 -2.17517e+00 1.89724e+00  0.00000e+00 0.00000e+00 9.53422e+01 138.904 2.86407e+00 138.904 0.8012 
1 1 1 4   48  10 o 5  1.00353e+01 1.09724e+00 2.23889e+02 292.973 5.85255e+00  -1.38059e+01 0.00000e+00 0.00000e+00 1.39152e+02 292.973 8.47375e+01 112.973 0.9661 
1 1 1 4   48  11 o 6  2.81734e+00 9.56925e-01 8.65961e+01 64.111  8.85502e-01  1.82449e+00  0.00000e+00 0.00000e+00 1.25355e+01 244.111 9.91316e+01 244.111 0.7023 
1 1 1 4   48  12 o 13 1.13192e+01 1.30138e+00 1.27503e+02 246.302 -5.09477e+00 -1.16073e+01 0.00000e+00 0.00000e+00 2.78877e+02 246.302 1.51374e+02 246.302 0.9597 
1 1 1 4   48  13 o 9  1.00471e+01 1.19207e+00 1.37753e+02 276.749 1.78278e+00  -1.50651e+01 0.00000e+00 0.00000e+00 2.25272e+02 276.749 8.75193e+01 276.749 0.9665 
1 1 1 4   48  14 o 3  4.24994e+00 1.31682e+00 7.65132e+01 23.070  3.44443e+00  1.46704e+00  0.00000e+00 0.00000e+00 5.89136e+01 23.070  1.75996e+01 203.070 0.8529 
1 1 1 4   48  15 o 15 4.02615e+00 1.23942e+00 7.00746e+01 294.221 1.52445e+00  -3.38867e+00 0.00000e+00 0.00000e+00 5.79377e+01 294.221 1.21369e+01 114.221 0.8516 
1 1 1 4   48  16 o 12 9.38378e+00 1.71209e+00 1.47026e+02 78.026  2.93290e+00  1.38290e+01  0.00000e+00 0.00000e+00 1.90421e+02 78.026  4.33945e+01 78.026  0.9640 
1 1 1 4   48  17 o 3  4.41375e+00 1.37359e+00 1.00590e+02 26.745  5.77227e+00  2.90881e+00  0.00000e+00 0.00000e+00 5.06028e+01 26.745  4.99871e+01 206.745 0.9190 
1 1 1 4   49  0  o 4  1.81869e+01 4.01866e-01 2.31517e+02 341.595 7.03997e+00  -2.34262e+00 0.00000e+00 0.00000e+00 4.02646e+02 341.595 1.71129e+02 341.595 0.9299 
1 1 1 4   49  1  o 7  1.24937e+01 5.14078e-01 1.53183e+02 186.802 -3.32444e+00 -3.96524e-01 0.00000e+00 0.00000e+00 2.36985e+02 186.802 8.38016e+01 186.802 0.8328 
1 1 1 4   49  2  o 3  2.15476e+01 4.41286e-01 4.89341e+02 61.568  8.64351e+00  1.59648e+01  0.00000e+00 0.00000e+00 2.96198e+02 61.568  1.93143e+02 241.568 0.9721 
1 1 1 4   49  3  o 9  3.29745e+01 5.96955e-01 5.40100e+02 184.909 -3.69504e+01 -3.17383e+00 0.00000e+00 0.00000e+00 6.79792e+02 184.909 1.39692e+02 184.909 0.9864 
1 1 1 4   49  4  o 2  3.96723e+00 7.45043e-01 2.11397e+02 93.101  -1.09718e-01 2.02506e+00  0.00000e+00 0.00000e+00 1.06905e+02 273.101 3.18302e+02 273.101 0.7023 
1 1 1 4   49  5  o 15 2.38189e+01 5.58923e-01 4.53967e+02 303.615 1.56005e+01  -2.34676e+01 0.00000e+00 0.00000e+00 4.23201e+02 303.615 3.07663e+01 123.615 0.9821 
1 1 1 4   49  6  o 13 1.61892e+01 6.07174e-01 2.97261e+02 99.134  -2.45390e+00 1.52615e+01  0.00000e+00 0.00000e+00 2.89723e+02 99.134  7.53769e+00 279.134 0.9671 
1 1 1 4   49  7  f 0  3.01185e+01 6.74267e-01 5.38268e+02 234.264 -3.24128e+01 -4.50476e+01 0.00000e+00 0.00000e+00 5.80433e+02 234.264 4.21649e+01 234.264 0.9909 
1 1 1 4   49  8  o 5  1.82078e+01 6.36231e-01 2.84065e+02 259.664 -4.46724e+00 -2.44953e+01 0.00000e+00 0.00000e+00 3.84364e+02 259.664 1.00299e+02 259.664 0.9797 
1 1 1 4   49  9  o 17 3.94677e+00 1.12449e+00 5.56039e+01 281.267 2.24221e-01  -1.12547e+00 0.00000e+00 0.00000e+00 1.77602e+01 281.267 3.78437e+01 101.267 0.4962 
1 1 1 4   49  10 o 7  1.30807e+01 9.24723e-01 1.89730e+02 192.398 -1.65731e+01 -3.64322e+00 0.00000e+00 0.00000e+00 2.85384e+02 192.398 9.56543e+01 192.398 0.9701 
1 1 1 4   49  11 o 4  5.55287e+00 1.29593e+00 1.54155e+02 229.308 -4.33723e+00 -5.04394e+00 0.00000e+00 0.00000e+00 3.73298e+01 229.308 1.16825e+02 49.308  0.9214 
1 1 1 4   49  12 o 19 7.04431e+00 1.56247e+00 1.31861e+02 3.666   6.91887e+00  4.43248e-01  0.00000e+00 0.00000e+00 1.11804e+02 3.666   2.00568e+01 183.666 0.9248 
1 1 1 4   49  13 o 5  3.79580e+00 1.15508e+00 8.59070e+01 123.494 -2.01618e+00 3.04683e+00  0.00000e+00 0.00000e+00 3.45228e+01 123.494 5.13843e+01 303.494 0.8487 
1 1 1 4   49  14 o 13 5.87545e+00 1.29012e+00 1.15299e+02 10.178  7.74219e+00  1.38995e+00  0.00000e+00 0.00000e+00 8.97208e+01 10.178  2.55787e+01 190.178 0.9341 
1 1 1 4   49  15 o 3  4.40526e+00 1.32339e+00 6.78726e+01 58.542  1.98329e+00  3.24178e+00  0.00000e+00 0.00000e+00 7.27922e+01 58.542  4.91961e+00 58.542  0.8554 
1 1 1 4   49  16 o 18 6.25943e+00 1.66376e+00 6.57591e+01 94.936  -3.78562e-01 4.38326e+00  0.00000e+00 0.00000e+00 1.39073e+02 94.936  7.33135e+01 94.936  0.8773 
1 1 1 4   49  17 o 4  5.24332e+00 1.59564e+00 5.07241e+01 21.457  3.01781e+00  1.18612e+00  0.00000e+00 0.00000e+00 1.10771e+02 21.457  6.00465e+01 21.457  0.8264 
1 1 1 4   50  0  o 10 2.60609e+01 4.79209e-01 3.75748e+02 155.063 -1.51677e+01 7.05258e+00  0.00000e+00 0.00000e+00 5.71638e+02 155.063 1.95890e+02 155.063 0.9696 
1 1 1 4   50  1  o 19 1.06691e+01 4.25727e-01 2.31235e+02 179.789 -4.25097e+00 1.56333e-02  0.00000e+00 0.00000e+00 1.17818e+02 179.789 1.13417e+02 359.789 0.8725 
1 1 1 4   50  2  o 14 1.26169e+01 4.36746e-01 1.76139e+02 62.196  2.17959e+00  4.13325e+00  0.00000e+00 0.00000e+00 2.42662e+02 62.196  6.65236e+01 62.196  0.8852 
1 1 1 4   50  3  o 13 5.06562e+00 5.95870e-01 1.96397e+02 333.733 1.93108e+00  -9.53023e-01 0.00000e+00 0.00000e+00 5.93567e+01 153.733 2.55753e+02 153.733 0.7214 
1 1 1 4   50  4  o 6  1.66342e+01 4.67700e-01 1.55428e+02 209.017 -5.45387e+00 -3.02519e+00 0.00000e+00 0.00000e+00 4.15844e+02 209.017 2.60417e+02 209.017 0.9159 
1 1 1 4   50  5  o 13 1.79774e+01 5.97299e-01 2.24939e+02 346.428 1.07277e+01  -2.58980e+00 0.00000e+00 0.00000e+00 4.17783e+02 346.428 1.92844e+02 346.428 0.9536 
1 1 1 4   50  6  o 7  1.88193e+01 5.36208e-01 1.77685e+02 238.767 -5.39321e+00 -8.89358e+00 0.00000e+00 0.00000e+00 4.92959e+02 238.767 3.15274e+02 238.767 0.9506 
1 1 1 4   50  7  o 9  2.04802e+01 6.09675e-01 3.88241e+02 182.045 -3.09714e+01 -1.10578e+00 0.00000e+00 0.00000e+00 3.66819e+02 182.045 2.14221e+01 2.045   0.9837 
1 1 1 4   50  8  o 9  1.90510e+01 6.38143e-01 3.20674e+02 60.873  1.39602e+01  2.50532e+01  0.00000e+00 0.00000e+00 3.80541e+02 60.873  5.98675e+01 60.873  0.9824 
1 1 1 4   50  9  o 5  1.59318e+01 8.20970e-01 3.14654e+02 323.715 2.38053e+01  -1.74775e+01 0.00000e+00 0.00000e+00 2.71847e+02 323.715 4.28067e+01 143.715 0.9829 
1 1 1 4   50  10 o 18 1.02243e+01 1.04443e+00 8.81493e+01 234.533 -3.92239e+00 -5.50571e+00 0.00000e+00 0.00000e+00 2.65051e+02 234.533 1.76902e+02 234.533 0.9228 
1 1 1 4   50  11 o 3  4.98510e+00 1.23593e+00 9.04143e+01 234.032 -2.12205e+00 -2.92419e+00 0.00000e+00 0.00000e+00 6.75460e+01 234.032 2.28683e+01 54.032  0.8468 
1 1 1 4   50  12 o 11 5.19358e+00 1.39023e+00 1.00896e+02 120.697 -2.37515e+00 4.00062e+00  0.00000e+00 0.00000e+00 7.09332e+01 120.697 2.99627e+01 300.697 0.8846 
1 1 1 4   50  13 o 11 3.62285e+00 1.10024e+00 8.60956e+01 351.163 3.65536e+00  -5.68288e-01 0.00000e+00 0.00000e+00 2.91206e+01 351.163 5.69750e+01 171.163 0.8509 
1 1 1 4   50  14 o 18 3.92397e+00 1.15654e+00 6.11452e+01 167.849 -2.94203e+00 6.33475e-01  0.00000e+00 0.00000e+00 5.76736e+01 167.849 3.47158e+00 347.849 0.8107 
1 1 1 4   50  15 o 8  6.04360e+00 1.54446e+00 1.37291e+02 10.373  9.17822e+00  1.68008e+00  0.00000e+00 0.00000e+00 7.58304e+01 10.373  6.14602e+01 190.373 0.9448 
1 1 1 4   50  16 o 4  4.77213e+00 1.44907e+00 4.35077e+01 176.015 -2.57939e+00 1.79698e-01  0.00000e+00 0.00000e+00 9.42472e+01 176.015 5.07396e+01 176.015 0.7740 
1 1 1 4   50  17 o 18 4.44675e+00 1.45792e+00 4.05229e+01 206.662 -2.18405e+00 -1.09667e+00 0.00000e+00 0.00000e+00 8.52047e+01 206.662 4.46817e+01 206.662 0.7588 
1 1 1 4   51  0  o 15 1.58550e+01 3.94942e-01 3.96936e+02 249.015 -3.87789e+00 -1.01103e+01 0.00000e+00 0.00000e+00 1.69259e+02 249.015 2.27677e+02 69.015  0.9526 
1 1 1 4   51  1  o 8  1.21459e+01 3.84070e-01 3.06767e+02 9.959   7.73408e+00  1.35797e+00  0.00000e+00 0.00000e+00 1.18527e+02 9.959   1.88241e+02 189.959 0.9340 
1 1 1 4   51  2  o 15 5.10643e+01 8.05722e-01 8.88865e+02 110.411 -3.25369e+01 8.74366e+01  0.00000e+00 0.00000e+00 1.01543e+03 110.411 1.26564e+02 110.411 0.9946 
1 1 1 4   51  3  o 10 3.22933e+01 5.71690e-01 5.78585e+02 297.430 1.90320e+01  -3.66692e+01 0.00000e+00 0.00000e+00 6.17474e+02 297.430 3.88892e+01 297.430 0.9878 
1 1 1 4   51  4  o 5  7.11441e+00 5.44760e-01 9.77066e+01 334.291 1.67401e+00  -8.05952e-01 0.00000e+00 0.00000e+00 8.18063e+01 334.291 1.59002e+01 154.291 0.6730 
1 1 1 4   51  5  o 18 2.66158e+01 5.56889e-01 4.21736e+02 25.501  3.06154e+01  1.46031e+01  0.00000e+00 0.00000e+00 5.61211e+02 25.501  1.39475e+02 25.501  0.9851 
1 1 1 4   51  6  o 14 2.63517e+01 5.77533e-01 4.87598e+02 94.284  -3.06383e+00 4.08956e+01  0.00000e+00 0.00000e+00 4.87975e+02 94.284  3.77210e-01 94.284  0.9877 
1 1 1 4   51  7  o 13 2.19301e+01 5.83055e-01 5.33764e+02 187.676 -4.97046e+01 -6.69920e+00 0.00000e+00 0.00000e+00 2.79773e+02 187.676 2.53991e+02 7.676   0.9900 
1 1 1 4   51  8  o 8  8.57037e+00 9.39324e-01 1.13115e+02 7.727   4.62261e+00  6.27227e-01  0.00000e+00 0.00000e+00 1.71015e+02 7.727   5.78993e+01 7.727   0.8850 
1 1 1 4   51  9  o 4  7.85250e+00 1.13940e+00 1.67430e+02 148.749 -6.86431e+00 4.16550e+00  0.00000e+00 0.00000e+00 1.07657e+02 148.749 5.97731e+01 328.749 0.9355 
1 1 1 4   51  10 o 8  6.49083e+00 1.30889e+00 1.93613e+02 29.131  7.20817e+00  4.01716e+00  0.00000e+00 0.00000e+00 3.41160e+01 29.131  1.59497e+02 209.131 0.9373 
1 1 1 4   51  11 o 18 1.24353e+01 1.12315e+00 2.16120e+02 267.911 -8.17783e-01 -2.24218e+01 0.00000e+00 0.00000e+00 2.38647e+02 267.911 2.25266e+01 267.911 0.9775 
1 1 1 4   51  12 o 13 7.67917e+00 1.08960e+00 1.77853e+02 99.363  -2.35591e+00 1.42874e+01  0.00000e+00 0.00000e+00 9.92009e+01 99.363  7.86519e+01 279.363 0.9648 
1 1 1 4   51  13 o 19 4.14552e+00 1.15562e+00 1.07773e+02 290.183 1.70205e+00  -4.63019e+00 0.00000e+00 0.00000e+00 3.03888e+01 290.183 7.73845e+01 110.183 0.8918 
1 1 1 4   51  14 o 16 8.00852e+00 1.31510e+00 1.67375e+02 65.717  6.54036e+00  1.44971e+01  0.00000e+00 0.00000e+00 1.22154e+02 65.717  4.52210e+01 245.717 0.9680 
1 1 1 4   51  15 o 4  8.02445e+00 1.54005e+00 1.57267e+02 296.536 6.54201e+00  -1.31006e+01 0.00000e+00 0.00000e+00 1.31787e+02 296.536 2.54809e+01 116.536 0.9652 
1 1 1 4   51  16 o 12 4.31067e+00 1.35412e+00 1.08429e+02 226.117 -4.40127e+00 -4.57632e+00 0.00000e+00 0.00000e+00 3.90490e+01 226.117 6.93802e+01 46.117  0.9175 
1 1 1 4   51  17 o 11 5.94399e+00 1.75856e+00 1.53828e+02 8.374   1.01537e+01  1.49468e+00  0.00000e+00 0.00000e+00 5.65539e+01 8.374   9.72738e+01 188.374 0.9500 
1 1 1 4   52  0  o 12 3.20028e+01 5.24421e-01 4.28848e+02 136.766 -2.08870e+01 1.96375e+01  0.00000e+00 0.00000e+00 7.49533e+02 136.766 3.20685e+02 136.766 0.9824 
1 1 1 4   52  1  o 5  1.45091e+01 3.96307e-01 2.58418e+02 81.505  1.16093e+00  7.77229e+00  0.00000e+00 0.00000e+00 2.49580e+02 81.505  8.83789e+00 261.505 0.9340 
1 1 1 4   52  2  f 0  2.18721e+01 4.55601e-01 5.79733e+02 237.422 -1.48386e+01 -2.32220e+01 0.00000e+00 0.00000e+00 2.25196e+02 237.422 3.54537e+02 57.422  0.9817 
1 1 1 4   52  3  o 3  1.41716e+01 4.30129e-01 2.53992e+02 271.664 2.56034e-01  -8.81198e+00 0.00000e+00 0.00000e+00 2.46173e+02 271.664 7.81955e+00 91.664  0.9414 
1 1 1 4   52  4  o 7  2.94165e+01 5.49212e-01 4.37986e+02 30.009  2.90830e+01  1.67971e+01  0.00000e+00 0.00000e+00 6.48198e+02 30.009  2.10212e+02 30.009  0.9850 
1 1 1 4   52  5  o 12 3.64966e+01 6.41586e-01 5.55634e+02 158.433 -5.38015e+01 2.12656e+01  0.00000e+00 0.00000e+00 8.00469e+02 158.433 2.44835e+02 158.433 0.9913 
1 1 1 4   52  6  o 12 4.75453e+01 8.22429e-01 7.87096e+02 355.983 1.20113e+02  -8.43479e+00 0.00000e+00 0.00000e+00 9.87288e+02 355.983 2.00191e+02 355.983 0.9958 
1 1 1 4   52  7  o 17 1.61327e+01 6.82752e-01 2.35185e+02 235.922 -8.96055e+00 -1.32457e+01 0.00000e+00 0.00000e+00 3.50044e+02 235.922 1.14859e+02 235.922 0.9682 
1 1 1 4   52  8  o 16 2.18313e+01 7.54483e-01 3.97033e+02 219.119 -3.56229e+01 -2.89700e+01 0.00000e+00 0.00000e+00 4.11722e+02 219.119 1.46884e+01 219.119 0.9890 
1 1 1 4   52  9  o 16 8.69654e+00 9.67721e-01 1.65583e+02 199.751 -8.88679e+00 -3.19082e+00 0.00000e+00 0.00000e+00 1.42278e+02 199.751 2.33053e+01 19.751  0.9455 
1 1 1 4   52  10 o 6  5.47820e+00 1.31038e+00 7.66708e+01 103.356 -6.83282e-01 2.87790e+00  0.00000e+00 0.00000e+00 8.87534e+01 103.356 1.20826e+01 103.356 0.8068 
1 1 1 4   52  11 o 19 5.46317e+00 1.25980e+00 1.05066e+02 78.484  9.88783e-01  4.85316e+00  0.00000e+00 0.00000e+00 7.72892e+01 78.484  2.77771e+01 258.484 0.8923 
1 1 1 4   52  12 o 5  5.01470e+00 1.17805e+00 8.42307e+01 105.213 -1.17072e+00 4.30505e+00  0.00000e+00 0.00000e+00 8.06099e+01 105.213 3.62078e+00 285.213 0.8792 
1 1 1 4   52  13 o 14 3.74769e+00 1.10736e+00 1.68700e+02 8.013   7.64678e+00  1.07643e+00  0.00000e+00 0.00000e+00 3.80740e+01 188.013 2.06774e+02 188.013 0.9328 
1 1 1 4   52  14 o 16 4.52112e+00 1.29555e+00 8.57865e+01 227.103 -3.00100e+00 -3.22982e+00 0.00000e+00 0.00000e+00 6.23716e+01 227.103 2.34149e+01 47.103  0.8776 
1 1 1 4   52  15 o 1  7.45198e+00 1.49008e+00 9.15013e+01 253.094 -2.28361e+00 -7.51355e+00 0.00000e+00 0.00000e+00 1.68203e+02 253.094 7.67014e+01 253.094 0.9340 
1 1 1 4   52  16 o 12 6.87961e+00 1.74303e+00 1.32514e+02 6.971   9.65521e+00  1.18047e+00  0.00000e+00 0.00000e+00 1.10425e+02 6.971   2.20896e+01 186.970 0.9471 
1 1 1 4   52  17 o 13 4.97835e+00 1.52145e+00 6.89772e+01 150.926 -4.02171e+00 2.23607e+00  0.00000e+00 0.00000e+00 9.48286e+01 150.926 2.58514e+01 150.926 0.8832 
1 1 1 4   53  0  o 17 4.22348e+01 6.44610e-01 8.23667e+02 258.350 -1.51862e+01 -7.36530e+01 0.00000e+00 0.00000e+00 7.48540e+02 258.350 7.51270e+01 78.350  0.9933 
1 1 1 4   53  1  o 7  1.72519e+01 4.14501e-01 2.74482e+02 81.882  1.45584e+00  1.02059e+01  0.00000e+00 0.00000e+00 3.39917e+02 81.882  6.54347e+01 81.882  0.9502 
1 1 1 4   53  2  o 19 1.22119e+01 5.17508e-01 1.56223e+02 187.191 -4.63743e+00 -5.85109e-01 0.00000e+00 0.00000e+00 2.48982e+02 187.191 9.27584e+01 187.191 0.8852 
1 1 1 4   53  3  o 12 1.00957e+01 4.97526e-01 4.16408e+01 356.070 1.12520e+00  -7.72910e-02 0.00000e+00 0.00000e+00 1.43731e+02 356.070 1.02090e+02 356.070 0.4899 
1 1 1 4   53  4  o 16 3.01529e+01 5.61238e-01 4.72176e+02 307.531 2.43185e+01  -3.16565e+01 0.00000e+00 0.00000e+00 6.43746e+02 307.531 1.71570e+02 307.531 0.9874 
1 1 1 4   53  5  o 12 2.22877e+01 5.10645e-01 4.26310e+02 7.748   3.03570e+01  4.13022e+00  0.00000e+00 0.00000e+00 3.95217e+02 7.748   3.10931e+01 187.748 0.9835 
1 1 1 4   53  6  o 7  1.61366e+01 5.20346e-01 3.85286e+02 281.373 4.35873e+00  -2.16687e+01 0.00000e+00 0.00000e+00 2.05518e+02 281.373 1.79768e+02 101.373 0.9771 
1 1 1 4   53  7  o 5  2.31912e+01 6.10015e-01 3.28864e+02 204.782 -3.17210e+01 -1.46453e+01 0.00000e+00 0.00000e+00 5.27389e+02 204.782 1.98526e+02 204.782 0.9856 
1 1 1 4   53  8  o 11 2.20624e+01 6.45629e-01 4.11586e+02 87.362  2.46577e+00  5.35248e+01  0.00000e+00 0.00000e+00 4.06915e+02 87.362  4.67171e+00 267.362 0.9906 
1 1 1 4   53  9  o 12 1.14252e+01 7.47844e-01 1.84096e+02 13.884  1.47661e+01  3.64980e+00  0.00000e+00 0.00000e+00 2.29323e+02 13.884  4.52279e+01 13.884  0.9665 
1 1 1 4   53  10 f 0  7.49201e+00 1.25125e+00 1.65955e+02 215.461 -7.34492e+00 -5.23150e+00 0.00000e+00 0.00000e+00 9.83712e+01 215.461 6.75835e+01 35.461  0.9428 
1 1 1 4   53  11 o 15 3.21616e+00 1.06694e+00 2.22804e+01 87.493  2.86761e-02  6.54835e-01  0.00000e+00 0.00000e+00 1.51680e+01 87.493  7.11245e+00 267.493 0.3113 
1 1 1 4   53  12 o 8  1.00229e+01 9.14070e-01 1.72562e+02 11.113  2.00590e+01  3.94003e+00  0.00000e+00 0.00000e+00 1.92842e+02 11.113  2.02796e+01 11.113  0.9752 
1 1 1 4   53  13 o 19 3.81144e+00 1.01525e+00 5.01539e+01 227.583 -1.61247e+00 -1.76482e+00 0.00000e+00 0.00000e+00 5.70069e+01 227.583 6.85294e+00 227.583 0.7525 
1 1 1 4   53  14 o 16 9.33219e+00 1.27565e+00 7.48900e+01 310.231 5.67899e+00  -6.71280e+00 0.00000e+00 0.00000e+00 2.53079e+02 310.231 1.78189e+02 310.231 0.9413 
1 1 1 4   53  15 o 11 7.29104e+00 1.54110e+00 1.08191e+02 234.548 -5.16933e+00 -7.26003e+00 0.00000e+00 0.00000e+00 1.48080e+02 234.548 3.98886e+01 234.548 0.9421 
1 1 1 4   53  16 o 17 5.59067e+00 1.57223e+00 1.49095e+02 12.986  9.71394e+00  2.24018e+00  0.00000e+00 0.00000e+00 4.85748e+01 12.986  1.00521e+02 192.986 0.9484 
1 1 1 4   53  17 o 11 7.45758e+00 1.92040e+00 1.32581e+02 351.476 1.01648e+01  -1.52345e+00 0.00000e+00 0.00000e+00 1.31318e+02 351.476 1.26295e+00 171.476 0.9500 
1 1 1 4   54  0  o 14 1.03176e+01 3.97058e-01 2.01736e+02 85.965  3.26295e-01  4.62616e+00  0.00000e+00 0.00000e+00 1.40109e+02 85.965  6.16265e+01 265.965 0.8842 
1 1 1 4   54  1  o 19 1.54282e+01 4.04003e-01 2.54972e+02 0.086   9.68586e+00  1.45897e-02  0.00000e+00 0.00000e+00 2.92483e+02 0.086   3.75105e+01 0.086   0.9469 
1 1 1 4   54  2  o 4  3.74547e+01 6.30422e-01 8.00523e+02 218.114 -5.64212e+01 -4.42622e+01 0.00000e+00 0.00000e+00 5.93358e+02 218.114 2.07165e+02 38.114  0.9930 
1 1 1 4   54  3  f 0  8.03787e+00 4.94954e-01 1.76993e+02 254.068 -1.02145e+00 -3.57833e+00 0.00000e+00 0.00000e+00 7.96271e+01 254.068 9.73662e+01 74.068  0.8519 
1 1 1 4   54  4  o 15 2.27961e+01 4.97163e-01 2.91298e+02 253.476 -5.72178e+00 -1.92869e+01 0.00000e+00 0.00000e+00 5.41490e+02 253.476 2.50192e+02 253.476 0.9748 
1 1 1 4   54  5  o 3  3.20710e+01 5.96667e-01 5.11338e+02 84.185  5.13294e+00  5.04006e+01  0.00000e+00 0.00000e+00 6.78490e+02 84.185  1.67152e+02 84.185  0.9901 
1 1 1 4   54  6  o 7  8.22617e+00 6.46935e-01 2.55797e+02 153.672 -7.32826e+00 3.62634e+00  0.00000e+00 0.00000e+00 3.28841e+01 153.672 2.22913e+02 333.672 0.9367 
1 1 1 4   54  7  o 14 2.20108e+01 6.26106e-01 3.52764e+02 166.381 -3.63264e+01 8.80105e+00  0.00000e+00 0.00000e+00 4.60569e+02 166.381 1.07805e+02 166.381 0.9865 
1 1 1 4   54  8  o 19 2.51593e+01 6.68429e-01 4.62949e+02 292.477 2.53438e+01  -6.12560e+01 0.00000e+00 0.00000e+00 4.72008e+02 292.477 9.05942e+00 292.477 0.9924 
1 1 1 4   54  9  o 13 6.42433e+00 9.61469e-01 1.06640e+02 238.679 -2.46269e+00 -4.04714e+00 0.00000e+00 0.00000e+00 1.06639e+02 238.679 1.22217e-03 58.679  0.8869 
1 1 1 4   54  10 o 13 1.80035e+01 8.77918e-01 3.57503e+02 23.016  5.04716e+01  2.14401e+01  0.00000e+00 0.00000e+00 3.09944e+02 23.016  4.75592e+01 203.015 0.9908 
1 1 1 4   54  11 o 9  4.58228e+00 1.25277e+00 4.72606e+01 256.013 -4.49548e-01 -1.80477e+00 0.00000e+00 0.00000e+00 6.81340e+01 256.013 2.08734e+01 256.013 0.6734 
1 1 1 4   54  12 o 4  1.26809e+01 8.32428e-01 3.05329e+02 218.566 -3.49111e+01 -2.78353e+01 0.00000e+00 0.00000e+00 1.63316e+02 218.566 1.42012e+02 38.566  0.9887 
1 1 1 4   54  13 o 15 1.95546e+01 8.50447e-01 3.44436e+02 64.092  3.89699e+01  8.02251e+01  0.00000e+00 0.00000e+00 3.81923e+02 64.092  3.74869e+01 64.092  0.9944 
1 1 1 4   54  14 o 4  7.19430e+00 1.35782e+00 1.54232e+02 217.554 -9.93128e+00 -7.63538e+00 0.00000e+00 0.00000e+00 1.03381e+02 217.554 5.08514e+01 37.554  0.9592 
1 1 1 4   54  15 o 3  3.65414e+00 1.19863e+00 6.41329e+01 319.227 2.35256e+00  -2.02870e+00 0.00000e+00 0.00000e+00 4.73098e+01 319.227 1.68231e+01 139.227 0.8176 
1 1 1 4   54  16 o 18 4.17103e+00 1.36329e+00 1.61521e+02 116.813 -4.27389e+00 8.45603e+00  0.00000e+00 0.00000e+00 1.44987e+01 296.813 1.76019e+02 296.813 0.9457 
1 1 1 4   54  17 o 1  3.99706e+00 1.33417e+00 1.82582e+02 308.467 7.67852e+00  -9.66479e+00 0.00000e+00 0.00000e+00 3.98851e+01 128.467 2.22467e+02 128.467 0.9586 
1 1 1 4   55  0  o 6  3.12829e+01 5.22625e-01 5.94519e+02 159.840 -4.26044e+01 1.56416e+01  0.00000e+00 0.00000e+00 5.64488e+02 159.840 3.00317e+01 339.840 0.9889 
1 1 1 4   55  1  o 6  2.41962e+01 4.77944e-01 3.11089e+02 259.445 -3.32269e+00 -1.78323e+01 0.00000e+00 0.00000e+00 5.70167e+02 259.445 2.59078e+02 259.445 0.9720 
1 1 1 4   55  2  o 19 3.15779e+01 5.58453e-01 5.16317e+02 141.285 -3.39457e+01 2.72106e+01  0.00000e+00 0.00000e+00 6.53285e+02 141.285 1.36968e+02 141.285 0.9884 
1 1 1 4   55  3  o 16 1.82931e+01 6.20431e-01 2.80637e+02 136.671 -1.01785e+01 9.60164e+00  0.00000e+00 0.00000e+00 3.79878e+02 136.671 9.92413e+01 136.671 0.9636 
1 1 1 4   55  4  o 16 9.65094e+00 5.12200e-01 2.09048e+02 141.720 -4.54822e+00 3.58942e+00  0.00000e+00 0.00000e+00 1.19679e+02 141.720 8.93689e+01 321.720 0.9090 
1 1 1 4   55  5  o 12 1.58088e+01 5.01417e-01 2.11104e+02 108.148 -3.43978e+00 1.04940e+01  0.00000e+00 0.00000e+00 3.53699e+02 108.148 1.42595e+02 108.148 0.9536 
1 1 1 4   55  6  o 1  1.14105e+01 5.63254e-01 2.11855e+02 70.537  3.45741e+00  9.78348e+00  0.00000e+00 0.00000e+00 1.94424e+02 70.537  1.74309e+01 250.537 0.9505 
1 1 1 4   55  7  o 13 5.69492e+00 9.31709e-01 1.20017e+02 299.077 1.49558e+00  -2.68958e+00 0.00000e+00 0.00000e+00 5.39213e+01 299.077 6.60958e+01 119.077 0.8156 
1 1 1 4   55  8  o 18 1.24711e+01 6.87971e-01 2.78871e+02 196.317 -2.01318e+01 -5.89339e+00 0.00000e+00 0.00000e+00 1.76771e+02 196.317 1.02100e+02 16.317  0.9759 
1 1 1 4   55  9  o 5  9.67124e+00 9.77403e-01 2.25620e+02 116.198 -6.85169e+00 1.39256e+01  0.00000e+00 0.00000e+00 1.24473e+02 116.198 1.01147e+02 296.198 0.9672 
1 1 1 4   55  10 o 7  5.94153e+00 1.22377e+00 1.37088e+02 197.339 -5.92565e+00 -1.85007e+00 0.00000e+00 0.00000e+00 6.63970e+01 197.339 7.06914e+01 17.339  0.9155 
1 1 1 4   55  11 o 8  6.80249e+00 1.01278e+00 9.94890e+01 5.143   6.65262e+00  5.98730e-01  0.00000e+00 0.00000e+00 1.34973e+02 5.143   3.54839e+01 5.143   0.9218 
1 1 1 4   55  12 o 3  5.21592e+00 1.14774e+00 5.20563e+01 27.661  2.54863e+00  1.33587e+00  0.00000e+00 0.00000e+00 1.03986e+02 27.661  5.19298e+01 27.661  0.8005 
1 1 1 4   55  13 o 5  4.96324e+00 1.22862e+00 7.44094e+01 17.011  4.33778e+00  1.32711e+00  0.00000e+00 0.00000e+00 8.89776e+01 17.011  1.45682e+01 17.011  0.8814 
1 1 1 4   55  14 o 9  7.94187e+00 1.36198e+00 1.62612e+02 240.458 -7.36959e+00 -1.30035e+01 0.00000e+00 0.00000e+00 1.23722e+02 240.458 3.88900e+01 60.458  0.9659 
1 1 1 4   55  15 o 12 8.70030e+00 1.45965e+00 1.11730e+02 145.973 -9.60985e+00 6.48858e+00  0.00000e+00 0.00000e+00 1.98447e+02 145.973 8.67172e+01 145.973 0.9559 
1 1 1 4   55  16 f 0  7.98303e+00 1.78001e+00 1.31126e+02 321.766 8.60640e+00  -6.78074e+00 0.00000e+00 0.00000e+00 1.52469e+02 321.766 2.13431e+01 321.766 0.9532 
1 1 1 4   55  17 o 15 3.70969e+00 1.25819e+00 5.04925e+01 57.751  1.80597e+00  2.86235e+00  0.00000e+00 0.00000e+00 6.48290e+01 57.751  1.43365e+01 57.751  0.8348 
1 1 1 4   56  0  o 1  1.93856e+01 4.13605e-01 2.53079e+02 251.572 -4.17650e+00 -1.25345e+01 0.00000e+00 0.00000e+00 4.45033e+02 251.572 1.91954e+02 251.572 0.9614 
1 1 1 4   56  1  f 0  1.99656e+01 4.81451e-01 3.44211e+02 259.948 -3.21330e+00 -1.81267e+01 0.00000e+00 0.00000e+00 3.83162e+02 259.948 3.89504e+01 259.948 0.9724 
1 1 1 4   56  2  o 14 1.01373e+01 4.54662e-01 1.01305e+02 28.621  2.48594e+00  1.35656e+00  0.00000e+00 0.00000e+00 2.01306e+02 28.621  1.00001e+02 28.621  0.7968 
1 1 1 4   56  3  o 1  2.72697e+01 5.24856e-01 4.25272e+02 120.575 -1.78598e+01 3.02291e+01  0.00000e+00 0.00000e+00 5.81768e+02 120.575 1.56496e+02 120.575 0.9857 
1 1 1 4   56  4  o 3  5.01245e+00 8.55075e-01 2.25903e+02 293.754 1.42782e+00  -3.24430e+00 0.00000e+00 0.00000e+00 6.75219e+01 113.754 2.93425e+02 113.754 0.8434 
1 1 1 4   56  5  o 6  1.79413e+01 6.76487e-01 2.96664e+02 205.352 -1.69229e+01 -8.01810e+00 0.00000e+00 0.00000e+00 3.57221e+02 205.352 6.05569e+01 205.352 0.9729 
1 1 1 4   56  6  o 19 3.11648e+01 6.03815e-01 5.31135e+02 356.328 7.01563e+01  -4.50283e+00 0.00000e+00 0.00000e+00 6.27767e+02 356.328 9.66327e+01 356.328 0.9929 
1 1 1 4   56  7  f 0  1.95297e+01 6.21315e-01 1.85492e+02 4.126   1.81493e+01  1.30936e+00  0.00000e+00 0.00000e+00 5.25408e+02 4.126   3.39916e+02 4.126   0.9721 
1 1 1 4   56  8  o 18 1.27506e+01 6.50499e-01 2.87467e+02 186.952 -2.24606e+01 -2.73887e+00 0.00000e+00 0.00000e+00 1.79165e+02 186.952 1.08302e+02 6.952   0.9776 
1 1 1 4   56  9  o 8  9.31623e+00 9.47939e-01 1.69692e+02 272.700 5.73387e-01  -1.21606e+01 0.00000e+00 0.00000e+00 1.64284e+02 272.700 5.40867e+00 92.700  0.9580 
1 1 1 4   56  10 o 8  8.46326e+00 1.11346e+00 9.32351e+01 344.713 6.30741e+00  -1.72400e+00 0.00000e+00 0.00000e+00 1.98002e+02 344.713 1.04767e+02 344.713 0.9200 
1 1 1 4   56  11 o 12 2.88739e+00 8.96785e-01 3.09659e+01 286.593 2.47056e-01  -8.29083e-01 0.00000e+00 0.00000e+00 1.18427e+01 286.593 1.91232e+01 106.593 0.3966 
1 1 1 4   56  12 o 9  8.49987e+00 1.02754e+00 1.54339e+02 216.861 -1.24257e+01 -9.31637e+00 0.00000e+00 0.00000e+00 1.52868e+02 216.861 1.47087e+00 36.861  0.9672 
1 1 1 4   56  13 o 13 1.55874e+01 9.01357e-01 2.67291e+02 317.065 4.38294e+01  -4.07792e+01 0.00000e+00 0.00000e+00 3.09921e+02 317.065 4.26299e+01 317.065 0.9916 
1 1 1 4   56  14 o 3  1.10113e+01 1.15074e+00 1.89927e+02 151.769 -2.56996e+01 1.37979e+01  0.00000e+00 0.00000e+00 2.13899e+02 151.769 2.39713e+01 151.769 0.9827 
1 1 1 4   56  15 o 8  4.31233e+00 1.28461e+00 9.76749e+01 212.630 -4.93432e+00 -3.15933e+00 0.00000e+00 0.00000e+00 4.86853e+01 212.630 4.89896e+01 32.631  0.9101 
1 1 1 4   56  16 o 17 7.71446e+00 1.69959e+00 1.07631e+02 46.210  6.32901e+00  6.60210e+00  0.00000e+00 0.00000e+00 1.63628e+02 46.210  5.59978e+01 46.210  0.9436 
1 1 1 4   56  17 o 10 9.05154e+00 1.89469e+00 1.02454e+02 119.726 -4.76377e+00 8.34299e+00  0.00000e+00 0.00000e+00 2.16493e+02 119.726 1.14039e+02 119.726 0.9464 
1 1 1 4   57  0  o 10 8.62897e+00 4.87245e-01 2.14529e+02 175.422 -4.82622e+00 3.86417e-01  0.00000e+00 0.00000e+00 7.29633e+01 175.422 1.41566e+02 355.422 0.8896 
1 1 1 4   57  1  o 3  3.75653e+00 7.62477e-01 1.53364e+02 329.693 1.34525e+00  -7.86333e-01 0.00000e+00 0.00000e+00 6.75029e+01 149.693 2.20867e+02 149.693 0.6102 
1 1 1 4   57  2  o 16 3.45037e+01 5.97844e-01 5.93829e+02 170.015 -5.63565e+01 9.92206e+00  0.00000e+00 0.00000e+00 6.87347e+02 170.015 9.35185e+01 170.015 0.9912 
1 1 1 4   57  3  o 7  1.47592e+01 5.80782e-01 3.39899e+02 354.413 1.42907e+01  -1.39802e+00 0.00000e+00 0.00000e+00 1.93375e+02 354.413 1.46524e+02 174.413 0.9645 
1 1 1 4   57  4  o 6  7.59191e+00 7.49817e-01 1.57858e+02 243.356 -1.69343e+00 -3.37518e+00 0.00000e+00 0.00000e+00 8.50985e+01 243.356 7.27593e+01 63.356  0.8543 
1 1 1 4   57  5  o 12 1.94196e+01 5.02834e-01 4.21415e+02 124.211 -1.59105e+01 2.34016e+01  0.00000e+00 0.00000e+00 2.92965e+02 124.211 1.28450e+02 304.211 0.9822 
1 1 1 4   57  6  o 9  6.11326e+00 8.92101e-01 1.33169e+02 175.883 -3.58631e+00 2.58161e-01  0.00000e+00 0.00000e+00 6.04915e+01 175.883 7.26777e+01 355.883 0.8459 
1 1 1 4   57  7  o 1  1.59925e+01 6.06185e-01 2.56190e+02 108.192 -7.60575e+00 2.31434e+01  0.00000e+00 0.00000e+00 3.30131e+02 108.192 7.39408e+01 108.192 0.9793 
1 1 1 4   57  8  o 6  6.32512e+00 8.70556e-01 9.94465e+01 5.246   4.19976e+00  3.85601e-01  0.00000e+00 0.00000e+00 1.06843e+02 5.246   7.39624e+00 5.246   0.8714 
1 1 1 4   57  9  o 13 5.05917e+00 1.18431e+00 7.51894e+01 174.753 -2.58260e+00 2.37162e-01  0.00000e+00 0.00000e+00 7.14682e+01 174.753 3.72126e+00 354.753 0.7748 
1 1 1 4   57  10 o 19 4.75816e+00 1.15286e+00 8.77974e+01 158.486 -3.21332e+00 1.26663e+00  0.00000e+00 0.00000e+00 6.14420e+01 158.486 2.63555e+01 338.486 0.8387 
1 1 1 4   57  11 o 4  1.08584e+01 7.59673e-01 1.96218e+02 278.982 3.80965e+00  -2.41024e+01 0.00000e+00 0.00000e+00 2.01272e+02 278.982 5.05353e+00 278.982 0.9793 
1 1 1 4   57  12 o 16 5.86999e+00 1.12393e+00 1.87742e+02 205.241 -1.13276e+01 -5.34034e+00 0.00000e+00 0.00000e+00 2.26176e+01 205.241 1.65124e+02 25.241  0.9592 
1 1 1 4   57  13 o 3  3.69291e+00 1.02347e+00 4.11530e+01 71.619  6.42537e-01  1.93373e+00  0.00000e+00 0.00000e+00 5.59007e+01 71.619  1.47477e+01 71.619  0.7039 
1 1 1 4   57  14 o 2  8.35431e+00 1.28809e+00 1.30729e+02 181.320 -1.39545e+01 -3.21615e-01 0.00000e+00 0.00000e+00 1.69615e+02 181.320 3.88862e+01 181.320 0.9635 
1 1 1 4   57  15 f 0  4.44760e+00 1.36177e+00 8.18324e+01 86.725  2.57147e-01  4.49360e+00  0.00000e+00 0.00000e+00 6.41614e+01 86.725  1.76710e+01 266.725 0.8804 
1 1 1 4   57  16 o 16 1.08103e+01 1.63457e+00 8.02468e+01 245.538 -4.32034e+00 -9.49677e+00 0.00000e+00 0.00000e+00 3.02694e+02 245.538 2.22447e+02 245.538 0.9508 
1 1 1 4   58  0  o 6  3.22349e+01 5.35199e-01 5.50400e+02 303.337 2.66922e+01  -4.05778e+01 0.00000e+00 0.00000e+00 6.44204e+02 303.337 9.38043e+01 303.337 0.9897 
1 1 1 4   58  1  o 19 3.26912e+01 6.31572e-01 5.27012e+02 137.303 -3.52756e+01 3.25478e+01  0.00000e+00 0.00000e+00 6.84511e+02 137.303 1.57499e+02 137.303 0.9895 
1 1 1 4   58  2  o 18 3.08103e+01 5.59214e-01 5.60128e+02 43.436  3.77320e+01  3.57257e+01  0.00000e+00 0.00000e+00 5.82694e+02 43.436  2.25660e+01 43.436  0.9903 
1 1 1 4   58  3  o 5  1.18739e+01 4.68020e-01 2.45990e+02 17.938  8.97176e+00  2.90438e+00  0.00000e+00 0.00000e+00 1.74458e+02 17.938  7.15328e+01 197.938 0.9454 
1 1 1 4   58  4  o 12 2.50489e+00 7.72648e-01 9.72130e+01 95.878  -8.06204e-02 7.83067e-01  0.00000e+00 0.00000e+00 6.28805e+01 275.878 1.60093e+02 275.878 0.3660 
1 1 1 4   58  5  f 0  6.74445e+00 7.13722e-01 8.08046e+01 125.818 -1.34976e+00 1.87027e+00  0.00000e+00 0.00000e+00 1.06652e+02 125.818 2.58479e+01 125.818 0.7422 
1 1 1 4   58  6  o 12 3.27663e+01 7.09578e-01 5.58923e+02 261.304 -1.31829e+01 -8.61901e+01 0.00000e+00 0.00000e+00 6.60854e+02 261.304 1.01931e+02 261.304 0.9942 
1 1 1 4   58  7  o 3  1.63788e+01 6.10421e-01 2.89781e+02 248.664 -9.82291e+00 -2.51477e+01 0.00000e+00 0.00000e+00 3.11864e+02 248.664 2.20825e+01 248.664 0.9813 
1 1 1 4   58  8  o 1  1.23915e+01 7.79600e-01 2.10416e+02 67.870  7.05482e+00  1.73483e+01  0.00000e+00 0.00000e+00 2.40744e+02 67.870  3.03274e+01 67.870  0.9729 
1 1 1 4   58  9  o 8  9.40470e+00 9.81446e-01 1.39959e+02 355.025 1.03783e+01  -9.03476e-01 0.00000e+00 0.00000e+00 1.94520e+02 355.025 5.45602e+01 355.025 0.9507 
1 1 1 4   58  10 o 10 5.77534e+00 9.64967e-01 1.36820e+02 48.387  5.06641e+00  5.70376e+00  0.00000e+00 0.00000e+00 6.44402e+01 48.387  7.23799e+01 228.387 0.9319 
1 1 1 4   58  11 o 5  1.35961e+01 7.16893e-01 2.60031e+02 213.107 -3.62084e+01 -2.36106e+01 0.00000e+00 0.00000e+00 2.42211e+02 213.107 1.78192e+01 33.107  0.9884 
1 1 1 4   58  12 o 1  8.38460e+00 9.58584e-01 1.81472e+02 60.957  8.93098e+00  1.60835e+01  0.00000e+00 0.00000e+00 1.23097e+02 60.957  5.83753e+01 240.957 0.9724 
1 1 1 4   58  13 o 18 8.25071e+00 1.25265e+00 1.48902e+02 194.119 -1.41758e+01 -3.56560e+00 0.00000e+00 0.00000e+00 1.48385e+02 194.119 5.16643e-01 14.119  0.9652 
1 1 1 4   58  14 o 4  7.15554e+00 1.42685e+00 1.26334e+02 7.387   1.02650e+01  1.33080e+00  0.00000e+00 0.00000e+00 1.27379e+02 7.387   1.04500e+00 7.387   0.9504 
1 1 1 4   58  15 o 11 3.58032e+00 1.15576e+00 3.72446e+01 102.280 -4.24600e-01 1.95062e+00  0.00000e+00 0.00000e+00 5.58099e+01 102.280 1.85653e+01 102.280 0.6972 
1 1 1 4   58  16 o 2  6.10950e+00 1.55823e+00 7.02309e+01 339.806 5.11283e+00  -1.88053e+00 0.00000e+00 0.00000e+00 1.35239e+02 339.806 6.50081e+01 339.806 0.9028 
1 1 1 4   59  0  o 7  9.09544e+00 4.38190e-01 2.03479e+02 352.481 5.57547e+00  -7.35925e-01 0.00000e+00 0.00000e+00 1.05081e+02 352.481 9.83974e+01 172.481 0.9061 
1 1 1 4   59  1  o 7  3.10375e+01 5.54661e-01 5.71683e+02 85.072  4.58895e+00  5.32174e+01  0.00000e+00 0.00000e+00 5.79610e+02 85.072  7.92780e+00 85.072  0.9906 
1 1 1 4   59  2  o 10 1.04149e+01 6.62282e-01 5.82044e+01 32.775  1.62900e+00  1.04881e+00  0.00000e+00 0.00000e+00 2.09829e+02 32.775  1.51625e+02 32.775  0.6872 
1 1 1 4   59  3  f 0  1.01310e+01 4.79434e-01 2.24152e+02 155.120 -6.62252e+00 3.07120e+00  0.00000e+00 0.00000e+00 1.28206e+02 155.120 9.59458e+01 335.120 0.9287 
1 1 1 4   59  4  o 19 2.38067e+01 6.23554e-01 5.61834e+02 134.112 -3.20043e+01 3.30124e+01  0.00000e+00 0.00000e+00 3.19900e+02 134.112 2.41933e+02 314.112 0.9891 
1 1 1 4   59  5  f 0  2.69394e+01 5.50240e-01 3.16564e+02 321.936 2.86810e+01  -2.24600e+01 0.00000e+00 0.00000e+00 6.78172e+02 321.936 3.61608e+02 321.936 0.9862 
1 1 1 4   59  6  o 3  1.02873e+01 6.59973e-01 2.48757e+02 79.670  2.14052e+00  1.17432e+01  0.00000e+00 0.00000e+00 1.19856e+02 79.670  1.28901e+02 259.670 0.9571 
1 1 1 4   59  7  o 5  1.32401e+01 6.20381e-01 3.13222e+02 318.835 1.90479e+01  -1.66547e+01 0.00000e+00 0.00000e+00 1.72423e+02 318.835 1.40799e+02 138.835 0.9800 
1 1 1 4   59  8  o 15 4.22680e+00 1.03374e+00 6.55778e+01 301.247 9.75545e-01  -1.60782e+00 0.00000e+00 0.00000e+00 4.15153e+01 301.247 2.40625e+01 121.247 0.6772 
1 1 1 4   59  9  o 10 6.47005e+00 1.12850e+00 8.26594e+01 24.768  3.83361e+00  1.76878e+00  0.00000e+00 0.00000e+00 1.28251e+02 24.768  4.55920e+01 24.768  0.8715 
1 1 1 4   59  10 o 10 1.29002e+01 6.80331e-01 2.03278e+02 183.594 -2.70681e+01 -1.70002e+00 0.00000e+00 0.00000e+00 2.70042e+02 183.594 6.67639e+01 183.594 0.9814 
1 1 1 4   59  11 o 2  3.59839e+00 9.91323e-01 3.13560e+01 74.183  3.52725e-01  1.24513e+00  0.00000e+00 0.00000e+00 4.13874e+01 74.183  1.00314e+01 74.183  0.5410 
1 1 1 4   59  12 o 5  5.70223e+00 1.15618e+00 1.32872e+02 238.909 -4.44478e+00 -7.37074e+00 0.00000e+00 0.00000e+00 6.73161e+01 238.909 6.55556e+01 58.909  0.9400 
1 1 1 4   59  13 o 3  5.96344e+00 1.17174e+00 8.16958e+01 211.943 -5.32432e+00 -3.31969e+00 0.00000e+00 0.00000e+00 1.22293e+02 211.943 4.05976e+01 211.943 0.9164 
1 1 1 4   59  14 o 18 4.28753e+00 1.24102e+00 6.48931e+01 36.508  3.05417e+00  2.26064e+00  0.00000e+00 0.00000e+00 7.19051e+01 36.508  7.01199e+00 36.508  0.8554 
1 1 1 4   59  15 o 18 3.94320e+00 1.25512e+00 3.65156e+01 302.801 1.10652e+00  -1.71691e+00 0.00000e+00 0.00000e+00 6.70535e+01 302.801 3.05379e+01 302.801 0.7046 
1 1 1 4   59  16 o 15 4.92256e+00 1.49686e+00 5.94505e+01 102.288 -8.15835e-01 3.74539e+00  0.00000e+00 0.00000e+00 9.76341e+01 102.288 3.81836e+01 102.288 0.8568 
1 1 1 4   60  0  o 2  2.25463e+01 4.48086e-01 3.86230e+02 298.404 1.19267e+01  -2.20543e+01 0.00000e+00 0.00000e+00 4.40780e+02 298.404 5.45498e+01 298.404 0.9799 
1 1 1 4   60  1  o 2  1.52114e+01 5.37219e-01 2.01275e+02 17.052  9.43452e+00  2.89383e+00  0.00000e+00 0.00000e+00 3.38559e+02 17.052  1.37284e+02 17.052  0.9479 
1 1 1 4   60  2  o 16 3.62023e+01 6.25369e-01 5.47817e+02 76.805  1.39708e+01  5.95890e+01  0.00000e+00 0.00000e+00 7.96558e+02 76.805  2.48741e+02 76.805  0.9918 
1 1 1 4   60  3  o 4  2.01627e+01 4.76440e-01 3.83375e+02 257.877 -5.36792e+00 -2.49896e+01 0.00000e+00 0.00000e+00 3.56648e+02 257.877 2.67276e+01 77.877  0.9802 
1 1 1 4   60  4  o 1  1.30106e+01 5.78358e-01 1.79558e+02 27.103  8.12006e+00  4.15575e+00  0.00000e+00 0.00000e+00 2.80034e+02 27.103  1.00476e+02 27.103  0.9435 
1 1 1 4   60  5  o 2  1.83669e+01 5.61293e-01 3.22478e+02 283.652 6.12957e+00  -2.52362e+01 0.00000e+00 0.00000e+00 3.51739e+02 283.652 2.92607e+01 283.652 0.9806 
1 1 1 4   60  6  o 4  7.06098e+00 8.07987e-01 1.82069e+02 160.660 -6.37740e+00 2.23832e+00  0.00000e+00 0.00000e+00 6.18014e+01 160.660 1.20268e+02 340.660 0.9227 
1 1 1 4   60  7  o 11 6.68602e+00 7.85596e-01 1.86440e+02 76.958  1.70012e+00  7.33937e+00  0.00000e+00 0.00000e+00 4.65058e+01 76.958  1.39934e+02 256.958 0.9310 
1 1 1 4   60  8  o 3  4.45307e+00 1.08376e+00 8.67165e+01 142.537 -2.11640e+00 1.62181e+00  0.00000e+00 0.00000e+00 4.35461e+01 142.537 4.31704e+01 322.537 0.7819 
1 1 1 4   60  9  o 15 8.30936e+00 1.00500e+00 1.74901e+02 69.475  4.17302e+00  1.11461e+01  0.00000e+00 0.00000e+00 1.22484e+02 69.475  5.24164e+01 249.475 0.9570 
1 1 1 4   60  10 o 13 3.48901e+00 9.30341e-01 1.78953e+02 317.669 4.46802e+00  -4.07000e+00 0.00000e+00 0.00000e+00 5.98729e+01 137.669 2.38826e+02 137.669 0.9130 
1 1 1 4   60  11 o 1  9.75502e+00 8.35611e-01 1.08878e+02 106.085 -3.39371e+00 1.17692e+01  0.00000e+00 0.00000e+00 2.40386e+02 106.085 1.31508e+02 106.085 0.9583 
1 1 1 4   60  12 o 1  6.63403e+00 1.16129e+00 9.23574e+01 117.251 -3.26625e+00 6.34166e+00  0.00000e+00 0.00000e+00 1.37288e+02 117.251 4.49309e+01 117.251 0.9270 
1 1 1 4   60  13 o 12 4.88197e+00 1.25561e+00 1.50855e+02 304.178 4.80405e+00  -7.07484e+00 0.00000e+00 0.00000e+00 2.03309e+01 304.178 1.30524e+02 124.178 0.9396 
1 1 1 4   60  14 o 13 5.09828e+00 1.25146e+00 9.78586e+01 85.671  5.28719e-01  6.98498e+00  0.00000e+00 0.00000e+00 7.81344e+01 85.671  1.97242e+01 265.671 0.9256 
1 1 1 4   60  15 o 19 1.21389e+01 1.34851e+00 1.88438e+02 9.993   3.07195e+01  5.41267e+00  0.00000e+00 0.00000e+00 2.56648e+02 9.993   6.82100e+01 9.993   0.9838 
1 1 1 4   60  16 o 19 3.75335e+00 1.24299e+00 7.20653e+01 195.567 -4.13796e+00 -1.15277e+00 0.00000e+00 0.00000e+00 5.00942e+01 195.567 2.19711e+01 15.567  0.8740 
1 1 1 4   61  0  o 2  2.55612e+01 4.75803e-01 3.41484e+02 143.663 -2.19464e+01 1.61429e+01  0.00000e+00 0.00000e+00 5.97510e+02 143.663 2.56027e+02 143.663 0.9815 
1 1 1 4   61  1  o 5  1.84861e+01 4.43263e-01 3.84181e+02 299.737 1.09882e+01  -1.92354e+01 0.00000e+00 0.00000e+00 2.92015e+02 299.737 9.21664e+01 119.737 0.9772 
1 1 1 4   61  2  o 15 2.85048e+01 5.40095e-01 4.50707e+02 86.905  2.21208e+00  4.09167e+01  0.00000e+00 0.00000e+00 6.03296e+02 86.905  1.52589e+02 86.905  0.9877 
1 1 1 4   61  3  o 17 2.68403e+01 5.33574e-01 4.82925e+02 53.531  2.66554e+01  3.60642e+01  0.00000e+00 0.00000e+00 5.10609e+02 53.531  2.76843e+01 53.531  0.9888 
1 1 1 4   61  4  o 14 2.75628e+01 5.92085e-01 3.53457e+02 120.792 -2.13075e+01 3.57553e+01  0.00000e+00 0.00000e+00 6.65869e+02 120.792 3.12412e+02 120.792 0.9879 
1 1 1 4   61  5  o 17 4.77822e+00 9.05980e-01 1.71394e+02 283.754 9.01600e-01  -3.68342e+00 0.00000e+00 0.00000e+00 1.84728e+01 103.754 1.89866e+02 103.754 0.8550 
1 1 1 4   61  6  o 8  1.91135e+01 6.81953e-01 3.75510e+02 178.648 -4.21099e+01 9.93962e-01  0.00000e+00 0.00000e+00 3.31242e+02 178.648 4.42683e+01 358.648 0.9881 
1 1 1 4   61  7  o 19 6.64013e+00 9.99301e-01 6.83187e+01 256.542 -6.65285e-01 -2.78014e+00 0.00000e+00 0.00000e+00 1.30176e+02 256.542 6.18569e+01 256.542 0.7990 
1 1 1 4   61  8  o 7  4.47070e+00 1.07588e+00 1.07561e+02 56.791  1.95233e+00  2.98242e+00  0.00000e+00 0.00000e+00 3.36411e+01 56.791  7.39201e+01 236.791 0.8444 
1 1 1 4   61  9  o 5  4.77486e+00 9.76716e-01 1.67027e+02 113.119 -2.71748e+00 6.36530e+00  0.00000e+00 0.00000e+00 1.94762e+00 293.119 1.68974e+02 293.119 0.9246 
1 1 1 4   61  10 o 12 8.03828e+00 8.16071e-01 9.27828e+01 325.403 6.48566e+00  -4.47362e+00 0.00000e+00 0.00000e+00 1.87876e+02 325.403 9.50930e+01 325.403 0.9342 
1 1 1 4   61  11 o 17 7.14130e+00 9.96916e-01 1.68005e+02 211.844 -1.19850e+01 -7.44364e+00 0.00000e+00 0.00000e+00 8.91340e+01 211.844 7.88714e+01 31.844  0.9639 
1 1 1 4   61  12 o 3  3.08139e+00 9.39621e-01 9.49105e+01 339.374 3.48620e+00  -1.31215e+00 0.00000e+00 0.00000e+00 3.11574e+00 339.374 9.17947e+01 159.374 0.8520 
1 1 1 4   61  13 o 1  4.41114e+00 1.23021e+00 8.78233e+01 145.485 -3.87866e+00 2.66719e+00  0.00000e+00 0.00000e+00 5.80292e+01 145.485 2.97941e+01 325.485 0.8861 
1 1 1 4   61  14 o 16 4.45994e+00 1.26523e+00 9.16240e+01 117.608 -2.55767e+00 4.89070e+00  0.00000e+00 0.00000e+00 5.87469e+01 117.608 3.28772e+01 297.608 0.9042 
1 1 1 4   61  15 o 14 7.75956e+00 1.53205e+00 1.35738e+02 151.446 -1.14421e+01 6.22643e+00  0.00000e+00 0.00000e+00 1.42070e+02 151.446 6.33164e+00 151.446 0.9608 
1 1 1 4   61  16 o 16 6.58559e+00 1.67022e+00 1.33430e+02 302.274 5.62576e+00  -8.90785e+00 0.00000e+00 0.00000e+00 9.98264e+01 302.274 3.36038e+01 122.274 0.9513 
1 1 1 4   62  0  o 1  2.36588e+01 4.63129e-01 4.29202e+02 114.034 -1.32780e+01 2.97753e+01  0.00000e+00 0.00000e+00 4.42476e+02 114.034 1.32739e+01 114.034 0.9845 
1 1 1 4   62  1  o 14 2.21409e+01 4.74635e-01 3.29957e+02 38.523  1.89376e+01  1.50760e+01  0.00000e+00 0.00000e+00 4.81411e+02 38.523  1.51454e+02 38.523  0.9791 
1 1 1 4   62  2  o 14 9.33653e+00 5.47470e-01 2.32953e+02 142.326 -6.11954e+00 4.72523e+00  0.00000e+00 0.00000e+00 9.30584e+01 142.326 1.39894e+02 322.326 0.9329 
1 1 1 4   62  3  f 0  1.66788e+01 4.72425e-01 3.50801e+02 224.770 -1.63444e+01 -1.62135e+01 0.00000e+00 0.00000e+00 2.59776e+02 224.770 9.10243e+01 44.770  0.9780 
1 1 1 4   62  4  o 5  1.30265e+01 5.52457e-01 2.30396e+02 72.033  4.07246e+00  1.25584e+01  0.00000e+00 0.00000e+00 2.38315e+02 72.033  7.91860e+00 72.033  0.9613 
1 1 1 4   62  5  o 12 1.13380e+01 6.03415e-01 2.19127e+02 130.884 -7.63211e+00 8.81570e+00  0.00000e+00 0.00000e+00 1.86560e+02 130.884 3.25670e+01 310.884 0.9561 
1 1 1 4   62  6  o 10 1.16650e+01 7.46014e-01 2.04425e+02 39.720  1.03103e+01  8.56581e+00  0.00000e+00 0.00000e+00 2.15436e+02 39.720  1.10113e+01 39.720  0.9619 
1 1 1 4   62  7  o 16 1.03387e+01 7.63225e-01 1.14744e+02 243.279 -3.84539e+00 -7.63883e+00 0.00000e+00 0.00000e+00 2.48641e+02 243.279 1.33897e+02 243.279 0.9396 
1 1 1 4   62  8  o 4  1.67463e+01 7.11841e-01 2.16934e+02 279.371 4.96019e+00  -3.00574e+01 0.00000e+00 0.00000e+00 3.98965e+02 279.371 1.82031e+02 279.371 0.9834 
1 1 1 4   62  9  o 7  9.71159e+00 6.63009e-01 1.64551e+02 87.889  5.62922e-01  1.52713e+01  0.00000e+00 0.00000e+00 1.86419e+02 87.889  2.18678e+01 87.889  0.9667 
1 1 1 4   62  10 o 7  1.26418e+01 6.76806e-01 1.73914e+02 9.987   2.42595e+01  4.27194e+00  0.00000e+00 0.00000e+00 2.88799e+02 9.987   1.14885e+02 9.987   0.9795 
1 1 1 4   62  11 o 6  3.75356e+00 9.62465e-01 7.16753e+01 95.031  -2.87751e-01 3.26850e+00  0.00000e+00 0.00000e+00 4.45195e+01 95.031  2.71558e+01 275.031 0.8288 
1 1 1 4   62  12 o 19 7.26522e+00 1.06836e+00 9.06985e+01 189.236 -8.72290e+00 -1.41845e+00 0.00000e+00 0.00000e+00 1.64674e+02 189.236 7.39751e+01 189.236 0.9416 
1 1 1 4   62  13 o 2  4.98320e+00 1.24117e+00 1.28415e+02 305.898 4.89464e+00  -6.76210e+00 0.00000e+00 0.00000e+00 4.59769e+01 305.898 8.24383e+01 125.898 0.9380 
1 1 1 4   62  14 o 1  1.02240e+01 1.18711e+00 1.63653e+02 14.540  2.16172e+01  5.60686e+00  0.00000e+00 0.00000e+00 2.08891e+02 14.540  4.52378e+01 14.540  0.9773 
1 1 1 4   62  15 o 8  9.74192e+00 1.52363e+00 4.26104e+01 286.334 1.44398e+00  -4.92711e+00 0.00000e+00 0.00000e+00 2.82735e+02 286.334 2.40125e+02 286.334 0.8964 
1 1 1 4   62  16 o 19 4.86130e+00 1.49188e+00 9.47202e+01 323.562 5.28408e+00  -3.90120e+00 0.00000e+00 0.00000e+00 7.18387e+01 323.562 2.28815e+01 143.562 0.9204 
1 1 1 4   63  0  o 4  1.21271e+01 4.30036e-01 1.91063e+02 285.832 2.09094e+00  -7.37329e+00 0.00000e+00 0.00000e+00 2.31950e+02 285.832 4.08872e+01 285.832 0.9323 
1 1 1 4   63  1  o 13 8.50056e+00 4.89721e-01 1.89316e+02 151.225 -5.02965e+00 2.76219e+00  0.00000e+00 0.00000e+00 9.95443e+01 151.225 8.97715e+01 331.225 0.9081 
1 1 1 4   63  2  o 8  2.07042e+01 4.77043e-01 3.24267e+02 283.250 5.32506e+00  -2.26149e+01 0.00000e+00 0.00000e+00 4.33691e+02 283.250 1.09425e+02 283.250 0.9782 
1 1 1 4   63  3  o 2  3.10566e+01 5.76139e-01 6.30750e+02 338.447 7.79003e+01  -3.07689e+01 0.00000e+00 0.00000e+00 5.24541e+02 338.447 1.06209e+02 158.447 0.9940 
1 1 1 4   63  4  o 19 2.47255e+01 5.98015e-01 4.97065e+02 340.729 5.29871e+01  -1.85259e+01 0.00000e+00 0.00000e+00 4.19925e+02 340.729 7.71400e+01 160.729 0.9911 
1 1 1 4   63  5  o 14 1.63811e+01 5.68142e-01 2.96111e+02 211.028 -2.25765e+01 -1.35804e+01 0.00000e+00 0.00000e+00 3.05078e+02 211.028 8.96655e+00 211.028 0.9808 
1 1 1 4   63  6  o 13 2.13741e+01 6.58705e-01 2.82078e+02 68.225  1.35285e+01  3.38659e+01  0.00000e+00 0.00000e+00 5.06503e+02 68.225  2.24424e+02 68.225  0.9862 
1 1 1 4   63  7  o 6  7.54516e+00 9.09653e-01 9.71953e+01 208.280 -4.51961e+00 -2.43149e+00 0.00000e+00 0.00000e+00 1.55761e+02 208.280 5.85659e+01 208.280 0.8964 
1 1 1 4   63  8  o 1  8.39016e+00 9.09179e-01 7.45897e+01 148.491 -4.30106e+00 2.63663e+00  0.00000e+00 0.00000e+00 2.06002e+02 148.491 1.31412e+02 148.491 0.8944 
1 1 1 4   63  9  o 19 8.86099e+00 7.15310e-01 1.58289e+02 287.012 4.28740e+00  -1.40125e+01 0.00000e+00 0.00000e+00 1.61404e+02 287.012 3.11443e+00 287.012 0.9653 
1 1 1 4   63  10 o 19 4.62837e+00 9.94879e-01 7.82938e+01 319.643 2.90208e+00  -2.46615e+00 0.00000e+00 0.00000e+00 6.96827e+01 319.643 8.61114e+00 139.643 0.8557 
1 1 1 4   63  11 o 2  9.18785e+00 8.54184e-01 2.04496e+02 237.696 -1.28701e+01 -2.03556e+01 0.00000e+00 0.00000e+00 1.31414e+02 237.696 7.30820e+01 57.696  0.9790 
1 1 1 4   63  12 o 1  5.70527e+00 1.14925e+00 1.54112e+02 306.646 6.63161e+00  -8.91442e+00 0.00000e+00 0.00000e+00 4.90091e+01 306.646 1.05103e+02 126.646 0.9539 
1 1 1 4   63  13 o 2  4.68266e+00 1.18073e+00 8.22435e+01 147.173 -4.43554e+00 2.86143e+00  0.00000e+00 0.00000e+00 7.48649e+01 147.173 7.37859e+00 327.173 0.8995 
1 1 1 4   63  14 o 4  4.39778e+00 1.28652e+00 9.45320e+01 119.691 -2.74627e+00 4.81640e+00  0.00000e+00 0.00000e+00 5.37696e+01 119.691 4.07624e+01 299.691 0.9046 
1 1 1 4   63  15 f 0  4.42036e+00 1.33975e+00 6.25330e+01 3.832   4.09050e+00  2.74000e-01  0.00000e+00 0.00000e+00 8.02645e+01 3.832   1.77315e+01 3.832   0.8672 
1 1 1 4   63  16 o 9  8.15093e+00 1.66629e+00 9.43636e+01 133.807 -6.85658e+00 7.14820e+00  0.00000e+00 0.00000e+00 1.93268e+02 133.807 9.89041e+01 133.807 0.9481 
1 1 1 4   64  0  o 10 1.15939e+01 4.37957e-01 1.48125e+02 28.735  5.22938e+00  2.86721e+00  0.00000e+00 0.00000e+00 2.47337e+02 28.735  9.92116e+01 28.735  0.9118 
1 1 1 4   64  1  o 17 1.06510e+01 4.55635e-01 9.89783e+01 298.297 1.97127e+00  -3.66154e+00 0.00000e+00 0.00000e+00 2.47456e+02 298.297 1.48477e+02 298.297 0.8693 
1 1 1 4   64  2  o 17 1.80403e+01 4.61522e-01 2.58596e+02 145.458 -1.66292e+01 1.14468e+01  0.00000e+00 0.00000e+00 3.99476e+02 145.458 1.40881e+02 145.458 0.9749 
1 1 1 4   64  3  o 2  1.77128e+01 4.73807e-01 2.17509e+02 224.446 -1.21699e+01 -1.19367e+01 0.00000e+00 0.00000e+00 4.25509e+02 224.446 2.08000e+02 224.446 0.9702 
1 1 1 4   64  4  o 18 1.82094e+01 5.62633e-01 2.33899e+02 118.296 -9.54078e+00 1.77221e+01  0.00000e+00 0.00000e+00 4.30259e+02 118.296 1.96360e+02 118.296 0.9748 
1 1 1 4   64  5  o 15 1.29565e+01 5.71590e-01 1.53147e+02 330.755 1.03102e+01  -5.77288e+00 0.00000e+00 0.00000e+00 3.10580e+02 330.755 1.57433e+02 330.755 0.9567 
1 1 1 4   64  6  o 17 1.12770e+01 7.12685e-01 2.29561e+02 49.030  1.13773e+01  1.31018e+01  0.00000e+00 0.00000e+00 1.79906e+02 49.030  4.96557e+01 229.030 0.9707 
1 1 1 4   64  7  o 5  5.38157e+00 1.03620e+00 5.64565e+01 245.714 -8.73926e-01 -1.93675e+00 0.00000e+00 0.00000e+00 8.78855e+01 245.714 3.14290e+01 245.714 0.7172 
1 1 1 4   64  8  o 7  1.44566e+01 5.63704e-01 2.68600e+02 201.061 -3.32480e+01 -1.28035e+01 0.00000e+00 0.00000e+00 2.64212e+02 201.061 4.38833e+00 21.061  0.9859 
1 1 1 4   64  9  o 7  1.07823e+01 6.45275e-01 1.29576e+02 67.576  5.56105e+00  1.34760e+01  0.00000e+00 0.00000e+00 2.59295e+02 67.576  1.29719e+02 67.576  0.9651 
1 1 1 4   64  10 f 0  1.02852e+01 7.13870e-01 1.79001e+02 41.386  1.76550e+01  1.55572e+01  0.00000e+00 0.00000e+00 1.96952e+02 41.386  1.79516e+01 41.386  0.9785 
1 1 1 4   64  11 o 6  4.58622e+00 1.07189e+00 8.71268e+01 237.807 -2.44708e+00 -3.88701e+00 0.00000e+00 0.00000e+00 6.40770e+01 237.807 2.30498e+01 57.807  0.8830 
1 1 1 4   64  12 o 9  7.75574e+00 1.05770e+00 2.29121e+02 127.788 -1.43307e+01 1.84832e+01  0.00000e+00 0.00000e+00 5.40447e+01 127.788 1.75077e+02 307.788 0.9784 
1 1 1 4   64  13 o 5  3.88915e+00 1.09619e+00 8.85104e+01 309.740 3.15832e+00  -3.79877e+00 0.00000e+00 0.00000e+00 4.08662e+01 309.740 4.76442e+01 129.740 0.8920 
1 1 1 4   64  14 o 12 1.02643e+01 1.20789e+00 1.40352e+02 282.673 4.62353e+00  -2.05607e+01 0.00000e+00 0.00000e+00 2.33007e+02 282.673 9.26554e+01 282.673 0.9760 
1 1 1 4   64  15 o 14 5.51041e+00 1.49469e+00 3.98305e+01 23.160  2.58003e+00  1.10368e+00  0.00000e+00 0.00000e+00 1.23234e+02 23.160  8.34037e+01 23.160  0.7946 
1 1 1 4   64  16 o 18 4.46335e+00 1.39711e+00 3.77870e+01 2.367   2.70872e+00  1.11988e-01  0.00000e+00 0.00000e+00 9.27869e+01 2.367   5.49999e+01 2.367   0.7861 
1 1 1 4   65  0  o 4  1.51914e+01 4.28516e-01 2.73862e+02 192.638 -1.59763e+01 -3.58218e+00 0.00000e+00 0.00000e+00 2.76702e+02 192.638 2.83970e+00 192.638 0.9690 
1 1 1 4   65  1  o 19 4.70363e+00 6.63660e-01 1.92161e+02 132.855 -2.60939e+00 2.81244e+00  0.00000e+00 0.00000e+00 4.13838e+01 312.855 2.33545e+02 312.855 0.8569 
1 1 1 4   65  2  o 2  5.78279e+00 6.76360e-01 5.47142e+01 247.499 -5.09855e-01 -1.23085e+00 0.00000e+00 0.00000e+00 6.46712e+01 247.499 9.95697e+00 247.499 0.5519 
1 1 1 4   65  3  o 18 3.94632e+01 7.40137e-01 7.08529e+02 194.383 -1.21585e+02 -3.11791e+01 0.00000e+00 0.00000e+00 7.61914e+02 194.383 5.33852e+01 194.383 0.9960 
1 1 1 4   65  4  o 15 4.03457e+01 7.99033e-01 7.53989e+02 350.124 1.47013e+02  -2.55954e+01 0.00000e+00 0.00000e+00 7.50217e+02 350.124 3.77183e+00 170.124 0.9966 
1 1 1 4   65  5  o 13 1.22588e+01 5.88748e-01 2.91111e+02 113.721 -8.24481e+00 1.87638e+01  0.00000e+00 0.00000e+00 1.56090e+02 113.721 1.35020e+02 293.721 0.9753 
1 1 1 4   65  6  o 19 1.22593e+01 6.82315e-01 1.80268e+02 8.403   1.51765e+01  2.24177e+00  0.00000e+00 0.00000e+00 2.62998e+02 8.403   8.27299e+01 8.403   0.9668 
1 1 1 4   65  7  o 15 6.70434e+00 9.61705e-01 8.25366e+01 20.895  3.95687e+00  1.51056e+00  0.00000e+00 0.00000e+00 1.36046e+02 20.895  5.35093e+01 20.895  0.8720 
1 1 1 4   65  8  o 9  1.17380e+01 6.02704e-01 2.51890e+02 152.450 -2.38002e+01 1.24159e+01  0.00000e+00 0.00000e+00 1.78598e+02 152.450 7.32925e+01 332.450 0.9812 
1 1 1 4   65  9  o 7  6.12106e+00 9.04461e-01 1.00359e+02 253.032 -1.74967e+00 -5.73441e+00 0.00000e+00 0.00000e+00 1.08290e+02 253.032 7.93124e+00 253.032 0.9123 
1 1 1 4   65  10 o 5  7.00232e+00 8.35635e-01 1.01363e+02 286.066 2.39342e+00  -8.31051e+00 0.00000e+00 0.00000e+00 1.44544e+02 286.066 4.31809e+01 286.066 0.9403 
1 1 1 4   65  11 o 15 5.40015e+00 1.06787e+00 7.00601e+01 273.039 2.37735e-01  -4.47776e+00 0.00000e+00 0.00000e+00 1.07313e+02 273.039 3.72526e+01 273.039 0.8799 
1 1 1 4   65  12 o 5  5.45537e+00 1.09790e+00 1.63536e+02 75.258  2.93994e+00  1.11734e+01  0.00000e+00 0.00000e+00 3.09885e+01 75.258  1.32548e+02 255.258 0.9557 
1 1 1 4   65  13 o 5  4.01244e+00 1.15852e+00 7.17526e+01 324.775 3.16180e+00  -2.23245e+00 0.00000e+00 0.00000e+00 5.66709e+01 324.775 1.50817e+01 144.775 0.8584 
1 1 1 4   65  14 o 2  4.16349e+00 1.25748e+00 8.10248e+01 111.440 -1.70311e+00 4.33688e+00  0.00000e+00 0.00000e+00 5.62533e+01 111.440 2.47715e+01 291.440 0.8848 
1 1 1 4   65  15 o 19 5.30651e+00 1.41921e+00 1.40398e+02 78.128  2.16288e+00  1.02883e+01  0.00000e+00 0.00000e+00 4.75507e+01 78.128  9.28477e+01 258.128 0.9512 
1 1 1 4   65  16 o 6  3.93891e+00 1.29185e+00 6.20653e+01 322.734 3.38710e+00  -2.57712e+00 0.00000e+00 0.00000e+00 6.58327e+01 322.734 3.76734e+00 322.734 0.8727 
1 1 1 4   66  0  o 18 1.00149e+01 4.45038e-01 1.81875e+02 250.494 -2.61757e+00 -7.38950e+00 0.00000e+00 0.00000e+00 1.67868e+02 250.494 1.40065e+01 70.494  0.9339 
1 1 1 4   66  1  o 1  1.49035e+01 4.42214e-01 2.27019e+02 20.192  1.40965e+01  5.18435e+00  0.00000e+00 0.00000e+00 3.11497e+02 20.192  8.44776e+01 20.192  0.9661 
1 1 1 4   66  2  o 16 1.17678e+01 4.78758e-01 2.18242e+02 306.457 7.05529e+00  -9.54971e+00 0.00000e+00 0.00000e+00 2.02951e+02 306.457 1.52905e+01 126.457 0.9569 
1 1 1 4   66  3  o 14 2.99346e+01 6.50939e-01 4.67384e+02 128.997 -4.11567e+01 5.08296e+01  0.00000e+00 0.00000e+00 6.43690e+02 128.997 1.76306e+02 128.997 0.9923 
1 1 1 4   66  4  o 8  1.69382e+01 5.51485e-01 3.02988e+02 348.757 3.01041e+01  -5.98402e+00 0.00000e+00 0.00000e+00 3.20124e+02 348.757 1.71361e+01 348.757 0.9836 
1 1 1 4   66  5  o 4  2.25487e+01 6.36594e-01 3.23952e+02 71.313  1.41840e+01  4.19367e+01  0.00000e+00 0.00000e+00 5.09736e+02 71.313  1.85784e+02 71.313  0.9886 
1 1 1 4   66  6  o 7  1.03881e+01 7.26760e-01 1.53642e+02 45.638  8.13742e+00  8.32066e+00  0.00000e+00 0.00000e+00 2.17699e+02 45.638  6.40564e+01 45.638  0.9560 
1 1 1 4   66  7  o 18 1.70773e+01 5.39540e-01 2.98796e+02 204.257 -4.03315e+01 -1.81738e+01 0.00000e+00 0.00000e+00 3.32335e+02 204.257 3.35392e+01 204.257 0.9886 
1 1 1 4   66  8  f 0  6.92158e+00 7.35552e-01 5.16013e+01 255.427 -8.44704e-01 -3.24908e+00 0.00000e+00 0.00000e+00 1.63940e+02 255.427 1.12338e+02 255.427 0.8333 
1 1 1 4   66  9  o 1  8.87695e+00 7.08919e-01 1.62030e+02 267.601 -6.56801e-01 -1.56753e+01 0.00000e+00 0.00000e+00 1.58843e+02 267.601 3.18662e+00 87.601  0.9676 
1 1 1 4   66  10 o 6  2.70658e+00 8.50969e-01 4.67087e+01 316.198 1.14153e+00  -1.09475e+00 0.00000e+00 0.00000e+00 1.55169e+01 316.198 3.11918e+01 136.198 0.6157 
1 1 1 4   66  11 o 1  7.53425e+00 9.39420e-01 1.06154e+02 89.527  8.54663e-02  1.03565e+01  0.00000e+00 0.00000e+00 1.61113e+02 89.527  5.49593e+01 89.527  0.9504 
1 1 1 4   66  12 o 10 5.35190e+00 1.16464e+00 1.19162e+02 280.674 1.52531e+00  -8.09265e+00 0.00000e+00 0.00000e+00 6.79389e+01 280.674 5.12230e+01 100.674 0.9372 
1 1 1 4   66  13 o 3  6.57033e+00 1.25416e+00 1.23851e+02 223.988 -7.92870e+00 -7.65340e+00 0.00000e+00 0.00000e+00 1.09707e+02 223.988 1.41449e+01 43.988  0.9535 
1 1 1 4   66  14 o 1  4.44624e+00 1.20730e+00 8.87191e+01 83.089  6.86315e-01  5.66249e+00  0.00000e+00 0.00000e+00 6.16100e+01 83.089  2.71091e+01 263.089 0.9075 
1 1 1 4   66  15 o 9  6.56592e+00 1.58734e+00 1.30877e+02 225.799 -7.41431e+00 -7.62413e+00 0.00000e+00 0.00000e+00 1.01777e+02 225.799 2.90993e+01 45.799  0.9518 
1 1 1 4   66  16 o 3  3.44130e+00 1.17587e+00 2.94542e+01 289.039 6.28348e-01  -1.82080e+00 0.00000e+00 0.00000e+00 5.82725e+01 289.039 2.88182e+01 289.039 0.6853 
1 1 1 4   67  0  o 8  1.40633e+01 4.28983e-01 1.63303e+02 161.000 -1.00908e+01 3.47446e+00  0.00000e+00 0.00000e+00 3.37235e+02 161.000 1.73933e+02 161.000 0.9519 
1 1 1 4   67  1  o 15 1.81057e+01 4.47881e-01 2.84525e+02 83.095  2.86628e+00  2.36700e+01  0.00000e+00 0.00000e+00 3.78166e+02 83.095  9.36412e+01 83.095  0.9788 
1 1 1 4   67  2  o 5  1.30785e+01 4.67360e-01 2.11179e+02 332.201 1.16560e+01  -6.14529e+00 0.00000e+00 0.00000e+00 2.58969e+02 332.201 4.77899e+01 332.201 0.9613 
1 1 1 4   67  3  o 19 9.30056e+00 6.02856e-01 1.84039e+02 318.943 6.98579e+00  -6.08477e+00 0.00000e+00 0.00000e+00 1.44428e+02 318.943 3.96114e+01 138.943 0.9444 
1 1 1 4   67  4  o 6  1.89846e+01 5.59891e-01 3.83331e+02 207.668 -3.68103e+01 -1.92994e+01 0.00000e+00 0.00000e+00 3.18004e+02 207.668 6.53271e+01 27.668  0.9879 
1 1 1 4   67  5  o 17 1.43056e+01 6.28945e-01 2.79194e+02 256.108 -6.50988e+00 -2.63205e+01 0.00000e+00 0.00000e+00 2.45746e+02 256.108 3.34480e+01 76.108  0.9814 
1 1 1 4   67  6  o 2  8.82898e+00 7.54835e-01 1.85651e+02 192.049 -1.13675e+01 -2.42648e+00 0.00000e+00 0.00000e+00 1.29879e+02 192.049 5.57714e+01 12.049  0.9560 
1 1 1 4   67  7  o 12 1.54675e+01 5.44395e-01 3.13681e+02 220.036 -3.25013e+01 -2.73066e+01 0.00000e+00 0.00000e+00 2.57571e+02 220.036 5.61103e+01 40.036  0.9882 
1 1 1 4   67  8  o 9  9.06555e+00 6.64851e-01 1.73544e+02 50.917  9.47666e+00  1.16679e+01  0.00000e+00 0.00000e+00 1.53715e+02 50.917  1.98290e+01 230.917 0.9661 
1 1 1 4   67  9  o 16 1.64162e+01 5.99317e-01 2.16461e+02 211.165 -3.47477e+01 -2.10153e+01 0.00000e+00 0.00000e+00 3.89102e+02 211.165 1.72641e+02 211.165 0.9876 
1 1 1 4   67  10 o 11 7.95810e+00 7.99707e-01 1.12804e+02 155.781 -1.00061e+01 4.50101e+00  0.00000e+00 0.00000e+00 1.70432e+02 155.781 5.76280e+01 155.781 0.9533 
1 1 1 4   67  11 o 3  8.36409e+00 9.17775e-01 7.71661e+01 188.588 -8.20199e+00 -1.23870e+00 0.00000e+00 0.00000e+00 2.15492e+02 188.588 1.38326e+02 188.588 0.9376 
1 1 1 4   67  12 o 1  3.75581e+00 1.07455e+00 5.85583e+01 249.705 -1.07925e+00 -2.91838e+00 0.00000e+00 0.00000e+00 5.60144e+01 249.705 2.54388e+00 69.705  0.8179 
1 1 1 4   67  13 o 11 7.24964e+00 1.26930e+00 1.09317e+02 11.812  1.02821e+01  2.15020e+00  0.00000e+00 0.00000e+00 1.47707e+02 11.812  3.83897e+01 11.812  0.9511 
1 1 1 4   67  14 o 19 5.60420e+00 1.32152e+00 8.24624e+01 126.701 -3.78968e+00 5.08399e+00  0.00000e+00 0.00000e+00 1.09040e+02 126.701 2.65780e+01 126.701 0.9174 
1 1 1 4   67  15 o 15 9.88025e+00 1.44282e+00 1.20913e+02 358.620 1.62727e+01  -3.92047e-01 0.00000e+00 0.00000e+00 2.35377e+02 358.620 1.14464e+02 358.620 0.9688 
1 1 1 4   67  16 o 19 3.58536e+00 1.21537e+00 7.30360e+00 348.390 4.67933e-01  -9.61415e-02 0.00000e+00 0.00000e+00 2.36728e+01 348.390 1.63692e+01 348.390 0.2323 
1 1 1 4   68  0  f 0  1.89327e+01 4.39666e-01 3.19911e+02 294.240 1.21513e+01  -2.69872e+01 0.00000e+00 0.00000e+00 3.75773e+02 294.240 5.58626e+01 294.240 0.9830 
1 1 1 4   68  1  o 8  7.25742e+00 5.58664e-01 1.41842e+02 340.792 4.59250e+00  -1.59999e+00 0.00000e+00 0.00000e+00 9.96755e+01 340.792 4.21663e+01 160.792 0.8901 
1 1 1 4   68  2  o 15 1.83023e+01 5.30914e-01 3.80036e+02 358.135 3.52742e+01  -1.14845e+00 0.00000e+00 0.00000e+00 2.94514e+02 358.135 8.55224e+01 178.135 0.9857 
1 1 1 4   68  3  o 13 1.63195e+01 5.38758e-01 2.59639e+02 199.752 -2.38490e+01 -8.56372e+00 0.00000e+00 0.00000e+00 3.38383e+02 199.752 7.87440e+01 199.752 0.9801 
1 1 1 4   68  4  f 0  1.88492e+01 5.62600e-01 3.95559e+02 30.476  3.93958e+01  2.31839e+01  0.00000e+00 0.00000e+00 3.01425e+02 30.476  9.41334e+01 210.476 0.9890 
1 1 1 4   68  5  o 8  2.75836e+01 6.89414e-01 5.24428e+02 327.643 8.93966e+01  -5.66392e+01 0.00000e+00 0.00000e+00 5.01868e+02 327.643 2.25597e+01 147.643 0.9953 
1 1 1 4   68  6  o 19 4.54114e+00 9.25574e-01 1.39736e+02 74.101  1.34516e+00  4.72265e+00  0.00000e+00 0.00000e+00 1.15429e+01 74.101  1.28193e+02 254.101 0.8913 
1 1 1 4   68  7  o 18 8.79252e+00 6.20063e-01 1.67864e+02 180.885 -1.33683e+01 -2.06471e-01 0.00000e+00 0.00000e+00 1.48162e+02 180.885 1.97022e+01 0.885   0.9618 
1 1 1 4   68  8  o 3  4.30204e+00 8.22249e-01 1.68913e+02 144.525 -5.88084e+00 4.19095e+00  0.00000e+00 0.00000e+00 1.97833e+01 324.525 1.88696e+02 324.525 0.9279 
1 1 1 4   68  9  o 5  6.93280e+00 8.52198e-01 1.49301e+02 115.566 -4.94410e+00 1.03348e+01  0.00000e+00 0.00000e+00 9.80258e+01 115.566 5.12756e+01 295.566 0.9553 
1 1 1 4   68  10 o 18 2.39203e+00 7.61181e-01 6.72910e+01 275.876 2.19140e-01  -2.12934e+00 0.00000e+00 0.00000e+00 3.04090e+00 95.876  7.03319e+01 95.876  0.7196 
1 1 1 4   68  11 o 10 3.02405e+00 9.35908e-01 6.92826e+01 269.157 -4.32724e-02 -2.94157e+00 0.00000e+00 0.00000e+00 2.16114e+01 269.157 4.76712e+01 89.157  0.8056 
1 1 1 4   68  12 o 9  3.57115e+00 1.05787e+00 1.01923e+02 168.517 -5.18692e+00 1.05367e+00  0.00000e+00 0.00000e+00 1.78963e+01 168.517 8.40271e+01 348.517 0.8998 
1 1 1 4   68  13 o 2  6.72303e+00 1.24981e+00 9.20638e+01 301.044 4.35070e+00  -7.22821e+00 0.00000e+00 0.00000e+00 1.43134e+02 301.044 5.10698e+01 301.044 0.9387 
1 1 1 4   68  14 o 19 6.12189e+00 1.34194e+00 1.12157e+02 142.560 -7.71801e+00 5.90938e+00  0.00000e+00 0.00000e+00 1.03774e+02 142.560 8.38348e+00 322.560 0.9471 
1 1 1 4   68  15 o 10 6.32516e+00 1.51440e+00 8.60300e+01 347.867 7.17516e+00  -1.54255e+00 0.00000e+00 0.00000e+00 1.32686e+02 347.867 4.66557e+01 347.867 0.9291 
1 1 1 4   69  0  o 18 1.38721e+01 5.00597e-01 2.22778e+02 180.694 -1.57443e+01 -1.90666e-01 0.00000e+00 0.00000e+00 2.78950e+02 180.694 5.61719e+01 180.694 0.9677 
1 1 1 4   69  1  o 10 2.05003e+01 4.64270e-01 4.04654e+02 76.242  1.00570e+01  4.10733e+01  0.00000e+00 0.00000e+00 3.52532e+02 76.242  5.21224e+01 256.241 0.9881 
1 1 1 4   69  2  o 4  1.49414e+01 5.20462e-01 1.95537e+02 73.604  4.95079e+00  1.68255e+01  0.00000e+00 0.00000e+00 3.46848e+02 73.604  1.51312e+02 73.604  0.9711 
1 1 1 4   69  3  o 10 1.25263e+01 5.44436e-01 1.78223e+02 348.341 1.26215e+01  -2.60433e+00 0.00000e+00 0.00000e+00 2.71496e+02 348.341 9.32735e+01 348.341 0.9604 
1 1 1 4   69  4  o 17 1.96174e+01 6.05546e-01 3.13034e+02 161.987 -3.98361e+01 1.29538e+01  0.00000e+00 0.00000e+00 4.11479e+02 161.987 9.84451e+01 161.987 0.9880 
1 1 1 4   69  5  f 0  9.77996e+00 7.90401e-01 2.34479e+02 120.570 -8.38094e+00 1.41886e+01  0.00000e+00 0.00000e+00 1.19793e+02 120.570 1.14686e+02 300.570 0.9692 
1 1 1 4   69  6  o 2  6.63426e+00 6.80494e-01 1.76251e+02 232.104 -6.06210e+00 -7.78826e+00 0.00000e+00 0.00000e+00 5.87554e+01 232.104 1.17496e+02 52.104  0.9479 
1 1 1 4   69  7  o 11 5.19324e+00 8.25308e-01 1.28371e+02 196.668 -5.79762e+00 -1.73584e+00 0.00000e+00 0.00000e+00 4.88061e+01 196.668 7.95649e+01 16.668  0.9132 
1 1 1 4   69  8  o 16 5.11441e+00 9.19775e-01 4.28216e+01 290.483 7.68333e-01  -2.05685e+00 0.00000e+00 0.00000e+00 9.61349e+01 290.483 5.33134e+01 290.483 0.7274 
1 1 1 4   69  9  o 1  1.27536e+01 6.29540e-01 1.75266e+02 336.435 2.68752e+01  -1.17222e+01 0.00000e+00 0.00000e+00 2.92723e+02 336.435 1.17457e+02 336.435 0.9828 
1 1 1 4   69  10 o 1  1.00059e+01 7.60095e-01 2.27620e+02 252.649 -9.35684e+00 -2.99469e+01 0.00000e+00 0.00000e+00 1.39812e+02 252.649 8.78081e+01 72.649  0.9839 
1 1 1 4   69  11 o 8  7.65896e+00 9.65998e-01 1.45748e+02 152.836 -1.37955e+01 7.07909e+00  0.00000e+00 0.00000e+00 1.30585e+02 152.836 1.51635e+01 332.836 0.9672 
1 1 1 4   69  12 o 4  4.70949e+00 1.14830e+00 9.47801e+01 343.208 5.58604e+00  -1.68571e+00 0.00000e+00 0.00000e+00 6.49520e+01 343.208 2.98281e+01 163.208 0.9097 
1 1 1 4   69  13 o 1  5.85852e+00 1.23933e+00 9.55304e+01 107.950 -2.39936e+00 7.40626e+00  0.00000e+00 0.00000e+00 1.08218e+02 107.950 1.26875e+01 107.950 0.9334 
1 1 1 4   69  14 o 4  4.53039e+00 1.30548e+00 9.88538e+01 111.255 -2.34180e+00 6.02030e+00  0.00000e+00 0.00000e+00 5.61684e+01 111.255 4.26854e+01 291.255 0.9190 
1 1 1 4   69  15 o 19 3.81115e+00 1.22934e+00 7.11800e+01 355.809 4.53550e+00  -3.32342e-01 0.00000e+00 0.00000e+00 5.38554e+01 355.809 1.73246e+01 175.809 0.8817 
1 1 1 4   70  0  o 10 9.74966e+00 6.01489e-01 1.05490e+02 238.530 -2.89426e+00 -4.72865e+00 0.00000e+00 0.00000e+00 2.24094e+02 238.530 1.18604e+02 238.530 0.9046 
1 1 1 4   70  1  o 3  5.06084e+00 8.01244e-01 5.46873e+01 27.894  1.40775e+00  7.45182e-01  0.00000e+00 0.00000e+00 6.22484e+01 27.894  7.56117e+00 27.894  0.6183 
1 1 1 4   70  2  o 9  8.50122e+00 5.85987e-01 1.53966e+02 254.945 -1.93518e+00 -7.19431e+00 0.00000e+00 0.00000e+00 1.41606e+02 254.945 1.23600e+01 74.945  0.9302 
1 1 1 4   70  3  o 18 6.89302e+00 6.76814e-01 9.85525e+01 282.111 8.58183e-01  -3.99921e+00 0.00000e+00 0.00000e+00 1.24790e+02 282.111 2.62380e+01 282.111 0.8669 
1 1 1 4   70  4  o 15 6.82022e+00 8.03831e-01 1.16161e+02 311.206 3.53743e+00  -4.03992e+00 0.00000e+00 0.00000e+00 1.13581e+02 311.206 2.58010e+00 131.206 0.9013 
1 1 1 4   70  5  o 9  1.65394e+01 6.23406e-01 3.70661e+02 199.844 -4.42572e+01 -1.59719e+01 0.00000e+00 0.00000e+00 2.40805e+02 199.844 1.29856e+02 19.844  0.9893 
1 1 1 4   70  6  o 11 1.53932e+01 5.11201e-01 2.73991e+02 106.750 -1.07003e+01 3.55543e+01  0.00000e+00 0.00000e+00 2.93349e+02 106.750 1.93585e+01 106.750 0.9864 
1 1 1 4   70  7  o 12 1.14588e+01 5.72125e-01 2.04374e+02 332.454 2.02458e+01  -1.05599e+01 0.00000e+00 0.00000e+00 2.14182e+02 332.454 9.80858e+00 332.454 0.9779 
1 1 1 4   70  8  o 1  5.85725e+00 8.18923e-01 1.50840e+02 131.248 -6.14405e+00 7.00653e+00  0.00000e+00 0.00000e+00 5.57963e+01 131.248 9.50440e+01 311.248 0.9447 
1 1 1 4   70  9  o 12 5.72762e+00 9.18193e-01 1.31619e+02 285.532 2.25647e+00  -8.11908e+00 0.00000e+00 0.00000e+00 6.90734e+01 285.532 6.25456e+01 105.532 0.9386 
1 1 1 4   70  10 o 1  5.01074e+00 9.63896e-01 8.99857e+01 160.605 -5.28766e+00 1.86157e+00  0.00000e+00 0.00000e+00 7.93663e+01 160.605 1.06195e+01 340.605 0.9058 
1 1 1 4   70  11 o 5  3.88067e+00 1.08053e+00 1.06152e+02 138.672 -4.04115e+00 3.55380e+00  0.00000e+00 0.00000e+00 2.43310e+01 138.672 8.18215e+01 318.672 0.9015 
1 1 1 4   70  12 o 12 4.07908e+00 1.11625e+00 8.86133e+01 51.369  3.20044e+00  4.00474e+00  0.00000e+00 0.00000e+00 4.76613e+01 51.369  4.09519e+01 231.369 0.8962 
1 1 1 4   70  13 o 17 5.60962e+00 1.31907e+00 8.69414e+01 193.083 -6.46209e+00 -1.50178e+00 0.00000e+00 0.00000e+00 1.05571e+02 193.083 1.86296e+01 193.083 0.9212 
1 1 1 4   70  14 o 1  4.71592e+00 1.21999e+00 7.34888e+01 266.406 -3.52089e-01 -5.60499e+00 0.00000e+00 0.00000e+00 8.55670e+01 266.406 1.20782e+01 266.406 0.9059 
1 1 1 4   70  15 o 2  4.54811e+00 1.37016e+00 1.01067e+02 89.580  5.39051e-02  7.35547e+00  0.00000e+00 0.00000e+00 5.61700e+01 89.580  4.48965e+01 269.580 0.9293 
1 1 1 4   71  0  o 8  1.70513e+01 5.12528e-01 2.83108e+02 278.833 4.25883e+00  -2.74066e+01 0.00000e+00 0.00000e+00 3.42352e+02 278.833 5.92439e+01 278.833 0.9818 
1 1 1 4   71  1  o 16 1.54992e+01 6.29823e-01 2.79353e+02 170.194 -2.43634e+01 4.21090e+00  0.00000e+00 0.00000e+00 2.87949e+02 170.194 8.59597e+00 170.194 0.9796 
1 1 1 4   71  2  o 10 1.51851e+01 6.90729e-01 1.91573e+02 89.390  1.86467e-01  1.75025e+01  0.00000e+00 0.00000e+00 3.59414e+02 89.390  1.67841e+02 89.390  0.9710 
1 1 1 4   71  3  o 11 9.42247e+00 5.45631e-01 1.94980e+02 202.018 -1.16963e+01 -4.72993e+00 0.00000e+00 0.00000e+00 1.42869e+02 202.018 5.21102e+01 22.018  0.9595 
1 1 1 4   71  4  o 2  8.89290e+00 6.88190e-01 1.77898e+02 342.430 1.10686e+01  -3.50468e+00 0.00000e+00 0.00000e+00 1.39750e+02 342.430 3.81475e+01 162.430 0.9559 
1 1 1 4   71  5  o 7  7.64061e+00 8.25566e-01 7.87834e+01 220.296 -3.45120e+00 -2.92645e+00 0.00000e+00 0.00000e+00 1.72734e+02 220.296 9.39506e+01 220.296 0.8811 
1 1 1 4   71  6  o 18 1.96657e+01 5.25082e-01 3.11316e+02 93.213  -3.16678e+00 5.64159e+01  0.00000e+00 0.00000e+00 4.16785e+02 93.213  1.05469e+02 93.213  0.9911 
1 1 1 4   71  7  o 6  1.57601e+01 5.49120e-01 2.47262e+02 16.522  4.06429e+01  1.20560e+01  0.00000e+00 0.00000e+00 3.34346e+02 16.522  8.70835e+01 16.522  0.9881 
1 1 1 4   71  8  f 0  6.12078e+00 8.50375e-01 5.02032e+01 46.341  2.24920e+00  2.35706e+00  0.00000e+00 0.00000e+00 1.38876e+02 46.341  8.86728e+01 46.341  0.8274 
1 1 1 4   71  9  o 4  1.22681e+01 6.51252e-01 2.46767e+02 180.665 -4.06431e+01 -4.72029e-01 0.00000e+00 0.00000e+00 2.05441e+02 180.665 4.13259e+01 0.665   0.9876 
1 1 1 4   71  10 o 3  1.09618e+01 8.93541e-01 1.58492e+02 81.914  3.22932e+00  2.27293e+01  0.00000e+00 0.00000e+00 2.41451e+02 81.914  8.29596e+01 81.914  0.9780 
1 1 1 4   71  11 o 9  1.60083e+01 8.25395e-01 2.96137e+02 195.993 -7.03501e+01 -2.01627e+01 0.00000e+00 0.00000e+00 2.96704e+02 195.993 5.67032e-01 195.993 0.9931 
1 1 1 4   71  12 o 17 3.36322e+00 1.02373e+00 6.04986e+01 342.149 2.80999e+00  -9.04936e-01 0.00000e+00 0.00000e+00 4.05759e+01 342.149 1.99226e+01 162.149 0.8064 
1 1 1 4   71  13 o 16 1.17869e+01 1.02613e+00 1.93488e+02 39.332  2.67621e+01  2.19298e+01  0.00000e+00 0.00000e+00 2.39141e+02 39.332  4.56532e+01 39.332  0.9854 
1 1 1 4   71  14 o 11 4.51569e+00 1.23036e+00 3.64045e+01 148.210 -2.14518e+00 1.32954e+00  0.00000e+00 0.00000e+00 9.26079e+01 148.210 5.62035e+01 148.210 0.7676 
1 1 1 4   71  15 o 9  4.19101e+00 1.26247e+00 3.27687e+01 79.277  4.60427e-01  2.43141e+00  0.00000e+00 0.00000e+00 8.60470e+01 79.277  5.32783e+01 79.277  0.7622 
1 1 1 4   72  0  o 4  1.98907e+01 5.33567e-01 2.41888e+02 294.745 1.23919e+01  -2.68869e+01 0.00000e+00 0.00000e+00 4.88441e+02 294.745 2.46553e+02 294.745 0.9830 
1 1 1 4   72  1  o 5  2.00943e+01 6.56313e-01 3.78669e+02 167.467 -4.48526e+01 9.97056e+00  0.00000e+00 0.00000e+00 3.63808e+02 167.467 1.48602e+01 347.467 0.9891 
1 1 1 4   72  2  o 10 2.93069e+01 8.32851e-01 5.45716e+02 331.382 9.18671e+01  -5.01241e+01 0.00000e+00 0.00000e+00 5.43975e+02 331.382 1.74048e+00 151.382 0.9952 
1 1 1 4   72  3  o 4  9.27163e+00 9.86159e-01 1.83597e+02 277.376 1.49527e+00  -1.15509e+01 0.00000e+00 0.00000e+00 1.47582e+02 277.376 3.60154e+01 97.376  0.9561 
1 1 1 4   72  4  o 13 7.79267e+00 7.52952e-01 1.43176e+02 202.277 -7.72985e+00 -3.16662e+00 0.00000e+00 0.00000e+00 1.29926e+02 202.277 1.32500e+01 22.277  0.9381 
1 1 1 4   72  5  o 7  1.77109e+01 5.57179e-01 2.82702e+02 144.948 -3.53551e+01 2.48041e+01  0.00000e+00 0.00000e+00 3.71184e+02 144.948 8.84820e+01 144.948 0.9884 
1 1 1 4   72  6  o 12 3.97575e+00 8.27662e-01 4.20709e+01 193.005 -1.47844e+00 -3.41455e-01 0.00000e+00 0.00000e+00 4.70809e+01 193.005 5.00999e+00 193.005 0.6004 
1 1 1 4   72  7  o 18 4.44544e+00 8.24883e-01 9.38201e+01 324.237 3.50704e+00  -2.52594e+00 0.00000e+00 0.00000e+00 5.13984e+01 324.237 4.24218e+01 144.237 0.8749 
1 1 1 4   72  8  o 9  7.91095e+00 7.26899e-01 9.91236e+01 152.328 -8.01105e+00 4.20089e+00  0.00000e+00 0.00000e+00 1.79346e+02 152.328 8.02225e+01 152.328 0.9430 
1 1 1 4   72  9  o 18 1.07110e+01 6.75367e-01 1.32519e+02 82.937  2.37981e+00  1.92082e+01  0.00000e+00 0.00000e+00 2.56698e+02 82.937  1.24179e+02 82.937  0.9738 
1 1 1 4   72  10 o 12 5.42873e+00 1.05998e+00 9.81499e+01 111.588 -2.35934e+00 5.96270e+00  0.00000e+00 0.00000e+00 8.78017e+01 111.588 1.03482e+01 291.588 0.9183 
1 1 1 4   72  11 o 19 3.81685e+00 1.07374e+00 9.51228e+01 313.775 3.20823e+00  -3.34847e+00 0.00000e+00 0.00000e+00 3.07023e+01 313.775 6.44205e+01 133.775 0.8842 
1 1 1 4   72  12 o 16 8.53213e+00 1.06738e+00 1.76413e+02 67.828  8.63306e+00  2.11843e+01  0.00000e+00 0.00000e+00 1.34479e+02 67.828  4.19339e+01 247.828 0.9779 
1 1 1 4   72  13 o 6  1.01038e+01 1.13828e+00 1.53512e+02 198.416 -2.22697e+01 -7.41519e+00 0.00000e+00 0.00000e+00 2.14639e+02 198.416 6.11270e+01 198.416 0.9785 
1 1 1 4   72  14 o 4  4.64165e+00 1.30200e+00 8.46666e+01 38.816  4.71444e+00  3.79263e+00  0.00000e+00 0.00000e+00 7.30657e+01 38.816  1.16009e+01 218.816 0.9131 
1 1 1 4   72  15 o 9  3.31936e+00 1.12022e+00 5.43324e+01 87.662  1.38672e-01  3.39687e+00  0.00000e+00 0.00000e+00 4.88237e+01 87.662  5.50867e+00 267.662 0.8357 
1 1 1 4   73  0  o 9  9.79751e+00 6.46657e-01 1.46560e+02 191.940 -9.51679e+00 -2.01246e+00 0.00000e+00 0.00000e+00 1.99988e+02 191.940 5.34279e+01 191.940 0.9471 
1 1 1 4   73  1  o 18 2.41638e+01 6.89032e-01 4.37147e+02 328.464 6.04313e+01  -3.70841e+01 0.00000e+00 0.00000e+00 4.59006e+02 328.464 2.18583e+01 328.464 0.9929 
1 1 1 4   73  2  o 3  1.29429e+01 6.99768e-01 3.10676e+02 124.844 -1.58713e+01 2.27985e+01  0.00000e+00 0.00000e+00 1.64006e+02 124.844 1.46670e+02 304.844 0.9818 
1 1 1 4   73  3  o 7  1.22463e+01 1.19742e+00 1.77998e+02 244.881 -5.90104e+00 -1.25863e+01 0.00000e+00 0.00000e+00 2.62675e+02 244.881 8.46777e+01 244.881 0.9633 
1 1 1 4   73  4  o 12 4.66830e+00 1.21502e+00 7.80467e+01 298.205 1.22069e+00  -2.27613e+00 0.00000e+00 0.00000e+00 5.68654e+01 298.205 2.11813e+01 118.205 0.7737 
1 1 1 4   73  5  o 15 3.97687e+00 1.09392e+00 1.17927e+02 66.175  1.51120e+00  3.42237e+00  0.00000e+00 0.00000e+00 8.73291e+00 66.175  1.09194e+02 246.175 0.8528 
1 1 1 4   73  6  o 13 1.18912e+01 5.45984e-01 2.38245e+02 160.254 -2.61306e+01 9.37953e+00  0.00000e+00 0.00000e+00 1.97715e+02 160.254 4.05297e+01 340.254 0.9818 
1 1 1 4   73  7  o 2  1.43496e+01 5.51270e-01 2.74430e+02 31.046  3.62485e+01  2.18195e+01  0.00000e+00 0.00000e+00 2.54906e+02 31.046  1.95239e+01 211.045 0.9881 
1 1 1 4   73  8  o 6  7.42059e+00 7.43606e-01 1.05341e+02 261.815 -1.40506e+00 -9.76859e+00 0.00000e+00 0.00000e+00 1.57175e+02 261.815 5.18336e+01 261.815 0.9479 
1 1 1 4   73  9  o 14 4.32862e+00 9.35479e-01 1.73948e+01 73.386  2.75693e-01  9.23993e-01  0.00000e+00 0.00000e+00 5.26243e+01 73.386  3.52295e+01 73.386  0.4336 
1 1 1 4   73  10 o 6  8.83076e+00 8.21440e-01 1.22834e+02 41.348  1.20619e+01  1.06144e+01  0.00000e+00 0.00000e+00 1.96066e+02 41.348  7.32326e+01 41.348  0.9684 
1 1 1 4   73  11 o 19 6.83239e+00 1.05662e+00 1.39758e+02 170.481 -1.25537e+01 2.10501e+00  0.00000e+00 0.00000e+00 1.04696e+02 170.481 3.50619e+01 350.481 0.9599 
1 1 1 4   73  12 o 19 5.73476e+00 1.19872e+00 4.92769e+01 233.038 -2.35194e+00 -3.12542e+00 0.00000e+00 0.00000e+00 1.34463e+02 233.038 8.51865e+01 233.038 0.8600 
1 1 1 4   73  13 o 17 3.71797e+00 1.11398e+00 1.00399e+02 66.361  2.35982e+00  5.39149e+00  0.00000e+00 0.00000e+00 2.56439e+01 66.361  7.47547e+01 246.361 0.9105 
1 1 1 4   73  14 f 0  4.06397e+00 1.23825e+00 9.87069e+01 331.599 5.67894e+00  -3.07067e+00 0.00000e+00 0.00000e+00 4.02394e+01 331.599 5.84675e+01 151.599 0.9189 
1 1 1 4   73  15 o 16 3.38047e+00 1.13242e+00 3.25185e+01 72.725  6.43484e-01  2.06918e+00  0.00000e+00 0.00000e+00 5.83988e+01 72.725  2.58802e+01 72.725  0.7234 
1 1 1 4   74  0  o 17 8.13747e+00 5.61771e-01 1.46946e+02 197.867 -8.04471e+00 -2.59319e+00 0.00000e+00 0.00000e+00 1.38311e+02 197.867 8.63502e+00 17.867  0.9388 
1 1 1 4   74  1  o 14 4.85747e+00 8.86208e-01 1.18509e+02 236.763 -2.21068e+00 -3.37352e+00 0.00000e+00 0.00000e+00 3.83593e+01 236.763 8.01501e+01 56.763  0.8648 
1 1 1 4   74  2  o 13 1.21284e+01 8.00651e-01 2.21931e+02 167.395 -1.88246e+01 4.20954e+00  0.00000e+00 0.00000e+00 2.19116e+02 167.395 2.81457e+00 347.395 0.9737 
1 1 1 4   74  3  o 10 2.46815e+01 8.99769e-01 4.61006e+02 57.436  4.42563e+01  6.92964e+01  0.00000e+00 0.00000e+00 4.55136e+02 57.436  5.86951e+00 237.435 0.9939 
1 1 1 4   74  4  o 8  4.88062e+00 1.05132e+00 1.44977e+02 68.338  1.99765e+00  5.02948e+00  0.00000e+00 0.00000e+00 1.94480e+01 68.338  1.25529e+02 248.338 0.9021 
1 1 1 4   74  5  f 0  1.32506e+01 8.57021e-01 2.45818e+02 247.215 -1.07768e+01 -2.56557e+01 0.00000e+00 0.00000e+00 2.39987e+02 247.215 5.83113e+00 67.215  0.9819 
1 1 1 4   74  6  o 11 1.14056e+01 6.66261e-01 2.10004e+02 101.820 -5.18503e+00 2.47763e+01  0.00000e+00 0.00000e+00 2.07309e+02 101.820 2.69461e+00 281.820 0.9800 
1 1 1 4   74  7  o 15 1.14225e+01 6.02153e-01 1.21723e+02 239.823 -7.34297e+00 -1.26283e+01 0.00000e+00 0.00000e+00 2.89759e+02 239.823 1.68036e+02 239.823 0.9651 
1 1 1 4   74  8  o 18 6.11139e+00 8.14564e-01 1.27395e+02 276.899 1.08535e+00  -8.96944e+00 0.00000e+00 0.00000e+00 8.76271e+01 276.899 3.97679e+01 96.900  0.9429 
1 1 1 4   74  9  o 3  6.92157e+00 8.38152e-01 1.57905e+02 249.794 -4.78666e+00 -1.30058e+01 0.00000e+00 0.00000e+00 9.07761e+01 249.794 6.71286e+01 69.794  0.9632 
1 1 1 4   74  10 o 11 1.06624e+01 7.43001e-01 2.10731e+02 42.830  2.52054e+01  2.33648e+01  0.00000e+00 0.00000e+00 1.80989e+02 42.830  2.97419e+01 222.830 0.9853 
1 1 1 4   74  11 o 11 1.09815e+01 8.07512e-01 1.90898e+02 231.285 -2.04731e+01 -2.55405e+01 0.00000e+00 0.00000e+00 2.12047e+02 231.285 2.11488e+01 231.285 0.9846 
1 1 1 4   74  12 o 7  8.59992e+00 1.08851e+00 1.88616e+02 59.713  1.15764e+01  1.98208e+01  0.00000e+00 0.00000e+00 1.24645e+02 59.713  6.39714e+01 239.713 0.9780 
1 1 1 4   74  13 o 18 8.97742e+00 1.20792e+00 1.18407e+02 122.318 -8.51600e+00 1.34618e+01  0.00000e+00 0.00000e+00 2.05105e+02 122.318 8.66983e+01 122.318 0.9681 
1 1 1 4   74  14 o 13 8.78962e+00 1.41500e+00 1.69678e+02 327.305 1.75809e+01  -1.12844e+01 0.00000e+00 0.00000e+00 1.49367e+02 327.305 2.03112e+01 147.305 0.9758 
1 1 1 4   74  15 o 17 5.95710e+00 1.48980e+00 8.39402e+01 162.102 -6.93658e+00 2.24016e+00  0.00000e+00 0.00000e+00 1.21696e+02 162.102 3.77556e+01 162.102 0.9286 
1 1 1 4   75  0  o 13 1.53413e+01 5.59972e-01 2.38537e+02 13.715  2.66471e+01  6.50316e+00  0.00000e+00 0.00000e+00 3.23630e+02 13.715  8.50926e+01 13.715  0.9816 
1 1 1 4   75  1  o 3  1.72958e+01 5.62920e-01 3.65337e+02 257.201 -1.02889e+01 -4.52893e+01 0.00000e+00 0.00000e+00 2.73425e+02 257.201 9.19115e+01 77.201  0.9892 
1 1 1 4   75  2  o 10 5.58634e+00 1.04512e+00 4.45004e+01 121.593 -9.07204e-01 1.47504e+00  0.00000e+00 0.00000e+00 9.07493e+01 121.593 4.62488e+01 121.593 0.6484 
1 1 1 4   75  3  o 16 1.42730e+01 9.34201e-01 3.04740e+02 198.523 -3.01270e+01 -1.00939e+01 0.00000e+00 0.00000e+00 2.19739e+02 198.523 8.50010e+01 18.523  0.9841 
1 1 1 4   75  4  o 10 1.74775e+01 5.96110e-01 3.35385e+02 66.680  2.11642e+01  4.90954e+01  0.00000e+00 0.00000e+00 3.11037e+02 66.680  2.43482e+01 246.680 0.9906 
1 1 1 4   75  5  o 15 7.80421e+00 8.05682e-01 1.45523e+02 310.291 6.68437e+00  -7.88437e+00 0.00000e+00 0.00000e+00 1.31355e+02 310.291 1.41680e+01 130.291 0.9503 
1 1 1 4   75  6  o 19 1.74992e+01 6.77725e-01 3.54785e+02 6.584   6.67296e+01  7.70157e+00  0.00000e+00 0.00000e+00 2.93510e+02 6.584   6.12751e+01 186.584 0.9925 
1 1 1 4   75  7  o 11 1.25623e+01 7.49677e-01 3.19675e+02 122.606 -2.48168e+01 3.87953e+01  0.00000e+00 0.00000e+00 1.43997e+02 122.606 1.75679e+02 302.606 0.9891 
1 1 1 4   75  8  o 9  1.18855e+01 7.72479e-01 2.02865e+02 32.447  2.51264e+01  1.59749e+01  0.00000e+00 0.00000e+00 2.33027e+02 32.447  3.01615e+01 32.447  0.9831 
1 1 1 4   75  9  o 18 4.03435e+00 9.17242e-01 1.01671e+02 95.420  -5.17681e-01 5.45607e+00  0.00000e+00 0.00000e+00 3.42544e+01 95.420  6.74171e+01 275.420 0.9035 
1 1 1 4   75  10 o 11 1.22425e+01 7.36228e-01 2.29206e+02 286.834 1.25369e+01  -4.14353e+01 0.00000e+00 0.00000e+00 2.21858e+02 286.834 7.34832e+00 106.834 0.9884 
1 1 1 4   75  11 o 6  4.31088e+00 1.06985e+00 1.16474e+02 71.929  2.27058e+00  6.95870e+00  0.00000e+00 0.00000e+00 3.27323e+01 71.929  8.37418e+01 251.929 0.9289 
1 1 1 4   75  12 o 10 2.55828e+00 8.59853e-01 1.13449e+01 208.207 -4.47617e-01 -2.40084e-01 0.00000e+00 0.00000e+00 1.21020e+01 208.207 7.57135e-01 208.207 0.2461 
1 1 1 4   75  13 o 3  5.65035e+00 1.35248e+00 1.09479e+02 306.167 5.09545e+00  -6.97048e+00 0.00000e+00 0.00000e+00 8.82273e+01 306.167 2.12514e+01 126.167 0.9402 
1 1 1 4   75  14 o 9  3.65306e+00 1.15744e+00 8.20938e+01 279.413 8.68563e-01  -5.23919e+00 0.00000e+00 0.00000e+00 4.02005e+01 279.413 4.18933e+01 99.413  0.9001 
1 1 1 4   75  15 o 19 4.13669e+00 1.30283e+00 6.08744e+01 158.374 -4.03509e+00 1.59973e+00  0.00000e+00 0.00000e+00 7.37175e+01 158.374 1.28432e+01 158.374 0.8755 
1 1 1 4   76  0  o 4  1.13755e+01 5.62572e-01 2.30287e+02 146.830 -1.69892e+01 1.11048e+01  0.00000e+00 0.00000e+00 1.83689e+02 146.830 4.65977e+01 326.830 0.9750 
1 1 1 4   76  1  o 17 1.21254e+01 5.82320e-01 1.95023e+02 266.681 -1.05533e+00 -1.82006e+01 0.00000e+00 0.00000e+00 2.45000e+02 266.681 4.99778e+01 266.681 0.9722 
1 1 1 4   76  2  o 7  1.68990e+01 6.63730e-01 3.57592e+02 30.836  4.03130e+01  2.40656e+01  0.00000e+00 0.00000e+00 2.66505e+02 30.836  9.10869e+01 210.836 0.9893 
1 1 1 4   76  3  o 15 1.46330e+01 8.16233e-01 2.68396e+02 29.448  2.82433e+01  1.59455e+01  0.00000e+00 0.00000e+00 2.69379e+02 29.448  9.83282e-01 29.448  0.9845 
1 1 1 4   76  4  o 12 6.99043e+00 7.00197e-01 1.68086e+02 256.362 -2.46237e+00 -1.01489e+01 0.00000e+00 0.00000e+00 8.00334e+01 256.362 8.80527e+01 76.362  0.9508 
1 1 1 4   76  5  o 15 3.33565e+00 9.06691e-01 1.13497e+02 346.093 3.28587e+00  -8.13594e-01 0.00000e+00 0.00000e+00 9.55335e+00 166.093 1.23050e+02 166.093 0.8349 
1 1 1 4   76  6  o 17 2.99171e+00 8.39461e-01 4.10230e+01 292.403 4.90484e-01  -1.18980e+00 0.00000e+00 0.00000e+00 1.91410e+01 292.403 2.18821e+01 112.403 0.5389 
1 1 1 4   76  7  o 19 5.86758e+00 1.11718e+00 1.43943e+02 209.480 -7.98272e+00 -4.51277e+00 0.00000e+00 0.00000e+00 6.26681e+01 209.480 8.12744e+01 29.480  0.9438 
1 1 1 4   76  8  o 5  3.15014e+00 9.05317e-01 9.78586e+01 276.499 4.35024e-01  -3.81866e+00 0.00000e+00 0.00000e+00 2.86007e+00 276.499 9.49985e+01 96.499  0.8572 
1 1 1 4   76  9  o 16 4.23368e+00 1.07187e+00 1.11725e+02 109.405 -1.88116e+00 5.34048e+00  0.00000e+00 0.00000e+00 3.14108e+01 109.405 8.03141e+01 289.405 0.9068 
1 1 1 4   76  10 o 7  1.07429e+01 9.43428e-01 1.87861e+02 290.672 1.03614e+01  -2.74610e+01 0.00000e+00 0.00000e+00 2.05641e+02 290.672 1.77803e+01 290.672 0.9828 
1 1 1 4   76  11 o 8  4.95216e+00 1.16398e+00 8.16955e+01 62.525  2.61692e+00  5.03252e+00  0.00000e+00 0.00000e+00 8.56135e+01 62.525  3.91804e+00 62.525  0.9069 
1 1 1 4   76  12 o 9  2.94328e+00 9.81197e-01 1.16070e+02 249.388 -2.03391e+00 -5.40778e+00 0.00000e+00 0.00000e+00 1.64865e+01 69.388  1.32557e+02 69.388  0.9088 
1 1 1 4   76  13 o 6  6.37889e+00 1.38554e+00 1.41905e+02 56.488  7.16602e+00  1.08219e+01  0.00000e+00 0.00000e+00 8.61113e+01 56.488  5.57937e+01 236.488 0.9607 
1 1 1 4   76  14 o 9  3.44487e+00 1.13422e+00 4.84507e+01 317.917 2.35406e+00  -2.12576e+00 0.00000e+00 0.00000e+00 5.68337e+01 317.917 8.38301e+00 317.917 0.8219 
1 1 1 4   76  15 o 18 8.00379e+00 1.58978e+00 1.33594e+02 155.547 -1.43499e+01 6.52536e+00  0.00000e+00 0.00000e+00 1.54211e+02 155.547 2.06170e+01 155.547 0.9677 
1 1 1 4   77  0  o 9  5.52877e+00 7.88156e-01 1.16862e+02 247.619 -1.86266e+00 -4.52335e+00 0.00000e+00 0.00000e+00 6.69203e+01 247.619 4.99414e+01 67.619  0.8908 
1 1 1 4   77  1  o 16 1.25341e+01 6.46222e-01 1.97941e+02 176.443 -1.92649e+01 1.19758e+00  0.00000e+00 0.00000e+00 2.57551e+02 176.443 5.96093e+01 176.443 0.9737 
1 1 1 4   77  2  o 16 6.65822e+00 8.41843e-01 7.66684e+01 93.708  -2.71009e-01 4.18222e+00  0.00000e+00 0.00000e+00 1.39650e+02 93.708  6.29815e+01 93.708  0.8705 
1 1 1 4   77  3  o 15 1.63567e+01 5.27599e-01 3.32865e+02 153.863 -4.50859e+01 2.21231e+01  0.00000e+00 0.00000e+00 2.71508e+02 153.863 6.13570e+01 333.863 0.9900 
1 1 1 4   77  4  o 2  1.30116e+01 6.12671e-01 2.25754e+02 342.992 2.68050e+01  -8.19919e+00 0.00000e+00 0.00000e+00 2.51112e+02 342.992 2.53584e+01 342.992 0.9820 
1 1 1 4   77  5  o 14 5.05738e+00 9.40205e-01 1.83902e+02 249.147 -3.16413e+00 -8.30657e+00 0.00000e+00 0.00000e+00 6.13257e+00 69.147  1.90035e+02 69.147  0.9419 
1 1 1 4   77  6  o 13 2.97129e+00 8.54200e-01 6.79405e+01 245.245 -8.27613e-01 -1.79485e+00 0.00000e+00 0.00000e+00 8.98209e+00 245.245 5.89584e+01 65.245  0.6939 
1 1 1 4   77  7  o 4  1.21084e+01 1.08061e+00 2.14845e+02 333.046 2.54971e+01  -1.29655e+01 0.00000e+00 0.00000e+00 2.28853e+02 333.046 1.40072e+01 333.046 0.9824 
1 1 1 4   77  8  f 0  4.61046e+00 1.04800e+00 5.19938e+01 2.168   2.90968e+00  1.10132e-01  0.00000e+00 0.00000e+00 8.61053e+01 2.168   3.41115e+01 2.168   0.8032 
1 1 1 4   77  9  o 19 9.16087e+00 9.20100e-01 1.99142e+02 227.204 -1.75295e+01 -1.89325e+01 0.00000e+00 0.00000e+00 1.35665e+02 227.204 6.34777e+01 47.204  0.9804 
1 1 1 4   77  10 o 7  7.67514e+00 1.06579e+00 1.69439e+02 301.850 9.75197e+00  -1.56975e+01 0.00000e+00 0.00000e+00 1.08700e+02 301.850 6.07386e+01 121.850 0.9726 
1 1 1 4   77  11 o 4  5.12248e+00 1.25984e+00 6.95558e+01 231.119 -3.01639e+00 -3.74075e+00 0.00000e+00 0.00000e+00 9.99838e+01 231.119 3.04280e+01 231.119 0.8887 
1 1 1 4   77  12 o 8  7.83469e+00 1.28545e+00 1.45337e+02 292.752 5.96957e+00  -1.42346e+01 0.00000e+00 0.00000e+00 1.36687e+02 292.752 8.64996e+00 112.752 0.9670 
1 1 1 4   77  13 o 5  4.36155e+00 1.29710e+00 3.83029e+01 268.085 -8.17213e-02 -2.44471e+00 0.00000e+00 0.00000e+00 8.48485e+01 268.085 4.65455e+01 268.085 0.7590 
1 1 1 4   77  14 o 12 3.97544e+00 1.24738e+00 6.98233e+00 3.503   5.04175e-01  3.08653e-02  0.00000e+00 0.00000e+00 2.92021e+01 3.503   2.22197e+01 3.503   0.2448 
1 1 1 4   77  15 o 11 3.83657e+00 1.27635e+00 1.28857e+01 107.234 -2.71743e-01 8.76041e-01  0.00000e+00 0.00000e+00 4.64468e+01 107.234 3.35611e+01 107.234 0.4163 
1 1 1 4   78  0  o 15 2.20721e+01 6.06092e-01 3.83390e+02 81.101  1.11678e+01  7.13246e+01  0.00000e+00 0.00000e+00 4.34340e+02 81.101  5.09498e+01 81.101  0.9930 
1 1 1 4   78  1  o 15 5.34130e+00 9.00558e-01 1.32149e+02 325.954 4.71952e+00  -3.18884e+00 0.00000e+00 0.00000e+00 4.86841e+01 325.954 8.34650e+01 145.954 0.9074 
1 1 1 4   78  2  o 7  9.95269e+00 6.99729e-01 1.72694e+02 13.580  1.48632e+01  3.59036e+00  0.00000e+00 0.00000e+00 1.86332e+02 13.580  1.36384e+01 13.580  0.9667 
1 1 1 4   78  3  o 6  9.08402e+00 5.74892e-01 1.52583e+02 86.093  8.60305e-01  1.25974e+01  0.00000e+00 0.00000e+00 1.72677e+02 86.093  2.00944e+01 86.093  0.9595 
1 1 1 4   78  4  o 10 1.28290e+01 5.73631e-01 2.48745e+02 272.782 1.50818e+00  -3.10411e+01 0.00000e+00 0.00000e+00 2.22181e+02 272.782 2.65634e+01 92.782  0.9838 
1 1 1 4   78  5  o 1  1.30829e+01 6.09870e-01 3.24218e+02 95.973  -4.68150e+00 4.47463e+01  0.00000e+00 0.00000e+00 1.58435e+02 95.973  1.65783e+02 275.973 0.9888 
1 1 1 4   78  6  o 8  1.57066e+01 6.50144e-01 2.66030e+02 308.508 3.07146e+01  -3.86024e+01 0.00000e+00 0.00000e+00 3.13897e+02 308.508 4.78667e+01 308.508 0.9898 
1 1 1 4   78  7  o 17 7.18631e+00 1.24454e+00 1.28683e+02 149.856 -8.37511e+00 4.86346e+00  0.00000e+00 0.00000e+00 1.25083e+02 149.856 3.60093e+00 329.856 0.9469 
1 1 1 4   78  8  o 14 7.37518e+00 8.83475e-01 9.70395e+01 320.338 7.08937e+00  -5.87775e+00 0.00000e+00 0.00000e+00 1.62538e+02 320.338 6.54987e+01 320.338 0.9440 
1 1 1 4   78  9  o 3  3.92637e+00 1.05738e+00 1.05845e+02 177.736 -5.46937e+00 2.16186e-01  0.00000e+00 0.00000e+00 2.63406e+01 177.736 7.95044e+01 357.736 0.9033 
1 1 1 4   78  10 o 14 4.76113e+00 1.20304e+00 1.04115e+02 143.582 -5.32242e+00 3.92661e+00  0.00000e+00 0.00000e+00 5.92336e+01 143.582 4.48817e+01 323.582 0.9210 
1 1 1 4   78  11 o 9  3.25257e+00 1.03718e+00 7.09122e+01 289.492 1.17424e+00  -3.31746e+00 0.00000e+00 0.00000e+00 3.10757e+01 289.492 3.98364e+01 109.492 0.8421 
1 1 1 4   78  12 o 3  4.93578e+00 1.34400e+00 1.03572e+02 51.353  4.26938e+00  5.33923e+00  0.00000e+00 0.00000e+00 6.60921e+01 51.353  3.74804e+01 231.353 0.9237 
1 1 1 4   78  13 o 12 4.41033e+00 1.33919e+00 1.29167e+02 175.899 -8.50543e+00 6.09886e-01  0.00000e+00 0.00000e+00 2.49261e+01 175.899 1.04240e+02 355.899 0.9394 
1 1 1 4   78  14 o 18 6.58918e+00 1.68561e+00 1.28133e+02 342.883 9.78164e+00  -3.01230e+00 0.00000e+00 0.00000e+00 1.04486e+02 342.883 2.36472e+01 162.883 0.9498 
1 1 1 4   78  15 o 19 3.22035e+00 1.11748e+00 4.30481e+01 93.346  -1.87820e-01 3.21215e+00  0.00000e+00 0.00000e+00 5.56136e+01 93.346  1.25655e+01 93.346  0.8249 
1 1 1 4   79  0  o 19 1.45520e+01 6.54672e-01 2.41858e+02 59.923  1.58501e+01  2.73683e+01  0.00000e+00 0.00000e+00 2.92272e+02 59.923  5.04144e+01 59.923  0.9841 
1 1 1 4   79  1  o 18 1.03719e+01 6.81368e-01 1.80288e+02 337.466 1.54202e+01  -6.39794e+00 0.00000e+00 0.00000e+00 1.94857e+02 337.466 1.45689e+01 337.466 0.9696 
1 1 1 4   79  2  o 4  3.00892e+00 7.73588e-01 8.56215e+01 287.247 6.65775e-01  -2.14449e+00 0.00000e+00 0.00000e+00 3.20131e+00 107.247 8.88228e+01 107.247 0.7342 
1 1 1 4   79  3  o 11 2.23429e+01 5.56897e-01 4.31372e+02 96.195  -1.01615e+01 9.36121e+01  0.00000e+00 0.00000e+00 3.97741e+02 96.195  3.36312e+01 276.195 0.9947 
1 1 1 4   79  4  o 8  1.76569e+01 5.45861e-01 3.17855e+02 300.350 3.02481e+01  -5.16595e+01 0.00000e+00 0.00000e+00 3.35313e+02 300.350 1.74577e+01 300.350 0.9916 
1 1 1 4   79  5  o 9  6.31318e+00 7.21722e-01 8.83304e+01 71.847  1.77143e+00  5.40291e+00  0.00000e+00 0.00000e+00 1.25300e+02 71.847  3.69700e+01 71.847  0.9072 
1 1 1 4   79  6  o 4  1.33543e+01 7.00390e-01 2.33199e+02 3.416   3.98230e+01  2.37705e+00  0.00000e+00 0.00000e+00 2.58560e+02 3.416   2.53618e+01 3.416   0.9874 
1 1 1 4   79  7  o 4  3.84318e+00 1.12273e+00 1.23089e+02 53.167  3.20838e+00  4.28363e+00  0.00000e+00 0.00000e+00 6.01343e+00 53.167  1.17075e+02 233.167 0.9010 
1 1 1 4   79  8  o 11 1.44620e+01 8.02997e-01 2.88210e+02 238.762 -2.96569e+01 -4.88965e+01 0.00000e+00 0.00000e+00 2.46120e+02 238.762 4.20896e+01 58.762  0.9912 
1 1 1 4   79  9  o 18 4.66242e+00 1.04656e+00 1.26526e+02 306.093 4.62516e+00  -6.34428e+00 0.00000e+00 0.00000e+00 3.57275e+01 306.093 9.07989e+01 126.093 0.9340 
1 1 1 4   79  10 o 9  4.62310e+00 1.20341e+00 1.01108e+02 312.542 4.26880e+00  -4.65178e+00 0.00000e+00 0.00000e+00 5.67860e+01 312.542 4.43216e+01 132.542 0.9170 
1 1 1 4   79  11 o 15 3.90723e+00 1.16096e+00 6.68592e+01 124.938 -2.02866e+00 2.90391e+00  0.00000e+00 0.00000e+00 5.58029e+01 124.938 1.10563e+01 304.938 0.8433 
1 1 1 4   79  12 o 3  4.04193e+00 1.24614e+00 3.25724e+01 324.056 1.55779e+00  -1.12946e+00 0.00000e+00 0.00000e+00 7.04325e+01 324.056 3.78601e+01 324.056 0.6849 
1 1 1 4   79  13 o 11 4.95982e+00 1.40780e+00 7.22428e+01 282.176 1.07155e+00  -4.96615e+00 0.00000e+00 0.00000e+00 9.28633e+01 282.176 2.06205e+01 282.176 0.8952 
1 1 1 4   79  14 o 6  4.05704e+00 1.29448e+00 6.88053e+01 146.489 -4.01204e+00 2.65659e+00  0.00000e+00 0.00000e+00 6.51961e+01 146.489 3.60917e+00 326.489 0.8888 
1 1 1 4   80  0  o 14 1.00687e+01 6.93732e-01 1.73755e+02 330.100 1.34718e+01  -7.74652e+00 0.00000e+00 0.00000e+00 1.89430e+02 330.100 1.56751e+01 330.100 0.9673 
1 1 1 4   80  1  o 8  1.17202e+01 6.40874e-01 2.06070e+02 274.004 1.60171e+00  -2.28802e+01 0.00000e+00 0.00000e+00 2.21411e+02 274.004 1.53407e+01 274.004 0.9780 
1 1 1 4   80  2  f 0  2.78891e+00 7.12789e-01 6.37458e+01 191.694 -1.64196e+00 -3.39867e-01 0.00000e+00 0.00000e+00 2.50528e+00 191.694 6.12406e+01 11.694  0.6369 
1 1 1 4   80  3  o 2  1.33250e+01 5.32421e-01 2.74744e+02 81.418  5.95442e+00  3.94546e+01  0.00000e+00 0.00000e+00 2.15997e+02 81.418  5.87465e+01 261.418 0.9874 
1 1 1 4   80  4  o 11 8.28650e+00 6.10524e-01 1.32012e+02 239.524 -5.87996e+00 -9.99172e+00 0.00000e+00 0.00000e+00 1.63405e+02 239.524 3.13936e+01 239.524 0.9558 
1 1 1 4   80  5  o 16 2.38169e+00 7.35437e-01 8.00273e+01 149.343 -1.88913e+00 1.11977e+00  0.00000e+00 0.00000e+00 1.54122e+01 329.343 9.54396e+01 329.343 0.7275 
1 1 1 4   80  6  o 14 6.39956e+00 7.57853e-01 1.25464e+02 147.950 -8.04839e+00 5.03892e+00  0.00000e+00 0.00000e+00 1.00214e+02 147.950 2.52498e+01 327.950 0.9458 
1 1 1 4   80  7  o 11 5.60563e+00 9.87462e-01 8.94123e+01 266.326 -4.01369e-01 -6.25117e+00 0.00000e+00 0.00000e+00 1.02056e+02 266.326 1.26441e+01 266.326 0.9163 
1 1 1 4   80  8  o 13 4.88935e+00 9.47651e-01 5.64846e+01 324.987 3.22958e+00  -2.26250e+00 0.00000e+00 0.00000e+00 1.00452e+02 324.987 4.39679e+01 324.987 0.8613 
1 1 1 4   80  9  o 3  8.61277e+00 9.83948e-01 1.68968e+02 148.420 -1.76515e+01 1.08509e+01  0.00000e+00 0.00000e+00 1.44043e+02 148.420 2.49251e+01 328.420 0.9756 
1 1 1 4   80  10 o 16 3.11980e+00 9.80964e-01 4.75115e+01 23.895  2.11911e+00  9.38842e-01  0.00000e+00 0.00000e+00 3.88789e+01 23.895  8.63263e+00 203.895 0.7436 
1 1 1 4   80  11 o 10 2.59155e+00 8.80830e-01 3.31395e+01 96.604  -1.68434e-01 1.45490e+00  0.00000e+00 0.00000e+00 2.35060e+01 96.604  9.63341e+00 276.604 0.5873 
1 1 1 4   80  12 o 10 4.80152e+00 1.32900e+00 4.87460e+01 300.906 1.70694e+00  -2.85145e+00 0.00000e+00 0.00000e+00 9.97381e+01 300.906 5.09921e+01 300.906 0.8313 
1 1 1 4   80  13 f 0  3.86240e+00 1.19011e+00 7.06101e+01 132.308 -3.03088e+00 3.32999e+00  0.00000e+00 0.00000e+00 5.58106e+01 132.308 1.47995e+01 312.308 0.8804 
1 1 1 4   80  14 o 13 3.44101e+00 1.15158e+00 2.96398e+01 313.844 1.35910e+00  -1.41509e+00 0.00000e+00 0.00000e+00 5.87554e+01 313.844 2.91155e+01 313.844 0.6914 
1 1 1 4   81  0  o 15 9.33546e+00 6.03207e-01 1.04310e+02 22.153  8.72478e+00  3.55217e+00  0.00000e+00 0.00000e+00 2.24717e+02 22.153  1.20406e+02 22.153  0.9453 
1 1 1 4   81  1  o 19 2.81410e+00 7.98656e-01 3.42632e+01 239.564 -4.50933e-01 -7.67498e-01 0.00000e+00 0.00000e+00 8.35196e+00 239.564 2.59113e+01 59.564  0.4061 
1 1 1 4   81  2  o 3  1.53319e+01 5.08069e-01 2.49877e+02 205.962 -3.77483e+01 -1.83803e+01 0.00000e+00 0.00000e+00 3.15006e+02 205.962 6.51287e+01 205.962 0.9880 
1 1 1 4   81  3  o 2  2.00420e+01 5.45756e-01 3.97924e+02 21.339  8.29520e+01  3.24071e+01  0.00000e+00 0.00000e+00 3.45252e+02 21.339  5.26720e+01 201.339 0.9944 
1 1 1 4   81  4  o 4  3.72900e+00 8.18351e-01 6.61830e+01 111.296 -8.88054e-01 2.27818e+00  0.00000e+00 0.00000e+00 3.93415e+01 111.296 2.68414e+01 291.296 0.7589 
1 1 1 4   81  5  o 1  6.41184e+00 7.55527e-01 8.04747e+01 178.167 -6.20751e+00 1.98604e-01  0.00000e+00 0.00000e+00 1.38391e+02 178.167 5.79160e+01 178.167 0.9155 
1 1 1 4   81  6  o 17 3.26492e+00 8.44458e-01 9.86906e+01 93.643  -2.46040e-01 3.86410e+00  0.00000e+00 0.00000e+00 5.78662e+00 93.643  9.29040e+01 273.643 0.8584 
1 1 1 4   81  7  o 19 4.96198e+00 8.96875e-01 1.45393e+02 205.009 -8.36627e+00 -3.90282e+00 0.00000e+00 0.00000e+00 2.92135e+01 205.009 1.16179e+02 25.009  0.9442 
1 1 1 4   81  8  o 8  4.79182e+00 9.84904e-01 1.33055e+02 250.700 -2.90140e+00 -8.28527e+00 0.00000e+00 0.00000e+00 3.49805e+01 250.700 9.80745e+01 70.700  0.9412 
1 1 1 4   81  9  o 1  3.70052e+00 9.86711e-01 7.28874e+01 244.133 -1.74652e+00 -3.60215e+00 0.00000e+00 0.00000e+00 4.61449e+01 244.133 2.67425e+01 64.133  0.8636 
1 1 1 4   81  10 o 4  9.68573e+00 1.02134e+00 1.84794e+02 231.996 -1.72335e+01 -2.20544e+01 0.00000e+00 0.00000e+00 1.69297e+02 231.996 1.54967e+01 51.996  0.9820 
1 1 1 4   81  11 o 5  8.16082e+00 1.20989e+00 1.18841e+02 34.831  1.08280e+01  7.53429e+00  0.00000e+00 0.00000e+00 1.73087e+02 34.831  5.42458e+01 34.831  0.9613 
1 1 1 4   81  12 o 8  8.91738e+00 1.32789e+00 1.70604e+02 268.309 -6.71867e-01 -2.27647e+01 0.00000e+00 0.00000e+00 1.53679e+02 268.309 1.69247e+01 88.309  0.9778 
1 1 1 4   81  13 o 7  6.81876e+00 1.56600e+00 7.47934e+01 140.136 -5.07519e+00 4.23812e+00  0.00000e+00 0.00000e+00 1.58611e+02 140.136 8.38180e+01 140.136 0.9209 
1 1 1 4   81  14 o 4  3.28618e+00 1.12552e+00 2.85205e+01 130.531 -1.21782e+00 1.42433e+00  0.00000e+00 0.00000e+00 5.39883e+01 130.531 2.54678e+01 130.531 0.6760 
1 1 1 4   82  0  o 9  6.78017e+00 7.26029e-01 1.56452e+02 207.943 -9.73121e+00 -5.16176e+00 0.00000e+00 0.00000e+00 8.45173e+01 207.943 7.19345e+01 27.943  0.9535 
1 1 1 4   82  1  o 7  7.90937e+00 5.57225e-01 1.32439e+02 85.391  8.96452e-01  1.11193e+01  0.00000e+00 0.00000e+00 1.48875e+02 85.391  1.64360e+01 85.391  0.9541 
1 1 1 4   82  2  o 5  1.19884e+01 4.73291e-01 2.02583e+02 201.758 -2.55856e+01 -1.02117e+01 0.00000e+00 0.00000e+00 2.36184e+02 201.758 3.36012e+01 201.758 0.9817 
1 1 1 4   82  3  f 0  5.18444e+00 7.08660e-01 1.61789e+02 234.174 -5.35061e+00 -7.41167e+00 0.00000e+00 0.00000e+00 2.05997e+01 234.174 1.41189e+02 54.174  0.9436 
1 1 1 4   82  4  o 8  8.76709e+00 6.02870e-01 1.38395e+02 118.444 -6.91606e+00 1.27673e+01  0.00000e+00 0.00000e+00 1.76983e+02 118.444 3.85886e+01 118.444 0.9649 
1 1 1 4   82  5  o 4  9.16991e+00 6.11324e-01 1.79985e+02 9.151   2.13903e+01  3.44555e+00  0.00000e+00 0.00000e+00 1.53851e+02 9.151   2.61332e+01 189.151 0.9766 
1 1 1 4   82  6  o 4  6.20742e+00 7.60685e-01 1.22788e+02 318.793 7.61887e+00  -6.67149e+00 0.00000e+00 0.00000e+00 9.68234e+01 318.793 2.59645e+01 138.793 0.9493 
1 1 1 4   82  7  f 0  1.04972e+01 6.45299e-01 1.02370e+02 221.872 -1.16590e+01 -1.04507e+01 0.00000e+00 0.00000e+00 2.76061e+02 221.872 1.73691e+02 221.872 0.9675 
1 1 1 4   82  8  o 3  7.88743e+00 7.80893e-01 1.60954e+02 80.179  3.27378e+00  1.89121e+01  0.00000e+00 0.00000e+00 1.25093e+02 80.179  3.58603e+01 260.179 0.9736 
1 1 1 4   82  9  o 5  6.05763e+00 1.02936e+00 9.39377e+01 87.732  3.32289e-01  8.39078e+00  0.00000e+00 0.00000e+00 1.17737e+02 87.732  2.37995e+01 87.732  0.9384 
1 1 1 4   82  10 o 17 8.04008e+00 9.74885e-01 1.44610e+02 73.172  5.32910e+00  1.76197e+01  0.00000e+00 0.00000e+00 1.46404e+02 73.172  1.79381e+00 73.172  0.9724 
1 1 1 4   82  11 f 0  4.87705e+00 1.16291e+00 1.81018e+01 244.419 -5.67871e-01 -1.18627e+00 0.00000e+00 0.00000e+00 8.11500e+01 244.419 6.30483e+01 244.419 0.5470 
1 1 1 4   82  12 o 11 4.14799e+00 1.24018e+00 3.59988e+01 67.506  8.75260e-01  2.11367e+00  0.00000e+00 0.00000e+00 7.81032e+01 67.506  4.21044e+01 67.506  0.7398 
1 1 1 4   82  13 o 14 3.23058e+00 1.08323e+00 7.18482e+01 296.002 2.05927e+00  -4.22178e+00 0.00000e+00 0.00000e+00 3.44986e+01 296.002 3.73496e+01 116.002 0.8859 
1 1 1 4   82  14 o 11 7.70470e+00 1.73032e+00 6.20911e+01 315.018 4.42418e+00  -4.42138e+00 0.00000e+00 0.00000e+00 2.00037e+02 315.018 1.37946e+02 315.018 0.9161 
1 1 1 4   83  0  o 8  8.89036e+00 6.40085e-01 2.23197e+02 198.303 -2.05529e+01 -6.79844e+00 0.00000e+00 0.00000e+00 1.00369e+02 198.303 1.22828e+02 18.303  0.9766 
1 1 1 4   83  1  o 10 8.81614e+00 5.08475e-01 1.75842e+02 244.680 -7.19299e+00 -1.52030e+01 0.00000e+00 0.00000e+00 1.42823e+02 244.680 3.30189e+01 64.680  0.9698 
1 1 1 4   83  2  o 1  1.08542e+01 4.76490e-01 1.27530e+02 283.463 3.72062e+00  -1.55419e+01 0.00000e+00 0.00000e+00 2.64177e+02 283.463 1.36647e+02 283.463 0.9682 
1 1 1 4   83  3  o 10 8.43035e+00 5.53233e-01 1.33146e+02 81.177  1.98586e+00  1.27942e+01  0.00000e+00 0.00000e+00 1.68697e+02 81.177  3.55511e+01 81.177  0.9606 
1 1 1 4   83  4  o 6  8.42538e+00 6.01440e-01 1.73981e+02 359.884 1.93753e+01  -3.90835e-02 0.00000e+00 0.00000e+00 1.31836e+02 359.884 4.21455e+01 179.884 0.9738 
1 1 1 4   83  5  o 11 8.80644e+00 6.15906e-01 1.68096e+02 0.442   2.00760e+01  1.54781e-01  0.00000e+00 0.00000e+00 1.51820e+02 0.442   1.62768e+01 180.442 0.9748 
1 1 1 4   83  6  o 10 4.54582e+00 8.47205e-01 1.08886e+02 166.301 -6.08211e+00 1.48249e+00  0.00000e+00 0.00000e+00 4.63064e+01 166.301 6.25798e+01 346.301 0.9162 
1 1 1 4   83  7  o 12 2.45760e+00 7.62226e-01 6.56721e+01 295.909 1.09945e+00  -2.26334e+00 0.00000e+00 0.00000e+00 4.52532e+00 295.909 6.11468e+01 115.909 0.7668 
1 1 1 4   83  8  o 9  7.54564e+00 8.45674e-01 8.39118e+01 160.075 -9.09622e+00 3.29726e+00  0.00000e+00 0.00000e+00 1.82155e+02 160.075 9.82431e+01 160.075 0.9468 
1 1 1 4   83  9  o 1  7.72738e+00 8.60854e-01 1.54464e+02 109.628 -6.58186e+00 1.84555e+01  0.00000e+00 0.00000e+00 1.25773e+02 109.628 2.86912e+01 289.628 0.9741 
1 1 1 4   83  10 o 1  6.37848e+00 1.07695e+00 9.54272e+01 341.746 8.23523e+00  -2.71620e+00 0.00000e+00 0.00000e+00 1.27795e+02 341.746 3.23678e+01 341.746 0.9404 
1 1 1 4   83  11 o 14 4.63274e+00 1.19721e+00 1.20628e+02 208.383 -7.33579e+00 -3.96364e+00 0.00000e+00 0.00000e+00 4.09953e+01 208.383 7.96331e+01 28.383  0.9380 
1 1 1 4   83  12 o 18 8.26832e+00 1.20599e+00 1.05104e+02 168.656 -1.40840e+01 2.82548e+00  0.00000e+00 0.00000e+00 1.91367e+02 168.656 8.62637e+01 168.656 0.9645 
1 1 1 4   83  13 o 19 3.27722e+00 1.07374e+00 7.63674e+01 92.860  -2.63824e-01 5.28082e+00  0.00000e+00 0.00000e+00 3.31697e+01 92.860  4.31977e+01 272.860 0.8996 
1 1 1 4   83  14 o 14 3.64087e+00 1.19790e+00 9.69469e+01 186.344 -6.97315e+00 -7.75233e-01 0.00000e+00 0.00000e+00 2.81873e+01 186.344 6.87596e+01 6.344   0.9257 
1 1 1 4   84  0  o 7  1.29354e+01 4.65676e-01 2.08130e+02 221.288 -2.33936e+01 -2.05434e+01 0.00000e+00 0.00000e+00 2.66010e+02 221.288 5.78799e+01 221.288 0.9838 
1 1 1 4   84  1  o 5  7.69892e+00 5.34869e-01 1.42486e+02 82.523  1.62420e+00  1.23759e+01  0.00000e+00 0.00000e+00 1.32652e+02 82.523  9.83356e+00 262.523 0.9591 
1 1 1 4   84  2  o 13 9.75390e+00 5.01498e-01 1.84021e+02 268.774 -4.48383e-01 -2.09466e+01 0.00000e+00 0.00000e+00 1.70677e+02 268.774 1.33437e+01 88.774  0.9758 
1 1 1 4   84  3  o 10 4.21828e+00 7.55871e-01 1.69014e+02 163.990 -8.25288e+00 2.36807e+00  0.00000e+00 0.00000e+00 2.12768e+01 343.990 1.90291e+02 343.990 0.9398 
1 1 1 4   84  4  o 11 3.71486e+00 7.86344e-01 8.25300e+01 35.870  2.90962e+00  2.10389e+00  0.00000e+00 0.00000e+00 3.45392e+01 35.870  4.79907e+01 215.870 0.8457 
1 1 1 4   84  5  o 11 1.27930e+01 5.74845e-01 3.04542e+02 60.454  2.70112e+01  4.76525e+01  0.00000e+00 0.00000e+00 1.67747e+02 60.454  1.36795e+02 240.454 0.9908 
1 1 1 4   84  6  o 8  4.23813e+00 7.80563e-01 7.87197e+01 48.153  3.15700e+00  3.52515e+00  0.00000e+00 0.00000e+00 6.12866e+01 48.153  1.74331e+01 228.153 0.8868 
1 1 1 4   84  7  o 18 5.18190e+00 8.99363e-01 1.18071e+02 199.162 -8.29847e+00 -2.88369e+00 0.00000e+00 0.00000e+00 6.35832e+01 199.162 5.44875e+01 19.162  0.9412 
1 1 1 4   84  8  o 12 3.75482e+00 9.52499e-01 9.32830e+01 27.054  4.72117e+00  2.41111e+00  0.00000e+00 0.00000e+00 3.25299e+01 27.054  6.07531e+01 207.053 0.8999 
1 1 1 4   84  9  o 4  7.08469e+00 1.05995e+00 1.28782e+02 103.123 -3.09155e+00 1.32605e+01  0.00000e+00 0.00000e+00 1.25032e+02 103.123 3.74993e+00 283.123 0.9625 
1 1 1 4   84  10 o 9  1.60735e+01 7.59098e-01 2.92234e+02 336.544 7.96018e+01  -3.45395e+01 0.00000e+00 0.00000e+00 3.02309e+02 336.544 1.00754e+01 336.544 0.9942 
1 1 1 4   84  11 f 0  8.17228e+00 1.09405e+00 1.46867e+02 140.240 -1.55297e+01 1.29205e+01  0.00000e+00 0.00000e+00 1.49409e+02 140.240 2.54204e+00 140.240 0.9749 
1 1 1 4   84  12 o 8  6.55526e+00 1.36487e+00 8.06831e+01 284.337 1.91709e+00  -7.50049e+00 0.00000e+00 0.00000e+00 1.46622e+02 284.337 6.59386e+01 284.337 0.9330 
1 1 1 4   84  13 o 11 4.92802e+00 1.32491e+00 1.14382e+02 60.723  4.66789e+00  8.32584e+00  0.00000e+00 0.00000e+00 5.87909e+01 60.723  5.55911e+01 240.723 0.9461 
1 1 1 4   84  14 o 18 4.93812e+00 1.42461e+00 2.46504e+01 163.272 -2.02413e+00 6.08339e-01  0.00000e+00 0.00000e+00 1.06512e+02 163.272 8.18618e+01 163.272 0.7156 
1 1 1 4   85  0  o 15 1.79219e+01 4.82737e-01 2.87035e+02 135.924 -4.32866e+01 4.19118e+01  0.00000e+00 0.00000e+00 3.74977e+02 135.924 8.79413e+01 135.924 0.9917 
1 1 1 4   85  1  o 6  1.34479e+01 5.14631e-01 2.46919e+02 12.753  3.76183e+01  8.51408e+00  0.00000e+00 0.00000e+00 2.47533e+02 12.753  6.13893e-01 12.753  0.9870 
1 1 1 4   85  2  o 5  6.71701e+00 5.76833e-01 1.51001e+02 230.992 -8.12298e+00 -1.00281e+01 0.00000e+00 0.00000e+00 8.93511e+01 230.992 6.16503e+01 50.992  0.9604 
1 1 1 4   85  3  o 3  4.98877e+00 6.93280e-01 1.01309e+02 53.330  3.86269e+00  5.18792e+00  0.00000e+00 0.00000e+00 6.95146e+01 53.330  3.17940e+01 233.330 0.9191 
1 1 1 4   85  4  o 5  2.44055e+00 7.14419e-01 6.42096e+01 28.861  1.72706e+00  9.51863e-01  0.00000e+00 0.00000e+00 1.18909e+00 208.861 6.53987e+01 208.861 0.6931 
1 1 1 4   85  5  o 5  6.15053e+00 7.37163e-01 1.54628e+02 31.268  1.12835e+01  6.85188e+00  0.00000e+00 0.00000e+00 6.56265e+01 31.268  8.90019e+01 211.268 0.9613 
1 1 1 4   85  6  o 17 6.56260e+00 7.50867e-01 9.40855e+01 96.370  -9.43079e-01 8.44736e+00  0.00000e+00 0.00000e+00 1.35470e+02 96.370  4.13844e+01 96.370  0.9392 
1 1 1 4   85  7  o 11 6.85105e+00 8.04137e-01 1.41195e+02 305.946 8.49339e+00  -1.17134e+01 0.00000e+00 0.00000e+00 1.04927e+02 305.946 3.62684e+01 125.946 0.9648 
1 1 1 4   85  8  o 10 2.90616e+00 8.72451e-01 4.86016e+01 83.663  2.50850e-01  2.25894e+00  0.00000e+00 0.00000e+00 3.12196e+01 83.663  1.73820e+01 263.663 0.7379 
1 1 1 4   85  9  o 8  6.25099e+00 9.91589e-01 8.05145e+01 41.570  5.98538e+00  5.30845e+00  0.00000e+00 0.00000e+00 1.37027e+02 41.570  5.65126e+01 41.570  0.9352 
1 1 1 4   85  10 o 15 7.12115e+00 1.05182e+00 1.27057e+02 271.311 3.34840e-01  -1.46265e+01 0.00000e+00 0.00000e+00 1.28598e+02 271.311 1.54075e+00 271.311 0.9652 
1 1 1 4   85  11 o 18 3.85107e+00 1.09272e+00 5.58386e+01 84.422  3.56163e-01  3.64704e+00  0.00000e+00 0.00000e+00 6.57514e+01 84.422  9.91279e+00 84.422  0.8493 
1 1 1 4   85  12 o 5  2.70102e+00 9.22114e-01 4.60402e+01 128.012 -1.52934e+00 1.95660e+00  0.00000e+00 0.00000e+00 3.05543e+01 128.012 1.54860e+01 308.012 0.7632 
1 1 1 4   85  13 o 18 6.30731e+00 1.42320e+00 1.00686e+02 117.125 -4.56345e+00 8.90819e+00  0.00000e+00 0.00000e+00 1.21508e+02 117.125 2.08219e+01 117.125 0.9486 
1 1 1 4   85  14 o 18 6.52185e+00 1.49782e+00 6.76855e+01 355.433 7.27712e+00  -5.81241e-01 0.00000e+00 0.00000e+00 1.57096e+02 355.433 8.94105e+01 355.433 0.9287 
1 1 1 4   86  0  o 5  7.35782e+00 5.62408e-01 1.35887e+02 90.027  -6.07800e-03 1.27640e+01  0.00000e+00 0.00000e+00 1.27158e+02 90.027  8.72983e+00 270.027 0.9600 
1 1 1 4   86  1  o 8  2.56338e+00 7.06673e-01 5.77770e+01 218.403 -1.48375e+00 -1.17612e+00 0.00000e+00 0.00000e+00 7.09346e+00 218.403 5.06835e+01 38.403  0.6795 
1 1 1 4   86  2  o 12 7.59010e+00 5.66881e-01 1.63933e+02 142.876 -1.31964e+01 9.98888e+00  0.00000e+00 0.00000e+00 1.10103e+02 142.876 5.38307e+01 322.876 0.9693 
1 1 1 4   86  3  o 4  1.05502e+01 5.12350e-01 1.82845e+02 356.496 2.69212e+01  -1.64866e+00 0.00000e+00 0.00000e+00 2.02774e+02 356.496 1.99286e+01 356.496 0.9813 
1 1 1 4   86  4  o 13 3.65810e+00 7.43032e-01 2.48835e+01 316.895 8.88404e-01  -8.31506e-01 0.00000e+00 0.00000e+00 4.56890e+01 316.895 2.08055e+01 316.895 0.5180 
1 1 1 4   86  5  o 16 5.94796e+00 7.57732e-01 8.52385e+01 354.462 6.82251e+00  -6.61511e-01 0.00000e+00 0.00000e+00 1.19411e+02 354.462 3.41727e+01 354.462 0.9239 
1 1 1 4   86  6  o 8  3.36662e+00 8.25896e-01 7.81608e+01 221.834 -2.89727e+00 -2.59353e+00 0.00000e+00 0.00000e+00 2.95333e+01 221.834 4.86275e+01 41.834  0.8591 
1 1 1 4   86  7  o 10 2.71588e+00 8.10732e-01 4.52167e+01 122.763 -1.03196e+00 1.60359e+00  0.00000e+00 0.00000e+00 2.37239e+01 122.763 2.14928e+01 302.763 0.6819 
1 1 1 4   86  8  o 7  3.52592e+00 8.37434e-01 5.55060e+01 40.641  2.46992e+00  2.12002e+00  0.00000e+00 0.00000e+00 5.30389e+01 40.641  2.46704e+00 220.641 0.8272 
1 1 1 4   86  9  o 18 3.22363e+00 9.35663e-01 3.79590e+01 61.234  9.52124e-01  1.73433e+00  0.00000e+00 0.00000e+00 4.52954e+01 61.234  7.33641e+00 61.234  0.6942 
1 1 1 4   86  10 o 11 3.77306e+00 1.07513e+00 9.41050e+01 227.939 -3.74805e+00 -4.15381e+00 0.00000e+00 0.00000e+00 3.29528e+01 227.939 6.11521e+01 47.940  0.9056 
1 1 1 4   86  11 f 0  4.16137e+00 1.17501e+00 1.04388e+02 191.103 -6.84744e+00 -1.34374e+00 0.00000e+00 0.00000e+00 3.87283e+01 191.103 6.56601e+01 11.103  0.9253 
1 1 1 4   86  12 o 10 3.16501e+00 1.03207e+00 3.13845e+01 16.197  1.85636e+00  5.39232e-01  0.00000e+00 0.00000e+00 4.93283e+01 16.197  1.79437e+01 16.197  0.6865 
1 1 1 4   86  13 o 14 3.83871e+00 1.19649e+00 9.46220e+01 5.168   6.82093e+00  6.16968e-01  0.00000e+00 0.00000e+00 3.70358e+01 5.168   5.75862e+01 185.168 0.9238 
1 1 1 4   86  14 o 9  3.86321e+00 1.22114e+00 4.52432e+01 75.345  9.55913e-01  3.65553e+00  0.00000e+00 0.00000e+00 7.72232e+01 75.345  3.19800e+01 75.345  0.8544 
1 1 1 4   87  0  o 10 1.15196e+01 4.76240e-01 2.26234e+02 81.028  5.53261e+00  3.50412e+01  0.00000e+00 0.00000e+00 1.96571e+02 81.028  2.96629e+01 261.028 0.9858 
1 1 1 4   87  1  o 19 1.91808e+01 4.87243e-01 3.08465e+02 210.564 -6.50576e+01 -3.84196e+01 0.00000e+00 0.00000e+00 4.01017e+02 210.564 9.25515e+01 210.564 0.9934 
1 1 1 4   87  2  o 19 1.03327e+01 4.99888e-01 1.76136e+02 115.319 -1.09168e+01 2.30751e+01  0.00000e+00 0.00000e+00 2.01030e+02 115.319 2.48936e+01 115.319 0.9802 
1 1 1 4   87  3  o 2  1.54393e+01 5.07611e-01 2.93961e+02 27.758  5.75851e+01  3.03075e+01  0.00000e+00 0.00000e+00 2.76555e+02 27.758  1.74057e+01 207.758 0.9923 
1 1 1 4   87  4  f 0  8.07880e+00 5.93453e-01 1.77591e+02 228.105 -1.32484e+01 -1.47682e+01 0.00000e+00 0.00000e+00 1.15560e+02 228.105 6.20306e+01 48.105  0.9745 
1 1 1 4   87  5  o 11 6.73108e+00 6.71087e-01 1.02768e+02 234.594 -5.77716e+00 -8.12742e+00 0.00000e+00 0.00000e+00 1.34931e+02 234.594 3.21632e+01 234.594 0.9484 
1 1 1 4   87  6  o 4  1.01516e+01 7.17961e-01 1.49931e+02 31.789  1.99791e+01  1.23822e+01  0.00000e+00 0.00000e+00 2.19848e+02 31.789  6.99170e+01 31.789  0.9785 
1 1 1 4   87  7  o 6  2.76472e+00 7.96282e-01 8.36649e+01 305.492 2.20064e+00  -3.08610e+00 0.00000e+00 0.00000e+00 4.30657e+00 305.492 7.93583e+01 125.492 0.8549 
1 1 1 4   87  8  o 1  4.68496e+00 1.00083e+00 1.30176e+02 302.971 5.13006e+00  -7.90826e+00 0.00000e+00 0.00000e+00 3.46129e+01 302.971 9.55636e+01 122.971 0.9454 
1 1 1 4   87  9  o 17 1.14371e+01 7.58167e-01 2.05999e+02 207.857 -3.50464e+01 -1.85225e+01 0.00000e+00 0.00000e+00 2.13984e+02 207.857 7.98502e+00 207.857 0.9873 
1 1 1 4   87  10 o 4  3.60224e+00 1.02789e+00 1.06046e+02 168.495 -6.23677e+00 1.26950e+00  0.00000e+00 0.00000e+00 1.68521e+01 168.495 8.91941e+01 348.495 0.9177 
1 1 1 4   87  11 o 16 7.01112e+00 1.17219e+00 1.46034e+02 334.330 1.56578e+01  -7.52547e+00 0.00000e+00 0.00000e+00 1.06886e+02 334.330 3.91484e+01 154.330 0.9708 
1 1 1 4   87  12 o 17 4.87348e+00 1.25208e+00 4.26356e+01 223.422 -2.65823e+00 -2.51570e+00 0.00000e+00 0.00000e+00 1.11041e+02 223.422 6.84053e+01 223.422 0.8490 
1 1 1 4   87  13 o 12 4.23781e+00 1.23016e+00 6.83015e+01 120.776 -3.02439e+00 5.07836e+00  0.00000e+00 0.00000e+00 7.49881e+01 120.776 6.68654e+00 120.776 0.9109 
1 1 1 4   87  14 o 2  2.95189e+00 1.00923e+00 8.05139e+01 329.275 5.30255e+00  -3.15161e+00 0.00000e+00 0.00000e+00 1.96621e+01 329.275 6.08518e+01 149.275 0.9149 
1 1 1 4   88  0  o 17 5.07940e+00 6.81673e-01 8.36784e+01 114.881 -2.37342e+00 5.11763e+00  0.00000e+00 0.00000e+00 8.76927e+01 114.881 4.01424e+00 114.881 0.9064 
1 1 1 4   88  1  o 14 9.90353e+00 5.64650e-01 2.27477e+02 54.638  1.71721e+01  2.41977e+01  0.00000e+00 0.00000e+00 1.34939e+02 54.638  9.25379e+01 234.638 0.9830 
1 1 1 4   88  2  o 9  3.88502e+00 7.58888e-01 7.15379e+01 0.468   3.67219e+00  2.99821e-02  0.00000e+00 0.00000e+00 5.13511e+01 0.468   2.01868e+01 180.468 0.8496 
1 1 1 4   88  3  f 0  3.44902e+00 7.81241e-01 1.01304e+02 34.527  3.92784e+00  2.70229e+00  0.00000e+00 0.00000e+00 1.26845e+01 34.527  8.86192e+01 214.527 0.8877 
1 1 1 4   88  4  o 12 2.56523e+00 7.45729e-01 9.57324e+01 128.883 -2.21595e+00 2.74792e+00  0.00000e+00 0.00000e+00 1.52588e+01 308.883 1.10991e+02 308.883 0.8427 
1 1 1 4   88  5  o 15 4.93374e+00 7.66399e-01 7.30873e+01 255.336 -1.41868e+00 -5.42173e+00 0.00000e+00 0.00000e+00 9.32550e+01 255.336 2.01677e+01 255.336 0.9057 
1 1 1 4   88  6  o 19 1.03053e+01 7.50207e-01 1.65184e+02 303.581 1.44159e+01  -2.17133e+01 0.00000e+00 0.00000e+00 2.10924e+02 303.581 4.57403e+01 303.581 0.9806 
1 1 1 4   88  7  o 2  4.49176e+00 9.20590e-01 8.76914e+01 165.419 -5.97512e+00 1.55433e+00  0.00000e+00 0.00000e+00 6.52325e+01 165.419 2.24589e+01 345.418 0.9150 
1 1 1 4   88  8  o 1  7.04613e+00 8.77591e-01 1.07651e+02 314.768 9.06920e+00  -9.14285e+00 0.00000e+00 0.00000e+00 1.44058e+02 314.768 3.64076e+01 314.768 0.9604 
1 1 1 4   88  9  o 11 3.65953e+00 9.84221e-01 3.05584e+01 276.889 2.15318e-01  -1.78204e+00 0.00000e+00 0.00000e+00 5.93982e+01 276.889 2.88398e+01 276.889 0.6611 
1 1 1 4   88  10 o 3  7.72188e+00 1.02213e+00 1.44780e+02 134.585 -1.38664e+01 1.40686e+01  0.00000e+00 0.00000e+00 1.34872e+02 134.585 9.90820e+00 314.585 0.9744 
1 1 1 4   88  11 o 7  6.57196e+00 1.22132e+00 4.96807e+01 103.201 -1.21544e+00 5.18157e+00  0.00000e+00 0.00000e+00 1.70146e+02 103.201 1.20465e+02 103.201 0.9004 
1 1 1 4   88  12 o 3  1.04504e+01 1.15431e+00 1.64259e+02 290.626 1.11103e+01  -2.95174e+01 0.00000e+00 0.00000e+00 2.17572e+02 290.626 5.33125e+01 290.626 0.9840 
1 1 1 4   88  13 o 19 3.53486e+00 1.11813e+00 3.47376e+01 111.869 -9.75997e-01 2.43162e+00  0.00000e+00 0.00000e+00 6.72448e+01 111.869 3.25072e+01 111.869 0.7775 
1 1 1 4   88  14 o 8  4.13764e+00 1.26998e+00 6.35111e+01 323.218 4.33916e+00  -3.24397e+00 0.00000e+00 0.00000e+00 7.49296e+01 323.218 1.14184e+01 323.218 0.9022 
1 1 1 4   89  0  o 18 9.27741e+00 5.21532e-01 2.05748e+02 91.229  -5.84243e-01 2.72314e+01  0.00000e+00 0.00000e+00 1.33099e+02 91.229  7.26497e+01 271.229 0.9815 
1 1 1 4   89  1  o 17 3.83081e+00 7.16637e-01 9.23653e+01 172.851 -4.73637e+00 5.94043e-01  0.00000e+00 0.00000e+00 3.42213e+01 172.851 5.81440e+01 352.851 0.8879 
1 1 1 4   89  2  o 12 3.86494e+00 7.61407e-01 6.89012e+01 52.602  2.22377e+00  2.90882e+00  0.00000e+00 0.00000e+00 5.32495e+01 52.602  1.56517e+01 232.602 0.8491 
1 1 1 4   89  3  o 18 6.33613e+00 6.58648e-01 9.52900e+01 50.102  5.42779e+00  6.49207e+00  0.00000e+00 0.00000e+00 1.26142e+02 50.102  3.08515e+01 50.102  0.9389 
1 1 1 4   89  4  o 8  9.20196e+00 5.70441e-01 1.68264e+02 287.788 6.92774e+00  -2.15933e+01 0.00000e+00 0.00000e+00 1.66588e+02 287.788 1.67620e+00 107.788 0.9777 
1 1 1 4   89  5  f 0  7.81242e+00 6.23015e-01 1.31305e+02 123.813 -9.15118e+00 1.36632e+01  0.00000e+00 0.00000e+00 1.50452e+02 123.813 1.91470e+01 123.813 0.9691 
1 1 1 4   89  6  o 6  6.04371e+00 8.59437e-01 1.13114e+02 17.007  9.26285e+00  2.83323e+00  0.00000e+00 0.00000e+00 9.98191e+01 17.007  1.32951e+01 197.007 0.9469 
1 1 1 4   89  7  o 9  8.38064e+00 7.09100e-01 1.37668e+02 209.606 -1.77583e+01 -1.00904e+01 0.00000e+00 0.00000e+00 1.66361e+02 209.606 2.86934e+01 209.606 0.9752 
1 1 1 4   89  8  o 6  2.69327e+00 8.13999e-01 3.86980e+01 82.987  2.19919e-01  1.78787e+00  0.00000e+00 0.00000e+00 2.76376e+01 82.987  1.10604e+01 262.988 0.6623 
1 1 1 4   89  9  o 13 9.40068e+00 8.23735e-01 1.76271e+02 153.671 -2.51573e+01 1.24492e+01  0.00000e+00 0.00000e+00 1.66920e+02 153.671 9.35108e+00 333.671 0.9820 
1 1 1 4   89  10 o 4  3.51578e+00 1.03155e+00 7.37837e+01 181.762 -4.60623e+00 -1.41739e-01 0.00000e+00 0.00000e+00 4.16332e+01 181.762 3.21505e+01 1.763   0.8834 
1 1 1 4   89  11 o 18 5.07871e+00 1.20625e+00 6.39241e+01 271.747 1.61602e-01  -5.29875e+00 0.00000e+00 0.00000e+00 1.05833e+02 271.747 4.19088e+01 271.747 0.8999 
1 1 1 4   89  12 f 0  4.54388e+00 1.24395e+00 8.39690e+01 193.732 -6.66359e+00 -1.62841e+00 0.00000e+00 0.00000e+00 7.18773e+01 193.732 1.20917e+01 13.732  0.9239 
1 1 1 4   89  13 o 3  5.31644e+00 1.37625e+00 6.28291e+01 191.044 -5.95363e+00 -1.16200e+00 0.00000e+00 0.00000e+00 1.17322e+02 191.044 5.44932e+01 191.044 0.9134 
1 1 1 4   90  0  o 7  3.77999e+00 7.29189e-01 4.21741e+01 154.086 -1.99478e+00 9.69198e-01  0.00000e+00 0.00000e+00 6.05553e+01 154.086 1.83812e+01 154.086 0.7305 
1 1 1 4   90  1  o 1  8.09263e+00 5.64118e-01 1.35694e+02 356.063 1.52724e+01  -1.05102e+00 0.00000e+00 0.00000e+00 1.55420e+02 356.063 1.97259e+01 356.063 0.9668 
1 1 1 4   90  2  o 2  5.64914e+00 6.46726e-01 4.33281e+01 171.748 -3.40793e+00 4.94230e-01  0.00000e+00 0.00000e+00 1.32853e+02 171.748 8.95254e+01 171.748 0.8381 
1 1 1 4   90  3  o 19 1.05037e+01 5.34311e-01 2.18371e+02 53.157  2.07390e+01  2.76796e+01  0.00000e+00 0.00000e+00 1.66804e+02 53.157  5.15675e+01 233.157 0.9854 
1 1 1 4   90  4  o 17 2.35028e+00 7.24466e-01 7.64218e+01 155.400 -2.51964e+00 1.15356e+00  0.00000e+00 0.00000e+00 7.19866e+00 335.400 8.36205e+01 335.400 0.7915 
1 1 1 4   90  5  o 6  1.37500e+01 5.61120e-01 2.29244e+02 279.072 8.18890e+00  -5.12858e+01 0.00000e+00 0.00000e+00 2.77391e+02 279.072 4.81467e+01 279.072 0.9903 
1 1 1 4   90  6  o 10 1.46752e+01 6.61545e-01 2.24023e+02 165.184 -5.09072e+01 1.34653e+01  0.00000e+00 0.00000e+00 3.16677e+02 165.184 9.26541e+01 165.184 0.9905 
1 1 1 4   90  7  o 16 9.01288e+00 7.14143e-01 1.55979e+02 327.293 2.12714e+01  -1.36596e+01 0.00000e+00 0.00000e+00 1.72518e+02 327.293 1.65393e+01 327.293 0.9800 
1 1 1 4   90  8  o 11 1.38005e+01 6.79381e-01 2.21050e+02 118.458 -2.53706e+01 4.68088e+01  0.00000e+00 0.00000e+00 2.87206e+02 118.458 6.61562e+01 118.458 0.9906 
1 1 1 4   90  9  o 17 4.08881e+00 1.06541e+00 8.69319e+01 280.898 1.06316e+00  -5.52181e+00 0.00000e+00 0.00000e+00 5.07611e+01 280.898 3.61707e+01 100.898 0.9061 
1 1 1 4   90  10 o 10 8.39910e+00 1.01202e+00 1.35113e+02 96.563  -2.33021e+00 2.02543e+01  0.00000e+00 0.00000e+00 1.69169e+02 96.563  3.40561e+01 96.563  0.9752 
1 1 1 4   90  11 o 7  4.45653e+00 1.17714e+00 7.61117e+01 90.559  -5.78027e-02 5.92027e+00  0.00000e+00 0.00000e+00 7.46619e+01 90.559  1.44977e+00 270.559 0.9111 
1 1 1 4   90  12 o 17 6.12698e+00 1.30616e+00 1.25934e+02 280.331 2.34344e+00  -1.28551e+01 0.00000e+00 0.00000e+00 9.25732e+01 280.331 3.33613e+01 100.331 0.9609 
1 1 1 4   90  13 o 16 3.07205e+00 1.02599e+00 5.74592e+01 345.417 4.45190e+00  -1.15818e+00 0.00000e+00 0.00000e+00 4.31761e+01 345.417 1.42831e+01 165.417 0.8832 
1 1 1 4   91  0  o 6  6.81363e+00 5.85368e-01 1.08070e+02 295.459 4.53927e+00  -9.53415e+00 0.00000e+00 0.00000e+00 1.33048e+02 295.459 2.49772e+01 295.459 0.9514 
1 1 1 4   91  1  o 16 6.36555e+00 6.32027e-01 7.23865e+01 77.186  1.53216e+00  6.73611e+00  0.00000e+00 0.00000e+00 1.46532e+02 77.186  7.41458e+01 77.186  0.9245 
1 1 1 4   91  2  o 12 8.70886e+00 6.34707e-01 2.02933e+02 82.551  3.34397e+00  2.55746e+01  0.00000e+00 0.00000e+00 1.14715e+02 82.551  8.82182e+01 262.551 0.9804 
1 1 1 4   91  3  o 15 9.54151e+00 5.70886e-01 2.25506e+02 242.993 -1.64219e+01 -3.22198e+01 0.00000e+00 0.00000e+00 1.24524e+02 242.993 1.00981e+02 62.993  0.9861 
1 1 1 4   91  4  o 8  4.89358e+00 8.06518e-01 1.26889e+02 124.492 -5.22079e+00 7.59853e+00  0.00000e+00 0.00000e+00 4.49807e+01 124.492 8.19083e+01 304.492 0.9441 
1 1 1 4   91  5  o 19 3.62190e+00 8.75169e-01 3.49062e+01 359.379 1.77839e+00  -1.92849e-02 0.00000e+00 0.00000e+00 5.37190e+01 359.379 1.88128e+01 359.379 0.6578 
1 1 1 4   91  6  o 11 3.05425e+00 8.21590e-01 6.39552e+01 118.203 -1.42944e+00 2.66554e+00  0.00000e+00 0.00000e+00 2.82547e+01 118.203 3.57004e+01 298.203 0.8118 
1 1 1 4   91  7  o 18 2.72978e+00 8.37963e-01 5.13494e+01 305.483 1.40981e+00  -1.97772e+00 0.00000e+00 0.00000e+00 2.54861e+01 305.483 2.58634e+01 125.483 0.7570 
1 1 1 4   91  8  o 9  5.86152e+00 9.92338e-01 1.20217e+02 157.226 -1.03816e+01 4.35843e+00  0.00000e+00 0.00000e+00 8.77461e+01 157.226 3.24706e+01 337.226 0.9545 
1 1 1 4   91  9  o 1  1.09956e+01 7.76512e-01 2.08566e+02 350.590 4.45590e+01  -7.38468e+00 0.00000e+00 0.00000e+00 1.95449e+02 350.590 1.31166e+01 170.590 0.9889 
1 1 1 4   91  10 o 14 5.03904e+00 1.15757e+00 1.69654e+02 178.804 -1.46512e+01 3.05765e-01  0.00000e+00 0.00000e+00 1.10009e+01 178.804 1.58653e+02 358.804 0.9653 
1 1 1 4   91  11 o 10 3.41116e+00 1.05257e+00 1.05099e+02 341.508 7.05344e+00  -2.35893e+00 0.00000e+00 0.00000e+00 1.26864e+01 341.508 9.24124e+01 161.508 0.9301 
1 1 1 4   91  12 o 17 4.80649e+00 1.28290e+00 1.24591e+02 180.656 -1.07227e+01 -1.22873e-01 0.00000e+00 0.00000e+00 4.52164e+01 180.656 7.93748e+01 0.657   0.9522 
1 1 1 4   91  13 o 3  3.32776e+00 1.07186e+00 3.70078e+01 155.410 -2.80569e+00 1.28394e+00  0.00000e+00 0.00000e+00 6.36985e+01 155.410 2.66908e+01 155.410 0.8161 
1 1 1 4   92  0  o 8  3.40805e+00 7.87158e-01 4.40192e+01 148.991 -1.74350e+00 1.04799e+00  0.00000e+00 0.00000e+00 4.51129e+01 148.991 1.09368e+00 148.991 0.7033 
1 1 1 4   92  1  o 13 8.81954e+00 5.52706e-01 1.23347e+02 74.821  4.19056e+00  1.54464e+01  0.00000e+00 0.00000e+00 1.94239e+02 74.821  7.08919e+01 74.821  0.9682 
1 1 1 4   92  2  o 4  3.61226e+00 7.84622e-01 7.39447e+01 202.000 -3.81573e+00 -1.54167e+00 0.00000e+00 0.00000e+00 4.26480e+01 202.000 3.12967e+01 22.000  0.8678 
1 1 1 4   92  3  f 0  5.04872e+00 7.34199e-01 1.54417e+02 311.988 7.99737e+00  -8.88573e+00 0.00000e+00 0.00000e+00 2.53294e+01 311.988 1.29087e+02 131.988 0.9572 
1 1 1 4   92  4  o 15 9.49405e+00 6.09504e-01 1.72668e+02 120.072 -1.32729e+01 2.29232e+01  0.00000e+00 0.00000e+00 1.73701e+02 120.072 1.03232e+00 120.072 0.9809 
1 1 1 4   92  5  o 19 2.74083e+00 8.05428e-01 6.76124e+01 162.316 -2.66030e+00 8.48204e-01  0.00000e+00 0.00000e+00 1.32515e+01 162.316 5.43609e+01 342.316 0.7934 
1 1 1 4   92  6  o 3  3.31312e+00 8.62231e-01 1.24079e+02 184.772 -6.68571e+00 -5.58182e-01 0.00000e+00 0.00000e+00 1.04865e+01 4.772   1.34565e+02 4.772   0.9221 
1 1 1 4   92  7  o 5  7.52193e+00 7.93353e-01 1.25958e+02 92.017  -5.81814e-01 1.65186e+01  0.00000e+00 0.00000e+00 1.45054e+02 92.017  1.90958e+01 92.017  0.9693 
1 1 1 4   92  8  o 1  8.46844e+00 8.70053e-01 1.55811e+02 226.923 -1.48998e+01 -1.59349e+01 0.00000e+00 0.00000e+00 1.51586e+02 226.923 4.22465e+00 46.923  0.9768 
1 1 1 4   92  9  f 0  1.04952e+01 8.35143e-01 2.59821e+02 44.592  3.83776e+01  3.78354e+01  0.00000e+00 0.00000e+00 1.26419e+02 44.592  1.33402e+02 224.592 0.9907 
1 1 1 4   92  10 o 5  3.40938e+00 1.01886e+00 7.12409e+01 240.799 -2.23688e+00 -4.00226e+00 0.00000e+00 0.00000e+00 4.05167e+01 240.799 3.07242e+01 60.799  0.8828 
1 1 1 4   92  11 o 8  4.18708e+00 1.17129e+00 3.89980e+01 70.647  1.05238e+00  2.99630e+00  0.00000e+00 0.00000e+00 8.87698e+01 70.647  4.97718e+01 70.647  0.8222 
1 1 1 4   92  12 o 19 3.11762e+00 1.01625e+00 1.27383e+01 333.911 8.67938e-01  -4.24986e-01 0.00000e+00 0.00000e+00 3.74935e+01 333.911 2.47552e+01 333.911 0.4344 
1 1 1 4   92  13 o 17 3.08445e+00 1.02252e+00 1.70931e+01 13.925  1.40436e+00  3.48187e-01  0.00000e+00 0.00000e+00 4.95394e+01 13.925  3.24462e+01 13.925  0.5827 
1 1 1 4   93  0  o 6  5.52289e+00 6.71382e-01 4.82000e+01 359.012 4.19529e+00  -7.23164e-02 0.00000e+00 0.00000e+00 1.30564e+02 359.012 8.23639e+01 359.012 0.8707 
1 1 1 4   93  1  o 18 3.18729e+00 7.88602e-01 8.24343e+01 301.444 2.05551e+00  -3.36173e+00 0.00000e+00 0.00000e+00 1.96231e+01 301.444 6.28112e+01 121.444 0.8612 
1 1 1 4   93  2  o 11 9.25878e+00 5.40273e-01 1.48998e+02 92.810  -1.11541e+00 2.27215e+01  0.00000e+00 0.00000e+00 1.87625e+02 92.810  3.86275e+01 92.810  0.9778 
1 1 1 4   93  3  o 14 3.28640e+00 7.93130e-01 4.12306e+01 322.544 1.61566e+00  -1.23776e+00 0.00000e+00 0.00000e+00 4.47368e+01 322.544 3.50619e+00 322.544 0.7035 
1 1 1 4   93  4  o 6  2.52620e+00 7.54971e-01 6.71233e+01 52.281  1.73346e+00  2.24132e+00  0.00000e+00 0.00000e+00 7.72705e+00 52.281  5.93963e+01 232.281 0.7969 
1 1 1 4   93  5  o 3  1.06661e+01 6.13024e-01 1.90250e+02 97.996  -4.78171e+00 3.40394e+01  0.00000e+00 0.00000e+00 2.00484e+02 97.996  1.02342e+01 97.996  0.9853 
1 1 1 4   93  6  o 3  3.45799e+00 8.92297e-01 9.09069e+01 349.001 4.78813e+00  -9.30645e-01 0.00000e+00 0.00000e+00 2.35527e+01 349.001 6.73541e+01 169.001 0.8905 
1 1 1 4   93  7  o 14 1.07599e+01 6.81674e-01 1.51751e+02 54.042  1.84429e+01  2.54241e+01  0.00000e+00 0.00000e+00 2.41697e+02 54.042  8.99456e+01 54.042  0.9840 
1 1 1 4   93  8  o 13 8.68465e+00 1.06886e+00 1.29798e+02 247.386 -6.84293e+00 -1.64275e+01 0.00000e+00 0.00000e+00 1.83651e+02 247.386 5.38531e+01 247.386 0.9715 
1 1 1 4   93  9  o 7  5.70896e+00 1.11146e+00 2.52004e+01 219.791 -1.93799e+00 -1.61418e+00 0.00000e+00 0.00000e+00 1.37502e+02 219.791 1.12302e+02 219.791 0.7674 
1 1 1 4   93  10 o 5  5.34334e+00 1.18686e+00 7.49064e+01 177.922 -6.61730e+00 2.40079e-01  0.00000e+00 0.00000e+00 1.07792e+02 177.922 3.28860e+01 177.922 0.9210 
1 1 1 4   93  11 o 19 5.04198e+00 1.21298e+00 9.65932e+01 200.704 -8.46661e+00 -3.20001e+00 0.00000e+00 0.00000e+00 7.98303e+01 200.704 1.67628e+01 20.704  0.9430 
1 1 1 4   93  12 o 4  3.00421e+00 9.84573e-01 7.38456e+01 179.783 -5.43170e+00 2.05941e-02  0.00000e+00 0.00000e+00 2.67044e+01 179.783 4.71412e+01 359.783 0.9025 
1 1 1 4   93  13 o 1  4.15781e+00 1.21354e+00 8.71672e+01 321.460 6.50112e+00  -5.17858e+00 0.00000e+00 0.00000e+00 5.73407e+01 321.460 2.98265e+01 141.460 0.9378 
1 1 1 4   94  0  o 18 7.41618e+00 5.99596e-01 1.15653e+02 238.755 -7.18095e+00 -1.18361e+01 0.00000e+00 0.00000e+00 1.49834e+02 238.755 3.41805e+01 238.755 0.9632 
1 1 1 4   94  1  o 9  9.76184e+00 5.76660e-01 1.57396e+02 60.820  1.22673e+01  2.19681e+01  0.00000e+00 0.00000e+00 1.98183e+02 60.820  4.07862e+01 60.820  0.9799 
1 1 1 4   94  2  o 18 7.73562e+00 6.48805e-01 1.25784e+02 250.594 -5.15279e+00 -1.46276e+01 0.00000e+00 0.00000e+00 1.52351e+02 250.594 2.65661e+01 250.594 0.9672 
1 1 1 4   94  3  o 19 6.66124e+00 6.80525e-01 1.15060e+02 340.809 1.10506e+01  -3.84635e+00 0.00000e+00 0.00000e+00 1.21739e+02 340.809 6.67910e+00 340.809 0.9563 
1 1 1 4   94  4  o 13 3.67133e+00 8.70913e-01 1.06872e+02 123.741 -3.50575e+00 5.24846e+00  0.00000e+00 0.00000e+00 1.82665e+01 123.741 8.86054e+01 303.741 0.9169 
1 1 1 4   94  5  f 0  3.08791e+00 8.48921e-01 6.66973e+01 250.431 -1.13328e+00 -3.18806e+00 0.00000e+00 0.00000e+00 2.91127e+01 250.431 3.75845e+01 70.431  0.8348 
1 1 1 4   94  6  o 7  2.60016e+00 7.45448e-01 7.28413e+01 324.959 2.77477e+00  -1.94585e+00 0.00000e+00 0.00000e+00 7.85103e+00 324.959 6.49903e+01 144.959 0.8351 
1 1 1 4   94  7  o 14 1.12329e+01 6.84247e-01 1.91601e+02 12.338  4.21017e+01  9.20869e+00  0.00000e+00 0.00000e+00 2.20865e+02 12.338  2.92642e+01 12.338  0.9883 
1 1 1 4   94  8  o 14 5.73259e+00 1.40930e+00 1.10540e+02 150.471 -7.21029e+00 4.08419e+00  0.00000e+00 0.00000e+00 8.90874e+01 150.471 2.14523e+01 330.471 0.9376 
1 1 1 4   94  9  o 7  6.41710e+00 1.09160e+00 1.26091e+02 9.452   1.34700e+01  2.24263e+00  0.00000e+00 0.00000e+00 1.03272e+02 9.452   2.28192e+01 189.452 0.9627 
1 1 1 4   94  10 o 17 6.41586e+00 1.11593e+00 8.70247e+01 91.584  -2.97826e-01 1.07714e+01  0.00000e+00 0.00000e+00 1.39756e+02 91.584  5.27309e+01 91.584  0.9524 
1 1 1 4   94  11 o 15 3.40250e+00 1.03329e+00 4.47346e+01 220.283 -2.46028e+00 -2.08519e+00 0.00000e+00 0.00000e+00 5.94375e+01 220.283 1.47029e+01 220.283 0.8253 
1 1 1 4   94  12 o 19 3.79339e+00 1.14613e+00 5.79572e+01 6.877   4.82354e+00  5.81723e-01  0.00000e+00 0.00000e+00 6.72128e+01 6.877   9.25565e+00 6.877   0.8900 
1 1 1 4   94  13 f 0  3.37907e+00 1.09097e+00 6.87036e+01 72.982  1.72378e+00  5.63199e+00  0.00000e+00 0.00000e+00 4.53098e+01 72.982  2.33938e+01 252.982 0.9106 
1 1 1 4   95  0  o 7  8.92191e+00 5.58584e-01 1.60356e+02 143.022 -1.88004e+01 1.41557e+01  0.00000e+00 0.00000e+00 1.64035e+02 143.022 3.67905e+00 143.022 0.9785 
1 1 1 4   95  1  o 10 7.49475e+00 6.22679e-01 1.43800e+02 26.026  1.62877e+01  7.95337e+00  0.00000e+00 0.00000e+00 1.26925e+02 26.026  1.68744e+01 206.026 0.9720 
1 1 1 4   95  2  o 16 4.09603e+00 8.08999e-01 6.48258e+01 3.300   3.83671e+00  2.21229e-01  0.00000e+00 0.00000e+00 6.56646e+01 3.300   8.38734e-01 3.300   0.8572 
1 1 1 4   95  3  o 4  9.65584e+00 5.70504e-01 1.10556e+02 353.583 1.75579e+01  -1.97483e+00 0.00000e+00 0.00000e+00 2.37995e+02 353.583 1.27439e+02 353.583 0.9713 
1 1 1 4   95  4  f 0  4.89410e+00 7.86586e-01 3.95110e+01 286.416 9.31257e-01  -3.16084e+00 0.00000e+00 0.00000e+00 1.11384e+02 286.416 7.18732e+01 286.416 0.8296 
1 1 1 4   95  5  o 5  3.00734e+00 8.38731e-01 5.72583e+01 292.382 1.13677e+00  -2.76046e+00 0.00000e+00 0.00000e+00 3.31352e+01 292.382 2.41231e+01 112.382 0.8089 
1 1 1 4   95  6  o 4  4.70551e+00 8.88451e-01 1.44499e+02 359.756 1.07216e+01  -4.57089e-02 0.00000e+00 0.00000e+00 2.19578e+01 359.756 1.22541e+02 179.756 0.9522 
1 1 1 4   95  7  o 9  7.00036e+00 8.50206e-01 1.06418e+02 132.303 -8.87081e+00 9.74793e+00  0.00000e+00 0.00000e+00 1.43533e+02 132.303 3.71149e+01 132.303 0.9613 
1 1 1 4   95  8  o 12 3.23347e+00 1.03659e+00 8.44686e+01 87.358  2.18542e-01  4.73555e+00  0.00000e+00 0.00000e+00 2.20304e+01 87.358  6.24382e+01 267.358 0.8870 
1 1 1 4   95  9  o 19 4.30731e+00 1.01058e+00 6.79630e+01 237.956 -2.93335e+00 -4.68632e+00 0.00000e+00 0.00000e+00 7.66285e+01 237.956 8.66554e+00 237.956 0.9044 
1 1 1 4   95  10 o 5  2.72124e+00 8.97250e-01 1.19570e+02 306.088 4.67477e+00  -6.41347e+00 0.00000e+00 0.00000e+00 2.51956e+01 126.088 1.44766e+02 126.088 0.9347 
1 1 1 4   95  11 f 0  1.42394e+01 8.68763e-01 2.18190e+02 128.018 -4.86723e+01 6.22572e+01  0.00000e+00 0.00000e+00 3.06540e+02 128.018 8.83494e+01 128.018 0.9937 
1 1 1 4   95  12 o 6  4.84318e+00 1.27395e+00 9.89050e+01 64.542  4.23177e+00  8.88884e+00  0.00000e+00 0.00000e+00 7.12341e+01 64.542  2.76708e+01 244.542 0.9478 
1 1 1 4   95  13 o 9  3.00162e+00 1.00820e+00 8.79043e+01 267.954 -2.78089e-01 -7.78298e+00 0.00000e+00 0.00000e+00 1.58804e+01 267.954 7.20238e+01 87.954  0.9334 
1 1 1 4   96  0  o 7  7.90658e+00 5.68601e-01 1.56143e+02 66.028  7.96067e+00  1.79031e+01  0.00000e+00 0.00000e+00 1.29971e+02 66.028  2.61720e+01 246.028 0.9741 
1 1 1 4   96  1  o 19 1.43665e+01 5.02149e-01 2.34701e+02 343.470 5.98376e+01  -1.77592e+01 0.00000e+00 0.00000e+00 2.94755e+02 343.470 6.00536e+01 343.470 0.9920 
1 1 1 4   96  2  o 17 6.17337e+00 6.78666e-01 1.29540e+02 224.495 -9.05906e+00 -8.90084e+00 0.00000e+00 0.00000e+00 9.06074e+01 224.495 3.89325e+01 44.495  0.9598 
1 1 1 4   96  3  o 19 3.93612e+00 8.65182e-01 2.78261e+01 134.555 -1.16388e+00 1.18209e+00  0.00000e+00 0.00000e+00 6.47531e+01 134.555 3.69270e+01 134.555 0.6330 
1 1 1 4   96  4  o 9  9.84563e+00 5.90952e-01 1.64875e+02 13.380  2.99778e+01  7.13085e+00  0.00000e+00 0.00000e+00 1.94937e+02 13.380  3.00616e+01 13.380  0.9836 
1 1 1 4   96  5  o 13 3.69771e+00 9.03670e-01 6.47393e+01 80.144  6.74354e-01  3.88165e+00  0.00000e+00 0.00000e+00 5.35562e+01 80.144  1.11830e+01 260.144 0.8612 
1 1 1 4   96  6  o 4  7.18736e+00 7.83168e-01 1.01611e+02 170.420 -1.29241e+01 2.18123e+00  0.00000e+00 0.00000e+00 1.54951e+02 170.420 5.33392e+01 170.420 0.9611 
1 1 1 4   96  7  o 10 4.27315e+00 9.93441e-01 1.35929e+02 299.221 4.75539e+00  -8.50152e+00 0.00000e+00 0.00000e+00 1.43699e+01 299.221 1.21559e+02 119.221 0.9472 
1 1 1 4   96  8  o 8  6.08005e+00 1.18853e+00 1.54764e+02 41.549  1.16691e+01  1.03418e+01  0.00000e+00 0.00000e+00 6.35824e+01 41.549  9.11815e+01 221.549 0.9674 
1 1 1 4   96  9  o 19 8.78024e+00 9.23998e-01 1.33938e+02 221.579 -1.75666e+01 -1.55850e+01 0.00000e+00 0.00000e+00 1.84878e+02 221.579 5.09405e+01 221.579 0.9785 
1 1 1 4   96  10 o 14 3.34549e+00 9.98989e-01 7.42646e+01 84.959  4.52233e-01  5.12676e+00  0.00000e+00 0.00000e+00 3.70107e+01 84.959  3.72539e+01 264.959 0.8967 
1 1 1 4   96  11 o 6  4.40456e+00 1.15284e+00 5.26649e+01 107.196 -1.47188e+00 4.75619e+00  0.00000e+00 0.00000e+00 9.31472e+01 107.196 4.04822e+01 107.196 0.8929 
1 1 1 4   96  12 o 17 4.36392e+00 1.21853e+00 5.99472e+01 328.755 4.74438e+00  -2.87843e+00 0.00000e+00 0.00000e+00 8.63570e+01 328.755 2.64098e+01 328.755 0.9047 
1 1 1 4   97  0  o 8  8.36636e+00 5.59978e-01 1.56480e+02 323.348 1.94761e+01  -1.44916e+01 0.00000e+00 0.00000e+00 1.47759e+02 323.348 8.72154e+00 143.348 0.9792 
1 1 1 4   97  1  o 18 2.57205e+00 7.55334e-01 7.28499e+01 113.718 -1.28261e+00 2.91940e+00  0.00000e+00 0.00000e+00 5.77569e+00 113.718 6.70742e+01 293.718 0.8230 
1 1 1 4   97  2  o 16 4.98808e+00 7.68584e-01 1.22401e+02 46.370  7.24574e+00  7.60078e+00  0.00000e+00 0.00000e+00 5.38261e+01 46.370  6.85746e+01 226.370 0.9511 
1 1 1 4   97  3  o 18 1.24086e+01 5.63763e-01 2.35228e+02 300.555 2.85076e+01  -4.82906e+01 0.00000e+00 0.00000e+00 2.21568e+02 300.555 1.36592e+01 120.555 0.9910 
1 1 1 4   97  4  o 19 5.48833e+00 7.97737e-01 8.93719e+01 300.868 4.66686e+00  -7.80752e+00 0.00000e+00 0.00000e+00 1.02928e+02 300.868 1.35564e+01 300.868 0.9433 
1 1 1 4   97  5  o 2  5.21665e+00 8.80441e-01 9.85292e+01 186.423 -8.08199e+00 -9.09783e-01 0.00000e+00 0.00000e+00 8.28791e+01 186.423 1.56501e+01 6.423   0.9363 
1 1 1 4   97  6  o 7  9.00285e+00 7.12231e-01 1.19615e+02 263.431 -2.20342e+00 -1.91356e+01 0.00000e+00 0.00000e+00 2.05889e+02 263.431 8.62735e+01 263.431 0.9737 
1 1 1 4   97  7  o 1  8.43186e+00 8.30757e-01 1.57839e+02 91.557  -7.22914e-01 2.65927e+01  0.00000e+00 0.00000e+00 1.49245e+02 91.557  8.59372e+00 271.557 0.9810 
1 1 1 4   97  8  o 13 3.03638e+00 9.32251e-01 8.34924e+01 224.388 -3.39919e+00 -3.32733e+00 0.00000e+00 0.00000e+00 1.65096e+01 224.388 6.69828e+01 44.388  0.8874 
1 1 1 4   97  9  f 0  3.25553e+00 9.73937e-01 5.30773e+01 160.350 -3.30801e+00 1.18118e+00  0.00000e+00 0.00000e+00 4.85894e+01 160.350 4.48786e+00 340.350 0.8418 
1 1 1 4   97  10 o 13 1.05610e+01 9.60380e-01 2.11830e+02 302.445 2.72230e+01  -4.28216e+01 0.00000e+00 0.00000e+00 1.75938e+02 302.445 3.58916e+01 122.445 0.9901 
1 1 1 4   97  11 o 8  5.36910e+00 1.28479e+00 1.12186e+02 78.654  2.21572e+00  1.10427e+01  0.00000e+00 0.00000e+00 7.77753e+01 78.654  3.44107e+01 258.654 0.9545 
1 1 1 4   97  12 o 15 2.29607e+00 8.07334e-01 2.22524e+01 280.931 3.15828e-01  -1.63527e+00 0.00000e+00 0.00000e+00 3.17152e+01 280.931 9.46276e+00 280.931 0.6345 
1 1 1 4   98  0  o 12 5.43114e+00 7.10390e-01 1.15775e+02 254.809 -2.91107e+00 -1.07210e+01 0.00000e+00 0.00000e+00 7.65701e+01 254.809 3.92044e+01 74.809  0.9539 
1 1 1 4   98  1  o 18 8.58308e+00 5.83245e-01 1.90502e+02 289.404 1.01078e+01  -2.86963e+01 0.00000e+00 0.00000e+00 1.22928e+02 289.404 6.75735e+01 109.404 0.9834 
1 1 1 4   98  2  o 8  2.95772e+00 7.98225e-01 1.11150e+02 306.836 3.39740e+00  -4.53551e+00 0.00000e+00 0.00000e+00 1.15456e+01 126.836 1.22696e+02 126.836 0.9069 
1 1 1 4   98  3  o 8  7.43145e+00 6.81120e-01 1.64823e+02 220.209 -1.75489e+01 -1.48348e+01 0.00000e+00 0.00000e+00 1.05074e+02 220.209 5.97495e+01 40.209  0.9780 
1 1 1 4   98  4  o 13 3.29355e+00 8.67963e-01 9.90935e+01 310.490 3.63114e+00  -4.25308e+00 0.00000e+00 0.00000e+00 1.16529e+01 310.490 8.74406e+01 130.490 0.9055 
1 1 1 4   98  5  o 4  4.37799e+00 9.32968e-01 8.60905e+01 126.422 -3.69691e+00 5.01029e+00  0.00000e+00 0.00000e+00 6.27651e+01 126.422 2.33254e+01 306.422 0.9157 
1 1 1 4   98  6  f 0  8.60879e+00 8.02698e-01 1.16701e+02 210.716 -1.62322e+01 -9.64426e+00 0.00000e+00 0.00000e+00 1.94300e+02 210.716 7.75986e+01 210.716 0.9731 
1 1 1 4   98  7  o 9  6.37405e+00 9.59696e-01 9.78008e+01 69.443  4.07851e+00  1.08757e+01  0.00000e+00 0.00000e+00 1.28342e+02 69.443  3.05409e+01 69.443  0.9559 
1 1 1 4   98  8  o 10 4.10429e+00 9.74125e-01 6.51907e+01 195.169 -5.03542e+00 -1.36521e+00 0.00000e+00 0.00000e+00 7.15867e+01 195.169 6.39599e+00 195.169 0.8982 
1 1 1 4   98  9  o 10 3.29785e+00 9.73374e-01 1.30648e+02 98.208  -1.35925e+00 9.42372e+00  0.00000e+00 0.00000e+00 1.49451e+01 278.207 1.45593e+02 278.207 0.9459 
1 1 1 4   98  10 o 17 5.14384e+00 1.20416e+00 1.14937e+02 246.937 -4.34183e+00 -1.01975e+01 0.00000e+00 0.00000e+00 6.69493e+01 246.937 4.79875e+01 66.937  0.9538 
1 1 1 4   98  11 o 2  4.20904e+00 1.17074e+00 7.49004e+01 117.564 -3.29832e+00 6.31877e+00  0.00000e+00 0.00000e+00 6.96751e+01 117.564 5.22535e+00 297.564 0.9269 
1 1 1 4   98  12 o 14 3.51637e+00 1.11222e+00 5.41691e+01 38.028  3.72743e+00  2.91508e+00  0.00000e+00 0.00000e+00 6.13183e+01 38.028  7.14917e+00 38.028  0.8868 
1 1 1 4   99  0  o 14 3.54725e+00 7.83644e-01 6.20717e+01 341.236 3.61681e+00  -1.22873e+00 0.00000e+00 0.00000e+00 5.06630e+01 341.236 1.14087e+01 161.236 0.8562 
1 1 1 4   99  1  o 14 9.13296e+00 5.74781e-01 1.37399e+02 21.073  2.09964e+01  8.09059e+00  0.00000e+00 0.00000e+00 1.94018e+02 21.073  5.66189e+01 21.073  0.9775 
1 1 1 4   99  2  o 6  8.33478e+00 5.98546e-01 1.23775e+02 68.478  7.36569e+00  1.86774e+01  0.00000e+00 0.00000e+00 1.77848e+02 68.478  5.40732e+01 68.478  0.9748 
1 1 1 4   99  3  o 5  8.32981e+00 6.60205e-01 1.96757e+02 235.699 -1.71780e+01 -2.51809e+01 0.00000e+00 0.00000e+00 1.07375e+02 235.699 8.93821e+01 55.699  0.9835 
1 1 1 4   99  4  o 18 1.27122e+01 5.86750e-01 1.94077e+02 45.192  3.48703e+01  3.51049e+01  0.00000e+00 0.00000e+00 2.73050e+02 45.192  7.89726e+01 45.192  0.9898 
1 1 1 4   99  5  o 11 6.09170e+00 8.50581e-01 1.24253e+02 163.862 -1.28636e+01 3.72208e+00  0.00000e+00 0.00000e+00 9.32531e+01 163.862 3.09997e+01 343.862 0.9619 
1 1 1 4   99  6  o 8  8.91279e+00 7.60350e-01 1.34362e+02 319.014 1.79371e+01  -1.55848e+01 0.00000e+00 0.00000e+00 1.89380e+02 319.014 5.50174e+01 319.014 0.9787 
1 1 1 4   99  7  o 5  9.66390e+00 7.47187e-01 1.56056e+02 219.831 -2.45997e+01 -2.05186e+01 0.00000e+00 0.00000e+00 1.96872e+02 219.831 4.08154e+01 219.831 0.9843 
1 1 1 4   99  8  o 9  5.11096e+00 1.10751e+00 8.89339e+01 172.852 -7.90690e+00 9.91619e-01  0.00000e+00 0.00000e+00 8.83190e+01 172.852 6.14885e-01 352.852 0.9350 
1 1 1 4   99  9  o 11 7.49416e+00 1.05886e+00 1.26349e+02 75.616  4.65578e+00  1.81540e+01  0.00000e+00 0.00000e+00 1.44014e+02 75.616  1.76647e+01 75.616  0.9729 
1 1 1 4   99  10 o 2  7.00974e+00 1.08337e+00 7.29904e+01 257.882 -2.51767e+00 -1.17262e+01 0.00000e+00 0.00000e+00 1.75741e+02 257.882 1.02751e+02 257.882 0.9574 
1 1 1 4   99  11 o 8  3.18783e+00 1.00797e+00 3.49529e+01 166.062 -2.88954e+00 7.17122e-01  0.00000e+00 0.00000e+00 6.05036e+01 166.062 2.55507e+01 166.062 0.8083 
1 1 1 4   99  12 o 7  4.24402e+00 1.25186e+00 6.60338e+01 14.658  6.15443e+00  1.60976e+00  0.00000e+00 0.00000e+00 7.81635e+01 14.658  1.21296e+01 14.658  0.9176 
1 1 1 4   100 0  o 7  2.47890e+00 7.40469e-01 5.19761e+01 149.345 -2.11793e+00 1.25526e+00  0.00000e+00 0.00000e+00 1.80066e+01 149.345 3.39694e+01 329.345 0.7608 
1 1 1 4   100 1  o 3  8.57054e+00 6.16742e-01 1.54730e+02 258.440 -5.39441e+00 -2.63720e+01 0.00000e+00 0.00000e+00 1.57379e+02 258.440 2.64859e+00 258.440 0.9812 
1 1 1 4   100 2  o 18 6.36004e+00 7.38369e-01 7.28488e+01 322.004 6.70121e+00  -5.23486e+00 0.00000e+00 0.00000e+00 1.48856e+02 322.004 7.60076e+01 322.004 0.9392 
1 1 1 4   100 3  o 1  1.26404e+01 5.78839e-01 2.33641e+02 125.621 -3.46505e+01 4.83620e+01  0.00000e+00 0.00000e+00 2.31551e+02 125.621 2.09011e+00 305.621 0.9916 
1 1 1 4   100 4  o 4  9.21155e+00 6.60568e-01 1.57625e+02 197.267 -2.54509e+01 -7.91109e+00 0.00000e+00 0.00000e+00 1.77771e+02 197.267 2.01458e+01 197.267 0.9811 
1 1 1 4   100 5  o 10 4.91428e+00 8.68563e-01 1.07636e+02 220.265 -7.29766e+00 -6.18118e+00 0.00000e+00 0.00000e+00 6.49135e+01 220.265 4.27226e+01 40.265  0.9462 
1 1 1 4   100 6  o 18 6.03630e+00 8.68776e-01 1.05683e+02 13.416  1.19878e+01  2.85945e+00  0.00000e+00 0.00000e+00 1.08992e+02 13.416  3.30981e+00 13.416  0.9585 
1 1 1 4   100 7  o 17 3.39702e+00 9.73416e-01 5.91067e+01 194.977 -3.76560e+00 -1.00738e+00 0.00000e+00 0.00000e+00 4.91958e+01 194.977 9.91083e+00 14.977  0.8595 
1 1 1 4   100 8  o 12 8.13506e+00 9.18289e-01 1.88842e+02 90.461  -2.61517e-01 3.24872e+01  0.00000e+00 0.00000e+00 1.08151e+02 90.461  8.06911e+01 270.461 0.9845 
1 1 1 4   100 9  f 0  5.08067e+00 1.13241e+00 7.53319e+01 104.883 -1.93768e+00 7.29081e+00  0.00000e+00 0.00000e+00 1.00039e+02 104.883 2.47067e+01 104.883 0.9311 
1 1 1 4   100 10 f 0  3.70268e+00 1.06820e+00 5.84564e+01 275.360 4.50795e-01  -4.80456e+00 0.00000e+00 0.00000e+00 6.35382e+01 275.360 5.08176e+00 275.360 0.8892 
1 1 1 4   100 11 o 4  3.64470e+00 1.08022e+00 6.65894e+01 257.590 -1.26365e+00 -5.74245e+00 0.00000e+00 0.00000e+00 5.63088e+01 257.590 1.02807e+01 77.590  0.9105 
1 1 1 4   100 12 o 15 2.85199e+00 9.46267e-01 5.65439e+01 77.585  1.10978e+00  5.04115e+00  0.00000e+00 0.00000e+00 3.81531e+01 77.585  1.83908e+01 257.585 0.8970 
1 1 1 4   101 0  o 10 1.05677e+01 5.58540e-01 2.01177e+02 247.295 -1.63372e+01 -3.90461e+01 0.00000e+00 0.00000e+00 1.86198e+02 247.295 1.49782e+01 67.295  0.9881 
1 1 1 4   101 1  o 12 8.92099e+00 5.94280e-01 1.64826e+02 69.907  9.12959e+00  2.49574e+01  0.00000e+00 0.00000e+00 1.59875e+02 69.907  4.95106e+00 249.907 0.9810 
1 1 1 4   101 2  o 1  3.55490e+00 8.66307e-01 5.92594e+01 298.477 1.75010e+00  -3.22639e+00 0.00000e+00 0.00000e+00 5.27978e+01 298.477 6.46167e+00 118.477 0.8495 
1 1 1 4   101 3  o 10 8.95010e+00 7.05389e-01 1.70503e+02 195.116 -2.91394e+01 -7.87115e+00 0.00000e+00 0.00000e+00 1.56044e+02 195.116 1.44589e+01 15.116  0.9833 
1 1 1 4   101 4  o 18 1.17827e+01 5.95431e-01 2.18237e+02 284.124 1.28867e+01  -5.12127e+01 0.00000e+00 0.00000e+00 2.14778e+02 284.124 3.45833e+00 104.124 0.9905 
1 1 1 4   101 5  o 6  1.26685e+01 6.50511e-01 1.52409e+02 40.370  3.09188e+01  2.62860e+01  0.00000e+00 0.00000e+00 3.11754e+02 40.370  1.59345e+02 40.370  0.9876 
1 1 1 4   101 6  o 15 6.98115e+00 8.36364e-01 1.53776e+02 183.029 -2.15842e+01 -1.14215e+00 0.00000e+00 0.00000e+00 9.91092e+01 183.029 5.46666e+01 3.029   0.9766 
1 1 1 4   101 7  o 13 3.41201e+00 9.25362e-01 5.75929e+01 196.796 -3.71501e+00 -1.12132e+00 0.00000e+00 0.00000e+00 5.10670e+01 196.796 6.52589e+00 16.796  0.8588 
1 1 1 4   101 8  o 19 6.16566e+00 1.10083e+00 1.14359e+02 55.853  8.15273e+00  1.20202e+01  0.00000e+00 0.00000e+00 1.06204e+02 55.853  8.15455e+00 235.853 0.9649 
1 1 1 4   101 9  o 10 3.28326e+00 9.54551e-01 6.61151e+01 354.407 4.86947e+00  -4.76882e-01 0.00000e+00 0.00000e+00 4.22778e+01 354.407 2.38373e+01 174.407 0.8908 
1 1 1 4   101 10 o 1  4.50436e+00 1.14270e+00 8.12890e+01 355.190 8.09813e+00  -6.81408e-01 0.00000e+00 0.00000e+00 7.49387e+01 355.190 6.35028e+00 175.190 0.9363 
1 1 1 4   101 11 o 18 9.25336e+00 1.16197e+00 1.41525e+02 175.195 -3.15800e+01 2.65486e+00  0.00000e+00 0.00000e+00 1.95642e+02 175.195 5.41170e+01 175.195 0.9841 
1 1 1 4   101 12 o 17 2.84193e+00 9.46880e-01 6.74929e+01 297.695 2.98741e+00  -5.69131e+00 0.00000e+00 0.00000e+00 2.91076e+01 297.695 3.83853e+01 117.695 0.9185 
1 1 1 4   102 0  o 12 7.23962e+00 6.62491e-01 1.45731e+02 58.812  1.05702e+01  1.74617e+01  0.00000e+00 0.00000e+00 1.16103e+02 58.812  2.96276e+01 238.812 0.9752 
1 1 1 4   102 1  o 6  4.66983e+00 7.65884e-01 9.99629e+01 292.142 3.18422e+00  -7.82516e+00 0.00000e+00 0.00000e+00 6.26502e+01 292.142 3.73127e+01 112.142 0.9388 
1 1 1 4   102 2  o 2  3.34249e+00 8.74023e-01 1.16617e+02 221.283 -5.27399e+00 -4.63050e+00 0.00000e+00 0.00000e+00 1.83689e+00 41.283  1.18454e+02 41.283  0.9257 
1 1 1 4   102 3  o 1  6.38806e+00 7.77396e-01 1.08854e+02 64.385  5.52398e+00  1.15215e+01  0.00000e+00 0.00000e+00 1.18639e+02 64.385  9.78564e+00 64.385  0.9600 
1 1 1 4   102 4  o 18 5.29727e+00 8.88491e-01 8.33160e+01 285.097 2.08226e+00  -7.71884e+00 0.00000e+00 0.00000e+00 1.00440e+02 285.097 1.71245e+01 285.097 0.9352 
1 1 1 4   102 5  o 12 1.25218e+01 6.27279e-01 2.04966e+02 144.431 -4.75506e+01 3.40038e+01  0.00000e+00 0.00000e+00 2.55460e+02 144.431 5.04944e+01 144.431 0.9914 
1 1 1 4   102 6  o 7  3.98439e+00 9.73404e-01 6.34606e+01 222.727 -3.63514e+00 -3.35753e+00 0.00000e+00 0.00000e+00 6.83578e+01 222.727 4.89728e+00 222.727 0.8922 
1 1 1 4   102 7  o 9  7.65099e+00 9.96180e-01 1.29280e+02 20.400  1.85254e+01  6.88969e+00  0.00000e+00 0.00000e+00 1.47097e+02 20.400  1.78165e+01 20.400  0.9744 
1 1 1 4   102 8  o 4  1.06829e+01 9.82199e-01 1.93403e+02 294.135 1.77184e+01  -3.95454e+01 0.00000e+00 0.00000e+00 1.97933e+02 294.135 4.52956e+00 294.135 0.9884 
1 1 1 4   102 9  o 8  8.62118e+00 9.28014e-01 1.19025e+02 147.150 -2.33866e+01 1.51007e+01  0.00000e+00 0.00000e+00 1.94591e+02 147.150 7.55657e+01 147.150 0.9819 
1 1 1 4   102 10 o 7  4.02490e+00 1.12614e+00 5.97649e+01 270.928 8.59959e-02  -5.30969e+00 0.00000e+00 0.00000e+00 7.44031e+01 270.928 1.46382e+01 270.928 0.9001 
1 1 1 4   102 11 o 1  2.79537e+00 9.23450e-01 5.98940e+01 343.428 4.83759e+00  -1.43958e+00 0.00000e+00 0.00000e+00 3.26592e+01 343.428 2.72348e+01 163.428 0.8945 
1 1 1 4   103 0  o 2  7.75783e+00 6.26447e-01 1.23322e+02 305.307 1.02865e+01  -1.45244e+01 0.00000e+00 0.00000e+00 1.56111e+02 305.307 3.27884e+01 305.307 0.9715 
1 1 1 4   103 1  o 10 5.14860e+00 7.82020e-01 1.02902e+02 265.490 -7.19569e-01 -9.12290e+00 0.00000e+00 0.00000e+00 7.72612e+01 265.490 2.56408e+01 85.490  0.9437 
1 1 1 4   103 2  o 6  8.21736e+00 6.65326e-01 1.58512e+02 19.889  2.43351e+01  8.80396e+00  0.00000e+00 0.00000e+00 1.40274e+02 19.889  1.82384e+01 199.889 0.9805 
1 1 1 4   103 3  f 0  8.36040e+00 6.55072e-01 1.75009e+02 202.765 -2.78296e+01 -1.16787e+01 0.00000e+00 0.00000e+00 1.29850e+02 202.765 4.51592e+01 22.765  0.9833 
1 1 1 4   103 4  o 14 5.32171e+00 8.88480e-01 6.55723e+01 171.099 -6.58685e+00 1.03155e+00  0.00000e+00 0.00000e+00 1.16301e+02 171.099 5.07287e+01 171.099 0.9216 
1 1 1 4   103 5  o 9  6.26647e+00 9.08295e-01 6.79706e+01 35.532  6.65858e+00  4.75516e+00  0.00000e+00 0.00000e+00 1.49679e+02 35.532  8.17086e+01 35.532  0.9367 
1 1 1 4   103 6  o 17 3.25287e+00 9.14288e-01 5.65341e+01 288.716 1.17456e+00  -3.46687e+00 0.00000e+00 0.00000e+00 4.58541e+01 288.716 1.06800e+01 108.716 0.8491 
1 1 1 4   103 7  o 6  6.09286e+00 1.03357e+00 1.09797e+02 7.996   1.39604e+01  1.96100e+00  0.00000e+00 0.00000e+00 1.07859e+02 7.996   1.93801e+00 187.996 0.9639 
1 1 1 4   103 8  o 16 9.55237e+00 8.40236e-01 1.41230e+02 243.020 -1.57176e+01 -3.08746e+01 0.00000e+00 0.00000e+00 2.07557e+02 243.020 6.63269e+01 243.020 0.9855 
1 1 1 4   103 9  o 13 2.37823e+00 7.89524e-01 3.58349e+01 340.776 2.28239e+00  -7.95895e-01 0.00000e+00 0.00000e+00 3.07303e+01 340.776 5.10456e+00 160.776 0.7557 
1 1 1 4   103 10 f 0  3.82168e+00 1.09558e+00 7.88283e+01 115.132 -3.02671e+00 6.45185e+00  0.00000e+00 0.00000e+00 5.23220e+01 115.132 2.65064e+01 295.132 0.9269 
1 1 1 4   103 11 o 18 2.60162e+00 8.73780e-01 4.92321e+01 277.797 6.21100e-01  -4.53589e+00 0.00000e+00 0.00000e+00 3.57378e+01 277.797 1.34943e+01 97.797  0.8826 
1 1 1 4   104 0  o 15 4.00308e+00 8.42572e-01 1.19519e+02 340.890 8.16478e+00  -2.82892e+00 0.00000e+00 0.00000e+00 1.99896e+01 340.890 9.95293e+01 160.890 0.9402 
1 1 1 4   104 1  o 15 2.52714e+00 7.56893e-01 3.86453e+01 123.801 -1.04586e+00 1.56225e+00  0.00000e+00 0.00000e+00 2.47831e+01 123.801 1.38622e+01 303.801 0.6771 
1 1 1 4   104 2  o 2  7.33852e+00 6.79183e-01 1.48100e+02 78.663  4.34846e+00  2.16900e+01  0.00000e+00 0.00000e+00 1.17743e+02 78.663  3.03565e+01 258.663 0.9771 
1 1 1 4   104 3  o 7  8.51342e+00 6.46619e-01 1.33375e+02 196.518 -2.41372e+01 -7.15813e+00 0.00000e+00 0.00000e+00 1.75917e+02 196.518 4.25416e+01 196.518 0.9799 
1 1 1 4   104 4  o 16 8.70296e+00 7.29625e-01 1.38843e+02 269.237 -3.65061e-01 -2.74282e+01 0.00000e+00 0.00000e+00 1.77856e+02 269.237 3.90136e+01 269.237 0.9816 
1 1 1 4   104 5  o 15 6.30077e+00 8.97468e-01 1.04011e+02 28.122  1.18175e+01  6.31581e+00  0.00000e+00 0.00000e+00 1.20653e+02 28.122  1.66420e+01 28.122  0.9619 
1 1 1 4   104 6  o 7  1.16194e+01 6.93761e-01 1.70167e+02 143.749 -3.93147e+01 2.88273e+01  0.00000e+00 0.00000e+00 2.56023e+02 143.749 8.58561e+01 143.749 0.9897 
1 1 1 4   104 7  o 18 6.28249e+00 1.07789e+00 6.12097e+01 281.973 1.67870e+00  -7.91578e+00 0.00000e+00 0.00000e+00 1.56674e+02 281.973 9.54640e+01 281.973 0.9360 
1 1 1 4   104 8  o 4  6.13548e+00 1.05912e+00 8.17745e+01 232.311 -6.48557e+00 -8.39466e+00 0.00000e+00 0.00000e+00 1.34500e+02 232.311 5.27254e+01 232.311 0.9516 
1 1 1 4   104 9  o 5  2.95958e+00 9.35525e-01 4.04706e+01 191.179 -3.16900e+00 -6.26250e-01 0.00000e+00 0.00000e+00 5.00123e+01 191.179 9.54174e+00 191.179 0.8257 
1 1 1 4   104 10 o 17 3.94620e+00 1.09898e+00 5.94935e+01 47.924  3.84138e+00  4.25493e+00  0.00000e+00 0.00000e+00 7.31267e+01 47.924  1.36332e+01 47.924  0.9080 
1 1 1 4   104 11 o 13 2.57813e+00 8.62095e-01 3.15620e+01 89.680  1.54683e-02  2.77018e+00  0.00000e+00 0.00000e+00 4.39246e+01 89.680  1.23626e+01 89.680  0.7915 
1 1 1 4   105 0  o 10 6.16182e+00 7.29712e-01 7.46160e+01 299.181 4.52272e+00  -8.09870e+00 0.00000e+00 0.00000e+00 1.41030e+02 299.181 6.64142e+01 299.181 0.9445 
1 1 1 4   105 1  o 9  9.10407e+00 6.06972e-01 9.75131e+01 192.861 -1.85786e+01 -4.24170e+00 0.00000e+00 0.00000e+00 2.30911e+02 192.861 1.33398e+02 192.861 0.9734 
1 1 1 4   105 2  o 11 1.02703e+01 6.05572e-01 2.06329e+02 309.305 3.01511e+01  -3.68314e+01 0.00000e+00 0.00000e+00 1.70298e+02 309.305 3.60311e+01 129.305 0.9894 
1 1 1 4   105 3  o 2  5.82439e+00 8.38464e-01 1.38339e+02 119.769 -8.47881e+00 1.48236e+01  0.00000e+00 0.00000e+00 7.11126e+01 119.769 6.72262e+01 299.769 0.9703 
1 1 1 4   105 4  o 2  4.59910e+00 9.44723e-01 8.54709e+01 186.164 -7.81080e+00 -8.43585e-01 0.00000e+00 0.00000e+00 7.37279e+01 186.164 1.17431e+01 6.164   0.9340 
1 1 1 4   105 5  f 0  3.10567e+00 9.02548e-01 4.11336e+01 46.785  1.75245e+00  1.86520e+00  0.00000e+00 0.00000e+00 4.76327e+01 46.785  6.49910e+00 46.785  0.7713 
1 1 1 4   105 6  o 14 4.23822e+00 1.00149e+00 7.41661e+01 185.147 -6.77131e+00 -6.09898e-01 0.00000e+00 0.00000e+00 7.08047e+01 185.147 3.36138e+00 5.147   0.9232 
1 1 1 4   105 7  o 14 1.15274e+01 9.28310e-01 1.76948e+02 3.676   4.74264e+01  3.04692e+00  0.00000e+00 0.00000e+00 2.45530e+02 3.676   6.85820e+01 3.676   0.9894 
1 1 1 4   105 8  o 5  3.21723e+00 9.60028e-01 6.04353e+01 187.790 -5.06674e+00 -6.93181e-01 0.00000e+00 0.00000e+00 4.63065e+01 187.790 1.41289e+01 7.790   0.8960 
1 1 1 4   105 9  o 14 6.98961e+00 1.09545e+00 1.06608e+02 269.983 -5.09680e-03 -1.69217e+01 0.00000e+00 0.00000e+00 1.44365e+02 269.983 3.77567e+01 269.983 0.9700 
1 1 1 4   105 10 o 13 4.72635e+00 1.20586e+00 1.19359e+02 100.308 -2.17606e+00 1.19641e+01  0.00000e+00 0.00000e+00 4.81725e+01 100.308 7.11869e+01 280.308 0.9580 
1 1 1 4   106 0  o 14 2.84720e+00 8.08776e-01 8.54512e+01 213.680 -4.05563e+00 -2.70272e+00 0.00000e+00 0.00000e+00 8.45952e+00 213.680 7.69917e+01 33.680  0.8904 
1 1 1 4   106 1  o 11 3.15452e+00 8.36323e-01 4.41963e+01 127.146 -1.69725e+00 2.24039e+00  0.00000e+00 0.00000e+00 4.87129e+01 127.146 4.51664e+00 127.146 0.7950 
1 1 1 4   106 2  o 7  6.10367e+00 7.99438e-01 1.15669e+02 191.875 -1.50044e+01 -3.15519e+00 0.00000e+00 0.00000e+00 1.02981e+02 191.875 1.26888e+01 11.875  0.9668 
1 1 1 4   106 3  o 18 3.89264e+00 9.05227e-01 2.30787e+01 198.374 -1.62694e+00 -5.40397e-01 0.00000e+00 0.00000e+00 6.99265e+01 198.374 4.68478e+01 198.374 0.6448 
1 1 1 4   106 4  o 2  2.06653e+00 6.85892e-01 4.33222e+01 218.378 -1.65164e+00 -1.30805e+00 0.00000e+00 0.00000e+00 1.13894e+01 218.378 3.19328e+01 38.378  0.7146 
1 1 1 4   106 5  o 4  4.01290e+00 9.47437e-01 4.38768e+01 133.617 -2.51751e+00 2.64203e+00  0.00000e+00 0.00000e+00 8.22703e+01 133.617 3.83935e+01 133.617 0.8485 
1 1 1 4   106 6  o 15 3.83865e+00 1.00024e+00 4.36974e+01 338.960 3.51594e+00  -1.35244e+00 0.00000e+00 0.00000e+00 7.77166e+01 338.960 3.40192e+01 338.960 0.8539 
1 1 1 4   106 7  o 5  2.29782e+00 7.77586e-01 3.08968e+01 272.472 7.91600e-02  -1.83363e+00 0.00000e+00 0.00000e+00 2.60113e+01 272.472 4.88550e+00 92.472  0.6688 
1 1 1 4   106 8  o 13 3.37720e+00 9.93154e-01 5.91634e+01 261.622 -7.07423e-01 -4.80370e+00 0.00000e+00 0.00000e+00 5.20981e+01 261.622 7.06528e+00 81.622  0.8899 
1 1 1 4   106 9  o 6  3.61573e+00 9.24452e-01 4.64033e+01 260.175 -8.07662e-01 -4.66376e+00 0.00000e+00 0.00000e+00 7.22572e+01 260.175 2.58540e+01 260.175 0.8868 
1 1 1 4   106 10 o 13 2.50486e+00 8.28687e-01 6.01044e+01 324.638 4.42303e+00  -3.13891e+00 0.00000e+00 0.00000e+00 2.35069e+01 324.638 3.65975e+01 144.638 0.9024 
1 1 1 4   107 0  o 19 4.41919e+00 8.89136e-01 1.19917e+02 174.582 -1.02658e+01 9.73612e-01  0.00000e+00 0.00000e+00 3.55927e+01 174.582 8.43244e+01 354.582 0.9502 
1 1 1 4   107 1  o 4  2.76920e+00 7.99483e-01 9.14063e+01 330.446 4.52614e+00  -2.56637e+00 0.00000e+00 0.00000e+00 6.88260e-01 330.446 9.07180e+01 150.446 0.8979 
1 1 1 4   107 2  o 5  6.20917e+00 7.72920e-01 8.13861e+01 208.145 -9.99351e+00 -5.34617e+00 0.00000e+00 0.00000e+00 1.38216e+02 208.145 5.68302e+01 208.145 0.9548 
1 1 1 4   107 3  o 2  6.62973e+00 8.03107e-01 1.20995e+02 63.301  7.88709e+00  1.56825e+01  0.00000e+00 0.00000e+00 1.17480e+02 63.301  3.51532e+00 243.301 0.9711 
1 1 1 4   107 4  o 10 8.88397e+00 7.04045e-01 1.23643e+02 232.935 -1.62275e+01 -2.14842e+01 0.00000e+00 0.00000e+00 1.99247e+02 232.935 7.56041e+01 232.935 0.9812 
1 1 1 4   107 5  o 12 9.63147e+00 7.32151e-01 1.41350e+02 47.662  2.43559e+01  2.67313e+01  0.00000e+00 0.00000e+00 2.10390e+02 47.662  6.90397e+01 47.662  0.9861 
1 1 1 4   107 6  o 4  2.65941e+00 7.72253e-01 1.93505e+01 326.474 1.12882e+00  -7.47869e-01 0.00000e+00 0.00000e+00 3.55927e+01 326.474 1.62422e+01 326.474 0.5579 
1 1 1 4   107 7  o 18 2.53972e+00 8.38491e-01 4.29412e+01 3.775   3.20686e+00  2.11567e-01  0.00000e+00 0.00000e+00 3.45914e+01 3.775   8.34985e+00 183.774 0.8246 
1 1 1 4   107 8  o 12 2.71317e+00 8.58884e-01 2.51952e+00 232.739 -1.19651e-01 -1.57284e-01 0.00000e+00 0.00000e+00 7.35426e+00 232.739 4.83474e+00 232.739 0.0983 
1 1 1 4   107 9  o 13 3.07093e+00 9.60465e-01 5.58672e+01 236.179 -2.67591e+00 -3.99414e+00 0.00000e+00 0.00000e+00 4.51028e+01 236.179 1.07644e+01 56.179  0.8887 
1 1 1 4   107 10 o 5  2.42641e+00 8.23837e-01 2.76623e+01 193.213 -2.39866e+00 -5.63192e-01 0.00000e+00 0.00000e+00 4.06233e+01 193.213 1.29610e+01 193.213 0.7610 
1 1 1 4   108 0  o 8  5.12330e+00 8.45274e-01 8.94240e+01 3.415   9.76753e+00  5.82870e-01  0.00000e+00 0.00000e+00 9.02851e+01 3.415   8.61065e-01 3.415   0.9474 
1 1 1 4   108 1  o 10 4.68240e+00 8.45783e-01 4.26866e+01 332.195 3.73950e+00  -1.97202e+00 0.00000e+00 0.00000e+00 1.08455e+02 332.195 6.57680e+01 332.195 0.8717 
1 1 1 4   108 2  o 1  1.03980e+01 6.59882e-01 1.91758e+02 142.582 -3.78187e+01 2.89332e+01  0.00000e+00 0.00000e+00 1.89219e+02 142.582 2.53908e+00 322.582 0.9894 
1 1 1 4   108 3  o 6  6.72063e+00 7.78103e-01 1.35694e+02 359.108 1.99963e+01  -3.11474e-01 0.00000e+00 0.00000e+00 1.06872e+02 359.108 2.88228e+01 179.108 0.9747 
1 1 1 4   108 4  o 19 6.51303e+00 8.51202e-01 1.02035e+02 100.739 -2.93163e+00 1.54578e+01  0.00000e+00 0.00000e+00 1.31340e+02 100.739 2.93046e+01 100.739 0.9677 
1 1 1 4   108 5  o 12 8.35305e+00 8.02581e-01 1.08430e+02 34.116  1.79721e+01  1.21756e+01  0.00000e+00 0.00000e+00 1.93629e+02 34.116  8.51989e+01 34.116  0.9767 
1 1 1 4   108 6  o 12 6.53087e+00 9.17687e-01 9.73626e+01 244.077 -6.45216e+00 -1.32744e+01 0.00000e+00 0.00000e+00 1.36059e+02 244.077 3.86959e+01 244.077 0.9655 
1 1 1 4   108 7  o 4  2.89509e+00 8.99342e-01 5.86565e+01 233.626 -2.60216e+00 -3.53281e+00 0.00000e+00 0.00000e+00 3.53030e+01 233.626 2.33536e+01 53.626  0.8769 
1 1 1 4   108 8  o 10 4.29369e+00 1.00831e+00 5.87374e+01 30.873  5.78179e+00  3.45659e+00  0.00000e+00 0.00000e+00 8.78048e+01 30.873  2.90674e+01 30.873  0.9225 
1 1 1 4   108 9  o 10 2.97581e+00 9.41334e-01 1.03744e+02 237.241 -4.94799e+00 -7.68977e+00 0.00000e+00 0.00000e+00 1.12083e-01 237.241 1.03632e+02 57.241  0.9436 
1 1 1 4   108 10 o 8  2.54588e+00 8.54990e-01 5.10220e+01 299.955 2.42086e+00  -4.20075e+00 0.00000e+00 0.00000e+00 3.27209e+01 299.955 1.83011e+01 119.955 0.8897 
1 1 1 4   109 0  o 2  5.99343e+00 7.85953e-01 1.02504e+02 217.639 -1.05157e+01 -8.10947e+00 0.00000e+00 0.00000e+00 1.10802e+02 217.639 8.29819e+00 217.639 0.9616 
1 1 1 4   109 1  o 7  6.91251e+00 7.50907e-01 1.43841e+02 128.920 -1.39626e+01 1.72916e+01  0.00000e+00 0.00000e+00 1.06214e+02 128.920 3.76275e+01 308.920 0.9772 
1 1 1 4   109 2  o 18 7.47092e+00 7.85552e-01 1.33440e+02 40.329  1.76437e+01  1.49782e+01  0.00000e+00 0.00000e+00 1.37086e+02 40.329  3.64627e+00 40.329  0.9782 
1 1 1 4   109 3  o 18 7.47149e+00 7.78091e-01 1.21352e+02 99.007  -3.54696e+00 2.23781e+01  0.00000e+00 0.00000e+00 1.49066e+02 99.007  2.77142e+01 99.007  0.9777 
1 1 1 4   109 4  o 12 7.11595e+00 8.35666e-01 1.19891e+02 237.541 -1.17651e+01 -1.84970e+01 0.00000e+00 0.00000e+00 1.37446e+02 237.541 1.75552e+01 237.541 0.9769 
1 1 1 4   109 5  f 0  3.56677e+00 9.72155e-01 5.43827e+01 321.288 3.39873e+00  -2.72408e+00 0.00000e+00 0.00000e+00 6.12566e+01 321.288 6.87391e+00 321.288 0.8759 
1 1 1 4   109 6  o 8  3.27874e+00 9.51755e-01 4.05835e+01 309.021 2.22277e+00  -2.74288e+00 0.00000e+00 0.00000e+00 6.16644e+01 309.021 2.10810e+01 309.021 0.8427 
1 1 1 4   109 7  o 11 3.88607e+00 9.62557e-01 6.89683e+01 144.984 -5.77000e+00 4.04257e+00  0.00000e+00 0.00000e+00 6.41753e+01 144.984 4.79306e+00 324.984 0.9260 
1 1 1 4   109 8  o 3  4.80347e+00 1.09160e+00 1.32332e+02 319.910 1.24268e+01  -1.04605e+01 0.00000e+00 0.00000e+00 3.97768e+01 319.910 9.25551e+01 139.911 0.9687 
1 1 1 4   109 9  o 7  2.93152e+00 9.55906e-01 5.17618e+01 214.073 -3.93146e+00 -2.65912e+00 0.00000e+00 0.00000e+00 4.43962e+01 214.073 7.36553e+00 34.073  0.8871 
1 1 1 4   110 0  o 10 3.12863e+00 8.58243e-01 6.25133e+01 354.065 4.29752e+00  -4.46728e-01 0.00000e+00 0.00000e+00 3.87568e+01 354.065 2.37565e+01 174.065 0.8748 
1 1 1 4   110 1  o 1  4.07287e+00 8.63480e-01 4.17148e+01 307.336 2.26531e+00  -2.96974e+00 0.00000e+00 0.00000e+00 8.67739e+01 307.336 4.50591e+01 307.336 0.8525 
1 1 1 4   110 2  o 17 4.35642e+00 9.06528e-01 6.89128e+01 298.662 3.26777e+00  -5.97808e+00 0.00000e+00 0.00000e+00 7.99581e+01 298.662 1.10453e+01 298.662 0.9234 
1 1 1 4   110 3  o 15 6.90799e+00 8.41583e-01 1.32906e+02 267.961 -8.35627e-01 -2.34745e+01 0.00000e+00 0.00000e+00 1.17246e+02 267.961 1.56596e+01 87.961  0.9785 
1 1 1 4   110 4  o 19 2.74570e+00 8.54906e-01 6.32861e+01 91.586  -1.19935e-01 4.33149e+00  0.00000e+00 0.00000e+00 2.56437e+01 91.586  3.76424e+01 271.586 0.8752 
1 1 1 4   110 5  o 8  5.15604e+00 9.74472e-01 5.75855e+01 197.056 -6.43491e+00 -1.97428e+00 0.00000e+00 0.00000e+00 1.18395e+02 197.056 6.08097e+01 197.056 0.9224 
1 1 1 4   110 6  o 5  3.24810e+00 9.20331e-01 7.17634e+01 118.299 -2.80343e+00 5.20683e+00  0.00000e+00 0.00000e+00 3.77078e+01 118.299 3.40556e+01 298.299 0.9110 
1 1 1 4   110 7  o 5  3.22338e+00 8.49316e-01 5.81807e+01 222.017 -3.95806e+00 -3.56596e+00 0.00000e+00 0.00000e+00 4.91760e+01 222.017 9.00470e+00 42.017  0.9005 
1 1 1 4   110 8  o 7  3.54397e+00 1.01210e+00 5.06191e+01 12.911  4.95237e+00  1.13525e+00  0.00000e+00 0.00000e+00 6.66937e+01 12.911  1.60746e+01 12.911  0.8952 
1 1 1 4   110 9  o 17 4.14069e+00 1.12444e+00 7.89997e+01 168.465 -8.21933e+00 1.67740e+00  0.00000e+00 0.00000e+00 6.46177e+01 168.465 1.43820e+01 348.465 0.9384 
1 1 1 4   111 0  o 14 7.25670e+00 7.60620e-01 1.12493e+02 185.578 -2.11330e+01 -2.06378e+00 0.00000e+00 0.00000e+00 1.49531e+02 185.578 3.70372e+01 185.578 0.9762 
1 1 1 4   111 1  o 1  3.04011e+00 8.13891e-01 7.62114e+01 34.999  4.94386e+00  3.46160e+00  0.00000e+00 0.00000e+00 2.64605e+01 34.999  4.97509e+01 214.999 0.9129 
1 1 1 4   111 2  o 1  3.60874e+00 8.93473e-01 7.60702e+01 201.851 -6.24572e+00 -2.50452e+00 0.00000e+00 0.00000e+00 4.70790e+01 201.851 2.89912e+01 21.851  0.9224 
1 1 1 4   111 3  o 15 2.56072e+00 7.82094e-01 5.20484e+01 352.432 3.48755e+00  -4.63357e-01 0.00000e+00 0.00000e+00 2.77271e+01 352.432 2.43213e+01 172.432 0.8420 
1 1 1 4   111 4  o 15 9.04560e+00 7.40832e-01 1.92761e+02 176.582 -4.62292e+01 2.76101e+00  0.00000e+00 0.00000e+00 1.38252e+02 176.582 5.45083e+01 356.582 0.9891 
1 1 1 4   111 5  o 10 4.84568e+00 9.95822e-01 8.65783e+01 49.035  6.82310e+00  7.85882e+00  0.00000e+00 0.00000e+00 8.38272e+01 49.035  2.75113e+00 229.035 0.9507 
1 1 1 4   111 6  o 2  3.07944e+00 9.05955e-01 5.16224e+01 244.778 -1.87672e+00 -3.98431e+00 0.00000e+00 0.00000e+00 4.83119e+01 244.778 3.31051e+00 64.778  0.8774 
1 1 1 4   111 7  o 8  3.01414e+00 9.16718e-01 9.09921e+01 342.472 7.42716e+00  -2.34580e+00 0.00000e+00 0.00000e+00 1.30366e+01 342.472 7.79555e+01 162.472 0.9334 
1 1 1 4   111 8  f 0  2.79820e+00 8.85901e-01 1.77315e+01 126.439 -9.80066e-01 1.32744e+00  0.00000e+00 0.00000e+00 4.75462e+01 126.439 2.98146e+01 126.439 0.6311 
1 1 1 4   111 9  o 3  2.49063e+00 8.60367e-01 8.54157e+01 204.670 -7.16578e+00 -3.29131e+00 0.00000e+00 0.00000e+00 5.66996e-01 204.670 8.48487e+01 24.670  0.9343 
1 1 1 4   112 0  f 0  3.75042e+00 8.92933e-01 1.33742e+02 326.126 9.34254e+00  -6.27172e+00 0.00000e+00 0.00000e+00 1.37150e+00 146.126 1.35114e+02 146.126 0.9545 
1 1 1 4   112 1  o 12 8.98602e+00 6.67004e-01 1.56143e+02 102.174 -7.76349e+00 3.59869e+01  0.00000e+00 0.00000e+00 1.71644e+02 102.174 1.55013e+01 102.174 0.9863 
1 1 1 4   112 2  o 8  6.83145e+00 7.90418e-01 1.16257e+02 272.389 8.58597e-01  -2.05800e+01 0.00000e+00 0.00000e+00 1.30198e+02 272.389 1.39414e+01 272.389 0.9754 
1 1 1 4   112 3  o 11 5.62277e+00 9.24697e-01 5.14417e+01 177.206 -6.67206e+00 3.25630e-01  0.00000e+00 0.00000e+00 1.40254e+02 177.206 8.88127e+01 177.206 0.9218 
1 1 1 4   112 4  o 6  3.16282e+00 8.89403e-01 4.79440e+01 74.732  1.12275e+00  4.11313e+00  0.00000e+00 0.00000e+00 5.41681e+01 74.732  6.22406e+00 74.732  0.8729 
1 1 1 4   112 5  o 14 2.89489e+00 8.59493e-01 4.77702e+01 14.668  3.65636e+00  9.57039e-01  0.00000e+00 0.00000e+00 4.37038e+01 14.668  4.06636e+00 194.668 0.8545 
1 1 1 4   112 6  o 6  6.73834e+00 9.75095e-01 8.52655e+01 148.624 -1.35528e+01 8.26499e+00  0.00000e+00 0.00000e+00 1.55895e+02 148.624 7.06290e+01 148.624 0.9680 
1 1 1 4   112 7  o 5  6.34492e+00 1.04258e+00 1.02202e+02 94.679  -1.45169e+00 1.77374e+01  0.00000e+00 0.00000e+00 1.25649e+02 94.679  2.34473e+01 94.679  0.9715 
1 1 1 4   112 8  o 7  5.58650e+00 1.13730e+00 1.24669e+02 334.262 1.65965e+01  -8.00088e+00 0.00000e+00 0.00000e+00 7.60905e+01 334.262 4.85782e+01 154.262 0.9725 
1 1 1 4   113 0  o 1  3.60547e+00 8.68778e-01 7.08380e+01 47.321  4.21928e+00  4.57581e+00  0.00000e+00 0.00000e+00 5.12106e+01 47.321  1.96274e+01 227.321 0.9157 
1 1 1 4   113 1  o 13 6.99036e+00 7.63756e-01 1.33739e+02 282.727 5.60591e+00  -2.48211e+01 0.00000e+00 0.00000e+00 1.19577e+02 282.727 1.41619e+01 102.727 0.9801 
1 1 1 4   113 2  o 19 6.19958e+00 8.47495e-01 1.43351e+02 79.239  4.06433e+00  2.13859e+01  0.00000e+00 0.00000e+00 8.05458e+01 79.239  6.28054e+01 259.239 0.9768 
1 1 1 4   113 3  o 8  3.22292e+00 8.10508e-01 7.29118e+01 98.128  -8.83897e-01 6.18894e+00  0.00000e+00 0.00000e+00 3.62567e+01 98.128  3.66551e+01 278.128 0.9161 
1 1 1 4   113 4  o 4  2.47291e+00 7.72311e-01 3.29003e+01 358.759 2.33806e+00  -5.06432e-02 0.00000e+00 0.00000e+00 3.53287e+01 358.759 2.42845e+00 358.759 0.7462 
1 1 1 4   113 5  o 12 4.27465e+00 9.60903e-01 6.37707e+01 108.707 -2.43171e+00 7.18121e+00  0.00000e+00 0.00000e+00 8.34325e+01 108.707 1.96618e+01 108.707 0.9315 
1 1 1 4   113 6  o 5  2.80190e+00 8.77423e-01 4.57823e+01 320.549 2.91982e+00  -2.40274e+00 0.00000e+00 0.00000e+00 4.27186e+01 320.549 3.06370e+00 140.549 0.8546 
1 1 1 4   113 7  o 14 5.68670e+00 1.02310e+00 1.02002e+02 247.060 -6.14964e+00 -1.45297e+01 0.00000e+00 0.00000e+00 1.01368e+02 247.060 6.34750e-01 67.060  0.9678 
1 1 1 4   113 8  o 18 4.58342e+00 1.12533e+00 6.87552e+01 33.288  6.98050e+00  4.58316e+00  0.00000e+00 0.00000e+00 9.00795e+01 33.288  2.13243e+01 33.288  0.9381 
1 1 1 4   114 0  o 5  5.83768e+00 8.52187e-01 1.43114e+02 287.750 6.36602e+00  -1.98870e+01 0.00000e+00 0.00000e+00 6.73896e+01 287.750 7.57242e+01 107.750 0.9758 
1 1 1 4   114 1  f 0  4.73875e+00 8.10188e-01 5.37036e+01 248.883 -2.44335e+00 -6.32646e+00 0.00000e+00 0.00000e+00 1.07958e+02 248.883 5.42541e+01 248.883 0.9230 
1 1 1 4   114 2  o 8  8.55450e+00 7.03973e-01 1.14261e+02 96.113  -3.45484e+00 3.22563e+01  0.00000e+00 0.00000e+00 1.97025e+02 96.113  8.27635e+01 96.113  0.9845 
1 1 1 4   114 3  o 3  5.39037e+00 9.30101e-01 1.32153e+02 323.522 1.44108e+01  -1.06550e+01 0.00000e+00 0.00000e+00 6.14510e+01 323.522 7.07023e+01 143.522 0.9717 
1 1 1 4   114 4  o 19 8.45361e+00 7.97577e-01 1.21911e+02 196.166 -3.02795e+01 -8.77741e+00 0.00000e+00 0.00000e+00 1.85548e+02 196.166 6.36366e+01 196.166 0.9840 
1 1 1 4   114 5  f 0  2.11725e+00 7.15719e-01 2.93746e+01 135.075 -1.49273e+00 1.48884e+00  0.00000e+00 0.00000e+00 2.65550e+01 135.075 2.81962e+00 315.075 0.7148 
1 1 1 4   114 6  o 14 2.42278e+00 7.74114e-01 4.83429e+01 148.294 -3.63173e+00 2.24352e+00  0.00000e+00 0.00000e+00 2.98212e+01 148.294 1.85216e+01 328.294 0.8731 
1 1 1 4   114 7  o 18 4.60906e+00 9.90353e-01 6.47433e+01 189.351 -9.20005e+00 -1.51493e+00 0.00000e+00 0.00000e+00 9.61163e+01 189.351 3.13731e+01 189.351 0.9447 
1 1 1 4   114 8  o 3  3.11115e+00 9.44821e-01 3.71957e+01 280.930 7.47260e-01  -3.86963e+00 0.00000e+00 0.00000e+00 6.17562e+01 280.930 2.45605e+01 280.930 0.8612 
1 1 1 4   115 0  o 1  9.18657e+00 6.72454e-01 1.30283e+02 264.846 -3.54091e+00 -3.92538e+01 0.00000e+00 0.00000e+00 2.04770e+02 264.846 7.44868e+01 264.846 0.9872 
1 1 1 4   115 1  o 6  6.55434e+00 7.90995e-01 1.15196e+02 98.202  -3.20537e+00 2.22370e+01  0.00000e+00 0.00000e+00 1.21525e+02 98.202  6.32869e+00 98.202  0.9775 
1 1 1 4   115 2  o 13 5.02298e+00 8.18704e-01 1.32317e+02 348.503 1.84473e+01  -3.75225e+00 0.00000e+00 0.00000e+00 4.82896e+01 348.503 8.40270e+01 168.503 0.9731 
1 1 1 4   115 3  o 19 1.96539e+00 6.70534e-01 4.69133e+01 70.757  1.03931e+00  2.97725e+00  0.00000e+00 0.00000e+00 1.26908e+01 70.757  3.42226e+01 250.757 0.8207 
1 1 1 4   115 4  o 17 3.04452e+00 8.49889e-01 3.67288e+01 84.093  3.59860e-01  3.47803e+00  0.00000e+00 0.00000e+00 5.78701e+01 84.093  2.11413e+01 84.093  0.8409 
1 1 1 4   115 5  o 10 3.37234e+00 9.62765e-01 4.78657e+01 221.544 -3.52514e+00 -3.12360e+00 0.00000e+00 0.00000e+00 6.25469e+01 221.544 1.46812e+01 221.544 0.8862 
1 1 1 4   115 6  o 4  4.01396e+00 9.75883e-01 6.75387e+01 263.308 -9.52847e-01 -8.12099e+00 0.00000e+00 0.00000e+00 7.13458e+01 263.308 3.80703e+00 263.308 0.9367 
1 1 1 4   115 7  o 19 2.84611e+00 9.01088e-01 6.82171e+01 180.847 -6.61984e+00 -9.78638e-02 0.00000e+00 0.00000e+00 2.85905e+01 180.847 3.96267e+01 0.847   0.9210 
1 1 1 4   115 8  o 2  5.39533e+00 1.16036e+00 7.78655e+01 28.980  9.73982e+00  5.39442e+00  0.00000e+00 0.00000e+00 1.12159e+02 28.980  3.42931e+01 28.980  0.9540 
1 1 1 4   116 0  o 5  4.98201e+00 8.92389e-01 8.73552e+01 180.506 -1.25439e+01 -1.10767e-01 0.00000e+00 0.00000e+00 8.91476e+01 180.506 1.79239e+00 180.506 0.9593 
1 1 1 4   116 1  o 5  2.40770e+00 7.64630e-01 3.54684e+01 342.510 2.64340e+00  -8.32953e-01 0.00000e+00 0.00000e+00 3.49279e+01 342.510 5.40575e-01 162.510 0.7916 
1 1 1 4   116 2  o 10 2.51901e+00 7.92982e-01 5.58148e+01 266.093 -2.93924e-01 -4.30386e+00 0.00000e+00 0.00000e+00 2.55669e+01 266.093 3.02479e+01 86.093  0.8746 
1 1 1 4   116 3  o 3  2.93670e+00 8.59692e-01 6.55716e+01 219.508 -4.60175e+00 -3.79446e+00 0.00000e+00 0.00000e+00 3.33419e+01 219.508 3.22297e+01 39.508  0.9118 
1 1 1 4   116 4  o 15 3.52026e+00 9.36984e-01 7.07406e+01 334.518 6.25563e+00  -2.98140e+00 0.00000e+00 0.00000e+00 4.95043e+01 334.518 2.12363e+01 154.518 0.9247 
1 1 1 4   116 5  o 13 2.91072e+00 8.93370e-01 4.32110e+01 185.042 -3.65971e+00 -3.22914e-01 0.00000e+00 0.00000e+00 4.81346e+01 185.042 4.92357e+00 185.042 0.8497 
1 1 1 4   116 6  o 4  3.02337e+00 9.04184e-01 5.94580e+01 348.315 6.06994e+00  -1.25535e+00 0.00000e+00 0.00000e+00 4.27345e+01 348.315 1.67234e+01 168.315 0.9153 
1 1 1 4   116 7  f 0  4.00929e+00 1.06114e+00 5.85595e+01 155.501 -6.30310e+00 2.87239e+00  0.00000e+00 0.00000e+00 7.83127e+01 155.501 1.97532e+01 155.501 0.9247 
1 1 1 4   117 0  o 3  2.94799e+00 8.46267e-01 3.81961e+01 22.139  3.24347e+00  1.31961e+00  0.00000e+00 0.00000e+00 5.33595e+01 22.139  1.51633e+01 22.139  0.8412 
1 1 1 4   117 1  o 5  5.90672e+00 8.77691e-01 1.14414e+02 321.561 1.46674e+01  -1.16415e+01 0.00000e+00 0.00000e+00 9.77870e+01 321.561 1.66266e+01 141.561 0.9729 
1 1 1 4   117 2  o 5  2.38900e+00 7.58041e-01 1.72284e+01 170.315 -1.38536e+00 2.36418e-01  0.00000e+00 0.00000e+00 3.32212e+01 170.315 1.59928e+01 170.315 0.5719 
1 1 1 4   117 3  o 15 7.71459e+00 8.21869e-01 1.25569e+02 304.535 1.70588e+01  -2.47878e+01 0.00000e+00 0.00000e+00 1.54541e+02 304.535 2.89723e+01 304.535 0.9832 
1 1 1 4   117 4  o 12 2.61188e+00 8.17768e-01 4.30804e+01 116.681 -1.75820e+00 3.49868e+00  0.00000e+00 0.00000e+00 3.98826e+01 116.681 3.19777e+00 296.681 0.8602 
1 1 1 4   117 5  o 7  7.68669e+00 9.00795e-01 9.80419e+01 23.701  2.29579e+01  1.00784e+01  0.00000e+00 0.00000e+00 1.80047e+02 23.701  8.20049e+01 23.701  0.9799 
1 1 1 4   117 6  o 19 3.29139e+00 9.73926e-01 9.60732e+01 201.191 -9.25309e+00 -3.58746e+00 0.00000e+00 0.00000e+00 1.91355e+01 201.191 7.69377e+01 21.192  0.9482 
1 1 1 4   117 7  o 10 3.45317e+00 9.90683e-01 8.79148e+01 183.703 -9.77816e+00 -6.32823e-01 0.00000e+00 0.00000e+00 3.28407e+01 183.703 5.50740e+01 3.703   0.9475 
1 1 1 4   118 0  o 6  6.61681e+00 7.98742e-01 8.54169e+01 252.489 -5.33681e+00 -1.69146e+01 0.00000e+00 0.00000e+00 1.51812e+02 252.489 6.63947e+01 252.489 0.9714 
1 1 1 4   118 1  o 2  3.02906e+00 8.59662e-01 2.19108e+01 256.346 -4.70051e-01 -1.93496e+00 0.00000e+00 0.00000e+00 5.59477e+01 256.346 3.40369e+01 256.346 0.6963 
1 1 1 4   118 2  o 10 3.00325e+00 8.79492e-01 2.87863e+01 230.840 -1.73711e+00 -2.13296e+00 0.00000e+00 0.00000e+00 5.87693e+01 230.840 2.99830e+01 230.840 0.7897 
1 1 1 4   118 3  o 15 2.92004e+00 8.81215e-01 6.45122e+01 88.947  1.12698e-01  6.13014e+00  0.00000e+00 0.00000e+00 3.40515e+01 88.947  3.04607e+01 268.947 0.9144 
1 1 1 4   118 4  o 19 2.42462e+00 7.77388e-01 6.22770e+01 261.213 -8.62458e-01 -5.57963e+00 0.00000e+00 0.00000e+00 1.88557e+01 261.213 4.34213e+01 81.213  0.9065 
1 1 1 4   118 5  o 17 2.89868e+00 8.79282e-01 7.21834e+01 42.780  5.29708e+00  4.90170e+00  0.00000e+00 0.00000e+00 2.70907e+01 42.780  4.50927e+01 222.780 0.9279 
1 1 1 4   118 6  o 5  5.04274e+00 1.11834e+00 9.38390e+01 231.675 -8.15855e+00 -1.03214e+01 0.00000e+00 0.00000e+00 8.50376e+01 231.675 8.80142e+00 51.675  0.9612 
1 1 1 4   118 7  f 0  2.87926e+00 8.99054e-01 2.28529e+01 169.269 -2.55110e+00 4.83469e-01  0.00000e+00 0.00000e+00 5.94858e+01 169.269 3.66329e+01 169.269 0.7751 
1 1 1 4   119 0  o 11 2.34491e+00 7.31443e-01 6.68424e+01 41.370  4.12294e+00  3.63097e+00  0.00000e+00 0.00000e+00 1.13450e+01 41.370  5.54974e+01 221.370 0.9037 
1 1 1 4   119 1  o 14 5.18225e+00 8.96939e-01 6.29198e+01 278.611 1.45574e+00  -9.61342e+00 0.00000e+00 0.00000e+00 1.18193e+02 278.611 5.52736e+01 278.611 0.9471 
1 1 1 4   119 2  o 13 3.27008e+00 9.05673e-01 1.33896e+01 63.268  5.68639e-01  1.12905e+00  0.00000e+00 0.00000e+00 5.08364e+01 63.268  3.74467e+01 63.268  0.5322 
1 1 1 4   119 3  o 16 3.03807e+00 8.80394e-01 6.62986e+01 119.914 -3.35996e+00 5.83987e+00  0.00000e+00 0.00000e+00 3.71272e+01 119.914 2.91714e+01 299.914 0.9225 
1 1 1 4   119 4  o 5  3.22888e+00 9.03280e-01 6.93308e+01 309.434 4.78015e+00  -5.81237e+00 0.00000e+00 0.00000e+00 4.15969e+01 309.434 2.77339e+01 129.434 0.9310 
1 1 1 4   119 5  o 14 3.64419e+00 9.62786e-01 8.67292e+01 232.325 -6.35013e+00 -8.22359e+00 0.00000e+00 0.00000e+00 4.10899e+01 232.325 4.56392e+01 52.325  0.9506 
1 1 1 4   119 6  o 8  4.40920e+00 1.07362e+00 5.45860e+01 85.530  5.78060e-01  7.39421e+00  0.00000e+00 0.00000e+00 9.66755e+01 85.530  4.20894e+01 85.530  0.9299 
1 1 1 4   119 7  f 0  2.57840e+00 8.40428e-01 3.73494e+01 50.621  2.36498e+00  2.88129e+00  0.00000e+00 0.00000e+00 4.36904e+01 50.621  6.34100e+00 50.621  0.8522 
1 1 1 4   120 0  o 7  3.00201e+00 8.32492e-01 4.18291e+01 223.078 -3.03626e+00 -2.83906e+00 0.00000e+00 0.00000e+00 5.44253e+01 223.078 1.25963e+01 223.078 0.8693 
1 1 1 4   120 1  o 6  2.54709e+00 7.97869e-01 2.06630e+01 341.586 1.71025e+00  -5.69380e-01 0.00000e+00 0.00000e+00 4.15885e+01 341.586 2.09254e+01 341.586 0.6625 
1 1 1 4   120 2  o 6  6.90501e+00 8.02870e-01 8.33359e+01 175.736 -2.12726e+01 1.58619e+00  0.00000e+00 0.00000e+00 1.65357e+02 175.736 8.20215e+01 175.736 0.9763 
1 1 1 4   120 3  o 16 3.19559e+00 8.85972e-01 4.74414e+01 348.371 5.08966e+00  -1.04740e+00 0.00000e+00 0.00000e+00 5.83955e+01 348.371 1.09541e+01 348.371 0.8977 
1 1 1 4   120 4  o 3  3.02018e+00 8.21842e-01 4.36918e+01 340.798 4.83948e+00  -1.68546e+00 0.00000e+00 0.00000e+00 5.61576e+01 340.798 1.24659e+01 340.798 0.8962 
1 1 1 4   120 5  o 5  2.92465e+00 8.83902e-01 1.46780e+01 341.714 1.42050e+00  -4.69385e-01 0.00000e+00 0.00000e+00 4.95261e+01 341.714 3.48481e+01 341.714 0.5952 
1 1 1 4   120 6  f 0  4.05945e+00 1.05889e+00 7.82689e+01 53.730  6.03880e+00  8.22984e+00  0.00000e+00 0.00000e+00 6.39075e+01 53.730  1.43614e+01 233.730 0.9497 
1 1 1 4   121 0  o 19 4.22852e+00 8.94028e-01 3.38997e+01 286.105 1.38861e+00  -4.80947e+00 0.00000e+00 0.00000e+00 1.05413e+02 286.105 7.15135e+01 286.105 0.8935 
1 1 1 4   121 1  o 1  2.12376e+00 6.98735e-01 5.47411e+01 169.398 -4.98529e+00 9.33132e-01  0.00000e+00 0.00000e+00 1.53552e+01 169.398 3.93859e+01 349.398 0.8950 
1 1 1 4   121 2  o 14 2.73316e+00 8.24068e-01 4.74132e+01 270.668 5.54670e-02  -4.75397e+00 0.00000e+00 0.00000e+00 4.20301e+01 270.668 5.38307e+00 90.668  0.8874 
1 1 1 4   121 3  o 15 2.04466e+00 6.79865e-01 3.99667e+01 293.387 1.48663e+00  -3.43757e+00 0.00000e+00 0.00000e+00 2.43520e+01 293.387 1.56147e+01 113.387 0.8530 
1 1 1 4   121 4  o 2  3.12756e+00 9.20507e-01 2.76194e+01 300.497 1.53576e+00  -2.60753e+00 0.00000e+00 0.00000e+00 6.60237e+01 300.497 3.84044e+01 300.497 0.8119 
1 1 1 4   121 5  o 19 2.63069e+00 8.40650e-01 3.56601e+01 178.596 -3.65974e+00 8.97098e-02  0.00000e+00 0.00000e+00 4.67039e+01 178.596 1.10438e+01 178.596 0.8491 
1 1 1 4   121 6  o 14 2.66863e+00 8.47317e-01 4.29674e+01 9.478   4.33717e+00  7.24077e-01  0.00000e+00 0.00000e+00 4.33390e+01 9.478   3.71534e-01 9.478   0.8772 
1 1 1 4   122 0  o 16 3.58569e+00 9.12728e-01 3.99982e+01 162.282 -4.39874e+00 1.40534e+00  0.00000e+00 0.00000e+00 7.67977e+01 162.282 3.67995e+01 162.282 0.8837 
1 1 1 4   122 1  f 0  3.59986e+00 9.03832e-01 8.96598e+01 275.987 1.14383e+00  -1.09070e+01 0.00000e+00 0.00000e+00 3.68448e+01 275.987 5.28150e+01 95.987  0.9533 
1 1 1 4   122 2  o 9  2.59022e+00 8.06673e-01 4.46084e+01 41.418  3.42127e+00  3.01819e+00  0.00000e+00 0.00000e+00 3.96302e+01 41.418  4.97820e+00 221.418 0.8821 
1 1 1 4   122 3  o 8  2.10296e+00 7.01202e-01 2.51948e+01 208.245 -2.12262e+00 -1.14027e+00 0.00000e+00 0.00000e+00 3.33243e+01 208.245 8.12943e+00 208.245 0.7548 
1 1 1 4   122 4  o 13 2.11272e+00 7.13296e-01 4.00314e+01 113.543 -1.64057e+00 3.76523e+00  0.00000e+00 0.00000e+00 2.75368e+01 113.543 1.24947e+01 293.543 0.8675 
1 1 1 4   122 5  o 7  2.48782e+00 8.09694e-01 5.20020e+01 297.983 2.97172e+00  -5.59299e+00 0.00000e+00 0.00000e+00 3.21139e+01 297.983 1.98881e+01 117.983 0.9172 
1 1 1 4   123 0  o 2  4.86607e+00 9.62686e-01 1.02014e+02 28.747  1.44080e+01  7.90361e+00  0.00000e+00 0.00000e+00 7.17438e+01 28.747  3.02706e+01 208.747 0.9691 
1 1 1 4   123 1  o 9  3.15932e+00 8.82004e-01 3.32602e+01 303.369 2.12134e+00  -3.22098e+00 0.00000e+00 0.00000e+00 6.66098e+01 303.369 3.33496e+01 303.369 0.8578 
1 1 1 4   123 2  o 4  5.36012e+00 9.74729e-01 9.89135e+01 159.913 -1.56535e+01 5.72446e+00  0.00000e+00 0.00000e+00 9.26122e+01 159.913 6.30132e+00 339.913 0.9695 
1 1 1 4   123 3  o 8  2.19461e+00 7.32068e-01 5.81643e+01 201.967 -5.61188e+00 -2.26364e+00 0.00000e+00 0.00000e+00 1.56935e+01 201.967 4.24708e+01 21.967  0.9131 
1 1 1 4   123 4  o 14 3.87118e+00 9.82573e-01 7.40959e+01 300.076 4.90431e+00  -8.46863e+00 0.00000e+00 0.00000e+00 6.10714e+01 300.076 1.30245e+01 120.076 0.9474 
1 1 1 4   124 0  o 1  2.74923e+00 8.15220e-01 2.51531e+01 143.400 -2.20830e+00 1.64005e+00  0.00000e+00 0.00000e+00 5.48204e+01 143.400 2.96673e+01 143.400 0.7897 
1 1 1 4   124 1  o 1  2.99144e+00 8.57769e-01 5.39982e+01 175.226 -6.50051e+00 5.42837e-01  0.00000e+00 0.00000e+00 4.73662e+01 175.226 6.63197e+00 355.226 0.9198 
1 1 1 4   124 2  o 16 2.25659e+00 7.30624e-01 3.85838e+01 234.060 -2.27661e+00 -3.14041e+00 0.00000e+00 0.00000e+00 3.28065e+01 234.060 5.77737e+00 54.060  0.8587 
1 1 1 4   125 0  o 2  3.03357e+00 8.70082e-01 4.55456e+01 4.485   5.64588e+00  4.42832e-01  0.00000e+00 0.00000e+00 5.57457e+01 4.485   1.02000e+01 4.485   0.9068 
1 1 1 4   125 1  o 5  3.83197e+00 9.43379e-01 8.36724e+01 179.456 -1.14895e+01 1.09029e-01  0.00000e+00 0.00000e+00 5.11604e+01 179.456 3.25119e+01 359.456 0.9554 
1 1 1 4   126 0  o 8  2.02695e+00 6.80557e-01 4.82193e+01 34.493  3.76787e+00  2.58887e+00  0.00000e+00 0.00000e+00 1.76177e+01 34.493  3.06016e+01 214.493 0.8824 
1 1 1 4   126 1  o 17 1.86379e+00 6.38000e-01 3.43686e+01 46.138  2.05276e+00  2.13594e+00  0.00000e+00 0.00000e+00 2.10150e+01 46.138  1.33535e+01 226.138 0.8072 
1 1 1 4   127 0  o 1  2.99802e+00 8.62814e-01 2.72279e+01 91.734  -1.07707e-01 3.55760e+00  0.00000e+00 0.00000e+00 6.58958e+01 91.734  3.86679e+01 91.734  0.8441 
1 1 1 5   0   0  f 0  2.37756e+01 7.38491e-01 7.36686e+02 180.000 -6.98106e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.58372e+02 180.000 5.78315e+02 0.000   1.0000 
1 1 1 5   0   1  o 10 2.33230e+01 7.33447e-01 8.23891e+02 0.000   5.63348e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.42586e+01 0.000   7.69633e+02 180.000 1.0000 
1 1 1 5   0   2  f 0  3.46817e+01 1.00441e+00 9.44331e+02 0.000   1.30724e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.61670e+02 0.000   5.82660e+02 180.000 1.0000 
1 1 1 5   0   3  o 17 2.04362e+01 6.92696e-01 3.83810e+01 180.000 -2.95387e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.82560e+02 180.000 1.44179e+02 180.000 0.2871 
1 1 1 5   0   4  o 5  1.16492e+01 5.94551e-01 1.09264e+02 0.000   5.45609e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.08860e+02 0.000   4.03835e-01 180.000 0.4972 
1 1 1 5   0   5  f 0  3.01178e+01 9.29028e-01 7.95073e+02 0.000   1.27615e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.39027e+02 0.000   4.56046e+02 180.000 1.0000 
1 1 1 5   0   6  o 16 3.01377e+01 9.41816e-01 7.90719e+02 0.000   1.55804e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.43975e+02 0.000   4.46744e+02 180.000 1.0000 
1 1 1 5   0   7  o 14 7.96612e+00 8.21879e-01 1.33486e+02 0.000   7.02160e-01  0.00000e+00  0.00000e+00 0.00000e+00 4.81554e+01 0.000   8.53304e+01 180.000 0.6057 
1 1 1 5   0   8  o 1  7.62243e+01 1.88000e+00 1.54983e+03 180.000 -9.65300e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.31875e+03 180.000 2.31080e+02 0.000   1.0000 
1 1 1 5   0   9  o 9  3.76369e+01 1.18384e+00 4.65677e+02 0.000   2.07725e+01  0.00000e+00  0.00000e+00 0.00000e+00 9.50272e+02 0.000   4.84595e+02 0.000   1.0000 
1 1 1 5   0   10 o 3  1.26610e+01 1.08039e+00 1.22643e+02 0.000   2.46468e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.46663e+02 0.000   2.24020e+02 0.000   0.9856 
1 1 1 5   0   11 o 3  1.58798e+01 1.13867e+00 8.65255e+01 180.000 -2.86485e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.06541e+02 180.000 4.20016e+02 180.000 0.9935 
1 1 1 5   0   12 o 4  2.61444e+00 1.72256e+00 1.84194e+02 180.000 -1.23567e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.01268e+02 0.000   2.85462e+02 0.000   0.8442 
1 1 1 5   0   13 o 19 1.29068e+01 1.54098e+00 2.62463e+02 0.000   1.19225e+01  0.00000e+00  0.00000e+00 0.00000e+00 2.22194e+02 0.000   4.02687e+01 180.000 1.0000 
1 1 1 5   0   14 o 7  2.32481e+01 1.33304e+00 2.74993e+02 180.000 -3.06379e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.97442e+02 180.000 3.22449e+02 180.000 1.0000 
1 1 1 5   0   15 o 4  3.57889e+00 2.27393e+00 3.04432e+01 180.000 -4.74932e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.89029e+01 180.000 1.54036e+00 0.000   0.4422 
1 1 1 5   0   16 o 10 2.78771e+00 1.93572e+00 4.70933e+01 0.000   7.34290e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.82688e+01 0.000   2.88245e+01 180.000 0.6257 
1 1 1 5   0   17 o 8  3.25508e+00 2.23073e+00 1.01685e+02 0.000   1.72819e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.27425e+01 0.000   8.89421e+01 180.000 0.9388 
1 1 1 5   1   0  o 4  1.20592e+01 3.71264e-01 1.58942e+02 160.827 -1.44488e+00 5.02406e-01  0.00000e+00 0.00000e+00 1.14991e+02 160.827 4.39505e+01 340.827 0.6034 
1 1 1 5   1   1  o 14 1.96770e+01 4.63670e-01 2.55314e+02 132.943 -2.00649e+00 2.15603e+00  0.00000e+00 0.00000e+00 3.41735e+02 132.943 8.64209e+01 132.943 0.8059 
1 1 1 5   1   2  o 11 1.66476e+01 4.28766e-01 2.83471e+02 42.537  2.78759e+00  2.55766e+00  0.00000e+00 0.00000e+00 2.52296e+02 42.537  3.11752e+01 222.537 0.8546 
1 1 1 5   1   3  o 5  7.11497e+00 4.01453e-01 2.42002e+02 289.275 4.28400e-01  -1.22500e+00 0.00000e+00 0.00000e+00 9.67746e+01 109.276 3.38777e+02 109.276 0.5420 
1 1 1 5   1   4  o 14 1.36212e+01 4.20712e-01 1.72598e+02 55.410  1.14387e+00  1.65873e+00  0.00000e+00 0.00000e+00 1.86571e+02 55.410  1.39728e+01 55.410  0.7002 
1 1 1 5   1   5  o 11 7.55576e+00 4.57155e-01 7.71755e+01 142.145 -4.92840e-01 3.83038e-01  0.00000e+00 0.00000e+00 7.55855e+00 142.145 6.96169e+01 322.145 0.2978 
1 1 1 5   1   6  o 14 3.91489e+01 8.15830e-01 8.87155e+02 177.006 -4.50999e+01 2.35850e+00  0.00000e+00 0.00000e+00 5.70399e+02 177.006 3.16757e+02 357.006 0.9889 
1 1 1 5   1   7  o 4  2.59451e+01 7.16650e-01 3.02912e+02 199.555 -9.73682e+00 -3.45858e+00 0.00000e+00 0.00000e+00 6.25201e+02 199.555 3.22288e+02 199.555 0.9503 
1 1 1 5   1   8  o 19 3.54071e+01 7.20651e-01 6.37341e+02 179.956 -3.83473e+01 2.91945e-02  0.00000e+00 0.00000e+00 6.77655e+02 179.956 4.03144e+01 179.956 0.9869 
1 1 1 5   1   9  o 1  2.54926e+01 6.47973e-01 5.08943e+02 208.493 -2.73705e+01 -1.48569e+01 0.00000e+00 0.00000e+00 4.34596e+02 208.493 7.43469e+01 28.493  0.9838 
1 1 1 5   1   10 o 12 4.66123e+01 9.20321e-01 7.94020e+02 215.889 -9.37091e+01 -6.78062e+01 0.00000e+00 0.00000e+00 9.51337e+02 215.889 1.57318e+02 215.889 0.9957 
1 1 1 5   1   11 o 4  2.65684e+01 7.66621e-01 3.72616e+02 2.827   4.14271e+01  2.04569e+00  0.00000e+00 0.00000e+00 6.13990e+02 2.827   2.41374e+02 2.827   0.9879 
1 1 1 5   1   12 o 6  2.25410e+01 8.12476e-01 4.68589e+02 265.636 -4.48012e+00 -5.87074e+01 0.00000e+00 0.00000e+00 3.71091e+02 265.636 9.74979e+01 85.636  0.9915 
1 1 1 5   1   13 o 4  1.61647e+01 9.25745e-01 2.77308e+02 203.878 -3.01680e+01 -1.33550e+01 0.00000e+00 0.00000e+00 3.20414e+02 203.878 4.31063e+01 203.878 0.9847 
1 1 1 5   1   14 o 5  9.43806e+00 1.45503e+00 2.22610e+02 83.509  1.86461e+00  1.63871e+01  0.00000e+00 0.00000e+00 1.20663e+02 83.509  1.01947e+02 263.508 0.9692 
1 1 1 5   1   15 o 4  1.27666e+01 1.29069e+00 2.12318e+02 150.378 -2.41760e+01 1.37463e+01  0.00000e+00 0.00000e+00 2.57758e+02 150.378 4.54405e+01 150.378 0.9819 
1 1 1 5   1   16 f 0  5.68671e+00 1.63530e+00 1.76424e+02 75.302  2.43834e+00  9.29559e+00  0.00000e+00 0.00000e+00 2.52645e+01 75.302  1.51160e+02 255.302 0.9464 
1 1 1 5   1   17 o 9  4.54602e+00 1.52950e+00 1.32297e+02 121.195 -3.35030e+00 5.53302e+00  0.00000e+00 0.00000e+00 2.41453e+01 121.195 1.08152e+02 301.195 0.9191 
1 1 1 5   2   0  o 4  2.02178e+01 4.67417e-01 3.25186e+02 252.441 -1.57725e+00 -4.98434e+00 0.00000e+00 0.00000e+00 3.58614e+02 252.441 3.34280e+01 252.441 0.8984 
1 1 1 5   2   1  o 8  7.80671e+00 3.67965e-01 1.76897e+02 196.860 -7.73774e-01 -2.34507e-01 0.00000e+00 0.00000e+00 6.68262e+01 16.860  2.43724e+02 16.860  0.3745 
1 1 1 5   2   2  o 3  2.97006e+01 6.24925e-01 4.55870e+02 78.050  2.23638e+00  1.05668e+01  0.00000e+00 0.00000e+00 6.09450e+02 78.050  1.53580e+02 78.050  0.9525 
1 1 1 5   2   3  f 0  9.82441e+00 3.90623e-01 2.95166e+02 215.758 -1.77143e+00 -1.27564e+00 0.00000e+00 0.00000e+00 2.66997e+01 35.758  3.21866e+02 35.758  0.7256 
1 1 1 5   2   4  o 17 1.95539e+01 4.86006e-01 4.39850e+02 45.724  5.13632e+00  5.26783e+00  0.00000e+00 0.00000e+00 2.44465e+02 45.724  1.95385e+02 225.724 0.9293 
1 1 1 5   2   5  o 3  1.21330e+01 4.43588e-01 3.74093e+02 50.640  3.08008e+00  3.75515e+00  0.00000e+00 0.00000e+00 3.24991e+01 50.640  3.41594e+02 230.640 0.8900 
1 1 1 5   2   6  o 1  2.17202e+01 5.49160e-01 5.94422e+02 130.385 -1.09709e+01 1.28973e+01  0.00000e+00 0.00000e+00 1.98817e+02 130.385 3.95605e+02 310.385 0.9700 
1 1 1 5   2   7  o 3  2.77114e+01 6.19313e-01 5.13661e+02 202.991 -1.72787e+01 -7.33128e+00 0.00000e+00 0.00000e+00 5.01292e+02 202.991 1.23692e+01 22.991  0.9730 
1 1 1 5   2   8  o 2  2.07615e+01 5.63227e-01 4.60477e+02 11.490  1.60196e+01  3.25632e+00  0.00000e+00 0.00000e+00 2.96553e+02 11.490  1.63924e+02 191.490 0.9689 
1 1 1 5   2   9  o 16 6.21211e+01 1.12723e+00 9.79671e+02 353.086 1.39635e+02  -1.69327e+01 0.00000e+00 0.00000e+00 1.34907e+03 353.086 3.69401e+02 353.086 0.9964 
1 1 1 5   2   10 o 16 2.03495e+01 6.64430e-01 4.75305e+02 84.546  2.94246e+00  3.08205e+01  0.00000e+00 0.00000e+00 2.77515e+02 84.546  1.97790e+02 264.546 0.9837 
1 1 1 5   2   11 o 17 1.52386e+01 8.05782e-01 1.93138e+02 22.459  1.13390e+01  4.68731e+00  0.00000e+00 0.00000e+00 3.55822e+02 22.459  1.62684e+02 22.459  0.9583 
1 1 1 5   2   12 o 12 1.46139e+01 9.04944e-01 3.49232e+02 236.837 -1.53062e+01 -2.34231e+01 0.00000e+00 0.00000e+00 1.89933e+02 236.837 1.59299e+02 56.837  0.9820 
1 1 1 5   2   13 o 8  8.24949e+00 1.32359e+00 1.03436e+02 1.852   5.58556e+00  1.80644e-01  0.00000e+00 0.00000e+00 1.77047e+02 1.852   7.36108e+01 1.852   0.9055 
1 1 1 5   2   14 o 1  2.61867e+01 9.59972e-01 4.56800e+02 131.444 -7.54297e+01 8.54268e+01  0.00000e+00 0.00000e+00 5.21586e+02 131.444 6.47866e+01 131.444 0.9956 
1 1 1 5   2   15 o 14 5.59368e+00 1.49675e+00 4.78632e+01 59.660  1.24943e+00  2.13473e+00  0.00000e+00 0.00000e+00 1.11999e+02 59.660  6.41355e+01 59.660  0.7621 
1 1 1 5   2   16 o 1  7.12877e+00 1.76093e+00 4.56057e+01 259.860 -5.09254e-01 -2.84734e+00 0.00000e+00 0.00000e+00 1.68563e+02 259.860 1.22958e+02 259.860 0.8017 
1 1 1 5   2   17 o 18 4.44245e+00 1.50288e+00 1.29130e+02 176.167 -6.25720e+00 4.19259e-01  0.00000e+00 0.00000e+00 2.32999e+01 176.167 1.05830e+02 356.167 0.9164 
1 1 1 5   3   0  o 19 8.97423e+00 3.57914e-01 2.63913e+02 71.669  5.90687e-01  1.78288e+00  0.00000e+00 0.00000e+00 3.52888e+01 251.669 2.99202e+02 251.669 0.6767 
1 1 1 5   3   1  o 19 2.17474e+01 4.93436e-01 2.95386e+02 295.798 1.62888e+00  -3.36973e+00 0.00000e+00 0.00000e+00 4.02958e+02 295.798 1.07572e+02 295.798 0.8528 
1 1 1 5   3   2  o 11 8.60014e+00 3.78068e-01 3.13303e+02 183.530 -2.14689e+00 -1.32426e-01 0.00000e+00 0.00000e+00 7.97845e+01 3.530   3.93088e+02 3.530   0.7211 
1 1 1 5   3   3  o 13 2.09512e+01 4.95592e-01 2.69494e+02 300.164 2.12816e+00  -3.66188e+00 0.00000e+00 0.00000e+00 4.18498e+02 300.164 1.49004e+02 300.164 0.8720 
1 1 1 5   3   4  o 7  1.79123e+01 4.66126e-01 5.84763e+02 246.372 -3.58678e+00 -8.19909e+00 0.00000e+00 0.00000e+00 5.08881e+01 246.372 5.33875e+02 66.373  0.9424 
1 1 1 5   3   5  o 14 1.19802e+01 4.35344e-01 3.41690e+02 185.812 -4.35391e+00 -4.43165e-01 0.00000e+00 0.00000e+00 5.37485e+01 185.812 2.87941e+02 5.812   0.8766 
1 1 1 5   3   6  f 0  2.71927e+01 5.93842e-01 4.57815e+02 149.360 -1.40200e+01 8.30466e+00  0.00000e+00 0.00000e+00 5.34058e+02 149.360 7.62425e+01 149.360 0.9688 
1 1 1 5   3   7  o 12 1.50181e+01 5.03962e-01 2.44035e+02 296.109 2.13257e+00  -4.35144e+00 0.00000e+00 0.00000e+00 2.58920e+02 296.109 1.48858e+01 296.109 0.8897 
1 1 1 5   3   8  o 17 4.11676e+01 8.31472e-01 5.18640e+02 138.996 -2.72130e+01 2.36591e+01  0.00000e+00 0.00000e+00 1.00898e+03 138.996 4.90339e+02 138.996 0.9860 
1 1 1 5   3   9  o 9  3.59730e+01 7.51574e-01 5.99337e+02 144.895 -4.20473e+01 2.95564e+01  0.00000e+00 0.00000e+00 7.40766e+02 144.895 1.41429e+02 144.895 0.9902 
1 1 1 5   3   10 o 1  3.86985e+01 8.20105e-01 5.24941e+02 130.723 -4.18301e+01 4.85917e+01  0.00000e+00 0.00000e+00 9.18983e+02 130.723 3.94041e+02 130.723 0.9922 
1 1 1 5   3   11 o 6  4.10492e+01 9.27035e-01 5.98917e+02 252.978 -2.95104e+01 -9.63902e+01 0.00000e+00 0.00000e+00 9.36451e+02 252.978 3.37534e+02 252.978 0.9950 
1 1 1 5   3   12 o 4  2.35518e+01 2.12412e+00 3.74803e+02 121.555 -1.83454e+01 2.98723e+01  0.00000e+00 0.00000e+00 4.97355e+02 121.555 1.22552e+02 121.555 0.9856 
1 1 1 5   3   13 o 7  1.47270e+01 9.50238e-01 3.26825e+02 76.278  8.34756e+00  3.41852e+01  0.00000e+00 0.00000e+00 2.18259e+02 76.278  1.08566e+02 256.278 0.9857 
1 1 1 5   3   14 o 7  2.38744e+01 9.94962e-01 4.08784e+02 267.359 -4.23132e+00 -9.17437e+01 0.00000e+00 0.00000e+00 4.82251e+02 267.359 7.34667e+01 267.359 0.9945 
1 1 1 5   3   15 o 14 6.89092e+00 1.60836e+00 1.67748e+02 61.376  4.82594e+00  8.84251e+00  0.00000e+00 0.00000e+00 7.74860e+01 61.376  9.02622e+01 241.376 0.9490 
1 1 1 5   3   16 o 6  1.18065e+01 1.82612e+00 2.05575e+02 267.739 -8.19858e-01 -2.07665e+01 0.00000e+00 0.00000e+00 2.26072e+02 267.739 2.04967e+01 267.739 0.9756 
1 1 1 5   3   17 o 2  7.91878e+00 1.88889e+00 1.72113e+02 5.207   1.17015e+01  1.06627e+00  0.00000e+00 0.00000e+00 1.11477e+02 5.207   6.06358e+01 185.207 0.9565 
1 1 1 5   4   0  o 10 2.59669e+01 5.54656e-01 6.09893e+02 16.225  1.19590e+01  3.48005e+00  0.00000e+00 0.00000e+00 3.27539e+02 16.225  2.82354e+02 196.225 0.9590 
1 1 1 5   4   1  o 10 2.11078e+01 4.83385e-01 3.09282e+02 215.139 -3.09497e+00 -2.17833e+00 0.00000e+00 0.00000e+00 3.69990e+02 215.139 6.07086e+01 215.139 0.8547 
1 1 1 5   4   2  o 1  1.40144e+01 4.59012e-01 5.61920e+01 157.591 -5.78178e-01 2.38409e-01  0.00000e+00 0.00000e+00 1.01253e+02 157.591 4.50607e+01 157.591 0.2983 
1 1 1 5   4   3  o 8  2.07629e+01 4.96332e-01 4.24422e+02 26.708  5.88691e+00  2.96183e+00  0.00000e+00 0.00000e+00 2.95420e+02 26.708  1.29001e+02 206.708 0.9206 
1 1 1 5   4   4  o 14 1.93659e+01 4.84012e-01 3.11917e+02 271.415 1.27192e-01  -5.14712e+00 0.00000e+00 0.00000e+00 3.42033e+02 271.415 3.01155e+01 271.415 0.8967 
1 1 1 5   4   5  o 1  4.18152e+01 8.55821e-01 8.81523e+02 59.410  1.98104e+01  3.35108e+01  0.00000e+00 0.00000e+00 6.72654e+02 59.410  2.08870e+02 239.410 0.9871 
1 1 1 5   4   6  o 19 2.80673e+01 6.06007e-01 5.73576e+02 50.906  1.32703e+01  1.63327e+01  0.00000e+00 0.00000e+00 4.57722e+02 50.906  1.15855e+02 230.906 0.9759 
1 1 1 5   4   7  f 0  3.33987e+01 6.98630e-01 4.18749e+02 192.538 -1.79348e+01 -3.98849e+00 0.00000e+00 0.00000e+00 8.03742e+02 192.538 3.84993e+02 192.538 0.9724 
1 1 1 5   4   8  o 19 4.16987e+01 8.38901e-01 5.45018e+02 275.753 3.84403e+00  -3.81519e+01 0.00000e+00 0.00000e+00 1.00361e+03 275.753 4.58592e+02 275.753 0.9869 
1 1 1 5   4   9  o 6  3.59415e+01 7.51629e-01 6.41164e+02 324.223 4.45544e+01  -3.21063e+01 0.00000e+00 0.00000e+00 6.98604e+02 324.223 5.74396e+01 324.223 0.9909 
1 1 1 5   4   10 o 2  2.68198e+01 7.07013e-01 4.48240e+02 140.824 -2.97069e+01 2.42074e+01  0.00000e+00 0.00000e+00 5.47103e+02 140.824 9.88625e+01 140.824 0.9869 
1 1 1 5   4   11 f 0  2.21602e+01 7.73872e-01 3.74339e+02 299.789 1.72382e+01  -3.01133e+01 0.00000e+00 0.00000e+00 4.46565e+02 299.789 7.22265e+01 299.789 0.9855 
1 1 1 5   4   12 o 19 1.30804e+01 9.81180e-01 2.11698e+02 208.365 -1.31581e+01 -7.10432e+00 0.00000e+00 0.00000e+00 2.63017e+02 208.365 5.13193e+01 208.365 0.9660 
1 1 1 5   4   13 o 5  7.09403e+00 1.41687e+00 1.87760e+02 342.619 8.06804e+00  -2.52534e+00 0.00000e+00 0.00000e+00 6.23298e+01 342.619 1.25430e+02 162.620 0.9388 
1 1 1 5   4   14 o 5  8.44103e+00 1.41470e+00 1.11156e+02 79.755  1.33227e+00  7.37093e+00  0.00000e+00 0.00000e+00 1.83631e+02 79.755  7.24750e+01 79.755  0.9306 
1 1 1 5   4   15 o 16 6.62489e+00 1.65764e+00 1.59898e+02 221.997 -6.68410e+00 -6.01785e+00 0.00000e+00 0.00000e+00 7.42915e+01 221.997 8.56069e+01 41.997  0.9427 
1 1 1 5   4   16 o 3  9.99745e+00 1.71908e+00 2.18108e+02 105.760 -5.39948e+00 1.91321e+01  0.00000e+00 0.00000e+00 1.46976e+02 105.760 7.11321e+01 285.760 0.9745 
1 1 1 5   4   17 o 13 4.42346e+00 1.48299e+00 1.40672e+02 106.212 -1.92212e+00 6.61098e+00  0.00000e+00 0.00000e+00 1.24028e+01 106.212 1.28269e+02 286.211 0.9242 
1 1 1 5   5   0  f 0  2.62872e+01 5.61066e-01 5.67023e+02 273.834 7.78128e-01  -1.16118e+01 0.00000e+00 0.00000e+00 3.79037e+02 273.834 1.87986e+02 93.834  0.9560 
1 1 1 5   5   1  o 5  1.92188e+01 5.49110e-01 5.79073e+02 31.779  5.44553e+00  3.37356e+00  0.00000e+00 0.00000e+00 8.53761e+01 31.779  4.93696e+02 211.779 0.9182 
1 1 1 5   5   2  o 17 1.92419e+01 5.40758e-01 4.36450e+02 137.901 -4.91661e+00 4.44235e+00  0.00000e+00 0.00000e+00 2.30950e+02 137.901 2.05499e+02 317.901 0.9211 
1 1 1 5   5   3  o 16 1.49048e+01 4.25416e-01 2.53099e+02 148.809 -2.40613e+00 1.45668e+00  0.00000e+00 0.00000e+00 1.93186e+02 148.809 5.99134e+01 328.809 0.7951 
1 1 1 5   5   4  o 6  1.02985e+01 4.05268e-01 4.26966e+02 270.338 2.20810e-02  -3.74196e+00 0.00000e+00 0.00000e+00 9.62382e+01 90.338  5.23204e+02 90.338  0.8528 
1 1 1 5   5   5  o 12 3.01038e+01 6.25916e-01 6.07684e+02 253.784 -5.42216e+00 -1.86443e+01 0.00000e+00 0.00000e+00 4.96261e+02 253.784 1.11422e+02 73.784  0.9739 
1 1 1 5   5   6  o 2  2.14510e+01 5.20283e-01 3.01867e+02 207.954 -7.48570e+00 -3.97247e+00 0.00000e+00 0.00000e+00 4.56480e+02 207.954 1.54614e+02 207.954 0.9390 
1 1 1 5   5   7  o 16 1.22774e+01 4.93805e-01 1.35971e+02 190.784 -2.16553e+00 -4.12472e-01 0.00000e+00 0.00000e+00 2.00767e+02 190.784 6.47962e+01 190.784 0.7286 
1 1 1 5   5   8  o 5  4.92046e+01 9.57527e-01 8.87268e+02 82.273  9.83039e+00  7.24477e+01  0.00000e+00 0.00000e+00 9.51692e+02 82.273  6.44237e+01 82.273  0.9931 
1 1 1 5   5   9  o 17 3.62206e+01 7.82040e-01 6.14775e+02 176.458 -5.28329e+01 3.26983e+00  0.00000e+00 0.00000e+00 7.34913e+02 176.458 1.20138e+02 176.458 0.9905 
1 1 1 5   5   10 o 11 3.40645e+01 7.65058e-01 6.70144e+02 349.330 7.11103e+01  -1.33975e+01 0.00000e+00 0.00000e+00 6.01996e+02 349.330 6.81477e+01 169.330 0.9931 
1 1 1 5   5   11 o 9  1.29559e+01 8.70904e-01 1.96818e+02 164.482 -1.01452e+01 2.81700e+00  0.00000e+00 0.00000e+00 2.66447e+02 164.482 6.96295e+01 164.482 0.9513 
1 1 1 5   5   12 o 1  1.69932e+01 8.55313e-01 3.42649e+02 135.710 -2.30405e+01 2.24762e+01  0.00000e+00 0.00000e+00 2.85794e+02 135.710 5.68545e+01 315.710 0.9843 
1 1 1 5   5   13 o 13 1.02491e+01 1.20580e+00 2.60613e+02 276.778 2.14145e+00  -1.80174e+01 0.00000e+00 0.00000e+00 1.13472e+02 276.778 1.47141e+02 96.778  0.9720 
1 1 1 5   5   14 o 2  6.89833e+00 1.51269e+00 1.78719e+02 53.138  5.65967e+00  7.54845e+00  0.00000e+00 0.00000e+00 6.60175e+01 53.138  1.12701e+02 233.138 0.9454 
1 1 1 5   5   15 o 10 7.06653e+00 1.56578e+00 1.53275e+02 138.769 -7.25713e+00 6.36000e+00  0.00000e+00 0.00000e+00 9.75905e+01 138.769 5.56842e+01 318.769 0.9467 
1 1 1 5   5   16 o 3  1.14647e+01 1.52928e+00 1.52848e+02 330.966 1.56102e+01  -8.66514e+00 0.00000e+00 0.00000e+00 2.64550e+02 330.966 1.11703e+02 330.966 0.9716 
1 1 1 5   5   17 o 3  6.07159e+00 1.76740e+00 6.91525e+01 140.708 -3.01705e+00 2.46872e+00  0.00000e+00 0.00000e+00 1.26239e+02 140.708 5.70867e+01 140.708 0.8595 
1 1 1 5   6   0  o 11 2.04941e+01 4.76063e-01 5.80770e+02 282.723 2.03187e+00  -8.99908e+00 0.00000e+00 0.00000e+00 1.47621e+02 282.723 4.33148e+02 102.723 0.9441 
1 1 1 5   6   1  o 9  1.06648e+01 4.47204e-01 7.54403e+01 253.955 -1.27148e-01 -4.42115e-01 0.00000e+00 0.00000e+00 1.45607e+01 253.955 6.08796e+01 73.955  0.2241 
1 1 1 5   6   2  o 15 2.00723e+01 5.63107e-01 4.72372e+02 174.403 -7.39568e+00 7.24823e-01  0.00000e+00 0.00000e+00 2.30583e+02 174.403 2.41789e+02 354.403 0.9301 
1 1 1 5   6   3  o 3  2.37398e+01 5.35306e-01 5.57381e+02 27.646  1.02416e+01  5.36473e+00  0.00000e+00 0.00000e+00 2.97001e+02 27.646  2.60379e+02 207.646 0.9557 
1 1 1 5   6   4  o 11 2.34236e+01 5.15803e-01 5.12382e+02 320.066 7.79388e+00  -6.52445e+00 0.00000e+00 0.00000e+00 3.25081e+02 320.066 1.87301e+02 140.066 0.9495 
1 1 1 5   6   5  o 4  4.06797e+01 7.87205e-01 7.41380e+02 3.857   3.17258e+01  2.13883e+00  0.00000e+00 0.00000e+00 7.66071e+02 3.857   2.46914e+01 3.857   0.9841 
1 1 1 5   6   6  o 5  1.47019e+01 4.61164e-01 4.67122e+02 99.841  -1.53608e+00 8.85524e+00  0.00000e+00 0.00000e+00 5.46158e+01 99.841  4.12507e+02 279.841 0.9426 
1 1 1 5   6   7  o 2  3.83285e+01 7.68833e-01 4.15796e+02 26.878  1.92594e+01  9.76154e+00  0.00000e+00 0.00000e+00 9.93115e+02 26.878  5.77319e+02 26.878  0.9766 
1 1 1 5   6   8  o 15 1.11861e+01 5.94781e-01 2.42781e+02 328.608 3.94880e+00  -2.40959e+00 0.00000e+00 0.00000e+00 1.29304e+02 328.608 1.13477e+02 148.608 0.8839 
1 1 1 5   6   9  o 13 2.03681e+01 6.33690e-01 2.49233e+02 89.561  9.33188e-02  1.21756e+01  0.00000e+00 0.00000e+00 4.84832e+02 89.561  2.35599e+02 89.561  0.9580 
1 1 1 5   6   10 o 16 1.89296e+01 7.82414e-01 3.22336e+02 327.945 1.63565e+01  -1.02424e+01 0.00000e+00 0.00000e+00 3.70822e+02 327.945 4.84869e+01 327.945 0.9737 
1 1 1 5   6   11 o 10 1.13690e+01 9.26185e-01 2.48207e+02 325.293 9.80372e+00  -6.79021e+00 0.00000e+00 0.00000e+00 1.60808e+02 325.293 8.73997e+01 145.293 0.9571 
1 1 1 5   6   12 o 15 1.95851e+01 7.88099e-01 4.08607e+02 308.952 2.81226e+01  -3.47873e+01 0.00000e+00 0.00000e+00 3.18930e+02 308.952 8.96772e+01 128.953 0.9888 
1 1 1 5   6   13 o 19 9.96305e+00 1.22247e+00 2.64462e+02 47.702  1.19785e+01  1.31649e+01  0.00000e+00 0.00000e+00 9.89720e+01 47.702  1.65490e+02 227.701 0.9715 
1 1 1 5   6   14 o 13 5.99739e+00 1.47399e+00 1.57379e+02 225.585 -5.13891e+00 -5.24502e+00 0.00000e+00 0.00000e+00 5.17351e+01 225.585 1.05644e+02 45.585  0.9292 
1 1 1 5   6   15 o 1  4.22851e+00 1.32593e+00 5.71414e+01 343.976 2.26689e+00  -6.51045e-01 0.00000e+00 0.00000e+00 6.15767e+01 343.976 4.43533e+00 343.976 0.7487 
1 1 1 5   6   16 o 13 1.21609e+01 1.64840e+00 1.75995e+02 108.577 -6.45169e+00 1.91961e+01  0.00000e+00 0.00000e+00 2.68298e+02 108.577 9.23027e+01 108.577 0.9750 
1 1 1 5   6   17 o 13 6.07862e+00 1.75814e+00 4.80815e+01 355.663 2.72086e+00  -2.06333e-01 0.00000e+00 0.00000e+00 1.31202e+02 355.663 8.31207e+01 355.663 0.7877 
1 1 1 5   7   0  o 10 7.33300e+00 4.13358e-01 9.27769e+01 68.294  1.48181e-01  3.72241e-01  0.00000e+00 0.00000e+00 3.85595e+01 248.293 1.31336e+02 248.293 0.1964 
1 1 1 5   7   1  o 6  1.61713e+01 4.90531e-01 5.47398e+02 84.940  4.42251e-01  4.99469e+00  0.00000e+00 0.00000e+00 3.25911e+00 264.940 5.50657e+02 264.940 0.8937 
1 1 1 5   7   2  o 19 2.30183e+01 5.95675e-01 4.88593e+02 230.834 -5.44556e+00 -6.68515e+00 0.00000e+00 0.00000e+00 3.26214e+02 230.834 1.62379e+02 50.835  0.9401 
1 1 1 5   7   3  o 3  2.14643e+01 5.06632e-01 5.19492e+02 4.102   9.66938e+00  6.93408e-01  0.00000e+00 0.00000e+00 2.45872e+02 4.102   2.73620e+02 184.102 0.9469 
1 1 1 5   7   4  o 11 2.23481e+01 5.05266e-01 2.15565e+02 72.097  1.32786e+00  4.11037e+00  0.00000e+00 0.00000e+00 5.20586e+02 72.097  3.05021e+02 72.097  0.8748 
1 1 1 5   7   5  o 3  1.84685e+01 4.74396e-01 2.46878e+02 266.185 -3.21536e-01 -4.82239e+00 0.00000e+00 0.00000e+00 3.71578e+02 266.185 1.24700e+02 266.185 0.8894 
1 1 1 5   7   6  o 3  1.89453e+01 4.97635e-01 8.08620e+01 302.809 9.92311e-01  -1.53921e+00 0.00000e+00 0.00000e+00 3.95619e+02 302.809 3.14757e+02 302.809 0.6680 
1 1 1 5   7   7  o 7  2.48993e+01 5.81449e-01 3.95481e+02 299.522 6.60909e+00  -1.16711e+01 0.00000e+00 0.00000e+00 5.06096e+02 299.522 1.10615e+02 299.522 0.9620 
1 1 1 5   7   8  f 0  2.75698e+01 6.36733e-01 2.03553e+02 337.084 8.87563e+00  -3.75208e+00 0.00000e+00 0.00000e+00 7.78515e+02 337.084 5.74963e+02 337.084 0.9466 
1 1 1 5   7   9  f 0  1.34397e+01 6.23614e-01 1.89088e+02 221.893 -4.53735e+00 -4.07009e+00 0.00000e+00 0.00000e+00 2.72925e+02 221.893 8.38369e+01 221.893 0.9138 
1 1 1 5   7   10 o 14 5.93382e+00 1.18879e+00 4.93067e+01 65.038  3.61671e-01  7.76954e-01  0.00000e+00 0.00000e+00 3.84850e+01 65.038  1.08217e+01 245.038 0.3934 
1 1 1 5   7   11 o 12 2.64208e+01 8.16988e-01 3.79377e+02 198.249 -4.08239e+01 -1.34609e+01 0.00000e+00 0.00000e+00 6.02109e+02 198.249 2.22733e+02 198.249 0.9883 
1 1 1 5   7   12 o 9  9.88839e+00 1.14422e+00 1.45228e+02 227.020 -5.41540e+00 -5.81139e+00 0.00000e+00 0.00000e+00 2.02033e+02 227.020 5.68051e+01 227.020 0.9348 
1 1 1 5   7   13 o 15 7.48753e+00 1.31656e+00 1.59056e+02 293.228 3.07808e+00  -7.17210e+00 0.00000e+00 0.00000e+00 1.03403e+02 293.228 5.56535e+01 113.228 0.9335 
1 1 1 5   7   14 o 11 5.19382e+00 1.39440e+00 7.74608e+01 34.126  2.77837e+00  1.88293e+00  0.00000e+00 0.00000e+00 8.49329e+01 34.126  7.47213e+00 34.126  0.8332 
1 1 1 5   7   15 o 9  1.15382e+01 1.39244e+00 1.80459e+02 231.301 -1.22973e+01 -1.53499e+01 0.00000e+00 0.00000e+00 2.41064e+02 231.301 6.06049e+01 231.301 0.9742 
1 1 1 5   7   16 o 12 9.53901e+00 1.78702e+00 9.01849e+01 43.789  5.41791e+00  5.19366e+00  0.00000e+00 0.00000e+00 2.42508e+02 43.789  1.52323e+02 43.789  0.9308 
1 1 1 5   7   17 o 17 6.17987e+00 1.77670e+00 1.20424e+02 225.821 -4.78625e+00 -4.92542e+00 0.00000e+00 0.00000e+00 9.33767e+01 225.821 2.70474e+01 45.821  0.9240 
1 1 1 5   8   0  o 5  3.30238e+01 7.89254e-01 7.81736e+02 106.646 -4.28578e+00 1.43343e+01  0.00000e+00 0.00000e+00 4.19085e+02 106.646 3.62651e+02 286.646 0.9660 
1 1 1 5   8   1  f 0  3.68297e+01 8.63098e-01 5.75864e+02 222.209 -8.76261e+00 -7.94791e+00 0.00000e+00 0.00000e+00 7.50783e+02 222.209 1.74920e+02 222.209 0.9568 
1 1 1 5   8   2  o 14 2.11570e+01 5.00579e-01 4.77257e+02 283.842 1.83961e+00  -7.46593e+00 0.00000e+00 0.00000e+00 2.65607e+02 283.842 2.11650e+02 103.842 0.9325 
1 1 1 5   8   3  o 5  1.30021e+01 4.69480e-01 2.31635e+02 78.568  5.16054e-01  2.55209e+00  0.00000e+00 0.00000e+00 1.48208e+02 78.568  8.34276e+01 258.568 0.7758 
1 1 1 5   8   4  o 8  1.99973e+01 4.72884e-01 3.57320e+02 244.243 -2.77371e+00 -5.74872e+00 0.00000e+00 0.00000e+00 3.33872e+02 244.243 2.34482e+01 64.243  0.9179 
1 1 1 5   8   5  f 0  1.94148e+01 4.81144e-01 3.42027e+02 235.992 -3.92535e+00 -5.81782e+00 0.00000e+00 0.00000e+00 3.34692e+02 235.992 7.33546e+00 55.992  0.9257 
1 1 1 5   8   6  o 17 3.10929e+01 6.47170e-01 6.95263e+02 222.309 -1.89983e+01 -1.72926e+01 0.00000e+00 0.00000e+00 4.52279e+02 222.309 2.42985e+02 42.309  0.9803 
1 1 1 5   8   7  o 5  1.84073e+01 5.10683e-01 4.03585e+02 51.577  6.29252e+00  7.93264e+00  0.00000e+00 0.00000e+00 2.54101e+02 51.577  1.49485e+02 231.577 0.9493 
1 1 1 5   8   8  o 4  1.01900e+01 6.05743e-01 2.50240e+02 339.401 4.10111e+00  -1.54141e+00 0.00000e+00 0.00000e+00 8.59428e+01 339.401 1.64297e+02 159.401 0.8767 
1 1 1 5   8   9  o 9  3.21986e+01 7.26058e-01 6.35235e+02 245.804 -1.99692e+01 -4.44422e+01 0.00000e+00 0.00000e+00 5.63517e+02 245.804 7.17184e+01 65.804  0.9897 
1 1 1 5   8   10 o 5  2.53262e+01 7.13117e-01 4.50253e+02 182.572 -3.50910e+01 -1.57624e+00 0.00000e+00 0.00000e+00 4.88453e+02 182.572 3.82000e+01 182.572 0.9857 
1 1 1 5   8   11 o 15 2.50130e+01 7.57333e-01 4.55501e+02 218.117 -3.87086e+01 -3.03700e+01 0.00000e+00 0.00000e+00 4.75064e+02 218.117 1.95632e+01 218.117 0.9898 
1 1 1 5   8   12 o 19 9.02357e+00 1.16955e+00 2.04495e+02 292.650 3.90434e+00  -9.35675e+00 0.00000e+00 0.00000e+00 1.17326e+02 292.650 8.71688e+01 112.650 0.9493 
1 1 1 5   8   13 o 8  3.94476e+00 1.22029e+00 5.41843e+01 94.588  -1.15456e-01 1.43869e+00  0.00000e+00 0.00000e+00 3.19899e+01 94.588  2.21944e+01 274.588 0.5818 
1 1 1 5   8   14 o 5  1.00856e+01 1.37548e+00 1.51654e+02 116.379 -5.71430e+00 1.15222e+01  0.00000e+00 0.00000e+00 2.11772e+02 116.379 6.01187e+01 116.379 0.9603 
1 1 1 5   8   15 o 19 4.70051e+00 1.42163e+00 1.18914e+02 49.558  3.37489e+00  3.95961e+00  0.00000e+00 0.00000e+00 3.93476e+01 49.558  7.95660e+01 229.558 0.8979 
1 1 1 5   8   16 f 0  7.04542e+00 1.77611e+00 7.78670e+01 37.464  3.82258e+00  2.92931e+00  0.00000e+00 0.00000e+00 1.56805e+02 37.464  7.89382e+01 37.464  0.8889 
1 1 1 5   8   17 o 10 7.19781e+00 1.93556e+00 1.76140e+02 236.757 -5.81957e+00 -8.87880e+00 0.00000e+00 0.00000e+00 8.03218e+01 236.757 9.58180e+01 56.757  0.9517 
1 1 1 5   9   0  o 13 6.62520e+00 4.06865e-01 2.42415e+02 330.243 8.02220e-01  -4.58637e-01 0.00000e+00 0.00000e+00 1.37962e+02 150.243 3.80377e+02 150.243 0.4188 
1 1 1 5   9   1  f 0  1.29458e+01 4.60242e-01 3.15918e+02 324.527 2.73115e+00  -1.94619e+00 0.00000e+00 0.00000e+00 9.01153e+01 324.527 2.25803e+02 144.527 0.8331 
1 1 1 5   9   2  o 1  1.32682e+01 3.87894e-01 5.50830e+02 118.945 -2.67290e+00 4.83304e+00  0.00000e+00 0.00000e+00 9.90856e+01 298.945 6.49916e+02 298.945 0.9042 
1 1 1 5   9   3  o 6  1.12477e+01 4.73660e-01 1.89363e+02 131.556 -1.21305e+00 1.36839e+00  0.00000e+00 0.00000e+00 9.33528e+01 131.556 9.60105e+01 311.556 0.6675 
1 1 1 5   9   4  o 12 2.10041e+01 4.87598e-01 3.51800e+02 287.339 1.95742e+00  -6.26947e+00 0.00000e+00 0.00000e+00 3.76106e+02 287.339 2.43059e+01 287.339 0.9204 
1 1 1 5   9   5  o 17 2.33301e+01 5.30184e-01 4.11290e+02 203.822 -9.22097e+00 -4.07125e+00 0.00000e+00 0.00000e+00 4.22336e+02 203.822 1.10455e+01 203.822 0.9490 
1 1 1 5   9   6  o 15 1.10146e+01 4.66093e-01 2.42167e+02 52.479  1.93483e+00  2.51958e+00  0.00000e+00 0.00000e+00 9.87834e+01 52.479  1.43384e+02 232.479 0.8222 
1 1 1 5   9   7  o 9  1.13907e+01 5.24592e-01 1.97475e+02 359.035 3.05977e+00  -5.15452e-02 0.00000e+00 0.00000e+00 1.51660e+02 359.035 4.58149e+01 179.035 0.8143 
1 1 1 5   9   8  o 6  3.71537e+01 7.68626e-01 5.82070e+02 287.792 1.12648e+01  -3.51018e+01 0.00000e+00 0.00000e+00 7.96896e+02 287.792 2.14825e+02 287.792 0.9863 
1 1 1 5   9   9  o 4  3.82947e+01 8.08190e-01 6.15870e+02 157.374 -5.74562e+01 2.39477e+01  0.00000e+00 0.00000e+00 8.13049e+02 157.374 1.97179e+02 157.374 0.9919 
1 1 1 5   9   10 f 0  1.39413e+01 7.73761e-01 3.38101e+02 214.656 -1.18713e+01 -8.20659e+00 0.00000e+00 0.00000e+00 1.67633e+02 214.656 1.70468e+02 34.656  0.9647 
1 1 1 5   9   11 o 6  2.20764e+01 7.63031e-01 3.25027e+02 213.922 -2.56742e+01 -1.72666e+01 0.00000e+00 0.00000e+00 4.91222e+02 213.922 1.66195e+02 213.922 0.9837 
1 1 1 5   9   12 o 12 9.13838e+00 1.15625e+00 1.29205e+02 22.837  5.99357e+00  2.52408e+00  0.00000e+00 0.00000e+00 1.86476e+02 22.837  5.72713e+01 22.837  0.9195 
1 1 1 5   9   13 o 15 9.29979e+00 1.30962e+00 2.03533e+02 308.314 8.29058e+00  -1.04922e+01 0.00000e+00 0.00000e+00 1.32320e+02 308.314 7.12138e+01 128.314 0.9619 
1 1 1 5   9   14 o 15 6.31465e+00 1.47887e+00 1.49262e+02 28.324  6.66408e+00  3.59184e+00  0.00000e+00 0.00000e+00 7.14275e+01 28.324  7.78347e+01 208.324 0.9314 
1 1 1 5   9   15 o 2  1.29787e+01 1.31085e+00 2.45220e+02 68.820  1.12963e+01  2.91531e+01  0.00000e+00 0.00000e+00 2.33600e+02 68.820  1.16198e+01 248.820 0.9839 
1 1 1 5   9   16 o 17 4.82750e+00 1.45360e+00 7.32677e+01 295.419 1.60783e+00  -3.38326e+00 0.00000e+00 0.00000e+00 8.10235e+01 295.419 7.75586e+00 295.419 0.8530 
1 1 1 5   9   17 o 17 4.41550e+00 1.47539e+00 1.11046e+02 268.937 -1.07000e-01 -5.76517e+00 0.00000e+00 0.00000e+00 3.91514e+01 268.937 7.18945e+01 88.937  0.9086 
1 1 1 5   10  0  o 12 3.21686e+01 7.62598e-01 7.36689e+02 114.276 -5.50778e+00 1.22120e+01  0.00000e+00 0.00000e+00 4.28064e+02 114.276 3.08625e+02 294.276 0.9619 
1 1 1 5   10  1  o 5  2.10002e+01 4.87389e-01 2.82625e+02 288.787 1.54795e+00  -4.55037e+00 0.00000e+00 0.00000e+00 4.19981e+02 288.787 1.37356e+02 288.787 0.8887 
1 1 1 5   10  2  o 13 1.55328e+01 4.10338e-01 4.00861e+02 143.797 -3.75849e+00 2.75109e+00  0.00000e+00 0.00000e+00 1.16597e+02 143.797 2.84264e+02 323.797 0.8848 
1 1 1 5   10  3  o 14 1.72913e+01 5.28020e-01 3.19201e+02 330.945 4.10807e+00  -2.28231e+00 0.00000e+00 0.00000e+00 2.57595e+02 330.945 6.16058e+01 150.945 0.8859 
1 1 1 5   10  4  o 11 1.00119e+01 4.12126e-01 2.03210e+02 342.836 1.72092e+00  -5.31523e-01 0.00000e+00 0.00000e+00 4.64466e+01 342.836 1.56764e+02 162.836 0.6623 
1 1 1 5   10  5  o 3  2.30230e+01 5.26846e-01 4.30804e+02 260.296 -1.75003e+00 -1.02338e+01 0.00000e+00 0.00000e+00 3.93151e+02 260.296 3.76535e+01 80.296  0.9505 
1 1 1 5   10  6  o 12 1.24506e+01 4.54671e-01 5.99708e+01 283.489 2.06956e-01  -8.62747e-01 0.00000e+00 0.00000e+00 1.29857e+02 283.489 6.98866e+01 283.489 0.4050 
1 1 1 5   10  7  o 5  1.39933e+01 4.91890e-01 2.60757e+02 67.076  1.93209e+00  4.56864e+00  0.00000e+00 0.00000e+00 2.09278e+02 67.076  5.14790e+01 247.076 0.8925 
1 1 1 5   10  8  o 19 1.45966e+01 5.61029e-01 2.79211e+02 262.786 -8.79512e-01 -6.94879e+00 0.00000e+00 0.00000e+00 2.29157e+02 262.786 5.00545e+01 82.786  0.9256 
1 1 1 5   10  9  o 16 4.26285e+01 8.69736e-01 7.87690e+02 141.785 -6.92122e+01 5.44932e+01  0.00000e+00 0.00000e+00 8.06705e+02 141.785 1.90151e+01 141.785 0.9943 
1 1 1 5   10  10 o 4  2.99679e+01 7.49844e-01 4.14992e+02 323.899 3.08006e+01  -2.24608e+01 0.00000e+00 0.00000e+00 6.96977e+02 323.899 2.81986e+02 323.899 0.9868 
1 1 1 5   10  11 o 6  3.09465e+01 7.86612e-01 5.24745e+02 70.040  2.38127e+01  6.55659e+01  0.00000e+00 0.00000e+00 6.30025e+02 70.040  1.05281e+02 70.040  0.9928 
1 1 1 5   10  12 o 4  1.36646e+01 9.26672e-01 1.31191e+02 328.020 8.80375e+00  -5.49697e+00 0.00000e+00 0.00000e+00 3.56748e+02 328.020 2.25557e+02 328.020 0.9505 
1 1 1 5   10  13 o 7  5.70362e+00 1.32236e+00 1.61618e+02 184.459 -6.45982e+00 -5.03702e-01 0.00000e+00 0.00000e+00 3.52276e+01 184.459 1.26390e+02 4.459   0.9192 
1 1 1 5   10  14 o 9  1.70708e+01 1.00234e+00 2.19069e+02 42.041  2.71308e+01  2.44640e+01  0.00000e+00 0.00000e+00 4.12633e+02 42.041  1.93564e+02 42.041  0.9862 
1 1 1 5   10  15 o 11 1.93289e+01 1.12982e+00 3.08265e+02 308.938 4.00290e+01  -4.95404e+01 0.00000e+00 0.00000e+00 4.10788e+02 308.938 1.02523e+02 308.938 0.9921 
1 1 1 5   10  16 o 14 8.08794e+00 1.79996e+00 1.87887e+02 329.288 1.13056e+01  -6.71601e+00 0.00000e+00 0.00000e+00 1.03394e+02 329.288 8.44930e+01 149.288 0.9612 
1 1 1 5   10  17 o 11 8.45572e+00 2.01752e+00 1.00769e+02 83.120  8.47036e-01  7.01973e+00  0.00000e+00 0.00000e+00 1.92471e+02 83.120  9.17024e+01 83.120  0.9263 
1 1 1 5   11  0  o 5  1.55589e+01 4.17121e-01 2.56735e+02 3.573   2.23179e+00  1.39373e-01  0.00000e+00 0.00000e+00 1.72527e+02 3.573   8.42079e+01 183.573 0.7330 
1 1 1 5   11  1  o 9  4.42047e+00 4.27658e-01 1.09320e+02 339.643 3.62492e-01  -1.34498e-01 0.00000e+00 0.00000e+00 7.77349e+01 159.643 1.87054e+02 159.643 0.1898 
1 1 1 5   11  2  o 17 1.40812e+01 3.99166e-01 3.03651e+02 316.718 2.30426e+00  -2.17006e+00 0.00000e+00 0.00000e+00 1.31878e+02 316.718 1.71773e+02 136.718 0.8215 
1 1 1 5   11  3  o 10 8.69633e+00 6.62902e-01 7.47792e+01 133.830 -3.52078e-01 3.66754e-01  0.00000e+00 0.00000e+00 5.87664e+00 133.830 6.89026e+01 313.830 0.2463 
1 1 1 5   11  4  o 18 1.45206e+01 4.23435e-01 4.56927e+02 14.672  5.65006e+00  1.47927e+00  0.00000e+00 0.00000e+00 4.04902e+01 14.672  4.16437e+02 194.671 0.9098 
1 1 1 5   11  5  o 17 6.98485e+00 4.81521e-01 1.40534e+02 329.561 8.83283e-01  -5.19032e-01 0.00000e+00 0.00000e+00 2.08810e+01 149.561 1.61415e+02 149.561 0.4550 
1 1 1 5   11  6  o 5  1.76183e+01 4.87594e-01 4.59993e+02 132.445 -6.47678e+00 7.08169e+00  0.00000e+00 0.00000e+00 1.67664e+02 132.445 2.92329e+02 312.445 0.9464 
1 1 1 5   11  7  o 4  1.25639e+01 5.00603e-01 3.27731e+02 120.394 -3.33259e+00 5.68166e+00  0.00000e+00 0.00000e+00 1.07592e+02 120.394 2.20139e+02 300.394 0.9206 
1 1 1 5   11  8  o 17 3.27002e+01 8.04462e-01 3.94395e+02 309.400 1.39078e+01  -1.69317e+01 0.00000e+00 0.00000e+00 8.07603e+02 309.400 4.13208e+02 309.400 0.9769 
1 1 1 5   11  9  o 9  4.98783e+01 9.83368e-01 7.67909e+02 1.109   9.93321e+01  1.92278e+00  0.00000e+00 0.00000e+00 1.09880e+03 1.109   3.30892e+02 1.109   0.9950 
1 1 1 5   11  10 o 7  2.86916e+01 8.54801e-01 2.87387e+02 29.595  2.17430e+01  1.23494e+01  0.00000e+00 0.00000e+00 7.69643e+02 29.595  4.82256e+02 29.595  0.9798 
1 1 1 5   11  11 o 13 2.99061e+01 7.90061e-01 6.92529e+02 200.368 -8.73019e+01 -3.24125e+01 0.00000e+00 0.00000e+00 4.25418e+02 200.368 2.67110e+02 20.368  0.9946 
1 1 1 5   11  12 o 15 1.03851e+01 1.17321e+00 2.22621e+02 62.290  5.88717e+00  1.12085e+01  0.00000e+00 0.00000e+00 1.51760e+02 62.290  7.08609e+01 242.290 0.9597 
1 1 1 5   11  13 o 18 1.31918e+01 1.07885e+00 2.68750e+02 269.052 -4.46243e-01 -2.69790e+01 0.00000e+00 0.00000e+00 2.17260e+02 269.052 5.14900e+01 89.052  0.9813 
1 1 1 5   11  14 o 6  9.44796e+00 1.49710e+00 1.92496e+02 75.317  3.57871e+00  1.36574e+01  0.00000e+00 0.00000e+00 1.49206e+02 75.317  4.32905e+01 255.317 0.9639 
1 1 1 5   11  15 o 16 3.96647e+00 1.27115e+00 1.48435e+02 222.261 -4.59922e+00 -4.17930e+00 0.00000e+00 0.00000e+00 1.22681e+01 42.261  1.60703e+02 42.261  0.9156 
1 1 1 5   11  16 o 10 5.40029e+00 1.56907e+00 1.28827e+02 55.146  3.95318e+00  5.67655e+00  0.00000e+00 0.00000e+00 5.82512e+01 55.146  7.05756e+01 235.146 0.9246 
1 1 1 5   11  17 o 11 5.65454e+00 1.73431e+00 1.08154e+02 204.045 -5.54893e+00 -2.47578e+00 0.00000e+00 0.00000e+00 8.52308e+01 204.045 2.29229e+01 24.045  0.9135 
1 1 1 5   12  0  o 18 1.97778e+01 6.86111e-01 2.07026e+02 156.628 -3.05083e+00 1.31847e+00  0.00000e+00 0.00000e+00 4.11824e+02 156.628 2.04798e+02 156.628 0.8313 
1 1 1 5   12  1  o 6  1.38359e+01 3.81511e-01 3.37608e+02 287.706 1.12189e+00  -3.51398e+00 0.00000e+00 0.00000e+00 1.05319e+02 287.706 2.32289e+02 107.706 0.8504 
1 1 1 5   12  2  o 6  6.48623e+00 5.18960e-01 1.27681e+02 140.928 -4.92154e-01 3.99566e-01  0.00000e+00 0.00000e+00 5.39218e+01 320.928 1.81603e+02 320.928 0.3020 
1 1 1 5   12  3  o 18 1.56107e+01 5.25553e-01 1.97376e+02 252.646 -7.14176e-01 -2.28543e+00 0.00000e+00 0.00000e+00 2.45213e+02 252.646 4.78369e+01 252.646 0.7530 
1 1 1 5   12  4  o 11 1.46587e+01 4.28389e-01 1.92316e+02 181.803 -2.71350e+00 -8.54190e-02 0.00000e+00 0.00000e+00 2.41748e+02 181.803 4.94322e+01 181.803 0.7865 
1 1 1 5   12  5  o 6  2.95187e+01 6.16689e-01 6.16849e+02 59.083  9.69593e+00  1.61901e+01  0.00000e+00 0.00000e+00 4.64613e+02 59.083  1.52236e+02 239.083 0.9731 
1 1 1 5   12  6  o 14 3.45593e+01 7.00721e-01 6.05809e+02 141.827 -2.02082e+01 1.58867e+01  0.00000e+00 0.00000e+00 6.69542e+02 141.827 6.37327e+01 141.827 0.9804 
1 1 1 5   12  7  o 7  2.56104e+01 5.94396e-01 4.27483e+02 254.655 -4.60895e+00 -1.67956e+01 0.00000e+00 0.00000e+00 5.08285e+02 254.655 8.08018e+01 254.655 0.9709 
1 1 1 5   12  8  o 10 3.27048e+01 7.95792e-01 4.87044e+02 292.996 1.29217e+01  -3.04473e+01 0.00000e+00 0.00000e+00 7.24756e+02 292.996 2.37712e+02 292.996 0.9848 
1 1 1 5   12  9  o 7  2.97988e+01 7.03832e-01 5.13430e+02 159.804 -3.80804e+01 1.40080e+01  0.00000e+00 0.00000e+00 5.93522e+02 159.804 8.00920e+01 159.804 0.9876 
1 1 1 5   12  10 o 2  1.99201e+01 7.06704e-01 4.19902e+02 346.373 2.58034e+01  -6.25524e+00 0.00000e+00 0.00000e+00 3.14845e+02 346.373 1.05057e+02 166.373 0.9810 
1 1 1 5   12  11 o 3  2.75562e+01 9.05948e-01 5.71221e+02 182.247 -6.94816e+01 -2.72645e+00 0.00000e+00 0.00000e+00 4.56953e+02 182.247 1.14268e+02 2.247   0.9928 
1 1 1 5   12  12 o 15 1.36950e+01 9.53044e-01 2.12410e+02 273.162 9.42314e-01  -1.70557e+01 0.00000e+00 0.00000e+00 2.86741e+02 273.162 7.43308e+01 273.162 0.9703 
1 1 1 5   12  13 o 6  5.04179e+00 1.39195e+00 4.87021e+01 246.145 -6.80065e-01 -1.53789e+00 0.00000e+00 0.00000e+00 7.20453e+01 246.145 2.33432e+01 246.145 0.6379 
1 1 1 5   12  14 o 6  9.25815e+00 1.44287e+00 2.30620e+02 326.324 1.41140e+01  -9.40439e+00 0.00000e+00 0.00000e+00 1.06342e+02 326.324 1.24278e+02 146.324 0.9701 
1 1 1 5   12  15 o 2  1.02739e+01 1.56801e+00 2.32144e+02 266.642 -1.26311e+00 -2.15301e+01 0.00000e+00 0.00000e+00 1.44029e+02 266.642 8.81157e+01 86.642  0.9765 
1 1 1 5   12  16 o 12 9.88593e+00 1.56522e+00 1.66252e+02 267.023 -8.50301e-01 -1.63509e+01 0.00000e+00 0.00000e+00 1.92641e+02 267.023 2.63888e+01 267.023 0.9690 
1 1 1 5   12  17 o 7  4.97571e+00 1.61828e+00 9.62607e+01 85.197  4.29374e-01  5.11010e+00  0.00000e+00 0.00000e+00 7.06882e+01 85.197  2.55725e+01 265.197 0.8963 
1 1 1 5   13  0  o 8  2.42652e+01 5.02027e-01 6.85860e+02 138.473 -9.99036e+00 8.84713e+00  0.00000e+00 0.00000e+00 1.92505e+02 138.473 4.93355e+02 318.473 0.9618 
1 1 1 5   13  1  o 14 2.18566e+01 5.01058e-01 6.78284e+02 98.779  -1.73408e+00 1.12289e+01  0.00000e+00 0.00000e+00 1.07399e+02 98.779  5.70885e+02 278.779 0.9549 
1 1 1 5   13  2  o 12 1.31653e+01 4.45411e-01 3.99848e+02 272.962 2.06037e-01  -3.98163e+00 0.00000e+00 0.00000e+00 2.79038e+01 272.962 3.71945e+02 92.962  0.8630 
1 1 1 5   13  3  o 12 1.49331e+01 4.39142e-01 3.08747e+02 125.430 -2.06135e+00 2.89736e+00  0.00000e+00 0.00000e+00 1.65758e+02 125.430 1.42989e+02 305.430 0.8440 
1 1 1 5   13  4  o 19 1.54634e+01 4.39569e-01 1.50177e+02 138.735 -1.67022e+00 1.46551e+00  0.00000e+00 0.00000e+00 2.75438e+02 138.735 1.25261e+02 138.735 0.7311 
1 1 1 5   13  5  o 17 3.50541e+01 6.98943e-01 5.45701e+02 217.003 -1.83658e+01 -1.38414e+01 0.00000e+00 0.00000e+00 7.44950e+02 217.003 1.99250e+02 217.003 0.9780 
1 1 1 5   13  6  o 17 2.11338e+01 6.08187e-01 3.73460e+02 279.231 1.55443e+00  -9.56417e+00 0.00000e+00 0.00000e+00 3.79807e+02 279.231 6.34699e+00 279.231 0.9469 
1 1 1 5   13  7  o 7  2.89023e+01 6.40948e-01 3.78572e+02 315.107 1.22774e+01  -1.22318e+01 0.00000e+00 0.00000e+00 6.77280e+02 315.107 2.98708e+02 315.107 0.9707 
1 1 1 5   13  8  o 8  3.96806e+01 8.08210e-01 7.11126e+02 7.236   5.79838e+01  7.36239e+00  0.00000e+00 0.00000e+00 7.69013e+02 7.236   5.78870e+01 7.236   0.9914 
1 1 1 5   13  9  o 9  2.00872e+01 6.31131e-01 4.22888e+02 120.067 -1.10982e+01 1.91710e+01  0.00000e+00 0.00000e+00 3.15387e+02 120.067 1.07501e+02 300.067 0.9772 
1 1 1 5   13  10 o 18 3.27140e+01 8.74033e-01 4.64633e+02 227.857 -3.18235e+01 -3.51665e+01 0.00000e+00 0.00000e+00 7.52324e+02 227.857 2.87692e+02 227.857 0.9894 
1 1 1 5   13  11 o 10 3.63255e+01 8.61318e-01 6.88063e+02 74.726  2.92389e+01  1.07071e+02  0.00000e+00 0.00000e+00 6.70950e+02 74.726  1.71136e+01 254.726 0.9955 
1 1 1 5   13  12 o 16 1.14958e+01 9.92835e-01 1.69499e+02 35.187  9.26233e+00  6.53070e+00  0.00000e+00 0.00000e+00 2.42804e+02 35.187  7.33048e+01 35.187  0.9548 
1 1 1 5   13  13 o 5  4.61821e+00 1.28179e+00 7.77546e+01 90.706  -3.18757e-02 2.58600e+00  0.00000e+00 0.00000e+00 5.64484e+01 90.706  2.13063e+01 270.706 0.7741 
1 1 1 5   13  14 o 19 3.65516e+00 1.18548e+00 1.27976e+02 321.897 3.24969e+00  -2.54833e+00 0.00000e+00 0.00000e+00 8.89634e+00 141.897 1.36872e+02 141.897 0.8683 
1 1 1 5   13  15 o 6  1.63483e+01 1.18233e+00 3.78245e+02 339.726 6.39176e+01  -2.36109e+01 0.00000e+00 0.00000e+00 2.30186e+02 339.726 1.48059e+02 159.726 0.9926 
1 1 1 5   13  16 o 4  1.67130e+01 1.38645e+00 3.45347e+02 161.212 -6.03544e+01 2.05321e+01  0.00000e+00 0.00000e+00 2.75872e+02 161.212 6.94758e+01 341.212 0.9921 
1 1 1 5   13  17 o 2  7.14754e+00 1.98014e+00 1.39419e+02 287.556 2.60959e+00  -8.24849e+00 0.00000e+00 0.00000e+00 1.12172e+02 287.556 2.72470e+01 107.556 0.9403 
1 1 1 5   14  0  o 2  1.91073e+01 4.91722e-01 2.84074e+02 303.159 2.34293e+00  -3.58591e+00 0.00000e+00 0.00000e+00 3.44155e+02 303.159 6.00814e+01 303.159 0.8736 
1 1 1 5   14  1  o 6  8.49423e+00 3.63116e-01 1.75035e+02 83.837  1.20754e-01  1.11833e+00  0.00000e+00 0.00000e+00 1.87193e+01 263.837 1.93754e+02 263.837 0.4889 
1 1 1 5   14  2  f 0  1.05464e+01 3.82513e-01 2.62119e+02 313.521 1.42558e+00  -1.50113e+00 0.00000e+00 0.00000e+00 1.93677e+01 313.521 2.42752e+02 133.521 0.7090 
1 1 1 5   14  3  o 14 1.07383e+01 3.84530e-01 1.02287e+02 31.039  7.19689e-01  4.33098e-01  0.00000e+00 0.00000e+00 5.40986e+01 31.039  4.81881e+01 211.039 0.3868 
1 1 1 5   14  4  o 13 1.85358e+01 4.99964e-01 2.63903e+02 68.159  1.72824e+00  4.31204e+00  0.00000e+00 0.00000e+00 3.53302e+02 68.159  8.93987e+01 68.159  0.8845 
1 1 1 5   14  5  o 17 9.92709e+00 4.34613e-01 2.75735e+02 156.481 -3.02406e+00 1.31608e+00  0.00000e+00 0.00000e+00 3.43734e+01 156.481 2.41361e+02 336.481 0.8298 
1 1 1 5   14  6  o 8  2.05623e+01 5.00919e-01 2.73098e+02 271.612 1.93872e-01  -6.88957e+00 0.00000e+00 0.00000e+00 4.42289e+02 271.612 1.69192e+02 271.612 0.9243 
1 1 1 5   14  7  o 12 3.89579e+01 7.44644e-01 8.93289e+02 39.148  4.24480e+01  3.45554e+01  0.00000e+00 0.00000e+00 5.59353e+02 39.148  3.33937e+02 219.148 0.9908 
1 1 1 5   14  8  o 7  4.57256e+01 8.62004e-01 8.22106e+02 150.744 -6.75745e+01 3.78530e+01  0.00000e+00 0.00000e+00 8.87094e+02 150.744 6.49882e+01 150.744 0.9935 
1 1 1 5   14  9  o 12 2.04857e+01 7.22897e-01 2.79609e+02 289.783 5.02042e+00  -1.39574e+01 0.00000e+00 0.00000e+00 4.64439e+02 289.783 1.84830e+02 289.783 0.9657 
1 1 1 5   14  10 o 15 7.26249e+00 1.08701e+00 1.17431e+02 160.402 -2.44318e+00 8.69865e-01  0.00000e+00 0.00000e+00 9.41228e+01 160.402 2.33080e+01 340.402 0.7748 
1 1 1 5   14  11 o 5  1.25509e+01 9.11490e-01 2.66387e+02 220.035 -1.12677e+01 -9.46641e+00 0.00000e+00 0.00000e+00 1.88964e+02 220.035 7.74235e+01 40.035  0.9654 
1 1 1 5   14  12 o 13 2.17226e+01 8.41444e-01 3.73784e+02 104.485 -1.21678e+01 4.70999e+01  0.00000e+00 0.00000e+00 4.33721e+02 104.485 5.99370e+01 104.485 0.9897 
1 1 1 5   14  13 o 19 2.08107e+01 8.78121e-01 3.37059e+02 231.933 -3.52766e+01 -4.50431e+01 0.00000e+00 0.00000e+00 4.37327e+02 231.933 1.00268e+02 231.933 0.9912 
1 1 1 5   14  14 o 6  1.21028e+01 1.18972e+00 2.48600e+02 341.777 2.51711e+01  -8.28722e+00 0.00000e+00 0.00000e+00 1.96811e+02 341.777 5.17890e+01 161.777 0.9809 
1 1 1 5   14  15 o 14 5.21076e+00 1.42939e+00 9.19571e+01 215.891 -3.79178e+00 -2.74393e+00 0.00000e+00 0.00000e+00 8.10142e+01 215.891 1.09429e+01 35.891  0.8854 
1 1 1 5   14  16 o 11 8.31125e+00 1.82200e+00 1.13797e+02 276.646 9.37529e-01  -8.04622e+00 0.00000e+00 0.00000e+00 1.77666e+02 276.646 6.38695e+01 276.646 0.9361 
1 1 1 5   14  17 o 6  8.36298e+00 2.11091e+00 2.42506e+02 68.842  5.84562e+00  1.51039e+01  0.00000e+00 0.00000e+00 6.07239e+01 68.842  1.81782e+02 248.842 0.9686 
1 1 1 5   15  0  o 9  1.48673e+01 3.83526e-01 3.24869e+02 105.249 -9.73594e-01 3.57133e+00  0.00000e+00 0.00000e+00 1.51277e+02 105.249 1.73592e+02 285.249 0.8510 
1 1 1 5   15  1  o 14 8.65681e+00 3.59422e-01 2.02267e+02 71.926  4.04862e-01  1.24060e+00  0.00000e+00 0.00000e+00 2.49703e+01 251.926 2.27237e+02 251.926 0.5441 
1 1 1 5   15  2  o 15 7.89070e+00 3.79497e-01 3.68491e+01 283.104 5.75146e-02  -2.47072e-01 0.00000e+00 0.00000e+00 5.28099e-01 283.104 3.63210e+01 103.104 0.1258 
1 1 1 5   15  3  o 1  1.40970e+01 4.01479e-01 5.20841e+02 67.256  2.44806e+00  5.83958e+00  0.00000e+00 0.00000e+00 3.40591e+01 247.256 5.54900e+02 247.256 0.9172 
1 1 1 5   15  4  o 5  2.38718e+01 5.67996e-01 4.30060e+02 357.553 9.33444e+00  -3.98864e-01 0.00000e+00 0.00000e+00 4.19081e+02 357.553 1.09785e+01 177.553 0.9449 
1 1 1 5   15  5  o 12 2.11859e+01 4.88006e-01 2.89881e+02 95.190  -6.65450e-01 7.32608e+00  0.00000e+00 0.00000e+00 4.51259e+02 95.190  1.61379e+02 95.190  0.9293 
1 1 1 5   15  6  o 14 1.99977e+01 6.31832e-01 3.94799e+02 4.009   1.02730e+01  7.19926e-01  0.00000e+00 0.00000e+00 3.20353e+02 4.009   7.44464e+01 184.009 0.9501 
1 1 1 5   15  7  o 2  1.23666e+01 5.71219e-01 1.11167e+02 116.953 -9.65588e-01 1.89895e+00  0.00000e+00 0.00000e+00 2.22998e+02 116.953 1.11831e+02 116.953 0.7181 
1 1 1 5   15  8  o 16 3.90003e+01 7.66902e-01 6.20852e+02 261.405 -7.49934e+00 -4.96148e+01 0.00000e+00 0.00000e+00 8.31711e+02 261.405 2.10859e+02 261.405 0.9900 
1 1 1 5   15  9  o 13 1.15748e+01 7.21533e-01 2.13098e+02 76.411  1.49941e+00  6.20302e+00  0.00000e+00 0.00000e+00 1.86492e+02 76.411  2.66066e+01 256.411 0.9179 
1 1 1 5   15  10 o 4  3.31974e+01 7.80740e-01 6.29682e+02 310.523 4.41098e+01  -5.16048e+01 0.00000e+00 0.00000e+00 6.09165e+02 310.523 2.05166e+01 130.523 0.9926 
1 1 1 5   15  11 o 19 2.33448e+01 7.80809e-01 5.26150e+02 82.947  7.14101e+00  5.77183e+01  0.00000e+00 0.00000e+00 3.43547e+02 82.947  1.82603e+02 262.947 0.9914 
1 1 1 5   15  12 o 5  9.48828e+00 1.15484e+00 9.37569e+01 81.269  8.22528e-01  5.35589e+00  0.00000e+00 0.00000e+00 2.27793e+02 81.269  1.34036e+02 81.269  0.9023 
1 1 1 5   15  13 o 12 1.47496e+01 9.95708e-01 2.60146e+02 312.699 2.05102e+01  -2.22274e+01 0.00000e+00 0.00000e+00 2.84308e+02 312.699 2.41622e+01 312.699 0.9833 
1 1 1 5   15  14 o 9  5.87710e+00 1.44158e+00 9.55036e+01 129.256 -2.93999e+00 3.59758e+00  0.00000e+00 0.00000e+00 9.95074e+01 129.256 4.00383e+00 129.256 0.8845 
1 1 1 5   15  15 o 3  5.20346e+00 1.46035e+00 7.44082e+01 103.166 -8.47237e-01 3.62181e+00  0.00000e+00 0.00000e+00 9.17589e+01 103.166 1.73508e+01 103.166 0.8518 
1 1 1 5   15  16 o 1  7.47393e+00 1.96223e+00 1.54944e+02 60.875  4.45218e+00  7.99095e+00  0.00000e+00 0.00000e+00 1.09266e+02 60.875  4.56774e+01 240.875 0.9436 
1 1 1 5   15  17 o 7  7.93996e+00 2.13365e+00 1.57643e+02 154.890 -8.92024e+00 4.18042e+00  0.00000e+00 0.00000e+00 1.24049e+02 154.890 3.35937e+01 334.890 0.9478 
1 1 1 5   16  0  o 11 1.94297e+01 4.90494e-01 4.29469e+02 309.847 4.02442e+00  -4.82216e+00 0.00000e+00 0.00000e+00 2.40684e+02 309.847 1.88785e+02 129.847 0.9165 
1 1 1 5   16  1  o 17 8.18698e+00 3.51311e-01 1.93305e+02 248.223 -4.51374e-01 -1.12981e+00 0.00000e+00 0.00000e+00 3.37111e+01 68.223  2.27016e+02 68.223  0.5179 
1 1 1 5   16  2  o 4  1.75145e+01 4.16130e-01 2.53644e+02 183.864 -3.81612e+00 -2.57734e-01 0.00000e+00 0.00000e+00 3.11009e+02 183.864 5.73648e+01 183.864 0.8564 
1 1 1 5   16  3  o 5  1.94839e+01 4.64923e-01 3.58240e+02 36.262  4.80288e+00  3.52321e+00  0.00000e+00 0.00000e+00 3.10457e+02 36.262  4.77824e+01 216.262 0.9117 
1 1 1 5   16  4  o 12 6.41323e+00 4.70393e-01 2.25174e+02 321.711 1.02616e+00  -8.10087e-01 0.00000e+00 0.00000e+00 9.36480e+01 141.711 3.18822e+02 141.711 0.5448 
1 1 1 5   16  5  o 12 8.56762e+00 4.64590e-01 3.24884e+02 108.696 -9.92931e-01 2.93410e+00  0.00000e+00 0.00000e+00 6.14155e+01 288.696 3.86299e+02 288.696 0.8169 
1 1 1 5   16  6  o 4  3.19631e+01 6.36449e-01 6.52994e+02 178.682 -2.71293e+01 6.24119e-01  0.00000e+00 0.00000e+00 5.27625e+02 178.682 1.25368e+02 358.682 0.9814 
1 1 1 5   16  7  o 18 2.80359e+01 6.76892e-01 3.21111e+02 13.428  1.34808e+01  3.21852e+00  0.00000e+00 0.00000e+00 6.95070e+02 13.428  3.73959e+02 13.428  0.9632 
1 1 1 5   16  8  o 9  3.36083e+01 7.82155e-01 6.39368e+02 154.732 -4.01569e+01 1.89546e+01  0.00000e+00 0.00000e+00 6.10660e+02 154.732 2.87077e+01 334.732 0.9887 
1 1 1 5   16  9  o 11 3.04691e+01 8.31761e-01 3.39000e+02 141.161 -2.17077e+01 1.74779e+01  0.00000e+00 0.00000e+00 7.86136e+02 141.161 4.47136e+02 141.161 0.9819 
1 1 1 5   16  10 o 1  1.38340e+01 7.77641e-01 3.66145e+02 150.747 -1.43334e+01 8.02795e+00  0.00000e+00 0.00000e+00 1.37843e+02 150.747 2.28302e+02 330.747 0.9691 
1 1 1 5   16  11 o 11 1.40434e+01 8.53104e-01 1.91989e+02 129.620 -8.04670e+00 9.71976e+00  0.00000e+00 0.00000e+00 3.14362e+02 129.620 1.22373e+02 129.620 0.9595 
1 1 1 5   16  12 o 1  2.10588e+01 8.55018e-01 3.03392e+02 305.547 2.42677e+01  -3.39626e+01 0.00000e+00 0.00000e+00 4.78013e+02 305.547 1.74621e+02 305.547 0.9879 
1 1 1 5   16  13 o 10 5.59763e+00 1.44279e+00 7.62416e+01 330.393 2.62269e+00  -1.49034e+00 0.00000e+00 0.00000e+00 9.42085e+01 330.393 1.79669e+01 330.393 0.8112 
1 1 1 5   16  14 o 2  9.19264e+00 1.40064e+00 1.46022e+02 149.274 -9.72035e+00 5.77741e+00  0.00000e+00 0.00000e+00 1.83210e+02 149.274 3.71886e+01 149.274 0.9547 
1 1 1 5   16  15 o 2  1.59919e+01 1.29702e+00 3.59228e+02 333.915 5.39182e+01  -2.63969e+01 0.00000e+00 0.00000e+00 2.35267e+02 333.915 1.23961e+02 153.915 0.9916 
1 1 1 5   16  16 o 14 1.37605e+01 1.79807e+00 2.87940e+02 193.609 -3.34587e+01 -8.10038e+00 0.00000e+00 0.00000e+00 2.19991e+02 193.609 6.79495e+01 13.609  0.9854 
1 1 1 5   16  17 o 18 1.10246e+01 2.22846e+00 1.42361e+02 319.421 8.62663e+00  -7.38851e+00 0.00000e+00 0.00000e+00 2.51686e+02 319.421 1.09326e+02 319.421 0.9549 
1 1 1 5   17  0  o 3  1.17550e+01 3.52422e-01 3.78652e+02 271.534 8.83366e-02  -3.29848e+00 0.00000e+00 0.00000e+00 1.15340e+01 91.534  3.90186e+02 91.534  0.8299 
1 1 1 5   17  1  o 14 1.63256e+01 3.93014e-01 4.40392e+02 51.558  3.38236e+00  4.26102e+00  0.00000e+00 0.00000e+00 1.14268e+02 51.558  3.26124e+02 231.558 0.9027 
1 1 1 5   17  2  o 5  2.66335e+01 5.84680e-01 5.59036e+02 129.688 -8.05937e+00 9.71184e+00  0.00000e+00 0.00000e+00 4.02919e+02 129.688 1.56117e+02 309.688 0.9595 
1 1 1 5   17  3  o 7  1.91834e+01 4.45401e-01 6.58160e+02 238.741 -5.88518e+00 -9.69503e+00 0.00000e+00 0.00000e+00 3.13638e+01 238.741 6.26796e+02 58.741  0.9548 
1 1 1 5   17  4  o 6  1.91948e+01 4.59793e-01 3.00998e+02 289.992 1.77606e+00  -4.88170e+00 0.00000e+00 0.00000e+00 3.47648e+02 289.992 4.66501e+01 289.992 0.8977 
1 1 1 5   17  5  o 5  2.58187e+01 5.44641e-01 4.60497e+02 158.350 -1.22171e+01 4.84934e+00  0.00000e+00 0.00000e+00 4.73600e+02 158.350 1.31028e+01 158.350 0.9612 
1 1 1 5   17  6  o 12 2.46887e+01 5.50914e-01 2.26827e+02 162.740 -6.94839e+00 2.15886e+00  0.00000e+00 0.00000e+00 6.35901e+02 162.740 4.09074e+02 162.740 0.9285 
1 1 1 5   17  7  f 0  4.06285e+01 7.70293e-01 7.27844e+02 359.854 5.55738e+01  -1.41730e-01 0.00000e+00 0.00000e+00 7.87111e+02 359.854 5.92673e+01 359.854 0.9910 
1 1 1 5   17  8  o 11 3.46369e+01 7.13220e-01 5.17925e+02 282.918 8.30497e+00  -3.62075e+01 0.00000e+00 0.00000e+00 7.67400e+02 282.918 2.49475e+02 282.918 0.9864 
1 1 1 5   17  9  o 11 2.77009e+01 6.79810e-01 4.51650e+02 65.280  1.42636e+01  3.09821e+01  0.00000e+00 0.00000e+00 5.74697e+02 65.280  1.23048e+02 65.280  0.9852 
1 1 1 5   17  10 o 4  2.03619e+01 9.13740e-01 2.68107e+02 310.828 1.13968e+01  -1.31903e+01 0.00000e+00 0.00000e+00 4.75052e+02 310.828 2.06946e+02 310.828 0.9709 
1 1 1 5   17  11 o 18 1.79943e+01 7.97960e-01 2.27256e+02 25.798  1.69988e+01  8.21677e+00  0.00000e+00 0.00000e+00 4.30735e+02 25.798  2.03479e+02 25.798  0.9731 
1 1 1 5   17  12 o 12 1.15459e+01 1.05493e+00 9.19872e+01 182.649 -6.61215e+00 -3.05929e-01 0.00000e+00 0.00000e+00 3.07391e+02 182.649 2.15404e+02 182.649 0.9210 
1 1 1 5   17  13 o 6  5.82447e+00 1.36454e+00 1.80507e+02 191.873 -7.48205e+00 -1.57300e+00 0.00000e+00 0.00000e+00 2.32745e+01 191.873 1.57233e+02 11.873  0.9321 
1 1 1 5   17  14 o 1  4.48939e+00 1.28908e+00 1.27930e+02 357.181 5.06871e+00  -2.49597e-01 0.00000e+00 0.00000e+00 2.28102e+01 357.181 1.05119e+02 177.181 0.8951 
1 1 1 5   17  15 o 8  8.61896e+00 1.59664e+00 1.04383e+02 347.900 8.05305e+00  -1.72650e+00 0.00000e+00 0.00000e+00 1.98412e+02 347.900 9.40291e+01 347.900 0.9372 
1 1 1 5   17  16 o 16 5.55949e+00 1.68037e+00 3.82537e+01 326.421 1.69234e+00  -1.12351e+00 0.00000e+00 0.00000e+00 1.08116e+02 326.421 6.98624e+01 326.421 0.7029 
1 1 1 5   17  17 o 8  8.15106e+00 2.08542e+00 1.08151e+02 60.643  3.41184e+00  6.06559e+00  0.00000e+00 0.00000e+00 1.74072e+02 60.643  6.59213e+01 60.643  0.9251 
1 1 1 5   18  0  o 13 1.41440e+01 3.64683e-01 3.96612e+02 7.728   4.24292e+00  5.75790e-01  0.00000e+00 0.00000e+00 6.83169e+01 7.728   3.28296e+02 187.728 0.8735 
1 1 1 5   18  1  o 17 1.01554e+01 4.41385e-01 2.38161e+02 129.999 -1.15767e+00 1.37969e+00  0.00000e+00 0.00000e+00 1.49519e+01 129.999 2.23209e+02 309.999 0.6622 
1 1 1 5   18  2  o 16 1.72031e+01 5.18086e-01 8.73813e+01 233.828 -6.89494e-01 -9.43058e-01 0.00000e+00 0.00000e+00 2.38214e+02 233.828 1.50833e+02 233.828 0.5028 
1 1 1 5   18  3  o 4  3.06909e+01 5.88960e-01 6.97694e+02 23.413  1.74336e+01  7.54902e+00  0.00000e+00 0.00000e+00 4.26741e+02 23.413  2.70953e+02 203.413 0.9733 
1 1 1 5   18  4  o 8  3.40401e+01 8.25207e-01 3.94471e+02 294.893 5.97262e+00  -1.28712e+01 0.00000e+00 0.00000e+00 8.40836e+02 294.893 4.46365e+02 294.893 0.9641 
1 1 1 5   18  5  o 10 3.23523e+01 6.28654e-01 4.39638e+02 277.144 1.94184e+00  -1.54940e+01 0.00000e+00 0.00000e+00 7.38400e+02 277.144 2.98762e+02 277.144 0.9674 
1 1 1 5   18  6  o 2  2.44089e+01 5.48546e-01 5.22156e+02 352.013 1.61785e+01  -2.26992e+00 0.00000e+00 0.00000e+00 3.67864e+02 352.013 1.54293e+02 172.013 0.9689 
1 1 1 5   18  7  o 19 2.93620e+01 6.25300e-01 5.37640e+02 9.780   2.93541e+01  5.05960e+00  0.00000e+00 0.00000e+00 5.48437e+02 9.780   1.07966e+01 9.780   0.9831 
1 1 1 5   18  8  o 2  2.68383e+01 6.35973e-01 4.54462e+02 196.601 -2.53566e+01 -7.55951e+00 0.00000e+00 0.00000e+00 5.35837e+02 196.601 8.13751e+01 196.601 0.9809 
1 1 1 5   18  9  o 16 3.65020e+01 9.11351e-01 3.84531e+02 299.114 1.82469e+01  -3.27647e+01 0.00000e+00 0.00000e+00 9.69688e+02 299.114 5.85157e+02 299.114 0.9866 
1 1 1 5   18  10 o 13 1.80961e+01 8.28561e-01 1.93222e+02 9.066   1.20138e+01  1.91689e+00  0.00000e+00 0.00000e+00 4.58433e+02 9.066   2.65211e+02 9.066   0.9580 
1 1 1 5   18  11 o 6  2.44185e+01 7.83205e-01 3.79035e+02 209.339 -3.72541e+01 -2.09395e+01 0.00000e+00 0.00000e+00 5.27663e+02 209.339 1.48628e+02 209.339 0.9882 
1 1 1 5   18  12 o 17 6.48296e+00 1.34785e+00 1.21502e+02 72.884  1.37376e+00  4.46110e+00  0.00000e+00 0.00000e+00 9.39826e+01 72.884  2.75190e+01 252.884 0.8851 
1 1 1 5   18  13 o 13 9.92111e+00 1.19072e+00 2.09144e+02 344.943 1.55059e+01  -4.17125e+00 0.00000e+00 0.00000e+00 1.51446e+02 344.943 5.76981e+01 164.943 0.9683 
1 1 1 5   18  14 o 17 1.59562e+01 1.09629e+00 2.78805e+02 344.010 3.87139e+01  -1.10936e+01 0.00000e+00 0.00000e+00 3.12243e+02 344.010 3.34378e+01 344.010 0.9875 
1 1 1 5   18  15 o 17 7.16940e+00 1.58300e+00 9.16948e+01 9.831   5.97167e+00  1.03481e+00  0.00000e+00 0.00000e+00 1.53747e+02 9.831   6.20519e+01 9.831   0.9133 
1 1 1 5   18  16 o 8  6.24883e+00 1.76503e+00 1.37477e+02 185.677 -7.75690e+00 -7.71163e-01 0.00000e+00 0.00000e+00 8.10104e+01 185.677 5.64667e+01 5.677   0.9335 
1 1 1 5   18  17 o 17 4.77604e+00 1.58641e+00 7.30126e+01 271.583 1.05745e-01  -3.82686e+00 0.00000e+00 0.00000e+00 8.01024e+01 271.583 7.08978e+00 271.583 0.8566 
1 1 1 5   19  0  o 17 9.80566e+00 3.38042e-01 1.77222e+02 298.077 6.14050e-01  -1.15112e+00 0.00000e+00 0.00000e+00 2.34962e+01 298.077 1.53726e+02 118.077 0.5440 
1 1 1 5   19  1  o 6  1.38416e+01 4.64372e-01 3.93306e+02 125.933 -2.76158e+00 3.81029e+00  0.00000e+00 0.00000e+00 6.82678e+01 125.933 3.25038e+02 305.933 0.8861 
1 1 1 5   19  2  o 4  1.11694e+01 3.70301e-01 2.60455e+02 285.884 6.12000e-01  -2.15068e+00 0.00000e+00 0.00000e+00 4.76819e+01 285.884 2.12773e+02 105.884 0.7330 
1 1 1 5   19  3  o 10 1.18663e+01 3.95463e-01 2.62886e+02 102.866 -6.12136e-01 2.68008e+00  0.00000e+00 0.00000e+00 8.97767e+01 102.866 1.73109e+02 282.866 0.7896 
1 1 1 5   19  4  o 10 3.03921e+01 5.96069e-01 5.10927e+02 70.956  5.35047e+00  1.55006e+01  0.00000e+00 0.00000e+00 5.97570e+02 70.956  8.66440e+01 70.956  0.9690 
1 1 1 5   19  5  o 18 3.82451e+01 7.13930e-01 8.05066e+02 111.690 -1.48707e+01 3.73881e+01  0.00000e+00 0.00000e+00 6.16356e+02 111.690 1.88711e+02 291.689 0.9875 
1 1 1 5   19  6  o 13 2.50777e+01 7.21455e-01 4.12415e+02 208.779 -1.15147e+01 -6.32477e+00 0.00000e+00 0.00000e+00 4.94641e+02 208.779 8.22264e+01 208.779 0.9612 
1 1 1 5   19  7  o 2  1.41557e+01 5.38802e-01 1.78083e+02 148.531 -4.05839e+00 2.48398e+00  0.00000e+00 0.00000e+00 2.94575e+02 148.531 1.16492e+02 148.531 0.8875 
1 1 1 5   19  8  o 9  1.90504e+01 6.83259e-01 7.88346e+01 33.765  2.69546e+00  1.80210e+00  0.00000e+00 0.00000e+00 5.13359e+02 33.765  4.34525e+02 33.765  0.8264 
1 1 1 5   19  9  o 13 1.97935e+01 6.66642e-01 4.00632e+02 136.576 -1.60657e+01 1.52052e+01  0.00000e+00 0.00000e+00 3.26634e+02 136.576 7.39977e+01 316.576 0.9771 
1 1 1 5   19  10 o 12 1.52009e+01 7.55300e-01 2.50563e+02 341.244 1.26178e+01  -4.28459e+00 0.00000e+00 0.00000e+00 2.98941e+02 341.244 4.83781e+01 341.244 0.9617 
1 1 1 5   19  11 o 17 2.80015e+01 1.52942e+00 3.28068e+02 321.693 2.88985e+01  -2.28284e+01 0.00000e+00 0.00000e+00 7.09619e+02 321.693 3.81551e+02 321.693 0.9863 
1 1 1 5   19  12 o 16 5.03154e+00 1.29166e+00 9.26291e+01 43.703  2.02771e+00  1.93791e+00  0.00000e+00 0.00000e+00 5.74830e+01 43.703  3.51460e+01 223.703 0.7945 
1 1 1 5   19  13 o 2  1.22859e+01 1.07655e+00 2.26670e+02 251.461 -7.11216e+00 -2.12086e+01 0.00000e+00 0.00000e+00 2.24016e+02 251.461 2.65442e+00 71.461  0.9774 
1 1 1 5   19  14 o 9  6.98481e+00 1.43305e+00 1.58538e+02 107.396 -2.61570e+00 8.34880e+00  0.00000e+00 0.00000e+00 8.79916e+01 107.396 7.05460e+01 287.396 0.9410 
1 1 1 5   19  15 f 0  1.46444e+01 1.31475e+00 2.52230e+02 284.488 9.83574e+00  -3.80655e+01 0.00000e+00 0.00000e+00 2.89657e+02 284.488 3.74262e+01 284.488 0.9872 
1 1 1 5   19  16 o 5  7.20521e+00 1.66054e+00 1.23824e+02 213.496 -7.18476e+00 -4.75476e+00 0.00000e+00 0.00000e+00 1.29865e+02 213.496 6.04031e+00 213.496 0.9400 
1 1 1 5   19  17 o 7  9.82439e+00 2.08665e+00 1.67686e+02 42.859  9.62097e+00  8.92742e+00  0.00000e+00 0.00000e+00 1.85693e+02 42.859  1.80070e+01 42.859  0.9611 
1 1 1 5   20  0  o 4  1.40718e+01 4.06018e-01 1.81081e+02 64.723  9.46819e-01  2.00507e+00  0.00000e+00 0.00000e+00 2.05651e+02 64.723  2.45693e+01 64.723  0.7304 
1 1 1 5   20  1  o 15 2.43866e+01 5.42037e-01 5.64017e+02 285.218 3.06916e+00  -1.12821e+01 0.00000e+00 0.00000e+00 3.13533e+02 285.218 2.50483e+02 105.218 0.9562 
1 1 1 5   20  2  o 3  1.86641e+01 5.45757e-01 2.03460e+02 285.661 8.83414e-01  -3.15104e+00 0.00000e+00 0.00000e+00 3.78358e+02 285.661 1.74898e+02 285.661 0.8283 
1 1 1 5   20  3  o 18 2.01377e+01 4.84206e-01 2.66507e+02 330.430 4.47613e+00  -2.53973e+00 0.00000e+00 0.00000e+00 4.13120e+02 330.430 1.46613e+02 330.430 0.8967 
1 1 1 5   20  4  o 11 1.75683e+01 5.04130e-01 2.70962e+02 271.286 1.11980e-01  -4.98945e+00 0.00000e+00 0.00000e+00 3.19626e+02 271.286 4.86636e+01 271.286 0.8932 
1 1 1 5   20  5  o 3  3.35788e+01 6.49527e-01 5.52513e+02 68.432  8.88459e+00  2.24764e+01  0.00000e+00 0.00000e+00 6.84791e+02 68.432  1.32278e+02 68.432  0.9791 
1 1 1 5   20  6  o 13 2.14435e+01 5.20726e-01 4.40262e+02 267.409 -5.66342e-01 -1.25137e+01 0.00000e+00 0.00000e+00 3.33738e+02 267.409 1.06523e+02 87.409  0.9592 
1 1 1 5   20  7  o 12 2.81467e+01 7.02773e-01 3.45583e+02 312.912 1.15852e+01  -1.24618e+01 0.00000e+00 0.00000e+00 6.81755e+02 312.912 3.36173e+02 312.912 0.9702 
1 1 1 5   20  8  o 3  1.76318e+01 9.01654e-01 9.42207e+01 226.313 -2.50031e+00 -2.61757e+00 0.00000e+00 0.00000e+00 4.67574e+02 226.313 3.73353e+02 226.313 0.8471 
1 1 1 5   20  9  o 11 2.47941e+01 7.72609e-01 2.85541e+02 233.682 -1.15822e+01 -1.57567e+01 0.00000e+00 0.00000e+00 6.22577e+02 233.682 3.37036e+02 233.682 0.9741 
1 1 1 5   20  10 o 1  1.66313e+01 1.07153e+00 1.66300e+02 278.795 1.38910e+00  -8.97858e+00 0.00000e+00 0.00000e+00 4.23335e+02 278.795 2.57035e+02 278.795 0.9432 
1 1 1 5   20  11 o 1  2.06823e+01 8.30797e-01 1.95586e+02 155.069 -1.80114e+01 8.37256e+00  0.00000e+00 0.00000e+00 5.61626e+02 155.069 3.66041e+02 155.069 0.9745 
1 1 1 5   20  12 f 0  1.21914e+01 9.98240e-01 1.33828e+02 327.112 9.38155e+00  -6.06646e+00 0.00000e+00 0.00000e+00 3.02978e+02 327.112 1.69150e+02 327.112 0.9541 
1 1 1 5   20  13 o 12 1.63484e+01 9.57482e-01 2.36755e+02 201.005 -3.00897e+01 -1.15532e+01 0.00000e+00 0.00000e+00 3.67206e+02 201.005 1.30450e+02 201.005 0.9844 
1 1 1 5   20  14 o 13 7.35593e+00 1.50041e+00 6.77302e+01 265.807 -2.96953e-01 -4.05045e+00 0.00000e+00 0.00000e+00 1.71151e+02 265.807 1.03421e+02 265.807 0.8658 
1 1 1 5   20  15 o 8  5.59852e+00 1.65268e+00 9.89559e+01 305.334 2.74934e+00  -3.87819e+00 0.00000e+00 0.00000e+00 8.72423e+01 305.334 1.17136e+01 125.334 0.8873 
1 1 1 5   20  16 o 18 6.15116e+00 1.77141e+00 1.32126e+02 172.904 -6.99995e+00 8.71329e-01  0.00000e+00 0.00000e+00 8.12348e+01 172.904 5.08915e+01 352.904 0.9261 
1 1 1 5   20  17 o 12 5.44199e+00 1.79412e+00 7.22544e+01 340.642 3.55592e+00  -1.24930e+00 0.00000e+00 0.00000e+00 1.01669e+02 340.642 2.94147e+01 340.642 0.8540 
1 1 1 5   21  0  o 8  1.59843e+01 4.01514e-01 5.09205e+02 12.317  6.80589e+00  1.48601e+00  0.00000e+00 0.00000e+00 4.71658e+01 12.317  4.62039e+02 192.317 0.9252 
1 1 1 5   21  1  o 16 9.17783e+00 3.90187e-01 1.91844e+02 179.527 -1.37034e+00 1.13083e-02  0.00000e+00 0.00000e+00 2.39334e+00 179.527 1.89451e+02 359.527 0.5624 
1 1 1 5   21  2  o 14 1.59336e+01 5.85944e-01 3.16097e+02 161.434 -4.05965e+00 1.36353e+00  0.00000e+00 0.00000e+00 2.07736e+02 161.434 1.08361e+02 341.434 0.8736 
1 1 1 5   21  3  o 16 1.39451e+01 4.64591e-01 1.92655e+02 228.216 -1.70019e+00 -1.90263e+00 0.00000e+00 0.00000e+00 2.11728e+02 228.216 1.90726e+01 228.216 0.7705 
1 1 1 5   21  4  o 5  2.00172e+01 4.75860e-01 2.59694e+02 102.583 -1.17902e+00 5.28205e+00  0.00000e+00 0.00000e+00 4.19934e+02 102.583 1.60241e+02 102.583 0.9021 
1 1 1 5   21  5  o 17 3.80086e+01 7.10041e-01 5.19438e+02 81.892  3.29899e+00  2.31560e+01  0.00000e+00 0.00000e+00 8.80007e+02 81.892  3.60569e+02 81.892  0.9784 
1 1 1 5   21  6  o 6  1.82664e+01 6.49429e-01 2.81673e+02 152.401 -6.00304e+00 3.13814e+00  0.00000e+00 0.00000e+00 3.52664e+02 152.401 7.09905e+01 152.401 0.9229 
1 1 1 5   21  7  f 0  1.96637e+01 6.44564e-01 3.65017e+02 21.899  1.16403e+01  4.67904e+00  0.00000e+00 0.00000e+00 3.44610e+02 21.899  2.04065e+01 201.899 0.9593 
1 1 1 5   21  8  o 2  2.83762e+01 6.51093e-01 5.00629e+02 204.243 -2.86177e+01 -1.28873e+01 0.00000e+00 0.00000e+00 5.49473e+02 204.243 4.88440e+01 204.243 0.9839 
1 1 1 5   21  9  o 10 3.08890e+01 7.88651e-01 6.64032e+02 163.913 -5.86314e+01 1.69081e+01  0.00000e+00 0.00000e+00 4.87796e+02 163.913 1.76236e+02 343.913 0.9918 
1 1 1 5   21  10 o 17 1.41679e+01 8.13604e-01 1.92096e+02 2.472   9.19181e+00  3.96793e-01  0.00000e+00 0.00000e+00 3.10566e+02 2.472   1.18470e+02 2.472   0.9440 
1 1 1 5   21  11 o 16 1.55300e+01 8.77063e-01 2.39455e+02 29.144  1.57946e+01  8.80722e+00  0.00000e+00 0.00000e+00 3.27607e+02 29.144  8.81520e+01 29.144  0.9719 
1 1 1 5   21  12 o 1  1.55920e+01 8.99143e-01 4.02594e+02 47.481  2.97180e+01  3.24098e+01  0.00000e+00 0.00000e+00 1.76174e+02 47.481  2.26419e+02 227.481 0.9886 
1 1 1 5   21  13 f 0  1.02086e+01 1.20475e+00 1.30771e+02 273.521 6.30210e-01  -1.02405e+01 0.00000e+00 0.00000e+00 2.33158e+02 273.521 1.02387e+02 273.521 0.9499 
1 1 1 5   21  14 o 6  4.48856e+00 1.33094e+00 1.41601e+02 146.245 -4.64412e+00 3.10367e+00  0.00000e+00 0.00000e+00 1.08155e+01 146.245 1.30785e+02 326.245 0.9054 
1 1 1 5   21  15 o 16 1.24745e+01 1.64639e+00 2.01526e+02 221.870 -1.61061e+01 -1.44357e+01 0.00000e+00 0.00000e+00 2.55063e+02 221.870 5.35369e+01 221.870 0.9766 
1 1 1 5   21  16 o 19 6.68140e+00 1.85847e+00 1.51773e+02 65.525  3.46638e+00  7.61495e+00  0.00000e+00 0.00000e+00 8.29841e+01 65.525  6.87886e+01 245.525 0.9382 
1 1 1 5   21  17 o 9  7.42977e+00 2.19090e+00 1.20285e+02 182.291 -6.46070e+00 -2.58495e-01 0.00000e+00 0.00000e+00 1.35233e+02 182.291 1.49486e+01 182.291 0.9190 
1 1 1 5   22  0  o 19 1.72879e+01 4.97905e-01 1.90736e+02 320.286 1.97864e+00  -1.64348e+00 0.00000e+00 0.00000e+00 3.11773e+02 320.286 1.21037e+02 320.286 0.7726 
1 1 1 5   22  1  o 15 4.75620e+00 4.71749e-01 2.25379e+02 101.727 -1.66889e-01 8.03944e-01  0.00000e+00 0.00000e+00 1.57475e+02 281.727 3.82854e+02 281.727 0.3794 
1 1 1 5   22  2  o 11 1.80673e+01 7.27674e-01 2.86881e+02 300.395 2.33230e+00  -3.97615e+00 0.00000e+00 0.00000e+00 3.13792e+02 300.395 2.69112e+01 300.395 0.8835 
1 1 1 5   22  3  o 11 9.07479e+00 4.09492e-01 2.49229e+02 148.589 -1.75481e+00 1.07160e+00  0.00000e+00 0.00000e+00 7.85061e+00 328.589 2.57079e+02 328.589 0.7068 
1 1 1 5   22  4  o 1  1.83622e+01 5.18369e-01 2.43297e+02 20.523  5.04698e+00  1.88935e+00  0.00000e+00 0.00000e+00 3.79794e+02 20.523  1.36497e+02 20.523  0.9017 
1 1 1 5   22  5  o 13 4.32238e+01 7.87135e-01 8.05216e+02 263.285 -4.78203e+00 -4.06132e+01 0.00000e+00 0.00000e+00 8.01302e+02 263.285 3.91365e+00 83.285  0.9877 
1 1 1 5   22  6  o 19 1.92712e+01 5.04294e-01 4.85000e+02 308.133 7.87446e+00  -1.00307e+01 0.00000e+00 0.00000e+00 2.11048e+02 308.133 2.73952e+02 128.133 0.9600 
1 1 1 5   22  7  o 14 5.39036e+01 9.68155e-01 1.08049e+03 205.415 -8.82898e+01 -4.19515e+01 0.00000e+00 0.00000e+00 9.36858e+02 205.415 1.43631e+02 25.415  0.9949 
1 1 1 5   22  8  o 15 2.01059e+01 6.00587e-01 2.99066e+02 29.325  1.28254e+01  7.20449e+00  0.00000e+00 0.00000e+00 4.30913e+02 29.325  1.31847e+02 29.325  0.9654 
1 1 1 5   22  9  o 12 1.23639e+01 7.73613e-01 2.64725e+02 1.475   9.72180e+00  2.50401e-01  0.00000e+00 0.00000e+00 1.75522e+02 1.475   8.92033e+01 181.475 0.9471 
1 1 1 5   22  10 o 17 9.24628e+00 1.01863e+00 2.71028e+02 242.329 -4.33844e+00 -8.27370e+00 0.00000e+00 0.00000e+00 5.73062e+01 242.329 2.13722e+02 62.329  0.9449 
1 1 1 5   22  11 o 3  1.65576e+01 8.18492e-01 2.84726e+02 180.485 -2.48142e+01 -2.09880e-01 0.00000e+00 0.00000e+00 3.24606e+02 180.485 3.98803e+01 180.485 0.9796 
1 1 1 5   22  12 o 14 8.81116e+00 1.27731e+00 1.66144e+02 11.232  9.12427e+00  1.81192e+00  0.00000e+00 0.00000e+00 1.46364e+02 11.232  1.97801e+01 191.232 0.9446 
1 1 1 5   22  13 o 15 9.05071e+00 1.36439e+00 1.85135e+02 138.864 -9.14819e+00 7.99072e+00  0.00000e+00 0.00000e+00 1.40203e+02 138.864 4.49312e+01 318.864 0.9579 
1 1 1 5   22  14 f 0  4.93685e+00 1.44842e+00 8.09422e+01 336.387 3.16559e+00  -1.38387e+00 0.00000e+00 0.00000e+00 7.43393e+01 336.387 6.60287e+00 156.387 0.8387 
1 1 1 5   22  15 o 10 8.08790e+00 1.68808e+00 7.85211e+01 354.377 5.43859e+00  -5.35485e-01 0.00000e+00 0.00000e+00 1.95231e+02 354.377 1.16710e+02 354.377 0.9032 
1 1 1 5   22  16 o 10 6.56932e+00 1.80551e+00 1.04216e+02 276.795 7.36677e-01  -6.18228e+00 0.00000e+00 0.00000e+00 1.21066e+02 276.795 1.68496e+01 276.795 0.9157 
1 1 1 5   22  17 o 2  5.12799e+00 1.73685e+00 9.23590e+01 201.076 -4.21187e+00 -1.62318e+00 0.00000e+00 0.00000e+00 7.66381e+01 201.076 1.57210e+01 21.076  0.8807 
1 1 1 5   23  0  o 6  5.28546e+00 3.83955e-01 2.36236e+02 236.765 -5.26180e-01 -8.03002e-01 0.00000e+00 0.00000e+00 1.50330e+02 56.765  3.86566e+02 56.765  0.4321 
1 1 1 5   23  1  o 12 1.49477e+01 4.57361e-01 5.35577e+02 112.297 -2.61081e+00 6.36681e+00  0.00000e+00 0.00000e+00 1.58068e+01 292.297 5.51384e+02 292.297 0.9242 
1 1 1 5   23  2  o 11 1.49295e+01 6.81157e-01 2.30351e+02 353.888 3.00725e+00  -3.22012e-01 0.00000e+00 0.00000e+00 2.25696e+02 353.888 4.65540e+00 173.888 0.8118 
1 1 1 5   23  3  o 7  1.12250e+01 4.05202e-01 2.24922e+02 334.092 2.04465e+00  -9.93178e-01 0.00000e+00 0.00000e+00 8.67739e+01 334.092 1.38148e+02 154.092 0.7379 
1 1 1 5   23  4  o 18 2.73586e+01 5.58527e-01 4.89744e+02 162.431 -1.52787e+01 4.83745e+00  0.00000e+00 0.00000e+00 5.07128e+02 162.431 1.73846e+01 162.431 0.9683 
1 1 1 5   23  5  o 14 1.60921e+01 4.66193e-01 1.33288e+02 130.195 -1.70701e+00 2.02034e+00  0.00000e+00 0.00000e+00 3.38943e+02 130.195 2.05655e+02 130.195 0.7799 
1 1 1 5   23  6  o 12 3.51283e+01 6.81053e-01 4.42825e+02 70.674  6.95948e+00  1.98441e+01  0.00000e+00 0.00000e+00 8.46990e+02 70.674  4.04164e+02 70.674  0.9759 
1 1 1 5   23  7  o 9  3.03380e+01 6.46061e-01 6.35762e+02 95.833  -3.33217e+00 3.26171e+01  0.00000e+00 0.00000e+00 4.87882e+02 95.833  1.47880e+02 275.833 0.9846 
1 1 1 5   23  8  o 15 3.08967e+01 6.82810e-01 4.76607e+02 59.473  1.81603e+01  3.07963e+01  0.00000e+00 0.00000e+00 6.68926e+02 59.473  1.92319e+02 59.473  0.9859 
1 1 1 5   23  9  o 3  1.55410e+01 6.97455e-01 1.80128e+02 359.544 7.97662e+00  -6.34021e-02 0.00000e+00 0.00000e+00 3.66169e+02 359.544 1.86042e+02 359.544 0.9350 
1 1 1 5   23  10 o 14 1.85334e+01 7.25671e-01 4.06854e+02 108.411 -9.18792e+00 2.76022e+01  0.00000e+00 0.00000e+00 2.77550e+02 108.411 1.29304e+02 288.411 0.9827 
1 1 1 5   23  11 o 9  3.02287e+01 9.05664e-01 4.07300e+02 325.263 5.23662e+01  -3.63103e+01 0.00000e+00 0.00000e+00 7.19242e+02 325.263 3.11942e+02 325.263 0.9921 
1 1 1 5   23  12 o 19 5.32733e+00 1.33501e+00 1.40437e+02 169.883 -4.59158e+00 8.19298e-01  0.00000e+00 0.00000e+00 3.65655e+01 169.883 1.03872e+02 349.883 0.8850 
1 1 1 5   23  13 o 8  9.08848e+00 1.33025e+00 2.02695e+02 304.829 8.07404e+00  -1.16047e+01 0.00000e+00 0.00000e+00 1.26043e+02 304.829 7.66528e+01 124.829 0.9640 
1 1 1 5   23  14 o 10 5.03093e+00 1.33792e+00 8.62095e+01 72.238  1.20275e+00  3.75457e+00  0.00000e+00 0.00000e+00 7.62785e+01 72.238  9.93097e+00 252.237 0.8613 
1 1 1 5   23  15 f 0  9.17226e+00 1.71639e+00 1.24257e+02 347.478 9.42104e+00  -2.09242e+00 0.00000e+00 0.00000e+00 2.01139e+02 347.478 7.68815e+01 347.478 0.9467 
1 1 1 5   23  16 o 6  6.45375e+00 1.86379e+00 9.82799e+01 213.424 -4.64271e+00 -3.06413e+00 0.00000e+00 0.00000e+00 1.20426e+02 213.424 2.21464e+01 213.424 0.9050 
1 1 1 5   23  17 o 15 5.09627e+00 1.73208e+00 1.01370e+02 134.761 -3.66582e+00 3.69659e+00  0.00000e+00 0.00000e+00 6.98541e+01 134.761 3.15159e+01 314.760 0.8980 
1 1 1 5   24  0  o 13 1.81991e+01 4.08676e-01 5.01726e+02 359.712 7.86867e+00  -3.95057e-02 0.00000e+00 0.00000e+00 1.37753e+02 359.712 3.63973e+02 179.712 0.9341 
1 1 1 5   24  1  o 13 1.90563e+01 4.26209e-01 4.05439e+02 56.571  3.60840e+00  5.46641e+00  0.00000e+00 0.00000e+00 2.54255e+02 56.571  1.51184e+02 236.571 0.9201 
1 1 1 5   24  2  o 3  1.96157e+01 5.44799e-01 3.80857e+02 15.306  6.90815e+00  1.89065e+00  0.00000e+00 0.00000e+00 3.03567e+02 15.306  7.72894e+01 195.306 0.9273 
1 1 1 5   24  3  o 9  1.32094e+01 4.16091e-01 1.37967e+02 285.704 5.25604e-01  -1.86933e+00 0.00000e+00 0.00000e+00 2.03999e+02 285.704 6.60316e+01 285.704 0.6880 
1 1 1 5   24  4  o 1  3.82302e+01 8.67138e-01 8.22726e+02 348.036 3.37876e+01  -7.15945e+00 0.00000e+00 0.00000e+00 5.94836e+02 348.036 2.27891e+02 168.036 0.9854 
1 1 1 5   24  5  o 17 1.52226e+01 4.64033e-01 2.21860e+02 143.156 -3.31553e+00 2.48430e+00  0.00000e+00 0.00000e+00 2.75756e+02 143.156 5.38960e+01 143.156 0.8688 
1 1 1 5   24  6  o 9  3.45242e+01 6.78287e-01 5.03326e+02 58.993  1.41932e+01  2.36153e+01  0.00000e+00 0.00000e+00 7.71701e+02 58.993  2.68375e+02 58.993  0.9817 
1 1 1 5   24  7  o 15 1.13194e+01 5.84718e-01 1.17464e+02 326.668 1.90837e+00  -1.25510e+00 0.00000e+00 0.00000e+00 1.97311e+02 326.668 7.98467e+01 326.668 0.7393 
1 1 1 5   24  8  o 14 1.79407e+01 5.86027e-01 3.60222e+02 43.952  1.11946e+01  1.07925e+01  0.00000e+00 0.00000e+00 2.92345e+02 43.952  6.78767e+01 223.952 0.9673 
1 1 1 5   24  9  o 19 1.02697e+01 8.43732e-01 1.85850e+02 228.503 -3.55072e+00 -4.01383e+00 0.00000e+00 0.00000e+00 1.62020e+02 228.503 2.38301e+01 48.503  0.9011 
1 1 1 5   24  10 f 0  8.25493e+00 1.09711e+00 7.43265e+01 226.379 -1.70181e+00 -1.78574e+00 0.00000e+00 0.00000e+00 1.61838e+02 226.379 8.75119e+01 226.379 0.7613 
1 1 1 5   24  11 o 15 4.68396e+00 1.23761e+00 1.02261e+02 206.251 -2.26472e+00 -1.11687e+00 0.00000e+00 0.00000e+00 3.28043e+01 206.251 6.94564e+01 26.251  0.7677 
1 1 1 5   24  12 o 13 6.29124e+00 1.37691e+00 1.21858e+02 22.594  4.28567e+00  1.78342e+00  0.00000e+00 0.00000e+00 8.70153e+01 22.594  3.48425e+01 202.594 0.8844 
1 1 1 5   24  13 o 7  6.20873e+00 1.36846e+00 1.00597e+02 80.988  7.38846e-01  4.65845e+00  0.00000e+00 0.00000e+00 1.05890e+02 80.988  5.29308e+00 80.988  0.8864 
1 1 1 5   24  14 o 18 4.49610e+00 1.39370e+00 6.88639e+01 359.196 2.85715e+00  -4.01098e-02 0.00000e+00 0.00000e+00 6.58193e+01 359.196 3.04463e+00 179.196 0.7989 
1 1 1 5   24  15 o 7  5.77923e+00 1.56881e+00 6.09866e+01 253.276 -9.66304e-01 -3.21605e+00 0.00000e+00 0.00000e+00 1.19479e+02 253.276 5.84922e+01 253.276 0.8333 
1 1 1 5   24  16 o 14 9.54790e+00 2.15663e+00 1.48723e+02 158.653 -9.37994e+00 3.66592e+00  0.00000e+00 0.00000e+00 1.90545e+02 158.653 4.18226e+01 158.653 0.9490 
1 1 1 5   24  17 o 16 6.03654e+00 1.94491e+00 8.28035e+01 103.573 -1.02268e+00 4.23609e+00  0.00000e+00 0.00000e+00 1.15040e+02 103.573 3.22365e+01 103.573 0.8760 
1 1 1 5   25  0  o 2  1.99242e+01 4.32616e-01 3.64262e+02 147.895 -5.21738e+00 3.27342e+00  0.00000e+00 0.00000e+00 3.21289e+02 147.895 4.29722e+01 327.895 0.9148 
1 1 1 5   25  1  f 0  2.05779e+01 4.45200e-01 2.45129e+02 334.264 4.03563e+00  -1.94538e+00 0.00000e+00 0.00000e+00 4.35921e+02 334.264 1.90791e+02 334.264 0.8797 
1 1 1 5   25  2  o 4  1.02168e+01 5.18465e-01 1.35048e+02 312.785 8.88299e-01  -9.59793e-01 0.00000e+00 0.00000e+00 7.44143e+01 312.785 6.06336e+01 132.785 0.5449 
1 1 1 5   25  3  o 15 2.78132e+01 5.55926e-01 4.02299e+02 356.590 1.17588e+01  -7.00575e-01 0.00000e+00 0.00000e+00 5.98755e+02 356.590 1.96456e+02 356.590 0.9566 
1 1 1 5   25  4  o 14 4.43695e+01 9.88621e-01 8.56760e+02 213.268 -3.44992e+01 -2.26339e+01 0.00000e+00 0.00000e+00 7.92326e+02 213.268 6.44340e+01 33.268  0.9878 
1 1 1 5   25  5  o 10 2.66376e+01 5.63453e-01 6.37030e+02 42.830  1.62120e+01  1.50282e+01  0.00000e+00 0.00000e+00 3.42223e+02 42.830  2.94807e+02 222.830 0.9771 
1 1 1 5   25  6  o 9  5.23699e+01 9.37558e-01 1.12918e+03 145.582 -7.60090e+01 5.20803e+01  0.00000e+00 0.00000e+00 8.30154e+02 145.582 2.99028e+02 325.582 0.9946 
1 1 1 5   25  7  o 5  1.75544e+01 5.59559e-01 4.79735e+02 69.171  6.30174e+00  1.65640e+01  0.00000e+00 0.00000e+00 1.61592e+02 69.171  3.18143e+02 249.171 0.9714 
1 1 1 5   25  8  o 14 1.67316e+01 5.98435e-01 3.35086e+02 245.412 -5.59714e+00 -1.22318e+01 0.00000e+00 0.00000e+00 2.70184e+02 245.412 6.49027e+01 65.412  0.9621 
1 1 1 5   25  9  o 8  1.86422e+01 6.85293e-01 2.24530e+02 191.422 -1.31079e+01 -2.64814e+00 0.00000e+00 0.00000e+00 4.49481e+02 191.422 2.24951e+02 191.422 0.9619 
1 1 1 5   25  10 f 0  2.97930e+01 7.57452e-01 3.64163e+02 280.749 8.51937e+00  -4.48781e+01 0.00000e+00 0.00000e+00 7.42984e+02 280.749 3.78821e+02 280.749 0.9890 
1 1 1 5   25  11 o 8  1.19095e+01 9.54223e-01 3.25597e+02 138.469 -1.56978e+01 1.39035e+01  0.00000e+00 0.00000e+00 1.10905e+02 138.469 2.14692e+02 318.469 0.9759 
1 1 1 5   25  12 o 4  1.60792e+01 8.90731e-01 2.75269e+02 306.741 1.82880e+01  -2.44987e+01 0.00000e+00 0.00000e+00 3.18380e+02 306.741 4.31109e+01 306.741 0.9835 
1 1 1 5   25  13 o 19 1.10135e+01 1.25451e+00 1.67510e+02 337.331 1.35637e+01  -5.66526e+00 0.00000e+00 0.00000e+00 2.31388e+02 337.331 6.38779e+01 337.331 0.9654 
1 1 1 5   25  14 o 15 4.53008e+00 1.37930e+00 9.54079e+01 106.694 -1.15285e+00 3.84404e+00  0.00000e+00 0.00000e+00 5.13518e+01 106.694 4.40560e+01 286.694 0.8640 
1 1 1 5   25  15 o 19 8.84069e+00 1.85078e+00 2.03012e+02 189.630 -1.41918e+01 -2.40805e+00 0.00000e+00 0.00000e+00 1.16521e+02 189.630 8.64905e+01 9.630   0.9646 
1 1 1 5   25  16 o 7  5.17725e+00 1.71623e+00 8.23019e+01 286.595 1.11486e+00  -3.74104e+00 0.00000e+00 0.00000e+00 8.43478e+01 286.595 2.04588e+00 286.595 0.8597 
1 1 1 5   25  17 o 18 5.12852e+00 1.73358e+00 4.52934e+01 52.294  1.41759e+00  1.83377e+00  0.00000e+00 0.00000e+00 9.73843e+01 52.294  5.20909e+01 52.294  0.7436 
1 1 1 5   26  0  o 13 1.96804e+01 4.31063e-01 1.39066e+02 54.190  1.42323e+00  1.97266e+00  0.00000e+00 0.00000e+00 4.21601e+02 54.190  2.82535e+02 54.190  0.7574 
1 1 1 5   26  1  o 15 2.44113e+01 8.36267e-01 4.25441e+02 171.205 -9.80864e+00 1.51766e+00  0.00000e+00 0.00000e+00 4.45292e+02 171.205 1.98504e+01 171.205 0.9482 
1 1 1 5   26  2  o 17 1.06374e+01 3.81977e-01 2.27261e+02 55.378  1.24560e+00  1.80415e+00  0.00000e+00 0.00000e+00 6.36708e+01 55.378  1.63590e+02 235.378 0.7270 
1 1 1 5   26  3  o 7  8.76519e+00 4.24461e-01 1.28757e+02 204.416 -1.07227e+00 -4.86767e-01 0.00000e+00 0.00000e+00 3.80401e+01 204.416 9.07169e+01 24.416  0.5058 
1 1 1 5   26  4  o 17 1.67767e+01 6.96935e-01 2.43784e+02 184.471 -5.32432e+00 -4.16353e-01 0.00000e+00 0.00000e+00 3.24748e+02 184.471 8.09643e+01 184.471 0.9007 
1 1 1 5   26  5  o 9  2.16356e+01 5.13442e-01 3.65787e+02 166.770 -9.90026e+00 2.32751e+00  0.00000e+00 0.00000e+00 4.07040e+02 166.770 4.12538e+01 166.770 0.9495 
1 1 1 5   26  6  o 9  1.89121e+01 5.75575e-01 2.76942e+02 180.813 -8.09926e+00 -1.14978e-01 0.00000e+00 0.00000e+00 3.88967e+02 180.813 1.12025e+02 180.813 0.9361 
1 1 1 5   26  7  o 4  1.55095e+01 5.64305e-01 3.26018e+02 206.065 -9.52291e+00 -4.65797e+00 0.00000e+00 0.00000e+00 2.29032e+02 206.065 9.69854e+01 26.065  0.9516 
1 1 1 5   26  8  o 7  1.72254e+01 6.06881e-01 3.62772e+02 309.335 1.05819e+01  -1.29125e+01 0.00000e+00 0.00000e+00 2.65170e+02 309.335 9.76018e+01 129.335 0.9696 
1 1 1 5   26  9  f 0  2.29253e+01 6.75919e-01 3.57049e+02 257.638 -5.41559e+00 -2.47090e+01 0.00000e+00 0.00000e+00 4.87425e+02 257.638 1.30376e+02 257.638 0.9800 
1 1 1 5   26  10 o 16 2.28857e+01 7.43195e-01 3.30252e+02 44.612  2.26109e+01  2.23065e+01  0.00000e+00 0.00000e+00 5.15968e+02 44.612  1.85716e+02 44.612  0.9841 
1 1 1 5   26  11 o 13 7.20099e+00 1.27089e+00 1.95195e+02 84.624  6.63041e-01  7.04514e+00  0.00000e+00 0.00000e+00 5.53320e+01 84.624  1.39863e+02 264.623 0.9264 
1 1 1 5   26  12 o 8  7.41971e+00 1.36241e+00 1.50722e+02 188.863 -7.02022e+00 -1.09466e+00 0.00000e+00 0.00000e+00 1.07372e+02 188.863 4.33504e+01 8.863   0.9267 
1 1 1 5   26  13 f 0  2.65885e+01 9.18372e-01 6.04866e+02 329.671 1.24310e+02  -7.27243e+01 0.00000e+00 0.00000e+00 3.89152e+02 329.671 2.15714e+02 149.671 0.9965 
1 1 1 5   26  14 o 6  5.05592e+00 1.50733e+00 9.91435e+01 100.563 -8.26770e-01 4.43344e+00  0.00000e+00 0.00000e+00 6.77857e+01 100.563 3.13578e+01 280.563 0.8806 
1 1 1 5   26  15 f 0  1.01347e+01 1.74026e+00 1.14754e+02 295.764 4.30896e+00  -8.92775e+00 0.00000e+00 0.00000e+00 2.45265e+02 295.764 1.30511e+02 295.764 0.9481 
1 1 1 5   26  16 o 17 6.44809e+00 1.96510e+00 1.33579e+02 61.857  3.38421e+00  6.32671e+00  0.00000e+00 0.00000e+00 9.03128e+01 61.857  4.32658e+01 241.857 0.9274 
1 1 1 5   26  17 o 9  5.87903e+00 1.91174e+00 8.02102e+01 328.280 3.66945e+00  -2.26808e+00 0.00000e+00 0.00000e+00 1.12135e+02 328.280 3.19253e+01 328.280 0.8746 
1 1 1 5   27  0  o 10 9.01612e+00 3.60171e-01 2.85402e+02 52.471  1.51345e+00  1.97031e+00  0.00000e+00 0.00000e+00 2.65800e+01 232.471 3.11982e+02 232.471 0.7633 
1 1 1 5   27  1  o 12 1.80110e+01 4.20927e-01 4.04610e+02 180.168 -6.93824e+00 -2.03588e-02 0.00000e+00 0.00000e+00 2.21951e+02 180.168 1.82658e+02 0.168   0.9248 
1 1 1 5   27  2  o 15 1.49986e+01 6.74214e-01 3.49861e+02 319.952 4.27840e+00  -3.59607e+00 0.00000e+00 0.00000e+00 1.61031e+02 319.952 1.88829e+02 139.952 0.9055 
1 1 1 5   27  3  o 9  2.15223e+01 4.80840e-01 3.86904e+02 334.059 9.03611e+00  -4.39578e+00 0.00000e+00 0.00000e+00 3.81375e+02 334.059 5.52854e+00 154.059 0.9489 
1 1 1 5   27  4  o 7  2.50496e+01 6.47085e-01 6.01176e+02 355.165 1.78533e+01  -1.51018e+00 0.00000e+00 0.00000e+00 3.14515e+02 355.165 2.86662e+02 175.165 0.9717 
1 1 1 5   27  5  o 12 3.18853e+01 6.31987e-01 5.86168e+02 113.689 -9.56538e+00 2.18024e+01  0.00000e+00 0.00000e+00 5.87818e+02 113.689 1.65020e+00 113.689 0.9788 
1 1 1 5   27  6  o 15 1.94469e+01 5.23758e-01 4.59320e+02 305.730 9.90586e+00  -1.37703e+01 0.00000e+00 0.00000e+00 2.50230e+02 305.730 2.09090e+02 125.730 0.9701 
1 1 1 5   27  7  o 5  2.97003e+01 9.15382e-01 2.84326e+02 46.635  1.18913e+01  1.25900e+01  0.00000e+00 0.00000e+00 7.99824e+02 46.635  5.15498e+02 46.635  0.9707 
1 1 1 5   27  8  o 14 2.27949e+01 7.49987e-01 4.23577e+02 317.212 1.83236e+01  -1.69604e+01 0.00000e+00 0.00000e+00 4.16072e+02 317.212 7.50455e+00 137.212 0.9798 
1 1 1 5   27  9  o 4  4.08791e+01 8.37288e-01 6.80378e+02 184.743 -8.42334e+01 -6.98888e+00 0.00000e+00 0.00000e+00 8.46895e+02 184.743 1.66517e+02 184.743 0.9941 
1 1 1 5   27  10 o 6  1.56217e+01 9.25749e-01 2.42392e+02 69.502  5.60055e+00  1.49807e+01  0.00000e+00 0.00000e+00 3.25851e+02 69.502  8.34588e+01 69.502  0.9682 
1 1 1 5   27  11 o 13 1.11518e+01 9.89034e-01 2.17962e+02 223.914 -9.45011e+00 -9.09842e+00 0.00000e+00 0.00000e+00 1.84528e+02 223.914 3.34343e+01 43.914  0.9611 
1 1 1 5   27  12 o 1  1.93641e+01 8.55354e-01 3.68212e+02 315.251 4.00781e+01  -3.97281e+01 0.00000e+00 0.00000e+00 3.52136e+02 315.251 1.60766e+01 135.251 0.9911 
1 1 1 5   27  13 o 6  1.63580e+01 1.01532e+00 3.46476e+02 233.057 -2.95242e+01 -3.92604e+01 0.00000e+00 0.00000e+00 2.60884e+02 233.057 8.55926e+01 53.057  0.9898 
1 1 1 5   27  14 o 8  4.55940e+00 1.35937e+00 1.29421e+01 82.834  7.12115e-02  5.66399e-01  0.00000e+00 0.00000e+00 3.39612e+01 82.834  2.10191e+01 82.834  0.2744 
1 1 1 5   27  15 o 15 1.42944e+01 1.58846e+00 2.34270e+02 187.001 -3.04758e+01 -3.74262e+00 0.00000e+00 0.00000e+00 2.92461e+02 187.001 5.81916e+01 187.001 0.9836 
1 1 1 5   27  16 o 7  7.96409e+00 2.12266e+00 2.06075e+02 76.473  2.82334e+00  1.17354e+01  0.00000e+00 0.00000e+00 7.94388e+01 76.473  1.26636e+02 256.473 0.9576 
1 1 1 5   27  17 o 12 5.69759e+00 1.85210e+00 8.00734e+01 224.139 -3.11294e+00 -3.02078e+00 0.00000e+00 0.00000e+00 1.06486e+02 224.139 2.64124e+01 224.139 0.8754 
1 1 1 5   28  0  f 0  3.74156e+01 6.78925e-01 7.97079e+02 248.364 -1.04105e+01 -2.62461e+01 0.00000e+00 0.00000e+00 5.84819e+02 248.364 2.12261e+02 68.364  0.9821 
1 1 1 5   28  1  o 19 2.26857e+01 5.33908e-01 1.98527e+02 81.802  5.82072e-01  4.04021e+00  0.00000e+00 0.00000e+00 5.40908e+02 81.802  3.42381e+02 81.802  0.8666 
1 1 1 5   28  2  o 4  1.57587e+01 4.14553e-01 2.46821e+02 154.483 -3.71933e+00 1.77538e+00  0.00000e+00 0.00000e+00 2.67733e+02 154.483 2.09123e+01 154.483 0.8680 
1 1 1 5   28  3  o 1  6.25275e+00 4.76772e-01 8.77703e+01 84.768  5.98529e-02  6.53589e-01  0.00000e+00 0.00000e+00 1.44595e+01 264.768 1.02230e+02 264.768 0.3117 
1 1 1 5   28  4  o 18 2.17522e+01 6.17070e-01 4.56819e+02 75.593  2.92224e+00  1.13755e+01  0.00000e+00 0.00000e+00 3.25800e+02 75.593  1.31019e+02 255.593 0.9564 
1 1 1 5   28  5  o 6  9.04665e+00 5.20811e-01 2.16763e+02 272.152 9.75271e-02  -2.59575e+00 0.00000e+00 0.00000e+00 4.70315e+01 272.152 1.69731e+02 92.152  0.7752 
1 1 1 5   28  6  o 6  2.41605e+01 5.63008e-01 4.52751e+02 326.936 1.72976e+01  -1.12606e+01 0.00000e+00 0.00000e+00 4.33629e+02 326.936 1.91219e+01 146.936 0.9755 
1 1 1 5   28  7  o 7  2.73383e+01 6.18852e-01 4.65561e+02 128.036 -1.63154e+01 2.08555e+01  0.00000e+00 0.00000e+00 5.42825e+02 128.036 7.72640e+01 128.036 0.9809 
1 1 1 5   28  8  o 13 1.67856e+01 8.08036e-01 2.30672e+02 192.309 -9.72157e+00 -2.12126e+00 0.00000e+00 0.00000e+00 3.67746e+02 192.309 1.37073e+02 192.309 0.9483 
1 1 1 5   28  9  o 18 4.58782e+01 9.02103e-01 7.17992e+02 63.142  4.63066e+01  9.14414e+01  0.00000e+00 0.00000e+00 9.97721e+02 63.142  2.79729e+02 63.142  0.9951 
1 1 1 5   28  10 o 17 1.17371e+01 8.93957e-01 2.41689e+02 288.528 3.81570e+00  -1.13851e+01 0.00000e+00 0.00000e+00 1.80454e+02 288.528 6.12347e+01 108.528 0.9574 
1 1 1 5   28  11 o 4  1.46487e+01 8.45847e-01 2.60654e+02 100.896 -3.99371e+00 2.07464e+01  0.00000e+00 0.00000e+00 2.76226e+02 100.896 1.55714e+01 100.896 0.9760 
1 1 1 5   28  12 o 2  1.43658e+01 9.42144e-01 2.40434e+02 348.423 2.61094e+01  -5.34847e+00 0.00000e+00 0.00000e+00 2.88518e+02 348.423 4.80841e+01 348.423 0.9811 
1 1 1 5   28  13 o 2  1.01232e+01 1.34282e+00 1.45113e+02 209.656 -1.06613e+01 -6.07033e+00 0.00000e+00 0.00000e+00 2.18789e+02 209.656 7.36766e+01 209.656 0.9583 
1 1 1 5   28  14 o 13 9.26477e+00 1.60551e+00 2.00770e+02 282.252 3.37020e+00  -1.55190e+01 0.00000e+00 0.00000e+00 1.35418e+02 282.252 6.53517e+01 102.252 0.9680 
1 1 1 5   28  15 o 4  1.50163e+01 1.43095e+00 3.10177e+02 73.421  1.32587e+01  4.45359e+01  0.00000e+00 0.00000e+00 2.46266e+02 73.421  6.39107e+01 253.421 0.9892 
1 1 1 5   28  16 o 9  5.97492e+00 1.86226e+00 1.46106e+02 3.041   7.47450e+00  3.97044e-01  0.00000e+00 0.00000e+00 6.20280e+01 3.041   8.40781e+01 183.041 0.9306 
1 1 1 5   28  17 f 0  4.98516e+00 1.62867e+00 1.33208e+02 149.912 -6.00449e+00 3.47905e+00  0.00000e+00 0.00000e+00 3.92399e+01 149.912 9.39683e+01 329.912 0.9249 
1 1 1 5   29  0  o 2  2.46033e+01 4.96509e-01 4.90101e+02 18.165  1.03808e+01  3.40601e+00  0.00000e+00 0.00000e+00 3.91638e+02 18.165  9.84628e+01 198.165 0.9531 
1 1 1 5   29  1  o 5  2.49009e+01 5.06342e-01 4.37767e+02 63.705  5.16799e+00  1.04587e+01  0.00000e+00 0.00000e+00 4.57653e+02 63.705  1.98862e+01 63.705  0.9561 
1 1 1 5   29  2  o 10 1.89205e+01 7.18867e-01 2.78136e+02 18.325  5.19153e+00  1.71945e+00  0.00000e+00 0.00000e+00 3.64661e+02 18.325  8.65248e+01 18.325  0.9032 
1 1 1 5   29  3  o 9  1.71251e+01 4.39133e-01 4.12650e+02 337.626 7.23490e+00  -2.97809e+00 0.00000e+00 0.00000e+00 1.88817e+02 337.626 2.23833e+02 157.627 0.9337 
1 1 1 5   29  4  o 17 2.25634e+01 5.12587e-01 3.60338e+02 258.318 -2.02610e+00 -9.79959e+00 0.00000e+00 0.00000e+00 4.44786e+02 258.318 8.44475e+01 258.318 0.9486 
1 1 1 5   29  5  o 13 6.66537e+01 1.15728e+00 9.79997e+02 330.691 7.56745e+01  -4.24826e+01 0.00000e+00 0.00000e+00 1.51249e+03 330.691 5.32497e+02 330.691 0.9942 
1 1 1 5   29  6  o 5  2.02748e+01 5.28782e-01 3.72041e+02 188.864 -1.31175e+01 -2.04569e+00 0.00000e+00 0.00000e+00 3.61128e+02 188.864 1.09128e+01 8.864   0.9616 
1 1 1 5   29  7  o 18 5.25859e+01 9.53773e-01 1.00501e+03 312.622 7.59492e+01  -8.25311e+01 0.00000e+00 0.00000e+00 9.63366e+02 312.622 4.16408e+01 132.622 0.9955 
1 1 1 5   29  8  o 14 3.74954e+01 7.60295e-01 7.31849e+02 151.352 -6.52617e+01 3.56523e+01  0.00000e+00 0.00000e+00 6.68090e+02 151.352 6.37592e+01 331.352 0.9933 
1 1 1 5   29  9  o 10 2.26736e+01 6.88591e-01 3.52080e+02 23.748  2.39285e+01  1.05277e+01  0.00000e+00 0.00000e+00 4.83491e+02 23.748  1.31410e+02 23.748  0.9807 
1 1 1 5   29  10 o 1  2.14566e+01 7.30913e-01 4.05136e+02 237.686 -2.10081e+01 -3.32136e+01 0.00000e+00 0.00000e+00 3.90531e+02 237.686 1.46050e+01 57.686  0.9872 
1 1 1 5   29  11 o 3  6.95065e+00 1.28351e+00 2.01597e+02 329.200 6.41860e+00  -3.82623e+00 0.00000e+00 0.00000e+00 4.12318e+01 329.200 1.60365e+02 149.200 0.9305 
1 1 1 5   29  12 o 16 8.68569e+00 1.20874e+00 1.03419e+02 182.500 -6.08824e+00 -2.65870e-01 0.00000e+00 0.00000e+00 1.94442e+02 182.500 9.10228e+01 182.500 0.9138 
1 1 1 5   29  13 o 7  1.65541e+01 1.18096e+00 2.74471e+02 209.816 -3.46572e+01 -1.98613e+01 0.00000e+00 0.00000e+00 3.38605e+02 209.816 6.41339e+01 209.816 0.9874 
1 1 1 5   29  14 o 2  7.45752e+00 1.62871e+00 1.12830e+02 261.550 -1.00372e+00 -6.75606e+00 0.00000e+00 0.00000e+00 1.45346e+02 261.550 3.25164e+01 261.550 0.9236 
1 1 1 5   29  15 o 14 6.72685e+00 1.82550e+00 9.77477e+01 135.599 -4.06851e+00 3.98435e+00  0.00000e+00 0.00000e+00 1.30879e+02 135.599 3.31313e+01 135.599 0.9073 
1 1 1 5   29  16 o 12 7.67111e+00 2.11097e+00 1.56163e+02 33.309  7.68637e+00  5.05082e+00  0.00000e+00 0.00000e+00 1.14878e+02 33.309  4.12849e+01 213.309 0.9440 
1 1 1 5   29  17 o 12 5.48500e+00 1.69890e+00 3.63080e+01 125.784 -1.20383e+00 1.67014e+00  0.00000e+00 0.00000e+00 1.08766e+02 125.784 7.24578e+01 125.784 0.7072 
1 1 1 5   30  0  o 8  6.72918e+00 3.84145e-01 1.96968e+02 63.354  6.36682e-01  1.26891e+00  0.00000e+00 0.00000e+00 5.13222e+01 243.354 2.48291e+02 243.354 0.5756 
1 1 1 5   30  1  o 18 1.77923e+01 4.26224e-01 3.12199e+02 266.031 -4.07258e-01 -5.87021e+00 0.00000e+00 0.00000e+00 2.97031e+02 266.031 1.51686e+01 86.031  0.9105 
1 1 1 5   30  2  o 13 3.09632e+01 5.93521e-01 4.99133e+02 52.223  1.14091e+01  1.47206e+01  0.00000e+00 0.00000e+00 6.33696e+02 52.223  1.34563e+02 52.223  0.9728 
1 1 1 5   30  3  o 8  2.00430e+01 4.69420e-01 2.86849e+02 120.123 -3.80197e+00 6.55264e+00  0.00000e+00 0.00000e+00 4.15332e+02 120.123 1.28484e+02 120.123 0.9314 
1 1 1 5   30  4  o 17 2.33854e+01 7.63319e-01 4.49740e+02 242.067 -6.39537e+00 -1.20621e+01 0.00000e+00 0.00000e+00 3.96973e+02 242.067 5.27676e+01 62.067  0.9627 
1 1 1 5   30  5  o 1  2.36263e+01 5.39296e-01 3.70190e+02 340.379 1.11823e+01  -3.98636e+00 0.00000e+00 0.00000e+00 4.80080e+02 340.379 1.09890e+02 340.379 0.9569 
1 1 1 5   30  6  o 9  1.31106e+01 6.19815e-01 3.46493e+02 120.843 -3.98314e+00 6.67030e+00  0.00000e+00 0.00000e+00 1.13597e+02 120.843 2.32895e+02 300.843 0.9332 
1 1 1 5   30  7  o 3  2.17478e+01 5.80095e-01 3.21345e+02 104.451 -3.87372e+00 1.50316e+01  0.00000e+00 0.00000e+00 4.69504e+02 104.451 1.48159e+02 104.451 0.9672 
1 1 1 5   30  8  o 2  1.54072e+01 7.34087e-01 1.92055e+02 303.562 4.54376e+00  -6.84865e+00 0.00000e+00 0.00000e+00 3.50585e+02 303.562 1.58531e+02 303.562 0.9370 
1 1 1 5   30  9  o 5  3.28069e+01 7.52374e-01 5.47191e+02 357.957 5.82410e+01  -2.07748e+00 0.00000e+00 0.00000e+00 6.74905e+02 357.957 1.27713e+02 357.957 0.9914 
1 1 1 5   30  10 o 15 1.61311e+01 1.00449e+00 2.29606e+02 143.886 -1.36824e+01 9.98266e+00  0.00000e+00 0.00000e+00 3.58122e+02 143.886 1.28516e+02 143.886 0.9700 
1 1 1 5   30  11 o 5  2.26312e+01 8.02079e-01 3.24119e+02 52.689  2.68770e+01  3.52674e+01  0.00000e+00 0.00000e+00 5.15914e+02 52.689  1.91794e+02 52.689  0.9887 
1 1 1 5   30  12 o 15 1.54740e+01 9.05149e-01 3.95462e+02 280.525 8.95697e+00  -4.82087e+01 0.00000e+00 0.00000e+00 1.79254e+02 280.525 2.16208e+02 100.525 0.9897 
1 1 1 5   30  13 o 2  2.00577e+01 1.11837e+00 3.56835e+02 266.718 -3.68316e+00 -6.42391e+01 0.00000e+00 0.00000e+00 3.89546e+02 266.718 3.27108e+01 266.718 0.9922 
1 1 1 5   30  14 o 19 5.06503e+00 1.43193e+00 1.23042e+02 88.712  1.33949e-01  5.95601e+00  0.00000e+00 0.00000e+00 5.00360e+01 88.712  7.30055e+01 268.712 0.9117 
1 1 1 5   30  15 o 15 1.50954e+01 1.79580e+00 2.55693e+02 335.964 3.06370e+01  -1.36635e+01 0.00000e+00 0.00000e+00 3.01216e+02 335.964 4.55229e+01 335.964 0.9850 
1 1 1 5   30  16 o 6  5.88072e+00 1.86853e+00 1.34898e+02 62.769  3.22931e+00  6.27527e+00  0.00000e+00 0.00000e+00 6.89517e+01 62.769  6.59458e+01 242.769 0.9262 
1 1 1 5   30  17 o 13 5.01926e+00 1.62685e+00 1.28628e+02 307.397 4.24640e+00  -5.55471e+00 0.00000e+00 0.00000e+00 4.50831e+01 307.397 8.35445e+01 127.397 0.9254 
1 1 1 5   31  0  o 16 1.21541e+01 3.76187e-01 2.96673e+02 72.094  1.17345e+00  3.63174e+00  0.00000e+00 0.00000e+00 9.45152e+01 72.094  2.02158e+02 252.094 0.8561 
1 1 1 5   31  1  o 1  6.77743e+00 4.56286e-01 8.63887e+01 149.309 -5.25993e-01 3.12194e-01  0.00000e+00 0.00000e+00 1.18782e+01 329.309 9.82669e+01 329.309 0.2924 
1 1 1 5   31  2  o 6  2.72194e+00 6.00592e-01 2.72418e+02 148.202 -7.51641e-01 4.66008e-01  0.00000e+00 0.00000e+00 2.31070e+02 328.202 5.03488e+02 328.202 0.4039 
1 1 1 5   31  3  o 15 2.02001e+01 5.31514e-01 4.31154e+02 69.467  3.98554e+00  1.06412e+01  0.00000e+00 0.00000e+00 2.94311e+02 69.467  1.36844e+02 249.467 0.9549 
1 1 1 5   31  4  o 4  1.89398e+01 6.27549e-01 1.69063e+02 40.349  3.16336e+00  2.68742e+00  0.00000e+00 0.00000e+00 4.49981e+02 40.349  2.80918e+02 40.349  0.8691 
1 1 1 5   31  5  o 2  4.17038e+01 7.72932e-01 8.41929e+02 260.662 -8.98000e+00 -5.46100e+01 0.00000e+00 0.00000e+00 7.12143e+02 260.662 1.29786e+02 80.662  0.9909 
1 1 1 5   31  6  o 16 1.44390e+01 6.52194e-01 2.43186e+02 36.281  4.80957e+00  3.53051e+00  0.00000e+00 0.00000e+00 2.51862e+02 36.281  8.67534e+00 36.281  0.9118 
1 1 1 5   31  7  o 16 1.92723e+01 6.53602e-01 1.67729e+02 90.246  -3.06489e-02 7.12938e+00  0.00000e+00 0.00000e+00 5.03856e+02 90.246  3.36126e+02 90.246  0.9270 
1 1 1 5   31  8  o 5  1.05032e+01 7.43677e-01 3.24769e+02 87.975  3.33503e-01  9.43397e+00  0.00000e+00 0.00000e+00 4.84466e+01 87.975  2.76323e+02 267.975 0.9454 
1 1 1 5   31  9  o 1  1.48051e+01 7.24620e-01 2.35140e+02 210.169 -1.05716e+01 -6.14509e+00 0.00000e+00 0.00000e+00 2.97859e+02 210.169 6.27193e+01 210.169 0.9582 
1 1 1 5   31  10 o 1  2.02270e+01 7.29109e-01 4.44430e+02 33.343  3.57238e+01  2.35045e+01  0.00000e+00 0.00000e+00 3.06310e+02 33.343  1.38120e+02 213.343 0.9882 
1 1 1 5   31  11 o 12 2.79878e+01 7.90291e-01 6.57907e+02 157.189 -1.12543e+02 4.73330e+01  0.00000e+00 0.00000e+00 3.88471e+02 157.189 2.69437e+02 337.189 0.9959 
1 1 1 5   31  12 o 6  1.67664e+01 8.81432e-01 3.92009e+02 299.802 2.62802e+01  -4.58843e+01 0.00000e+00 0.00000e+00 2.31126e+02 299.802 1.60884e+02 119.802 0.9905 
1 1 1 5   31  13 o 3  1.11289e+01 1.45809e+00 2.17012e+02 134.566 -1.37354e+01 1.39449e+01  0.00000e+00 0.00000e+00 1.89528e+02 134.566 2.74834e+01 314.566 0.9741 
1 1 1 5   31  14 o 9  5.20459e+00 1.49110e+00 1.13648e+02 209.492 -4.76854e+00 -2.69706e+00 0.00000e+00 0.00000e+00 6.25684e+01 209.492 5.10791e+01 29.492  0.9034 
1 1 1 5   31  15 o 1  5.47717e+00 1.75705e+00 6.73739e+01 87.789  1.27048e-01  3.29043e+00  0.00000e+00 0.00000e+00 1.02784e+02 87.789  3.54099e+01 87.789  0.8295 
1 1 1 5   31  16 o 17 5.97721e+00 1.91251e+00 7.45210e+01 286.981 1.12526e+00  -3.68498e+00 0.00000e+00 0.00000e+00 1.17322e+02 286.981 4.28010e+01 286.981 0.8576 
1 1 1 5   31  17 o 8  5.49973e+00 1.72660e+00 4.87301e+01 132.628 -1.86063e+00 2.02147e+00  0.00000e+00 0.00000e+00 1.13621e+02 132.628 6.48910e+01 132.628 0.7894 
1 1 1 5   32  0  o 2  1.51507e+01 4.50989e-01 4.74539e+02 180.649 -7.49665e+00 -8.49886e-02 0.00000e+00 0.00000e+00 5.55534e+01 180.649 4.18986e+02 0.650   0.9307 
1 1 1 5   32  1  o 3  1.03748e+01 3.77237e-01 2.21344e+02 1.335   2.77578e+00  6.46740e-02  0.00000e+00 0.00000e+00 8.76082e+01 1.335   1.33736e+02 181.335 0.7920 
1 1 1 5   32  2  o 5  2.87901e+01 1.03679e+00 4.66659e+02 157.379 -1.34744e+01 5.61473e+00  0.00000e+00 0.00000e+00 5.78194e+02 157.379 1.11536e+02 157.379 0.9651 
1 1 1 5   32  3  o 6  2.09365e+01 4.79273e-01 5.62147e+02 338.951 1.30293e+01  -5.01424e+00 0.00000e+00 0.00000e+00 1.96443e+02 338.951 3.65703e+02 158.951 0.9635 
1 1 1 5   32  4  o 16 3.25920e+01 7.67118e-01 4.47097e+02 157.640 -1.71051e+01 7.03631e+00  0.00000e+00 0.00000e+00 7.44927e+02 157.640 2.97830e+02 157.640 0.9726 
1 1 1 5   32  5  o 13 5.09128e+01 9.11477e-01 9.80956e+02 67.497  2.91871e+01  7.04527e+01  0.00000e+00 0.00000e+00 9.20902e+02 67.497  6.00537e+01 247.497 0.9934 
1 1 1 5   32  6  o 14 2.42936e+01 5.71544e-01 6.00488e+02 94.879  -2.13049e+00 2.49586e+01  0.00000e+00 0.00000e+00 2.94469e+02 94.879  3.06019e+02 274.879 0.9798 
1 1 1 5   32  7  o 19 3.01168e+01 6.59639e-01 4.34346e+02 354.703 3.16616e+01  -2.93545e+00 0.00000e+00 0.00000e+00 6.79801e+02 354.703 2.45455e+02 354.703 0.9841 
1 1 1 5   32  8  o 3  3.69261e+01 9.12952e-01 5.21111e+02 247.441 -2.16684e+01 -5.21602e+01 0.00000e+00 0.00000e+00 8.54249e+02 247.441 3.33138e+02 247.441 0.9911 
1 1 1 5   32  9  o 1  1.00777e+01 8.80072e-01 4.13198e+01 230.371 -8.92696e-01 -1.07798e+00 0.00000e+00 0.00000e+00 1.74607e+02 230.371 1.33287e+02 230.371 0.5703 
1 1 1 5   32  10 o 17 7.97401e+00 1.14760e+00 1.04339e+02 16.207  3.47327e+00  1.00953e+00  0.00000e+00 0.00000e+00 1.49298e+02 16.207  4.49591e+01 16.207  0.8470 
1 1 1 5   32  11 o 5  6.29688e+00 1.26801e+00 7.39640e+01 253.990 -7.56978e-01 -2.63817e+00 0.00000e+00 0.00000e+00 1.12575e+02 253.990 3.86109e+01 253.990 0.7892 
1 1 1 5   32  12 f 0  1.16087e+01 1.10520e+00 1.50144e+02 95.238  -1.21310e+00 1.32335e+01  0.00000e+00 0.00000e+00 2.68681e+02 95.238  1.18536e+02 95.238  0.9616 
1 1 1 5   32  13 o 14 1.74474e+01 1.22178e+00 2.93621e+02 129.619 -2.84375e+01 3.43519e+01  0.00000e+00 0.00000e+00 3.53240e+02 129.619 5.96191e+01 129.619 0.9887 
1 1 1 5   32  14 o 16 9.32196e+00 1.61534e+00 1.13955e+02 228.002 -5.99740e+00 -6.66126e+00 0.00000e+00 0.00000e+00 2.15276e+02 228.002 1.01321e+02 228.002 0.9424 
1 1 1 5   32  15 o 13 8.14256e+00 1.91324e+00 7.13239e+01 323.692 3.80813e+00  -2.79820e+00 0.00000e+00 0.00000e+00 1.99028e+02 323.692 1.27705e+02 323.692 0.8866 
1 1 1 5   32  16 o 1  5.36259e+00 1.64184e+00 4.01798e+01 315.318 1.59104e+00  -1.57345e+00 0.00000e+00 0.00000e+00 1.06951e+02 315.318 6.67712e+01 315.318 0.7332 
1 1 1 5   32  17 o 7  4.24677e+00 1.43835e+00 5.02029e+01 52.914  1.61431e+00  2.13559e+00  0.00000e+00 0.00000e+00 7.41234e+01 52.914  2.39205e+01 52.914  0.7830 
1 1 1 5   33  0  o 13 3.49205e+01 7.17698e-01 6.56653e+02 50.559  1.74278e+01  2.11858e+01  0.00000e+00 0.00000e+00 6.31859e+02 50.559  2.47945e+01 230.559 0.9816 
1 1 1 5   33  1  o 4  1.96467e+01 4.47147e-01 5.08874e+02 8.904   1.17995e+01  1.84865e+00  0.00000e+00 0.00000e+00 1.98138e+02 8.904   3.10736e+02 188.904 0.9572 
1 1 1 5   33  2  o 16 2.50784e+01 5.87447e-01 3.90668e+02 315.622 9.18523e+00  -8.98781e+00 0.00000e+00 0.00000e+00 5.14830e+02 315.622 1.24163e+02 315.622 0.9603 
1 1 1 5   33  3  o 9  3.24479e+01 6.99061e-01 9.24356e+02 226.914 -2.50665e+01 -2.67999e+01 0.00000e+00 0.00000e+00 2.79020e+02 226.914 6.45336e+02 46.914  0.9863 
1 1 1 5   33  4  o 3  1.52101e+01 4.62344e-01 3.65365e+02 253.078 -2.14552e+00 -7.05208e+00 0.00000e+00 0.00000e+00 1.66218e+02 253.078 1.99147e+02 73.078  0.9295 
1 1 1 5   33  5  o 7  2.57325e+01 5.70196e-01 3.56846e+02 192.819 -1.37947e+01 -3.13881e+00 0.00000e+00 0.00000e+00 5.75829e+02 192.819 2.18983e+02 192.819 0.9640 
1 1 1 5   33  6  o 10 1.07955e+01 5.67851e-01 2.16392e+02 125.224 -2.82748e+00 4.00464e+00  0.00000e+00 0.00000e+00 1.45243e+02 125.224 7.11491e+01 305.224 0.8911 
1 1 1 5   33  7  o 11 3.03668e+01 6.60162e-01 5.76566e+02 356.425 4.18250e+01  -2.61306e+00 0.00000e+00 0.00000e+00 5.51121e+02 356.425 2.54453e+01 176.425 0.9880 
1 1 1 5   33  8  o 9  2.29921e+01 6.48984e-01 3.73242e+02 205.096 -2.22150e+01 -1.04045e+01 0.00000e+00 0.00000e+00 4.72938e+02 205.096 9.96965e+01 205.096 0.9794 
1 1 1 5   33  9  o 15 8.01886e+00 1.02868e+00 2.21512e+02 266.028 -4.58254e-01 -6.59974e+00 0.00000e+00 0.00000e+00 5.59124e+01 266.028 1.65600e+02 86.028  0.9210 
1 1 1 5   33  10 o 6  2.01184e+01 7.29545e-01 3.93855e+02 125.659 -2.30050e+01 3.20636e+01  0.00000e+00 0.00000e+00 3.51977e+02 125.659 4.18784e+01 305.659 0.9872 
1 1 1 5   33  11 o 5  5.97875e+00 1.22295e+00 7.40258e+01 206.192 -2.43872e+00 -1.19955e+00 0.00000e+00 0.00000e+00 1.02527e+02 206.192 2.85010e+01 206.192 0.7867 
1 1 1 5   33  12 o 2  5.62224e+00 1.36931e+00 1.15077e+02 46.534  3.23178e+00  3.40962e+00  0.00000e+00 0.00000e+00 7.17723e+01 46.534  4.33048e+01 226.534 0.8859 
1 1 1 5   33  13 o 18 6.36340e+00 1.53348e+00 9.36025e+01 197.154 -4.51982e+00 -1.39517e+00 0.00000e+00 0.00000e+00 1.17964e+02 197.154 2.43615e+01 197.154 0.8867 
1 1 1 5   33  14 o 10 1.33967e+01 1.68960e+00 2.29427e+02 39.465  2.01045e+01  1.65524e+01  0.00000e+00 0.00000e+00 2.62829e+02 39.465  3.34024e+01 39.465  0.9806 
1 1 1 5   33  15 o 15 7.96055e+00 2.03670e+00 1.17588e+02 149.030 -6.05563e+00 3.63428e+00  0.00000e+00 0.00000e+00 1.58507e+02 149.030 4.09191e+01 149.030 0.9262 
1 1 1 5   33  16 o 3  4.96976e+00 1.56634e+00 1.04140e+02 69.562  1.89943e+00  5.09694e+00  0.00000e+00 0.00000e+00 6.37165e+01 69.562  4.04233e+01 249.562 0.9027 
1 1 1 5   33  17 f 0  4.46942e+00 1.50570e+00 1.04045e+02 295.744 2.44713e+00  -5.07479e+00 0.00000e+00 0.00000e+00 4.73925e+01 295.744 5.66529e+01 115.744 0.9063 
1 1 1 5   34  0  o 10 2.35045e+01 4.89098e-01 4.73664e+02 290.330 4.29810e+00  -1.16007e+01 0.00000e+00 0.00000e+00 3.73296e+02 290.330 1.00368e+02 110.330 0.9587 
1 1 1 5   34  1  o 2  3.30276e+01 7.07735e-01 6.81689e+02 316.911 1.80338e+01  -1.68694e+01 0.00000e+00 0.00000e+00 5.34511e+02 316.911 1.47178e+02 136.911 0.9795 
1 1 1 5   34  2  f 0  3.91903e+01 8.07152e-01 5.78452e+02 89.851  6.95065e-02  2.68075e+01  0.00000e+00 0.00000e+00 8.67243e+02 89.851  2.88791e+02 89.851  0.9812 
1 1 1 5   34  3  o 10 2.24861e+01 5.00154e-01 3.01107e+02 209.752 -7.68117e+00 -4.39057e+00 0.00000e+00 0.00000e+00 4.95028e+02 209.752 1.93921e+02 209.752 0.9417 
1 1 1 5   34  4  o 10 5.58320e+01 9.82071e-01 9.41964e+02 130.979 -4.62092e+01 5.31963e+01  0.00000e+00 0.00000e+00 1.14229e+03 130.979 2.00323e+02 130.979 0.9929 
1 1 1 5   34  5  o 6  3.85969e+01 7.31779e-01 6.26213e+02 345.318 4.37576e+01  -1.14650e+01 0.00000e+00 0.00000e+00 8.08734e+02 345.318 1.82521e+02 345.318 0.9889 
1 1 1 5   34  6  o 5  4.52207e+01 8.39882e-01 7.88057e+02 32.226  6.21470e+01  3.91756e+01  0.00000e+00 0.00000e+00 9.00209e+02 32.226  1.12151e+02 32.226  0.9932 
1 1 1 5   34  7  o 11 1.90982e+01 6.90829e-01 4.36866e+02 261.761 -3.17844e+00 -2.19503e+01 0.00000e+00 0.00000e+00 2.64536e+02 261.761 1.72330e+02 81.761  0.9772 
1 1 1 5   34  8  o 17 1.12499e+01 1.13620e+00 1.86938e+02 240.084 -3.19735e+00 -5.55674e+00 0.00000e+00 0.00000e+00 2.01228e+02 240.084 1.42899e+01 240.084 0.9183 
1 1 1 5   34  9  o 19 1.25633e+01 8.06180e-01 4.05044e+02 107.734 -5.92374e+00 1.85241e+01  0.00000e+00 0.00000e+00 5.45600e+01 107.734 3.50484e+02 287.734 0.9739 
1 1 1 5   34  10 o 14 2.28567e+01 8.27574e-01 4.30884e+02 267.059 -2.65680e+00 -5.17133e+01 0.00000e+00 0.00000e+00 4.19000e+02 267.059 1.18835e+01 87.059  0.9903 
1 1 1 5   34  11 o 7  1.23957e+01 8.98428e-01 2.03048e+02 111.993 -6.61138e+00 1.63696e+01  0.00000e+00 0.00000e+00 2.48802e+02 111.993 4.57534e+01 111.993 0.9713 
1 1 1 5   34  12 o 5  1.27239e+01 1.25997e+00 2.12840e+02 49.803  1.31910e+01  1.56111e+01  0.00000e+00 0.00000e+00 2.52634e+02 49.803  3.97940e+01 49.803  0.9752 
1 1 1 5   34  13 o 3  1.84508e+01 1.09435e+00 3.17070e+02 325.426 4.61100e+01  -3.17786e+01 0.00000e+00 0.00000e+00 3.68467e+02 325.426 5.13970e+01 325.426 0.9910 
1 1 1 5   34  14 o 18 6.97006e+00 1.83409e+00 2.05669e+02 157.421 -1.04095e+01 4.32854e+00  0.00000e+00 0.00000e+00 4.36169e+01 157.421 1.62052e+02 337.421 0.9546 
1 1 1 5   34  15 o 1  7.25801e+00 2.06945e+00 2.21993e+02 249.340 -4.21998e+00 -1.11918e+01 0.00000e+00 0.00000e+00 3.81411e+01 249.340 1.83852e+02 69.341  0.9572 
1 1 1 5   34  16 o 11 4.30728e+00 1.42253e+00 1.32662e+02 45.855  4.84273e+00  4.98949e+00  0.00000e+00 0.00000e+00 1.64063e+01 45.855  1.16255e+02 225.855 0.9250 
1 1 1 5   34  17 o 18 6.11431e+00 1.88071e+00 1.24195e+02 173.674 -7.09533e+00 7.86535e-01  0.00000e+00 0.00000e+00 8.77078e+01 173.674 3.64870e+01 353.674 0.9271 
1 1 1 5   35  0  o 17 3.51389e+01 8.26075e-01 4.70255e+02 43.918  1.29761e+01  1.24948e+01  0.00000e+00 0.00000e+00 8.13174e+02 43.918  3.42918e+02 43.918  0.9718 
1 1 1 5   35  1  o 9  2.87643e+01 5.62677e-01 5.04457e+02 106.053 -5.25168e+00 1.82509e+01  0.00000e+00 0.00000e+00 5.47914e+02 106.053 4.34568e+01 106.053 0.9733 
1 1 1 5   35  2  o 10 2.16191e+01 5.45214e-01 4.46307e+02 151.794 -1.00416e+01 5.38553e+00  0.00000e+00 0.00000e+00 3.29907e+02 151.794 1.16400e+02 331.794 0.9551 
1 1 1 5   35  3  o 6  1.47034e+01 4.42362e-01 4.35548e+02 103.670 -1.94734e+00 8.00680e+00  0.00000e+00 0.00000e+00 8.25173e+01 103.670 3.53031e+02 283.670 0.9372 
1 1 1 5   35  4  o 13 3.99019e+01 7.42054e-01 8.37208e+02 147.417 -3.78878e+01 2.42144e+01  0.00000e+00 0.00000e+00 6.46124e+02 147.417 1.91084e+02 327.417 0.9888 
1 1 1 5   35  5  o 13 5.53438e+01 9.83255e-01 1.03200e+03 324.706 8.01107e+01  -5.67091e+01 0.00000e+00 0.00000e+00 1.03786e+03 324.706 5.86163e+00 324.706 0.9949 
1 1 1 5   35  6  o 16 1.49476e+01 5.46197e-01 3.79183e+02 204.535 -1.07542e+01 -4.90896e+00 0.00000e+00 0.00000e+00 1.58338e+02 204.535 2.20845e+02 24.535  0.9567 
1 1 1 5   35  7  o 5  3.08145e+01 6.72605e-01 4.61283e+02 83.834  3.96791e+00  3.67286e+01  0.00000e+00 0.00000e+00 6.80936e+02 83.834  2.19653e+02 83.834  0.9864 
1 1 1 5   35  8  o 12 4.09532e+01 8.17171e-01 6.65421e+02 232.913 -5.17523e+01 -6.84620e+01 0.00000e+00 0.00000e+00 8.64206e+02 232.913 1.98785e+02 232.913 0.9942 
1 1 1 5   35  9  o 12 1.73847e+01 8.80778e-01 3.25977e+02 333.710 2.10739e+01  -1.04108e+01 0.00000e+00 0.00000e+00 3.12917e+02 333.710 1.30601e+01 153.710 0.9785 
1 1 1 5   35  10 o 14 1.01887e+01 9.52402e-01 1.81046e+02 231.958 -6.39620e+00 -8.17447e+00 0.00000e+00 0.00000e+00 1.82558e+02 231.958 1.51202e+00 231.958 0.9505 
1 1 1 5   35  11 o 16 1.01768e+01 1.10332e+00 1.93540e+02 184.563 -1.31242e+01 -1.04739e+00 0.00000e+00 0.00000e+00 1.73565e+02 184.563 1.99757e+01 4.563   0.9612 
1 1 1 5   35  12 o 10 8.14366e+00 1.40105e+00 2.12873e+02 355.676 1.23778e+01  -9.35988e-01 0.00000e+00 0.00000e+00 8.00097e+01 355.676 1.32863e+02 175.676 0.9588 
1 1 1 5   35  13 o 16 6.42289e+00 1.59968e+00 8.39832e+01 81.667  5.74743e-01  3.92386e+00  0.00000e+00 0.00000e+00 1.23614e+02 81.667  3.96308e+01 81.667  0.8622 
1 1 1 5   35  14 o 19 7.10044e+00 1.72268e+00 7.83053e+01 297.029 2.15824e+00  -4.23050e+00 0.00000e+00 0.00000e+00 1.57707e+02 297.029 7.94015e+01 297.029 0.8872 
1 1 1 5   35  15 o 15 7.51862e+00 1.96793e+00 1.67126e+02 60.511  4.87076e+00  8.61286e+00  0.00000e+00 0.00000e+00 9.97327e+01 60.511  6.73935e+01 240.511 0.9480 
1 1 1 5   35  16 o 7  7.71801e+00 1.90752e+00 1.29324e+02 227.004 -6.19522e+00 -6.64459e+00 0.00000e+00 0.00000e+00 1.43024e+02 227.004 1.37006e+01 227.004 0.9432 
1 1 1 5   35  17 o 18 5.10068e+00 1.65233e+00 1.84412e+02 345.887 1.00884e+01  -2.53640e+00 0.00000e+00 0.00000e+00 3.15648e+00 165.887 1.87569e+02 165.887 0.9506 
1 1 1 5   36  0  f 0  2.87718e+01 7.11699e-01 3.70373e+02 133.658 -9.55906e+00 1.00176e+01  0.00000e+00 0.00000e+00 6.71047e+02 133.658 3.00674e+02 133.658 0.9632 
1 1 1 5   36  1  o 1  4.07428e+01 1.35252e+00 2.72221e+02 226.302 -8.80079e+00 -9.21000e+00 0.00000e+00 0.00000e+00 1.19774e+03 226.302 9.25515e+02 226.302 0.9599 
1 1 1 5   36  2  o 13 1.45084e+01 5.72364e-01 2.51179e+02 317.748 3.30173e+00  -2.99928e+00 0.00000e+00 0.00000e+00 2.28290e+02 317.748 2.28890e+01 137.748 0.8792 
1 1 1 5   36  3  o 17 1.93684e+01 5.52358e-01 4.59040e+02 318.213 8.44531e+00  -7.54751e+00 0.00000e+00 0.00000e+00 2.36127e+02 318.213 2.22912e+02 138.213 0.9548 
1 1 1 5   36  4  o 2  1.78119e+01 5.94074e-01 1.25253e+02 78.177  7.23463e-01  3.45596e+00  0.00000e+00 0.00000e+00 4.38997e+02 78.177  3.13744e+02 78.177  0.8427 
1 1 1 5   36  5  o 11 3.08761e+00 8.06029e-01 7.26284e+01 174.773 -3.77744e-01 3.45587e-02  0.00000e+00 0.00000e+00 5.10032e+01 354.773 1.23632e+02 354.773 0.1863 
1 1 1 5   36  6  o 7  3.00696e+01 6.40834e-01 4.85372e+02 270.294 1.62155e-01  -3.15513e+01 0.00000e+00 0.00000e+00 6.26690e+02 270.294 1.41318e+02 270.294 0.9840 
1 1 1 5   36  7  o 2  3.23240e+01 6.87595e-01 5.23064e+02 340.768 4.13487e+01  -1.44246e+01 0.00000e+00 0.00000e+00 6.77597e+02 340.768 1.54533e+02 340.768 0.9885 
1 1 1 5   36  8  o 11 1.61181e+01 6.61567e-01 3.20478e+02 130.507 -1.03447e+01 1.21089e+01  0.00000e+00 0.00000e+00 2.65694e+02 130.507 5.47837e+01 310.507 0.9681 
1 1 1 5   36  9  o 19 6.84498e+00 1.10496e+00 1.25604e+02 323.187 2.74714e+00  -2.05611e+00 0.00000e+00 0.00000e+00 8.96682e+01 323.187 3.59353e+01 143.187 0.8374 
1 1 1 5   36  10 o 17 1.85932e+01 7.58684e-01 3.01653e+02 113.785 -1.31468e+01 2.98293e+01  0.00000e+00 0.00000e+00 3.85549e+02 113.785 8.38963e+01 113.785 0.9845 
1 1 1 5   36  11 o 9  8.51616e+00 1.12447e+00 1.42567e+02 70.227  2.72345e+00  7.57590e+00  0.00000e+00 0.00000e+00 1.56431e+02 70.227  1.38641e+01 70.227  0.9357 
1 1 1 5   36  12 o 10 1.29235e+01 1.18491e+00 1.98980e+02 339.623 1.86299e+01  -6.91969e+00 0.00000e+00 0.00000e+00 2.73360e+02 339.623 7.43806e+01 339.623 0.9745 
1 1 1 5   36  13 o 1  4.09680e+00 1.27913e+00 9.09570e+01 319.709 2.55571e+00  -2.16668e+00 0.00000e+00 0.00000e+00 3.69464e+01 319.709 5.40106e+01 139.709 0.8329 
1 1 1 5   36  14 o 15 5.15544e+00 1.62636e+00 1.07812e+02 150.497 -4.35319e+00 2.46324e+00  0.00000e+00 0.00000e+00 6.47306e+01 150.497 4.30818e+01 330.497 0.8934 
1 1 1 5   36  15 o 17 6.45112e+00 1.70309e+00 1.85287e+02 280.059 1.96717e+00  -1.10889e+01 0.00000e+00 0.00000e+00 4.52256e+01 280.059 1.40061e+02 100.060 0.9545 
1 1 1 5   36  16 o 15 8.66430e+00 1.90550e+00 1.64500e+02 79.904  2.27562e+00  1.27801e+01  0.00000e+00 0.00000e+00 1.46860e+02 79.904  1.76399e+01 259.904 0.9607 
1 1 1 5   36  17 o 7  4.83233e+00 1.59163e+00 4.78495e+01 194.001 -2.65953e+00 -6.63163e-01 0.00000e+00 0.00000e+00 9.46303e+01 194.001 4.67808e+01 194.001 0.7888 
1 1 1 5   37  0  o 10 6.01645e+00 4.58834e-01 2.72028e+02 66.332  7.79713e-01  1.77897e+00  0.00000e+00 0.00000e+00 1.16474e+02 246.332 3.88502e+02 246.332 0.6881 
1 1 1 5   37  1  o 17 2.53914e+01 5.22461e-01 5.81103e+02 231.394 -1.13370e+01 -1.41985e+01 0.00000e+00 0.00000e+00 3.46515e+02 231.394 2.34589e+02 51.394  0.9721 
1 1 1 5   37  2  o 18 3.17546e+01 6.13927e-01 6.47126e+02 327.234 2.24311e+01  -1.44370e+01 0.00000e+00 0.00000e+00 5.23817e+02 327.234 1.23309e+02 147.234 0.9811 
1 1 1 5   37  3  o 11 3.97871e+01 9.29820e-01 8.55494e+02 92.914  -2.24977e+00 4.42020e+01  0.00000e+00 0.00000e+00 6.23028e+02 92.914  2.32466e+02 272.914 0.9886 
1 1 1 5   37  4  o 15 2.99111e+01 7.91891e-01 4.12195e+02 222.513 -1.39082e+01 -1.27504e+01 0.00000e+00 0.00000e+00 6.81878e+02 222.513 2.69683e+02 222.513 0.9731 
1 1 1 5   37  5  o 12 3.22269e+01 6.51160e-01 4.24536e+02 181.566 -2.34261e+01 -6.40314e-01 0.00000e+00 0.00000e+00 7.60572e+02 181.566 3.36036e+02 181.566 0.9784 
1 1 1 5   37  6  o 17 2.22999e+01 5.69523e-01 4.11304e+02 61.882  9.58458e+00  1.79365e+01  0.00000e+00 0.00000e+00 4.05848e+02 61.882  5.45605e+00 241.882 0.9751 
1 1 1 5   37  7  o 8  2.18220e+01 5.98574e-01 2.00429e+02 7.963   1.18518e+01  1.65776e+00  0.00000e+00 0.00000e+00 5.84435e+02 7.963   3.84007e+02 7.963   0.9573 
1 1 1 5   37  8  o 8  2.59903e+01 6.68620e-01 4.55844e+02 176.212 -3.75212e+01 2.48403e+00  0.00000e+00 0.00000e+00 5.07351e+02 176.212 5.15067e+01 176.212 0.9866 
1 1 1 5   37  9  o 9  2.45355e+01 7.08345e-01 4.96022e+02 228.956 -3.46933e+01 -3.98484e+01 0.00000e+00 0.00000e+00 4.16544e+02 228.956 7.94781e+01 48.956  0.9905 
1 1 1 5   37  10 o 7  2.49463e+01 7.46576e-01 3.62649e+02 37.682  4.00221e+01  3.09120e+01  0.00000e+00 0.00000e+00 5.64443e+02 37.682  2.01794e+02 37.682  0.9901 
1 1 1 5   37  11 o 9  5.48930e+00 1.41974e+00 1.04592e+02 214.246 -2.82976e+00 -1.92640e+00 0.00000e+00 0.00000e+00 6.77943e+01 214.246 3.67973e+01 34.246  0.8370 
1 1 1 5   37  12 o 13 2.62324e+01 1.00129e+00 3.08673e+02 346.376 6.78072e+01  -1.64349e+01 0.00000e+00 0.00000e+00 6.67999e+02 346.376 3.59326e+02 346.376 0.9928 
1 1 1 5   37  13 o 17 1.11841e+01 1.70610e+00 1.86062e+02 237.300 -8.58590e+00 -1.33742e+01 0.00000e+00 0.00000e+00 2.19709e+02 237.300 3.36471e+01 237.300 0.9680 
1 1 1 5   37  14 o 12 4.92456e+00 1.55174e+00 5.12438e+01 78.293  4.63216e-01  2.23536e+00  0.00000e+00 0.00000e+00 8.51012e+01 78.293  3.38574e+01 78.293  0.7392 
1 1 1 5   37  15 o 11 4.02002e+00 1.30785e+00 3.50961e+01 196.214 -1.61350e+00 -4.69201e-01 0.00000e+00 0.00000e+00 6.08546e+01 196.214 2.57585e+01 196.214 0.6377 
1 1 1 5   37  16 o 13 7.23495e+00 1.71409e+00 1.12372e+02 194.618 -7.84527e+00 -2.04617e+00 0.00000e+00 0.00000e+00 1.40955e+02 194.618 2.85837e+01 194.618 0.9361 
1 1 1 5   37  17 o 2  4.00987e+00 1.39004e+00 4.99913e+01 73.812  7.59982e-01  2.61796e+00  0.00000e+00 0.00000e+00 6.80243e+01 73.812  1.80330e+01 73.812  0.7875 
1 1 1 5   38  0  o 12 1.78261e+01 4.48411e-01 2.73279e+02 323.833 4.83780e+00  -3.53646e+00 0.00000e+00 0.00000e+00 3.37704e+02 323.833 6.44247e+01 323.833 0.9122 
1 1 1 5   38  1  o 15 3.13151e+01 6.02342e-01 6.19432e+02 88.396  7.07903e-01  2.52786e+01  0.00000e+00 0.00000e+00 5.33824e+02 88.396  8.56079e+01 268.396 0.9800 
1 1 1 5   38  2  o 10 2.73295e+01 7.21242e-01 3.39057e+02 34.193  9.74329e+00  6.61973e+00  0.00000e+00 0.00000e+00 6.43432e+02 34.193  3.04375e+02 34.193  0.9566 
1 1 1 5   38  3  o 6  3.11130e+01 7.57221e-01 6.14817e+02 163.679 -2.47392e+01 7.24429e+00  0.00000e+00 0.00000e+00 5.31626e+02 163.679 8.31905e+01 343.679 0.9804 
1 1 1 5   38  4  o 10 3.42494e+01 7.53631e-01 4.58028e+02 333.323 2.62398e+01  -1.31842e+01 0.00000e+00 0.00000e+00 8.07077e+02 333.323 3.49049e+02 333.323 0.9828 
1 1 1 5   38  5  o 15 3.14425e+01 6.46339e-01 5.73451e+02 24.305  3.43804e+01  1.55270e+01  0.00000e+00 0.00000e+00 5.92417e+02 24.305  1.89657e+01 24.305  0.9867 
1 1 1 5   38  6  o 2  2.47799e+01 6.94054e-01 4.25264e+02 122.200 -1.36278e+01 2.16406e+01  0.00000e+00 0.00000e+00 4.87472e+02 122.200 6.22075e+01 122.200 0.9802 
1 1 1 5   38  7  f 0  1.72545e+01 5.92578e-01 3.62561e+02 228.402 -1.16192e+01 -1.30878e+01 0.00000e+00 0.00000e+00 2.66863e+02 228.402 9.56984e+01 48.402  0.9710 
1 1 1 5   38  8  o 3  1.30858e+01 8.43246e-01 8.61687e+01 159.704 -3.40483e+00 1.25923e+00  0.00000e+00 0.00000e+00 3.30429e+02 159.704 2.44260e+02 159.704 0.8476 
1 1 1 5   38  9  o 1  2.52614e+01 7.08292e-01 4.51287e+02 233.954 -3.04347e+01 -4.18196e+01 0.00000e+00 0.00000e+00 4.87984e+02 233.954 3.66978e+01 233.954 0.9903 
1 1 1 5   38  10 o 11 1.10262e+01 9.56344e-01 2.34416e+02 253.550 -3.97027e+00 -1.34469e+01 0.00000e+00 0.00000e+00 1.64384e+02 253.550 7.00324e+01 73.550  0.9637 
1 1 1 5   38  11 o 6  1.18120e+01 1.12020e+00 1.82526e+02 164.018 -1.41728e+01 4.05921e+00  0.00000e+00 0.00000e+00 2.45312e+02 164.018 6.27859e+01 164.018 0.9655 
1 1 1 5   38  12 o 18 1.39072e+01 1.18425e+00 2.41743e+02 241.763 -1.30015e+01 -2.42100e+01 0.00000e+00 0.00000e+00 2.70162e+02 241.763 2.84185e+01 241.763 0.9816 
1 1 1 5   38  13 o 19 7.00024e+00 1.73673e+00 1.19810e+02 309.307 4.13532e+00  -5.05108e+00 0.00000e+00 0.00000e+00 1.21506e+02 309.307 1.69590e+00 309.307 0.9199 
1 1 1 5   38  14 o 9  5.50424e+00 1.68431e+00 8.08789e+01 95.919  -3.95743e-01 3.81695e+00  0.00000e+00 0.00000e+00 9.57846e+01 95.919  1.49056e+01 95.919  0.8570 
1 1 1 5   38  15 o 3  5.30203e+00 1.54216e+00 5.75196e+01 232.867 -1.82167e+00 -2.40582e+00 0.00000e+00 0.00000e+00 1.03472e+02 232.867 4.59526e+01 232.867 0.8113 
1 1 1 5   38  16 o 5  5.92967e+00 1.76171e+00 1.22604e+02 37.406  5.65458e+00  4.32425e+00  0.00000e+00 0.00000e+00 8.29362e+01 37.406  3.96676e+01 217.406 0.9268 
1 1 1 5   38  17 o 16 7.14134e+00 2.02829e+00 1.80081e+02 163.435 -1.08900e+01 3.23931e+00  0.00000e+00 0.00000e+00 7.47562e+01 163.435 1.05325e+02 343.434 0.9549 
1 1 1 5   39  0  o 14 1.79229e+01 4.50438e-01 2.92378e+02 229.772 -4.41792e+00 -5.22281e+00 0.00000e+00 0.00000e+00 3.29577e+02 229.772 3.71989e+01 229.772 0.9237 
1 1 1 5   39  1  o 17 2.14378e+01 4.77932e-01 1.27639e+02 90.917  -5.62536e-02 3.51632e+00  0.00000e+00 0.00000e+00 5.50578e+02 90.917  4.22939e+02 90.917  0.8420 
1 1 1 5   39  2  o 19 4.57945e+01 8.19311e-01 9.13950e+02 106.840 -1.58808e+01 5.24667e+01  0.00000e+00 0.00000e+00 7.91160e+02 106.840 1.22789e+02 286.840 0.9908 
1 1 1 5   39  3  o 12 8.48610e+00 5.85708e-01 8.13770e+01 277.146 1.36225e-01  -1.08657e+00 0.00000e+00 0.00000e+00 7.14017e+01 277.146 9.97532e+00 97.146  0.4791 
1 1 1 5   39  4  o 18 2.42458e+01 5.51038e-01 3.86081e+02 311.874 1.09796e+01  -1.22480e+01 0.00000e+00 0.00000e+00 4.96924e+02 311.874 1.10843e+02 311.874 0.9691 
1 1 1 5   39  5  o 3  3.71339e+01 7.24536e-01 7.51177e+02 182.875 -5.78363e+01 -2.90496e+00 0.00000e+00 0.00000e+00 6.32100e+02 182.875 1.19077e+02 2.875   0.9913 
1 1 1 5   39  6  o 16 3.36960e+01 6.91829e-01 6.38233e+02 48.205  3.42308e+01  3.82919e+01  0.00000e+00 0.00000e+00 6.15404e+02 48.205  2.28287e+01 228.205 0.9902 
1 1 1 5   39  7  o 8  1.85441e+01 5.96637e-01 4.65476e+02 195.318 -2.50888e+01 -6.87179e+00 0.00000e+00 0.00000e+00 2.17601e+02 195.318 2.47875e+02 15.318  0.9806 
1 1 1 5   39  8  o 16 1.40747e+01 8.80816e-01 2.69584e+02 314.340 9.16022e+00  -9.37362e+00 0.00000e+00 0.00000e+00 2.38405e+02 314.340 3.11794e+01 134.340 0.9611 
1 1 1 5   39  9  o 13 1.58822e+01 7.13627e-01 3.78417e+02 251.590 -9.06639e+00 -2.72384e+01 0.00000e+00 0.00000e+00 2.07371e+02 251.590 1.71046e+02 71.590  0.9824 
1 1 1 5   39  10 o 17 1.68500e+01 7.76890e-01 2.39835e+02 251.978 -7.44536e+00 -2.28844e+01 0.00000e+00 0.00000e+00 3.79245e+02 251.978 1.39410e+02 251.978 0.9790 
1 1 1 5   39  11 o 12 1.46882e+01 1.06878e+00 1.28508e+02 217.522 -1.11439e+01 -8.55770e+00 0.00000e+00 0.00000e+00 4.02495e+02 217.522 2.73987e+02 217.522 0.9637 
1 1 1 5   39  12 o 13 5.13909e+00 1.40680e+00 1.25936e+02 225.091 -3.43258e+00 -3.44347e+00 0.00000e+00 0.00000e+00 4.55672e+01 225.091 8.03688e+01 45.091  0.8901 
1 1 1 5   39  13 o 11 7.04556e+00 1.75644e+00 1.19404e+02 337.372 6.14664e+00  -2.56205e+00 0.00000e+00 0.00000e+00 1.23889e+02 337.372 4.48479e+00 337.372 0.9215 
1 1 1 5   39  14 o 7  8.63521e+00 1.89546e+00 2.09869e+02 85.367  1.16020e+00  1.43182e+01  0.00000e+00 0.00000e+00 1.02044e+02 85.367  1.07826e+02 265.367 0.9645 
1 1 1 5   39  15 o 6  8.65956e+00 1.70989e+00 1.43724e+02 304.331 6.76843e+00  -9.91058e+00 0.00000e+00 0.00000e+00 1.66536e+02 304.331 2.28122e+01 304.331 0.9574 
1 1 1 5   39  16 o 14 6.36984e+00 1.79844e+00 9.49021e+01 75.991  1.34332e+00  5.38429e+00  0.00000e+00 0.00000e+00 1.20608e+02 75.991  2.57063e+01 75.991  0.9047 
1 1 1 5   39  17 o 18 7.10736e+00 2.01909e+00 3.95546e+01 173.224 -2.53716e+00 3.01474e-01  0.00000e+00 0.00000e+00 1.65159e+02 173.224 1.25604e+02 173.224 0.7709 
1 1 1 5   40  0  o 12 4.06582e+01 6.82527e-01 8.71598e+02 61.829  2.13175e+01  3.98051e+01  0.00000e+00 0.00000e+00 6.38667e+02 61.829  2.32932e+02 241.829 0.9889 
1 1 1 5   40  1  o 3  1.34214e+01 3.98960e-01 1.95908e+02 271.784 1.04532e-01  -3.35581e+00 0.00000e+00 0.00000e+00 2.24275e+02 271.784 2.83669e+01 271.784 0.8333 
1 1 1 5   40  2  o 17 2.59211e+01 5.40037e-01 5.48818e+02 104.250 -4.76147e+00 1.87489e+01  0.00000e+00 0.00000e+00 3.99628e+02 104.250 1.49190e+02 284.250 0.9738 
1 1 1 5   40  3  f 0  6.04874e+00 7.19807e-01 1.86238e+02 28.256  1.52457e+00  8.19402e-01  0.00000e+00 0.00000e+00 3.89019e+01 208.256 2.25140e+02 208.256 0.6482 
1 1 1 5   40  4  o 7  3.35295e+01 7.40838e-01 5.96304e+02 79.375  6.25574e+00  3.33459e+01  0.00000e+00 0.00000e+00 6.44878e+02 79.375  4.85749e+01 79.375  0.9852 
1 1 1 5   40  5  o 16 2.81649e+01 7.87772e-01 3.41946e+02 235.012 -1.18819e+01 -1.69770e+01 0.00000e+00 0.00000e+00 6.90432e+02 235.012 3.48486e+02 235.012 0.9756 
1 1 1 5   40  6  o 12 9.48020e+00 6.34089e-01 1.83417e+02 265.585 -3.56882e-01 -4.62207e+00 0.00000e+00 0.00000e+00 1.31488e+02 265.585 5.19295e+01 85.585  0.8842 
1 1 1 5   40  7  o 17 2.34399e+01 6.16998e-01 3.39478e+02 200.592 -2.13140e+01 -8.00804e+00 0.00000e+00 0.00000e+00 5.21379e+02 200.592 1.81901e+02 200.592 0.9778 
1 1 1 5   40  8  o 5  1.69166e+01 6.74936e-01 3.00947e+02 98.659  -2.62634e+00 1.72459e+01  0.00000e+00 0.00000e+00 3.15802e+02 98.659  1.48547e+01 98.659  0.9709 
1 1 1 5   40  9  o 9  1.03992e+01 8.80779e-01 1.47937e+02 142.058 -5.53088e+00 4.31216e+00  0.00000e+00 0.00000e+00 2.13425e+02 142.058 6.54884e+01 142.058 0.9257 
1 1 1 5   40  10 o 19 4.91169e+00 1.18860e+00 1.10767e+02 88.105  9.99196e-02  3.02059e+00  0.00000e+00 0.00000e+00 3.88213e+01 88.105  7.19458e+01 268.105 0.8116 
1 1 1 5   40  11 o 10 2.03688e+01 9.79698e-01 2.63085e+02 143.006 -3.09944e+01 2.33509e+01  0.00000e+00 0.00000e+00 4.91001e+02 143.006 2.27916e+02 143.006 0.9870 
1 1 1 5   40  12 o 6  1.31541e+01 1.00450e+00 2.25749e+02 33.071  2.37255e+01  1.54496e+01  0.00000e+00 0.00000e+00 2.58599e+02 33.071  3.28503e+01 33.071  0.9822 
1 1 1 5   40  13 o 5  9.70704e+00 1.73356e+00 1.42249e+02 231.853 -6.82013e+00 -8.68330e+00 0.00000e+00 0.00000e+00 2.04574e+02 231.853 6.23253e+01 231.853 0.9536 
1 1 1 5   40  14 o 11 5.07730e+00 1.44530e+00 2.16268e+01 304.563 6.24793e-01  -9.06944e-01 0.00000e+00 0.00000e+00 6.98475e+01 304.563 4.82208e+01 304.563 0.4811 
1 1 1 5   40  15 o 4  3.84066e+00 1.28794e+00 6.34823e+01 190.567 -2.81889e+00 -5.25842e-01 0.00000e+00 0.00000e+00 5.14452e+01 190.567 1.20371e+01 10.567  0.7997 
1 1 1 5   40  16 o 19 9.84359e+00 1.65410e+00 8.60221e+01 289.594 3.01159e+00  -8.46051e+00 0.00000e+00 0.00000e+00 2.60902e+02 289.594 1.74880e+02 289.594 0.9426 
1 1 1 5   40  17 o 1  6.86033e+00 2.01801e+00 6.68911e+01 35.831  3.30758e+00  2.38820e+00  0.00000e+00 0.00000e+00 1.55206e+02 35.831  8.83150e+01 35.831  0.8665 
1 1 1 5   41  0  o 6  2.69104e+01 5.03646e-01 5.21264e+02 188.975 -1.83464e+01 -2.89748e+00 0.00000e+00 0.00000e+00 4.61882e+02 188.975 5.93819e+01 8.975   0.9727 
1 1 1 5   41  1  o 16 3.03287e+01 5.51497e-01 6.16951e+02 338.652 2.29317e+01  -8.96287e+00 0.00000e+00 0.00000e+00 4.98995e+02 338.652 1.17956e+02 158.652 0.9795 
1 1 1 5   41  2  o 16 3.10710e+01 6.07485e-01 6.20476e+02 134.024 -2.12696e+01 2.20070e+01  0.00000e+00 0.00000e+00 5.27631e+02 134.024 9.28448e+01 314.024 0.9835 
1 1 1 5   41  3  o 9  2.78524e+01 6.13106e-01 5.57444e+02 221.196 -2.20257e+01 -1.92791e+01 0.00000e+00 0.00000e+00 4.70991e+02 221.196 8.64525e+01 41.196  0.9828 
1 1 1 5   41  4  o 7  9.33713e+00 5.16672e-01 2.55664e+02 217.056 -3.27805e+00 -2.47522e+00 0.00000e+00 0.00000e+00 4.86758e+01 217.056 2.06988e+02 37.056  0.8675 
1 1 1 5   41  5  o 16 2.29637e+01 6.79114e-01 5.90711e+02 270.151 7.72820e-02  -2.92297e+01 0.00000e+00 0.00000e+00 2.57116e+02 270.151 3.33596e+02 90.151  0.9827 
1 1 1 5   41  6  o 2  2.67558e+00 8.11489e-01 1.98940e+02 107.240 -4.05456e-01 1.30661e+00  0.00000e+00 0.00000e+00 1.42478e+02 287.240 3.41418e+02 287.240 0.5618 
1 1 1 5   41  7  o 11 1.62932e+01 6.10415e-01 3.58729e+02 173.205 -1.86386e+01 2.22083e+00  0.00000e+00 0.00000e+00 2.36652e+02 173.205 1.22078e+02 353.205 0.9730 
1 1 1 5   41  8  o 3  3.70392e+01 8.99064e-01 6.02478e+02 336.220 7.72676e+01  -3.40469e+01 0.00000e+00 0.00000e+00 7.79960e+02 336.220 1.77483e+02 336.220 0.9941 
1 1 1 5   41  9  o 4  1.31013e+01 7.53046e-01 1.96871e+02 357.208 1.28082e+01  -6.24568e-01 0.00000e+00 0.00000e+00 2.75302e+02 357.208 7.84307e+01 357.208 0.9602 
1 1 1 5   41  10 o 5  5.61816e+00 1.36074e+00 6.58239e+01 164.010 -2.04181e+00 5.85087e-01  0.00000e+00 0.00000e+00 8.53420e+01 164.010 1.95181e+01 164.010 0.7171 
1 1 1 5   41  11 f 0  5.61207e+00 1.36087e+00 4.33081e+01 39.120  1.30626e+00  1.06231e+00  0.00000e+00 0.00000e+00 9.10533e+01 39.120  4.77452e+01 39.120  0.6384 
1 1 1 5   41  12 o 13 6.54140e+00 1.62811e+00 1.05739e+02 24.970  4.56352e+00  2.12505e+00  0.00000e+00 0.00000e+00 1.13515e+02 24.970  7.77612e+00 24.970  0.8942 
1 1 1 5   41  13 o 14 1.26829e+01 1.60720e+00 2.46281e+02 218.227 -2.01418e+01 -1.58652e+01 0.00000e+00 0.00000e+00 2.19510e+02 218.227 2.67710e+01 38.227  0.9803 
1 1 1 5   41  14 o 7  1.20386e+01 1.41946e+00 2.40306e+02 275.611 2.84058e+00  -2.89154e+01 0.00000e+00 0.00000e+00 2.02602e+02 275.611 3.77037e+01 95.611  0.9826 
1 1 1 5   41  15 f 0  4.38930e+00 1.35677e+00 8.86358e+01 137.162 -3.46950e+00 3.21708e+00  0.00000e+00 0.00000e+00 5.69934e+01 137.162 3.16424e+01 317.162 0.8868 
1 1 1 5   41  16 o 11 7.78504e+00 1.86391e+00 1.64888e+02 332.324 1.04332e+01  -5.47198e+00 0.00000e+00 0.00000e+00 1.13532e+02 332.324 5.13563e+01 152.324 0.9566 
1 1 1 5   41  17 o 17 8.43089e+00 2.06386e+00 2.01056e+02 143.208 -1.16619e+01 8.72169e+00  0.00000e+00 0.00000e+00 1.02883e+02 143.208 9.81728e+01 323.208 0.9650 
1 1 1 5   42  0  o 1  2.82520e+01 6.13856e-01 3.59998e+02 97.695  -1.84800e+00 1.36769e+01  0.00000e+00 0.00000e+00 6.61820e+02 97.695  3.01822e+02 97.695  0.9631 
1 1 1 5   42  1  o 16 2.47371e+01 4.88911e-01 4.79350e+02 55.826  9.03069e+00  1.33012e+01  0.00000e+00 0.00000e+00 4.20441e+02 55.826  5.89094e+01 235.826 0.9684 
1 1 1 5   42  2  o 15 2.69419e+01 5.54362e-01 4.98589e+02 299.351 1.01903e+01  -1.81212e+01 0.00000e+00 0.00000e+00 4.88854e+02 299.351 9.73519e+00 119.351 0.9756 
1 1 1 5   42  3  o 13 1.79273e+01 5.58007e-01 2.96113e+02 14.904  9.00993e+00  2.39811e+00  0.00000e+00 0.00000e+00 3.40161e+02 14.904  4.40482e+01 14.904  0.9447 
1 1 1 5   42  4  o 3  2.49536e+01 5.61494e-01 4.11111e+02 194.296 -2.08577e+01 -5.31490e+00 0.00000e+00 0.00000e+00 5.04284e+02 194.296 9.31736e+01 194.296 0.9765 
1 1 1 5   42  5  o 19 1.95516e+01 6.63103e-01 5.11039e+02 189.942 -2.16814e+01 -3.80030e+00 0.00000e+00 0.00000e+00 2.06522e+02 189.942 3.04518e+02 9.942   0.9770 
1 1 1 5   42  6  o 3  4.59124e+01 8.59690e-01 8.20465e+02 120.296 -5.10606e+01 8.73932e+01  0.00000e+00 0.00000e+00 8.95434e+02 120.296 7.49696e+01 120.296 0.9950 
1 1 1 5   42  7  o 16 1.68327e+01 6.14614e-01 3.53916e+02 28.032  1.62875e+01  8.67193e+00  0.00000e+00 0.00000e+00 2.60812e+02 28.032  9.31035e+01 208.032 0.9725 
1 1 1 5   42  8  o 1  1.36213e+01 7.19332e-01 2.84885e+02 197.113 -1.57109e+01 -4.83732e+00 0.00000e+00 0.00000e+00 2.10684e+02 197.113 7.42009e+01 17.113  0.9691 
1 1 1 5   42  9  o 9  5.59208e+00 1.21583e+00 1.38091e+02 235.271 -2.00671e+00 -2.89489e+00 0.00000e+00 0.00000e+00 3.86781e+01 235.271 9.94125e+01 55.271  0.8423 
1 1 1 5   42  10 o 7  8.09734e+00 1.28288e+00 1.20112e+02 356.643 5.86142e+00  -3.43857e-01 0.00000e+00 0.00000e+00 1.56425e+02 356.643 3.63131e+01 356.643 0.9103 
1 1 1 5   42  11 o 1  1.22481e+01 1.08555e+00 2.33025e+02 81.666  3.17365e+00  2.16655e+01  0.00000e+00 0.00000e+00 2.15662e+02 81.666  1.73626e+01 261.666 0.9769 
1 1 1 5   42  12 o 16 1.74474e+01 1.19873e+00 3.02227e+02 22.204  4.41949e+01  1.80394e+01  0.00000e+00 0.00000e+00 3.44832e+02 22.204  4.26048e+01 22.204  0.9895 
1 1 1 5   42  13 o 11 5.92107e+00 1.62202e+00 1.26461e+02 159.668 -6.08067e+00 2.25311e+00  0.00000e+00 0.00000e+00 7.74390e+01 159.668 4.90221e+01 339.668 0.9193 
1 1 1 5   42  14 o 16 9.97369e+00 1.44902e+00 2.10221e+02 99.095  -3.58813e+00 2.24133e+01  0.00000e+00 0.00000e+00 1.54840e+02 99.095  5.53807e+01 279.095 0.9777 
1 1 1 5   42  15 o 3  6.99794e+00 1.73389e+00 1.66644e+02 27.486  9.58367e+00  4.98606e+00  0.00000e+00 0.00000e+00 8.27273e+01 27.486  8.39167e+01 207.486 0.9525 
1 1 1 5   42  16 o 9  5.45326e+00 1.66217e+00 1.27513e+02 286.298 2.10636e+00  -7.20396e+00 0.00000e+00 0.00000e+00 6.22353e+01 286.298 6.52772e+01 106.298 0.9308 
1 1 1 5   42  17 o 17 4.65639e+00 1.57507e+00 4.95354e+01 230.082 -1.86032e+00 -2.22348e+00 0.00000e+00 0.00000e+00 8.99974e+01 230.082 4.04620e+01 230.082 0.8022 
1 1 1 5   43  0  o 1  7.06264e+00 4.49747e-01 2.18010e+02 60.576  1.20659e+00  2.13928e+00  0.00000e+00 0.00000e+00 1.64163e+01 240.576 2.34427e+02 240.576 0.7601 
1 1 1 5   43  1  o 4  1.96192e+01 4.90602e-01 3.28911e+02 41.665  7.63949e+00  6.79823e+00  0.00000e+00 0.00000e+00 3.70924e+02 41.665  4.20128e+01 41.665  0.9498 
1 1 1 5   43  2  o 8  8.38749e+00 4.73870e-01 2.74621e+02 65.883  1.78545e+00  3.98824e+00  0.00000e+00 0.00000e+00 1.47629e+00 65.883  2.73144e+02 245.883 0.8764 
1 1 1 5   43  3  o 10 2.41641e+01 5.37188e-01 4.17470e+02 267.916 -6.27280e-01 -1.72373e+01 0.00000e+00 0.00000e+00 4.63494e+02 267.916 4.60240e+01 267.916 0.9706 
1 1 1 5   43  4  o 18 2.28975e+01 5.48062e-01 3.92824e+02 158.984 -1.75569e+01 6.74495e+00  0.00000e+00 0.00000e+00 4.44083e+02 158.984 5.12590e+01 158.984 0.9730 
1 1 1 5   43  5  o 12 8.39572e+00 8.99917e-01 1.90790e+02 354.196 3.80139e+00  -3.86380e-01 0.00000e+00 0.00000e+00 7.92281e+01 354.196 1.11562e+02 174.196 0.8563 
1 1 1 5   43  6  o 11 2.02620e+01 6.06162e-01 3.77139e+02 62.432  9.89575e+00  1.89547e+01  0.00000e+00 0.00000e+00 3.65788e+02 62.432  1.13508e+01 242.432 0.9763 
1 1 1 5   43  7  o 3  1.51868e+01 7.44360e-01 4.15572e+02 290.285 6.90540e+00  -1.86826e+01 0.00000e+00 0.00000e+00 1.40151e+02 290.285 2.75421e+02 110.285 0.9746 
1 1 1 5   43  8  o 13 1.95145e+01 7.79193e-01 3.45825e+02 219.573 -2.17633e+01 -1.79868e+01 0.00000e+00 0.00000e+00 3.73619e+02 219.573 2.77935e+01 219.573 0.9821 
1 1 1 5   43  9  o 16 1.13380e+01 8.79582e-01 2.25140e+02 40.868  1.10131e+01  9.52919e+00  0.00000e+00 0.00000e+00 1.85451e+02 40.868  3.96889e+01 220.868 0.9650 
1 1 1 5   43  10 o 18 2.12672e+01 8.92227e-01 3.69576e+02 318.315 4.12081e+01  -3.66954e+01 0.00000e+00 0.00000e+00 4.20934e+02 318.315 5.13577e+01 318.315 0.9909 
1 1 1 5   43  11 o 15 1.00306e+01 1.20051e+00 1.82639e+02 52.390  8.62266e+00  1.11926e+01  0.00000e+00 0.00000e+00 1.79897e+02 52.390  2.74164e+00 232.390 0.9639 
1 1 1 5   43  12 o 11 7.56317e+00 1.62379e+00 1.27117e+02 13.830  6.84555e+00  1.68518e+00  0.00000e+00 0.00000e+00 1.35374e+02 13.830  8.25637e+00 13.830  0.9261 
1 1 1 5   43  13 o 14 7.15793e+00 1.70166e+00 5.49100e+01 310.828 2.07605e+00  -2.40274e+00 0.00000e+00 0.00000e+00 1.65514e+02 310.828 1.10604e+02 310.828 0.8222 
1 1 1 5   43  14 o 11 5.65297e+00 1.50909e+00 1.33127e+02 295.616 3.34290e+00  -6.97203e+00 0.00000e+00 0.00000e+00 6.42765e+01 295.616 6.88501e+01 115.616 0.9329 
1 1 1 5   43  15 o 6  4.81008e+00 1.43015e+00 2.51797e+01 241.235 -6.84574e-01 -1.24705e+00 0.00000e+00 0.00000e+00 7.85322e+01 241.235 5.33525e+01 241.235 0.5764 
1 1 1 5   43  16 o 2  8.96816e+00 2.01563e+00 1.33667e+02 187.510 -9.73840e+00 -1.28390e+00 0.00000e+00 0.00000e+00 1.83999e+02 187.510 5.03319e+01 187.510 0.9476 
1 1 1 5   43  17 o 5  4.42312e+00 1.50610e+00 6.42845e+01 56.087  2.08556e+00  3.10206e+00  0.00000e+00 0.00000e+00 7.65675e+01 56.087  1.22830e+01 56.087  0.8526 
1 1 1 5   44  0  o 5  1.76492e+01 5.04351e-01 3.62622e+02 74.540  2.64282e+00  9.55568e+00  0.00000e+00 0.00000e+00 2.65678e+02 74.540  9.69446e+01 254.540 0.9481 
1 1 1 5   44  1  o 11 3.39380e+01 6.83105e-01 5.93445e+02 325.599 2.54730e+01  -1.74422e+01 0.00000e+00 0.00000e+00 6.60208e+02 325.599 6.67631e+01 325.599 0.9837 
1 1 1 5   44  2  o 14 7.56174e+00 9.72398e-01 2.07932e+02 57.777  1.44294e+00  2.28934e+00  0.00000e+00 0.00000e+00 1.51959e+01 57.777  1.92736e+02 237.777 0.7857 
1 1 1 5   44  3  o 17 3.93332e+01 7.36543e-01 7.28024e+02 113.972 -1.98275e+01 4.45923e+01  0.00000e+00 0.00000e+00 7.34067e+02 113.972 6.04275e+00 113.972 0.9897 
1 1 1 5   44  4  o 3  1.15657e+01 5.54326e-01 2.52607e+02 233.596 -3.77047e+00 -5.11335e+00 0.00000e+00 0.00000e+00 1.45951e+02 233.596 1.06656e+02 53.596  0.9175 
1 1 1 5   44  5  o 16 8.71437e+00 7.76552e-01 1.09728e+02 50.682  1.43567e+00  1.75293e+00  0.00000e+00 0.00000e+00 1.31452e+02 50.682  2.17241e+01 50.682  0.7369 
1 1 1 5   44  6  o 18 1.95838e+01 8.42654e-01 1.90795e+02 207.564 -9.79381e+00 -5.11215e+00 0.00000e+00 0.00000e+00 5.10472e+02 207.564 3.19678e+02 207.564 0.9536 
1 1 1 5   44  7  o 7  3.69140e+01 7.59010e-01 6.10575e+02 35.677  5.94242e+01  4.26640e+01  0.00000e+00 0.00000e+00 7.65789e+02 35.677  1.55214e+02 35.677  0.9931 
1 1 1 5   44  8  o 5  5.57495e+00 9.53645e-01 1.33497e+02 243.411 -1.39875e+00 -2.79460e+00 0.00000e+00 0.00000e+00 3.78399e+01 243.411 9.56570e+01 63.411  0.8188 
1 1 1 5   44  9  o 19 3.03063e+01 9.06186e-01 5.41879e+02 51.831  5.53453e+01  7.04105e+01  0.00000e+00 0.00000e+00 5.88894e+02 51.831  4.70158e+01 51.831  0.9944 
1 1 1 5   44  10 o 2  7.26309e+00 1.36226e+00 1.57150e+02 250.563 -2.34849e+00 -6.65525e+00 0.00000e+00 0.00000e+00 9.51560e+01 250.563 6.19942e+01 70.563  0.9262 
1 1 1 5   44  11 o 4  5.27180e+00 1.41156e+00 4.35101e+01 266.979 -8.62060e-02 -1.63339e+00 0.00000e+00 0.00000e+00 8.05955e+01 266.979 3.70854e+01 266.979 0.6279 
1 1 1 5   44  12 o 4  1.46448e+01 1.27191e+00 1.86128e+02 3.769   2.42250e+01  1.59599e+00  0.00000e+00 0.00000e+00 3.51219e+02 3.769   1.65091e+02 3.769   0.9792 
1 1 1 5   44  13 o 19 6.16247e+00 1.46961e+00 7.09755e+01 248.708 -1.51325e+00 -3.88288e+00 0.00000e+00 0.00000e+00 1.29734e+02 248.708 5.87585e+01 248.708 0.8697 
1 1 1 5   44  14 o 11 3.31822e+00 1.11478e+00 6.95644e+01 256.599 -6.89469e-01 -2.89378e+00 0.00000e+00 0.00000e+00 3.07966e+01 256.599 3.87678e+01 76.599  0.8081 
1 1 1 5   44  15 o 10 5.43625e+00 1.55845e+00 1.33189e+02 102.315 -1.66833e+00 7.64201e+00  0.00000e+00 0.00000e+00 5.66568e+01 102.315 7.65325e+01 282.315 0.9337 
1 1 1 5   44  16 f 0  7.69140e+00 1.87700e+00 1.16902e+02 262.577 -1.06906e+00 -8.20522e+00 0.00000e+00 0.00000e+00 1.52583e+02 262.577 3.56810e+01 262.577 0.9375 
1 1 1 5   44  17 o 17 6.28771e+00 1.88837e+00 1.38491e+02 35.769  7.06279e+00  5.08804e+00  0.00000e+00 0.00000e+00 8.23870e+01 35.769  5.61042e+01 215.769 0.9407 
1 1 1 5   45  0  o 17 3.57000e+01 6.18445e-01 5.90042e+02 11.398  3.89159e+01  7.84568e+00  0.00000e+00 0.00000e+00 7.33211e+02 11.398  1.43170e+02 11.398  0.9873 
1 1 1 5   45  1  o 15 5.92879e+00 5.82120e-01 1.60630e+02 74.971  4.34455e-01  1.61811e+00  0.00000e+00 0.00000e+00 1.89127e+01 254.971 1.79543e+02 254.971 0.6366 
1 1 1 5   45  2  o 17 1.90027e+01 5.08975e-01 4.52051e+02 216.916 -1.17557e+01 -8.83145e+00 0.00000e+00 0.00000e+00 2.36833e+02 216.916 2.15219e+02 36.916  0.9654 
1 1 1 5   45  3  o 17 2.92981e+01 6.04375e-01 4.58945e+02 313.424 1.93264e+01  -2.04196e+01 0.00000e+00 0.00000e+00 6.21572e+02 313.424 1.62626e+02 313.424 0.9821 
1 1 1 5   45  4  o 3  3.13437e+01 6.42564e-01 3.48545e+02 233.448 -1.43806e+01 -1.93972e+01 0.00000e+00 0.00000e+00 8.03890e+02 233.448 4.55345e+02 233.448 0.9791 
1 1 1 5   45  5  o 3  5.52603e+01 1.05951e+00 9.72439e+02 116.715 -6.07658e+01 1.20738e+02  0.00000e+00 0.00000e+00 1.09495e+03 116.715 1.22509e+02 116.715 0.9963 
1 1 1 5   45  6  o 11 9.30965e+00 8.63339e-01 4.96084e+01 94.620  -1.04414e-01 1.29212e+00  0.00000e+00 0.00000e+00 1.39705e+02 94.620  9.00967e+01 94.620  0.5416 
1 1 1 5   45  7  o 7  1.07675e+01 8.96630e-01 9.72212e+01 12.397  3.52269e+00  7.74295e-01  0.00000e+00 0.00000e+00 2.44929e+02 12.397  1.47708e+02 12.397  0.8465 
1 1 1 5   45  8  o 7  2.51238e+01 6.78940e-01 5.09614e+02 335.923 5.31398e+01  -2.37455e+01 0.00000e+00 0.00000e+00 4.25119e+02 335.923 8.44958e+01 155.923 0.9914 
1 1 1 5   45  9  o 7  1.59970e+01 8.45379e-01 4.05096e+02 89.492  3.18404e-01  3.59251e+01  0.00000e+00 0.00000e+00 1.86651e+02 89.492  2.18445e+02 269.492 0.9860 
1 1 1 5   45  10 o 19 2.58532e+01 8.98139e-01 3.82358e+02 324.936 5.58453e+01  -3.91969e+01 0.00000e+00 0.00000e+00 5.80078e+02 324.936 1.97720e+02 324.936 0.9926 
1 1 1 5   45  11 o 12 1.06629e+01 1.34706e+00 2.33041e+02 235.903 -1.01637e+01 -1.50133e+01 0.00000e+00 0.00000e+00 1.55485e+02 235.903 7.75559e+01 55.903  0.9720 
1 1 1 5   45  12 o 12 6.51117e+00 1.61680e+00 1.09527e+02 291.740 1.92783e+00  -4.83453e+00 0.00000e+00 0.00000e+00 1.09528e+02 291.740 2.57935e-05 291.740 0.8979 
1 1 1 5   45  13 o 12 7.96258e+00 1.32220e+00 1.09921e+02 269.980 -3.10271e-03 -9.03304e+00 0.00000e+00 0.00000e+00 1.71226e+02 269.980 6.13043e+01 269.980 0.9429 
1 1 1 5   45  14 f 0  5.20329e+00 1.48504e+00 2.06235e+02 83.199  1.32142e+00  1.10803e+01  0.00000e+00 0.00000e+00 2.04529e+01 263.199 2.26688e+02 263.199 0.9541 
1 1 1 5   45  15 o 18 3.93494e+00 1.30112e+00 4.60733e+01 345.852 2.26737e+00  -5.71555e-01 0.00000e+00 0.00000e+00 6.37354e+01 345.852 1.76622e+01 345.852 0.7462 
1 1 1 5   45  16 o 19 5.23347e+00 1.58238e+00 5.58915e+01 133.198 -2.25954e+00 2.40635e+00  0.00000e+00 0.00000e+00 1.06431e+02 133.198 5.05399e+01 133.198 0.8300 
1 1 1 5   45  17 o 7  5.23709e+00 1.68462e+00 7.16699e+01 55.179  2.44998e+00  3.52232e+00  0.00000e+00 0.00000e+00 9.92087e+01 55.179  2.75388e+01 55.179  0.8738 
1 1 1 5   46  0  o 13 1.45376e+01 4.09422e-01 2.22466e+02 42.852  4.18061e+00  3.87828e+00  0.00000e+00 0.00000e+00 2.72741e+02 42.852  5.02756e+01 42.852  0.9075 
1 1 1 5   46  1  o 7  3.73080e+01 7.05731e-01 7.09697e+02 216.829 -3.60706e+01 -2.70131e+01 0.00000e+00 0.00000e+00 6.75347e+02 216.829 3.43498e+01 36.829  0.9888 
1 1 1 5   46  2  o 4  5.78240e+00 5.67518e-01 9.60814e+01 230.950 -6.00586e-01 -7.40344e-01 0.00000e+00 0.00000e+00 2.80778e+00 50.950  9.88892e+01 50.950  0.4296 
1 1 1 5   46  3  o 11 1.08587e+01 4.89912e-01 2.56793e+02 159.729 -5.47308e+00 2.02144e+00  0.00000e+00 0.00000e+00 1.14132e+02 159.729 1.42661e+02 339.729 0.9097 
1 1 1 5   46  4  o 6  3.30049e+01 6.66224e-01 6.48910e+02 150.685 -4.53855e+01 2.54848e+01  0.00000e+00 0.00000e+00 5.78429e+02 150.685 7.04801e+01 330.685 0.9903 
1 1 1 5   46  5  o 2  4.42115e+01 8.29802e-01 7.79530e+02 225.311 -6.53199e+01 -6.60331e+01 0.00000e+00 0.00000e+00 8.71488e+02 225.311 9.19580e+01 225.311 0.9946 
1 1 1 5   46  6  o 2  1.55271e+01 6.06660e-01 2.51380e+02 60.023  6.26230e+00  1.08566e+01  0.00000e+00 0.00000e+00 3.07765e+02 60.023  5.63856e+01 60.023  0.9592 
1 1 1 5   46  7  o 2  1.08269e+01 7.22424e-01 2.23774e+02 167.886 -8.07277e+00 1.73268e+00  0.00000e+00 0.00000e+00 1.57133e+02 167.886 6.66410e+01 347.886 0.9373 
1 1 1 5   46  8  o 17 2.73342e+01 6.94314e-01 4.50757e+02 282.954 1.32018e+01  -5.73953e+01 0.00000e+00 0.00000e+00 5.66192e+02 282.954 1.15435e+02 282.954 0.9915 
1 1 1 5   46  9  o 2  1.78884e+01 8.42492e-01 3.12677e+02 85.450  2.61375e+00  3.28451e+01  0.00000e+00 0.00000e+00 3.48095e+02 85.450  3.54184e+01 85.450  0.9847 
1 1 1 5   46  10 o 10 1.09574e+01 1.12059e+00 2.70456e+02 262.103 -2.78452e+00 -2.00738e+01 0.00000e+00 0.00000e+00 1.30156e+02 262.103 1.40300e+02 82.103  0.9750 
1 1 1 5   46  11 o 7  5.50519e+00 1.46175e+00 7.48481e+01 302.650 1.61872e+00  -2.52628e+00 0.00000e+00 0.00000e+00 9.22930e+01 302.650 1.74449e+01 302.650 0.8100 
1 1 1 5   46  12 o 8  1.31945e+01 1.46948e+00 2.90106e+02 315.630 2.26033e+01  -2.21116e+01 0.00000e+00 0.00000e+00 1.96318e+02 315.630 9.37874e+01 135.630 0.9841 
1 1 1 5   46  13 o 4  9.94230e+00 1.29649e+00 2.90749e+02 130.038 -1.99949e+01 2.37969e+01  0.00000e+00 0.00000e+00 7.54700e+01 130.038 2.15279e+02 310.038 0.9838 
1 1 1 5   46  14 o 9  4.26424e+00 1.34478e+00 3.40939e+01 213.259 -1.37479e+00 -9.01662e-01 0.00000e+00 0.00000e+00 6.63958e+01 213.259 3.23019e+01 213.259 0.6298 
1 1 1 5   46  15 o 19 9.61113e+00 1.63323e+00 9.46616e+01 100.680 -1.69984e+00 9.01368e+00  0.00000e+00 0.00000e+00 2.44530e+02 100.680 1.49868e+02 100.680 0.9438 
1 1 1 5   46  16 o 15 4.87203e+00 1.56130e+00 3.99510e+01 117.898 -1.05206e+00 1.98715e+00  0.00000e+00 0.00000e+00 9.37841e+01 117.898 5.38331e+01 117.898 0.7346 
1 1 1 5   46  17 o 18 6.30462e+00 1.91006e+00 1.54496e+02 292.246 3.61031e+00  -8.82655e+00 0.00000e+00 0.00000e+00 6.81795e+01 292.246 8.63169e+01 112.246 0.9460 
1 1 1 5   47  0  o 9  4.39030e+01 7.31010e-01 8.08236e+02 322.113 4.74383e+01  -3.69117e+01 0.00000e+00 0.00000e+00 8.25781e+02 322.113 1.75452e+01 322.113 0.9916 
1 1 1 5   47  1  o 7  1.65245e+01 5.05804e-01 2.37825e+02 242.402 -3.13288e+00 -5.99313e+00 0.00000e+00 0.00000e+00 3.34584e+02 242.402 9.67593e+01 242.402 0.9228 
1 1 1 5   47  2  o 1  3.09743e+01 5.75643e-01 5.22580e+02 56.591  1.86509e+01  2.82756e+01  0.00000e+00 0.00000e+00 6.22987e+02 56.591  1.00407e+02 56.591  0.9851 
1 1 1 5   47  3  o 12 1.55515e+01 4.93004e-01 1.62108e+02 101.773 -1.11918e+00 5.36965e+00  0.00000e+00 0.00000e+00 3.65446e+02 101.773 2.03337e+02 101.773 0.9035 
1 1 1 5   47  4  o 12 2.85658e+01 6.12425e-01 5.27479e+02 241.492 -1.72360e+01 -3.17349e+01 0.00000e+00 0.00000e+00 5.30047e+02 241.492 2.56807e+00 241.492 0.9861 
1 1 1 5   47  5  o 6  2.31046e+01 5.83291e-01 3.63361e+02 41.116  1.77263e+01  1.54726e+01  0.00000e+00 0.00000e+00 4.85384e+02 41.116  1.22023e+02 41.116  0.9785 
1 1 1 5   47  6  o 4  4.81066e+01 9.01006e-01 8.21335e+02 200.224 -1.11911e+02 -4.12283e+01 0.00000e+00 0.00000e+00 9.76827e+02 200.224 1.55493e+02 200.224 0.9958 
1 1 1 5   47  7  o 6  1.07487e+01 6.99759e-01 2.21522e+02 45.077  6.49754e+00  6.51510e+00  0.00000e+00 0.00000e+00 1.59273e+02 45.077  6.22497e+01 225.077 0.9440 
1 1 1 5   47  8  o 14 1.17264e+01 8.74943e-01 3.06115e+02 110.521 -5.72414e+00 1.52928e+01  0.00000e+00 0.00000e+00 1.20160e+02 110.521 1.85955e+02 290.521 0.9689 
1 1 1 5   47  9  o 15 5.45876e+00 1.29702e+00 1.91726e+02 323.601 4.55306e+00  -3.35672e+00 0.00000e+00 0.00000e+00 6.08990e+00 143.601 1.97816e+02 143.601 0.9067 
1 1 1 5   47  10 o 6  1.03910e+01 9.78671e-01 2.34473e+02 222.271 -1.37702e+01 -1.25174e+01 0.00000e+00 0.00000e+00 1.44503e+02 222.271 8.99700e+01 42.271  0.9727 
1 1 1 5   47  11 o 7  8.30334e+00 1.45423e+00 1.66905e+02 331.640 8.98310e+00  -4.84902e+00 0.00000e+00 0.00000e+00 1.28618e+02 331.640 3.82870e+01 151.640 0.9497 
1 1 1 5   47  12 o 16 5.81343e+00 1.42933e+00 1.50042e+02 305.791 4.44515e+00  -6.16548e+00 0.00000e+00 0.00000e+00 5.28417e+01 305.791 9.72000e+01 125.791 0.9317 
1 1 1 5   47  13 o 19 3.66529e+00 1.15822e+00 7.70115e+01 8.273   3.08605e+00  4.48722e-01  0.00000e+00 0.00000e+00 3.52843e+01 8.273   4.17271e+01 188.273 0.8184 
1 1 1 5   47  14 o 11 7.34185e+00 1.46254e+00 1.54902e+02 287.847 3.68322e+00  -1.14395e+01 0.00000e+00 0.00000e+00 1.08094e+02 287.847 4.68083e+01 107.847 0.9574 
1 1 1 5   47  15 o 12 3.52116e+00 1.21449e+00 4.19190e+01 18.504  1.94414e+00  6.50670e-01  0.00000e+00 0.00000e+00 5.10042e+01 18.504  9.08519e+00 18.504  0.7058 
1 1 1 5   47  16 o 13 7.51661e+00 1.91210e+00 1.52885e+02 142.828 -8.43518e+00 6.39626e+00  0.00000e+00 0.00000e+00 1.14324e+02 142.828 3.85610e+01 322.828 0.9515 
1 1 1 5   47  17 o 3  7.53313e+00 2.03989e+00 1.19963e+02 284.531 2.07909e+00  -8.02155e+00 0.00000e+00 0.00000e+00 1.43692e+02 284.531 2.37291e+01 284.531 0.9376 
1 1 1 5   48  0  o 14 2.72928e+01 5.22943e-01 4.19534e+02 117.450 -9.06042e+00 1.74421e+01  0.00000e+00 0.00000e+00 5.78289e+02 117.450 1.58755e+02 117.450 0.9742 
1 1 1 5   48  1  o 2  4.46485e+01 7.45276e-01 6.88624e+02 112.925 -2.48745e+01 5.88151e+01  0.00000e+00 0.00000e+00 9.74032e+02 112.925 2.85408e+02 112.925 0.9921 
1 1 1 5   48  2  f 0  1.12323e+01 4.56457e-01 1.32120e+02 326.944 2.60382e+00  -1.69457e+00 0.00000e+00 0.00000e+00 2.12600e+02 326.944 8.04803e+01 326.944 0.8176 
1 1 1 5   48  3  o 4  2.90705e+01 5.66812e-01 5.04819e+02 125.143 -1.87011e+01 2.65665e+01  0.00000e+00 0.00000e+00 5.69555e+02 125.143 6.47358e+01 125.143 0.9845 
1 1 1 5   48  4  o 19 3.16018e+01 6.51840e-01 5.49443e+02 54.178  2.70103e+01  3.74202e+01  0.00000e+00 0.00000e+00 6.23943e+02 54.178  7.45005e+01 54.178  0.9891 
1 1 1 5   48  5  o 12 2.16442e+01 5.76238e-01 3.82986e+02 132.407 -1.68802e+01 1.84819e+01  0.00000e+00 0.00000e+00 4.13064e+02 132.407 3.00781e+01 132.407 0.9798 
1 1 1 5   48  6  o 7  3.29768e+01 7.02654e-01 4.67709e+02 197.863 -4.64214e+01 -1.49602e+01 0.00000e+00 0.00000e+00 7.57208e+02 197.863 2.89500e+02 197.863 0.9897 
1 1 1 5   48  7  o 19 8.68777e+00 7.85871e-01 2.24761e+02 43.815  5.90624e+00  5.66686e+00  0.00000e+00 0.00000e+00 8.06242e+01 43.815  1.44137e+02 223.815 0.9368 
1 1 1 5   48  8  o 17 8.67914e+00 1.04085e+00 1.81782e+02 338.675 6.94433e+00  -2.71089e+00 0.00000e+00 0.00000e+00 1.21113e+02 338.675 6.06690e+01 158.676 0.9303 
1 1 1 5   48  9  o 11 1.76198e+01 8.35478e-01 2.56836e+02 283.910 7.13311e+00  -2.88012e+01 0.00000e+00 0.00000e+00 3.92720e+02 283.910 1.35884e+02 283.910 0.9830 
1 1 1 5   48  10 o 2  1.73774e+01 9.69551e-01 2.31210e+02 97.601  -3.85519e+00 2.88883e+01  0.00000e+00 0.00000e+00 4.08965e+02 97.601  1.77755e+02 97.601  0.9827 
1 1 1 5   48  11 o 19 2.15185e+01 9.80070e-01 3.55567e+02 294.617 2.79157e+01  -6.09244e+01 0.00000e+00 0.00000e+00 4.44732e+02 294.617 8.91650e+01 294.617 0.9925 
1 1 1 5   48  12 o 4  1.56783e+01 9.38092e-01 2.17007e+02 256.625 -8.88687e+00 -3.73748e+01 0.00000e+00 0.00000e+00 3.62501e+02 256.625 1.45493e+02 256.625 0.9869 
1 1 1 5   48  13 o 13 3.43269e+00 1.12527e+00 6.91406e+01 120.863 -1.40615e+00 2.35299e+00  0.00000e+00 0.00000e+00 3.22230e+01 120.863 3.69176e+01 300.862 0.7889 
1 1 1 5   48  14 o 8  5.28976e+00 1.49997e+00 1.26997e+02 154.351 -6.43863e+00 3.09167e+00  0.00000e+00 0.00000e+00 5.64587e+01 154.351 7.05382e+01 334.351 0.9271 
1 1 1 5   48  15 f 0  1.22800e+01 1.60211e+00 1.88645e+02 55.551  1.45778e+01  2.12514e+01  0.00000e+00 0.00000e+00 2.61423e+02 55.551  7.27785e+01 55.551  0.9804 
1 1 1 5   48  16 o 13 5.48892e+00 1.70182e+00 1.32423e+02 233.548 -4.61741e+00 -6.25102e+00 0.00000e+00 0.00000e+00 5.89305e+01 233.548 7.34928e+01 53.548  0.9332 
1 1 1 5   49  0  o 7  9.42920e+00 5.63025e-01 1.36755e+02 229.355 -1.75529e+00 -2.04470e+00 0.00000e+00 0.00000e+00 1.40849e+02 229.355 4.09432e+00 229.355 0.7846 
1 1 1 5   49  1  o 14 7.60411e+00 5.02426e-01 3.09568e+02 272.650 2.27691e-01  -4.91887e+00 0.00000e+00 0.00000e+00 5.51311e+01 92.650  3.64699e+02 92.650  0.8916 
1 1 1 5   49  2  o 13 1.75620e+01 4.58158e-01 5.32111e+02 28.193  1.79264e+01  9.60908e+00  0.00000e+00 0.00000e+00 1.10629e+02 28.193  4.21482e+02 208.193 0.9751 
1 1 1 5   49  3  o 6  1.80256e+01 4.74723e-01 3.89373e+02 227.802 -1.15403e+01 -1.27281e+01 0.00000e+00 0.00000e+00 2.67218e+02 227.802 1.22155e+02 47.802  0.9704 
1 1 1 5   49  4  o 15 2.76333e+01 5.74491e-01 5.00475e+02 194.801 -3.48460e+01 -9.20771e+00 0.00000e+00 0.00000e+00 5.22230e+02 194.801 2.17548e+01 194.801 0.9860 
1 1 1 5   49  5  o 6  5.75302e+01 1.03432e+00 9.72428e+02 11.543  1.51173e+02  3.08757e+01  0.00000e+00 0.00000e+00 1.17976e+03 11.543  2.07336e+02 11.543  0.9968 
1 1 1 5   49  6  o 4  1.18929e+01 6.64790e-01 1.49387e+02 107.199 -1.71577e+00 5.54307e+00  0.00000e+00 0.00000e+00 2.56379e+02 107.199 1.06992e+02 107.199 0.9092 
1 1 1 5   49  7  o 16 1.14717e+01 7.30190e-01 1.74417e+02 99.520  -1.43356e+00 8.54868e+00  0.00000e+00 0.00000e+00 2.30346e+02 99.520  5.59287e+01 99.520  0.9404 
1 1 1 5   49  8  o 6  2.78597e+01 8.49681e-01 4.38861e+02 332.932 5.68296e+01  -2.90416e+01 0.00000e+00 0.00000e+00 5.97925e+02 332.932 1.59064e+02 332.932 0.9921 
1 1 1 5   49  9  o 11 1.12600e+01 9.76692e-01 2.28049e+02 161.359 -1.59247e+01 5.37199e+00  0.00000e+00 0.00000e+00 1.81416e+02 161.359 4.66329e+01 341.359 0.9698 
1 1 1 5   49  10 o 5  6.64723e+00 1.37576e+00 9.43772e+01 279.827 7.36861e-01  -4.25401e+00 0.00000e+00 0.00000e+00 1.23565e+02 279.827 2.91881e+01 279.827 0.8747 
1 1 1 5   49  11 o 16 6.31420e+00 1.46260e+00 1.73225e+02 267.884 -3.16155e-01 -8.55675e+00 0.00000e+00 0.00000e+00 4.90721e+01 267.884 1.24153e+02 87.884  0.9397 
1 1 1 5   49  12 f 0  9.26087e+00 1.18847e+00 1.24487e+02 218.038 -9.54354e+00 -7.46642e+00 0.00000e+00 0.00000e+00 2.07682e+02 218.038 8.31946e+01 218.038 0.9578 
1 1 1 5   49  13 o 11 4.35360e+00 1.30777e+00 1.24971e+02 51.450  3.72902e+00  4.67967e+00  0.00000e+00 0.00000e+00 2.36501e+01 51.450  1.01321e+02 231.450 0.9121 
1 1 1 5   49  14 o 12 4.30925e+00 1.31383e+00 1.33492e+02 236.920 -3.53196e+00 -5.42209e+00 0.00000e+00 0.00000e+00 1.46522e+01 236.920 1.18839e+02 56.920  0.9191 
1 1 1 5   49  15 o 11 1.38237e+01 1.60023e+00 1.19792e+02 349.446 1.77126e+01  -3.30011e+00 0.00000e+00 0.00000e+00 3.82361e+02 349.446 2.62568e+02 349.446 0.9718 
1 1 1 5   49  16 o 17 9.04637e+00 1.99166e+00 1.88263e+02 78.231  3.12495e+00  1.49983e+01  0.00000e+00 0.00000e+00 1.38402e+02 78.231  4.98616e+01 258.231 0.9668 
1 1 1 5   50  0  o 9  2.75964e+01 5.28255e-01 4.59625e+02 3.685   2.63716e+01  1.69848e+00  0.00000e+00 0.00000e+00 5.55936e+02 3.685   9.63107e+01 3.685   0.9809 
1 1 1 5   50  1  o 9  2.03917e+01 4.97013e-01 3.11884e+02 314.769 9.74186e+00  -9.82090e+00 0.00000e+00 0.00000e+00 4.25092e+02 314.769 1.13208e+02 314.769 0.9631 
1 1 1 5   50  2  o 13 3.40178e+01 6.16894e-01 6.22176e+02 165.147 -4.99606e+01 1.32496e+01  0.00000e+00 0.00000e+00 6.42028e+02 165.147 1.98517e+01 165.147 0.9903 
1 1 1 5   50  3  o 5  2.07047e+01 4.94077e-01 2.70566e+02 239.640 -7.60965e+00 -1.29914e+01 0.00000e+00 0.00000e+00 4.80209e+02 239.640 2.09643e+02 239.640 0.9662 
1 1 1 5   50  4  o 13 3.80088e+01 6.86137e-01 6.12057e+02 45.260  4.56024e+01  4.60182e+01  0.00000e+00 0.00000e+00 8.03334e+02 45.260  1.91278e+02 45.260  0.9923 
1 1 1 5   50  5  o 5  4.16915e+01 8.02496e-01 7.69883e+02 17.841  9.64024e+01  3.10282e+01  0.00000e+00 0.00000e+00 7.86909e+02 17.841  1.70258e+01 17.841  0.9951 
1 1 1 5   50  6  o 3  1.91387e+01 6.05714e-01 4.01268e+02 139.990 -2.02849e+01 1.70270e+01  0.00000e+00 0.00000e+00 3.03152e+02 139.990 9.81156e+01 319.990 0.9809 
1 1 1 5   50  7  o 11 1.60998e+01 6.40866e-01 3.71758e+02 177.095 -2.73146e+01 1.38629e+00  0.00000e+00 0.00000e+00 2.21067e+02 177.095 1.50691e+02 357.095 0.9815 
1 1 1 5   50  8  o 1  1.23021e+01 8.56002e-01 2.14880e+02 1.392   1.45358e+01  3.53130e-01  0.00000e+00 0.00000e+00 2.30343e+02 1.392   1.54627e+01 1.392   0.9650 
1 1 1 5   50  9  o 9  9.22957e+00 1.03550e+00 1.67266e+02 140.937 -8.10835e+00 6.58077e+00  0.00000e+00 0.00000e+00 1.61764e+02 140.937 5.50144e+00 320.937 0.9508 
1 1 1 5   50  10 o 16 1.50054e+01 1.08854e+00 2.00416e+02 130.824 -1.57635e+01 1.82469e+01  0.00000e+00 0.00000e+00 3.50175e+02 130.824 1.49759e+02 130.824 0.9790 
1 1 1 5   50  11 o 19 6.02275e+00 1.47061e+00 8.23402e+01 257.168 -8.87895e-01 -3.89786e+00 0.00000e+00 0.00000e+00 1.12471e+02 257.168 3.01308e+01 257.168 0.8634 
1 1 1 5   50  12 f 0  4.91750e+00 1.26790e+00 1.11467e+02 166.320 -5.14171e+00 1.25147e+00  0.00000e+00 0.00000e+00 5.41978e+01 166.320 5.72697e+01 346.320 0.8997 
1 1 1 5   50  13 o 4  4.72836e+00 1.32199e+00 1.47534e+02 284.866 1.91696e+00  -7.22192e+00 0.00000e+00 0.00000e+00 1.71048e+01 284.866 1.30429e+02 104.866 0.9305 
1 1 1 5   50  14 o 14 1.05303e+01 1.45952e+00 1.80512e+02 75.952  4.91997e+00  1.96632e+01  0.00000e+00 0.00000e+00 2.03468e+02 75.952  2.29556e+01 75.952  0.9750 
1 1 1 5   50  15 o 19 6.21067e+00 1.69657e+00 1.04807e+02 303.430 3.50800e+00  -5.31408e+00 0.00000e+00 0.00000e+00 1.08206e+02 303.430 3.39914e+00 303.430 0.9177 
1 1 1 5   50  16 o 2  5.56752e+00 1.67851e+00 8.89774e+01 117.474 -2.56971e+00 4.94183e+00  0.00000e+00 0.00000e+00 9.92145e+01 117.474 1.02371e+01 117.474 0.9051 
1 1 1 5   51  0  o 11 8.44231e+00 7.45205e-01 6.86982e+01 131.810 -8.49564e-01 9.49847e-01  0.00000e+00 0.00000e+00 1.00796e+02 131.810 3.20982e+01 131.810 0.5352 
1 1 1 5   51  1  o 7  8.73366e+00 5.32166e-01 2.82334e+02 284.447 1.36336e+00  -5.29193e+00 0.00000e+00 0.00000e+00 1.36055e+01 284.447 2.68728e+02 104.447 0.9032 
1 1 1 5   51  2  o 12 1.18113e+01 4.65196e-01 1.45272e+02 180.824 -4.14524e+00 -5.96040e-02 0.00000e+00 0.00000e+00 2.39818e+02 180.824 9.45453e+01 180.824 0.8689 
1 1 1 5   51  3  o 16 1.93583e+01 4.93351e-01 3.47859e+02 340.221 1.66043e+01  -5.97101e+00 0.00000e+00 0.00000e+00 3.57658e+02 340.221 9.79959e+00 340.221 0.9712 
1 1 1 5   51  4  o 18 1.50250e+01 5.25460e-01 2.27158e+02 341.931 9.83193e+00  -3.20770e+00 0.00000e+00 0.00000e+00 3.08648e+02 341.931 8.14895e+01 341.931 0.9503 
1 1 1 5   51  5  o 12 1.91817e+01 5.84835e-01 3.57893e+02 117.103 -9.68491e+00 1.89232e+01  0.00000e+00 0.00000e+00 3.44692e+02 117.103 1.32008e+01 297.103 0.9762 
1 1 1 5   51  6  o 5  2.82081e+01 6.61592e-01 4.22448e+02 211.794 -3.93526e+01 -2.43944e+01 0.00000e+00 0.00000e+00 6.24321e+02 211.794 2.01873e+02 211.794 0.9891 
1 1 1 5   51  7  o 13 1.48358e+01 8.01711e-01 2.21981e+02 6.785   1.54114e+01  1.83350e+00  0.00000e+00 0.00000e+00 3.16257e+02 6.785   9.42761e+01 6.785   0.9672 
1 1 1 5   51  8  o 10 1.15657e+01 8.74755e-01 2.98438e+02 49.306  1.24002e+01  1.44196e+01  0.00000e+00 0.00000e+00 1.23705e+02 49.306  1.74733e+02 229.306 0.9733 
1 1 1 5   51  9  o 13 4.01572e+00 1.17591e+00 6.06877e+01 212.397 -1.34410e+00 -8.52912e-01 0.00000e+00 0.00000e+00 3.23511e+01 212.397 2.83366e+01 32.398  0.6180 
1 1 1 5   51  10 f 0  8.46034e+00 1.31573e+00 1.53887e+02 140.559 -7.43188e+00 6.11363e+00  0.00000e+00 0.00000e+00 1.46195e+02 140.559 7.69218e+00 320.559 0.9465 
1 1 1 5   51  11 o 15 1.18565e+01 9.48615e-01 2.18295e+02 66.094  1.00982e+01  2.27814e+01  0.00000e+00 0.00000e+00 2.16805e+02 66.094  1.49015e+00 246.094 0.9797 
1 1 1 5   51  12 o 2  4.35805e+00 1.20021e+00 8.94804e+01 327.004 3.50790e+00  -2.27766e+00 0.00000e+00 0.00000e+00 5.24963e+01 327.004 3.69841e+01 147.005 0.8702 
1 1 1 5   51  13 o 1  6.23677e+00 1.39759e+00 9.03536e+01 91.414  -1.41175e-01 5.71968e+00  0.00000e+00 0.00000e+00 1.21491e+02 91.414  3.11376e+01 91.414  0.9078 
1 1 1 5   51  14 o 10 4.48814e+00 1.36635e+00 9.50885e+01 210.817 -4.43232e+00 -2.64394e+00 0.00000e+00 0.00000e+00 5.54507e+01 210.817 3.96378e+01 30.817  0.8970 
1 1 1 5   51  15 o 9  3.72144e+00 1.25991e+00 5.60297e+01 280.384 5.16146e-01  -2.81665e+00 0.00000e+00 0.00000e+00 5.51326e+01 280.384 8.97108e-01 100.384 0.7994 
1 1 1 5   51  16 o 16 5.67935e+00 1.74381e+00 1.34294e+02 18.357  7.98337e+00  2.64902e+00  0.00000e+00 0.00000e+00 6.47364e+01 18.357  6.95581e+01 198.357 0.9385 
1 1 1 5   52  0  o 12 4.66359e+01 7.73802e-01 6.60348e+02 46.534  5.10947e+01  5.39073e+01  0.00000e+00 0.00000e+00 1.07700e+03 46.534  4.16653e+02 46.534  0.9932 
1 1 1 5   52  1  o 11 1.48841e+01 4.44482e-01 2.47197e+02 249.198 -3.16089e+00 -8.32042e+00 0.00000e+00 0.00000e+00 2.78783e+02 249.198 3.15859e+01 249.198 0.9420 
1 1 1 5   52  2  o 7  2.43937e+01 5.70300e-01 3.09223e+02 213.435 -1.68247e+01 -1.11087e+01 0.00000e+00 0.00000e+00 5.82971e+02 213.435 2.73748e+02 213.435 0.9749 
1 1 1 5   52  3  o 16 1.57611e+01 5.23274e-01 3.05639e+02 109.758 -4.47297e+00 1.24527e+01  0.00000e+00 0.00000e+00 2.62902e+02 109.758 4.27366e+01 289.758 0.9614 
1 1 1 5   52  4  o 12 3.09161e+01 6.99040e-01 5.52638e+02 176.474 -4.84882e+01 2.98735e+00  0.00000e+00 0.00000e+00 5.95293e+02 176.474 4.26544e+01 176.474 0.9897 
1 1 1 5   52  5  o 18 2.45684e+01 5.75409e-01 5.01198e+02 272.071 1.46820e+00  -4.05954e+01 0.00000e+00 0.00000e+00 4.09095e+02 272.071 9.21035e+01 92.071  0.9876 
1 1 1 5   52  6  o 4  1.14790e+01 7.84450e-01 2.55560e+02 359.251 1.23162e+01  -1.61046e-01 0.00000e+00 0.00000e+00 1.57163e+02 359.251 9.83978e+01 179.251 0.9585 
1 1 1 5   52  7  o 3  3.88942e+01 9.52914e-01 5.60400e+02 198.583 -9.28328e+01 -3.12113e+01 0.00000e+00 0.00000e+00 8.90805e+02 198.583 3.30405e+02 198.583 0.9949 
1 1 1 5   52  8  o 19 1.88307e+01 8.63134e-01 3.52165e+02 359.888 3.88512e+01  -7.60077e-02 0.00000e+00 0.00000e+00 3.44726e+02 359.888 7.43844e+00 179.888 0.9870 
1 1 1 5   52  9  o 18 5.35404e+00 1.30185e+00 3.23325e+01 110.815 -3.98596e-01 1.04849e+00  0.00000e+00 0.00000e+00 6.55703e+01 110.815 3.32378e+01 110.815 0.4879 
1 1 1 5   52  10 o 1  5.09316e+00 1.31653e+00 4.46219e+01 187.442 -1.66262e+00 -2.17182e-01 0.00000e+00 0.00000e+00 7.69149e+01 187.442 3.22930e+01 187.442 0.6369 
1 1 1 5   52  11 o 17 1.03907e+01 1.03844e+00 2.48372e+02 206.601 -2.25686e+01 -1.13018e+01 0.00000e+00 0.00000e+00 1.32984e+02 206.601 1.15389e+02 26.601  0.9800 
1 1 1 5   52  12 o 12 3.93693e+00 1.17242e+00 1.13499e+01 279.565 7.78356e-02  -4.61880e-01 0.00000e+00 0.00000e+00 2.22504e+01 279.565 1.09004e+01 279.565 0.2280 
1 1 1 5   52  13 o 5  3.91389e+00 1.17945e+00 4.08118e+01 214.492 -1.63079e+00 -1.12046e+00 0.00000e+00 0.00000e+00 6.08407e+01 214.492 2.00289e+01 214.492 0.6942 
1 1 1 5   52  14 o 5  3.94577e+00 1.25389e+00 3.73807e+01 7.402   1.80284e+00  2.34220e-01  0.00000e+00 0.00000e+00 6.07978e+01 7.402   2.34171e+01 7.402   0.6655 
1 1 1 5   52  15 o 2  9.42779e+00 1.80744e+00 1.57863e+02 133.725 -9.78844e+00 1.02340e+01  0.00000e+00 0.00000e+00 1.81710e+02 133.725 2.38473e+01 133.725 0.9640 
1 1 1 5   52  16 o 2  4.25914e+00 1.43969e+00 7.97699e+01 42.909  3.31036e+00  3.07716e+00  0.00000e+00 0.00000e+00 6.03066e+01 42.909  1.94633e+01 222.909 0.8809 
1 1 1 5   53  0  o 6  1.28052e+01 5.80481e-01 1.92782e+02 286.686 1.69956e+00  -5.66983e+00 0.00000e+00 0.00000e+00 2.44734e+02 286.686 5.19521e+01 286.686 0.9111 
1 1 1 5   53  1  o 5  3.01485e+01 5.65896e-01 5.67997e+02 125.104 -2.63358e+01 3.74670e+01  0.00000e+00 0.00000e+00 5.50395e+02 125.104 1.76023e+01 305.104 0.9890 
1 1 1 5   53  2  o 16 3.11926e+01 5.86571e-01 6.19533e+02 275.791 5.07779e+00  -5.00698e+01 0.00000e+00 0.00000e+00 5.38880e+02 275.791 8.06531e+01 95.791  0.9900 
1 1 1 5   53  3  o 19 9.30350e+00 7.10035e-01 1.87003e+02 234.013 -2.83228e+00 -3.90009e+00 0.00000e+00 0.00000e+00 1.23279e+02 234.013 6.37234e+01 54.013  0.8890 
1 1 1 5   53  4  o 12 1.08083e+01 6.93030e-01 2.42349e+02 30.905  7.15765e+00  4.28465e+00  0.00000e+00 0.00000e+00 1.37968e+02 30.905  1.04382e+02 210.905 0.9380 
1 1 1 5   53  5  o 19 2.26180e+01 5.65889e-01 4.20874e+02 144.566 -2.76003e+01 1.96393e+01  0.00000e+00 0.00000e+00 4.14925e+02 144.566 5.94901e+00 324.566 0.9851 
1 1 1 5   53  6  o 19 1.39835e+01 6.35800e-01 3.30263e+02 226.422 -1.35046e+01 -1.41920e+01 0.00000e+00 0.00000e+00 1.80628e+02 226.422 1.49635e+02 46.422  0.9741 
1 1 1 5   53  7  o 3  2.07009e+01 7.57969e-01 3.14115e+02 204.195 -2.93254e+01 -1.31766e+01 0.00000e+00 0.00000e+00 4.49964e+02 204.195 1.35848e+02 204.195 0.9843 
1 1 1 5   53  8  o 12 2.29214e+01 8.20922e-01 3.85600e+02 5.632   5.28440e+01  5.21105e+00  0.00000e+00 0.00000e+00 4.65560e+02 5.632   7.99603e+01 5.632   0.9905 
1 1 1 5   53  9  o 10 1.15032e+01 1.05889e+00 2.81749e+02 286.129 6.72493e+00  -2.32544e+01 0.00000e+00 0.00000e+00 1.40354e+02 286.129 1.41396e+02 106.129 0.9791 
1 1 1 5   53  10 o 16 9.44634e+00 1.23284e+00 1.66826e+02 115.081 -5.30913e+00 1.13435e+01  0.00000e+00 0.00000e+00 1.72621e+02 115.081 5.79526e+00 115.081 0.9592 
1 1 1 5   53  11 o 9  8.60415e+00 1.09827e+00 2.12998e+02 14.099  1.60431e+01  4.02934e+00  0.00000e+00 0.00000e+00 9.92970e+01 14.099  1.13701e+02 194.099 0.9693 
1 1 1 5   53  12 o 17 7.36542e+00 1.27088e+00 9.15587e+01 348.229 6.95737e+00  -1.44977e+00 0.00000e+00 0.00000e+00 1.63904e+02 348.229 7.23452e+01 348.229 0.9267 
1 1 1 5   53  13 o 17 3.31206e+00 1.09179e+00 9.20330e+01 132.843 -2.70396e+00 2.91562e+00  0.00000e+00 0.00000e+00 1.48374e+01 132.843 7.71955e+01 312.843 0.8626 
1 1 1 5   53  14 o 18 5.84413e+00 1.55042e+00 7.57090e+01 233.370 -2.87359e+00 -3.86513e+00 0.00000e+00 0.00000e+00 1.18498e+02 233.370 4.27893e+01 233.370 0.8889 
1 1 1 5   53  15 o 17 3.53444e+00 1.20948e+00 1.22699e+02 285.355 1.67877e+00  -6.11353e+00 0.00000e+00 0.00000e+00 1.57706e+00 105.355 1.24276e+02 105.355 0.9173 
1 1 1 5   53  16 o 13 4.56933e+00 1.43185e+00 1.05027e+02 37.596  5.05581e+00  3.89294e+00  0.00000e+00 0.00000e+00 5.15391e+01 37.596  5.34883e+01 217.596 0.9179 
1 1 1 5   54  0  o 8  7.77628e+00 5.41553e-01 1.57492e+02 343.671 3.13854e+00  -9.19497e-01 0.00000e+00 0.00000e+00 8.39788e+01 343.671 7.35136e+01 163.671 0.8282 
1 1 1 5   54  1  o 2  1.09947e+01 5.34835e-01 1.72498e+02 52.202  3.03592e+00  3.91423e+00  0.00000e+00 0.00000e+00 1.95421e+02 52.202  2.29230e+01 52.202  0.8923 
1 1 1 5   54  2  o 14 2.05250e+01 4.92022e-01 4.70477e+02 251.022 -8.62588e+00 -2.50834e+01 0.00000e+00 0.00000e+00 2.84689e+02 251.022 1.85788e+02 71.023  0.9810 
1 1 1 5   54  3  o 9  1.19043e+01 6.16694e-01 3.46008e+02 40.488  8.97367e+00  7.66102e+00  0.00000e+00 0.00000e+00 8.11397e+01 40.488  2.64869e+02 220.488 0.9566 
1 1 1 5   54  4  o 3  2.65969e+01 7.27593e-01 3.44099e+02 143.637 -2.25592e+01 1.66099e+01  0.00000e+00 0.00000e+00 6.35522e+02 143.637 2.91423e+02 143.637 0.9820 
1 1 1 5   54  5  f 0  2.56623e+01 5.85397e-01 4.20683e+02 196.885 -3.55957e+01 -1.08044e+01 0.00000e+00 0.00000e+00 5.28759e+02 196.885 1.08076e+02 196.885 0.9865 
1 1 1 5   54  6  o 3  2.48985e+01 6.97536e-01 6.32639e+02 67.730  2.58551e+01  6.31346e+01  0.00000e+00 0.00000e+00 2.94186e+02 67.730  3.38453e+02 247.730 0.9926 
1 1 1 5   54  7  o 15 1.09013e+01 8.58158e-01 2.61832e+02 252.283 -4.97000e+00 -1.55574e+01 0.00000e+00 0.00000e+00 1.34169e+02 252.283 1.27663e+02 72.283  0.9689 
1 1 1 5   54  8  o 7  1.06192e+01 8.22125e-01 2.18539e+02 114.798 -6.38269e+00 1.38145e+01  0.00000e+00 0.00000e+00 1.66191e+02 114.798 5.23476e+01 294.798 0.9666 
1 1 1 5   54  9  o 6  1.34554e+01 9.37787e-01 2.01582e+02 275.967 2.06257e+00  -1.97342e+01 0.00000e+00 0.00000e+00 2.89733e+02 275.967 8.81515e+01 275.967 0.9745 
1 1 1 5   54  10 o 12 8.80433e+00 1.14996e+00 1.40353e+02 86.642  5.98228e-01  1.01954e+01  0.00000e+00 0.00000e+00 1.72843e+02 86.642  3.24898e+01 86.642  0.9497 
1 1 1 5   54  11 o 16 1.20376e+01 9.14566e-01 1.71912e+02 322.752 1.78913e+01  -1.36038e+01 0.00000e+00 0.00000e+00 2.68639e+02 322.752 9.67275e+01 322.752 0.9775 
1 1 1 5   54  12 o 7  6.48404e+00 1.29648e+00 1.18783e+02 42.195  6.13566e+00  5.56250e+00  0.00000e+00 0.00000e+00 1.08702e+02 42.195  1.00802e+01 222.195 0.9375 
1 1 1 5   54  13 o 8  7.91899e+00 1.41775e+00 1.11079e+02 261.194 -1.45527e+00 -9.39363e+00 0.00000e+00 0.00000e+00 1.69055e+02 261.194 5.79759e+01 261.194 0.9458 
1 1 1 5   54  14 o 1  4.49017e+00 1.36753e+00 6.81026e+01 116.074 -1.66357e+00 3.39968e+00  0.00000e+00 0.00000e+00 7.53438e+01 116.074 7.24125e+00 116.074 0.8547 
1 1 1 5   54  15 o 17 6.61646e+00 1.71391e+00 7.47094e+01 40.354  3.85666e+00  3.27692e+00  0.00000e+00 0.00000e+00 1.46422e+02 40.354  7.17131e+01 40.354  0.8948 
1 1 1 5   54  16 o 8  4.36505e+00 1.35486e+00 1.21674e+02 357.726 7.80608e+00  -3.09908e-01 0.00000e+00 0.00000e+00 3.04312e+01 357.726 9.12426e+01 177.726 0.9336 
1 1 1 5   55  0  o 10 1.84650e+01 4.42203e-01 4.51700e+02 192.346 -2.24819e+01 -4.92091e+00 0.00000e+00 0.00000e+00 2.25348e+02 192.346 2.26352e+02 12.346  0.9780 
1 1 1 5   55  1  o 4  4.81779e+00 6.42133e-01 2.64528e+01 91.614  -9.77605e-03 3.46916e-01  0.00000e+00 0.00000e+00 4.43245e+00 91.614  2.20203e+01 271.614 0.1710 
1 1 1 5   55  2  o 2  2.53720e+01 5.28846e-01 6.22191e+02 280.316 8.55968e+00  -4.70253e+01 0.00000e+00 0.00000e+00 3.19274e+02 280.316 3.02918e+02 100.316 0.9895 
1 1 1 5   55  3  o 6  1.49767e+01 5.01898e-01 2.39196e+02 77.900  2.42778e+00  1.13241e+01  0.00000e+00 0.00000e+00 2.97647e+02 77.900  5.84518e+01 77.900  0.9558 
1 1 1 5   55  4  o 12 2.15454e+01 6.28757e-01 4.05054e+02 96.176  -3.08168e+00 2.84801e+01  0.00000e+00 0.00000e+00 3.88717e+02 96.176  1.63368e+01 276.176 0.9824 
1 1 1 5   55  5  o 6  9.34089e+00 6.62936e-01 2.62647e+02 247.494 -3.63775e+00 -8.77980e+00 0.00000e+00 0.00000e+00 6.86561e+01 247.494 1.93991e+02 67.494  0.9458 
1 1 1 5   55  6  o 1  8.74818e+00 8.71501e-01 1.45751e+02 101.339 -1.16945e+00 5.83173e+00  0.00000e+00 0.00000e+00 1.53242e+02 101.339 7.49079e+00 101.339 0.9115 
1 1 1 5   55  7  o 9  1.64432e+01 7.59524e-01 3.62271e+02 39.496  2.56508e+01  2.11416e+01  0.00000e+00 0.00000e+00 2.44794e+02 39.496  1.17477e+02 219.496 0.9848 
1 1 1 5   55  8  o 16 3.75597e+00 1.12288e+00 4.08846e+01 250.117 -3.45419e-01 -9.55100e-01 0.00000e+00 0.00000e+00 2.27275e+01 250.117 1.81572e+01 70.117  0.4519 
1 1 1 5   55  9  o 9  2.12157e+01 8.76400e-01 3.51703e+02 12.223  5.86819e+01  1.27121e+01  0.00000e+00 0.00000e+00 4.36508e+02 12.223  8.48048e+01 12.223  0.9916 
1 1 1 5   55  10 o 19 1.18717e+01 8.38455e-01 1.61015e+02 308.392 1.19700e+01  -1.51069e+01 0.00000e+00 0.00000e+00 2.71904e+02 308.392 1.10889e+02 308.392 0.9737 
1 1 1 5   55  11 o 12 4.77296e+00 1.21385e+00 1.61429e+02 77.226  1.70972e+00  7.54120e+00  0.00000e+00 0.00000e+00 5.25665e+00 77.226  1.56173e+02 257.226 0.9329 
1 1 1 5   55  12 o 1  7.56493e+00 1.17663e+00 1.35404e+02 146.279 -9.32730e+00 6.22555e+00  0.00000e+00 0.00000e+00 1.34716e+02 146.279 6.87966e-01 326.279 0.9543 
1 1 1 5   55  13 o 13 4.67935e+00 1.35291e+00 7.64750e+01 98.729  -6.10929e-01 3.97877e+00  0.00000e+00 0.00000e+00 7.47979e+01 98.729  1.67710e+00 278.729 0.8645 
1 1 1 5   55  14 o 13 9.27248e+00 1.55975e+00 1.29033e+02 183.871 -1.25989e+01 -8.52516e-01 0.00000e+00 0.00000e+00 2.03479e+02 183.871 7.44455e+01 183.871 0.9595 
1 1 1 5   55  15 o 19 5.87756e+00 1.53205e+00 7.80760e+01 353.892 5.32581e+00  -5.69909e-01 0.00000e+00 0.00000e+00 1.19706e+02 353.892 4.16298e+01 353.892 0.9010 
1 1 1 5   55  16 o 15 6.83364e+00 1.79378e+00 1.27972e+02 346.063 9.07378e+00  -2.25172e+00 0.00000e+00 0.00000e+00 1.12997e+02 346.063 1.49749e+01 166.063 0.9449 
1 1 1 5   56  0  o 18 2.23582e+01 4.71170e-01 4.55313e+02 175.393 -2.85420e+01 2.29982e+00  0.00000e+00 0.00000e+00 3.68009e+02 175.393 8.73040e+01 355.393 0.9824 
1 1 1 5   56  1  o 7  9.20235e+00 4.76488e-01 1.69560e+02 233.869 -2.79435e+00 -3.82772e+00 0.00000e+00 0.00000e+00 1.36447e+02 233.869 3.31125e+01 53.869  0.8870 
1 1 1 5   56  2  o 9  2.25579e+01 5.10896e-01 4.49779e+02 272.691 1.36992e+00  -2.91412e+01 0.00000e+00 0.00000e+00 3.81409e+02 272.691 6.83705e+01 92.691  0.9827 
1 1 1 5   56  3  o 1  3.11957e+01 6.04558e-01 5.87723e+02 257.417 -1.23538e+01 -5.53458e+01 0.00000e+00 0.00000e+00 5.71662e+02 257.417 1.60613e+01 77.417  0.9911 
1 1 1 5   56  4  o 6  4.36230e+01 8.18918e-01 5.82992e+02 27.169  7.85625e+01  4.03217e+01  0.00000e+00 0.00000e+00 1.04343e+03 27.169  4.60440e+02 27.169  0.9943 
1 1 1 5   56  5  o 7  7.43356e+00 7.80976e-01 9.64374e+01 243.795 -1.32379e+00 -2.68971e+00 0.00000e+00 0.00000e+00 1.29271e+02 243.795 3.28333e+01 243.795 0.8098 
1 1 1 5   56  6  o 11 1.13485e+01 7.96553e-01 2.05568e+02 64.289  4.65401e+00  9.66542e+00  0.00000e+00 0.00000e+00 1.99530e+02 64.289  6.03811e+00 244.289 0.9522 
1 1 1 5   56  7  o 4  1.48503e+01 7.10346e-01 2.40263e+02 273.730 1.31187e+00  -2.01244e+01 0.00000e+00 0.00000e+00 3.02367e+02 273.730 6.21047e+01 273.730 0.9749 
1 1 1 5   56  8  o 7  1.48547e+01 8.60116e-01 2.51170e+02 47.445  1.78995e+01  1.94966e+01  0.00000e+00 0.00000e+00 2.94844e+02 47.445  4.36749e+01 47.445  0.9809 
1 1 1 5   56  9  o 4  1.38965e+01 9.33431e-01 1.71930e+02 306.326 1.18999e+01  -1.61843e+01 0.00000e+00 0.00000e+00 3.35502e+02 306.326 1.63572e+02 306.326 0.9748 
1 1 1 5   56  10 o 11 3.09714e+00 9.70929e-01 9.77008e+01 246.815 -1.12915e+00 -2.63635e+00 0.00000e+00 0.00000e+00 4.95250e+00 66.815  1.02653e+02 66.815  0.7997 
1 1 1 5   56  11 o 14 1.54894e+01 8.50111e-01 2.89184e+02 199.924 -5.12169e+01 -1.85643e+01 0.00000e+00 0.00000e+00 2.85227e+02 199.924 3.95717e+00 19.924  0.9908 
1 1 1 5   56  12 o 12 7.84078e+00 1.25904e+00 1.80289e+02 39.161  1.18362e+01  9.64004e+00  0.00000e+00 0.00000e+00 1.03262e+02 39.161  7.70270e+01 219.161 0.9667 
1 1 1 5   56  13 o 15 4.73638e+00 1.35001e+00 6.50212e+01 41.787  2.66992e+00  2.38606e+00  0.00000e+00 0.00000e+00 8.46577e+01 41.787  1.96365e+01 41.787  0.8452 
1 1 1 5   56  14 o 17 3.38452e+00 1.07323e+00 1.02212e+02 271.929 1.76603e-01  -5.24273e+00 0.00000e+00 0.00000e+00 1.14544e+01 271.929 9.07573e+01 91.929  0.8988 
1 1 1 5   56  15 o 2  5.49755e+00 1.42899e+00 7.51034e+01 296.056 2.28990e+00  -4.68338e+00 0.00000e+00 0.00000e+00 1.09261e+02 296.056 3.41572e+01 296.056 0.8981 
1 1 1 5   56  16 o 15 8.65526e+00 1.84653e+00 8.97408e+01 104.798 -2.02053e+00 7.64843e+00  0.00000e+00 0.00000e+00 2.12049e+02 104.798 1.22308e+02 104.798 0.9345 
1 1 1 5   57  0  o 14 1.74070e+01 4.41678e-01 2.94259e+02 349.962 1.52877e+01  -2.70613e+00 0.00000e+00 0.00000e+00 3.36761e+02 349.962 4.25018e+01 349.962 0.9672 
1 1 1 5   57  1  o 10 3.72467e+01 6.38119e-01 7.19698e+02 132.731 -5.18924e+01 5.61734e+01  0.00000e+00 0.00000e+00 6.67344e+02 132.731 5.23537e+01 312.731 0.9934 
1 1 1 5   57  2  o 2  2.69606e+01 5.30078e-01 4.80775e+02 312.825 2.83578e+01  -3.05967e+01 0.00000e+00 0.00000e+00 5.17773e+02 312.825 3.69985e+01 312.825 0.9879 
1 1 1 5   57  3  o 2  3.11484e+01 6.07952e-01 3.47849e+02 142.461 -2.73055e+01 2.09818e+01  0.00000e+00 0.00000e+00 8.02859e+02 142.461 4.55010e+02 142.461 0.9854 
1 1 1 5   57  4  o 12 3.35905e+01 6.53048e-01 5.78960e+02 60.607  3.26640e+01  5.79864e+01  0.00000e+00 0.00000e+00 6.70875e+02 60.607  9.19149e+01 60.607  0.9925 
1 1 1 5   57  5  o 3  2.77792e+01 6.71598e-01 4.63021e+02 308.525 3.48470e+01  -4.37699e+01 0.00000e+00 0.00000e+00 5.69014e+02 308.525 1.05992e+02 308.525 0.9910 
1 1 1 5   57  6  o 11 1.20345e+01 8.85122e-01 2.31120e+02 278.672 2.03286e+00  -1.33276e+01 0.00000e+00 0.00000e+00 2.02903e+02 278.672 2.82169e+01 98.672  0.9622 
1 1 1 5   57  7  o 1  3.64744e+00 9.70966e-01 1.40652e+02 290.318 1.04093e+00  -2.81133e+00 0.00000e+00 0.00000e+00 2.99571e+01 110.318 1.70609e+02 110.318 0.8098 
1 1 1 5   57  8  o 17 4.68110e+00 1.15102e+00 1.17198e+02 176.471 -3.53407e+00 2.17928e-01  0.00000e+00 0.00000e+00 3.06848e+01 176.471 8.65134e+01 356.471 0.8432 
1 1 1 5   57  9  o 8  1.64514e+01 8.96541e-01 3.43583e+02 329.410 4.12226e+01  -2.43690e+01 0.00000e+00 0.00000e+00 2.66120e+02 329.410 7.74639e+01 149.410 0.9895 
1 1 1 5   57  10 o 5  6.13265e+00 1.04407e+00 1.10997e+02 111.635 -2.40982e+00 6.07565e+00  0.00000e+00 0.00000e+00 1.00231e+02 111.635 1.07662e+01 291.635 0.9200 
1 1 1 5   57  11 o 1  4.94843e+00 1.21979e+00 9.89736e+01 203.241 -4.43981e+00 -1.90668e+00 0.00000e+00 0.00000e+00 6.57195e+01 203.241 3.32541e+01 23.241  0.8893 
1 1 1 5   57  12 o 19 8.69710e+00 1.22616e+00 1.15116e+02 36.357  9.25508e+00  6.81280e+00  0.00000e+00 0.00000e+00 1.95703e+02 36.357  8.05873e+01 36.357  0.9554 
1 1 1 5   57  13 o 19 1.05717e+01 1.32916e+00 2.40881e+02 237.558 -1.52436e+01 -2.39809e+01 0.00000e+00 0.00000e+00 1.47311e+02 237.558 9.35691e+01 57.558  0.9822 
1 1 1 5   57  14 o 19 8.30349e+00 1.32207e+00 1.20976e+02 343.301 1.28988e+01  -3.86960e+00 0.00000e+00 0.00000e+00 1.77495e+02 343.301 5.65189e+01 343.301 0.9621 
1 1 1 5   57  15 o 10 5.35055e+00 1.43422e+00 8.57156e+01 86.132  3.97748e-01  5.88317e+00  0.00000e+00 0.00000e+00 9.62115e+01 86.132  1.04959e+01 86.132  0.9107 
1 1 1 5   57  16 o 9  4.69363e+00 1.44550e+00 5.51367e+01 23.111  3.25498e+00  1.38913e+00  0.00000e+00 0.00000e+00 9.24971e+01 23.111  3.73604e+01 23.111  0.8431 
1 1 1 5   58  0  o 11 1.69805e+01 4.46756e-01 2.07615e+02 131.243 -7.53706e+00 8.59641e+00  0.00000e+00 0.00000e+00 4.00193e+02 131.243 1.92578e+02 131.243 0.9552 
1 1 1 5   58  1  o 1  4.56310e+01 7.45128e-01 8.29000e+02 91.494  -3.12169e+00 1.19709e+02  0.00000e+00 0.00000e+00 8.74065e+02 91.494  4.50655e+01 91.494  0.9958 
1 1 1 5   58  2  o 5  1.68314e+01 4.67297e-01 3.53319e+02 155.593 -1.74326e+01 7.91044e+00  0.00000e+00 0.00000e+00 2.60876e+02 155.593 9.24432e+01 335.593 0.9735 
1 1 1 5   58  3  f 0  2.96792e+01 5.70047e-01 2.86780e+02 317.502 2.23055e+01  -2.04380e+01 0.00000e+00 0.00000e+00 8.07209e+02 317.502 5.20429e+02 317.502 0.9833 
1 1 1 5   58  4  f 0  6.98408e+00 7.52259e-01 2.25202e+02 224.755 -4.70942e+00 -4.66939e+00 0.00000e+00 0.00000e+00 1.59594e+01 224.755 2.09242e+02 44.755  0.9212 
1 1 1 5   58  5  o 19 1.04977e+01 7.41272e-01 1.74750e+02 338.143 7.65870e+00  -3.07213e+00 0.00000e+00 0.00000e+00 1.94051e+02 338.143 1.93009e+01 338.143 0.9373 
1 1 1 5   58  6  o 4  1.07950e+01 8.40582e-01 1.34357e+02 337.836 7.70307e+00  -3.13791e+00 0.00000e+00 0.00000e+00 2.45046e+02 337.836 1.10689e+02 337.836 0.9378 
1 1 1 5   58  7  o 17 3.96526e+00 1.06018e+00 7.90427e+01 202.619 -1.80133e+00 -7.50525e-01 0.00000e+00 0.00000e+00 2.34211e+01 202.619 5.56216e+01 22.619  0.6896 
1 1 1 5   58  8  o 11 2.03965e+01 7.75726e-01 3.64696e+02 315.654 4.28440e+01  -4.18772e+01 0.00000e+00 0.00000e+00 3.92955e+02 315.654 2.82591e+01 315.654 0.9916 
1 1 1 5   58  9  o 12 8.94203e+00 8.75780e-01 1.76519e+02 214.049 -1.11217e+01 -7.51563e+00 0.00000e+00 0.00000e+00 1.45618e+02 214.049 3.09010e+01 34.049  0.9620 
1 1 1 5   58  10 o 5  1.03962e+01 9.13547e-01 2.39466e+02 245.603 -1.05317e+01 -2.32208e+01 0.00000e+00 0.00000e+00 1.41994e+02 245.603 9.74717e+01 65.603  0.9802 
1 1 1 5   58  11 o 4  1.46445e+01 8.85091e-01 2.73447e+02 53.404  2.94790e+01  3.96994e+01  0.00000e+00 0.00000e+00 2.68945e+02 53.404  4.50240e+00 233.404 0.9898 
1 1 1 5   58  12 o 17 1.55640e+01 9.71079e-01 2.78637e+02 278.229 7.80361e+00  -5.39632e+01 0.00000e+00 0.00000e+00 2.98075e+02 278.229 1.94374e+01 278.229 0.9908 
1 1 1 5   58  13 o 12 3.86214e+00 1.15753e+00 4.13426e+01 43.417  1.56466e+00  1.48051e+00  0.00000e+00 0.00000e+00 6.28149e+01 43.417  2.14723e+01 43.417  0.7215 
1 1 1 5   58  14 o 1  9.66090e+00 1.30961e+00 1.44475e+02 63.212  8.26168e+00  1.63642e+01  0.00000e+00 0.00000e+00 2.06417e+02 63.212  6.19427e+01 63.212  0.9723 
1 1 1 5   58  15 o 2  6.30914e+00 1.63133e+00 6.77307e+01 272.203 1.89393e-01  -4.92363e+00 0.00000e+00 0.00000e+00 1.42269e+02 272.203 7.45383e+01 272.203 0.8917 
1 1 1 5   59  0  o 15 2.70253e+01 5.21526e-01 4.30172e+02 193.017 -3.52085e+01 -8.13978e+00 0.00000e+00 0.00000e+00 5.68274e+02 193.017 1.38102e+02 193.017 0.9861 
1 1 1 5   59  1  o 3  4.72426e+01 7.66305e-01 7.22201e+02 11.997  1.05068e+02  2.23264e+01  0.00000e+00 0.00000e+00 1.03987e+03 11.997  3.17674e+02 11.997  0.9953 
1 1 1 5   59  2  f 0  1.36543e+01 5.53833e-01 2.97219e+02 296.308 5.92300e+00  -1.19802e+01 0.00000e+00 0.00000e+00 1.94976e+02 296.308 1.02243e+02 116.308 0.9618 
1 1 1 5   59  3  o 16 1.31135e+01 5.67496e-01 1.12909e+02 104.632 -1.28896e+00 4.93689e+00  0.00000e+00 0.00000e+00 3.27314e+02 104.632 2.14404e+02 104.632 0.8957 
1 1 1 5   59  4  f 0  1.52945e+01 5.18993e-01 4.19861e+02 310.992 1.80559e+01  -2.07770e+01 0.00000e+00 0.00000e+00 1.42849e+02 310.992 2.77012e+02 130.992 0.9817 
1 1 1 5   59  5  o 19 1.38969e+01 6.55803e-01 2.06394e+02 241.445 -6.42489e+00 -1.18062e+01 0.00000e+00 0.00000e+00 2.94641e+02 241.445 8.82469e+01 241.445 0.9621 
1 1 1 5   59  6  o 5  7.34670e+00 1.03056e+00 1.27086e+02 143.697 -3.99039e+00 2.93152e+00  0.00000e+00 0.00000e+00 1.18538e+02 143.697 8.54831e+00 323.697 0.8922 
1 1 1 5   59  7  o 7  4.90137e+00 1.15958e+00 1.34555e+02 62.777  1.88181e+00  3.65791e+00  0.00000e+00 0.00000e+00 2.47845e+01 62.777  1.09770e+02 242.776 0.8678 
1 1 1 5   59  8  o 12 9.63575e+00 9.95005e-01 1.86777e+02 302.558 6.97610e+00  -1.09257e+01 0.00000e+00 0.00000e+00 1.59908e+02 302.558 2.68696e+01 122.558 0.9606 
1 1 1 5   59  9  o 16 7.34182e+00 9.84431e-01 9.62272e+01 218.563 -4.83457e+00 -3.85426e+00 0.00000e+00 0.00000e+00 1.55331e+02 218.563 5.91035e+01 218.563 0.9151 
1 1 1 5   59  10 o 14 6.97053e+00 1.09120e+00 1.31357e+02 141.249 -6.46345e+00 5.18763e+00  0.00000e+00 0.00000e+00 1.13249e+02 141.249 1.81082e+01 321.249 0.9376 
1 1 1 5   59  11 o 13 7.31054e+00 1.21209e+00 1.40528e+02 44.081  7.58901e+00  7.34939e+00  0.00000e+00 0.00000e+00 1.19685e+02 44.081  2.08423e+01 224.081 0.9514 
1 1 1 5   59  12 o 18 3.54482e+00 1.04780e+00 5.92672e+01 120.542 -1.44907e+00 2.45592e+00  0.00000e+00 0.00000e+00 4.65589e+01 120.542 1.27082e+01 300.542 0.7984 
1 1 1 5   59  13 o 9  5.19051e+00 1.29969e+00 8.05531e+01 62.985  2.39254e+00  4.69249e+00  0.00000e+00 0.00000e+00 9.38785e+01 62.985  1.33254e+01 62.985  0.8992 
1 1 1 5   59  14 o 14 6.05464e+00 1.34408e+00 1.54561e+02 212.201 -9.62446e+00 -6.06104e+00 0.00000e+00 0.00000e+00 6.13881e+01 212.201 9.31733e+01 32.201  0.9550 
1 1 1 5   59  15 o 1  3.83868e+00 1.24665e+00 1.46018e+01 123.278 -4.62286e-01 7.04361e-01  0.00000e+00 0.00000e+00 4.09617e+01 123.278 2.63600e+01 123.278 0.3878 
1 1 1 5   60  0  o 10 1.89700e+01 5.06253e-01 3.48030e+02 334.138 1.89956e+01  -9.20802e+00 0.00000e+00 0.00000e+00 3.45562e+02 334.138 2.46765e+00 154.138 0.9760 
1 1 1 5   60  1  o 9  2.17492e+01 4.82199e-01 2.70319e+02 62.853  8.87127e+00  1.73010e+01  0.00000e+00 0.00000e+00 5.23324e+02 62.853  2.53005e+02 62.853  0.9739 
1 1 1 5   60  2  o 16 2.34431e+01 5.12746e-01 3.97921e+02 192.302 -3.16079e+01 -6.89254e+00 0.00000e+00 0.00000e+00 4.66837e+02 192.302 6.89163e+01 192.302 0.9844 
1 1 1 5   60  3  o 3  1.29798e+01 4.97847e-01 2.50387e+02 125.112 -8.08636e+00 1.15006e+01  0.00000e+00 0.00000e+00 2.18378e+02 125.112 3.20086e+01 305.112 0.9638 
1 1 1 5   60  4  o 2  2.14141e+01 5.91512e-01 3.88424e+02 236.057 -2.13267e+01 -3.16865e+01 0.00000e+00 0.00000e+00 4.03444e+02 236.057 1.50193e+01 236.057 0.9868 
1 1 1 5   60  5  o 6  6.55713e+00 8.73219e-01 1.37993e+02 329.024 3.77066e+00  -2.26351e+00 0.00000e+00 0.00000e+00 7.75434e+01 329.024 6.04494e+01 149.024 0.8773 
1 1 1 5   60  6  o 10 2.39423e+01 7.48807e-01 4.38367e+02 241.380 -3.00914e+01 -5.51457e+01 0.00000e+00 0.00000e+00 4.51460e+02 241.380 1.30930e+01 241.380 0.9920 
1 1 1 5   60  7  o 6  7.20669e+00 1.07199e+00 1.64380e+02 223.667 -5.76951e+00 -5.50708e+00 0.00000e+00 0.00000e+00 8.80270e+01 223.667 7.63530e+01 43.667  0.9350 
1 1 1 5   60  8  o 6  6.23557e+00 1.17345e+00 1.68608e+02 174.291 -7.80638e+00 7.80460e-01  0.00000e+00 0.00000e+00 4.94673e+01 174.291 1.19141e+02 354.291 0.9339 
1 1 1 5   60  9  o 18 1.14798e+01 7.98744e-01 2.61985e+02 52.880  1.67826e+01  2.21746e+01  0.00000e+00 0.00000e+00 1.59973e+02 52.880  1.02012e+02 232.880 0.9819 
1 1 1 5   60  10 o 9  9.88961e+00 8.06069e-01 2.09939e+02 207.608 -2.07656e+01 -1.08599e+01 0.00000e+00 0.00000e+00 1.52164e+02 207.608 5.77741e+01 27.609  0.9784 
1 1 1 5   60  11 o 17 9.97583e+00 9.31006e-01 1.65911e+02 16.268  1.97481e+01  5.76293e+00  0.00000e+00 0.00000e+00 1.98053e+02 16.268  3.21421e+01 16.268  0.9754 
1 1 1 5   60  12 o 8  4.26625e+00 1.10993e+00 9.11078e+01 330.152 4.35665e+00  -2.49997e+00 0.00000e+00 0.00000e+00 5.14719e+01 330.152 3.96359e+01 150.152 0.8939 
1 1 1 5   60  13 f 0  1.03868e+01 1.13648e+00 1.20412e+02 9.928   1.62255e+01  2.84003e+00  0.00000e+00 0.00000e+00 2.55724e+02 9.928   1.35311e+02 9.928   0.9692 
1 1 1 5   60  14 o 1  7.13948e+00 1.51119e+00 1.71649e+02 228.032 -9.45534e+00 -1.05129e+01 0.00000e+00 0.00000e+00 8.53477e+01 228.032 8.63017e+01 48.032  0.9640 
1 1 1 5   60  15 o 4  4.71407e+00 1.44534e+00 7.83198e+01 325.335 4.16597e+00  -2.88087e+00 0.00000e+00 0.00000e+00 7.91003e+01 325.335 7.80434e-01 325.335 0.8949 
1 1 1 5   61  0  o 7  2.54305e+01 5.50928e-01 3.39332e+02 120.471 -1.55590e+01 2.64448e+01  0.00000e+00 0.00000e+00 5.97503e+02 120.471 2.58171e+02 120.471 0.9836 
1 1 1 5   61  1  o 15 3.13360e+01 5.77520e-01 4.99175e+02 295.041 2.28458e+01  -4.89015e+01 0.00000e+00 0.00000e+00 6.63776e+02 295.041 1.64601e+02 295.041 0.9907 
1 1 1 5   61  2  o 12 4.91259e+01 8.01606e-01 8.50388e+02 201.537 -1.48465e+02 -5.85931e+01 0.00000e+00 0.00000e+00 9.84342e+02 201.537 1.33955e+02 201.537 0.9969 
1 1 1 5   61  3  o 2  2.63438e+01 5.39435e-01 4.68008e+02 339.578 4.94374e+01  -1.84067e+01 0.00000e+00 0.00000e+00 5.09611e+02 339.578 4.16034e+01 339.578 0.9905 
1 1 1 5   61  4  o 17 1.46910e+01 5.73922e-01 1.43557e+02 211.278 -8.72473e+00 -5.30020e+00 0.00000e+00 0.00000e+00 3.79166e+02 211.278 2.35609e+02 211.278 0.9497 
1 1 1 5   61  5  o 18 4.73015e+00 9.14713e-01 1.01145e+02 216.391 -2.17890e+00 -1.60590e+00 0.00000e+00 0.00000e+00 3.80936e+01 216.391 6.30517e+01 36.391  0.7857 
1 1 1 5   61  6  o 2  2.89723e+01 7.54157e-01 5.80836e+02 2.956   1.02195e+02  5.27781e+00  0.00000e+00 0.00000e+00 4.99111e+02 2.956   8.17249e+01 182.956 0.9951 
1 1 1 5   61  7  o 12 1.70264e+01 7.33992e-01 1.76458e+02 195.459 -2.06694e+01 -5.71636e+00 0.00000e+00 0.00000e+00 4.46155e+02 195.459 2.69697e+02 195.459 0.9764 
1 1 1 5   61  8  o 13 1.35900e+01 6.07862e-01 2.30302e+02 102.778 -6.31077e+00 2.78253e+01  0.00000e+00 0.00000e+00 2.69533e+02 102.778 3.92312e+01 102.778 0.9823 
1 1 1 5   61  9  o 17 1.89574e+01 6.26500e-01 3.18905e+02 194.012 -6.16681e+01 -1.53889e+01 0.00000e+00 0.00000e+00 3.85064e+02 194.012 6.61592e+01 194.012 0.9921 
1 1 1 5   61  10 o 2  1.37391e+01 7.10967e-01 3.05668e+02 125.919 -3.02031e+01 4.16941e+01  0.00000e+00 0.00000e+00 2.03372e+02 125.919 1.02295e+02 305.919 0.9902 
1 1 1 5   61  11 o 7  5.42937e+00 1.04968e+00 1.07918e+02 213.273 -5.95529e+00 -3.90786e+00 0.00000e+00 0.00000e+00 8.02887e+01 213.273 2.76295e+01 33.273  0.9269 
1 1 1 5   61  12 o 19 3.18646e+00 9.98354e-01 6.03496e+01 172.228 -2.58898e+00 3.53372e-01  0.00000e+00 0.00000e+00 3.21698e+01 172.228 2.81799e+01 352.228 0.7767 
1 1 1 5   61  13 o 12 9.05879e+00 1.26337e+00 1.32256e+02 174.796 -1.55034e+01 1.41195e+00  0.00000e+00 0.00000e+00 1.95119e+02 174.796 6.28632e+01 174.796 0.9673 
1 1 1 5   61  14 o 7  9.83825e+00 1.37296e+00 2.02048e+02 31.359  2.22595e+01  1.35652e+01  0.00000e+00 0.00000e+00 1.58159e+02 31.359  4.38891e+01 211.359 0.9806 
1 1 1 5   61  15 o 8  7.18164e+00 1.64524e+00 1.07467e+02 159.768 -8.32244e+00 3.06740e+00  0.00000e+00 0.00000e+00 1.44895e+02 159.768 3.74276e+01 159.768 0.9418 
1 1 1 5   62  0  o 8  2.06562e+01 4.73667e-01 4.16856e+02 37.309  2.37202e+01  1.80756e+01  0.00000e+00 0.00000e+00 3.43600e+02 37.309  7.32562e+01 217.309 0.9831 
1 1 1 5   62  1  o 3  2.45281e+01 5.09211e-01 3.99903e+02 256.168 -9.20710e+00 -3.73949e+01 0.00000e+00 0.00000e+00 5.06783e+02 256.168 1.06879e+02 256.168 0.9869 
1 1 1 5   62  2  o 7  1.78670e+01 4.79788e-01 2.68872e+02 41.691  1.54820e+01  1.37895e+01  0.00000e+00 0.00000e+00 3.84059e+02 41.691  1.15187e+02 41.691  0.9756 
1 1 1 5   62  3  o 4  5.97577e+00 6.99173e-01 1.63484e+02 249.277 -1.56820e+00 -4.14510e+00 0.00000e+00 0.00000e+00 3.31271e+01 249.277 1.30357e+02 69.277  0.8783 
1 1 1 5   62  4  o 12 2.40566e+01 6.10819e-01 3.57544e+02 58.777  2.09259e+01  3.45215e+01  0.00000e+00 0.00000e+00 5.32385e+02 58.777  1.74841e+02 58.777  0.9875 
1 1 1 5   62  5  o 14 1.49967e+01 6.04507e-01 1.93353e+02 300.590 8.40818e+00  -1.42232e+01 0.00000e+00 0.00000e+00 3.51109e+02 300.590 1.57757e+02 300.590 0.9692 
1 1 1 5   62  6  o 3  1.60250e+01 6.86954e-01 3.25250e+02 133.278 -2.40202e+01 2.55092e+01  0.00000e+00 0.00000e+00 2.66296e+02 133.278 5.89533e+01 313.278 0.9856 
1 1 1 5   62  7  o 19 1.88450e+01 7.17044e-01 2.22356e+02 171.083 -3.38049e+01 5.30401e+00  0.00000e+00 0.00000e+00 4.72908e+02 171.083 2.50551e+02 171.083 0.9853 
1 1 1 5   62  8  o 4  6.18896e+00 8.93968e-01 1.87067e+02 20.259  9.19591e+00  3.39422e+00  0.00000e+00 0.00000e+00 3.24633e+01 20.259  1.54603e+02 200.259 0.9475 
1 1 1 5   62  9  o 15 8.68239e+00 7.81242e-01 1.36003e+02 119.876 -6.18373e+00 1.07641e+01  0.00000e+00 0.00000e+00 1.75547e+02 119.876 3.95438e+01 119.876 0.9588 
1 1 1 5   62  10 o 12 6.82987e+00 9.45631e-01 1.16607e+02 40.132  7.12190e+00  6.00394e+00  0.00000e+00 0.00000e+00 1.24763e+02 40.132  8.15599e+00 40.132  0.9447 
1 1 1 5   62  11 o 1  6.38928e+00 1.07319e+00 7.28578e+01 57.575  2.95613e+00  4.65368e+00  0.00000e+00 0.00000e+00 1.43135e+02 57.575  7.02776e+01 57.575  0.9041 
1 1 1 5   62  12 o 3  2.55362e+00 8.47844e-01 5.55802e+01 307.531 1.26881e+00  -1.65170e+00 0.00000e+00 0.00000e+00 1.22687e+01 307.531 4.33114e+01 127.531 0.7109 
1 1 1 5   62  13 o 14 8.60068e+00 1.30188e+00 1.21173e+02 5.854   1.33626e+01  1.36998e+00  0.00000e+00 0.00000e+00 1.87890e+02 5.854   6.67171e+01 5.854   0.9620 
1 1 1 5   62  14 o 4  5.76334e+00 1.42604e+00 8.61682e+01 313.296 4.04452e+00  -4.29254e+00 0.00000e+00 0.00000e+00 1.09773e+02 313.296 2.36045e+01 313.296 0.9107 
1 1 1 5   62  15 o 3  4.65951e+00 1.41731e+00 6.61093e+01 167.584 -4.25236e+00 9.36173e-01  0.00000e+00 0.00000e+00 8.61365e+01 167.584 2.00272e+01 167.584 0.8759 
1 1 1 5   63  0  o 14 1.18174e+01 4.63698e-01 2.49034e+02 278.649 1.91630e+00  -1.25975e+01 0.00000e+00 0.00000e+00 1.75697e+02 278.649 7.33378e+01 98.649  0.9599 
1 1 1 5   63  1  o 19 4.37181e+00 7.72106e-01 1.55925e+02 214.119 -2.36402e+00 -1.60171e+00 0.00000e+00 0.00000e+00 2.51627e+01 34.119  1.81087e+02 34.119  0.7987 
1 1 1 5   63  2  o 9  1.51854e+01 4.67794e-01 3.59460e+02 150.596 -2.10762e+01 1.18776e+01  0.00000e+00 0.00000e+00 1.97388e+02 150.596 1.62072e+02 330.596 0.9791 
1 1 1 5   63  3  o 17 1.07738e+01 5.85307e-01 1.18853e+02 56.878  3.38121e+00  5.18245e+00  0.00000e+00 0.00000e+00 2.50446e+02 56.878  1.31593e+02 56.878  0.9152 
1 1 1 5   63  4  o 14 3.50408e+01 7.33685e-01 5.74901e+02 206.287 -9.60732e+01 -4.74550e+01 0.00000e+00 0.00000e+00 7.31369e+02 206.287 1.56468e+02 206.287 0.9953 
1 1 1 5   63  5  o 17 1.22655e+01 5.77129e-01 2.87024e+02 77.067  4.83851e+00  2.10702e+01  0.00000e+00 0.00000e+00 1.61577e+02 77.067  1.25447e+02 257.067 0.9766 
1 1 1 5   63  6  o 2  1.33413e+01 7.27028e-01 1.85914e+02 165.621 -1.74557e+01 4.47505e+00  0.00000e+00 0.00000e+00 2.99596e+02 165.621 1.13683e+02 165.621 0.9718 
1 1 1 5   63  7  o 4  4.58233e+00 1.11685e+00 6.62472e+01 16.571  2.02559e+00  6.02730e-01  0.00000e+00 0.00000e+00 5.65077e+01 16.571  9.73958e+00 196.571 0.7155 
1 1 1 5   63  8  o 8  7.03600e+00 8.20682e-01 1.60292e+02 64.961  4.34131e+00  9.29343e+00  0.00000e+00 0.00000e+00 8.98718e+01 64.961  7.04204e+01 244.961 0.9499 
1 1 1 5   63  9  o 6  6.11515e+00 9.21324e-01 1.42065e+02 180.379 -8.87523e+00 -5.86738e-02 0.00000e+00 0.00000e+00 7.34423e+01 180.379 6.86229e+01 0.379   0.9419 
1 1 1 5   63  10 o 10 4.70232e+00 1.06739e+00 1.43246e+02 251.543 -2.24644e+00 -6.73070e+00 0.00000e+00 0.00000e+00 1.97223e+01 251.543 1.23524e+02 71.543  0.9266 
1 1 1 5   63  11 o 10 1.25657e+01 7.92109e-01 1.30280e+02 39.189  1.79428e+01  1.46282e+01  0.00000e+00 0.00000e+00 3.29246e+02 39.189  1.98966e+02 39.189  0.9782 
1 1 1 5   63  12 o 18 1.47731e+01 8.25073e-01 2.11988e+02 83.240  5.69670e+00  4.80615e+01  0.00000e+00 0.00000e+00 3.34316e+02 83.240  1.22328e+02 83.240  0.9896 
1 1 1 5   63  13 o 9  7.16909e+00 1.30189e+00 8.56979e+01 327.544 6.81816e+00  -4.33631e+00 0.00000e+00 0.00000e+00 1.64883e+02 327.544 7.91853e+01 327.544 0.9359 
1 1 1 5   63  14 o 14 3.17580e+00 1.07166e+00 7.92181e+01 126.977 -2.39035e+00 3.17474e+00  0.00000e+00 0.00000e+00 2.30176e+01 126.977 5.62006e+01 306.977 0.8625 
1 1 1 5   63  15 o 3  1.01352e+01 1.59442e+00 2.20789e+02 334.626 2.48961e+01  -1.18080e+01 0.00000e+00 0.00000e+00 1.50307e+02 334.626 7.04813e+01 154.625 0.9817 
1 1 1 5   64  0  o 12 1.27982e+01 4.53729e-01 1.00003e+02 276.397 6.13064e-01  -5.46831e+00 0.00000e+00 0.00000e+00 3.33042e+02 276.397 2.33039e+02 276.397 0.9039 
1 1 1 5   64  1  o 17 3.50712e+01 6.19172e-01 6.60192e+02 326.442 8.43037e+01  -5.59218e+01 0.00000e+00 0.00000e+00 6.46427e+02 326.442 1.37644e+01 146.442 0.9950 
1 1 1 5   64  2  o 6  1.92770e+01 4.86317e-01 3.55242e+02 215.056 -2.58758e+01 -1.81559e+01 0.00000e+00 0.00000e+00 3.55089e+02 215.056 1.53818e-01 35.056  0.9841 
1 1 1 5   64  3  o 8  1.68070e+01 5.55058e-01 3.69976e+02 287.593 8.86498e+00  -2.79577e+01 0.00000e+00 0.00000e+00 2.48584e+02 287.593 1.21392e+02 107.593 0.9828 
1 1 1 5   64  4  o 15 1.86975e+01 5.73165e-01 3.89950e+02 46.113  3.01177e+01  3.13110e+01  0.00000e+00 0.00000e+00 3.02112e+02 46.113  8.78376e+01 226.113 0.9884 
1 1 1 5   64  5  o 17 8.48989e+00 7.87662e-01 2.65314e+02 74.862  3.55430e+00  1.31381e+01  0.00000e+00 0.00000e+00 4.06738e+01 74.862  2.24641e+02 254.862 0.9625 
1 1 1 5   64  6  o 5  1.76502e+01 6.85271e-01 2.08027e+02 185.027 -2.68677e+01 -2.36352e+00 0.00000e+00 0.00000e+00 4.40416e+02 185.027 2.32389e+02 185.027 0.9813 
1 1 1 5   64  7  o 4  8.30523e+00 6.87191e-01 2.08947e+02 175.719 -1.47773e+01 1.10630e+00  0.00000e+00 0.00000e+00 9.12552e+01 175.719 1.17692e+02 355.719 0.9656 
1 1 1 5   64  8  o 4  7.73628e+00 7.45215e-01 1.47676e+02 298.605 5.12665e+00  -9.40098e+00 0.00000e+00 0.00000e+00 1.27965e+02 298.605 1.97108e+01 118.605 0.9521 
1 1 1 5   64  9  o 11 8.64835e+00 7.86241e-01 9.20987e+01 93.216  -4.47945e-01 7.97109e+00  0.00000e+00 0.00000e+00 2.10443e+02 93.216  1.18344e+02 93.216  0.9351 
1 1 1 5   64  10 o 8  1.01303e+01 7.74359e-01 1.36034e+02 314.239 1.23797e+01  -1.27128e+01 0.00000e+00 0.00000e+00 2.31970e+02 314.239 9.59355e+01 314.239 0.9714 
1 1 1 5   64  11 f 0  2.80381e+00 8.87708e-01 4.98428e+01 140.101 -1.39901e+00 1.16972e+00  0.00000e+00 0.00000e+00 2.00178e+01 140.101 2.98250e+01 320.101 0.6666 
1 1 1 5   64  12 o 13 9.73466e+00 9.90187e-01 1.69502e+02 341.043 2.08085e+01  -7.14732e+00 0.00000e+00 0.00000e+00 1.85832e+02 341.043 1.63300e+01 341.043 0.9770 
1 1 1 5   64  13 o 18 5.75508e+00 1.31610e+00 8.38786e+01 54.073  3.81369e+00  5.26310e+00  0.00000e+00 0.00000e+00 1.13714e+02 54.073  2.98358e+01 54.073  0.9195 
1 1 1 5   64  14 o 11 3.47152e+00 1.12541e+00 6.81867e+01 276.622 4.21545e-01  -3.63082e+00 0.00000e+00 0.00000e+00 4.17748e+01 276.622 2.64119e+01 96.622  0.8488 
1 1 1 5   64  15 o 14 3.38704e+00 1.11900e+00 1.34289e+01 194.168 -7.61889e-01 -1.92329e-01 0.00000e+00 0.00000e+00 3.27229e+01 194.168 1.92940e+01 194.168 0.3654 
1 1 1 5   65  0  o 5  2.34429e+01 5.00233e-01 3.39901e+02 210.522 -3.17057e+01 -1.86927e+01 0.00000e+00 0.00000e+00 5.25535e+02 210.522 1.85634e+02 210.522 0.9863 
1 1 1 5   65  1  o 12 2.29854e+01 5.04832e-01 3.56649e+02 317.739 2.95869e+01  -2.68854e+01 0.00000e+00 0.00000e+00 4.92980e+02 317.739 1.36331e+02 317.739 0.9874 
1 1 1 5   65  2  o 12 8.43488e+00 5.35801e-01 7.98578e+01 105.257 -8.39863e-01 3.07916e+00  0.00000e+00 0.00000e+00 1.80109e+02 105.257 1.00251e+02 105.257 0.8232 
1 1 1 5   65  3  o 16 8.66493e+00 6.46957e-01 1.18109e+02 80.595  8.99487e-01  5.43053e+00  0.00000e+00 0.00000e+00 1.75139e+02 80.595  5.70302e+01 80.595  0.9039 
1 1 1 5   65  4  o 13 6.34313e+00 7.82983e-01 9.76140e+01 320.922 2.68577e+00  -2.18092e+00 0.00000e+00 0.00000e+00 1.01634e+02 320.922 4.02004e+00 320.922 0.8390 
1 1 1 5   65  5  o 2  7.95103e+00 8.08148e-01 1.32997e+02 110.427 -2.50851e+00 6.73540e+00  0.00000e+00 0.00000e+00 1.43111e+02 110.427 1.01135e+01 110.427 0.9276 
1 1 1 5   65  6  o 19 1.30041e+01 7.15739e-01 1.63983e+02 175.826 -1.60584e+01 1.17182e+00  0.00000e+00 0.00000e+00 3.07429e+02 175.826 1.43446e+02 175.826 0.9684 
1 1 1 5   65  7  o 6  1.16110e+01 6.09327e-01 1.57048e+02 11.159  1.62937e+01  3.21426e+00  0.00000e+00 0.00000e+00 2.64207e+02 11.159  1.07159e+02 11.159  0.9694 
1 1 1 5   65  8  o 2  9.23220e+00 6.90274e-01 1.72922e+02 340.366 1.58197e+01  -5.64364e+00 0.00000e+00 0.00000e+00 1.62062e+02 340.366 1.08605e+01 160.366 0.9698 
1 1 1 5   65  9  o 9  8.92222e+00 7.70842e-01 1.46548e+02 259.256 -2.78288e+00 -1.46661e+01 0.00000e+00 0.00000e+00 1.75799e+02 259.256 2.92506e+01 259.256 0.9659 
1 1 1 5   65  10 f 0  1.36074e+01 7.06786e-01 1.00616e+02 173.066 -1.83608e+01 2.23287e+00  0.00000e+00 0.00000e+00 3.94211e+02 173.066 2.93595e+02 173.066 0.9726 
1 1 1 5   65  11 o 3  1.18246e+01 8.68033e-01 1.90027e+02 23.639  3.06086e+01  1.33972e+01  0.00000e+00 0.00000e+00 2.45233e+02 23.639  5.52058e+01 23.639  0.9849 
1 1 1 5   65  12 o 11 6.43631e+00 1.21103e+00 1.66015e+02 354.166 1.30499e+01  -1.33335e+00 0.00000e+00 0.00000e+00 6.50568e+01 354.166 1.00958e+02 174.166 0.9611 
1 1 1 5   65  13 o 12 7.46338e+00 1.25346e+00 7.59530e+01 120.515 -3.91946e+00 6.65004e+00  0.00000e+00 0.00000e+00 1.83951e+02 120.515 1.07998e+02 120.515 0.9328 
1 1 1 5   65  14 o 16 1.03517e+01 1.38237e+00 1.55628e+02 34.273  1.77273e+01  1.20806e+01  0.00000e+00 0.00000e+00 2.21486e+02 34.273  6.58587e+01 34.273  0.9764 
1 1 1 5   65  15 o 4  9.99710e+00 1.54022e+00 1.11884e+02 297.979 6.69726e+00  -1.26067e+01 0.00000e+00 0.00000e+00 2.47554e+02 297.979 1.35670e+02 297.979 0.9643 
1 1 1 5   66  0  o 15 1.81275e+01 5.51401e-01 2.93091e+02 20.734  2.40434e+01  9.10143e+00  0.00000e+00 0.00000e+00 3.71948e+02 20.734  7.88568e+01 20.734  0.9804 
1 1 1 5   66  1  o 3  1.28118e+01 5.29848e-01 1.19423e+02 190.127 -7.13317e+00 -1.27405e+00 0.00000e+00 0.00000e+00 3.25664e+02 190.127 2.06241e+02 190.127 0.9282 
1 1 1 5   66  2  o 19 1.32294e+01 5.45920e-01 1.71370e+02 221.992 -8.53143e+00 -7.67956e+00 0.00000e+00 0.00000e+00 3.01751e+02 221.992 1.30382e+02 221.992 0.9554 
1 1 1 5   66  3  o 9  2.03715e+01 5.68250e-01 3.40288e+02 333.939 3.57013e+01  -1.74595e+01 0.00000e+00 0.00000e+00 4.12650e+02 333.939 7.23623e+01 333.939 0.9873 
1 1 1 5   66  4  o 4  1.43286e+01 5.17022e-01 2.86698e+02 64.854  1.07560e+01  2.29135e+01  0.00000e+00 0.00000e+00 2.38974e+02 64.854  4.77236e+01 244.854 0.9800 
1 1 1 5   66  5  o 8  1.87713e+01 6.62964e-01 3.30079e+02 331.236 3.99038e+01  -2.19045e+01 0.00000e+00 0.00000e+00 3.64790e+02 331.236 3.47112e+01 331.236 0.9890 
1 1 1 5   66  6  o 6  1.13291e+01 7.31135e-01 1.96929e+02 216.200 -1.45971e+01 -1.06833e+01 0.00000e+00 0.00000e+00 2.15185e+02 216.200 1.82562e+01 216.200 0.9720 
1 1 1 5   66  7  o 6  8.07699e+00 7.07572e-01 1.73709e+02 239.519 -6.32757e+00 -1.07503e+01 0.00000e+00 0.00000e+00 1.16142e+02 239.519 5.75664e+01 59.519  0.9590 
1 1 1 5   66  8  o 14 1.15886e+01 7.39901e-01 1.87531e+02 36.194  1.78441e+01  1.30570e+01  0.00000e+00 0.00000e+00 2.36068e+02 36.194  4.85366e+01 36.194  0.9771 
1 1 1 5   66  9  o 5  1.19824e+01 6.84859e-01 2.18375e+02 304.771 1.84373e+01  -2.65565e+01 0.00000e+00 0.00000e+00 2.22749e+02 304.771 4.37419e+00 304.771 0.9844 
1 1 1 5   66  10 o 8  1.04439e+01 8.03940e-01 2.08073e+02 83.030  3.57835e+00  2.92707e+01  0.00000e+00 0.00000e+00 1.75673e+02 83.030  3.24001e+01 263.030 0.9829 
1 1 1 5   66  11 o 16 1.13029e+01 8.79593e-01 2.08428e+02 243.236 -1.54098e+01 -3.05543e+01 0.00000e+00 0.00000e+00 2.07704e+02 243.236 7.24427e-01 63.236  0.9853 
1 1 1 5   66  12 o 19 1.15802e+01 9.42948e-01 1.61616e+02 284.505 6.85960e+00  -2.65142e+01 0.00000e+00 0.00000e+00 2.62909e+02 284.505 1.01294e+02 284.505 0.9816 
1 1 1 5   66  13 o 19 7.47582e+00 1.34914e+00 1.06751e+02 308.149 5.97294e+00  -7.60418e+00 0.00000e+00 0.00000e+00 1.57449e+02 308.149 5.06975e+01 308.149 0.9468 
1 1 1 5   66  14 o 5  7.05616e+00 1.39638e+00 9.56482e+01 175.421 -9.11241e+00 7.29801e-01  0.00000e+00 0.00000e+00 1.52729e+02 175.421 5.70804e+01 175.421 0.9436 
1 1 1 5   66  15 o 3  4.53711e+00 1.39347e+00 8.95585e+01 224.936 -4.25439e+00 -4.24486e+00 0.00000e+00 0.00000e+00 6.47793e+01 224.936 2.47792e+01 44.936  0.9125 
1 1 1 5   67  0  o 12 1.12173e+01 5.54020e-01 1.30360e+02 284.570 1.86438e+00  -7.17266e+00 0.00000e+00 0.00000e+00 2.59899e+02 284.570 1.29539e+02 284.570 0.9299 
1 1 1 5   67  1  o 19 1.63738e+01 5.50880e-01 3.55787e+02 201.728 -2.94827e+01 -1.17492e+01 0.00000e+00 0.00000e+00 2.47215e+02 201.728 1.08572e+02 21.728  0.9841 
1 1 1 5   67  2  o 18 1.54507e+01 5.49692e-01 3.60720e+02 184.054 -3.32551e+01 -2.35679e+00 0.00000e+00 0.00000e+00 2.08791e+02 184.054 1.51929e+02 4.054   0.9849 
1 1 1 5   67  3  f 0  1.16577e+01 5.82745e-01 1.50247e+02 128.068 -6.20560e+00 7.92352e+00  0.00000e+00 0.00000e+00 2.63793e+02 128.068 1.13547e+02 128.068 0.9489 
1 1 1 5   67  4  o 17 1.05246e+01 6.96588e-01 2.23867e+02 2.176   1.58150e+01  6.01007e-01  0.00000e+00 0.00000e+00 1.57383e+02 2.176   6.64837e+01 182.176 0.9679 
1 1 1 5   67  5  o 4  3.37530e+00 9.45452e-01 1.52489e+02 118.708 -1.68652e+00 3.07947e+00  0.00000e+00 0.00000e+00 4.61699e+01 298.708 1.98659e+02 298.708 0.8417 
1 1 1 5   67  6  o 4  1.10506e+01 5.62363e-01 1.85651e+02 311.506 1.17412e+01  -1.32680e+01 0.00000e+00 0.00000e+00 2.16011e+02 311.506 3.03603e+01 311.506 0.9714 
1 1 1 5   67  7  o 14 8.87507e+00 6.59370e-01 1.96232e+02 154.401 -1.48728e+01 7.12541e+00  0.00000e+00 0.00000e+00 1.25571e+02 154.401 7.06613e+01 334.401 0.9692 
1 1 1 5   67  8  o 18 2.33794e+01 6.18618e-01 4.06404e+02 250.868 -3.30116e+01 -9.51611e+01 0.00000e+00 0.00000e+00 4.63686e+02 250.868 5.72816e+01 250.868 0.9950 
1 1 1 5   67  9  o 4  2.66242e+00 8.41395e-01 6.91020e+01 314.972 1.58287e+00  -1.58441e+00 0.00000e+00 0.00000e+00 3.91213e+00 314.972 6.51898e+01 134.972 0.7334 
1 1 1 5   67  10 o 3  3.11792e+00 9.14798e-01 4.22942e+01 18.343  1.54153e+00  5.11086e-01  0.00000e+00 0.00000e+00 3.05799e+01 18.343  1.17142e+01 198.343 0.6253 
1 1 1 5   67  11 o 2  9.10969e+00 9.90778e-01 1.71022e+02 331.293 1.86281e+01  -1.02016e+01 0.00000e+00 0.00000e+00 1.61203e+02 331.293 9.81903e+00 151.293 0.9762 
1 1 1 5   67  12 o 4  2.66846e+00 8.96259e-01 3.19497e+01 198.928 -1.30142e+00 -4.46278e-01 0.00000e+00 0.00000e+00 2.42393e+01 198.928 7.71043e+00 18.928  0.5639 
1 1 1 5   67  13 o 7  4.45318e+00 1.22499e+00 5.52601e+01 136.614 -2.48138e+00 2.34541e+00  0.00000e+00 0.00000e+00 8.37612e+01 136.614 2.85010e+01 136.614 0.8365 
1 1 1 5   67  14 o 18 6.48903e+00 1.50735e+00 8.42962e+01 339.041 6.48262e+00  -2.48318e+00 0.00000e+00 0.00000e+00 1.39543e+02 339.041 5.52467e+01 339.041 0.9249 
1 1 1 5   67  15 o 15 6.93288e+00 1.62953e+00 1.04604e+02 268.647 -2.19119e-01 -9.28003e+00 0.00000e+00 0.00000e+00 1.39451e+02 268.647 3.48472e+01 268.647 0.9445 
1 1 1 5   68  0  o 17 1.00618e+01 5.90890e-01 2.65206e+02 73.681  4.46702e+00  1.52574e+01  0.00000e+00 0.00000e+00 9.91520e+01 73.681  1.66054e+02 253.681 0.9680 
1 1 1 5   68  1  f 0  1.61387e+01 5.57709e-01 1.44164e+02 278.278 1.99964e+00  -1.37435e+01 0.00000e+00 0.00000e+00 4.37495e+02 278.278 2.93331e+02 278.278 0.9633 
1 1 1 5   68  2  o 1  1.37429e+01 6.84107e-01 2.45451e+02 174.316 -1.90526e+01 1.89634e+00  0.00000e+00 0.00000e+00 2.55178e+02 174.316 9.72769e+00 174.316 0.9735 
1 1 1 5   68  3  o 6  8.89664e+00 6.57992e-01 1.69528e+02 147.808 -7.88294e+00 4.96266e+00  0.00000e+00 0.00000e+00 1.44977e+02 147.808 2.45511e+01 327.808 0.9447 
1 1 1 5   68  4  o 8  2.41840e+01 6.84270e-01 3.63374e+02 313.404 4.42527e+01  -4.67891e+01 0.00000e+00 0.00000e+00 5.34540e+02 313.404 1.71167e+02 313.404 0.9922 
1 1 1 5   68  5  o 5  8.84600e+00 8.40077e-01 1.35705e+02 302.577 4.74432e+00  -7.42502e+00 0.00000e+00 0.00000e+00 1.75898e+02 302.577 4.01931e+01 302.577 0.9414 
1 1 1 5   68  6  o 6  3.81815e+00 8.60420e-01 6.97901e+01 81.807  3.25764e-01  2.26263e+00  0.00000e+00 0.00000e+00 3.58541e+01 81.807  3.39360e+01 261.807 0.7396 
1 1 1 5   68  7  o 12 5.92656e+00 8.41359e-01 1.50982e+02 264.542 -7.77991e-01 -8.14220e+00 0.00000e+00 0.00000e+00 5.66706e+01 264.542 9.43118e+01 84.542  0.9367 
1 1 1 5   68  8  o 2  9.93882e+00 6.57892e-01 1.82018e+02 300.562 9.55998e+00  -1.61896e+01 0.00000e+00 0.00000e+00 1.79625e+02 300.562 2.39253e+00 120.562 0.9730 
1 1 1 5   68  9  o 9  9.49116e+00 7.23528e-01 1.39463e+02 196.176 -1.52235e+01 -4.41606e+00 0.00000e+00 0.00000e+00 2.03969e+02 196.176 6.45057e+01 196.176 0.9679 
1 1 1 5   68  10 o 4  4.91292e+00 1.03950e+00 9.01515e+01 344.831 5.40018e+00  -1.46406e+00 0.00000e+00 0.00000e+00 7.61045e+01 344.831 1.40470e+01 164.831 0.9056 
1 1 1 5   68  11 o 12 3.68070e+00 1.00938e+00 9.91994e+01 177.199 -4.95010e+00 2.42203e-01  0.00000e+00 0.00000e+00 2.34856e+01 177.199 7.57138e+01 357.199 0.8924 
1 1 1 5   68  12 o 4  4.55502e+00 1.05954e+00 8.15394e+01 338.460 5.16654e+00  -2.03929e+00 0.00000e+00 0.00000e+00 7.23341e+01 338.460 9.20525e+00 158.460 0.9048 
1 1 1 5   68  13 o 2  1.06926e+01 1.14571e+00 9.76682e+01 210.527 -1.37106e+01 -8.08504e+00 0.00000e+00 0.00000e+00 2.88564e+02 210.527 1.90896e+02 210.527 0.9681 
1 1 1 5   68  14 o 8  4.70180e+00 1.33821e+00 4.80707e+01 89.847  8.61708e-03  3.23452e+00  0.00000e+00 0.00000e+00 9.67398e+01 89.847  4.86691e+01 89.847  0.8259 
1 1 1 5   68  15 o 10 6.11138e+00 1.59097e+00 9.10265e+01 134.458 -5.32864e+00 5.43042e+00  0.00000e+00 0.00000e+00 1.21168e+02 134.458 3.01417e+01 134.458 0.9318 
1 1 1 5   69  0  o 17 2.09005e+01 5.70988e-01 3.62473e+02 180.538 -4.32564e+01 -4.05968e-01 0.00000e+00 0.00000e+00 4.10141e+02 180.538 4.76681e+01 180.538 0.9884 
1 1 1 5   69  1  o 1  8.19477e+00 7.42969e-01 1.57098e+02 15.409  6.97547e+00  1.92259e+00  0.00000e+00 0.00000e+00 1.27400e+02 15.409  2.96983e+01 195.409 0.9281 
1 1 1 5   69  2  o 7  9.91374e+00 7.24605e-01 1.65467e+02 120.466 -4.97884e+00 8.46393e+00  0.00000e+00 0.00000e+00 1.85998e+02 120.466 2.05313e+01 120.466 0.9476 
1 1 1 5   69  3  o 18 2.24239e+01 7.33578e-01 4.25811e+02 330.201 5.52047e+01  -3.16149e+01 0.00000e+00 0.00000e+00 4.06525e+02 330.201 1.92862e+01 150.201 0.9921 
1 1 1 5   69  4  f 0  1.61084e+01 8.66344e-01 2.87488e+02 299.979 1.63637e+01  -2.83669e+01 0.00000e+00 0.00000e+00 3.05901e+02 299.979 1.84125e+01 299.979 0.9846 
1 1 1 5   69  5  o 11 1.42005e+01 7.55959e-01 2.37077e+02 161.122 -2.43174e+01 8.31520e+00  0.00000e+00 0.00000e+00 2.83730e+02 161.122 4.66532e+01 161.122 0.9803 
1 1 1 5   69  6  o 18 3.64075e+00 8.56513e-01 1.09564e+02 303.302 1.87351e+00  -2.85189e+00 0.00000e+00 0.00000e+00 4.33813e+00 303.302 1.05225e+02 123.302 0.8364 
1 1 1 5   69  7  o 10 2.55079e+00 8.04024e-01 5.57675e+01 208.664 -1.26868e+00 -6.93549e-01 0.00000e+00 0.00000e+00 2.03518e-01 28.664  5.59710e+01 28.664  0.5825 
1 1 1 5   69  8  o 8  1.34248e+01 6.29516e-01 2.45689e+02 129.673 -2.38672e+01 2.87753e+01  0.00000e+00 0.00000e+00 2.49484e+02 129.673 3.79427e+00 129.673 0.9865 
1 1 1 5   69  9  o 1  1.04373e+01 7.18294e-01 1.68495e+02 169.268 -2.17612e+01 4.12435e+00  0.00000e+00 0.00000e+00 2.12704e+02 169.268 4.42091e+01 169.268 0.9772 
1 1 1 5   69  10 o 14 8.28594e+00 9.25295e-01 9.82717e+01 353.543 1.05408e+01  -1.19291e+00 0.00000e+00 0.00000e+00 1.96336e+02 353.543 9.80645e+01 353.543 0.9516 
1 1 1 5   69  11 o 15 5.91121e+00 1.13777e+00 1.08723e+02 222.472 -6.21724e+00 -5.69142e+00 0.00000e+00 0.00000e+00 9.84948e+01 222.472 1.02282e+01 42.472  0.9387 
1 1 1 5   69  12 o 16 4.80619e+00 1.17572e+00 1.25351e+02 26.841  7.14674e+00  3.61649e+00  0.00000e+00 0.00000e+00 4.24466e+01 26.841  8.29040e+01 206.841 0.9353 
1 1 1 5   69  13 o 10 5.11687e+00 1.34751e+00 5.28177e+01 242.226 -1.64042e+00 -3.11477e+00 0.00000e+00 0.00000e+00 1.07943e+02 242.226 5.51251e+01 242.226 0.8422 
1 1 1 5   69  14 o 10 5.43924e+00 1.46876e+00 1.95951e+01 313.604 9.52045e-01  -9.99605e-01 0.00000e+00 0.00000e+00 9.50134e+01 313.604 7.54183e+01 313.604 0.5652 
1 1 1 5   69  15 o 10 4.28543e+00 1.37413e+00 5.09855e+01 324.579 2.91644e+00  -2.07420e+00 0.00000e+00 0.00000e+00 8.39494e+01 324.579 3.29638e+01 324.579 0.8451 
1 1 1 5   70  0  o 18 8.76782e+00 6.79583e-01 2.17719e+02 69.895  3.96010e+00  1.08188e+01  0.00000e+00 0.00000e+00 9.55757e+01 69.895  1.22144e+02 249.895 0.9556 
1 1 1 5   70  1  o 2  6.62209e+00 8.60587e-01 7.48262e+01 136.785 -2.10818e+00 1.98076e+00  0.00000e+00 0.00000e+00 1.23738e+02 136.785 4.89114e+01 136.785 0.8017 
1 1 1 5   70  2  o 12 8.46451e+00 7.92984e-01 1.40032e+02 274.182 5.70390e-01  -7.80058e+00 0.00000e+00 0.00000e+00 1.55586e+02 274.182 1.55540e+01 274.182 0.9337 
1 1 1 5   70  3  o 3  2.02167e+01 1.02397e+00 3.16880e+02 166.921 -4.22945e+01 9.82597e+00  0.00000e+00 0.00000e+00 4.30593e+02 166.921 1.13713e+02 166.921 0.9884 
1 1 1 5   70  4  o 9  1.12780e+01 9.43537e-01 2.00715e+02 96.692  -1.88994e+00 1.61078e+01  0.00000e+00 0.00000e+00 2.07928e+02 96.692  7.21282e+00 96.692  0.9687 
1 1 1 5   70  5  o 4  1.19638e+01 7.53504e-01 2.06562e+02 242.893 -9.46545e+00 -1.84918e+01 0.00000e+00 0.00000e+00 2.30016e+02 242.893 2.34540e+01 242.893 0.9756 
1 1 1 5   70  6  o 8  6.08595e+00 8.53170e-01 8.69163e+01 211.599 -4.05774e+00 -2.49625e+00 0.00000e+00 0.00000e+00 1.15106e+02 211.599 2.81900e+01 211.599 0.8876 
1 1 1 5   70  7  o 10 3.00145e+00 8.57863e-01 1.20321e+02 72.936  1.08663e+00  3.54003e+00  0.00000e+00 0.00000e+00 2.48113e+01 252.936 1.45133e+02 252.936 0.8510 
1 1 1 5   70  8  o 14 3.84200e+00 9.38575e-01 1.45481e+02 316.510 4.57515e+00  -4.34007e+00 0.00000e+00 0.00000e+00 1.38013e+01 136.510 1.59282e+02 136.510 0.9169 
1 1 1 5   70  9  o 19 1.14310e+01 7.20280e-01 1.87726e+02 194.563 -2.80738e+01 -7.29334e+00 0.00000e+00 0.00000e+00 2.32013e+02 194.563 4.42861e+01 194.563 0.9826 
1 1 1 5   70  10 o 3  4.42760e+00 1.05345e+00 7.72838e+01 307.776 2.83596e+00  -3.65923e+00 0.00000e+00 0.00000e+00 6.89273e+01 307.776 8.35641e+00 127.776 0.8840 
1 1 1 5   70  11 o 1  6.07832e+00 1.08565e+00 1.06412e+02 219.081 -7.06175e+00 -5.73506e+00 0.00000e+00 0.00000e+00 1.07682e+02 219.081 1.26908e+00 219.081 0.9433 
1 1 1 5   70  12 o 4  3.69608e+00 1.14509e+00 7.27740e+01 222.626 -2.98015e+00 -2.74286e+00 0.00000e+00 0.00000e+00 4.66013e+01 222.626 2.61727e+01 42.626  0.8654 
1 1 1 5   70  13 o 14 3.77066e+00 1.18493e+00 1.00844e+02 51.279  3.53869e+00  4.41365e+00  0.00000e+00 0.00000e+00 2.66732e+01 51.279  7.41709e+01 231.279 0.9067 
1 1 1 5   70  14 o 15 3.70714e+00 1.23957e+00 4.88368e+01 52.238  1.77538e+00  2.29193e+00  0.00000e+00 0.00000e+00 6.20223e+01 52.238  1.31855e+01 52.238  0.8022 
1 1 1 5   70  15 o 6  3.54468e+00 1.21168e+00 8.04047e+01 226.893 -3.62479e+00 -3.87257e+00 0.00000e+00 0.00000e+00 3.84306e+01 226.893 4.19741e+01 46.893  0.9000 
1 1 1 5   71  0  o 16 1.02957e+01 6.76910e-01 1.93656e+02 343.950 1.29273e+01  -3.71904e+00 0.00000e+00 0.00000e+00 1.76670e+02 343.950 1.69864e+01 163.950 0.9621 
1 1 1 5   71  1  o 6  3.44863e+00 8.62791e-01 8.65207e+01 257.354 -4.24440e-01 -1.89172e+00 0.00000e+00 0.00000e+00 2.13038e+00 257.354 8.43903e+01 77.354  0.6875 
1 1 1 5   71  2  o 1  9.05796e+00 7.58850e-01 1.24601e+02 332.884 7.25365e+00  -3.71438e+00 0.00000e+00 0.00000e+00 1.92622e+02 332.884 6.80206e+01 332.884 0.9365 
1 1 1 5   71  3  o 7  1.56016e+01 1.08709e+00 2.76531e+02 168.048 -2.77585e+01 5.87601e+00  0.00000e+00 0.00000e+00 2.96580e+02 168.048 2.00485e+01 168.048 0.9822 
1 1 1 5   71  4  o 7  7.78206e+00 1.03568e+00 7.83897e+01 98.347  -6.31400e-01 4.30350e+00  0.00000e+00 0.00000e+00 1.76484e+02 98.347  9.80941e+01 98.347  0.8757 
1 1 1 5   71  5  o 19 7.47613e+00 8.95742e-01 7.20225e+01 297.036 2.07451e+00  -4.06504e+00 0.00000e+00 0.00000e+00 1.74614e+02 297.036 1.02591e+02 297.036 0.8822 
1 1 1 5   71  6  o 3  1.23206e+01 6.43276e-01 2.76163e+02 92.978  -1.70207e+00 3.27128e+01  0.00000e+00 0.00000e+00 1.77428e+02 92.978  9.87351e+01 272.978 0.9846 
1 1 1 5   71  7  o 3  1.58976e+01 7.90464e-01 2.63747e+02 343.525 4.28711e+01  -1.26782e+01 0.00000e+00 0.00000e+00 3.23877e+02 343.525 6.01303e+01 343.525 0.9888 
1 1 1 5   71  8  o 18 1.12259e+01 7.63521e-01 2.18577e+02 270.847 4.54349e-01  -3.07361e+01 0.00000e+00 0.00000e+00 1.94098e+02 270.847 2.44785e+01 90.847  0.9836 
1 1 1 5   71  9  o 12 1.47823e+01 7.84378e-01 2.40404e+02 108.529 -1.54239e+01 4.60200e+01  0.00000e+00 0.00000e+00 3.06175e+02 108.529 6.57709e+01 108.529 0.9896 
1 1 1 5   71  10 f 0  4.62724e+00 1.12520e+00 4.58825e+01 72.121  8.35071e-01  2.58871e+00  0.00000e+00 0.00000e+00 9.01173e+01 72.121  4.42348e+01 72.121  0.7870 
1 1 1 5   71  11 o 2  5.58389e+00 1.21719e+00 6.46384e+01 126.315 -2.83073e+00 3.85143e+00  0.00000e+00 0.00000e+00 1.20473e+02 126.315 5.58341e+01 126.315 0.8880 
1 1 1 5   71  12 o 2  7.67297e+00 1.35912e+00 1.22275e+02 122.506 -6.41494e+00 1.00671e+01  0.00000e+00 0.00000e+00 1.51757e+02 122.506 2.94819e+01 122.506 0.9572 
1 1 1 5   71  13 o 11 4.22761e+00 1.31075e+00 7.67437e+01 270.744 5.82138e-02  -4.48239e+00 0.00000e+00 0.00000e+00 6.19651e+01 270.744 1.47786e+01 90.744  0.8798 
1 1 1 5   71  14 o 4  3.82861e+00 1.26903e+00 9.68969e+01 326.204 4.77460e+00  -3.19578e+00 0.00000e+00 0.00000e+00 3.26931e+01 326.204 6.42038e+01 146.204 0.9082 
1 1 1 5   71  15 o 2  7.01946e+00 1.75376e+00 1.51038e+02 209.956 -1.10644e+01 -6.37678e+00 0.00000e+00 0.00000e+00 9.99342e+01 209.956 5.11041e+01 29.956  0.9600 
1 1 1 5   72  0  f 0  1.29599e+01 5.78826e-01 1.90231e+02 71.234  5.59831e+00  1.64770e+01  0.00000e+00 0.00000e+00 2.80072e+02 71.234  8.98406e+01 71.234  0.9708 
1 1 1 5   72  1  o 12 9.29531e+00 7.22378e-01 1.44954e+02 328.097 8.30863e+00  -5.17231e+00 0.00000e+00 0.00000e+00 1.84296e+02 328.097 3.93414e+01 328.097 0.9474 
1 1 1 5   72  2  o 1  1.22324e+01 8.68354e-01 2.06960e+02 58.032  9.46991e+00  1.51740e+01  0.00000e+00 0.00000e+00 2.37436e+02 58.032  3.04755e+01 58.032  0.9716 
1 1 1 5   72  3  o 14 1.14047e+01 9.39686e-01 1.04771e+02 177.514 -8.54708e+00 3.71128e-01  0.00000e+00 0.00000e+00 2.95913e+02 177.514 1.91142e+02 177.514 0.9396 
1 1 1 5   72  4  o 7  1.12205e+01 7.23985e-01 1.75761e+02 323.189 1.31756e+01  -9.86044e+00 0.00000e+00 0.00000e+00 2.30835e+02 323.189 5.50736e+01 323.189 0.9691 
1 1 1 5   72  5  f 0  2.19717e+01 7.46928e-01 3.88461e+02 164.504 -7.23458e+01 2.00584e+01  0.00000e+00 0.00000e+00 4.27540e+02 164.504 3.90793e+01 164.504 0.9933 
1 1 1 5   72  6  o 3  9.47199e+00 7.33760e-01 1.41079e+02 76.639  3.20468e+00  1.34930e+01  0.00000e+00 0.00000e+00 2.00002e+02 76.639  5.89228e+01 76.639  0.9632 
1 1 1 5   72  7  o 7  1.65750e+01 1.05929e+00 3.20829e+02 163.481 -4.66225e+01 1.38271e+01  0.00000e+00 0.00000e+00 2.92281e+02 163.481 2.85478e+01 343.481 0.9897 
1 1 1 5   72  8  o 15 1.18160e+01 7.86031e-01 2.08323e+02 63.721  1.27774e+01  2.58766e+01  0.00000e+00 0.00000e+00 2.25484e+02 63.721  1.71604e+01 63.721  0.9825 
1 1 1 5   72  9  o 2  3.00312e+00 9.36356e-01 2.32479e+01 304.460 4.97596e-01  -7.25090e-01 0.00000e+00 0.00000e+00 2.18526e+01 304.460 1.39536e+00 124.460 0.4020 
1 1 1 5   72  10 o 11 3.14228e+00 9.83906e-01 3.85592e+01 82.166  2.25843e-01  1.64138e+00  0.00000e+00 0.00000e+00 3.56649e+01 82.166  2.89427e+00 262.166 0.6326 
1 1 1 5   72  11 o 15 4.68322e+00 1.22764e+00 8.98302e+01 88.318  1.54320e-01  5.25603e+00  0.00000e+00 0.00000e+00 6.73210e+01 88.318  2.25092e+01 268.318 0.8990 
1 1 1 5   72  12 o 1  9.02561e+00 1.30938e+00 1.90836e+02 289.493 7.13172e+00  -2.01467e+01 0.00000e+00 0.00000e+00 1.37895e+02 289.493 5.29403e+01 109.493 0.9763 
1 1 1 5   72  13 o 11 6.21593e+00 1.53841e+00 1.04944e+02 270.545 7.64484e-02  -8.03135e+00 0.00000e+00 0.00000e+00 1.11866e+02 270.545 6.92191e+00 270.545 0.9355 
1 1 1 5   72  14 o 7  4.49120e+00 1.39431e+00 1.16263e+02 86.299  4.78824e-01  7.40231e+00  0.00000e+00 0.00000e+00 3.93574e+01 86.299  7.69057e+01 266.299 0.9299 
1 1 1 5   73  0  o 9  9.96845e+00 6.06674e-01 1.75181e+02 317.954 9.65864e+00  -8.71082e+00 0.00000e+00 0.00000e+00 1.82739e+02 317.954 7.55820e+00 317.954 0.9608 
1 1 1 5   73  1  o 4  2.48930e+01 6.67490e-01 4.68726e+02 268.906 -1.61021e+00 -8.43564e+01 0.00000e+00 0.00000e+00 4.56207e+02 268.906 1.25195e+01 88.906  0.9941 
1 1 1 5   73  2  o 18 1.05942e+01 1.06524e+00 1.26813e+02 344.548 8.97812e+00  -2.48169e+00 0.00000e+00 0.00000e+00 2.47322e+02 344.548 1.20509e+02 344.548 0.9447 
1 1 1 5   73  3  o 12 7.25946e+00 1.13335e+00 1.78232e+02 90.928  -1.45028e-01 8.95346e+00  0.00000e+00 0.00000e+00 7.75235e+01 90.928  1.00709e+02 270.928 0.9424 
1 1 1 5   73  4  o 15 8.60396e+00 7.03046e-01 2.18144e+02 350.660 1.65123e+01  -2.71574e+00 0.00000e+00 0.00000e+00 9.37418e+01 350.660 1.24402e+02 170.660 0.9696 
1 1 1 5   73  5  o 12 7.76179e+00 7.52072e-01 9.26042e+01 276.388 7.48695e-01  -6.68777e+00 0.00000e+00 0.00000e+00 1.75020e+02 276.388 8.24161e+01 276.388 0.9224 
1 1 1 5   73  6  o 3  1.39554e+01 6.73173e-01 2.58080e+02 37.377  3.10233e+01  2.36996e+01  0.00000e+00 0.00000e+00 2.56793e+02 37.377  1.28721e+00 217.377 0.9871 
1 1 1 5   73  7  f 0  2.42633e+01 1.07312e+00 3.75985e+02 122.765 -5.02844e+01 7.81321e+01  0.00000e+00 0.00000e+00 5.25812e+02 122.765 1.49826e+02 122.765 0.9946 
1 1 1 5   73  8  o 7  6.28404e+00 1.06451e+00 1.18887e+02 319.372 6.23266e+00  -5.34736e+00 0.00000e+00 0.00000e+00 1.01085e+02 319.372 1.78020e+01 139.372 0.9370 
1 1 1 5   73  9  o 3  1.26040e+01 8.30095e-01 2.21494e+02 321.774 2.98065e+01  -2.34772e+01 0.00000e+00 0.00000e+00 2.42986e+02 321.774 2.14917e+01 321.774 0.9867 
1 1 1 5   73  10 o 12 7.21634e+00 1.10358e+00 1.61845e+02 239.511 -7.65210e+00 -1.29962e+01 0.00000e+00 0.00000e+00 9.84733e+01 239.511 6.33719e+01 59.511  0.9663 
1 1 1 5   73  11 o 6  4.04995e+00 1.17050e+00 8.51047e+01 339.382 4.42980e+00  -1.66666e+00 0.00000e+00 0.00000e+00 4.89180e+01 339.382 3.61866e+01 159.382 0.8868 
1 1 1 5   73  12 o 4  7.09070e+00 1.38933e+00 1.48427e+02 95.979  -1.36812e+00 1.30637e+01  0.00000e+00 0.00000e+00 1.05768e+02 95.979  4.26591e+01 275.979 0.9611 
1 1 1 5   73  13 o 1  4.49706e+00 1.36248e+00 2.14586e+01 338.553 1.26508e+00  -4.96979e-01 0.00000e+00 0.00000e+00 7.23092e+01 338.553 5.08506e+01 338.553 0.5593 
1 1 1 5   73  14 o 10 3.48538e+00 1.16771e+00 6.00428e+01 44.453  2.62662e+00  2.57693e+00  0.00000e+00 0.00000e+00 5.03197e+01 44.453  9.72310e+00 224.453 0.8500 
1 1 1 5   74  0  o 14 9.57070e+00 6.17371e-01 1.41678e+02 349.459 1.02474e+01  -1.90689e+00 0.00000e+00 0.00000e+00 1.98314e+02 349.459 5.66358e+01 349.459 0.9507 
1 1 1 5   74  1  o 7  7.70103e+00 6.25741e-01 1.88945e+02 123.723 -6.18952e+00 9.27255e+00  0.00000e+00 0.00000e+00 8.56221e+01 123.723 1.03323e+02 303.723 0.9540 
1 1 1 5   74  2  o 10 6.85120e+00 9.12283e-01 1.00822e+02 92.510  -2.22657e-01 5.07867e+00  0.00000e+00 0.00000e+00 1.28428e+02 92.510  2.76065e+01 92.510  0.8953 
1 1 1 5   74  3  o 7  8.33604e+00 8.54898e-01 1.33223e+02 245.781 -3.72855e+00 -8.28908e+00 0.00000e+00 0.00000e+00 1.60677e+02 245.781 2.74542e+01 245.781 0.9433 
1 1 1 5   74  4  f 0  1.11177e+01 6.67554e-01 2.46734e+02 110.034 -8.42231e+00 2.30980e+01  0.00000e+00 0.00000e+00 1.60264e+02 110.034 8.64700e+01 290.034 0.9794 
1 1 1 5   74  5  o 11 5.21791e+00 8.28425e-01 1.42475e+02 216.317 -5.48398e+00 -4.03088e+00 0.00000e+00 0.00000e+00 3.75796e+01 216.317 1.04896e+02 36.317  0.9233 
1 1 1 5   74  6  o 17 9.48449e+00 7.59445e-01 1.93477e+02 145.848 -1.63430e+01 1.10867e+01  0.00000e+00 0.00000e+00 1.51852e+02 145.848 4.16240e+01 325.848 0.9743 
1 1 1 5   74  7  o 19 2.46876e+01 1.06774e+00 3.61013e+02 125.502 -5.74715e+01 8.05669e+01  0.00000e+00 0.00000e+00 5.56675e+02 125.502 1.95661e+02 125.502 0.9949 
1 1 1 5   74  8  o 13 1.25752e+01 7.81176e-01 1.92104e+02 44.675  2.26825e+01  2.24266e+01  0.00000e+00 0.00000e+00 2.70178e+02 44.675  7.80744e+01 44.675  0.9842 
1 1 1 5   74  9  o 6  2.59453e+00 8.54975e-01 9.89623e+01 121.920 -1.79296e+00 2.87829e+00  0.00000e+00 0.00000e+00 1.80481e+01 301.920 1.17010e+02 301.920 0.8352 
1 1 1 5   74  10 o 11 5.42951e+00 1.12414e+00 9.14144e+01 182.693 -6.18028e+00 -2.90703e-01 0.00000e+00 0.00000e+00 9.40546e+01 182.693 2.64021e+00 182.693 0.9152 
1 1 1 5   74  11 o 4  8.44430e+00 1.17340e+00 1.62857e+02 35.316  1.49490e+01  1.05907e+01  0.00000e+00 0.00000e+00 1.43471e+02 35.316  1.93866e+01 215.316 0.9723 
1 1 1 5   74  12 o 9  8.29054e+00 1.27438e+00 1.22194e+02 177.512 -1.32346e+01 5.75009e-01  0.00000e+00 0.00000e+00 1.75057e+02 177.512 5.28639e+01 177.512 0.9615 
1 1 1 5   74  13 o 8  4.34951e+00 1.31986e+00 1.04322e+02 110.216 -2.35831e+00 6.40426e+00  0.00000e+00 0.00000e+00 4.53854e+01 110.216 5.89361e+01 290.216 0.9235 
1 1 1 5   74  14 o 11 4.17411e+00 1.34176e+00 5.88650e+01 289.017 1.31136e+00  -3.80485e+00 0.00000e+00 0.00000e+00 7.55325e+01 289.017 1.66675e+01 289.017 0.8645 
1 1 1 5   75  0  o 18 9.03237e+00 8.14656e-01 1.35271e+02 354.017 9.65107e+00  -1.01151e+00 0.00000e+00 0.00000e+00 1.84261e+02 354.017 4.89896e+01 354.017 0.9470 
1 1 1 5   75  1  o 10 1.49829e+01 6.70449e-01 2.60064e+02 119.281 -1.47806e+01 2.63590e+01  0.00000e+00 0.00000e+00 2.90405e+02 119.281 3.03411e+01 119.281 0.9833 
1 1 1 5   75  2  o 7  6.78509e+00 8.85309e-01 1.56194e+02 297.014 3.85622e+00  -7.56365e+00 0.00000e+00 0.00000e+00 8.19110e+01 297.014 7.42827e+01 117.014 0.9391 
1 1 1 5   75  3  o 17 1.12596e+01 5.68688e-01 2.96665e+02 331.845 2.69886e+01  -1.44442e+01 0.00000e+00 0.00000e+00 1.17167e+02 331.845 1.79498e+02 151.845 0.9835 
1 1 1 5   75  4  o 15 7.33852e+00 6.53407e-01 1.56087e+02 93.877  -7.33068e-01 1.08176e+01  0.00000e+00 0.00000e+00 1.05175e+02 93.877  5.09126e+01 273.877 0.9527 
1 1 1 5   75  5  o 3  1.48206e+01 6.27923e-01 2.52544e+02 46.305  2.71006e+01  2.83646e+01  0.00000e+00 0.00000e+00 2.94140e+02 46.305  4.15964e+01 46.305  0.9872 
1 1 1 5   75  6  o 19 2.72006e+00 8.24572e-01 9.21661e+01 120.161 -1.24537e+00 2.14310e+00  0.00000e+00 0.00000e+00 1.46618e+01 300.161 1.06828e+02 300.161 0.7627 
1 1 1 5   75  7  o 4  9.11919e+00 1.28281e+00 1.35985e+02 351.947 1.17612e+01  -1.66405e+00 0.00000e+00 0.00000e+00 1.89981e+02 351.947 5.39965e+01 351.947 0.9569 
1 1 1 5   75  8  o 7  4.40111e+00 1.00437e+00 4.01188e+01 316.454 1.58744e+00  -1.50882e+00 0.00000e+00 0.00000e+00 7.93096e+01 316.454 3.91908e+01 316.454 0.7266 
1 1 1 5   75  9  o 10 3.15486e+00 9.71866e-01 1.14551e+02 177.634 -4.98015e+00 2.05788e-01  0.00000e+00 0.00000e+00 9.37301e+00 357.634 1.23924e+02 357.634 0.8930 
1 1 1 5   75  10 o 17 3.04482e+00 9.45125e-01 9.29654e+01 212.927 -3.35993e+00 -2.17589e+00 0.00000e+00 0.00000e+00 5.16689e+00 212.927 8.77985e+01 32.927  0.8636 
1 1 1 5   75  11 o 6  1.03663e+01 1.10416e+00 1.49739e+02 358.929 2.39966e+01  -4.48731e-01 0.00000e+00 0.00000e+00 2.28797e+02 358.929 7.90582e+01 358.929 0.9789 
1 1 1 5   75  12 o 12 8.58845e+00 1.40535e+00 4.57235e+01 109.849 -1.69465e+00 4.69443e+00  0.00000e+00 0.00000e+00 2.40273e+02 109.849 1.94549e+02 109.849 0.8932 
1 1 1 5   75  13 o 6  4.55451e+00 1.34599e+00 8.74070e+01 300.829 2.88360e+00  -4.83179e+00 0.00000e+00 0.00000e+00 6.63742e+01 300.829 2.10328e+01 120.829 0.9061 
1 1 1 5   75  14 o 3  4.29416e+00 1.34657e+00 8.35613e+01 113.154 -2.36794e+00 5.53720e+00  0.00000e+00 0.00000e+00 6.23884e+01 113.154 2.11729e+01 293.154 0.9127 
1 1 1 5   76  0  o 4  1.12400e+01 5.88349e-01 2.18800e+02 335.463 1.91858e+01  -8.75842e+00 0.00000e+00 0.00000e+00 1.90929e+02 335.463 2.78715e+01 155.463 0.9760 
1 1 1 5   76  1  o 1  7.97380e+00 7.73731e-01 1.50831e+02 38.431  7.86561e+00  6.24109e+00  0.00000e+00 0.00000e+00 1.31789e+02 38.431  1.90416e+01 218.431 0.9488 
1 1 1 5   76  2  f 0  1.19779e+01 8.03781e-01 3.97702e+02 53.970  2.43309e+01  3.34520e+01  0.00000e+00 0.00000e+00 4.43443e+01 53.970  3.53358e+02 233.970 0.9878 
1 1 1 5   76  3  o 7  7.19213e+00 6.60606e-01 1.27819e+02 29.206  7.18965e+00  4.01912e+00  0.00000e+00 0.00000e+00 1.24006e+02 29.206  3.81314e+00 209.206 0.9372 
1 1 1 5   76  4  o 15 2.88760e+00 7.58515e-01 1.39709e+02 259.322 -6.97586e-01 -3.69954e+00 0.00000e+00 0.00000e+00 4.75952e+01 79.322  1.87304e+02 79.322  0.8538 
1 1 1 5   76  5  o 7  1.26438e+01 5.82597e-01 2.44644e+02 72.259  1.00731e+01  3.14853e+01  0.00000e+00 0.00000e+00 2.20506e+02 72.259  2.41375e+01 252.259 0.9848 
1 1 1 5   76  6  o 17 6.44072e+00 7.94222e-01 7.85695e+01 100.745 -1.06589e+00 5.61702e+00  0.00000e+00 0.00000e+00 1.39814e+02 100.745 6.12441e+01 100.745 0.9077 
1 1 1 5   76  7  o 15 1.12778e+01 8.08422e-01 2.58919e+02 67.679  1.40855e+01  3.43082e+01  0.00000e+00 0.00000e+00 1.56542e+02 67.679  1.02377e+02 247.679 0.9864 
1 1 1 5   76  8  o 4  5.50698e+00 1.01692e+00 1.27296e+02 82.629  1.09134e+00  8.43645e+00  0.00000e+00 0.00000e+00 6.58223e+01 82.629  6.14734e+01 262.629 0.9392 
1 1 1 5   76  9  o 2  8.81986e+00 9.86417e-01 1.47290e+02 58.147  9.36661e+00  1.50757e+01  0.00000e+00 0.00000e+00 1.72494e+02 58.147  2.52041e+01 58.147  0.9714 
1 1 1 5   76  10 f 0  5.43959e+00 1.10750e+00 1.04202e+02 95.143  -7.17425e-01 7.97039e+00  0.00000e+00 0.00000e+00 8.56111e+01 95.143  1.85912e+01 275.143 0.9353 
1 1 1 5   76  11 f 0  3.90787e+00 1.18071e+00 2.53613e+01 54.444  8.06341e-01  1.12810e+00  0.00000e+00 0.00000e+00 5.72495e+01 54.444  3.18882e+01 54.444  0.5668 
1 1 1 5   76  12 o 12 5.24463e+00 1.40258e+00 7.22472e+01 106.003 -1.34242e+00 4.68056e+00  0.00000e+00 0.00000e+00 1.01794e+02 106.003 2.95466e+01 106.003 0.8903 
1 1 1 5   76  13 o 1  3.48350e+00 1.16596e+00 5.06241e+01 306.218 1.76160e+00  -2.40530e+00 0.00000e+00 0.00000e+00 5.43123e+01 306.218 3.68819e+00 306.218 0.8086 
1 1 1 5   76  14 o 6  8.26963e+00 1.76336e+00 1.26770e+02 77.889  2.51184e+00  1.17052e+01  0.00000e+00 0.00000e+00 1.67964e+02 77.889  4.11940e+01 77.889  0.9573 
1 1 1 5   77  0  o 17 1.36993e+01 6.75869e-01 2.19770e+02 304.459 1.52661e+01  -2.22460e+01 0.00000e+00 0.00000e+00 2.82208e+02 304.459 6.24378e+01 304.459 0.9813 
1 1 1 5   77  1  o 6  3.86561e+00 9.30584e-01 1.47277e+02 210.251 -4.12121e+00 -2.40350e+00 0.00000e+00 0.00000e+00 1.91061e+01 30.251  1.66383e+02 30.251  0.8878 
1 1 1 5   77  2  o 12 1.41788e+01 6.94981e-01 1.98719e+02 121.120 -1.29537e+01 2.14564e+01  0.00000e+00 0.00000e+00 3.20211e+02 121.120 1.21492e+02 121.120 0.9798 
1 1 1 5   77  3  o 15 1.63242e+01 5.40602e-01 2.88338e+02 284.711 1.17320e+01  -4.46846e+01 0.00000e+00 0.00000e+00 3.14795e+02 284.711 2.64564e+01 284.711 0.9891 
1 1 1 5   77  4  o 14 6.54747e+00 6.79893e-01 1.15936e+02 112.467 -3.00011e+00 7.25455e+00  0.00000e+00 0.00000e+00 1.12479e+02 112.467 3.45775e+00 292.467 0.9339 
1 1 1 5   77  5  o 14 1.73333e+01 5.76514e-01 3.22615e+02 43.495  4.29526e+01  4.07537e+01  0.00000e+00 0.00000e+00 3.19299e+02 43.495  3.31511e+00 223.495 0.9915 
1 1 1 5   77  6  o 1  7.55559e+00 7.27719e-01 1.18041e+02 186.249 -1.12632e+01 -1.23328e+00 0.00000e+00 0.00000e+00 1.51371e+02 186.249 3.33304e+01 186.249 0.9548 
1 1 1 5   77  7  o 3  7.33267e+00 7.72602e-01 1.52565e+02 262.761 -1.85592e+00 -1.46112e+01 0.00000e+00 0.00000e+00 1.11758e+02 262.761 4.08071e+01 82.761  0.9654 
1 1 1 5   77  8  o 13 1.38759e+01 6.66877e-01 2.24785e+02 323.298 3.61929e+01  -2.69792e+01 0.00000e+00 0.00000e+00 2.87411e+02 323.298 6.26263e+01 323.298 0.9889 
1 1 1 5   77  9  o 19 1.10209e+01 7.93427e-01 1.67954e+02 157.275 -2.57023e+01 1.07646e+01  0.00000e+00 0.00000e+00 2.35863e+02 157.275 6.79089e+01 157.275 0.9819 
1 1 1 5   77  10 o 11 7.91382e+00 1.03196e+00 1.70064e+02 340.472 1.89657e+01  -6.72656e+00 0.00000e+00 0.00000e+00 1.17710e+02 340.472 5.23546e+01 160.472 0.9748 
1 1 1 5   77  11 o 3  7.55696e+00 1.23283e+00 1.58832e+02 213.654 -1.29821e+01 -8.64306e+00 0.00000e+00 0.00000e+00 1.13749e+02 213.654 4.50833e+01 33.654  0.9674 
1 1 1 5   77  12 o 18 9.85759e+00 1.20111e+00 1.82902e+02 330.639 2.36693e+01  -1.33157e+01 0.00000e+00 0.00000e+00 1.77636e+02 330.639 5.26643e+00 150.639 0.9814 
1 1 1 5   77  13 o 8  6.41752e+00 1.53705e+00 1.83900e+02 125.576 -8.73647e+00 1.22139e+01  0.00000e+00 0.00000e+00 4.70291e+01 125.576 1.36870e+02 305.576 0.9661 
1 1 1 5   77  14 o 2  4.01290e+00 1.27186e+00 7.22231e+01 263.402 -5.84487e-01 -5.05292e+00 0.00000e+00 0.00000e+00 6.15187e+01 263.402 1.07044e+01 83.402  0.8954 
1 1 1 5   78  0  o 5  1.15750e+01 6.17718e-01 1.96636e+02 54.762  1.18819e+01  1.68197e+01  0.00000e+00 0.00000e+00 2.24872e+02 54.762  2.82366e+01 54.762  0.9754 
1 1 1 5   78  1  o 11 1.14253e+01 1.10936e+00 1.41837e+02 348.937 1.25701e+01  -2.45764e+00 0.00000e+00 0.00000e+00 2.67774e+02 348.937 1.25938e+02 348.937 0.9601 
1 1 1 5   78  2  o 16 8.77574e+00 5.94357e-01 1.25116e+02 44.154  7.64945e+00  7.42685e+00  0.00000e+00 0.00000e+00 1.86835e+02 44.154  6.17193e+01 44.154  0.9519 
1 1 1 5   78  3  o 9  1.79093e+01 5.47503e-01 3.21990e+02 200.229 -5.88749e+01 -2.16961e+01 0.00000e+00 0.00000e+00 3.41495e+02 200.229 1.95049e+01 200.229 0.9920 
1 1 1 5   78  4  o 1  4.57762e+00 8.29892e-01 5.21564e+01 156.875 -2.19298e+00 9.36527e-01  0.00000e+00 0.00000e+00 7.63718e+01 156.875 2.42153e+01 156.875 0.7518 
1 1 1 5   78  5  o 12 4.16279e+00 8.68466e-01 9.37132e+01 193.666 -4.18065e+00 -1.01655e+00 0.00000e+00 0.00000e+00 4.21838e+01 193.666 5.15294e+01 13.667  0.8742 
1 1 1 5   78  6  o 5  8.86880e+00 6.83580e-01 1.77858e+02 356.076 1.90825e+01  -1.30887e+00 0.00000e+00 0.00000e+00 1.44505e+02 356.076 3.33529e+01 176.076 0.9735 
1 1 1 5   78  7  o 9  7.34733e+00 7.90413e-01 1.84255e+02 321.143 1.43591e+01  -1.15686e+01 0.00000e+00 0.00000e+00 8.24782e+01 321.143 1.01776e+02 141.143 0.9725 
1 1 1 5   78  8  o 18 1.54258e+01 6.74753e-01 2.90699e+02 137.633 -5.36733e+01 4.89543e+01  0.00000e+00 0.00000e+00 2.81026e+02 137.633 9.67293e+00 317.633 0.9931 
1 1 1 5   78  9  o 6  5.85139e+00 1.03385e+00 1.02097e+02 49.061  5.11207e+00  5.89350e+00  0.00000e+00 0.00000e+00 1.01698e+02 49.061  3.98710e-01 229.061 0.9335 
1 1 1 5   78  10 o 11 5.90094e+00 1.12944e+00 1.12256e+02 5.846   9.44480e+00  9.67015e-01  0.00000e+00 0.00000e+00 9.58828e+01 5.846   1.63733e+01 185.846 0.9458 
1 1 1 5   78  11 o 12 3.06204e+00 9.69007e-01 3.93396e+01 6.959   1.93932e+00  2.36695e-01  0.00000e+00 0.00000e+00 3.94248e+01 6.959   8.51462e-02 6.959   0.6900 
1 1 1 5   78  12 o 10 7.86192e+00 1.26193e+00 6.32653e+01 91.084  -1.39968e-01 7.39867e+00  0.00000e+00 0.00000e+00 2.09086e+02 91.084  1.45821e+02 91.084  0.9297 
1 1 1 5   78  13 o 12 2.69984e+00 9.37324e-01 6.18533e+01 63.260  1.57193e+00  3.11995e+00  0.00000e+00 0.00000e+00 2.26756e+01 63.260  3.91777e+01 243.260 0.8408 
1 1 1 5   78  14 o 10 4.71226e+00 1.37250e+00 9.62253e+01 159.261 -6.79707e+00 2.57373e+00  0.00000e+00 0.00000e+00 6.65884e+01 159.261 2.96368e+01 339.261 0.9284 
1 1 1 5   79  0  f 0  2.57579e+00 7.76979e-01 1.83041e+01 77.735  9.30269e-02  4.27899e-01  0.00000e+00 0.00000e+00 2.25705e+00 77.735  1.60471e+01 257.735 0.2139 
1 1 1 5   79  1  o 17 4.98975e+00 8.76510e-01 5.54392e+01 99.170  -3.97685e-01 2.46348e+00  0.00000e+00 0.00000e+00 8.69673e+01 99.170  3.15281e+01 99.170  0.7645 
1 1 1 5   79  2  o 7  1.38604e+01 5.04540e-01 1.87125e+02 261.705 -4.11126e+00 -2.82006e+01 0.00000e+00 0.00000e+00 3.21202e+02 261.705 1.34078e+02 261.705 0.9823 
1 1 1 5   79  3  o 16 6.41747e+00 7.02788e-01 1.30041e+02 74.412  2.40960e+00  8.63726e+00  0.00000e+00 0.00000e+00 9.57883e+01 74.412  3.42523e+01 254.412 0.9425 
1 1 1 5   79  4  o 9  7.58874e+00 6.56982e-01 1.34223e+02 246.990 -4.13283e+00 -9.73154e+00 0.00000e+00 0.00000e+00 1.35367e+02 246.990 1.14432e+00 246.990 0.9515 
1 1 1 5   79  5  o 6  9.25348e+00 6.18647e-01 1.33682e+02 327.008 1.30561e+01  -8.47597e+00 0.00000e+00 0.00000e+00 2.00503e+02 327.008 6.68208e+01 327.008 0.9673 
1 1 1 5   79  6  o 8  8.26462e+00 6.76765e-01 1.80968e+02 32.728  1.60550e+01  1.03182e+01  0.00000e+00 0.00000e+00 1.19351e+02 32.728  6.16173e+01 212.728 0.9734 
1 1 1 5   79  7  o 9  7.78637e+00 8.01115e-01 1.73137e+02 235.281 -1.02320e+01 -1.47662e+01 0.00000e+00 0.00000e+00 1.09259e+02 235.281 6.38784e+01 55.281  0.9718 
1 1 1 5   79  8  o 12 1.08072e+01 7.48734e-01 1.82486e+02 158.531 -2.82614e+01 1.11145e+01  0.00000e+00 0.00000e+00 2.14064e+02 158.531 3.15785e+01 158.531 0.9834 
1 1 1 5   79  9  o 7  6.57633e+00 1.04140e+00 1.38756e+02 249.979 -4.50111e+00 -1.23526e+01 0.00000e+00 0.00000e+00 9.70235e+01 249.979 4.17328e+01 69.979  0.9612 
1 1 1 5   79  10 o 12 3.58846e+00 1.04190e+00 9.99333e+01 241.704 -2.62662e+00 -4.87895e+00 0.00000e+00 0.00000e+00 2.11008e+01 241.704 7.88325e+01 61.704  0.9046 
1 1 1 5   79  11 o 8  9.00591e+00 1.12369e+00 1.29457e+02 48.975  1.09685e+01  1.26067e+01  0.00000e+00 0.00000e+00 1.95991e+02 48.975  6.65342e+01 48.975  0.9696 
1 1 1 5   79  12 o 8  5.06063e+00 1.27938e+00 1.09969e+02 15.165  8.33194e+00  2.25827e+00  0.00000e+00 0.00000e+00 6.72656e+01 15.165  4.27038e+01 195.165 0.9402 
1 1 1 5   79  13 o 7  5.97560e+00 1.35822e+00 1.17019e+02 170.755 -1.04774e+01 1.70543e+00  0.00000e+00 0.00000e+00 9.47020e+01 170.755 2.23172e+01 350.755 0.9517 
1 1 1 5   79  14 o 4  3.19062e+00 1.07443e+00 1.70237e+01 287.517 3.49985e-01  -1.10887e+00 0.00000e+00 0.00000e+00 4.24648e+01 287.517 2.54411e+01 287.517 0.5011 
1 1 1 5   80  0  o 13 1.40497e+01 5.85301e-01 2.86416e+02 257.622 -9.30992e+00 -4.24213e+01 0.00000e+00 0.00000e+00 2.31807e+02 257.622 5.46095e+01 77.622  0.9884 
1 1 1 5   80  1  o 12 5.48503e+00 6.77917e-01 5.57609e+01 18.935  3.04549e+00  1.04477e+00  0.00000e+00 0.00000e+00 1.13134e+02 18.935  5.73732e+01 18.935  0.8250 
1 1 1 5   80  2  o 1  1.32673e+01 4.94217e-01 1.59745e+02 222.314 -1.77340e+01 -1.61444e+01 0.00000e+00 0.00000e+00 3.25054e+02 222.314 1.65310e+02 222.314 0.9789 
1 1 1 5   80  3  o 10 1.42385e+01 5.15670e-01 2.70607e+02 359.186 4.41840e+01  -6.27826e-01 0.00000e+00 0.00000e+00 2.54858e+02 359.186 1.57491e+01 179.186 0.9886 
1 1 1 5   80  4  o 16 4.76741e+00 7.83107e-01 5.21377e+01 85.554  2.18734e-01  2.81338e+00  0.00000e+00 0.00000e+00 8.95032e+01 85.554  3.73656e+01 85.554  0.7959 
1 1 1 5   80  5  o 2  1.73588e+01 5.81842e-01 2.74008e+02 31.937  5.35228e+01  3.33626e+01  0.00000e+00 0.00000e+00 3.68773e+02 31.937  9.47645e+01 31.937  0.9920 
1 1 1 5   80  6  o 8  6.89780e+00 7.52337e-01 7.43276e+01 293.435 2.72084e+00  -6.27700e+00 0.00000e+00 0.00000e+00 1.63469e+02 293.435 8.91412e+01 293.435 0.9237 
1 1 1 5   80  7  o 14 9.91403e+00 6.76474e-01 2.07656e+02 158.812 -2.76915e+01 1.07340e+01  0.00000e+00 0.00000e+00 1.55994e+02 158.812 5.16613e+01 338.812 0.9830 
1 1 1 5   80  8  o 11 6.07610e+00 9.18316e-01 1.19126e+02 143.106 -8.21874e+00 6.16950e+00  0.00000e+00 0.00000e+00 9.62114e+01 143.106 2.29150e+01 323.106 0.9500 
1 1 1 5   80  9  o 2  9.79089e+00 8.47682e-01 1.38318e+02 227.983 -1.47713e+01 -1.63952e+01 0.00000e+00 0.00000e+00 2.18438e+02 227.983 8.01202e+01 227.983 0.9771 
1 1 1 5   80  10 o 10 5.60195e+00 1.16059e+00 8.62786e+01 89.974  3.06725e-03  6.85374e+00  0.00000e+00 0.00000e+00 1.06653e+02 89.974  2.03745e+01 89.974  0.9239 
1 1 1 5   80  11 o 11 3.49909e+00 1.07594e+00 5.23018e+01 150.189 -2.50106e+00 1.43303e+00  0.00000e+00 0.00000e+00 5.21232e+01 150.189 1.78627e-01 330.189 0.8009 
1 1 1 5   80  12 o 14 7.13488e+00 1.33076e+00 1.15332e+02 310.302 7.61035e+00  -8.97301e+00 0.00000e+00 0.00000e+00 1.38838e+02 310.302 2.35059e+01 310.302 0.9565 
1 1 1 5   80  13 o 3  3.87880e+00 1.21272e+00 1.04381e+02 32.524  6.21155e+00  3.96089e+00  0.00000e+00 0.00000e+00 2.98062e+01 32.524  7.45748e+01 212.524 0.9294 
1 1 1 5   80  14 o 13 4.30160e+00 1.30989e+00 7.09984e+01 120.570 -2.88879e+00 4.89050e+00  0.00000e+00 0.00000e+00 7.41490e+01 120.570 3.15062e+00 120.570 0.9071 
1 1 1 5   81  0  o 10 1.40239e+01 5.87698e-01 2.06554e+02 60.588  1.50183e+01  2.66397e+01  0.00000e+00 0.00000e+00 3.08038e+02 60.588  1.01485e+02 60.588  0.9835 
1 1 1 5   81  1  o 7  1.73587e+01 4.99761e-01 3.07387e+02 249.382 -2.12044e+01 -5.63602e+01 0.00000e+00 0.00000e+00 3.34959e+02 249.382 2.75718e+01 249.382 0.9917 
1 1 1 5   81  2  o 13 9.33562e+00 5.43381e-01 1.51648e+02 355.266 1.51743e+01  -1.25658e+00 0.00000e+00 0.00000e+00 1.85110e+02 355.266 3.34624e+01 355.266 0.9666 
1 1 1 5   81  3  o 12 8.77592e+00 5.75092e-01 1.35722e+02 28.525  1.20304e+01  6.53873e+00  0.00000e+00 0.00000e+00 1.79610e+02 28.525  4.38874e+01 28.525  0.9628 
1 1 1 5   81  4  o 1  3.50383e+00 7.35491e-01 7.99636e+01 174.530 -3.53594e+00 3.38586e-01  0.00000e+00 0.00000e+00 3.03740e+01 174.530 4.95896e+01 354.530 0.8438 
1 1 1 5   81  5  o 19 3.04026e+00 8.12525e-01 6.15142e+01 87.476  1.04427e-01  2.36924e+00  0.00000e+00 0.00000e+00 2.36089e+01 87.476  3.79053e+01 267.476 0.7503 
1 1 1 5   81  6  o 13 1.07945e+01 6.51246e-01 1.52167e+02 220.889 -1.68970e+01 -1.46309e+01 0.00000e+00 0.00000e+00 2.41495e+02 220.889 8.93279e+01 220.889 0.9774 
1 1 1 5   81  7  o 19 3.76928e+00 8.78858e-01 5.02407e+01 240.099 -1.39558e+00 -2.42690e+00 0.00000e+00 0.00000e+00 6.14083e+01 240.099 1.11676e+01 240.099 0.7940 
1 1 1 5   81  8  o 10 5.13112e+00 1.02371e+00 1.08213e+02 159.833 -7.28115e+00 2.67413e+00  0.00000e+00 0.00000e+00 7.03586e+01 159.833 3.78543e+01 339.833 0.9331 
1 1 1 5   81  9  o 3  6.69521e+00 1.06671e+00 1.14429e+02 101.436 -2.22522e+00 1.10004e+01  0.00000e+00 0.00000e+00 1.23803e+02 101.436 9.37368e+00 101.436 0.9544 
1 1 1 5   81  10 o 1  4.85845e+00 1.17158e+00 8.95920e+01 59.836  2.95073e+00  5.07721e+00  0.00000e+00 0.00000e+00 7.52461e+01 59.836  1.43459e+01 239.836 0.9103 
1 1 1 5   81  11 o 7  4.07298e+00 1.15907e+00 1.11110e+02 88.245  2.12080e-01  6.92299e+00  0.00000e+00 0.00000e+00 2.91981e+01 88.245  8.19118e+01 268.245 0.9247 
1 1 1 5   81  12 o 16 5.35260e+00 1.36607e+00 1.04378e+02 0.524   8.14928e+00  7.44820e-02  0.00000e+00 0.00000e+00 8.22650e+01 0.524   2.21133e+01 180.524 0.9365 
1 1 1 5   81  13 o 1  3.44303e+00 1.14216e+00 5.64792e+01 201.080 -3.61718e+00 -1.39431e+00 0.00000e+00 0.00000e+00 5.35333e+01 201.080 2.94594e+00 21.080  0.8586 
1 1 1 5   81  14 o 10 6.11071e+00 1.55637e+00 1.14007e+02 151.452 -9.02461e+00 4.90977e+00  0.00000e+00 0.00000e+00 1.01896e+02 151.452 1.21113e+01 331.452 0.9500 
1 1 1 5   82  0  o 6  8.28873e+00 7.13296e-01 9.42436e+01 60.270  3.99444e+00  6.99458e+00  0.00000e+00 0.00000e+00 1.95049e+02 60.270  1.00806e+02 60.270  0.9357 
1 1 1 5   82  1  o 6  1.28206e+01 4.93448e-01 2.10410e+02 2.435   3.10168e+01  1.31919e+00  0.00000e+00 0.00000e+00 2.60119e+02 2.435   4.97092e+01 2.435   0.9838 
1 1 1 5   82  2  o 6  1.29001e+01 5.04251e-01 3.11759e+02 2.191   4.30796e+01  1.64781e+00  0.00000e+00 0.00000e+00 1.63941e+02 2.191   1.47818e+02 182.190 0.9883 
1 1 1 5   82  3  o 14 1.30104e+01 5.21453e-01 2.34682e+02 218.423 -3.09385e+01 -2.45418e+01 0.00000e+00 0.00000e+00 2.44589e+02 218.423 9.90742e+00 218.423 0.9873 
1 1 1 5   82  4  o 4  4.54421e+00 8.18634e-01 1.68960e+02 10.769  9.23777e+00  1.75705e+00  0.00000e+00 0.00000e+00 8.69055e+00 190.769 1.77650e+02 190.769 0.9452 
1 1 1 5   82  5  o 14 1.26084e+01 5.66889e-01 2.77967e+02 121.121 -2.55721e+01 4.23566e+01  0.00000e+00 0.00000e+00 1.87670e+02 121.121 9.02969e+01 301.121 0.9898 
1 1 1 5   82  6  o 8  6.46481e+00 8.43309e-01 1.66283e+02 281.900 2.89958e+00  -1.37594e+01 0.00000e+00 0.00000e+00 6.61445e+01 281.900 1.00139e+02 101.900 0.9638 
1 1 1 5   82  7  o 10 1.09176e+01 6.97345e-01 1.60257e+02 85.910  1.96339e+00  2.74609e+01  0.00000e+00 0.00000e+00 2.39477e+02 85.910  7.92200e+01 85.910  0.9817 
1 1 1 5   82  8  o 17 4.34105e+00 8.85932e-01 1.07567e+02 69.818  2.25542e+00  6.13608e+00  0.00000e+00 0.00000e+00 4.13480e+01 69.818  6.62187e+01 249.818 0.9200 
1 1 1 5   82  9  o 11 4.37333e+00 1.02308e+00 3.67236e+01 340.833 2.31490e+00  -8.04648e-01 0.00000e+00 0.00000e+00 8.70956e+01 340.833 5.03720e+01 340.833 0.7595 
1 1 1 5   82  10 o 16 4.80404e+00 1.05273e+00 7.05665e+01 102.925 -1.18492e+00 5.16325e+00  0.00000e+00 0.00000e+00 9.05139e+01 102.925 1.99474e+01 102.925 0.8999 
1 1 1 5   82  11 o 15 3.94197e+00 1.12517e+00 6.17843e+01 218.258 -3.15168e+00 -2.48527e+00 0.00000e+00 0.00000e+00 6.50754e+01 218.258 3.29110e+00 218.258 0.8640 
1 1 1 5   82  12 o 2  4.05356e+00 1.23468e+00 1.01366e+02 207.678 -5.77940e+00 -3.03150e+00 0.00000e+00 0.00000e+00 3.74377e+01 207.678 6.39278e+01 27.679  0.9198 
1 1 1 5   82  13 o 2  5.74985e+00 1.49891e+00 9.63480e+01 314.504 5.69257e+00  -5.79190e+00 0.00000e+00 0.00000e+00 1.03940e+02 314.504 7.59236e+00 314.504 0.9362 
1 1 1 5   82  14 o 1  3.59149e+00 1.17814e+00 6.77625e+01 181.646 -5.22150e+00 -1.50044e-01 0.00000e+00 0.00000e+00 5.22009e+01 181.646 1.55616e+01 1.646   0.8983 
1 1 1 5   83  0  o 3  1.23365e+01 4.80184e-01 2.28352e+02 44.365  2.16859e+01  2.12104e+01  0.00000e+00 0.00000e+00 2.24053e+02 44.365  4.29904e+00 224.365 0.9834 
1 1 1 5   83  1  o 17 2.27480e+01 5.27868e-01 4.03281e+02 215.427 -8.67801e+01 -6.17321e+01 0.00000e+00 0.00000e+00 4.41194e+02 215.427 3.79123e+01 215.427 0.9953 
1 1 1 5   83  2  o 16 8.87639e+00 5.45213e-01 1.87978e+02 316.273 1.46326e+01  -1.39961e+01 0.00000e+00 0.00000e+00 1.34853e+02 316.273 5.31252e+01 136.274 0.9750 
1 1 1 5   83  3  o 13 6.43389e+00 6.70253e-01 1.92034e+02 284.633 4.03516e+00  -1.54549e+01 0.00000e+00 0.00000e+00 4.03398e+01 284.633 1.51694e+02 104.633 0.9682 
1 1 1 5   83  4  o 11 7.55291e+00 6.43550e-01 1.81048e+02 334.779 1.66431e+01  -7.83923e+00 0.00000e+00 0.00000e+00 9.29375e+01 334.779 8.81109e+01 154.779 0.9724 
1 1 1 5   83  5  o 4  6.09624e+00 7.93247e-01 9.82405e+01 253.944 -2.25245e+00 -7.82624e+00 0.00000e+00 0.00000e+00 1.14701e+02 253.944 1.64600e+01 253.944 0.9364 
1 1 1 5   83  6  o 13 4.81253e+00 8.50224e-01 1.06963e+02 247.557 -2.64260e+00 -6.39773e+00 0.00000e+00 0.00000e+00 5.90022e+01 247.557 4.79606e+01 67.557  0.9247 
1 1 1 5   83  7  o 3  3.65677e+00 9.33825e-01 6.59298e+01 344.949 3.28047e+00  -8.82102e-01 0.00000e+00 0.00000e+00 4.80017e+01 344.949 1.79281e+01 164.949 0.8355 
1 1 1 5   83  8  o 15 7.52321e+00 8.53447e-01 1.51725e+02 128.745 -1.05341e+01 1.31277e+01  0.00000e+00 0.00000e+00 1.20273e+02 128.745 3.14524e+01 308.745 0.9698 
1 1 1 5   83  9  o 15 7.13194e+00 9.40645e-01 1.30093e+02 244.779 -6.47872e+00 -1.37549e+01 0.00000e+00 0.00000e+00 1.26802e+02 244.779 3.29017e+00 64.779  0.9665 
1 1 1 5   83  10 o 5  1.18411e+01 8.73064e-01 1.87201e+02 308.040 2.46574e+01  -3.15143e+01 0.00000e+00 0.00000e+00 2.48373e+02 308.040 6.11711e+01 308.040 0.9874 
1 1 1 5   83  11 o 8  4.82432e+00 1.23300e+00 6.95775e+01 114.887 -2.18210e+00 4.70370e+00  0.00000e+00 0.00000e+00 9.16538e+01 114.887 2.20763e+01 114.887 0.8975 
1 1 1 5   83  12 o 1  6.47111e+00 1.28987e+00 8.13114e+01 343.046 7.72072e+00  -2.35363e+00 0.00000e+00 0.00000e+00 1.44079e+02 343.046 6.27671e+01 343.046 0.9358 
1 1 1 5   83  13 o 10 4.33862e+00 1.29716e+00 4.06707e+01 95.378  -2.89628e-01 3.07662e+00  0.00000e+00 0.00000e+00 9.10910e+01 95.378  5.04203e+01 95.378  0.8164 
1 1 1 5   83  14 o 6  2.63463e+00 9.28623e-01 4.64295e+01 11.823  3.43607e+00  7.19265e-01  0.00000e+00 0.00000e+00 3.60023e+01 11.823  1.04272e+01 191.823 0.8417 
1 1 1 5   84  0  o 6  1.38461e+01 4.76576e-01 1.97333e+02 276.178 3.62457e+00  -3.34853e+01 0.00000e+00 0.00000e+00 3.11177e+02 276.178 1.13843e+02 276.178 0.9850 
1 1 1 5   84  1  o 10 4.21133e+00 7.59169e-01 8.65094e+01 319.588 3.33826e+00  -2.84229e+00 0.00000e+00 0.00000e+00 5.11885e+01 319.588 3.53210e+01 139.588 0.8768 
1 1 1 5   84  2  o 4  5.71933e+00 7.07758e-01 1.66761e+02 279.428 1.99520e+00  -1.20155e+01 0.00000e+00 0.00000e+00 3.75831e+01 279.428 1.29178e+02 99.428  0.9580 
1 1 1 5   84  3  o 2  3.58120e+00 8.32637e-01 4.80790e+01 291.308 7.20377e-01  -1.84690e+00 0.00000e+00 0.00000e+00 4.47304e+01 291.308 3.34859e+00 111.308 0.6949 
1 1 1 5   84  4  o 11 1.51196e+01 5.40252e-01 2.96509e+02 130.400 -4.12992e+01 4.85258e+01  0.00000e+00 0.00000e+00 2.62941e+02 130.400 3.35679e+01 310.400 0.9921 
1 1 1 5   84  5  o 13 3.05582e+00 8.18142e-01 1.07342e+02 295.395 1.86044e+00  -3.91893e+00 0.00000e+00 0.00000e+00 7.58500e+00 115.395 1.14927e+02 115.395 0.8754 
1 1 1 5   84  6  o 12 8.76256e+00 7.65087e-01 1.56089e+02 267.469 -9.40551e-01 -2.12748e+01 0.00000e+00 0.00000e+00 1.62880e+02 267.469 6.79067e+00 267.469 0.9762 
1 1 1 5   84  7  o 5  1.54083e+01 6.29972e-01 1.99446e+02 92.652  -2.39163e+00 5.16317e+01  0.00000e+00 0.00000e+00 3.69399e+02 92.652  1.69953e+02 92.652  0.9903 
1 1 1 5   84  8  o 9  3.81634e+00 9.74363e-01 7.71185e+01 275.574 4.10455e-01  -4.20605e+00 0.00000e+00 0.00000e+00 4.68681e+01 275.574 3.02504e+01 95.574  0.8717 
1 1 1 5   84  9  o 18 5.15329e+00 1.07609e+00 1.07631e+02 282.553 1.79794e+00  -8.07448e+00 0.00000e+00 0.00000e+00 7.23657e+01 282.553 3.52653e+01 102.553 0.9375 
1 1 1 5   84  10 o 1  4.38612e+00 1.13637e+00 7.97955e+01 191.497 -5.11295e+00 -1.03994e+00 0.00000e+00 0.00000e+00 6.69344e+01 191.497 1.28612e+01 11.497  0.8982 
1 1 1 5   84  11 o 2  5.22531e+00 1.18122e+00 3.81530e+01 103.661 -7.53353e-01 3.09943e+00  0.00000e+00 0.00000e+00 1.21962e+02 103.661 8.38090e+01 103.661 0.8231 
1 1 1 5   84  12 o 18 7.85825e+00 1.33473e+00 1.63517e+02 11.186  1.94848e+01  3.85322e+00  0.00000e+00 0.00000e+00 1.21428e+02 11.186  4.20889e+01 191.186 0.9745 
1 1 1 5   84  13 o 13 4.99982e+00 1.31321e+00 8.59929e+01 236.323 -4.07632e+00 -6.11747e+00 0.00000e+00 0.00000e+00 8.67914e+01 236.323 7.98466e-01 236.323 0.9293 
1 1 1 5   84  14 o 7  3.21422e+00 1.08500e+00 4.83371e+01 246.792 -1.51375e+00 -3.53052e+00 0.00000e+00 0.00000e+00 5.40552e+01 246.792 5.71816e+00 246.792 0.8571 
1 1 1 5   85  0  o 13 1.53726e+01 4.78236e-01 2.71407e+02 313.844 3.94504e+01  -4.10749e+01 0.00000e+00 0.00000e+00 2.96552e+02 313.844 2.51455e+01 313.844 0.9912 
1 1 1 5   85  1  o 2  5.92058e+00 6.88930e-01 1.12576e+02 40.042  6.54249e+00  5.49804e+00  0.00000e+00 0.00000e+00 9.48037e+01 40.042  1.77726e+01 220.042 0.9395 
1 1 1 5   85  2  o 7  6.26763e+00 6.61559e-01 6.88894e+01 141.102 -4.09391e+00 3.30311e+00  0.00000e+00 0.00000e+00 1.41220e+02 141.102 7.23307e+01 141.102 0.8991 
1 1 1 5   85  3  o 5  5.48659e+00 7.08869e-01 8.60480e+01 204.046 -5.43048e+00 -2.42300e+00 0.00000e+00 0.00000e+00 1.00431e+02 204.046 1.43827e+01 204.046 0.9115 
1 1 1 5   85  4  o 5  1.23999e+01 5.59012e-01 2.57902e+02 212.291 -3.99372e+01 -2.52381e+01 0.00000e+00 0.00000e+00 1.99533e+02 212.291 5.83687e+01 32.291  0.9894 
1 1 1 5   85  5  o 19 2.01555e+01 5.69395e-01 3.29635e+02 24.978  9.00227e+01  4.19357e+01  0.00000e+00 0.00000e+00 4.18051e+02 24.978  8.84158e+01 24.978  0.9950 
1 1 1 5   85  6  o 6  6.70359e+00 8.64322e-01 1.70825e+02 133.724 -1.15488e+01 1.20751e+01  0.00000e+00 0.00000e+00 7.14806e+01 133.724 9.93449e+01 313.724 0.9696 
1 1 1 5   85  7  f 0  5.44455e+00 9.31681e-01 1.02781e+02 28.136  7.55702e+00  4.04113e+00  0.00000e+00 0.00000e+00 8.79113e+01 28.136  1.48698e+01 208.136 0.9397 
1 1 1 5   85  8  o 7  4.96375e+00 9.82541e-01 6.24977e+01 187.377 -4.70797e+00 -6.09534e-01 0.00000e+00 0.00000e+00 1.01594e+02 187.377 3.90963e+01 187.377 0.8872 
1 1 1 5   85  9  o 2  6.24145e+00 1.07762e+00 1.25810e+02 53.658  6.62205e+00  9.00109e+00  0.00000e+00 0.00000e+00 9.60261e+01 53.658  2.97838e+01 233.658 0.9541 
1 1 1 5   85  10 o 9  4.29846e+00 1.04606e+00 9.49941e+01 206.852 -5.91571e+00 -2.99503e+00 0.00000e+00 0.00000e+00 5.24458e+01 206.852 4.25483e+01 26.852  0.9212 
1 1 1 5   85  11 o 5  3.64469e+00 1.09584e+00 3.58225e+01 254.257 -6.36081e-01 -2.25637e+00 0.00000e+00 0.00000e+00 6.55045e+01 254.257 2.96820e+01 254.257 0.7469 
1 1 1 5   85  12 o 11 6.11293e+00 1.35274e+00 3.80451e+01 231.435 -2.35173e+00 -2.94967e+00 0.00000e+00 0.00000e+00 1.56199e+02 231.435 1.18154e+02 231.435 0.8542 
1 1 1 5   85  13 o 19 4.43470e+00 1.31884e+00 9.19597e+01 333.080 6.83693e+00  -3.47157e+00 0.00000e+00 0.00000e+00 6.17625e+01 333.080 3.01972e+01 153.080 0.9323 
1 1 1 5   85  14 o 6  3.61034e+00 1.17795e+00 2.99556e+01 53.441  1.41929e+00  1.91396e+00  0.00000e+00 0.00000e+00 7.08745e+01 53.441  4.09189e+01 53.441  0.7516 
1 1 1 5   86  0  o 3  9.75853e+00 5.15981e-01 1.75779e+02 253.389 -6.21319e+00 -2.08278e+01 0.00000e+00 0.00000e+00 1.79418e+02 253.389 3.63880e+00 253.389 0.9767 
1 1 1 5   86  1  o 13 1.28095e+01 5.11078e-01 2.77200e+02 86.130  3.35386e+00  4.95740e+01  0.00000e+00 0.00000e+00 1.95415e+02 86.130  8.17850e+01 266.130 0.9899 
1 1 1 5   86  2  f 0  5.16660e+00 7.57515e-01 9.16779e+01 247.036 -2.28945e+00 -5.40297e+00 0.00000e+00 0.00000e+00 8.36324e+01 247.036 8.04546e+00 67.036  0.9103 
1 1 1 5   86  3  o 16 4.00966e+00 7.99229e-01 6.29994e+01 160.103 -3.10668e+00 1.12440e+00  0.00000e+00 0.00000e+00 6.10889e+01 160.103 1.91045e+00 340.103 0.8302 
1 1 1 5   86  4  o 16 1.11366e+01 5.62695e-01 2.68710e+02 18.905  4.09601e+01  1.40277e+01  0.00000e+00 0.00000e+00 1.41618e+02 18.905  1.27092e+02 198.905 0.9884 
1 1 1 5   86  5  f 0  2.58842e+00 7.44871e-01 7.69026e+01 182.132 -3.12544e+00 -1.16332e-01 0.00000e+00 0.00000e+00 2.11723e+00 182.132 7.47854e+01 2.132   0.8190 
1 1 1 5   86  6  o 4  7.67147e+00 7.94156e-01 1.23024e+02 199.833 -1.33291e+01 -4.80754e+00 0.00000e+00 0.00000e+00 1.52613e+02 199.833 2.95891e+01 199.833 0.9640 
1 1 1 5   86  7  o 7  5.76545e+00 9.09962e-01 1.38596e+02 263.416 -1.44626e+00 -1.25304e+01 0.00000e+00 0.00000e+00 6.75422e+01 263.416 7.10535e+01 83.416  0.9595 
1 1 1 5   86  8  o 13 1.01828e+01 7.60770e-01 1.51898e+02 37.359  2.03853e+01  1.55627e+01  0.00000e+00 0.00000e+00 2.19977e+02 37.359  6.80793e+01 37.359  0.9803 
1 1 1 5   86  9  o 19 1.02754e+01 8.04969e-01 1.87705e+02 222.512 -2.52695e+01 -2.31653e+01 0.00000e+00 0.00000e+00 1.89343e+02 222.512 1.63857e+00 222.512 0.9853 
1 1 1 5   86  10 o 16 4.89586e+00 1.16693e+00 2.01667e+01 216.654 -1.21991e+00 -9.07773e-01 0.00000e+00 0.00000e+00 8.94057e+01 216.654 6.92390e+01 216.654 0.6012 
1 1 1 5   86  11 o 4  2.87249e+00 9.48749e-01 9.31549e+01 290.358 1.85004e+00  -4.98585e+00 0.00000e+00 0.00000e+00 3.07375e+00 290.358 9.00812e+01 110.358 0.9003 
1 1 1 5   86  12 o 4  3.55185e+00 1.08482e+00 6.73783e+01 43.009  3.66064e+00  3.41469e+00  0.00000e+00 0.00000e+00 5.06580e+01 43.009  1.67204e+01 223.009 0.8935 
1 1 1 5   86  13 o 10 6.97708e+00 1.45602e+00 8.24168e+01 311.707 6.07012e+00  -6.81128e+00 0.00000e+00 0.00000e+00 1.62277e+02 311.707 7.98607e+01 311.707 0.9435 
1 1 1 5   86  14 o 4  3.30686e+00 1.09529e+00 6.30693e+01 109.140 -1.67395e+00 4.82322e+00  0.00000e+00 0.00000e+00 4.69715e+01 109.140 1.60979e+01 289.140 0.8958 
1 1 1 5   87  0  o 2  9.31757e+00 5.24609e-01 1.72290e+02 149.940 -1.84782e+01 1.06942e+01  0.00000e+00 0.00000e+00 1.66628e+02 149.940 5.66208e+00 329.940 0.9763 
1 1 1 5   87  1  o 7  1.08120e+01 5.36305e-01 2.31693e+02 255.921 -8.67214e+00 -3.45785e+01 0.00000e+00 0.00000e+00 1.65512e+02 255.921 6.61809e+01 75.921  0.9859 
1 1 1 5   87  2  o 13 6.07982e+00 6.60879e-01 1.19988e+02 335.026 9.09654e+00  -4.23680e+00 0.00000e+00 0.00000e+00 9.49892e+01 335.026 2.49990e+01 155.026 0.9488 
1 1 1 5   87  3  o 10 3.66673e+00 8.21011e-01 1.16287e+02 150.805 -4.91959e+00 2.74894e+00  0.00000e+00 0.00000e+00 7.56565e+00 150.805 1.08721e+02 330.805 0.9063 
1 1 1 5   87  4  o 11 4.40791e+00 8.25613e-01 7.45714e+01 29.477  3.88617e+00  2.19667e+00  0.00000e+00 0.00000e+00 6.98739e+01 29.477  4.69750e+00 209.477 0.8793 
1 1 1 5   87  5  o 10 2.05785e+00 6.61107e-01 4.11021e+01 265.513 -1.05473e-01 -1.34419e+00 0.00000e+00 0.00000e+00 1.56293e+00 265.513 3.95392e+01 85.513  0.5563 
1 1 1 5   87  6  o 17 4.49605e+00 9.10037e-01 1.11299e+02 336.762 6.79955e+00  -2.91965e+00 0.00000e+00 0.00000e+00 4.44608e+01 336.762 6.68381e+01 156.762 0.9297 
1 1 1 5   87  7  o 5  3.58937e+00 9.28949e-01 6.58352e+01 131.121 -2.46293e+00 2.82118e+00  0.00000e+00 0.00000e+00 4.82202e+01 131.121 1.76150e+01 311.121 0.8529 
1 1 1 5   87  8  o 10 5.19425e+00 1.08764e+00 1.41494e+02 126.635 -6.84164e+00 9.20053e+00  0.00000e+00 0.00000e+00 4.33243e+01 126.635 9.81699e+01 306.635 0.9553 
1 1 1 5   87  9  o 18 6.76939e+00 1.01302e+00 1.71206e+02 271.016 3.13997e-01  -1.77143e+01 0.00000e+00 0.00000e+00 7.36180e+01 271.016 9.75878e+01 91.015  0.9714 
1 1 1 5   87  10 o 8  2.79299e+00 9.08155e-01 5.02848e+01 4.288   2.64279e+00  1.98143e-01  0.00000e+00 0.00000e+00 3.08384e+01 4.288   1.94464e+01 184.288 0.7804 
1 1 1 5   87  11 o 19 8.26290e+00 1.19319e+00 1.42930e+02 133.382 -1.33807e+01 1.41585e+01  0.00000e+00 0.00000e+00 1.56472e+02 133.382 1.35419e+01 133.382 0.9740 
1 1 1 5   87  12 o 12 6.12380e+00 1.29667e+00 8.84681e+01 305.738 5.48204e+00  -7.61845e+00 0.00000e+00 0.00000e+00 1.26742e+02 305.738 3.82740e+01 305.738 0.9451 
1 1 1 5   87  13 f 0  4.28009e+00 1.19159e+00 6.59437e+01 211.170 -5.21862e+00 -3.15676e+00 0.00000e+00 0.00000e+00 7.94169e+01 211.170 1.34732e+01 211.170 0.9139 
1 1 1 5   88  0  o 1  1.08883e+01 4.98986e-01 2.01170e+02 73.237  9.12465e+00  3.02924e+01  0.00000e+00 0.00000e+00 1.97940e+02 73.237  3.23001e+00 253.237 0.9841 
1 1 1 5   88  1  o 12 9.41611e+00 5.65583e-01 1.93281e+02 275.094 2.38201e+00  -2.67187e+01 0.00000e+00 0.00000e+00 1.50913e+02 275.094 4.23681e+01 95.095  0.9812 
1 1 1 5   88  2  o 8  6.67188e+00 6.53787e-01 1.10251e+02 86.390  6.27675e-01  9.94823e+00  0.00000e+00 0.00000e+00 1.25516e+02 86.390  1.52652e+01 86.390  0.9484 
1 1 1 5   88  3  o 18 4.47621e+00 7.99073e-01 1.11813e+02 249.256 -2.43693e+00 -6.43413e+00 0.00000e+00 0.00000e+00 4.23261e+01 249.256 6.94871e+01 69.256  0.9242 
1 1 1 5   88  4  o 15 8.61847e+00 6.29268e-01 2.16159e+02 245.062 -1.29325e+01 -2.78124e+01 0.00000e+00 0.00000e+00 9.96892e+01 245.062 1.16469e+02 65.062  0.9836 
1 1 1 5   88  5  o 4  4.25355e+00 8.14560e-01 8.19743e+01 322.785 4.13241e+00  -3.13835e+00 0.00000e+00 0.00000e+00 6.02731e+01 322.785 2.17011e+01 142.785 0.8976 
1 1 1 5   88  6  o 8  1.08665e+01 6.40912e-01 1.99762e+02 287.591 1.06168e+01  -3.34862e+01 0.00000e+00 0.00000e+00 1.99238e+02 287.591 5.24490e-01 107.591 0.9857 
1 1 1 5   88  7  o 16 1.71344e+01 6.25177e-01 2.89668e+02 154.590 -8.41197e+01 3.99615e+01  0.00000e+00 0.00000e+00 3.45072e+02 154.590 5.54043e+01 154.590 0.9946 
1 1 1 5   88  8  o 10 3.30266e+00 1.03994e+00 1.45541e+02 297.960 3.27960e+00  -6.17838e+00 0.00000e+00 0.00000e+00 3.17291e+01 117.960 1.77270e+02 117.960 0.9255 
1 1 1 5   88  9  o 7  1.34666e+01 7.50688e-01 2.19196e+02 116.738 -2.52969e+01 5.02153e+01  0.00000e+00 0.00000e+00 2.77606e+02 116.738 5.84099e+01 116.738 0.9911 
1 1 1 5   88  10 o 17 4.74972e+00 1.15872e+00 9.54701e+01 286.581 2.10318e+00  -7.06353e+00 0.00000e+00 0.00000e+00 6.87964e+01 286.581 2.66737e+01 106.581 0.9294 
1 1 1 5   88  11 o 9  3.97372e+00 1.11389e+00 8.15826e+01 264.857 -5.32636e-01 -5.91743e+00 0.00000e+00 0.00000e+00 5.31245e+01 264.857 2.84581e+01 84.857  0.9114 
1 1 1 5   88  12 o 17 4.26382e+00 1.22402e+00 5.76757e+01 126.969 -2.68023e+00 3.56085e+00  0.00000e+00 0.00000e+00 8.16590e+01 126.969 2.39833e+01 126.969 0.8790 
1 1 1 5   88  13 o 13 3.04720e+00 1.02386e+00 7.79838e+01 272.929 3.17144e-01  -6.19870e+00 0.00000e+00 0.00000e+00 2.56599e+01 272.929 5.23239e+01 92.929  0.9155 
1 1 1 5   89  0  o 13 3.07044e+00 7.57464e-01 4.17234e+01 341.756 1.64784e+00  -5.43169e-01 0.00000e+00 0.00000e+00 3.24960e+01 341.756 9.22742e+00 161.756 0.6491 
1 1 1 5   89  1  o 17 7.88683e+00 5.78263e-01 1.42071e+02 161.807 -1.53234e+01 5.03586e+00  0.00000e+00 0.00000e+00 1.42424e+02 161.807 3.52813e-01 161.807 0.9685 
1 1 1 5   89  2  o 17 8.53186e+00 5.84569e-01 1.49818e+02 350.323 1.87431e+01  -3.19588e+00 0.00000e+00 0.00000e+00 1.59519e+02 350.323 9.70106e+00 350.323 0.9733 
1 1 1 5   89  3  o 18 8.06819e+00 6.38047e-01 1.33902e+02 160.754 -1.67488e+01 5.84765e+00  0.00000e+00 0.00000e+00 1.58054e+02 160.754 2.41522e+01 160.754 0.9714 
1 1 1 5   89  4  f 0  5.02160e+00 7.96920e-01 3.77077e+01 287.154 8.34340e-01  -2.70306e+00 0.00000e+00 0.00000e+00 1.11285e+02 287.154 7.35777e+01 287.154 0.7965 
1 1 1 5   89  5  f 0  8.19240e+00 6.99273e-01 2.19693e+02 333.259 2.62238e+01  -1.32125e+01 0.00000e+00 0.00000e+00 8.02203e+01 333.259 1.39472e+02 153.259 0.9828 
1 1 1 5   89  6  o 6  3.85031e+00 8.66714e-01 1.17790e+02 144.223 -5.58553e+00 4.02503e+00  0.00000e+00 0.00000e+00 1.47427e+01 144.223 1.03047e+02 324.223 0.9242 
1 1 1 5   89  7  o 11 8.84933e+00 7.53329e-01 1.40192e+02 222.794 -1.65221e+01 -1.52965e+01 0.00000e+00 0.00000e+00 1.81921e+02 222.794 4.17289e+01 222.794 0.9775 
1 1 1 5   89  8  o 17 5.01776e+00 1.09470e+00 5.10982e+01 301.906 2.03858e+00  -3.27433e+00 0.00000e+00 0.00000e+00 1.09133e+02 301.906 5.80347e+01 301.906 0.8578 
1 1 1 5   89  9  o 15 7.01176e+00 1.02161e+00 1.06258e+02 19.559  1.17316e+01  4.16803e+00  0.00000e+00 0.00000e+00 1.43974e+02 19.559  3.77154e+01 19.559  0.9590 
1 1 1 5   89  10 o 6  9.13532e+00 1.02614e+00 1.57249e+02 252.963 -7.94784e+00 -2.59365e+01 0.00000e+00 0.00000e+00 1.76268e+02 252.963 1.90195e+01 252.963 0.9814 
1 1 1 5   89  11 o 5  4.39482e+00 1.17083e+00 8.51845e+01 359.637 7.05578e+00  -4.46657e-02 0.00000e+00 0.00000e+00 6.61658e+01 359.637 1.90187e+01 179.637 0.9262 
1 1 1 5   89  12 o 6  6.83682e+00 1.38420e+00 1.27738e+02 185.385 -1.42873e+01 -1.34683e+00 0.00000e+00 0.00000e+00 1.17338e+02 185.385 1.03992e+01 5.385   0.9645 
1 1 1 5   89  13 o 3  6.29323e+00 1.36277e+00 1.48566e+02 28.188  1.55301e+01  8.32308e+00  0.00000e+00 0.00000e+00 7.84616e+01 28.188  7.01042e+01 208.188 0.9712 
1 1 1 5   90  0  o 10 7.26255e+00 5.88135e-01 1.13837e+02 15.374  1.18371e+01  3.25477e+00  0.00000e+00 0.00000e+00 1.45292e+02 15.374  3.14555e+01 15.374  0.9584 
1 1 1 5   90  1  o 17 1.32003e+01 5.28441e-01 3.07253e+02 258.960 -1.17382e+01 -6.01609e+01 0.00000e+00 0.00000e+00 1.80257e+02 258.960 1.26995e+02 78.960  0.9918 
1 1 1 5   90  2  o 2  4.49410e+00 7.55168e-01 4.85993e+01 153.338 -3.05223e+00 1.53261e+00  0.00000e+00 0.00000e+00 9.14105e+01 153.338 4.28112e+01 153.338 0.8366 
1 1 1 5   90  3  o 7  2.11648e+00 6.70979e-01 5.64634e+01 31.308  1.62133e+00  9.86088e-01  0.00000e+00 0.00000e+00 2.84554e+00 211.308 5.93089e+01 211.308 0.6802 
1 1 1 5   90  4  o 6  1.26433e+01 6.33442e-01 2.46948e+02 200.988 -4.68225e+01 -1.79619e+01 0.00000e+00 0.00000e+00 2.19199e+02 200.988 2.77489e+01 20.988  0.9900 
1 1 1 5   90  5  o 13 6.55245e+00 7.84335e-01 1.33682e+02 343.417 1.38285e+01  -4.11804e+00 0.00000e+00 0.00000e+00 1.01714e+02 343.417 3.19679e+01 163.417 0.9647 
1 1 1 5   90  6  o 13 1.17482e+01 6.64795e-01 1.97171e+02 181.367 -4.16964e+01 -9.95098e-01 0.00000e+00 0.00000e+00 2.34990e+02 181.367 3.78192e+01 181.367 0.9879 
1 1 1 5   90  7  o 6  3.68543e+00 9.62043e-01 5.86895e+01 71.148  1.11427e+00  3.26339e+00  0.00000e+00 0.00000e+00 5.63317e+01 71.148  2.35782e+00 251.148 0.8384 
1 1 1 5   90  8  o 1  5.40067e+00 1.17921e+00 7.26727e+01 88.519  1.40599e-01  5.43761e+00  0.00000e+00 0.00000e+00 1.08763e+02 88.519  3.60901e+01 88.519  0.9027 
1 1 1 5   90  9  o 19 4.77476e+00 1.03389e+00 1.18892e+02 335.759 9.06439e+00  -4.08143e+00 0.00000e+00 0.00000e+00 4.95693e+01 335.759 6.93226e+01 155.759 0.9483 
1 1 1 5   90  10 o 17 4.94222e+00 1.15154e+00 8.77947e+01 139.115 -5.63005e+00 4.87426e+00  0.00000e+00 0.00000e+00 8.31859e+01 139.115 4.60876e+00 319.115 0.9302 
1 1 1 5   90  11 o 15 9.15557e+00 1.11672e+00 1.69551e+02 355.837 3.15511e+01  -2.29649e+00 0.00000e+00 0.00000e+00 1.65386e+02 355.837 4.16469e+00 175.837 0.9841 
1 1 1 5   90  12 o 1  3.26774e+00 1.02947e+00 5.62263e+01 218.750 -3.44660e+00 -2.76617e+00 0.00000e+00 0.00000e+00 5.03681e+01 218.750 5.85829e+00 38.750  0.8779 
1 1 1 5   90  13 o 8  3.22736e+00 1.06258e+00 3.14347e+01 304.741 1.42462e+00  -2.05424e+00 0.00000e+00 0.00000e+00 6.02488e+01 304.741 2.88142e+01 304.741 0.7650 
1 1 1 5   91  0  o 16 8.41470e+00 5.78090e-01 1.16996e+02 307.222 9.99426e+00  -1.31565e+01 0.00000e+00 0.00000e+00 1.86577e+02 307.222 6.95816e+01 307.222 0.9692 
1 1 1 5   91  1  o 17 3.42251e+00 7.51772e-01 7.87203e+01 66.298  1.69423e+00  3.85925e+00  0.00000e+00 0.00000e+00 3.22933e+01 66.298  4.64270e+01 246.298 0.8713 
1 1 1 5   91  2  o 4  7.20876e+00 6.58505e-01 1.27668e+02 5.227   1.46219e+01  1.33777e+00  0.00000e+00 0.00000e+00 1.31418e+02 5.227   3.74976e+00 5.227   0.9653 
1 1 1 5   91  3  o 2  3.43542e+00 8.56786e-01 8.85463e+01 101.586 -8.91666e-01 4.34938e+00  0.00000e+00 0.00000e+00 2.38291e+01 101.586 6.47171e+01 281.586 0.8785 
1 1 1 5   91  4  o 19 1.66983e+01 7.48483e-01 2.66834e+02 213.292 -5.54070e+01 -3.63849e+01 0.00000e+00 0.00000e+00 3.50186e+02 213.292 8.33521e+01 213.292 0.9924 
1 1 1 5   91  5  o 1  3.78140e+00 8.99406e-01 6.52781e+01 76.648  9.03003e-01  3.80441e+00  0.00000e+00 0.00000e+00 5.57909e+01 76.648  9.48722e+00 256.648 0.8600 
1 1 1 5   91  6  o 15 6.82696e+00 8.26380e-01 1.57150e+02 14.395  1.67074e+01  4.28808e+00  0.00000e+00 0.00000e+00 8.95046e+01 14.395  6.76451e+01 194.395 0.9706 
1 1 1 5   91  7  o 14 9.95124e+00 7.44814e-01 2.17593e+02 151.828 -3.23523e+01 1.73270e+01  0.00000e+00 0.00000e+00 1.47689e+02 151.828 6.99044e+01 331.828 0.9863 
1 1 1 5   91  8  o 13 4.74661e+00 1.11301e+00 1.31152e+02 345.725 9.27624e+00  -2.36008e+00 0.00000e+00 0.00000e+00 3.59643e+01 345.725 9.51876e+01 165.725 0.9462 
1 1 1 5   91  9  o 1  1.26856e+01 7.80560e-01 2.08196e+02 164.372 -5.31052e+01 1.48554e+01  0.00000e+00 0.00000e+00 2.59364e+02 164.372 5.11678e+01 164.372 0.9909 
1 1 1 5   91  10 o 15 3.71207e+00 1.09495e+00 6.92456e+01 338.138 4.22357e+00  -1.69462e+00 0.00000e+00 0.00000e+00 5.24645e+01 338.138 1.67810e+01 158.138 0.8818 
1 1 1 5   91  11 o 18 5.05003e+00 1.28251e+00 7.52462e+01 239.553 -3.37792e+00 -5.74665e+00 0.00000e+00 0.00000e+00 9.77284e+01 239.553 2.24822e+01 239.553 0.9216 
1 1 1 5   91  12 o 8  6.56111e+00 1.26446e+00 8.59388e+01 223.963 -7.72953e+00 -7.45459e+00 0.00000e+00 0.00000e+00 1.46148e+02 223.963 6.02090e+01 223.963 0.9522 
1 1 1 5   91  13 o 11 3.44525e+00 1.11268e+00 3.09297e+01 44.130  1.94836e+00  1.89006e+00  0.00000e+00 0.00000e+00 6.96645e+01 44.130  3.87349e+01 44.130  0.7864 
1 1 1 5   92  0  f 0  2.58307e+01 5.73776e-01 4.32573e+02 67.434  7.05456e+01  1.69762e+02  0.00000e+00 0.00000e+00 5.26014e+02 67.434  9.34403e+01 67.434  0.9973 
1 1 1 5   92  1  o 14 1.33194e+01 5.28215e-01 3.34598e+02 230.989 -4.64849e+01 -5.73818e+01 0.00000e+00 0.00000e+00 1.57757e+02 230.989 1.76841e+02 50.989  0.9932 
1 1 1 5   92  2  o 5  8.37836e+00 5.89044e-01 1.49652e+02 336.369 1.87311e+01  -8.19536e+00 0.00000e+00 0.00000e+00 1.54483e+02 336.369 4.83122e+00 336.369 0.9752 
1 1 1 5   92  3  o 17 9.46069e+00 5.93634e-01 2.11746e+02 194.107 -3.30603e+01 -8.30860e+00 0.00000e+00 0.00000e+00 1.35214e+02 194.107 7.65323e+01 14.107  0.9852 
1 1 1 5   92  4  o 19 3.81264e+00 8.55771e-01 1.11969e+02 344.532 6.06056e+00  -1.67714e+00 0.00000e+00 0.00000e+00 1.81177e+01 344.532 9.38511e+01 164.532 0.9166 
1 1 1 5   92  5  o 18 1.36956e+01 5.99859e-01 2.33885e+02 258.413 -1.19111e+01 -5.80949e+01 0.00000e+00 0.00000e+00 2.71559e+02 258.413 3.76741e+01 258.413 0.9915 
1 1 1 5   92  6  o 5  5.11162e+00 9.72823e-01 1.03509e+02 56.736  4.86315e+00  7.41354e+00  0.00000e+00 0.00000e+00 7.56514e+01 56.736  2.78575e+01 236.736 0.9418 
1 1 1 5   92  7  o 18 4.46877e+00 9.50874e-01 6.04123e+01 91.143  -8.82107e-02 4.41990e+00  0.00000e+00 0.00000e+00 8.55710e+01 91.143  2.51587e+01 91.143  0.8780 
1 1 1 5   92  8  o 11 2.86738e+00 9.18399e-01 2.55771e+01 264.834 -1.17695e-01 -1.30194e+00 0.00000e+00 0.00000e+00 3.25278e+01 264.834 6.95067e+00 264.834 0.5448 
1 1 1 5   92  9  o 18 2.34775e+00 7.76336e-01 2.67614e+01 107.500 -3.91795e-01 1.24261e+00  0.00000e+00 0.00000e+00 2.06901e+01 107.500 6.07135e+00 287.500 0.5435 
1 1 1 5   92  10 o 16 7.85443e+00 1.12891e+00 1.12289e+02 351.077 1.57754e+01  -2.47693e+00 0.00000e+00 0.00000e+00 1.70389e+02 351.077 5.81002e+01 351.077 0.9682 
1 1 1 5   92  11 o 12 5.38663e+00 1.30379e+00 1.16587e+02 271.115 2.12775e-01  -1.09344e+01 0.00000e+00 0.00000e+00 7.41804e+01 271.115 4.24062e+01 91.115  0.9531 
1 1 1 5   92  12 o 17 3.27456e+00 1.05463e+00 7.16665e+01 149.976 -4.89657e+00 2.82982e+00  0.00000e+00 0.00000e+00 3.85918e+01 149.976 3.30747e+01 329.976 0.9066 
1 1 1 5   92  13 o 19 2.61064e+00 9.03254e-01 3.51464e+01 330.810 2.46775e+00  -1.37861e+00 0.00000e+00 0.00000e+00 4.20159e+01 330.810 6.86947e+00 330.810 0.7963 
1 1 1 5   93  0  o 19 7.61887e+00 6.35956e-01 1.62774e+02 334.208 1.78821e+01  -8.64144e+00 0.00000e+00 0.00000e+00 1.13435e+02 334.208 4.93391e+01 154.208 0.9745 
1 1 1 5   93  1  o 2  6.31923e+00 6.69436e-01 5.47321e+01 65.179  2.29774e+00  4.96796e+00  0.00000e+00 0.00000e+00 1.57665e+02 65.179  1.02933e+02 65.179  0.9033 
1 1 1 5   93  2  o 4  3.15894e+00 8.00415e-01 8.58482e+01 70.667  1.39950e+00  3.98903e+00  0.00000e+00 0.00000e+00 1.66261e+01 70.667  6.92221e+01 250.667 0.8717 
1 1 1 5   93  3  o 11 2.70051e+00 7.84261e-01 3.83940e+01 124.448 -9.65754e-01 1.40794e+00  0.00000e+00 0.00000e+00 2.62634e+01 124.448 1.21306e+01 304.448 0.6434 
1 1 1 5   93  4  o 3  6.40155e+00 7.76386e-01 1.36337e+02 116.395 -6.13757e+00 1.23665e+01  0.00000e+00 0.00000e+00 9.30933e+01 116.395 4.32441e+01 296.395 0.9631 
1 1 1 5   93  5  o 4  9.13624e+00 7.07897e-01 1.61113e+02 194.461 -2.42302e+01 -6.24878e+00 0.00000e+00 0.00000e+00 1.71994e+02 194.461 1.08811e+01 194.461 0.9798 
1 1 1 5   93  6  o 4  1.00317e+01 6.86140e-01 1.62275e+02 65.468  1.27329e+01  2.78985e+01  0.00000e+00 0.00000e+00 2.04832e+02 65.468  4.25574e+01 65.468  0.9836 
1 1 1 5   93  7  o 17 8.03536e+00 8.08563e-01 1.35114e+02 21.239  1.72845e+01  6.71766e+00  0.00000e+00 0.00000e+00 1.55619e+02 21.239  2.05054e+01 21.239  0.9727 
1 1 1 5   93  8  o 13 4.73236e+00 1.09365e+00 3.58313e+01 58.793  1.47756e+00  2.43904e+00  0.00000e+00 0.00000e+00 1.04681e+02 58.793  6.88497e+01 58.793  0.7984 
1 1 1 5   93  9  o 10 5.75585e+00 1.11842e+00 8.14337e+01 1.249   8.20096e+00  1.78766e-01  0.00000e+00 0.00000e+00 1.19053e+02 1.249   3.76194e+01 1.249   0.9369 
1 1 1 5   93  10 o 3  8.36903e+00 1.08820e+00 1.90875e+02 150.306 -2.79613e+01 1.59451e+01  0.00000e+00 0.00000e+00 1.15278e+02 150.306 7.55978e+01 330.306 0.9843 
1 1 1 5   93  11 o 10 5.34432e+00 1.26835e+00 9.03805e+01 345.895 8.31265e+00  -2.08868e+00 0.00000e+00 0.00000e+00 9.61778e+01 345.895 5.79725e+00 345.895 0.9397 
1 1 1 5   93  12 o 8  5.97426e+00 1.33184e+00 1.06389e+02 233.798 -6.86271e+00 -9.37614e+00 0.00000e+00 0.00000e+00 1.05656e+02 233.798 7.32716e-01 53.798  0.9559 
1 1 1 5   93  13 o 5  3.64460e+00 1.16017e+00 7.29837e+01 143.897 -5.37503e+00 3.92001e+00  0.00000e+00 0.00000e+00 5.16341e+01 143.897 2.13496e+01 323.897 0.9214 
1 1 1 5   94  0  o 16 9.28838e+00 5.68538e-01 1.63071e+02 61.557  1.23758e+01  2.28478e+01  0.00000e+00 0.00000e+00 1.75675e+02 61.557  1.26049e+01 61.557  0.9806 
1 1 1 5   94  1  o 12 1.23463e+01 5.34926e-01 2.04988e+02 214.031 -3.37284e+01 -2.27768e+01 0.00000e+00 0.00000e+00 2.48606e+02 214.031 4.36188e+01 214.031 0.9876 
1 1 1 5   94  2  o 16 7.11466e+00 6.56967e-01 9.11324e+01 231.490 -7.04130e+00 -8.84880e+00 0.00000e+00 0.00000e+00 1.61567e+02 231.490 7.04346e+01 231.490 0.9547 
1 1 1 5   94  3  o 6  4.21157e+00 8.67901e-01 6.73486e+01 343.457 4.12343e+00  -1.22479e+00 0.00000e+00 0.00000e+00 6.96295e+01 343.457 2.28089e+00 343.457 0.8742 
1 1 1 5   94  4  f 0  8.97534e+00 6.50803e-01 1.27443e+02 149.760 -1.78653e+01 1.04145e+01  0.00000e+00 0.00000e+00 1.98303e+02 149.760 7.08602e+01 149.760 0.9755 
1 1 1 5   94  5  o 14 3.95440e+00 8.74233e-01 4.45238e+01 118.991 -1.51574e+00 2.73549e+00  0.00000e+00 0.00000e+00 7.59567e+01 118.991 3.14329e+01 118.991 0.8190 
1 1 1 5   94  6  o 11 7.91038e+00 8.16149e-01 1.43735e+02 70.006  6.96721e+00  1.91480e+01  0.00000e+00 0.00000e+00 1.43192e+02 70.006  5.42657e-01 250.005 0.9751 
1 1 1 5   94  7  o 16 6.02650e+00 9.31063e-01 1.30445e+02 161.873 -1.30465e+01 4.27105e+00  0.00000e+00 0.00000e+00 8.53538e+01 161.873 4.50911e+01 341.873 0.9629 
1 1 1 5   94  8  o 4  2.56433e+00 8.51040e-01 5.84061e+01 288.777 9.63514e-01  -2.83401e+00 0.00000e+00 0.00000e+00 1.87720e+01 288.777 3.96341e+01 108.777 0.8095 
1 1 1 5   94  9  o 6  8.52245e+00 1.02642e+00 1.64244e+02 116.141 -1.13618e+01 2.31508e+01  0.00000e+00 0.00000e+00 1.46316e+02 116.141 1.79279e+01 296.140 0.9804 
1 1 1 5   94  10 o 11 4.60790e+00 1.14661e+00 8.81414e+01 332.565 7.15624e+00  -3.71497e+00 0.00000e+00 0.00000e+00 7.20634e+01 332.565 1.60780e+01 152.565 0.9358 
1 1 1 5   94  11 o 16 5.29425e+00 1.26824e+00 9.89765e+01 17.695  9.64640e+00  3.07763e+00  0.00000e+00 0.00000e+00 8.76629e+01 17.695  1.13135e+01 197.695 0.9493 
1 1 1 5   94  12 o 12 6.36129e+00 1.31145e+00 1.04319e+02 249.466 -4.48313e+00 -1.19689e+01 0.00000e+00 0.00000e+00 1.22372e+02 249.466 1.80537e+01 249.466 0.9600 
1 1 1 5   95  0  o 14 8.87309e+00 5.61800e-01 1.45441e+02 336.175 1.96355e+01  -8.67063e+00 0.00000e+00 0.00000e+00 1.76709e+02 336.175 3.12679e+01 336.175 0.9764 
1 1 1 5   95  1  o 6  5.15998e+00 7.67891e-01 3.33500e+01 153.341 -2.35498e+00 1.18231e+00  0.00000e+00 0.00000e+00 1.16124e+02 153.341 8.27738e+01 153.341 0.7789 
1 1 1 5   95  2  o 6  9.51247e+00 5.88679e-01 1.72111e+02 306.408 1.66390e+01  -2.25616e+01 0.00000e+00 0.00000e+00 1.75322e+02 306.408 3.21128e+00 306.408 0.9820 
1 1 1 5   95  3  o 15 6.72485e+00 7.42498e-01 1.43154e+02 3.805   1.66718e+01  1.10874e+00  0.00000e+00 0.00000e+00 9.93743e+01 3.805   4.37800e+01 183.805 0.9696 
1 1 1 5   95  4  o 5  1.09576e+01 6.15947e-01 1.66865e+02 98.776  -5.40347e+00 3.50027e+01  0.00000e+00 0.00000e+00 2.34905e+02 98.776  6.80397e+01 98.776  0.9858 
1 1 1 5   95  5  o 10 8.08884e+00 7.29972e-01 1.02334e+02 12.927  1.48695e+01  3.41293e+00  0.00000e+00 0.00000e+00 1.88474e+02 12.927  8.61403e+01 12.927  0.9666 
1 1 1 5   95  6  o 6  3.48062e+00 9.16460e-01 1.01336e+02 264.698 -5.26342e-01 -5.67180e+00 0.00000e+00 0.00000e+00 1.61079e+01 264.698 8.52283e+01 84.698  0.9074 
1 1 1 5   95  7  o 11 5.33028e+00 1.00672e+00 1.05787e+02 61.852  4.55460e+00  8.51293e+00  0.00000e+00 0.00000e+00 8.18302e+01 61.852  2.39564e+01 241.852 0.9467 
1 1 1 5   95  8  o 5  6.29243e+00 1.06007e+00 1.21338e+02 331.589 1.15950e+01  -6.27231e+00 0.00000e+00 0.00000e+00 1.03500e+02 331.589 1.78379e+01 151.589 0.9613 
1 1 1 5   95  9  o 16 5.11885e+00 1.03908e+00 4.28209e+01 153.066 -3.78463e+00 1.92285e+00  0.00000e+00 0.00000e+00 1.23103e+02 153.066 8.02825e+01 153.066 0.8723 
1 1 1 5   95  10 o 1  3.77566e+00 1.09751e+00 1.76464e+01 72.185  4.13811e-01  1.28773e+00  0.00000e+00 0.00000e+00 6.05432e+01 72.185  4.28967e+01 72.185  0.5575 
1 1 1 5   95  11 o 4  2.09380e+00 7.43940e-01 2.11366e+01 279.124 2.12082e-01  -1.32046e+00 0.00000e+00 0.00000e+00 2.18752e+01 279.124 7.38567e-01 279.124 0.5533 
1 1 1 5   95  12 o 2  2.84631e+00 9.50554e-01 4.47772e+01 119.805 -1.79416e+00 3.13221e+00  0.00000e+00 0.00000e+00 4.46486e+01 119.805 1.28607e-01 299.805 0.8466 
1 1 1 5   96  0  o 15 8.22138e+00 6.28429e-01 1.68643e+02 19.289  2.20475e+01  7.71632e+00  0.00000e+00 0.00000e+00 1.30358e+02 19.289  3.82847e+01 199.289 0.9784 
1 1 1 5   96  1  o 13 2.51404e+00 7.48832e-01 4.54981e+01 98.256  -2.62737e-01 1.81082e+00  0.00000e+00 0.00000e+00 1.69167e+01 98.256  2.85814e+01 278.256 0.6677 
1 1 1 5   96  2  o 16 5.55994e+00 7.66010e-01 9.08940e+01 22.658  7.99897e+00  3.33907e+00  0.00000e+00 0.00000e+00 1.03527e+02 22.658  1.26328e+01 22.658  0.9404 
1 1 1 5   96  3  o 2  8.34427e+00 6.55954e-01 1.58096e+02 105.000 -5.93187e+00 2.21373e+01  0.00000e+00 0.00000e+00 1.45344e+02 105.000 1.27512e+01 285.000 0.9779 
1 1 1 5   96  4  o 13 3.96173e+00 9.00190e-01 1.05210e+02 204.341 -6.26482e+00 -2.83414e+00 0.00000e+00 0.00000e+00 3.09289e+01 204.341 7.42813e+01 24.341  0.9241 
1 1 1 5   96  5  o 18 2.74663e+00 7.90742e-01 2.99608e+01 150.643 -1.28454e+00 7.22520e-01  0.00000e+00 0.00000e+00 3.02518e+01 150.643 2.91033e-01 150.643 0.5896 
1 1 1 5   96  6  o 15 6.57890e+00 8.87516e-01 1.30058e+02 198.378 -1.43281e+01 -4.76030e+00 0.00000e+00 0.00000e+00 1.06284e+02 198.378 2.37739e+01 18.378  0.9663 
1 1 1 5   96  7  o 16 6.41805e+00 9.94798e-01 1.02394e+02 94.911  -1.00398e+00 1.16838e+01  0.00000e+00 0.00000e+00 1.25756e+02 94.911  2.33627e+01 94.911  0.9564 
1 1 1 5   96  8  o 7  2.75328e+00 8.74252e-01 2.62758e+01 333.060 1.34051e+00  -6.81268e-01 0.00000e+00 0.00000e+00 3.48101e+01 333.060 8.53431e+00 333.060 0.5970 
1 1 1 5   96  9  o 19 4.06096e+00 1.05560e+00 1.06234e+02 227.658 -6.01903e+00 -6.60508e+00 0.00000e+00 0.00000e+00 3.59160e+01 227.658 7.03181e+01 47.658  0.9423 
1 1 1 5   96  10 o 1  5.89225e+00 1.19928e+00 1.13335e+02 107.832 -3.78012e+00 1.17513e+01  0.00000e+00 0.00000e+00 9.64128e+01 107.832 1.69225e+01 287.832 0.9586 
1 1 1 5   96  11 o 9  5.01426e+00 1.25745e+00 9.92540e+01 341.401 9.39650e+00  -3.16209e+00 0.00000e+00 0.00000e+00 7.72153e+01 341.401 2.20388e+01 161.401 0.9481 
1 1 1 5   96  12 o 14 3.10669e+00 1.02557e+00 2.51169e+01 312.724 1.36029e+00  -1.47288e+00 0.00000e+00 0.00000e+00 5.53999e+01 312.724 3.02830e+01 312.724 0.6986 
1 1 1 5   97  0  f 0  3.09356e+00 8.11375e-01 7.99039e+01 226.189 -2.86707e+00 -2.98860e+00 0.00000e+00 0.00000e+00 1.99742e+01 226.189 5.99297e+01 46.189  0.8687 
1 1 1 5   97  1  o 1  2.95813e+00 8.01894e-01 5.24085e+01 125.333 -1.54391e+00 2.17792e+00  0.00000e+00 0.00000e+00 3.36030e+01 125.333 1.88055e+01 305.332 0.7823 
1 1 1 5   97  2  o 8  3.00224e+00 8.23056e-01 6.30263e+01 162.889 -2.90802e+00 8.95229e-01  0.00000e+00 0.00000e+00 2.77189e+01 162.889 3.53073e+01 342.889 0.8131 
1 1 1 5   97  3  o 14 5.52923e+00 8.39993e-01 1.41270e+02 31.188  1.20947e+01  7.32142e+00  0.00000e+00 0.00000e+00 5.68746e+01 31.188  8.43957e+01 211.188 0.9640 
1 1 1 5   97  4  o 2  1.05479e+01 6.41455e-01 1.72879e+02 183.345 -3.22719e+01 -1.88598e+00 0.00000e+00 0.00000e+00 2.13130e+02 183.345 4.02513e+01 183.345 0.9844 
1 1 1 5   97  5  o 11 6.07803e+00 8.58934e-01 1.17220e+02 24.007  1.08371e+01  4.82658e+00  0.00000e+00 0.00000e+00 9.89733e+01 24.007  1.82465e+01 204.007 0.9569 
1 1 1 5   97  6  o 11 4.22960e+00 9.51128e-01 7.23789e+01 194.612 -5.17184e+00 -1.34831e+00 0.00000e+00 0.00000e+00 6.92316e+01 194.612 3.14723e+00 14.612  0.9008 
1 1 1 5   97  7  o 16 4.31289e+00 9.48103e-01 8.43882e+01 78.583  1.41766e+00  7.02033e+00  0.00000e+00 0.00000e+00 6.42283e+01 78.583  2.01599e+01 258.583 0.9273 
1 1 1 5   97  8  f 0  3.40270e+00 9.38308e-01 6.12983e+01 51.227  2.55693e+00  3.18327e+00  0.00000e+00 0.00000e+00 4.82561e+01 51.227  1.30421e+01 231.227 0.8666 
1 1 1 5   97  9  o 18 9.53508e+00 9.42013e-01 1.37977e+02 272.894 1.56708e+00  -3.09958e+01 0.00000e+00 0.00000e+00 2.10394e+02 272.894 7.24168e+01 272.894 0.9838 
1 1 1 5   97  10 o 13 5.59229e+00 1.20133e+00 1.06622e+02 80.769  1.83549e+00  1.12935e+01  0.00000e+00 0.00000e+00 9.17005e+01 80.769  1.49211e+01 260.769 0.9552 
1 1 1 5   97  11 o 10 4.39534e+00 1.20001e+00 7.57574e+01 283.297 1.57880e+00  -6.68021e+00 0.00000e+00 0.00000e+00 7.49486e+01 283.297 8.08793e-01 103.297 0.9240 
1 1 1 5   97  12 o 12 2.82827e+00 9.62098e-01 5.41782e+01 336.590 4.30069e+00  -1.86195e+00 0.00000e+00 0.00000e+00 3.87179e+01 336.590 1.54603e+01 156.590 0.8856 
1 1 1 5   98  0  o 2  1.67474e+01 5.23983e-01 2.69059e+02 293.041 3.22034e+01  -7.57156e+01 0.00000e+00 0.00000e+00 3.49373e+02 293.041 8.03142e+01 293.041 0.9939 
1 1 1 5   98  1  o 16 3.18937e+00 8.09645e-01 5.19310e+01 48.448  1.93262e+00  2.18046e+00  0.00000e+00 0.00000e+00 4.32846e+01 48.448  8.64633e+00 228.448 0.8034 
1 1 1 5   98  2  o 16 8.12082e+00 6.48963e-01 9.56705e+01 89.406  1.61128e-01  1.55413e+01  0.00000e+00 0.00000e+00 1.96255e+02 89.406  1.00585e+02 89.406  0.9673 
1 1 1 5   98  3  o 2  5.07348e+00 7.87628e-01 8.15595e+01 189.226 -6.78341e+00 -1.10179e+00 0.00000e+00 0.00000e+00 9.26845e+01 189.226 1.11251e+01 189.226 0.9241 
1 1 1 5   98  4  o 4  1.70232e+01 5.95385e-01 3.14129e+02 35.786  8.51922e+01  6.14103e+01  0.00000e+00 0.00000e+00 3.15526e+02 35.786  1.39795e+00 35.786  0.9952 
1 1 1 5   98  5  o 10 5.15036e+00 9.52439e-01 8.29177e+01 195.751 -6.97504e+00 -1.96726e+00 0.00000e+00 0.00000e+00 9.47393e+01 195.751 1.18216e+01 195.751 0.9282 
1 1 1 5   98  6  o 9  5.46269e+00 9.98260e-01 7.52537e+01 62.879  3.35873e+00  6.55769e+00  0.00000e+00 0.00000e+00 1.13401e+02 62.879  3.81477e+01 62.879  0.9294 
1 1 1 5   98  7  o 8  4.89352e+00 1.10541e+00 5.38180e+01 6.961   4.65890e+00  5.68785e-01  0.00000e+00 0.00000e+00 1.07208e+02 6.961   5.33905e+01 6.961   0.8858 
1 1 1 5   98  8  o 5  2.59430e+00 8.50964e-01 6.15038e+01 130.463 -2.29815e+00 2.69430e+00  0.00000e+00 0.00000e+00 1.97453e+01 130.463 4.17585e+01 310.463 0.8432 
1 1 1 5   98  9  f 0  2.78246e+00 9.14887e-01 2.56509e+01 236.367 -9.40925e-01 -1.41443e+00 0.00000e+00 0.00000e+00 4.06305e+01 236.367 1.49795e+01 236.367 0.6416 
1 1 1 5   98  10 o 5  6.94186e+00 1.18191e+00 1.01074e+02 83.815  1.52576e+00  1.40789e+01  0.00000e+00 0.00000e+00 1.47302e+02 83.815  4.62285e+01 83.815  0.9640 
1 1 1 5   98  11 o 5  4.66576e+00 1.22278e+00 9.53586e+01 251.920 -2.91755e+00 -8.93678e+00 0.00000e+00 0.00000e+00 6.82521e+01 251.920 2.71065e+01 71.920  0.9452 
1 1 1 5   98  12 o 1  2.96644e+00 9.92452e-01 3.59285e+01 120.054 -1.62359e+00 2.80601e+00  0.00000e+00 0.00000e+00 5.49707e+01 120.054 1.90422e+01 120.054 0.8264 
1 1 1 5   99  0  o 12 6.63979e+00 6.96050e-01 9.32808e+01 244.060 -4.96321e+00 -1.02033e+01 0.00000e+00 0.00000e+00 1.42212e+02 244.060 4.89314e+01 244.060 0.9549 
1 1 1 5   99  1  o 2  2.26354e+00 7.06763e-01 4.38902e+01 78.306  3.66571e-01  1.77110e+00  0.00000e+00 0.00000e+00 1.19213e+01 78.306  3.19689e+01 258.306 0.6637 
1 1 1 5   99  2  o 1  2.69669e+00 7.82820e-01 7.53064e+01 279.561 5.61126e-01  -3.33137e+00 0.00000e+00 0.00000e+00 8.30282e+00 279.561 6.70036e+01 99.561  0.8345 
1 1 1 5   99  3  o 5  9.50438e+00 6.28982e-01 1.55623e+02 37.267  2.27970e+01  1.73460e+01  0.00000e+00 0.00000e+00 1.91300e+02 37.267  3.56763e+01 37.267  0.9824 
1 1 1 5   99  4  o 11 3.20025e+00 9.01470e-01 6.62516e+01 111.492 -1.33576e+00 3.39239e+00  0.00000e+00 0.00000e+00 3.46257e+01 111.492 3.16259e+01 291.492 0.8484 
1 1 1 5   99  5  o 7  3.42089e+00 9.42864e-01 2.35826e+01 172.523 -1.40262e+00 1.84093e-01  0.00000e+00 0.00000e+00 4.94098e+01 172.523 2.58272e+01 172.523 0.5743 
1 1 1 5   99  6  o 6  3.45885e+00 9.46271e-01 5.44374e+01 75.538  9.27363e-01  3.59559e+00  0.00000e+00 0.00000e+00 5.49718e+01 75.538  5.34356e-01 75.538  0.8515 
1 1 1 5   99  7  o 6  5.32200e+00 1.12755e+00 9.88243e+01 4.508   9.15288e+00  7.21658e-01  0.00000e+00 0.00000e+00 8.77399e+01 4.508   1.10844e+01 184.508 0.9439 
1 1 1 5   99  8  o 9  8.59422e+00 9.51751e-01 1.52101e+02 49.472  1.91176e+01  2.23614e+01  0.00000e+00 0.00000e+00 1.61538e+02 49.472  9.43668e+00 49.472  0.9829 
1 1 1 5   99  9  o 15 7.69604e+00 1.06716e+00 1.20339e+02 247.548 -7.52081e+00 -1.81999e+01 0.00000e+00 0.00000e+00 1.57980e+02 247.548 3.76405e+01 247.548 0.9743 
1 1 1 5   99  10 o 12 4.76381e+00 1.21001e+00 9.00694e+01 72.538  2.73510e+00  8.69497e+00  0.00000e+00 0.00000e+00 7.66935e+01 72.538  1.33759e+01 252.538 0.9434 
1 1 1 5   99  11 o 11 3.13711e+00 1.01183e+00 5.00170e+01 243.982 -1.83270e+00 -3.75466e+00 0.00000e+00 0.00000e+00 5.12125e+01 243.982 1.19549e+00 243.982 0.8700 
1 1 1 5   99  12 o 14 2.76584e+00 9.32215e-01 3.88030e+01 29.792  3.06422e+00  1.75430e+00  0.00000e+00 0.00000e+00 4.75987e+01 29.792  8.79576e+00 29.792  0.8427 
1 1 1 5   100 0  o 4  1.62658e+01 5.37384e-01 2.58902e+02 275.704 7.72633e+00  -7.73588e+01 0.00000e+00 0.00000e+00 3.41206e+02 275.704 8.23036e+01 275.704 0.9935 
1 1 1 5   100 1  o 16 5.79780e+00 7.72714e-01 1.15054e+02 128.940 -7.69454e+00 9.52245e+00  0.00000e+00 0.00000e+00 9.12843e+01 128.940 2.37697e+01 308.940 0.9582 
1 1 1 5   100 2  o 12 5.62733e+00 8.29170e-01 1.17245e+02 109.985 -3.94973e+00 1.08609e+01  0.00000e+00 0.00000e+00 8.25170e+01 109.985 3.47281e+01 289.985 0.9557 
1 1 1 5   100 3  o 5  7.06604e+00 7.43228e-01 1.12939e+02 302.000 7.45801e+00  -1.19355e+01 0.00000e+00 0.00000e+00 1.40030e+02 302.000 2.70914e+01 302.000 0.9638 
1 1 1 5   100 4  o 10 3.67650e+00 7.51688e-01 3.48888e+01 190.502 -2.43621e+00 -4.51607e-01 0.00000e+00 0.00000e+00 6.92484e+01 190.502 3.43597e+01 190.502 0.7626 
1 1 1 5   100 5  o 17 3.18224e+00 8.65125e-01 4.92938e+01 19.115  2.87535e+00  9.96515e-01  0.00000e+00 0.00000e+00 4.68145e+01 19.115  2.47931e+00 199.115 0.8131 
1 1 1 5   100 6  o 2  6.91313e+00 8.98596e-01 8.73048e+01 199.985 -1.08838e+01 -3.95825e+00 0.00000e+00 0.00000e+00 1.58084e+02 199.985 7.07788e+01 199.985 0.9558 
1 1 1 5   100 7  f 0  5.87423e+00 1.08072e+00 4.82567e+01 338.509 4.71228e+00  -1.85535e+00 0.00000e+00 0.00000e+00 1.46921e+02 338.509 9.86648e+01 338.509 0.8949 
1 1 1 5   100 8  o 2  5.47460e+00 1.11246e+00 1.21054e+02 115.636 -5.86110e+00 1.22132e+01  0.00000e+00 0.00000e+00 7.45159e+01 115.636 4.65382e+01 295.636 0.9624 
1 1 1 5   100 9  o 14 4.12603e+00 1.06697e+00 6.09922e+01 208.989 -4.74152e+00 -2.62709e+00 0.00000e+00 0.00000e+00 7.71615e+01 208.989 1.61693e+01 208.989 0.9023 
1 1 1 5   100 10 o 6  7.23176e+00 1.16299e+00 1.13037e+02 17.101  1.77860e+01  5.47194e+00  0.00000e+00 0.00000e+00 1.47913e+02 17.101  3.48768e+01 17.101  0.9727 
1 1 1 5   100 11 o 15 5.83866e+00 1.29274e+00 5.64673e+01 100.224 -1.16048e+00 6.43420e+00  0.00000e+00 0.00000e+00 1.42698e+02 100.224 8.62310e+01 100.224 0.9200 
1 1 1 5   101 0  o 12 4.10305e+00 8.47370e-01 4.20749e+01 166.886 -2.91331e+00 6.78719e-01  0.00000e+00 0.00000e+00 8.12027e+01 166.886 3.91277e+01 166.886 0.8093 
1 1 1 5   101 1  o 1  2.56962e+00 7.65842e-01 3.31314e+01 193.291 -1.58752e+00 -3.75024e-01 0.00000e+00 0.00000e+00 2.66836e+01 193.291 6.44782e+00 13.291  0.6269 
1 1 1 5   101 2  o 15 5.46949e+00 8.69114e-01 7.33925e+01 42.877  4.86089e+00  4.51342e+00  0.00000e+00 0.00000e+00 1.13704e+02 42.877  4.03112e+01 42.877  0.9212 
1 1 1 5   101 3  o 18 8.65260e+00 6.85495e-01 1.76733e+02 300.480 1.55312e+01  -2.63875e+01 0.00000e+00 0.00000e+00 1.39293e+02 300.480 3.74402e+01 120.480 0.9835 
1 1 1 5   101 4  o 6  7.50297e+00 7.59236e-01 1.25150e+02 82.528  2.54891e+00  1.94343e+01  0.00000e+00 0.00000e+00 1.46269e+02 82.528  2.11194e+01 82.528  0.9741 
1 1 1 5   101 5  f 0  3.67634e+00 9.56778e-01 9.02492e+01 332.178 5.73994e+00  -3.02918e+00 0.00000e+00 0.00000e+00 3.52532e+01 332.178 5.49959e+01 152.178 0.9194 
1 1 1 5   101 6  o 18 9.09198e+00 8.00816e-01 1.53054e+02 245.949 -1.24516e+01 -2.78994e+01 0.00000e+00 0.00000e+00 1.78935e+02 245.949 2.58802e+01 245.949 0.9835 
1 1 1 5   101 7  o 6  5.29403e+00 1.08014e+00 6.32246e+01 67.234  2.57154e+00  6.12779e+00  0.00000e+00 0.00000e+00 1.17833e+02 67.234  5.46085e+01 67.234  0.9213 
1 1 1 5   101 8  o 17 4.84468e+00 1.08965e+00 8.27216e+01 349.931 8.06376e+00  -1.43182e+00 0.00000e+00 0.00000e+00 8.57035e+01 349.931 2.98183e+00 349.931 0.9368 
1 1 1 5   101 9  o 6  4.04355e+00 1.12808e+00 9.40440e+01 138.543 -6.25660e+00 5.52709e+00  0.00000e+00 0.00000e+00 4.66721e+01 138.543 4.73718e+01 318.542 0.9380 
1 1 1 5   101 10 o 11 3.95621e+00 1.12861e+00 5.64985e+01 355.446 5.11199e+00  -4.07130e-01 0.00000e+00 0.00000e+00 7.49976e+01 355.446 1.84991e+01 355.446 0.8963 
1 1 1 5   101 11 o 11 3.64414e+00 1.10940e+00 3.32730e+01 81.819  4.56082e-01  3.17263e+00  0.00000e+00 0.00000e+00 7.80459e+01 81.819  4.47729e+01 81.819  0.8241 
1 1 1 5   102 0  o 19 2.72444e+00 7.69397e-01 7.43538e+01 0.513   3.74415e+00  3.35194e-02  0.00000e+00 0.00000e+00 1.18860e+01 0.513   6.24678e+01 180.513 0.8529 
1 1 1 5   102 1  f 0  2.40059e+00 7.13354e-01 7.58493e+01 52.390  2.15802e+00  2.80126e+00  0.00000e+00 0.00000e+00 7.34160e-01 232.390 7.65834e+01 232.390 0.8430 
1 1 1 5   102 2  o 14 3.99293e+00 8.10895e-01 4.80814e+01 7.139   3.56257e+00  4.46206e-01  0.00000e+00 0.00000e+00 7.72756e+01 7.139   2.91942e+01 7.139   0.8457 
1 1 1 5   102 3  o 14 1.68734e+01 5.84776e-01 3.12084e+02 219.186 -8.87357e+01 -7.23361e+01 0.00000e+00 0.00000e+00 3.11599e+02 219.186 4.85733e-01 39.186  0.9956 
1 1 1 5   102 4  o 12 6.55952e+00 8.21865e-01 1.33075e+02 93.632  -1.12585e+00 1.77379e+01  0.00000e+00 0.00000e+00 1.03492e+02 93.632  2.95824e+01 273.632 0.9714 
1 1 1 5   102 5  o 11 7.26121e+00 8.65960e-01 1.24525e+02 239.717 -9.62905e+00 -1.64897e+01 0.00000e+00 0.00000e+00 1.37869e+02 239.717 1.33438e+01 239.717 0.9735 
1 1 1 5   102 6  o 5  9.04218e+00 7.88153e-01 1.55170e+02 67.370  1.17909e+01  2.82837e+01  0.00000e+00 0.00000e+00 1.74925e+02 67.370  1.97552e+01 67.370  0.9835 
1 1 1 5   102 7  o 15 4.57673e+00 1.11619e+00 3.70161e+01 111.483 -1.26107e+00 3.20415e+00  0.00000e+00 0.00000e+00 1.05326e+02 111.483 6.83099e+01 111.483 0.8381 
1 1 1 5   102 8  o 3  3.07458e+00 9.38148e-01 6.10064e+01 321.673 3.36359e+00  -2.65901e+00 0.00000e+00 0.00000e+00 3.86585e+01 321.673 2.23479e+01 141.673 0.8737 
1 1 1 5   102 9  o 18 3.53861e+00 1.03648e+00 5.49813e+01 205.947 -4.39254e+00 -2.13740e+00 0.00000e+00 0.00000e+00 6.19079e+01 205.947 6.92654e+00 205.947 0.8906 
1 1 1 5   102 10 o 17 4.16382e+00 1.13165e+00 7.71406e+01 5.302   7.83584e+00  7.27201e-01  0.00000e+00 0.00000e+00 6.70596e+01 5.302   1.00810e+01 185.302 0.9341 
1 1 1 5   102 11 o 7  3.96840e+00 1.18249e+00 7.47300e+01 277.073 9.00352e-01  -7.25651e+00 0.00000e+00 0.00000e+00 6.18691e+01 277.073 1.28610e+01 97.073  0.9289 
1 1 1 5   103 0  o 17 5.64247e+00 8.45027e-01 1.12605e+02 164.394 -1.12098e+01 3.13103e+00  0.00000e+00 0.00000e+00 8.75385e+01 164.394 2.50660e+01 344.394 0.9560 
1 1 1 5   103 1  o 10 8.76153e+00 6.56236e-01 1.57421e+02 278.415 4.16266e+00  -2.81371e+01 0.00000e+00 0.00000e+00 1.61941e+02 278.415 4.51997e+00 278.415 0.9823 
1 1 1 5   103 2  o 13 5.63307e+00 8.48758e-01 9.99213e+01 274.131 7.64075e-01  -1.05801e+01 0.00000e+00 0.00000e+00 9.90255e+01 274.131 8.95730e-01 94.131  0.9516 
1 1 1 5   103 3  o 10 1.00018e+01 6.67539e-01 1.75287e+02 204.593 -3.46414e+01 -1.58547e+01 0.00000e+00 0.00000e+00 1.91023e+02 204.593 1.57362e+01 204.593 0.9868 
1 1 1 5   103 4  o 9  9.42047e+00 7.13705e-01 1.69096e+02 10.002  3.39692e+01  5.99091e+00  0.00000e+00 0.00000e+00 1.75432e+02 10.002  6.33584e+00 10.002  0.9854 
1 1 1 5   103 5  o 6  5.12381e+00 9.37906e-01 8.60137e+01 177.308 -8.79989e+00 4.13758e-01  0.00000e+00 0.00000e+00 9.29966e+01 177.308 6.98281e+00 177.308 0.9414 
1 1 1 5   103 6  o 19 3.42370e+00 9.84232e-01 7.70341e+01 62.949  2.41813e+00  4.73537e+00  0.00000e+00 0.00000e+00 3.73351e+01 62.949  3.96991e+01 242.949 0.9003 
1 1 1 5   103 7  o 11 7.61514e+00 9.73658e-01 1.70566e+02 305.386 1.58715e+01  -2.23445e+01 0.00000e+00 0.00000e+00 1.06747e+02 305.386 6.38193e+01 125.387 0.9816 
1 1 1 5   103 8  o 5  6.33309e+00 1.12886e+00 1.05770e+02 64.783  5.82511e+00  1.23695e+01  0.00000e+00 0.00000e+00 1.20362e+02 64.783  1.45927e+01 64.783  0.9627 
1 1 1 5   103 9  o 10 4.70107e+00 1.08055e+00 5.96073e+01 14.945  6.68711e+00  1.78496e+00  0.00000e+00 0.00000e+00 1.01563e+02 14.945  4.19560e+01 14.945  0.9246 
1 1 1 5   103 10 o 16 3.98295e+00 1.08783e+00 8.70345e+01 146.511 -7.55419e+00 4.99783e+00  0.00000e+00 0.00000e+00 5.21846e+01 146.511 3.48499e+01 326.512 0.9431 
1 1 1 5   104 0  o 12 3.26289e+00 8.69654e-01 4.92064e+01 50.773  1.97936e+00  2.42461e+00  0.00000e+00 0.00000e+00 4.99327e+01 50.773  7.26241e-01 50.773  0.8192 
1 1 1 5   104 1  o 8  4.95030e+00 8.97148e-01 8.92674e+01 320.720 6.54531e+00  -5.35348e+00 0.00000e+00 0.00000e+00 8.31518e+01 320.720 6.11554e+00 140.720 0.9389 
1 1 1 5   104 2  o 5  2.72736e+00 7.97878e-01 4.19134e+01 139.336 -1.79188e+00 1.53931e+00  0.00000e+00 0.00000e+00 3.38937e+01 139.336 8.01969e+00 319.336 0.7491 
1 1 1 5   104 3  o 3  1.30674e+01 6.11927e-01 2.32900e+02 131.883 -4.65612e+01 5.19236e+01  0.00000e+00 0.00000e+00 2.48467e+02 131.883 1.55668e+01 131.883 0.9928 
1 1 1 5   104 4  o 15 1.66834e+01 6.20265e-01 2.62009e+02 19.460  1.00310e+02  3.54424e+01  0.00000e+00 0.00000e+00 3.54089e+02 19.460  9.20792e+01 19.460  0.9953 
1 1 1 5   104 5  o 4  3.74020e+00 9.61094e-01 9.49504e+01 203.613 -6.32244e+00 -2.76397e+00 0.00000e+00 0.00000e+00 3.33237e+01 203.613 6.16267e+01 23.613  0.9244 
1 1 1 5   104 6  o 10 4.19205e+00 1.05621e+00 9.46905e+01 346.142 8.24125e+00  -2.03311e+00 0.00000e+00 0.00000e+00 5.13477e+01 346.142 4.33428e+01 166.142 0.9391 
1 1 1 5   104 7  o 15 3.63331e+00 9.86851e-01 8.01592e+01 147.170 -5.57106e+00 3.59439e+00  0.00000e+00 0.00000e+00 4.39703e+01 147.170 3.61889e+01 327.170 0.9212 
1 1 1 5   104 8  o 7  2.31446e+00 7.83870e-01 4.64571e+01 201.368 -2.85620e+00 -1.11747e+00 0.00000e+00 0.00000e+00 2.34695e+01 201.368 2.29876e+01 21.368  0.8148 
1 1 1 5   104 9  o 7  2.68168e+00 8.77023e-01 3.01175e+01 287.596 7.42681e-01  -2.34182e+00 0.00000e+00 0.00000e+00 4.54496e+01 287.596 1.53322e+01 287.596 0.7602 
1 1 1 5   104 10 o 8  2.29605e+00 7.95391e-01 4.14392e+01 208.320 -3.07367e+00 -1.65641e+00 0.00000e+00 0.00000e+00 3.00812e+01 208.320 1.13580e+01 28.320  0.8407 
1 1 1 5   105 0  o 6  4.14172e+00 8.72507e-01 5.98055e+01 119.271 -2.38586e+00 4.25656e+00  0.00000e+00 0.00000e+00 7.69599e+01 119.271 1.71543e+01 119.271 0.8905 
1 1 1 5   105 1  o 10 4.32953e+00 8.57488e-01 2.68005e+01 256.743 -5.57009e-01 -2.36425e+00 0.00000e+00 0.00000e+00 9.47596e+01 256.743 6.79591e+01 256.743 0.7570 
1 1 1 5   105 2  o 7  4.47065e+00 9.67624e-01 8.76142e+01 193.594 -7.03675e+00 -1.70164e+00 0.00000e+00 0.00000e+00 6.62893e+01 193.594 2.13249e+01 13.594  0.9281 
1 1 1 5   105 3  o 12 3.19140e+00 8.99453e-01 7.01827e+01 55.014  2.64594e+00  3.78078e+00  0.00000e+00 0.00000e+00 3.44187e+01 55.014  3.57640e+01 235.014 0.8836 
1 1 1 5   105 4  f 0  5.44346e+00 9.50792e-01 1.51757e+02 5.980   1.59355e+01  1.66936e+00  0.00000e+00 0.00000e+00 4.37515e+01 5.980   1.08005e+02 185.980 0.9683 
1 1 1 5   105 5  o 11 3.05698e+00 8.82997e-01 6.48652e+01 210.860 -3.93911e+00 -2.35383e+00 0.00000e+00 0.00000e+00 3.52400e+01 210.860 2.96251e+01 30.861  0.8829 
1 1 1 5   105 6  o 19 3.89533e+00 1.03605e+00 5.01352e+01 261.114 -6.06970e-01 -3.88226e+00 0.00000e+00 0.00000e+00 7.42088e+01 261.114 2.40736e+01 261.114 0.8608 
1 1 1 5   105 7  o 2  3.42473e+00 9.56128e-01 5.88935e+01 253.530 -1.31527e+00 -4.44885e+00 0.00000e+00 0.00000e+00 5.33949e+01 253.530 5.49855e+00 73.530  0.8843 
1 1 1 5   105 8  o 10 4.46654e+00 1.10519e+00 6.14632e+01 227.835 -4.32684e+00 -4.77770e+00 0.00000e+00 0.00000e+00 9.06560e+01 227.835 2.91928e+01 227.835 0.9188 
1 1 1 5   105 9  o 10 5.17464e+00 1.31395e+00 8.91553e+01 51.112  5.90243e+00  7.31800e+00  0.00000e+00 0.00000e+00 9.20957e+01 51.112  2.94045e+00 51.112  0.9452 
1 1 1 5   105 10 o 19 3.09270e+00 1.00427e+00 6.80952e+01 193.107 -6.30254e+00 -1.46747e+00 0.00000e+00 0.00000e+00 3.71997e+01 193.107 3.08955e+01 13.107  0.9191 
1 1 1 5   106 0  o 17 7.89319e+00 7.04107e-01 1.18971e+02 61.493  9.67453e+00  1.78129e+01  0.00000e+00 0.00000e+00 1.66322e+02 61.493  4.73512e+01 61.493  0.9750 
1 1 1 5   106 1  o 10 2.60148e+00 7.81842e-01 7.78565e+01 223.765 -3.01383e+00 -2.88659e+00 0.00000e+00 0.00000e+00 6.04611e+00 223.765 7.18104e+01 43.765  0.8699 
1 1 1 5   106 2  o 3  2.61688e+00 7.99938e-01 4.73831e+01 22.014  2.50831e+00  1.01415e+00  0.00000e+00 0.00000e+00 2.88509e+01 22.014  1.85322e+01 202.014 0.7856 
1 1 1 5   106 3  o 5  6.63902e+00 8.78405e-01 1.39130e+02 43.923  1.35597e+01  1.30595e+01  0.00000e+00 0.00000e+00 1.00433e+02 43.923  3.86969e+01 223.923 0.9731 
1 1 1 5   106 4  o 4  5.92699e+00 9.36502e-01 9.96702e+01 294.860 5.18977e+00  -1.12010e+01 0.00000e+00 0.00000e+00 1.11017e+02 294.860 1.13466e+01 294.860 0.9586 
1 1 1 5   106 5  o 16 6.52414e+00 9.09901e-01 7.63689e+01 236.561 -6.61944e+00 -1.00242e+01 0.00000e+00 0.00000e+00 1.55244e+02 236.561 7.88755e+01 236.561 0.9574 
1 1 1 5   106 6  o 5  6.85070e+00 9.66776e-01 1.37640e+02 157.400 -2.01561e+01 8.39008e+00  0.00000e+00 0.00000e+00 1.10460e+02 157.400 2.71806e+01 337.400 0.9768 
1 1 1 5   106 7  o 19 3.66979e+00 1.00717e+00 4.34592e+01 301.823 2.06387e+00  -3.32574e+00 0.00000e+00 0.00000e+00 7.35445e+01 301.823 3.00853e+01 301.823 0.8601 
1 1 1 5   106 8  o 1  5.64115e+00 1.12427e+00 8.97218e+01 54.811  6.45254e+00  9.15076e+00  0.00000e+00 0.00000e+00 1.09761e+02 54.811  2.00395e+01 54.811  0.9542 
1 1 1 5   106 9  o 16 4.14194e+00 1.21461e+00 9.53019e+01 343.275 8.65534e+00  -2.60091e+00 0.00000e+00 0.00000e+00 4.93846e+01 343.275 4.59173e+01 163.275 0.9429 
1 1 1 5   107 0  f 0  7.14707e+00 7.54657e-01 8.47419e+01 145.427 -1.11856e+01 7.70871e+00  0.00000e+00 0.00000e+00 1.70183e+02 145.427 8.54409e+01 145.427 0.9625 
1 1 1 5   107 1  o 12 5.71425e+00 8.43497e-01 6.90307e+01 3.800   8.38870e+00  5.57188e-01  0.00000e+00 0.00000e+00 1.29747e+02 3.800   6.07158e+01 3.800   0.9385 
1 1 1 5   107 2  o 19 3.41060e+00 7.92356e-01 8.40316e+01 63.839  2.72042e+00  5.53822e+00  0.00000e+00 0.00000e+00 3.16438e+01 63.839  5.23878e+01 243.839 0.9149 
1 1 1 5   107 3  o 5  6.18838e+00 8.71794e-01 9.60798e+01 198.204 -1.23473e+01 -4.06042e+00 0.00000e+00 0.00000e+00 1.24325e+02 198.204 2.82456e+01 198.204 0.9607 
1 1 1 5   107 4  o 12 5.59751e+00 9.45682e-01 4.89443e+01 147.808 -5.23690e+00 3.29688e+00  0.00000e+00 0.00000e+00 1.40964e+02 147.808 9.20201e+01 147.808 0.9152 
1 1 1 5   107 5  o 17 4.97818e+00 1.01838e+00 1.14343e+02 223.238 -9.06961e+00 -8.52818e+00 0.00000e+00 0.00000e+00 6.26177e+01 223.238 5.17253e+01 43.238  0.9590 
1 1 1 5   107 6  o 9  5.32218e+00 1.03786e+00 3.39158e+01 61.403  1.85841e+00  3.40904e+00  0.00000e+00 0.00000e+00 1.35502e+02 61.403  1.01586e+02 61.403  0.8589 
1 1 1 5   107 7  o 11 2.57420e+00 8.31393e-01 2.78957e+01 227.916 -1.34799e+00 -1.49267e+00 0.00000e+00 0.00000e+00 3.88409e+01 227.916 1.09452e+01 227.916 0.6996 
1 1 1 5   107 8  f 0  5.17525e+00 1.04049e+00 4.29351e+01 317.531 4.08899e+00  -3.74278e+00 0.00000e+00 0.00000e+00 1.30506e+02 317.531 8.75709e+01 317.531 0.9046 
1 1 1 5   107 9  o 13 3.15984e+00 9.89604e-01 2.78246e+01 203.340 -2.39719e+00 -1.03437e+00 0.00000e+00 0.00000e+00 6.30495e+01 203.340 3.52249e+01 203.340 0.7765 
1 1 1 5   108 0  o 11 6.66900e+00 8.11098e-01 9.34788e+01 236.520 -7.39747e+00 -1.11848e+01 0.00000e+00 0.00000e+00 1.44200e+02 236.520 5.07214e+01 236.520 0.9620 
1 1 1 5   108 1  o 6  6.15869e+00 8.38024e-01 8.86059e+01 124.210 -6.47486e+00 9.52396e+00  0.00000e+00 0.00000e+00 1.29460e+02 124.210 4.08542e+01 124.210 0.9555 
1 1 1 5   108 2  o 13 1.06161e+01 6.65000e-01 1.56325e+02 304.246 2.34592e+01  -3.44601e+01 0.00000e+00 0.00000e+00 2.32349e+02 304.246 7.60243e+01 304.246 0.9879 
1 1 1 5   108 3  o 2  5.49832e+00 9.59194e-01 1.00405e+02 205.044 -1.11832e+01 -5.22530e+00 0.00000e+00 0.00000e+00 9.49308e+01 205.044 5.47451e+00 25.044  0.9586 
1 1 1 5   108 4  o 12 4.62131e+00 9.96745e-01 4.81107e+01 349.000 4.52972e+00  -8.80468e-01 0.00000e+00 0.00000e+00 1.03222e+02 349.000 5.51115e+01 349.000 0.8836 
1 1 1 5   108 5  o 16 5.34586e+00 9.83841e-01 5.20034e+01 26.197  5.68618e+00  2.79752e+00  0.00000e+00 0.00000e+00 1.29719e+02 26.197  7.77152e+01 26.197  0.9173 
1 1 1 5   108 6  o 1  4.58905e+00 1.00714e+00 6.13339e+01 334.918 6.25698e+00  -2.92863e+00 0.00000e+00 0.00000e+00 9.58646e+01 334.918 3.45307e+01 334.918 0.9245 
1 1 1 5   108 7  o 12 4.23686e+00 9.98524e-01 8.16347e+01 147.636 -7.82762e+00 4.96071e+00  0.00000e+00 0.00000e+00 6.65949e+01 147.636 1.50398e+01 327.636 0.9444 
1 1 1 5   108 8  o 18 6.36196e+00 1.11790e+00 1.19034e+02 279.989 3.14788e+00  -1.78723e+01 0.00000e+00 0.00000e+00 1.10001e+02 279.989 9.03221e+00 99.989  0.9720 
1 1 1 5   108 9  o 11 3.43492e+00 1.06688e+00 3.00925e+01 69.168  1.05182e+00  2.76429e+00  0.00000e+00 0.00000e+00 7.25130e+01 69.168  4.24205e+01 69.168  0.8068 
1 1 1 5   109 0  o 11 3.28573e+00 8.77906e-01 6.17655e+01 212.512 -3.72372e+00 -2.37338e+00 0.00000e+00 0.00000e+00 4.50596e+01 212.512 1.67059e+01 32.512  0.8778 
1 1 1 5   109 1  o 12 4.65871e+00 9.25005e-01 6.17895e+01 64.037  2.82289e+00  5.79733e+00  0.00000e+00 0.00000e+00 9.67754e+01 64.037  3.49860e+01 64.037  0.9188 
1 1 1 5   109 2  o 13 6.10334e+00 8.77977e-01 8.82380e+01 329.451 1.10431e+01  -6.51749e+00 0.00000e+00 0.00000e+00 1.28875e+02 329.451 4.06371e+01 329.451 0.9602 
1 1 1 5   109 3  o 18 4.00055e+00 9.32842e-01 6.03470e+01 220.054 -4.38481e+00 -3.68631e+00 0.00000e+00 0.00000e+00 7.42252e+01 220.054 1.38782e+01 220.054 0.9079 
1 1 1 5   109 4  f 0  1.00375e+01 7.26871e-01 1.37322e+02 74.232  1.01769e+01  3.60407e+01  0.00000e+00 0.00000e+00 2.29565e+02 74.232  9.22428e+01 74.232  0.9866 
1 1 1 5   109 5  o 1  5.12435e+00 1.00877e+00 6.02086e+01 271.821 2.21784e-01  -6.97526e+00 0.00000e+00 0.00000e+00 1.15450e+02 271.821 5.52410e+01 271.821 0.9253 
1 1 1 5   109 6  o 17 1.13033e+01 9.01849e-01 1.78766e+02 107.916 -1.63714e+01 5.06395e+01  0.00000e+00 0.00000e+00 2.35974e+02 107.916 5.72081e+01 107.916 0.9906 
1 1 1 5   109 7  o 6  6.57797e+00 1.03582e+00 1.31872e+02 287.832 6.66430e+00  -2.07171e+01 0.00000e+00 0.00000e+00 1.06075e+02 287.832 2.57970e+01 107.832 0.9767 
1 1 1 5   109 8  o 14 1.14759e+01 8.53965e-01 1.83419e+02 165.701 -6.18503e+01 1.57640e+01  0.00000e+00 0.00000e+00 2.38135e+02 165.701 5.47153e+01 165.701 0.9921 
1 1 1 5   109 9  o 19 2.61586e+00 8.80351e-01 4.37584e+01 43.129  2.91478e+00  2.73039e+00  0.00000e+00 0.00000e+00 3.98261e+01 43.129  3.93230e+00 223.129 0.8633 
1 1 1 5   110 0  o 13 3.87407e+00 9.17844e-01 5.41268e+01 243.495 -2.24276e+00 -4.49725e+00 0.00000e+00 0.00000e+00 7.41076e+01 243.495 1.99807e+01 243.495 0.8940 
1 1 1 5   110 1  o 3  4.79645e+00 9.35994e-01 9.58325e+01 36.118  8.80134e+00  6.42226e+00  0.00000e+00 0.00000e+00 7.34352e+01 36.118  2.23973e+01 216.118 0.9529 
1 1 1 5   110 2  o 9  4.51567e+00 9.03650e-01 6.75611e+01 285.902 1.86069e+00  -6.53102e+00 0.00000e+00 0.00000e+00 8.68277e+01 285.902 1.92666e+01 285.902 0.9231 
1 1 1 5   110 3  o 12 5.69587e+00 9.32283e-01 8.55736e+01 131.400 -7.47939e+00 8.48380e+00  0.00000e+00 0.00000e+00 1.15840e+02 131.400 3.02668e+01 131.400 0.9547 
1 1 1 5   110 4  o 8  6.58921e+00 9.03883e-01 1.35435e+02 301.500 1.11952e+01  -1.82692e+01 0.00000e+00 0.00000e+00 1.02854e+02 301.500 3.25805e+01 121.500 0.9764 
1 1 1 5   110 5  o 4  3.67297e+00 9.78084e-01 4.73429e+01 149.329 -3.61322e+00 2.14288e+00  0.00000e+00 0.00000e+00 7.11162e+01 149.329 2.37733e+01 149.329 0.8708 
1 1 1 5   110 6  f 0  5.11030e+00 1.02230e+00 4.96901e+01 156.158 -6.07805e+00 2.68610e+00  0.00000e+00 0.00000e+00 1.24663e+02 156.158 7.49726e+01 156.158 0.9213 
1 1 1 5   110 7  o 14 2.53096e+00 8.31715e-01 4.54850e+01 352.284 3.81372e+00  -5.16703e-01 0.00000e+00 0.00000e+00 3.48609e+01 352.284 1.06241e+01 172.284 0.8574 
1 1 1 5   110 8  o 12 4.65529e+00 1.11196e+00 1.32621e+02 207.934 -1.43782e+01 -7.62389e+00 0.00000e+00 0.00000e+00 3.43088e+01 207.934 9.83122e+01 27.934  0.9688 
1 1 1 5   111 0  o 17 8.61052e+00 7.23236e-01 1.36754e+02 36.620  2.61126e+01  1.94073e+01  0.00000e+00 0.00000e+00 1.77031e+02 36.620  4.02775e+01 36.620  0.9845 
1 1 1 5   111 1  o 6  9.71013e+00 6.72142e-01 1.37647e+02 122.082 -2.03312e+01 3.24336e+01  0.00000e+00 0.00000e+00 2.17112e+02 122.082 7.94647e+01 122.082 0.9869 
1 1 1 5   111 2  o 11 3.39125e+00 8.29544e-01 4.35888e+01 168.162 -3.74637e+00 7.85242e-01  0.00000e+00 0.00000e+00 6.39638e+01 168.162 2.03751e+01 168.162 0.8566 
1 1 1 5   111 3  o 2  4.44880e+00 9.36552e-01 5.90954e+01 246.687 -2.43422e+00 -5.64854e+00 0.00000e+00 0.00000e+00 9.15718e+01 246.687 3.24764e+01 246.687 0.9146 
1 1 1 5   111 4  o 10 3.68730e+00 8.55843e-01 5.61846e+01 341.295 5.52598e+00  -1.87094e+00 0.00000e+00 0.00000e+00 6.80172e+01 341.295 1.18326e+01 341.295 0.9097 
1 1 1 5   111 5  o 13 8.60414e+00 8.18936e-01 1.26310e+02 126.353 -1.98911e+01 2.70260e+01  0.00000e+00 0.00000e+00 1.87470e+02 126.353 6.11598e+01 126.353 0.9850 
1 1 1 5   111 6  o 12 4.81273e+00 1.06586e+00 8.08650e+01 255.533 -2.36958e+00 -9.18404e+00 0.00000e+00 0.00000e+00 8.76281e+01 255.533 6.76307e+00 255.533 0.9457 
1 1 1 5   111 7  o 9  2.98014e+00 9.22669e-01 5.42132e+01 231.972 -2.82808e+00 -3.61609e+00 0.00000e+00 0.00000e+00 4.31759e+01 231.972 1.10373e+01 51.972  0.8829 
1 1 1 5   111 8  o 4  2.02825e+00 7.07582e-01 2.34075e+01 54.376  1.11214e+00  1.55203e+00  0.00000e+00 0.00000e+00 2.78006e+01 54.376  4.39312e+00 54.376  0.6823 
1 1 1 5   112 0  o 11 4.59474e+00 9.06698e-01 5.73312e+01 213.414 -5.34238e+00 -3.52447e+00 0.00000e+00 0.00000e+00 9.87783e+01 213.414 4.14471e+01 213.414 0.9182 
1 1 1 5   112 1  o 1  2.99880e+00 8.37398e-01 8.86944e+01 263.181 -7.80752e-01 -6.52907e+00 0.00000e+00 0.00000e+00 1.34650e+01 263.181 7.52294e+01 83.181  0.9205 
1 1 1 5   112 2  o 4  2.69088e+00 8.16150e-01 1.65559e+01 44.200  8.21406e-01  7.98772e-01  0.00000e+00 0.00000e+00 3.28121e+01 44.200  1.62562e+01 44.200  0.4957 
1 1 1 5   112 3  o 4  6.10753e+00 8.99603e-01 1.21483e+02 87.616  8.58769e-01  2.06298e+01  0.00000e+00 0.00000e+00 9.90504e+01 87.616  2.24327e+01 267.616 0.9755 
1 1 1 5   112 4  o 14 8.50563e+00 7.95329e-01 1.34432e+02 201.528 -3.07271e+01 -1.21210e+01 0.00000e+00 0.00000e+00 1.75608e+02 201.528 4.11758e+01 201.528 0.9847 
1 1 1 5   112 5  o 13 3.98145e+00 1.00579e+00 6.04618e+01 18.366  5.63635e+00  1.87126e+00  0.00000e+00 0.00000e+00 7.38471e+01 18.366  1.33852e+01 18.366  0.9114 
1 1 1 5   112 6  o 16 3.21952e+00 9.30648e-01 2.29641e+01 318.874 1.68015e+00  -1.46704e+00 0.00000e+00 0.00000e+00 6.42784e+01 318.874 4.13143e+01 318.874 0.7322 
1 1 1 5   112 7  o 11 3.35623e+00 9.86453e-01 5.06417e+01 359.653 5.06203e+00  -3.06600e-02 0.00000e+00 0.00000e+00 6.04780e+01 359.653 9.83631e+00 359.653 0.8948 
1 1 1 5   112 8  o 14 5.88013e+00 1.20313e+00 1.04031e+02 95.735  -1.52596e+00 1.51951e+01  0.00000e+00 0.00000e+00 1.06237e+02 95.735  2.20589e+00 95.735  0.9667 
1 1 1 5   113 0  o 19 4.68827e+00 8.52577e-01 4.98849e+01 220.713 -4.56562e+00 -3.92892e+00 0.00000e+00 0.00000e+00 1.08410e+02 220.713 5.85248e+01 220.713 0.9127 
1 1 1 5   113 1  o 9  2.98243e+00 8.47825e-01 7.56266e+01 41.845  4.33870e+00  3.88540e+00  0.00000e+00 0.00000e+00 2.47379e+01 41.845  5.08888e+01 221.845 0.9095 
1 1 1 5   113 2  o 12 4.35342e+00 9.45497e-01 6.19308e+01 136.441 -5.07200e+00 4.82315e+00  0.00000e+00 0.00000e+00 8.71615e+01 136.441 2.52307e+01 136.441 0.9255 
1 1 1 5   113 3  o 19 4.20836e+00 9.65143e-01 6.63724e+01 83.955  7.32851e-01  6.92029e+00  0.00000e+00 0.00000e+00 7.76887e+01 83.955  1.13163e+01 83.955  0.9251 
1 1 1 5   113 4  o 12 2.71195e+00 8.40897e-01 4.81615e+01 309.131 2.57964e+00  -3.17075e+00 0.00000e+00 0.00000e+00 3.88260e+01 309.131 9.33555e+00 129.131 0.8668 
1 1 1 5   113 5  o 16 7.72424e+00 9.44818e-01 1.12187e+02 297.918 1.10909e+01  -2.09316e+01 0.00000e+00 0.00000e+00 1.67523e+02 297.918 5.53363e+01 297.918 0.9787 
1 1 1 5   113 6  f 0  3.85311e+00 1.03558e+00 1.03997e+02 61.984  4.78989e+00  9.00231e+00  0.00000e+00 0.00000e+00 3.13742e+01 61.984  7.26228e+01 241.984 0.9496 
1 1 1 5   113 7  o 10 3.95407e+00 1.05483e+00 1.06161e+02 186.655 -1.18281e+01 -1.38015e+00 0.00000e+00 0.00000e+00 3.38153e+01 186.655 7.23456e+01 6.655   0.9570 
1 1 1 5   114 0  f 0  4.28454e+00 8.55833e-01 1.10363e+02 222.310 -9.38717e+00 -8.54457e+00 0.00000e+00 0.00000e+00 4.17094e+01 222.310 6.86532e+01 42.310  0.9598 
1 1 1 5   114 1  o 12 4.40767e+00 9.33188e-01 6.42171e+01 120.283 -3.58167e+00 6.13339e+00  0.00000e+00 0.00000e+00 8.68550e+01 120.283 2.26380e+01 120.283 0.9267 
1 1 1 5   114 2  o 6  2.59639e+00 8.08996e-01 2.55828e+01 260.605 -3.38210e-01 -2.04404e+00 0.00000e+00 0.00000e+00 4.25343e+01 260.605 1.69515e+01 260.605 0.7092 
1 1 1 5   114 3  o 19 3.20272e+00 9.00281e-01 3.92252e+01 13.848  3.60269e+00  8.88084e-01  0.00000e+00 0.00000e+00 6.16467e+01 13.848  2.24216e+01 13.848  0.8514 
1 1 1 5   114 4  f 0  4.53504e+00 9.67821e-01 6.30832e+01 307.966 4.71322e+00  -6.04008e+00 0.00000e+00 0.00000e+00 9.33147e+01 307.966 3.02316e+01 307.966 0.9322 
1 1 1 5   114 5  o 4  3.86755e+00 1.00418e+00 5.19682e+01 145.946 -4.46670e+00 3.01894e+00  0.00000e+00 0.00000e+00 7.70345e+01 145.946 2.50663e+01 145.946 0.9017 
1 1 1 5   114 6  o 14 2.65923e+00 8.55325e-01 3.55920e+01 191.814 -3.24220e+00 -6.78186e-01 0.00000e+00 0.00000e+00 4.61060e+01 191.814 1.05140e+01 191.814 0.8307 
1 1 1 5   114 7  o 19 2.55272e+00 8.32351e-01 3.33831e+01 74.979  8.46980e-01  3.15639e+00  0.00000e+00 0.00000e+00 4.47756e+01 74.979  1.13925e+01 74.979  0.8280 
1 1 1 5   115 0  f 0  8.53744e+00 7.03074e-01 1.27592e+02 230.041 -2.40091e+01 -2.86547e+01 0.00000e+00 0.00000e+00 1.83783e+02 230.041 5.61915e+01 230.041 0.9865 
1 1 1 5   115 1  o 2  5.29569e+00 9.70071e-01 1.03705e+02 322.047 1.13012e+01  -8.81452e+00 0.00000e+00 0.00000e+00 8.51480e+01 322.047 1.85568e+01 142.047 0.9645 
1 1 1 5   115 2  f 0  3.98097e+00 9.62398e-01 7.46260e+01 153.660 -7.38983e+00 3.65866e+00  0.00000e+00 0.00000e+00 6.33512e+01 153.660 1.12748e+01 333.660 0.9372 
1 1 1 5   115 3  o 4  4.81045e+00 9.75557e-01 7.65160e+01 353.340 1.00838e+01  -1.17745e+00 0.00000e+00 0.00000e+00 9.23798e+01 353.340 1.58639e+01 353.340 0.9494 
1 1 1 5   115 4  o 10 3.13425e+00 9.28952e-01 3.70359e+01 41.685  2.61978e+00  2.33289e+00  0.00000e+00 0.00000e+00 6.05030e+01 41.685  2.34671e+01 41.685  0.8415 
1 1 1 5   115 5  o 15 3.33345e+00 9.46728e-01 8.83719e+01 196.419 -8.31950e+00 -2.45151e+00 0.00000e+00 0.00000e+00 2.75539e+01 196.419 6.08180e+01 16.419  0.9405 
1 1 1 5   115 6  o 9  2.05337e+00 7.03522e-01 2.63517e+01 325.875 1.87898e+00  -1.27335e+00 0.00000e+00 0.00000e+00 2.96365e+01 325.875 3.28484e+00 325.875 0.7375 
1 1 1 5   115 7  o 4  2.20935e+00 7.48410e-01 4.21242e+01 88.932  7.46195e-02  4.00325e+00  0.00000e+00 0.00000e+00 2.84133e+01 88.932  1.37109e+01 268.932 0.8637 
1 1 1 5   116 0  o 2  5.99392e+00 8.78060e-01 1.04347e+02 170.031 -1.70643e+01 2.99947e+00  0.00000e+00 0.00000e+00 1.10684e+02 170.031 6.33667e+00 170.031 0.9707 
1 1 1 5   116 1  o 7  6.80943e+00 8.53858e-01 9.57403e+01 34.863  1.66646e+01  1.16095e+01  0.00000e+00 0.00000e+00 1.49687e+02 34.863  5.39472e+01 34.863  0.9751 
1 1 1 5   116 2  o 19 3.12332e+00 8.95639e-01 7.78450e+01 121.503 -3.64242e+00 5.94308e+00  0.00000e+00 0.00000e+00 2.89819e+01 121.503 4.88631e+01 301.503 0.9252 
1 1 1 5   116 3  o 15 2.96843e+00 8.94434e-01 3.76673e+01 50.078  2.24803e+00  2.68650e+00  0.00000e+00 0.00000e+00 5.46550e+01 50.078  1.69877e+01 50.078  0.8413 
1 1 1 5   116 4  o 13 4.16526e+00 9.99095e-01 9.18599e+01 228.881 -6.63381e+00 -7.59937e+00 0.00000e+00 0.00000e+00 5.42835e+01 228.881 3.75764e+01 48.881  0.9491 
1 1 1 5   116 5  o 11 3.69435e+00 9.81241e-01 8.10070e+01 69.030  3.38258e+00  8.82560e+00  0.00000e+00 0.00000e+00 4.81210e+01 69.030  3.28860e+01 249.030 0.9455 
1 1 1 5   116 6  o 4  2.49228e+00 8.14663e-01 3.20116e+01 173.683 -3.10369e+00 3.43556e-01  0.00000e+00 0.00000e+00 4.34026e+01 173.683 1.13911e+01 173.683 0.8187 
1 1 1 5   116 7  o 12 2.99589e+00 9.15646e-01 8.20391e+01 332.486 8.17164e+00  -4.25642e+00 0.00000e+00 0.00000e+00 2.24802e+01 332.486 5.95590e+01 152.486 0.9441 
1 1 1 5   117 0  o 1  2.89932e+00 8.14349e-01 1.11458e+02 88.518  2.61702e-01  1.01184e+01  0.00000e+00 0.00000e+00 9.77720e+00 268.518 1.21235e+02 268.518 0.9492 
1 1 1 5   117 1  o 6  5.24433e+00 1.01731e+00 8.53940e+01 194.692 -1.11554e+01 -2.92499e+00 0.00000e+00 0.00000e+00 9.97936e+01 194.692 1.43996e+01 194.692 0.9556 
1 1 1 5   117 2  o 17 2.62638e+00 8.16112e-01 5.60136e+01 89.972  2.35225e-03  4.75667e+00  0.00000e+00 0.00000e+00 3.01203e+01 89.972  2.58933e+01 269.972 0.8874 
1 1 1 5   117 3  o 8  2.16507e+00 7.28586e-01 2.93417e+01 295.717 9.41283e-01  -1.95436e+00 0.00000e+00 0.00000e+00 2.85661e+01 295.717 7.75560e-01 115.717 0.7237 
1 1 1 5   117 4  o 7  2.98978e+00 8.86380e-01 6.47085e+01 312.989 4.45927e+00  -4.78376e+00 0.00000e+00 0.00000e+00 3.69479e+01 312.989 2.77606e+01 132.989 0.9200 
1 1 1 5   117 5  o 12 4.04461e+00 9.44523e-01 6.69666e+01 145.192 -6.91804e+00 4.80959e+00  0.00000e+00 0.00000e+00 7.33299e+01 145.192 6.36330e+00 145.192 0.9386 
1 1 1 5   117 6  o 16 6.67296e+00 1.13597e+00 1.03659e+02 0.988   1.81590e+01  3.13017e-01  0.00000e+00 0.00000e+00 1.36020e+02 0.988   3.23620e+01 0.988   0.9721 
1 1 1 5   118 0  o 12 1.12701e+01 6.66430e-01 1.56830e+02 235.118 -3.76067e+01 -5.39447e+01 0.00000e+00 0.00000e+00 2.56244e+02 235.118 9.94139e+01 235.118 0.9924 
1 1 1 5   118 1  o 3  2.57470e+00 8.13922e-01 2.88146e+01 233.835 -1.52980e+00 -2.09287e+00 0.00000e+00 0.00000e+00 4.48658e+01 233.835 1.60512e+01 233.835 0.7747 
1 1 1 5   118 2  o 14 1.98093e+00 6.74818e-01 1.78962e+01 57.169  6.87977e-01  1.06626e+00  0.00000e+00 0.00000e+00 2.11563e+01 57.169  3.26009e+00 57.169  0.5336 
1 1 1 5   118 3  o 6  2.65885e+00 8.29449e-01 5.45642e+01 355.751 5.20933e+00  -3.87066e-01 0.00000e+00 0.00000e+00 3.36823e+01 355.751 2.08818e+01 175.751 0.8983 
1 1 1 5   118 4  o 17 4.35996e+00 9.24922e-01 8.31837e+01 189.630 -1.13788e+01 -1.93068e+00 0.00000e+00 0.00000e+00 7.07536e+01 189.630 1.24301e+01 9.630   0.9556 
1 1 1 5   118 5  o 19 2.17167e+00 7.25659e-01 2.57104e+01 356.590 2.44246e+00  -1.45552e-01 0.00000e+00 0.00000e+00 3.51895e+01 356.590 9.47907e+00 356.590 0.7591 
1 1 1 5   118 6  o 11 2.74067e+00 8.61919e-01 3.87243e+01 302.620 2.17701e+00  -3.40144e+00 0.00000e+00 0.00000e+00 4.88425e+01 302.620 1.01182e+01 302.620 0.8650 
1 1 1 5   119 0  o 10 2.43390e+00 7.64884e-01 4.14069e+01 357.729 3.56577e+00  -1.41416e-01 0.00000e+00 0.00000e+00 3.44934e+01 357.729 6.91351e+00 177.729 0.8446 
1 1 1 5   119 1  o 17 2.44790e+00 7.78999e-01 5.29433e+01 51.039  3.04189e+00  3.76167e+00  0.00000e+00 0.00000e+00 2.74628e+01 51.039  2.54806e+01 231.039 0.8895 
1 1 1 5   119 2  o 18 3.55258e+00 9.09744e-01 2.52149e+01 118.077 -1.38761e+00 2.60128e+00  0.00000e+00 0.00000e+00 8.05478e+01 118.077 5.53330e+01 118.077 0.8061 
1 1 1 5   119 3  o 3  2.86655e+00 8.37797e-01 1.02545e+01 67.582  4.05087e-01  9.81923e-01  0.00000e+00 0.00000e+00 3.92941e+01 67.582  2.90396e+01 67.582  0.4680 
1 1 1 5   119 4  o 14 2.66887e+00 8.24847e-01 3.14181e+01 316.586 2.35439e+00  -2.22754e+00 0.00000e+00 0.00000e+00 5.00362e+01 316.586 1.86181e+01 316.586 0.8263 
1 1 1 5   119 5  o 13 5.56972e+00 1.07827e+00 7.78320e+01 149.770 -1.09113e+01 6.35831e+00  0.00000e+00 0.00000e+00 1.19544e+02 149.770 4.17119e+01 149.770 0.9596 
1 1 1 5   119 6  o 3  2.31081e+00 7.77618e-01 2.43234e+01 325.187 2.03582e+00  -1.41559e+00 0.00000e+00 0.00000e+00 4.07625e+01 325.187 1.64390e+01 325.187 0.7628 
1 1 1 5   120 0  o 18 3.49040e+00 8.93853e-01 3.51467e+01 164.966 -4.13517e+00 1.11066e+00  0.00000e+00 0.00000e+00 7.73925e+01 164.966 4.22458e+01 164.966 0.8735 
1 1 1 5   120 1  o 10 2.96577e+00 8.65695e-01 5.98180e+01 150.749 -5.42701e+00 3.03943e+00  0.00000e+00 0.00000e+00 4.04324e+01 150.749 1.93856e+01 330.749 0.9157 
1 1 1 5   120 2  o 1  2.16334e+00 7.16860e-01 5.34935e+01 134.783 -3.24130e+00 3.26598e+00  0.00000e+00 0.00000e+00 1.70517e+01 134.783 3.64418e+01 314.783 0.8832 
1 1 1 5   120 3  o 4  2.59612e+00 8.11115e-01 4.52125e+01 296.451 2.05409e+00  -4.12864e+00 0.00000e+00 0.00000e+00 3.94765e+01 296.451 5.73600e+00 116.451 0.8835 
1 1 1 5   120 4  o 5  2.51716e+00 8.12751e-01 3.67715e+01 49.016  2.29361e+00  2.64001e+00  0.00000e+00 0.00000e+00 4.13851e+01 49.016  4.61356e+00 49.016  0.8410 
1 1 1 5   120 5  f 0  2.10145e+00 7.21960e-01 3.90807e+01 291.417 1.49631e+00  -3.81483e+00 0.00000e+00 0.00000e+00 2.81981e+01 291.417 1.08826e+01 111.417 0.8672 
1 1 1 5   121 0  o 17 2.72002e+00 8.18248e-01 3.01900e+01 8.205   3.04291e+00  4.38780e-01  0.00000e+00 0.00000e+00 5.16395e+01 8.205   2.14494e+01 8.205   0.8153 
1 1 1 5   121 1  o 13 4.27011e+00 9.80727e-01 9.17606e+01 227.615 -8.51044e+00 -9.32520e+00 0.00000e+00 0.00000e+00 5.94482e+01 227.615 3.23124e+01 47.616  0.9595 
1 1 1 5   121 2  o 14 4.65074e+00 9.96666e-01 7.78007e+01 110.689 -4.06731e+00 1.07700e+01  0.00000e+00 0.00000e+00 8.62163e+01 110.689 8.41557e+00 110.689 0.9555 
1 1 1 5   121 3  o 15 2.79668e+00 8.53486e-01 5.72093e+01 341.740 5.48147e+00  -1.80860e+00 0.00000e+00 0.00000e+00 3.65882e+01 341.740 2.06211e+01 161.740 0.9087 
1 1 1 5   121 4  o 19 2.46656e+00 7.97909e-01 2.38942e+01 216.302 -1.95185e+00 -1.43391e+00 0.00000e+00 0.00000e+00 4.49527e+01 216.302 2.10584e+01 216.302 0.7562 
1 1 1 5   121 5  o 3  3.31476e+00 9.75941e-01 7.46199e+01 100.379 -1.46716e+00 8.01031e+00  0.00000e+00 0.00000e+00 3.99395e+01 100.379 3.46804e+01 280.379 0.9364 
1 1 1 5   122 0  o 18 2.73667e+00 8.22648e-01 4.53525e+01 132.782 -3.32185e+00 3.58948e+00  0.00000e+00 0.00000e+00 4.45663e+01 132.782 7.86271e-01 312.782 0.8908 
1 1 1 5   122 1  f 0  2.91124e+00 8.57085e-01 3.73125e+01 48.482  2.72025e+00  3.07277e+00  0.00000e+00 0.00000e+00 5.58470e+01 48.482  1.85344e+01 48.482  0.8674 
1 1 1 5   122 2  o 4  3.05534e+00 8.60518e-01 4.54028e+01 133.076 -3.57153e+00 3.81988e+00  0.00000e+00 0.00000e+00 5.58785e+01 133.076 1.04757e+01 133.076 0.8984 
1 1 1 5   122 3  o 19 2.34446e+00 7.69028e-01 1.65355e+01 216.327 -1.32909e+00 -9.77273e-01 0.00000e+00 0.00000e+00 3.80512e+01 216.327 2.15156e+01 216.327 0.6310 
1 1 1 5   123 0  o 1  2.53629e+00 7.95321e-01 4.67625e+01 228.501 -3.43789e+00 -3.88596e+00 0.00000e+00 0.00000e+00 3.71799e+01 228.501 9.58260e+00 48.501  0.8976 
1 1 1 5   123 1  o 12 2.27004e+00 7.33601e-01 3.70704e+01 176.391 -3.97351e+00 2.50651e-01  0.00000e+00 0.00000e+00 3.51617e+01 176.391 1.90866e+00 356.390 0.8628 
1 1 1 5   124 0  o 4  2.25899e+00 7.39977e-01 5.60493e+00 252.129 -1.79919e-01 -5.58013e-01 0.00000e+00 0.00000e+00 1.78129e+01 252.129 1.22080e+01 252.129 0.2812 
1 1 1 5   124 1  o 4  2.52275e+00 7.97978e-01 2.65263e+01 151.597 -2.53095e+00 1.36863e+00  0.00000e+00 0.00000e+00 4.79240e+01 151.597 2.13977e+01 151.597 0.8005 
1 1 1 6   0   0  o 5  1.67163e+01 6.26573e-01 3.22419e+02 0.000   2.03178e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.86137e+02 0.000   3.62826e+01 180.000 0.9662 
1 1 1 6   0   1  o 18 1.48816e+01 6.31775e-01 4.44754e+02 180.000 -2.87091e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.12489e+02 180.000 3.32265e+02 0.000   0.9936 
1 1 1 6   0   2  o 15 6.08940e+00 6.81940e-01 9.20997e+01 180.000 -2.15575e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.33733e+01 0.000   1.35473e+02 0.000   0.2123 
1 1 1 6   0   3  o 5  8.88238e+00 6.34224e-01 4.51667e+01 180.000 -1.76721e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.33951e+01 180.000 3.17716e+01 0.000   0.1749 
1 1 1 6   0   4  o 15 1.90760e+01 7.25489e-01 3.04696e+02 0.000   3.07443e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.11333e+02 0.000   1.06637e+02 0.000   0.9957 
1 1 1 6   0   5  o 16 2.52994e+01 8.65141e-01 5.35597e+02 180.000 -8.88133e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.18063e+02 180.000 1.17533e+02 0.000   1.0000 
1 1 1 6   0   6  o 18 7.23301e+00 9.62205e-01 4.85598e+01 0.000   2.23354e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.13389e+01 0.000   3.72209e+01 180.000 0.2197 
1 1 1 6   0   7  o 3  4.05791e+01 1.22520e+00 2.58079e+02 0.000   9.11050e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.27117e+03 0.000   1.01309e+03 0.000   1.0000 
1 1 1 6   0   8  o 9  2.88572e+01 9.73247e-01 2.54533e+02 0.000   8.13428e+00  0.00000e+00  0.00000e+00 0.00000e+00 8.32733e+02 0.000   5.78200e+02 0.000   1.0000 
1 1 1 6   0   9  o 19 1.46325e+01 1.01674e+00 3.61033e+02 180.000 -7.34167e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.90128e+02 180.000 1.70905e+02 0.000   1.0000 
1 1 1 6   0   10 f 0  3.90140e+00 2.10712e+00 9.39926e+01 180.000 -5.65766e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.87420e+01 0.000   1.12735e+02 0.000   0.5122 
1 1 1 6   0   11 o 8  2.23298e+01 1.15269e+00 3.48343e+02 180.000 -1.91731e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.92132e+02 180.000 1.43789e+02 180.000 1.0000 
1 1 1 6   0   12 o 19 7.17047e+00 2.38702e+00 2.14101e+02 180.000 -4.24778e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.55553e+01 180.000 1.58545e+02 0.000   0.9996 
1 1 1 6   0   13 o 11 5.02885e+00 2.47493e+00 1.32460e+02 0.000   2.07949e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.08177e+01 0.000   8.16426e+01 180.000 0.9692 
1 1 1 6   0   14 o 7  3.45444e+00 2.22599e+00 4.67934e+01 0.000   6.36968e-01  0.00000e+00  0.00000e+00 0.00000e+00 2.62728e+01 0.000   2.05205e+01 180.000 0.5628 
1 1 1 6   0   15 o 3  3.45932e+00 2.27828e+00 1.08060e+02 0.000   1.63968e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.24299e+01 0.000   9.56300e+01 180.000 0.9274 
1 1 1 6   0   16 o 6  4.89961e+00 2.97360e+00 1.27267e+02 0.000   2.23760e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.24725e+01 0.000   7.47946e+01 180.000 0.9775 
1 1 1 6   1   0  o 2  5.58255e+00 4.75069e-01 1.03474e+02 98.721  -6.59786e-02 4.30113e-01  0.00000e+00 0.00000e+00 5.87599e+01 278.721 1.62234e+02 278.721 0.2126 
1 1 1 6   1   1  o 15 8.02442e+00 4.85937e-01 3.03416e+02 259.133 -3.97809e-01 -2.07221e+00 0.00000e+00 0.00000e+00 8.71799e+01 79.133  3.90596e+02 79.133  0.7150 
1 1 1 6   1   2  o 16 2.54309e+01 5.78191e-01 4.92834e+02 279.421 1.57427e+00  -9.48796e+00 0.00000e+00 0.00000e+00 4.14410e+02 279.421 7.84237e+01 99.421  0.9465 
1 1 1 6   1   3  o 13 1.02725e+01 4.27883e-01 9.66508e+01 184.257 -8.72307e-01 -6.49357e-02 0.00000e+00 0.00000e+00 5.83334e+01 184.257 3.83175e+01 4.257   0.4002 
1 1 1 6   1   4  o 10 3.22781e+01 6.99813e-01 4.81086e+02 328.112 1.38830e+01  -8.63733e+00 0.00000e+00 0.00000e+00 6.97860e+02 328.112 2.16774e+02 328.112 0.9689 
1 1 1 6   1   5  o 14 3.36313e+01 7.31281e-01 5.57027e+02 209.795 -2.12238e+01 -1.21528e+01 0.00000e+00 0.00000e+00 6.84510e+02 209.795 1.27484e+02 209.795 0.9793 
1 1 1 6   1   6  o 16 6.95101e+01 1.37760e+00 1.27495e+03 71.908  3.38352e+01  1.03567e+02  0.00000e+00 0.00000e+00 1.33294e+03 71.908  5.79892e+01 71.908  0.9954 
1 1 1 6   1   7  o 18 2.09493e+01 6.05071e-01 5.16249e+02 229.826 -1.22929e+01 -1.45599e+01 0.00000e+00 0.00000e+00 2.52234e+02 229.826 2.64015e+02 49.826  0.9734 
1 1 1 6   1   8  o 4  4.38336e+01 9.00518e-01 5.28807e+02 352.164 5.01520e+01  -6.90192e+00 0.00000e+00 0.00000e+00 1.10633e+03 352.164 5.77528e+02 352.164 0.9901 
1 1 1 6   1   9  o 8  3.39620e+01 7.73771e-01 6.26029e+02 179.413 -5.88365e+01 6.03225e-01  0.00000e+00 0.00000e+00 6.42296e+02 179.413 1.62667e+01 179.413 0.9915 
1 1 1 6   1   10 o 14 3.50776e+01 8.35309e-01 4.85878e+02 125.172 -3.32312e+01 4.71577e+01  0.00000e+00 0.00000e+00 8.23442e+02 125.172 3.37564e+02 125.172 0.9913 
1 1 1 6   1   11 o 6  8.79736e+00 1.24266e+00 1.66336e+02 212.020 -5.65448e+00 -3.53604e+00 0.00000e+00 0.00000e+00 1.38842e+02 212.020 2.74948e+01 32.020  0.9216 
1 1 1 6   1   12 o 7  1.71816e+01 9.57985e-01 3.68695e+02 354.616 4.36804e+01  -4.11674e+00 0.00000e+00 0.00000e+00 2.70296e+02 354.616 9.83992e+01 174.616 0.9885 
1 1 1 6   1   13 f 0  4.37882e+00 1.33283e+00 1.65298e+02 222.661 -3.91416e+00 -3.60701e+00 0.00000e+00 0.00000e+00 1.70505e+01 42.661  1.82349e+02 42.661  0.9004 
1 1 1 6   1   14 o 12 1.55421e+01 1.13394e+00 2.53188e+02 63.362  1.68839e+01  3.36602e+01  0.00000e+00 0.00000e+00 3.23080e+02 63.362  6.98925e+01 63.362  0.9866 
1 1 1 6   1   15 o 8  2.16831e+01 1.21238e+00 3.14536e+02 347.355 7.16647e+01  -1.60773e+01 0.00000e+00 0.00000e+00 4.94231e+02 347.355 1.79694e+02 347.355 0.9932 
1 1 1 6   1   16 o 5  5.42273e+00 1.66404e+00 6.00320e+01 233.341 -1.79405e+00 -2.41054e+00 0.00000e+00 0.00000e+00 1.04883e+02 233.341 4.48514e+01 233.341 0.8103 
1 1 1 6   2   0  o 17 1.20615e+01 4.08934e-01 2.41536e+02 281.606 4.41293e-01  -2.14863e+00 0.00000e+00 0.00000e+00 8.89071e+01 281.606 1.52629e+02 101.606 0.7271 
1 1 1 6   2   1  o 19 1.21741e+01 4.82819e-01 2.68625e+02 109.001 -9.21690e-01 2.67657e+00  0.00000e+00 0.00000e+00 9.68756e+01 109.001 1.71750e+02 289.001 0.7967 
1 1 1 6   2   2  o 1  1.28787e+01 4.33392e-01 7.18163e+01 135.289 -5.04954e-01 4.99879e-01  0.00000e+00 0.00000e+00 9.05968e+01 135.289 1.87804e+01 135.289 0.3346 
1 1 1 6   2   3  o 8  1.05379e+01 6.27975e-01 2.88408e+02 258.187 -5.45808e-01 -2.60973e+00 0.00000e+00 0.00000e+00 2.21932e+01 258.187 2.66215e+02 78.187  0.7819 
1 1 1 6   2   4  o 17 2.21878e+01 5.50245e-01 4.73583e+02 180.970 -1.10974e+01 -1.87894e-01 0.00000e+00 0.00000e+00 3.24191e+02 180.970 1.49392e+02 0.970   0.9538 
1 1 1 6   2   5  o 1  1.70591e+01 5.08275e-01 2.86103e+02 283.253 1.47014e+00  -6.24197e+00 0.00000e+00 0.00000e+00 3.04421e+02 283.253 1.83185e+01 283.253 0.9183 
1 1 1 6   2   6  o 1  4.28695e+01 8.95116e-01 7.26320e+02 339.793 3.83937e+01  -1.41312e+01 0.00000e+00 0.00000e+00 8.69612e+02 339.793 1.43291e+02 339.793 0.9877 
1 1 1 6   2   7  o 3  3.25201e+01 7.14512e-01 4.91660e+02 193.744 -2.72272e+01 -6.65951e+00 0.00000e+00 0.00000e+00 7.11809e+02 193.744 2.20149e+02 193.744 0.9820 
1 1 1 6   2   8  o 14 8.64472e+00 8.11454e-01 4.54510e+01 222.360 -6.37986e-01 -5.81755e-01 0.00000e+00 0.00000e+00 8.34989e+01 222.360 3.80479e+01 222.360 0.3959 
1 1 1 6   2   9  o 19 2.47883e+01 7.03441e-01 2.75408e+02 230.184 -1.21620e+01 -1.45889e+01 0.00000e+00 0.00000e+00 6.33364e+02 230.184 3.57955e+02 230.184 0.9733 
1 1 1 6   2   10 o 7  3.86981e+01 8.70803e-01 6.75067e+02 345.575 8.52981e+01  -2.19410e+01 0.00000e+00 0.00000e+00 7.73775e+02 345.575 9.87083e+01 345.575 0.9943 
1 1 1 6   2   11 o 16 1.95359e+01 8.39385e-01 3.49026e+02 126.313 -1.98275e+01 2.69790e+01  0.00000e+00 0.00000e+00 3.75220e+02 126.313 2.61941e+01 126.313 0.9850 
1 1 1 6   2   12 o 10 1.86700e+01 9.12448e-01 3.76726e+02 3.314   4.91713e+01  2.84734e+00  0.00000e+00 0.00000e+00 3.18503e+02 3.314   5.82223e+01 183.314 0.9898 
1 1 1 6   2   13 o 11 6.88734e+00 1.49581e+00 1.13178e+02 173.808 -5.35694e+00 5.81154e-01  0.00000e+00 0.00000e+00 1.20335e+02 173.808 7.15734e+00 173.808 0.9017 
1 1 1 6   2   14 o 5  6.36896e+00 1.49414e+00 6.35226e+01 292.519 1.26704e+00  -3.05600e+00 0.00000e+00 0.00000e+00 1.35236e+02 292.519 7.17134e+01 292.519 0.8304 
1 1 1 6   2   15 o 15 5.11946e+00 1.44518e+00 7.79857e+01 103.644 -9.01362e-01 3.71333e+00  0.00000e+00 0.00000e+00 8.66467e+01 103.644 8.66097e+00 103.644 0.8563 
1 1 1 6   2   16 o 13 4.93573e+00 1.52722e+00 1.19372e+02 203.880 -5.37959e+00 -2.38162e+00 0.00000e+00 0.00000e+00 4.92847e+01 203.880 7.00878e+01 23.880  0.9105 
1 1 1 6   3   0  o 4  1.79668e+01 4.58458e-01 4.31770e+02 73.848  1.62028e+00  5.59444e+00  0.00000e+00 0.00000e+00 1.83941e+02 73.848  2.47829e+02 253.848 0.9095 
1 1 1 6   3   1  o 17 2.20823e+01 6.11076e-01 2.67339e+02 63.820  2.24482e+00  4.56617e+00  0.00000e+00 0.00000e+00 4.77792e+02 63.820  2.10453e+02 63.820  0.8954 
1 1 1 6   3   2  f 0  2.49974e+01 6.68663e-01 1.62388e+02 46.788  2.12364e+00  2.26053e+00  0.00000e+00 0.00000e+00 6.07588e+02 46.788  4.45200e+02 46.788  0.8172 
1 1 1 6   3   3  o 12 1.40349e+01 5.17106e-01 3.94247e+02 92.973  -2.77238e-01 5.33876e+00  0.00000e+00 0.00000e+00 8.23321e+01 92.973  3.11915e+02 272.973 0.9008 
1 1 1 6   3   4  f 0  3.94593e+01 8.20800e-01 9.08441e+02 254.422 -1.00846e+01 -3.61722e+01 0.00000e+00 0.00000e+00 5.59069e+02 254.422 3.49372e+02 74.422  0.9866 
1 1 1 6   3   5  f 0  1.98287e+01 5.35150e-01 4.20677e+02 212.696 -9.21067e+00 -5.91220e+00 0.00000e+00 0.00000e+00 2.91747e+02 212.696 1.28930e+02 32.696  0.9532 
1 1 1 6   3   6  o 3  5.22820e+01 1.05795e+00 9.24596e+02 116.877 -2.84748e+01 5.61828e+01  0.00000e+00 0.00000e+00 1.03026e+03 116.877 1.05661e+02 116.877 0.9920 
1 1 1 6   3   7  o 19 3.57468e+01 7.59921e-01 8.19768e+02 38.163  4.02857e+01  3.16599e+01  0.00000e+00 0.00000e+00 5.14144e+02 38.163  3.05625e+02 218.163 0.9902 
1 1 1 6   3   8  o 3  4.41063e+01 8.99849e-01 7.88626e+02 212.639 -6.39464e+01 -4.09572e+01 0.00000e+00 0.00000e+00 8.62186e+02 212.639 7.35599e+01 212.639 0.9934 
1 1 1 6   3   9  o 15 2.51630e+01 7.06032e-01 5.37355e+02 17.823  3.57977e+01  1.15095e+01  0.00000e+00 0.00000e+00 3.97760e+02 17.823  1.39595e+02 197.823 0.9866 
1 1 1 6   3   10 o 12 2.52575e+01 7.63274e-01 3.35612e+02 105.109 -7.53139e+00 2.78959e+01  0.00000e+00 0.00000e+00 5.98823e+02 105.109 2.63211e+02 105.109 0.9825 
1 1 1 6   3   11 o 17 1.63434e+01 8.59512e-01 2.54594e+02 219.397 -1.57344e+01 -1.29232e+01 0.00000e+00 0.00000e+00 3.45250e+02 219.397 9.06561e+01 219.397 0.9751 
1 1 1 6   3   12 o 13 1.08538e+01 1.16572e+00 1.85326e+02 152.025 -1.16312e+01 6.17789e+00  0.00000e+00 0.00000e+00 2.07187e+02 152.025 2.18617e+01 152.025 0.9613 
1 1 1 6   3   13 o 3  1.32432e+01 1.11739e+00 2.47239e+02 326.491 2.16525e+01  -1.43362e+01 0.00000e+00 0.00000e+00 2.41046e+02 326.491 6.19302e+00 146.491 0.9806 
1 1 1 6   3   14 o 9  4.38790e+00 1.34653e+00 9.98273e+01 168.607 -3.75263e+00 7.56206e-01  0.00000e+00 0.00000e+00 4.14179e+01 168.607 5.84094e+01 348.607 0.8566 
1 1 1 6   3   15 o 3  1.00288e+01 1.60406e+00 2.25303e+02 284.744 5.06235e+00  -1.92370e+01 0.00000e+00 0.00000e+00 1.41744e+02 284.744 8.35592e+01 104.744 0.9745 
1 1 1 6   3   16 o 12 5.66629e+00 1.71541e+00 2.85490e+01 294.365 5.97963e-01  -1.32034e+00 0.00000e+00 0.00000e+00 9.55078e+01 294.365 6.69588e+01 294.365 0.5834 
1 1 1 6   4   0  f 0  1.22445e+01 4.10737e-01 1.97624e+01 135.607 -1.29498e-01 1.26783e-01  0.00000e+00 0.00000e+00 2.18708e+01 135.607 2.10836e+00 135.607 0.0902 
1 1 1 6   4   1  o 6  3.08246e+01 7.62969e-01 7.21353e+02 233.525 -1.13224e+01 -1.53152e+01 0.00000e+00 0.00000e+00 4.09363e+02 233.525 3.11991e+02 53.525  0.9734 
1 1 1 6   4   2  o 15 2.60266e+01 5.85820e-01 5.96637e+02 353.244 1.17727e+01  -1.39455e+00 0.00000e+00 0.00000e+00 3.42000e+02 353.244 2.54636e+02 173.244 0.9568 
1 1 1 6   4   3  o 15 2.40633e+01 6.54165e-01 6.29657e+02 247.579 -5.55707e+00 -1.34684e+01 0.00000e+00 0.00000e+00 2.45691e+02 247.579 3.83966e+02 67.579  0.9650 
1 1 1 6   4   4  o 10 3.25056e+01 7.03006e-01 5.53568e+02 112.630 -7.25537e+00 1.74042e+01  0.00000e+00 0.00000e+00 6.38795e+02 112.630 8.52273e+01 112.630 0.9731 
1 1 1 6   4   5  o 19 2.07367e+01 5.46877e-01 2.35294e+02 20.179  6.00148e+00  2.20564e+00  0.00000e+00 0.00000e+00 4.82323e+02 20.179  2.47030e+02 20.179  0.9181 
1 1 1 6   4   6  o 9  4.48545e+01 8.79875e-01 9.24326e+02 46.331  3.75941e+01  3.93830e+01  0.00000e+00 0.00000e+00 7.50670e+02 46.331  1.73657e+02 226.331 0.9908 
1 1 1 6   4   7  o 19 3.91381e+01 8.07223e-01 7.76180e+02 216.613 -4.25064e+01 -3.15826e+01 0.00000e+00 0.00000e+00 6.84737e+02 216.613 9.14424e+01 36.613  0.9905 
1 1 1 6   4   8  o 11 2.41897e+01 6.54038e-01 5.70337e+02 55.518  1.73175e+01  2.52145e+01  0.00000e+00 0.00000e+00 3.26024e+02 55.518  2.44313e+02 235.518 0.9835 
1 1 1 6   4   9  o 16 1.80900e+01 6.84647e-01 3.34019e+02 234.163 -9.85019e+00 -1.36392e+01 0.00000e+00 0.00000e+00 3.26791e+02 234.163 7.22742e+00 54.163  0.9698 
1 1 1 6   4   10 o 15 1.73273e+01 7.99098e-01 2.58617e+02 253.654 -4.28218e+00 -1.46006e+01 0.00000e+00 0.00000e+00 3.71998e+02 253.654 1.13382e+02 253.654 0.9666 
1 1 1 6   4   11 o 4  2.52054e+01 8.13870e-01 4.38386e+02 110.729 -1.92664e+01 5.09076e+01  0.00000e+00 0.00000e+00 5.01548e+02 110.729 6.31618e+01 110.729 0.9908 
1 1 1 6   4   12 f 0  2.58433e+01 8.99504e-01 4.81404e+02 303.919 4.87422e+01  -7.24830e+01 0.00000e+00 0.00000e+00 4.85265e+02 303.919 3.86085e+00 303.919 0.9943 
1 1 1 6   4   13 o 5  8.84027e+00 1.53839e+00 2.17650e+02 240.907 -6.35878e+00 -1.14276e+01 0.00000e+00 0.00000e+00 1.01783e+02 240.907 1.15867e+02 60.907  0.9610 
1 1 1 6   4   14 o 13 1.20981e+01 1.30936e+00 1.27266e+02 359.263 1.36738e+01  -1.75911e-01 0.00000e+00 0.00000e+00 3.10424e+02 359.263 1.83158e+02 359.263 0.9627 
1 1 1 6   4   15 o 14 9.60026e+00 1.63944e+00 2.34247e+02 99.436  -3.18508e+00 1.91639e+01  0.00000e+00 0.00000e+00 1.16888e+02 99.436  1.17359e+02 279.436 0.9739 
1 1 1 6   4   16 o 3  5.68560e+00 1.68256e+00 1.41862e+02 277.459 9.56025e-01  -7.30200e+00 0.00000e+00 0.00000e+00 5.64454e+01 277.459 8.54162e+01 97.459  0.9294 
1 1 1 6   5   0  o 10 7.55722e+00 4.27266e-01 1.14215e+02 164.513 -6.20431e-01 1.71909e-01  0.00000e+00 0.00000e+00 2.70011e+01 344.513 1.41216e+02 344.513 0.3063 
1 1 1 6   5   1  o 9  2.36120e+01 6.30742e-01 3.66942e+02 162.047 -7.05584e+00 2.28613e+00  0.00000e+00 0.00000e+00 4.60508e+02 162.047 9.35663e+01 162.047 0.9299 
1 1 1 6   5   2  o 13 1.73422e+01 4.73874e-01 1.21967e+02 23.264  1.68682e+00  7.25204e-01  0.00000e+00 0.00000e+00 3.15276e+02 23.264  1.93309e+02 23.264  0.6689 
1 1 1 6   5   3  o 2  3.46151e+01 8.48987e-01 5.81356e+02 221.123 -1.44671e+01 -1.26305e+01 0.00000e+00 0.00000e+00 6.88984e+02 221.123 1.07628e+02 221.123 0.9736 
1 1 1 6   5   4  o 1  2.43587e+01 5.79243e-01 5.33749e+02 282.151 2.87192e+00  -1.33379e+01 0.00000e+00 0.00000e+00 3.50135e+02 282.151 1.83614e+02 102.151 0.9626 
1 1 1 6   5   5  o 2  2.93203e+01 6.61820e-01 5.33593e+02 252.151 -6.25504e+00 -1.94251e+01 0.00000e+00 0.00000e+00 5.44168e+02 252.151 1.05753e+01 252.151 0.9752 
1 1 1 6   5   6  o 6  5.22887e+01 9.99844e-01 7.96106e+02 96.808  -6.43813e+00 5.39300e+01  0.00000e+00 0.00000e+00 1.15643e+03 96.808  3.60329e+02 96.808  0.9908 
1 1 1 6   5   7  o 8  3.32289e+01 7.22978e-01 5.46357e+02 144.210 -2.57611e+01 1.85729e+01  0.00000e+00 0.00000e+00 6.85975e+02 144.210 1.39618e+02 144.210 0.9841 
1 1 1 6   5   8  o 15 3.32712e+01 7.78409e-01 3.88611e+02 164.771 -2.74425e+01 7.47111e+00  0.00000e+00 0.00000e+00 8.42682e+02 164.771 4.54072e+02 164.771 0.9823 
1 1 1 6   5   9  o 9  2.47336e+01 7.12973e-01 3.59494e+02 83.677  2.94093e+00  2.65428e+01  0.00000e+00 0.00000e+00 5.54500e+02 83.677  1.95006e+02 83.677  0.9811 
1 1 1 6   5   10 o 9  3.32195e+01 8.04718e-01 6.90173e+02 201.944 -7.21382e+01 -2.90640e+01 0.00000e+00 0.00000e+00 5.52571e+02 201.944 1.37602e+02 21.944  0.9936 
1 1 1 6   5   11 o 14 9.25278e+00 1.20604e+00 7.38738e+01 207.576 -2.77909e+00 -1.45137e+00 0.00000e+00 0.00000e+00 2.11524e+02 207.576 1.37650e+02 207.576 0.8195 
1 1 1 6   5   12 o 17 9.74576e+00 1.26259e+00 1.67874e+02 274.666 8.46436e-01  -1.03695e+01 0.00000e+00 0.00000e+00 1.80675e+02 274.666 1.28016e+01 274.666 0.9507 
1 1 1 6   5   13 o 16 6.33045e+00 1.52983e+00 1.66723e+02 158.253 -6.68417e+00 2.66633e+00  0.00000e+00 0.00000e+00 5.40887e+01 158.253 1.12635e+02 338.253 0.9277 
1 1 1 6   5   14 o 14 8.67255e+00 1.65324e+00 1.85045e+02 199.633 -1.14720e+01 -4.09241e+00 0.00000e+00 0.00000e+00 1.27181e+02 199.633 5.78637e+01 19.633  0.9580 
1 1 1 6   5   15 o 17 1.22948e+01 1.60218e+00 2.44480e+02 235.369 -1.50489e+01 -2.17894e+01 0.00000e+00 0.00000e+00 2.08444e+02 235.369 3.60361e+01 55.369  0.9809 
1 1 1 6   5   16 o 10 5.58168e+00 1.66963e+00 1.14338e+02 3.217   5.86061e+00  3.29387e-01  0.00000e+00 0.00000e+00 7.63410e+01 3.217   3.79970e+01 183.217 0.9103 
1 1 1 6   6   0  o 12 1.99702e+01 5.69246e-01 3.44401e+02 5.789   5.97751e+00  6.06043e-01  0.00000e+00 0.00000e+00 3.42156e+02 5.789   2.24501e+00 185.789 0.9125 
1 1 1 6   6   1  o 19 1.69040e+01 4.60448e-01 3.78039e+02 226.212 -3.78047e+00 -3.94395e+00 0.00000e+00 0.00000e+00 1.97264e+02 226.212 1.80775e+02 46.212  0.9031 
1 1 1 6   6   2  o 19 1.43114e+01 4.46719e-01 2.42598e+02 99.040  -4.72049e-01 2.96702e+00  0.00000e+00 0.00000e+00 1.94479e+02 99.040  4.81185e+01 279.040 0.8103 
1 1 1 6   6   3  o 4  3.07880e+01 7.77389e-01 6.96311e+02 279.250 3.28646e+00  -2.01798e+01 0.00000e+00 0.00000e+00 4.35446e+02 279.250 2.60865e+02 99.250  0.9752 
1 1 1 6   6   4  o 9  3.29894e+01 7.13244e-01 6.90417e+02 202.725 -2.19252e+01 -9.18294e+00 0.00000e+00 0.00000e+00 5.26653e+02 202.725 1.63763e+02 22.725  0.9787 
1 1 1 6   6   5  o 5  1.10303e+01 4.97682e-01 3.52224e+02 24.843  4.61369e+00  2.13598e+00  0.00000e+00 0.00000e+00 2.00117e+01 24.843  3.32212e+02 204.842 0.8953 
1 1 1 6   6   6  o 15 6.72348e+00 7.62777e-01 2.43266e+02 62.366  9.98984e-01  1.90813e+00  0.00000e+00 0.00000e+00 6.04386e+01 242.366 3.03705e+02 242.366 0.7215 
1 1 1 6   6   7  o 5  3.03679e+01 6.79038e-01 6.58177e+02 299.913 1.74558e+01  -3.03403e+01 0.00000e+00 0.00000e+00 4.69733e+02 299.913 1.88444e+02 119.913 0.9856 
1 1 1 6   6   8  o 4  4.20866e+01 8.66254e-01 7.95723e+02 299.741 3.63053e+01  -6.35453e+01 0.00000e+00 0.00000e+00 7.79042e+02 299.741 1.66806e+01 119.741 0.9931 
1 1 1 6   6   9  o 7  3.24194e+01 7.68630e-01 4.94670e+02 266.567 -2.86852e+00 -4.78243e+01 0.00000e+00 0.00000e+00 7.13600e+02 266.567 2.18929e+02 266.567 0.9895 
1 1 1 6   6   10 o 3  3.83176e+01 8.86233e-01 5.55638e+02 125.013 -4.10567e+01 5.86072e+01  0.00000e+00 0.00000e+00 8.76992e+02 125.013 3.21354e+02 125.013 0.9930 
1 1 1 6   6   11 o 18 1.48909e+01 8.63705e-01 2.71513e+02 289.037 6.43894e+00  -1.86606e+01 0.00000e+00 0.00000e+00 2.74555e+02 289.037 3.04155e+00 289.037 0.9743 
1 1 1 6   6   12 o 8  8.25435e+00 1.32375e+00 2.25119e+02 143.871 -9.36314e+00 6.83508e+00  0.00000e+00 0.00000e+00 7.16979e+01 143.871 1.53421e+02 323.871 0.9558 
1 1 1 6   6   13 o 7  8.08374e+00 1.46294e+00 2.12226e+02 193.758 -1.16584e+01 -2.85451e+00 0.00000e+00 0.00000e+00 7.87749e+01 193.758 1.33451e+02 13.758  0.9574 
1 1 1 6   6   14 o 10 9.08487e+00 1.54030e+00 2.14044e+02 309.505 9.89549e+00  -1.20019e+01 0.00000e+00 0.00000e+00 1.16189e+02 309.505 9.78550e+01 129.505 0.9673 
1 1 1 6   6   15 o 14 7.12217e+00 1.73765e+00 9.09674e+01 111.787 -2.01523e+00 5.04180e+00  0.00000e+00 0.00000e+00 1.50416e+02 111.787 5.94483e+01 111.787 0.9025 
1 1 1 6   6   16 f 0  5.43871e+00 1.68323e+00 1.47383e+02 343.414 7.53522e+00  -2.24435e+00 0.00000e+00 0.00000e+00 4.32593e+01 343.414 1.04124e+02 163.414 0.9341 
1 1 1 6   7   0  o 4  1.96422e+01 4.84695e-01 4.76547e+02 6.210   8.09630e+00  8.80978e-01  0.00000e+00 0.00000e+00 2.16440e+02 6.210   2.60107e+02 186.210 0.9364 
1 1 1 6   7   1  o 12 7.03190e+00 4.46101e-01 7.20445e+01 202.458 -3.98341e-01 -1.64655e-01 0.00000e+00 0.00000e+00 1.62222e+01 22.458  8.82667e+01 22.458  0.2107 
1 1 1 6   7   2  o 10 2.16775e+01 5.28258e-01 4.91608e+02 2.258   9.16451e+00  3.61431e-01  0.00000e+00 0.00000e+00 2.79487e+02 2.258   2.12121e+02 182.258 0.9438 
1 1 1 6   7   3  o 7  8.27032e+00 5.46929e-01 3.54289e+02 344.507 2.69908e+00  -7.48147e-01 0.00000e+00 0.00000e+00 1.06741e+02 164.507 4.61030e+02 164.507 0.7941 
1 1 1 6   7   4  o 9  1.89317e+01 5.10095e-01 4.99806e+02 304.827 5.65376e+00  -8.12660e+00 0.00000e+00 0.00000e+00 1.76738e+02 304.827 3.23068e+02 124.827 0.9481 
1 1 1 6   7   5  o 3  1.97513e+01 5.19213e-01 3.48206e+02 349.469 8.08554e+00  -1.50305e+00 0.00000e+00 0.00000e+00 3.49421e+02 349.469 1.21549e+00 349.469 0.9371 
1 1 1 6   7   6  o 8  5.52749e+01 1.04490e+00 1.00396e+03 356.729 7.19548e+01  -4.11193e+00 0.00000e+00 0.00000e+00 1.06478e+03 356.729 6.08214e+01 356.729 0.9930 
1 1 1 6   7   7  o 9  2.92895e+01 6.65838e-01 3.91645e+02 127.329 -1.21759e+01 1.59664e+01  0.00000e+00 0.00000e+00 6.84229e+02 127.329 2.92584e+02 127.329 0.9748 
1 1 1 6   7   8  o 10 3.38567e+01 7.46370e-01 6.68292e+02 141.993 -3.92450e+01 3.06696e+01  0.00000e+00 0.00000e+00 5.94384e+02 141.993 7.39078e+01 321.993 0.9899 
1 1 1 6   7   9  o 10 8.91067e+00 9.60701e-01 1.74087e+02 354.625 4.52579e+00  -4.25839e-01 0.00000e+00 0.00000e+00 1.21812e+02 354.625 5.22743e+01 174.625 0.8817 
1 1 1 6   7   10 o 18 2.53805e+01 9.21097e-01 3.53492e+02 208.959 -2.62641e+01 -1.45340e+01 0.00000e+00 0.00000e+00 5.86072e+02 208.959 2.32580e+02 208.959 0.9832 
1 1 1 6   7   11 o 19 2.80089e+01 8.21057e-01 4.72699e+02 181.256 -6.50074e+01 -1.42533e+00 0.00000e+00 0.00000e+00 5.73324e+02 181.256 1.00624e+02 181.256 0.9923 
1 1 1 6   7   12 o 18 1.55440e+01 9.80572e-01 3.54802e+02 40.676  2.87471e+01  2.47054e+01  0.00000e+00 0.00000e+00 2.22186e+02 40.676  1.32616e+02 220.676 0.9867 
1 1 1 6   7   13 o 3  7.28351e+00 1.38957e+00 7.31368e+01 4.623   3.81881e+00  3.08801e-01  0.00000e+00 0.00000e+00 1.61479e+02 4.623   8.83419e+01 4.623   0.8567 
1 1 1 6   7   14 o 14 9.08578e+00 1.54069e+00 1.79354e+02 84.322  1.33560e+00  1.34331e+01  0.00000e+00 0.00000e+00 1.49169e+02 84.322  3.01843e+01 264.322 0.9622 
1 1 1 6   7   15 o 11 4.42621e+00 1.42575e+00 1.26268e+02 38.040  4.36587e+00  3.41587e+00  0.00000e+00 0.00000e+00 2.40984e+01 38.040  1.02170e+02 218.040 0.9046 
1 1 1 6   7   16 o 13 7.78583e+00 1.95833e+00 1.64811e+02 147.674 -8.97876e+00 5.68195e+00  0.00000e+00 0.00000e+00 1.13260e+02 147.674 5.15502e+01 327.673 0.9517 
1 1 1 6   8   0  o 4  2.47526e+01 5.58759e-01 5.65049e+02 253.572 -3.41584e+00 -1.15854e+01 0.00000e+00 0.00000e+00 3.28023e+02 253.572 2.37026e+02 73.572  0.9577 
1 1 1 6   8   1  o 2  7.09892e+00 4.47228e-01 1.13274e+02 295.795 2.74601e-01  -5.68176e-01 0.00000e+00 0.00000e+00 3.28084e+01 115.795 1.46082e+02 115.795 0.3008 
1 1 1 6   8   2  o 6  1.29423e+01 4.95981e-01 3.58600e+02 320.739 3.07991e+00  -2.51736e+00 0.00000e+00 0.00000e+00 6.21881e+01 320.739 2.96412e+02 140.739 0.8627 
1 1 1 6   8   3  o 3  8.58740e+00 5.88036e-01 1.32218e+01 84.009  1.12767e-02  1.07459e-01  0.00000e+00 0.00000e+00 4.23914e+00 84.009  8.98269e+00 264.009 0.0539 
1 1 1 6   8   4  o 17 2.84538e+01 6.10010e-01 4.35152e+02 190.874 -1.26593e+01 -2.43191e+00 0.00000e+00 0.00000e+00 5.94876e+02 190.874 1.59724e+02 190.874 0.9604 
1 1 1 6   8   5  o 17 3.14019e+01 6.61669e-01 5.87214e+02 29.886  1.90059e+01  1.09228e+01  0.00000e+00 0.00000e+00 5.69056e+02 29.886  1.81580e+01 209.886 0.9769 
1 1 1 6   8   6  o 5  2.26189e+01 5.67558e-01 4.10997e+02 183.398 -1.22657e+01 -7.28287e-01 0.00000e+00 0.00000e+00 4.06005e+02 183.398 4.99191e+00 3.398   0.9584 
1 1 1 6   8   7  o 7  1.32313e+01 5.74578e-01 3.59972e+02 104.148 -2.04296e+00 8.10464e+00  0.00000e+00 0.00000e+00 1.07761e+02 104.148 2.52211e+02 284.148 0.9381 
1 1 1 6   8   8  o 10 2.55392e+01 6.55436e-01 4.30716e+02 225.319 -1.71038e+01 -1.72951e+01 0.00000e+00 0.00000e+00 5.11458e+02 225.319 8.07420e+01 225.319 0.9792 
1 1 1 6   8   9  o 13 2.27155e+01 6.95254e-01 3.61688e+02 88.416  6.81659e-01  2.46431e+01  0.00000e+00 0.00000e+00 4.76326e+02 88.416  1.14638e+02 88.416  0.9795 
1 1 1 6   8   10 o 16 2.84907e+01 8.01768e-01 2.29131e+02 8.179   2.18885e+01  3.14587e+00  0.00000e+00 0.00000e+00 8.19029e+02 8.179   5.89898e+02 8.179   0.9771 
1 1 1 6   8   11 o 13 1.46513e+01 9.15839e-01 2.02743e+02 125.568 -8.96757e+00 1.25406e+01  0.00000e+00 0.00000e+00 3.30476e+02 125.568 1.27733e+02 125.568 0.9670 
1 1 1 6   8   12 o 16 1.50606e+01 9.55831e-01 1.50874e+02 153.216 -1.41244e+01 7.12972e+00  0.00000e+00 0.00000e+00 3.97476e+02 153.216 2.46602e+02 153.216 0.9679 
1 1 1 6   8   13 o 12 8.52975e+00 1.38441e+00 1.27375e+02 356.858 7.81498e+00  -4.29044e-01 0.00000e+00 0.00000e+00 1.72084e+02 356.858 4.47092e+01 356.858 0.9337 
1 1 1 6   8   14 o 13 4.94976e+00 1.42738e+00 7.98868e+01 286.878 1.00323e+00  -3.30656e+00 0.00000e+00 0.00000e+00 7.61164e+01 286.878 3.77040e+00 106.878 0.8387 
1 1 1 6   8   15 o 16 7.79190e+00 1.72948e+00 1.84799e+02 105.229 -3.18257e+00 1.16908e+01  0.00000e+00 0.00000e+00 9.54604e+01 105.229 8.93389e+01 285.228 0.9578 
1 1 1 6   8   16 o 1  5.55035e+00 1.74115e+00 8.05753e+01 236.669 -2.32467e+00 -3.53485e+00 0.00000e+00 0.00000e+00 1.01016e+02 236.669 2.04405e+01 236.669 0.8718 
1 1 1 6   9   0  o 9  1.60365e+01 4.43463e-01 2.66326e+02 171.529 -3.62998e+00 5.40635e-01  0.00000e+00 0.00000e+00 2.46915e+02 171.529 1.94113e+01 351.529 0.8495 
1 1 1 6   9   1  o 10 2.51905e+01 5.71336e-01 4.53156e+02 2.836   8.87535e+00  4.39702e-01  0.00000e+00 0.00000e+00 4.40951e+02 2.836   1.22042e+01 182.836 0.9419 
1 1 1 6   9   2  o 4  1.52705e+01 5.19351e-01 4.93572e+02 187.505 -6.36910e+00 -8.39061e-01 0.00000e+00 0.00000e+00 3.50249e+01 187.505 4.58547e+02 7.505   0.9185 
1 1 1 6   9   3  o 11 3.00920e+01 6.59151e-01 4.85742e+02 33.169  1.15784e+01  7.56776e+00  0.00000e+00 0.00000e+00 6.06654e+02 33.169  1.20912e+02 33.169  0.9631 
1 1 1 6   9   4  o 15 3.81129e+01 7.57461e-01 1.03530e+03 104.698 -1.03513e+01 3.94609e+01  0.00000e+00 0.00000e+00 3.83537e+02 104.698 6.51764e+02 284.698 0.9877 
1 1 1 6   9   5  o 15 1.10482e+01 4.79460e-01 3.36073e+02 317.481 3.26106e+00  -2.99015e+00 0.00000e+00 0.00000e+00 2.95683e+01 317.481 3.06504e+02 137.481 0.8781 
1 1 1 6   9   6  o 5  4.73266e+01 9.15376e-01 9.62160e+02 35.866  4.80786e+01  3.47592e+01  0.00000e+00 0.00000e+00 8.06354e+02 35.866  1.55806e+02 215.866 0.9915 
1 1 1 6   9   7  o 3  2.34635e+01 6.05066e-01 3.85952e+02 302.245 8.28602e+00  -1.31349e+01 0.00000e+00 0.00000e+00 4.69227e+02 302.245 8.32750e+01 302.245 0.9672 
1 1 1 6   9   8  o 6  2.05702e+01 6.32552e-01 3.19659e+02 16.209  1.54598e+01  4.49399e+00  0.00000e+00 0.00000e+00 4.30819e+02 16.209  1.11159e+02 16.209  0.9684 
1 1 1 6   9   9  o 19 1.62762e+01 7.24162e-01 2.78011e+02 129.209 -8.55437e+00 1.04855e+01  0.00000e+00 0.00000e+00 3.11891e+02 129.209 3.38806e+01 129.209 0.9623 
1 1 1 6   9   10 o 15 2.86511e+01 7.93643e-01 4.62245e+02 181.261 -5.09118e+01 -1.12038e+00 0.00000e+00 0.00000e+00 6.05827e+02 181.261 1.43582e+02 181.261 0.9901 
1 1 1 6   9   11 o 14 1.20015e+01 1.04751e+00 2.59182e+02 148.909 -1.34741e+01 8.12520e+00  0.00000e+00 0.00000e+00 1.77896e+02 148.909 8.12865e+01 328.909 0.9677 
1 1 1 6   9   12 o 5  1.65081e+01 9.60356e-01 2.08608e+02 277.811 3.25338e+00  -2.37166e+01 0.00000e+00 0.00000e+00 3.99277e+02 277.811 1.90669e+02 277.811 0.9789 
1 1 1 6   9   13 o 8  1.37983e+01 1.13122e+00 3.05145e+02 359.556 3.31796e+01  -2.57090e-01 0.00000e+00 0.00000e+00 2.05763e+02 359.556 9.93820e+01 179.556 0.9848 
1 1 1 6   9   14 f 0  4.77926e+00 1.42539e+00 1.05549e+02 101.829 -9.04156e-01 4.31684e+00  0.00000e+00 0.00000e+00 5.20630e+01 101.829 5.34860e+01 281.830 0.8776 
1 1 1 6   9   15 o 3  1.40159e+01 1.52170e+00 1.57776e+02 184.437 -2.07623e+01 -1.61124e+00 0.00000e+00 0.00000e+00 3.55751e+02 184.437 1.97975e+02 184.437 0.9757 
1 1 1 6   9   16 o 12 8.18983e+00 2.01126e+00 1.44870e+02 60.879  4.62865e+00  8.30877e+00  0.00000e+00 0.00000e+00 1.45822e+02 60.879  9.52016e-01 60.879  0.9459 
1 1 1 6   10  0  o 12 7.87432e+00 4.79179e-01 8.70334e+01 160.687 -5.51347e-01 1.93222e-01  0.00000e+00 0.00000e+00 3.87698e+00 340.687 9.09104e+01 340.687 0.2803 
1 1 1 6   10  1  o 8  8.01942e+00 4.33739e-01 2.29816e+02 265.519 -1.11553e-01 -1.42353e+00 0.00000e+00 0.00000e+00 5.52180e+01 85.519  2.85034e+02 85.519  0.5778 
1 1 1 6   10  2  o 18 1.34663e+01 4.98260e-01 3.01781e+02 56.918  1.88070e+00  2.88703e+00  0.00000e+00 0.00000e+00 1.23611e+02 56.918  1.78170e+02 236.918 0.8382 
1 1 1 6   10  3  o 4  3.63046e+01 7.21923e-01 8.49423e+02 219.275 -2.16964e+01 -1.77424e+01 0.00000e+00 0.00000e+00 4.94260e+02 219.275 3.55163e+02 39.275  0.9820 
1 1 1 6   10  4  o 4  3.82058e+01 7.57574e-01 7.32235e+02 142.389 -2.66556e+01 2.05354e+01  0.00000e+00 0.00000e+00 6.86220e+02 142.389 4.60155e+01 322.389 0.9850 
1 1 1 6   10  5  o 12 1.83413e+01 5.07560e-01 2.22261e+02 340.595 4.56728e+00  -1.60884e+00 0.00000e+00 0.00000e+00 3.92699e+02 340.595 1.70437e+02 340.595 0.8896 
1 1 1 6   10  6  o 17 3.97703e+01 7.96924e-01 6.86493e+02 224.000 -2.65914e+01 -2.56793e+01 0.00000e+00 0.00000e+00 7.91888e+02 224.000 1.05395e+02 224.000 0.9864 
1 1 1 6   10  7  o 2  3.10152e+01 6.90210e-01 6.01288e+02 157.021 -2.92916e+01 1.24209e+01  0.00000e+00 0.00000e+00 5.48861e+02 157.021 5.24270e+01 337.021 0.9842 
1 1 1 6   10  8  o 17 8.97962e+00 7.86009e-01 1.72125e+02 77.276  8.24298e-01  3.65045e+00  0.00000e+00 0.00000e+00 1.16372e+02 77.276  5.57531e+01 257.276 0.8528 
1 1 1 6   10  9  o 2  2.97765e+01 7.53230e-01 4.30301e+02 353.202 3.79139e+01  -4.51971e+00 0.00000e+00 0.00000e+00 6.76352e+02 353.202 2.46051e+02 353.202 0.9868 
1 1 1 6   10  10 o 11 1.18490e+01 9.49461e-01 1.26131e+02 94.011  -3.93829e-01 5.61705e+00  0.00000e+00 0.00000e+00 2.78133e+02 94.011  1.52002e+02 94.011  0.9062 
1 1 1 6   10  11 o 19 1.81864e+01 8.28469e-01 3.14021e+02 229.955 -1.93253e+01 -2.29940e+01 0.00000e+00 0.00000e+00 3.58916e+02 229.955 4.48949e+01 229.955 0.9832 
1 1 1 6   10  12 o 7  1.53877e+01 9.76778e-01 3.10447e+02 48.412  2.19372e+01  2.47193e+01  0.00000e+00 0.00000e+00 2.59562e+02 48.412  5.08846e+01 228.412 0.9848 
1 1 1 6   10  13 o 10 1.28357e+01 1.11218e+00 2.35551e+02 83.139  3.00742e+00  2.49946e+01  0.00000e+00 0.00000e+00 2.37348e+02 83.139  1.79706e+00 83.139  0.9799 
1 1 1 6   10  14 o 18 8.18702e+00 1.63029e+00 1.12191e+02 339.525 6.81909e+00  -2.54609e+00 0.00000e+00 0.00000e+00 1.73449e+02 339.525 6.12583e+01 339.525 0.9285 
1 1 1 6   10  15 o 4  4.90815e+00 1.47523e+00 1.23768e+02 315.918 4.21168e+00  -4.07887e+00 0.00000e+00 0.00000e+00 4.39822e+01 315.918 7.97863e+01 135.918 0.9102 
1 1 1 6   10  16 o 6  4.81005e+00 1.55592e+00 9.98372e+01 110.312 -1.76792e+00 4.77611e+00  0.00000e+00 0.00000e+00 6.17942e+01 110.312 3.80430e+01 290.312 0.8955 
1 1 1 6   11  0  o 19 1.60122e+01 5.06635e-01 3.74640e+02 33.100  3.94091e+00  2.56908e+00  0.00000e+00 0.00000e+00 1.59831e+02 33.100  2.14809e+02 213.100 0.8860 
1 1 1 6   11  1  o 3  9.16632e+00 4.33370e-01 3.50880e+02 277.017 3.02225e-01  -2.45535e+00 0.00000e+00 0.00000e+00 8.76527e+01 97.017  4.38533e+02 97.017  0.7621 
1 1 1 6   11  2  o 13 3.14168e+01 7.32733e-01 6.44914e+02 314.868 1.27372e+01  -1.27960e+01 0.00000e+00 0.00000e+00 5.05776e+02 314.868 1.39137e+02 134.868 0.9719 
1 1 1 6   11  3  o 15 1.63844e+01 4.65624e-01 3.06454e+02 12.837  4.45140e+00  1.01436e+00  0.00000e+00 0.00000e+00 2.38330e+02 12.837  6.81245e+01 192.837 0.8822 
1 1 1 6   11  4  o 3  2.15136e+01 5.46846e-01 2.57433e+02 281.845 1.37094e+00  -6.53664e+00 0.00000e+00 0.00000e+00 4.89974e+02 281.845 2.32540e+02 281.845 0.9218 
1 1 1 6   11  5  o 5  1.72256e+01 5.01763e-01 3.02874e+02 10.804  6.07161e+00  1.15867e+00  0.00000e+00 0.00000e+00 2.91210e+02 10.804  1.16646e+01 190.804 0.9151 
1 1 1 6   11  6  o 6  1.93860e+01 5.41587e-01 2.28954e+02 40.293  4.61562e+00  3.91337e+00  0.00000e+00 0.00000e+00 4.38161e+02 40.293  2.09207e+02 40.293  0.9131 
1 1 1 6   11  7  o 1  3.18706e+01 7.02341e-01 5.77794e+02 150.175 -2.71921e+01 1.55886e+01  0.00000e+00 0.00000e+00 6.03756e+02 150.175 2.59625e+01 150.175 0.9839 
1 1 1 6   11  8  o 7  2.02379e+01 6.27554e-01 4.65359e+02 45.270  1.61926e+01  1.63462e+01  0.00000e+00 0.00000e+00 2.80269e+02 45.270  1.85090e+02 225.270 0.9780 
1 1 1 6   11  9  o 1  7.96117e+00 1.04440e+00 1.63501e+02 202.272 -3.33313e+00 -1.36515e+00 0.00000e+00 0.00000e+00 9.02252e+01 202.272 7.32757e+01 22.272  0.8463 
1 1 1 6   11  10 o 15 9.23490e+00 1.29231e+00 1.93503e+02 261.361 -9.58163e-01 -6.30646e+00 0.00000e+00 0.00000e+00 1.25618e+02 261.361 6.78857e+01 81.361  0.9179 
1 1 1 6   11  11 o 14 1.53413e+01 9.17101e-01 2.43309e+02 82.442  2.54077e+00  1.91490e+01  0.00000e+00 0.00000e+00 3.18882e+02 82.442  7.55738e+01 82.442  0.9738 
1 1 1 6   11  12 o 15 2.50246e+01 8.97276e-01 4.64178e+02 208.623 -7.18876e+01 -3.92314e+01 0.00000e+00 0.00000e+00 4.71371e+02 208.623 7.19280e+00 208.623 0.9939 
1 1 1 6   11  13 o 2  5.52555e+00 1.42320e+00 2.27590e+02 34.600  7.66775e+00  5.28957e+00  0.00000e+00 0.00000e+00 3.13402e+01 214.600 2.58930e+02 214.600 0.9447 
1 1 1 6   11  14 o 7  1.04011e+01 1.49408e+00 2.67186e+02 288.275 7.36968e+00  -2.23164e+01 0.00000e+00 0.00000e+00 1.15218e+02 288.275 1.51968e+02 108.275 0.9785 
1 1 1 6   11  15 o 19 4.75309e+00 1.45708e+00 9.37547e+01 119.047 -2.19577e+00 3.95364e+00  0.00000e+00 0.00000e+00 6.34820e+01 119.047 3.02727e+01 299.047 0.8810 
1 1 1 6   11  16 o 11 6.80639e+00 1.93006e+00 1.16888e+02 54.583  3.72906e+00  5.24395e+00  0.00000e+00 0.00000e+00 1.17727e+02 54.583  8.38483e-01 54.583  0.9186 
1 1 1 6   12  0  o 10 2.78108e+01 7.12166e-01 4.91616e+02 209.816 -9.19107e+00 -5.26729e+00 0.00000e+00 0.00000e+00 5.05291e+02 209.816 1.36756e+01 209.816 0.9516 
1 1 1 6   12  1  o 7  1.20821e+01 4.85358e-01 4.24400e+02 254.932 -1.01677e+00 -3.77670e+00 0.00000e+00 0.00000e+00 3.28880e+01 74.932  4.57288e+02 74.932  0.8600 
1 1 1 6   12  2  o 8  1.22982e+01 4.81370e-01 1.53617e+02 338.677 1.56620e+00  -6.11351e-01 0.00000e+00 0.00000e+00 1.41999e+02 338.677 1.16182e+01 158.677 0.6379 
1 1 1 6   12  3  o 6  1.31532e+01 4.49376e-01 3.01389e+02 292.075 1.34819e+00  -3.32428e+00 0.00000e+00 0.00000e+00 1.17755e+02 292.075 1.83634e+02 112.075 0.8455 
1 1 1 6   12  4  o 9  2.32849e+01 5.48333e-01 3.45976e+02 77.370  2.11592e+00  9.44315e+00  0.00000e+00 0.00000e+00 4.84943e+02 77.370  1.38967e+02 77.370  0.9468 
1 1 1 6   12  5  o 14 3.42248e+01 7.05054e-01 6.91891e+02 185.278 -2.89708e+01 -2.67637e+00 0.00000e+00 0.00000e+00 5.75595e+02 185.278 1.16296e+02 5.278   0.9827 
1 1 1 6   12  6  o 10 7.05272e+00 6.34512e-01 2.49788e+02 231.298 -1.49463e+00 -1.86549e+00 0.00000e+00 0.00000e+00 4.97844e+01 51.298  2.99572e+02 51.298  0.7525 
1 1 1 6   12  7  o 18 2.90649e+01 6.72724e-01 4.85290e+02 23.091  2.20708e+01  9.41005e+00  0.00000e+00 0.00000e+00 5.86753e+02 23.091  1.01463e+02 23.091  0.9789 
1 1 1 6   12  8  o 1  1.14267e+01 8.61851e-01 2.06569e+02 1.632   5.66536e+00  1.61405e-01  0.00000e+00 0.00000e+00 1.83786e+02 1.632   2.27831e+01 181.632 0.9069 
1 1 1 6   12  9  o 14 1.92438e+01 6.99071e-01 3.31584e+02 272.061 6.54729e-01  -1.81919e+01 0.00000e+00 0.00000e+00 3.72933e+02 272.061 4.13489e+01 272.061 0.9721 
1 1 1 6   12  10 f 0  1.67113e+01 9.16265e-01 2.88449e+02 123.952 -1.01672e+01 1.51006e+01  0.00000e+00 0.00000e+00 3.23146e+02 123.952 3.46972e+01 123.952 0.9721 
1 1 1 6   12  11 o 7  4.32522e+00 1.20378e+00 1.83347e+02 260.344 -7.08885e-01 -4.16639e+00 0.00000e+00 0.00000e+00 4.14656e+01 80.344  2.24813e+02 80.344  0.8717 
1 1 1 6   12  12 o 14 1.93410e+01 9.30650e-01 3.95688e+02 168.944 -5.16448e+01 1.00910e+01  0.00000e+00 0.00000e+00 3.24864e+02 168.944 7.08238e+01 348.944 0.9905 
1 1 1 6   12  13 o 6  1.17286e+01 1.23547e+00 2.19176e+02 39.314  1.58219e+01  1.29566e+01  0.00000e+00 0.00000e+00 2.10839e+02 39.314  8.33702e+00 219.314 0.9752 
1 1 1 6   12  14 o 11 9.39942e+00 1.51623e+00 1.39958e+02 295.631 4.95054e+00  -1.03181e+01 0.00000e+00 0.00000e+00 1.97404e+02 295.631 5.74457e+01 295.631 0.9553 
1 1 1 6   12  15 f 0  5.76324e+00 1.67511e+00 8.89890e+01 353.221 4.57216e+00  -5.43470e-01 0.00000e+00 0.00000e+00 1.02163e+02 353.221 1.31739e+01 353.221 0.8833 
1 1 1 6   12  16 o 5  7.92019e+00 2.05255e+00 1.39900e+02 90.605  -8.80832e-02 8.34112e+00  0.00000e+00 0.00000e+00 1.38855e+02 90.605  1.04576e+00 270.605 0.9380 
1 1 1 6   13  0  o 3  2.01460e+01 5.30833e-01 5.96589e+02 113.384 -3.67576e+00 8.50066e+00  0.00000e+00 0.00000e+00 1.20079e+02 113.384 4.76509e+02 293.384 0.9444 
1 1 1 6   13  1  o 3  1.00867e+01 4.22986e-01 1.00638e+02 328.827 7.48843e-01  -4.53035e-01 0.00000e+00 0.00000e+00 5.15437e+01 328.827 4.90944e+01 148.827 0.4004 
1 1 1 6   13  2  o 18 1.70862e+01 5.79324e-01 4.07483e+02 28.810  5.38325e+00  2.96066e+00  0.00000e+00 0.00000e+00 1.81351e+02 28.810  2.26132e+02 208.810 0.9145 
1 1 1 6   13  3  o 6  2.26113e+01 5.26732e-01 3.13190e+02 287.816 1.94785e+00  -6.06088e+00 0.00000e+00 0.00000e+00 4.68817e+02 287.816 1.55627e+02 287.816 0.9177 
1 1 1 6   13  4  o 15 3.62529e+01 7.27928e-01 7.59267e+02 152.207 -2.89827e+01 1.52765e+01  0.00000e+00 0.00000e+00 5.85999e+02 152.207 1.73268e+02 332.207 0.9846 
1 1 1 6   13  5  o 17 2.94133e+01 6.34345e-01 6.33345e+02 52.599  1.38928e+01  1.81701e+01  0.00000e+00 0.00000e+00 4.50623e+02 52.599  1.82722e+02 232.599 0.9779 
1 1 1 6   13  6  o 19 1.25345e+01 5.30007e-01 3.53119e+02 272.124 2.22824e-01  -6.00783e+00 0.00000e+00 0.00000e+00 7.79067e+01 272.124 2.75212e+02 92.124  0.9125 
1 1 1 6   13  7  o 5  1.65879e+01 5.85731e-01 2.58870e+02 3.627   7.38090e+00  4.67840e-01  0.00000e+00 0.00000e+00 3.22175e+02 3.627   6.33043e+01 3.627   0.9297 
1 1 1 6   13  8  o 1  5.90258e+00 1.05020e+00 5.75493e+01 348.797 7.77006e-01  -1.53894e-01 0.00000e+00 0.00000e+00 2.42551e+01 348.797 3.32942e+01 168.797 0.3679 
1 1 1 6   13  9  o 15 2.83459e+01 7.37196e-01 4.70009e+02 248.490 -1.38743e+01 -3.52047e+01 0.00000e+00 0.00000e+00 5.83248e+02 248.490 1.13239e+02 248.490 0.9867 
1 1 1 6   13  10 o 17 1.27687e+01 9.02123e-01 2.48962e+02 120.137 -6.62563e+00 1.14130e+01  0.00000e+00 0.00000e+00 2.13133e+02 120.137 3.58293e+01 300.137 0.9613 
1 1 1 6   13  11 o 17 7.88811e+00 1.28848e+00 1.33431e+02 188.545 -5.42643e+00 -8.15359e-01 0.00000e+00 0.00000e+00 1.34782e+02 188.545 1.35091e+00 188.545 0.9036 
1 1 1 6   13  12 o 7  1.71342e+01 9.86104e-01 2.32487e+02 189.874 -2.65896e+01 -4.62807e+00 0.00000e+00 0.00000e+00 3.99929e+02 189.874 1.67442e+02 189.874 0.9813 
1 1 1 6   13  13 o 5  4.73950e+00 1.37207e+00 1.82682e+02 127.007 -3.97624e+00 5.27528e+00  0.00000e+00 0.00000e+00 1.86103e+01 307.007 2.01293e+02 307.007 0.9209 
1 1 1 6   13  14 o 11 4.28593e+00 1.37352e+00 7.30909e+01 235.845 -1.63988e+00 -2.41714e+00 0.00000e+00 0.00000e+00 5.63708e+01 235.845 1.67201e+01 55.845  0.8040 
1 1 1 6   13  15 o 12 6.95924e+00 1.84581e+00 1.71499e+02 154.547 -8.78268e+00 4.18025e+00  0.00000e+00 0.00000e+00 7.59816e+01 154.547 9.55177e+01 334.547 0.9471 
1 1 1 6   13  16 o 6  6.46777e+00 1.85188e+00 9.59982e+01 7.680   5.20680e+00  7.02091e-01  0.00000e+00 0.00000e+00 1.22157e+02 7.680   2.61593e+01 7.680   0.8990 
1 1 1 6   14  0  o 15 1.78332e+01 4.97470e-01 4.85310e+02 296.136 2.91245e+00  -5.93566e+00 0.00000e+00 0.00000e+00 1.33312e+02 296.136 3.51997e+02 116.136 0.9209 
1 1 1 6   14  1  o 19 3.09792e+01 6.28127e-01 6.51675e+02 127.280 -1.04192e+01 1.36868e+01  0.00000e+00 0.00000e+00 4.81046e+02 127.280 1.70629e+02 307.280 0.9705 
1 1 1 6   14  2  o 6  2.57400e+01 5.59586e-01 4.36770e+02 324.865 8.86801e+00  -6.24064e+00 0.00000e+00 0.00000e+00 4.87292e+02 324.865 5.05218e+01 324.865 0.9527 
1 1 1 6   14  3  o 5  9.96198e+00 5.31188e-01 1.78051e+02 21.822  1.75845e+00  7.04104e-01  0.00000e+00 0.00000e+00 7.70854e+01 21.822  1.00966e+02 201.822 0.6796 
1 1 1 6   14  4  o 8  2.55431e+01 5.77445e-01 5.22671e+02 42.940  1.08591e+01  1.01052e+01  0.00000e+00 0.00000e+00 4.06913e+02 42.940  1.15757e+02 222.940 0.9657 
1 1 1 6   14  5  o 8  2.42353e+01 5.69369e-01 2.49316e+02 189.190 -7.31486e+00 -1.18339e+00 0.00000e+00 0.00000e+00 5.99914e+02 189.190 3.50598e+02 189.190 0.9298 
1 1 1 6   14  6  o 10 1.38376e+01 5.22476e-01 2.11273e+02 293.089 1.83131e+00  -4.29566e+00 0.00000e+00 0.00000e+00 2.50243e+02 293.089 3.89701e+01 293.089 0.8851 
1 1 1 6   14  7  o 9  2.82511e+01 6.68745e-01 5.75235e+02 51.911  1.71891e+01  2.19307e+01  0.00000e+00 0.00000e+00 4.69860e+02 51.911  1.05375e+02 231.911 0.9819 
1 1 1 6   14  8  o 5  2.35342e+01 6.66498e-01 4.78250e+02 95.306  -2.49623e+00 2.68784e+01  0.00000e+00 0.00000e+00 3.91641e+02 95.306  8.66088e+01 275.306 0.9813 
1 1 1 6   14  9  o 19 4.16627e+01 8.96969e-01 6.63483e+02 160.014 -8.16552e+01 2.96980e+01  0.00000e+00 0.00000e+00 8.96349e+02 160.014 2.32866e+02 160.014 0.9942 
1 1 1 6   14  10 o 19 1.48214e+01 8.68062e-01 4.15768e+02 295.634 1.11040e+01  -2.31402e+01 0.00000e+00 0.00000e+00 1.31193e+02 295.634 2.84575e+02 115.634 0.9803 
1 1 1 6   14  11 o 2  1.55986e+01 8.63977e-01 3.16442e+02 94.820  -2.37222e+00 2.81339e+01  0.00000e+00 0.00000e+00 2.60029e+02 94.820  5.64131e+01 274.820 0.9821 
1 1 1 6   14  12 o 5  1.07440e+01 1.15925e+00 2.51240e+02 290.210 6.02587e+00  -1.63688e+01 0.00000e+00 0.00000e+00 1.41101e+02 290.210 1.10140e+02 110.210 0.9709 
1 1 1 6   14  13 o 5  1.34503e+01 1.13593e+00 2.09752e+02 12.217  2.29774e+01  4.97516e+00  0.00000e+00 0.00000e+00 2.84998e+02 12.217  7.52459e+01 12.217  0.9785 
1 1 1 6   14  14 o 19 5.69793e+00 1.52642e+00 8.87024e+01 333.469 3.91085e+00  -1.95251e+00 0.00000e+00 0.00000e+00 9.89144e+01 333.469 1.02120e+01 333.469 0.8764 
1 1 1 6   14  15 o 2  5.65349e+00 1.69383e+00 9.82665e+01 133.769 -3.41180e+00 3.56165e+00  0.00000e+00 0.00000e+00 9.10290e+01 133.769 7.23755e+00 313.769 0.8918 
1 1 1 6   14  16 o 1  5.48740e+00 1.72592e+00 1.04519e+02 66.199  2.10853e+00  4.78055e+00  0.00000e+00 0.00000e+00 8.04375e+01 66.199  2.40813e+01 246.199 0.8983 
1 1 1 6   15  0  o 12 1.71055e+01 5.64041e-01 1.08307e+02 42.079  1.18337e+00  1.06845e+00  0.00000e+00 0.00000e+00 2.90265e+02 42.079  1.81957e+02 42.079  0.6186 
1 1 1 6   15  1  o 14 2.75973e+01 6.69703e-01 5.42032e+02 108.379 -3.98098e+00 1.19817e+01  0.00000e+00 0.00000e+00 4.55620e+02 108.379 8.64125e+01 288.379 0.9595 
1 1 1 6   15  2  o 3  2.16551e+01 5.11329e-01 3.62313e+02 43.279  5.47417e+00  5.15474e+00  0.00000e+00 0.00000e+00 3.97279e+02 43.279  3.49659e+01 43.279  0.9309 
1 1 1 6   15  3  o 12 2.78257e+01 5.98601e-01 6.33120e+02 257.885 -3.91978e+00 -1.82616e+01 0.00000e+00 0.00000e+00 3.86985e+02 257.885 2.46134e+02 77.886  0.9729 
1 1 1 6   15  4  o 13 2.92120e+01 6.24146e-01 6.87511e+02 126.028 -1.30534e+01 1.79481e+01  0.00000e+00 0.00000e+00 3.88238e+02 126.028 2.99273e+02 306.028 0.9772 
1 1 1 6   15  5  o 14 2.18305e+01 5.46274e-01 4.39366e+02 181.126 -1.25509e+01 -2.46697e-01 0.00000e+00 0.00000e+00 3.49800e+02 181.126 8.95661e+01 1.126   0.9593 
1 1 1 6   15  6  o 1  1.94676e+01 5.51409e-01 2.66801e+02 30.588  7.11342e+00  4.20478e+00  0.00000e+00 0.00000e+00 4.20801e+02 30.588  1.53999e+02 30.588  0.9374 
1 1 1 6   15  7  o 1  1.19306e+01 6.23233e-01 3.54009e+02 62.064  3.39532e+00  6.40281e+00  0.00000e+00 0.00000e+00 6.31887e+01 62.064  2.90821e+02 242.064 0.9282 
1 1 1 6   15  8  o 8  2.64349e+01 6.83671e-01 2.93505e+02 255.787 -4.55832e+00 -1.79966e+01 0.00000e+00 0.00000e+00 6.74987e+02 255.787 3.81483e+02 255.787 0.9727 
1 1 1 6   15  9  o 19 1.12135e+01 8.82762e-01 3.16264e+02 21.726  1.03545e+01  4.12606e+00  0.00000e+00 0.00000e+00 8.65740e+01 21.726  2.29690e+02 201.726 0.9540 
1 1 1 6   15  10 o 13 2.89746e+01 8.11307e-01 4.95685e+02 109.722 -2.03076e+01 5.66481e+01  0.00000e+00 0.00000e+00 5.85893e+02 109.722 9.02082e+01 109.722 0.9917 
1 1 1 6   15  11 o 1  1.20783e+01 1.03638e+00 1.50285e+02 48.445  6.41425e+00  7.23601e+00  0.00000e+00 0.00000e+00 2.80009e+02 48.445  1.29724e+02 48.445  0.9468 
1 1 1 6   15  12 f 0  8.62898e+00 1.27230e+00 4.25533e+01 315.141 1.62565e+00  -1.61765e+00 0.00000e+00 0.00000e+00 1.97775e+02 315.141 1.55221e+02 315.141 0.7405 
1 1 1 6   15  13 o 12 1.09308e+01 1.34301e+00 2.57368e+02 107.003 -6.34172e+00 2.07386e+01  0.00000e+00 0.00000e+00 1.43940e+02 107.003 1.13428e+02 287.003 0.9767 
1 1 1 6   15  14 o 5  4.01440e+00 1.30019e+00 9.41356e+01 134.974 -2.66825e+00 2.67066e+00  0.00000e+00 0.00000e+00 3.47040e+01 134.974 5.94316e+01 314.974 0.8543 
1 1 1 6   15  15 o 15 6.35444e+00 1.79752e+00 5.52411e+01 316.027 2.08661e+00  -2.01314e+00 0.00000e+00 0.00000e+00 1.36159e+02 316.027 8.09177e+01 316.027 0.8023 
1 1 1 6   15  16 o 5  6.63687e+00 1.92035e+00 1.46200e+02 319.036 6.27318e+00  -5.44632e+00 0.00000e+00 0.00000e+00 8.72965e+01 319.036 5.89033e+01 139.036 0.9377 
1 1 1 6   16  0  f 0  1.91285e+01 4.61176e-01 5.21632e+02 293.010 3.33012e+00  -7.84149e+00 0.00000e+00 0.00000e+00 1.55136e+02 293.010 3.66497e+02 113.010 0.9393 
1 1 1 6   16  1  o 1  1.81126e+01 4.65114e-01 2.01736e+02 100.408 -5.88987e-01 3.20662e+00  0.00000e+00 0.00000e+00 3.62931e+02 100.408 1.61195e+02 100.408 0.8275 
1 1 1 6   16  2  o 15 5.18355e+00 6.66617e-01 1.90390e+02 81.050  1.45563e-01  9.24247e-01  0.00000e+00 0.00000e+00 1.07751e+02 261.050 2.98142e+02 261.050 0.4231 
1 1 1 6   16  3  f 0  2.27270e+01 5.33559e-01 4.44341e+02 323.897 8.61274e+00  -6.28119e+00 0.00000e+00 0.00000e+00 3.70841e+02 323.897 7.34998e+01 143.897 0.9519 
1 1 1 6   16  4  o 3  3.47422e+01 7.07637e-01 4.15019e+02 17.973  1.50545e+01  4.88367e+00  0.00000e+00 0.00000e+00 8.52113e+02 17.973  4.37094e+02 17.973  0.9679 
1 1 1 6   16  5  o 4  3.25220e+01 6.81377e-01 6.82701e+02 270.525 2.64363e-01  -2.88500e+01 0.00000e+00 0.00000e+00 5.21354e+02 270.525 1.61347e+02 90.525  0.9825 
1 1 1 6   16  6  o 8  2.75062e+01 6.31864e-01 5.54508e+02 342.659 2.30230e+01  -7.18914e+00 0.00000e+00 0.00000e+00 4.60159e+02 342.659 9.43488e+01 162.659 0.9790 
1 1 1 6   16  7  f 0  2.19009e+01 6.04476e-01 1.15873e+02 72.158  1.63398e+00  5.07644e+00  0.00000e+00 0.00000e+00 6.27150e+02 72.158  5.11276e+02 72.158  0.9006 
1 1 1 6   16  8  o 17 2.80593e+01 7.10184e-01 5.38598e+02 257.671 -8.58995e+00 -3.93030e+01 0.00000e+00 0.00000e+00 5.05014e+02 257.671 3.35839e+01 77.671  0.9875 
1 1 1 6   16  9  o 1  3.21615e+01 7.76541e-01 3.72098e+02 56.479  2.09546e+01  3.16333e+01  0.00000e+00 0.00000e+00 8.22835e+02 56.479  4.50737e+02 56.479  0.9867 
1 1 1 6   16  10 o 8  1.71205e+01 8.89475e-01 2.50016e+02 136.531 -1.28492e+01 1.21802e+01  0.00000e+00 0.00000e+00 3.75943e+02 136.531 1.25927e+02 136.531 0.9713 
1 1 1 6   16  11 o 10 1.51966e+01 9.15085e-01 3.60648e+02 1.130   2.98515e+01  5.88713e-01  0.00000e+00 0.00000e+00 2.01481e+02 1.130   1.59167e+02 181.130 0.9831 
1 1 1 6   16  12 o 18 4.52058e+00 1.29989e+00 5.91408e+01 238.309 -9.11838e-01 -1.47693e+00 0.00000e+00 0.00000e+00 5.12388e+01 238.309 7.90204e+00 58.309  0.6492 
1 1 1 6   16  13 o 2  5.79883e+00 1.43818e+00 5.99601e+01 209.060 -2.25975e+00 -1.25571e+00 0.00000e+00 0.00000e+00 1.08741e+02 209.060 4.87805e+01 209.060 0.7740 
1 1 1 6   16  14 o 16 1.14580e+01 1.41614e+00 1.86246e+02 258.116 -4.14292e+00 -1.96865e+01 0.00000e+00 0.00000e+00 2.33361e+02 258.116 4.71158e+01 258.116 0.9748 
1 1 1 6   16  15 o 5  4.39340e+00 1.41492e+00 7.72022e+01 41.957  2.57276e+00  2.31306e+00  0.00000e+00 0.00000e+00 6.11782e+01 41.957  1.60240e+01 221.957 0.8390 
1 1 1 6   16  16 o 11 8.64029e+00 1.95530e+00 1.36376e+02 101.328 -1.93882e+00 9.67819e+00  0.00000e+00 0.00000e+00 1.70890e+02 101.328 3.45133e+01 101.328 0.9479 
1 1 1 6   17  0  o 2  4.27958e+00 5.13205e-01 1.24756e+02 140.614 -3.70426e-01 3.04124e-01  0.00000e+00 0.00000e+00 8.71985e+01 320.614 2.11954e+02 320.614 0.2330 
1 1 1 6   17  1  o 6  2.37378e+01 5.29310e-01 4.81471e+02 243.201 -4.55168e+00 -9.01123e+00 0.00000e+00 0.00000e+00 3.67245e+02 243.201 1.14226e+02 63.201  0.9491 
1 1 1 6   17  2  o 15 1.26987e+01 5.67405e-01 2.85203e+02 211.597 -2.80972e+00 -1.72838e+00 0.00000e+00 0.00000e+00 1.11840e+02 211.597 1.73363e+02 31.597  0.8299 
1 1 1 6   17  3  o 18 2.69784e+01 5.86067e-01 7.17121e+02 25.196  1.83078e+01  8.61346e+00  0.00000e+00 0.00000e+00 2.73985e+02 25.196  4.43136e+02 205.196 0.9750 
1 1 1 6   17  4  o 17 2.58362e+01 5.80789e-01 4.70869e+02 3.563   1.59762e+01  9.94671e-01  0.00000e+00 0.00000e+00 4.71755e+02 3.563   8.85928e-01 3.563   0.9682 
1 1 1 6   17  5  o 12 2.95585e+01 6.38814e-01 5.02637e+02 139.098 -1.45664e+01 1.26186e+01  0.00000e+00 0.00000e+00 5.81839e+02 139.098 7.92020e+01 139.098 0.9737 
1 1 1 6   17  6  o 17 1.41378e+01 5.86399e-01 1.90750e+02 324.391 3.39758e+00  -2.43320e+00 0.00000e+00 0.00000e+00 2.72704e+02 324.391 8.19538e+01 324.391 0.8701 
1 1 1 6   17  7  o 3  1.32323e+01 6.14140e-01 1.86257e+02 173.145 -5.12821e+00 6.16507e-01  0.00000e+00 0.00000e+00 2.60908e+02 173.145 7.46515e+01 173.145 0.8971 
1 1 1 6   17  8  o 3  2.07510e+01 6.48244e-01 5.59269e+02 357.934 3.09547e+01  -1.11639e+00 0.00000e+00 0.00000e+00 2.09546e+02 357.934 3.49724e+02 177.934 0.9837 
1 1 1 6   17  9  o 8  2.07898e+01 7.25047e-01 4.88446e+02 203.996 -2.85954e+01 -1.27290e+01 0.00000e+00 0.00000e+00 2.81724e+02 203.996 2.06722e+02 23.996  0.9839 
1 1 1 6   17  10 o 10 1.59923e+01 9.46764e-01 3.05952e+02 33.130  1.67825e+01  1.09528e+01  0.00000e+00 0.00000e+00 2.80772e+02 33.130  2.51803e+01 213.130 0.9747 
1 1 1 6   17  11 o 14 1.48426e+01 9.23501e-01 2.81613e+02 318.458 1.69877e+01  -1.50513e+01 0.00000e+00 0.00000e+00 2.64386e+02 318.458 1.72262e+01 138.459 0.9777 
1 1 1 6   17  12 o 1  5.55578e+00 1.42367e+00 7.84420e+01 264.865 -2.42987e-01 -2.70398e+00 0.00000e+00 0.00000e+00 8.58816e+01 264.865 7.43956e+00 264.865 0.7865 
1 1 1 6   17  13 o 16 9.92738e+00 1.38836e+00 1.64131e+02 234.218 -7.21917e+00 -1.00164e+01 0.00000e+00 0.00000e+00 1.93567e+02 234.218 2.94355e+01 234.218 0.9586 
1 1 1 6   17  14 o 6  5.62250e+00 1.50509e+00 1.58014e+02 341.919 7.60727e+00  -2.48360e+00 0.00000e+00 0.00000e+00 3.95229e+01 341.919 1.18491e+02 161.919 0.9353 
1 1 1 6   17  15 o 6  5.17542e+00 1.59916e+00 1.51922e+02 135.104 -5.08004e+00 5.06157e+00  0.00000e+00 0.00000e+00 2.82634e+01 135.104 1.23658e+02 315.104 0.9274 
1 1 1 6   17  16 o 19 3.77153e+00 1.34598e+00 1.15794e+02 70.512  1.78347e+00  5.03973e+00  0.00000e+00 0.00000e+00 1.16627e+01 70.512  1.04131e+02 250.512 0.9008 
1 1 1 6   18  0  o 5  9.22243e+00 3.97648e-01 4.79985e+02 192.724 -3.84476e+00 -8.68129e-01 0.00000e+00 0.00000e+00 1.80852e+02 12.724  6.60837e+02 12.724  0.8612 
1 1 1 6   18  1  o 13 1.93559e+01 4.74307e-01 4.20143e+02 228.848 -5.15973e+00 -5.90395e+00 0.00000e+00 0.00000e+00 2.60761e+02 228.848 1.59381e+02 48.848  0.9339 
1 1 1 6   18  2  o 8  1.45535e+01 5.64940e-01 2.87631e+02 263.253 -4.44477e-01 -3.75708e+00 0.00000e+00 0.00000e+00 1.80971e+02 263.253 1.06661e+02 83.253  0.8546 
1 1 1 6   18  3  o 6  2.24946e+01 5.07036e-01 4.56604e+02 83.822  1.15054e+00  1.06297e+01  0.00000e+00 0.00000e+00 3.50293e+02 83.822  1.06311e+02 263.822 0.9520 
1 1 1 6   18  4  o 8  2.80267e+01 5.83769e-01 3.18047e+02 50.226  7.46644e+00  8.96989e+00  0.00000e+00 0.00000e+00 6.91676e+02 50.226  3.73629e+02 50.226  0.9561 
1 1 1 6   18  5  o 2  2.82921e+01 6.24151e-01 4.44931e+02 216.743 -1.29135e+01 -9.64043e+00 0.00000e+00 0.00000e+00 5.87441e+02 216.743 1.42511e+02 216.743 0.9685 
1 1 1 6   18  6  o 19 2.49288e+01 5.80336e-01 3.40922e+02 79.670  2.35494e+00  1.29196e+01  0.00000e+00 0.00000e+00 5.61765e+02 79.670  2.20843e+02 79.670  0.9611 
1 1 1 6   18  7  o 10 1.72411e+01 5.82502e-01 1.20751e+02 329.591 3.75965e+00  -2.20655e+00 0.00000e+00 0.00000e+00 4.48198e+02 329.591 3.27447e+02 329.591 0.8760 
1 1 1 6   18  8  o 8  1.00901e+01 7.78091e-01 7.58448e+01 153.917 -1.81457e+00 8.88272e-01  0.00000e+00 0.00000e+00 1.90567e+02 153.917 1.14722e+02 153.917 0.7011 
1 1 1 6   18  9  o 4  3.62857e+01 9.31837e-01 6.67220e+02 213.687 -6.07775e+01 -4.05138e+01 0.00000e+00 0.00000e+00 6.89562e+02 213.687 2.23412e+01 213.687 0.9931 
1 1 1 6   18  10 o 3  1.47305e+01 8.61635e-01 2.46479e+02 13.302  1.50909e+01  3.56789e+00  0.00000e+00 0.00000e+00 2.89755e+02 13.302  4.32753e+01 13.302  0.9672 
1 1 1 6   18  11 o 12 1.32812e+01 9.87013e-01 2.74236e+02 15.054  1.90211e+01  5.11594e+00  0.00000e+00 0.00000e+00 2.12581e+02 15.054  6.16541e+01 195.054 0.9743 
1 1 1 6   18  12 o 1  1.65746e+01 9.57962e-01 2.62395e+02 313.774 2.32055e+01  -2.42204e+01 0.00000e+00 0.00000e+00 3.51532e+02 313.774 8.91366e+01 313.774 0.9850 
1 1 1 6   18  13 o 11 5.85924e+00 1.55283e+00 7.09387e+01 341.422 2.79057e+00  -9.37948e-01 0.00000e+00 0.00000e+00 1.06507e+02 341.422 3.55682e+01 341.422 0.8058 
1 1 1 6   18  14 o 6  6.06645e+00 1.58392e+00 1.85495e+02 288.595 3.10075e+00  -9.21620e+00 0.00000e+00 0.00000e+00 3.03265e+01 288.595 1.55168e+02 108.595 0.9471 
1 1 1 6   18  15 o 4  8.45191e+00 1.85356e+00 1.44920e+02 125.419 -5.62587e+00 7.91074e+00  0.00000e+00 0.00000e+00 1.55544e+02 125.419 1.06245e+01 125.419 0.9470 
1 1 1 6   18  16 o 4  6.75888e+00 2.02201e+00 1.08632e+02 260.924 -9.03162e-01 -5.65380e+00 0.00000e+00 0.00000e+00 1.21554e+02 260.924 1.29222e+01 260.924 0.9079 
1 1 1 6   19  0  o 13 2.44190e+01 6.03332e-01 5.46993e+02 66.254  4.72586e+00  1.07424e+01  0.00000e+00 0.00000e+00 3.32521e+02 66.254  2.14472e+02 246.254 0.9564 
1 1 1 6   19  1  o 16 1.65495e+01 4.46304e-01 3.26378e+02 143.722 -4.16157e+00 3.05456e+00  0.00000e+00 0.00000e+00 2.32801e+02 143.722 9.35768e+01 323.722 0.8970 
1 1 1 6   19  2  o 19 1.61717e+01 5.34049e-01 3.34540e+02 126.428 -2.88246e+00 3.90574e+00  0.00000e+00 0.00000e+00 2.07615e+02 126.428 1.26924e+02 306.428 0.8899 
1 1 1 6   19  3  o 4  2.18196e+01 6.34350e-01 1.65954e+02 134.140 -3.03727e+00 3.12982e+00  0.00000e+00 0.00000e+00 5.54283e+02 134.140 3.88330e+02 134.140 0.8761 
1 1 1 6   19  4  o 1  2.95717e+01 6.81591e-01 5.27736e+02 39.050  1.44235e+01  1.17006e+01  0.00000e+00 0.00000e+00 5.56031e+02 39.050  2.82953e+01 39.050  0.9727 
1 1 1 6   19  5  o 13 3.26900e+01 6.52321e-01 6.15755e+02 81.043  3.99355e+00  2.53369e+01  0.00000e+00 0.00000e+00 5.91630e+02 81.043  2.41250e+01 261.043 0.9803 
1 1 1 6   19  6  o 17 1.15736e+01 5.43090e-01 3.94929e+02 232.668 -5.26349e+00 -6.90127e+00 0.00000e+00 0.00000e+00 1.51371e+01 232.668 3.79792e+02 52.668  0.9405 
1 1 1 6   19  7  o 18 3.69651e+01 7.49289e-01 7.29891e+02 321.729 4.39385e+01  -3.46642e+01 0.00000e+00 0.00000e+00 6.49973e+02 321.729 7.99176e+01 141.729 0.9910 
1 1 1 6   19  8  o 8  3.14253e+01 7.13015e-01 6.33008e+02 172.762 -5.12145e+01 6.50444e+00  0.00000e+00 0.00000e+00 5.38911e+02 172.762 9.40977e+01 352.762 0.9903 
1 1 1 6   19  9  o 18 2.22562e+01 7.24317e-01 4.32807e+02 251.447 -9.73531e+00 -2.90071e+01 0.00000e+00 0.00000e+00 3.91293e+02 251.447 4.15143e+01 71.447  0.9835 
1 1 1 6   19  10 o 10 5.34262e+00 1.28178e+00 3.96383e+01 261.986 -1.17402e-01 -8.33913e-01 0.00000e+00 0.00000e+00 3.83122e+01 261.986 1.32610e+00 81.986  0.3877 
1 1 1 6   19  11 o 13 1.10340e+01 1.12137e+00 1.30619e+02 250.638 -2.50852e+00 -7.13829e+00 0.00000e+00 0.00000e+00 2.55994e+02 250.638 1.25376e+02 250.638 0.9314 
1 1 1 6   19  12 o 14 9.74137e+00 1.26260e+00 1.29724e+02 306.251 5.24042e+00  -7.14681e+00 0.00000e+00 0.00000e+00 2.15251e+02 306.251 8.55274e+01 306.251 0.9418 
1 1 1 6   19  13 o 17 4.31774e+00 1.30101e+00 9.87767e+01 143.900 -2.93237e+00 2.13833e+00  0.00000e+00 0.00000e+00 3.87651e+01 143.900 6.00116e+01 323.900 0.8476 
1 1 1 6   19  14 o 17 1.02436e+01 1.70523e+00 8.17876e+01 259.602 -1.22658e+00 -6.68463e+00 0.00000e+00 0.00000e+00 2.73422e+02 259.602 1.91634e+02 259.602 0.9232 
1 1 1 6   19  15 o 1  9.50704e+00 1.87164e+00 2.18270e+02 121.382 -8.47539e+00 1.38949e+01  0.00000e+00 0.00000e+00 1.27457e+02 121.382 9.08131e+01 301.382 0.9688 
1 1 1 6   19  16 o 3  5.58495e+00 1.81138e+00 6.91377e+01 351.885 3.37839e+00  -4.81727e-01 0.00000e+00 0.00000e+00 1.06086e+02 351.885 3.69486e+01 351.885 0.8364 
1 1 1 6   20  0  o 6  6.85368e+00 4.34718e-01 2.54775e+02 208.340 -1.47562e+00 -7.95882e-01 0.00000e+00 0.00000e+00 9.04092e+01 28.340  3.45185e+02 28.340  0.6368 
1 1 1 6   20  1  o 2  1.42138e+01 4.11236e-01 3.45404e+02 269.176 -6.46016e-02 -4.49258e+00 0.00000e+00 0.00000e+00 1.25788e+02 269.176 2.19616e+02 89.176  0.8801 
1 1 1 6   20  2  o 18 2.45510e+00 6.83061e-01 7.31777e+01 79.073  3.60874e-02  1.86917e-01  0.00000e+00 0.00000e+00 6.44141e+01 259.073 1.37592e+02 259.073 0.0948 
1 1 1 6   20  3  o 5  2.50743e+01 6.16441e-01 3.96237e+02 53.975  6.99574e+00  9.61982e+00  0.00000e+00 0.00000e+00 5.07801e+02 53.975  1.11565e+02 53.975  0.9570 
1 1 1 6   20  4  o 6  3.50776e+01 9.86916e-01 5.86206e+02 2.945   2.40366e+01  1.23656e+00  0.00000e+00 0.00000e+00 7.07610e+02 2.945   1.21404e+02 2.945   0.9790 
1 1 1 6   20  5  o 13 1.69438e+01 6.14872e-01 1.38509e+02 182.359 -3.10582e+00 -1.27935e-01 0.00000e+00 0.00000e+00 3.83464e+02 182.359 2.44955e+02 182.359 0.8177 
1 1 1 6   20  6  o 3  7.22660e+01 1.26365e+00 1.24709e+03 233.687 -9.65133e+01 -1.31325e+02 0.00000e+00 0.00000e+00 1.46686e+03 233.687 2.19774e+02 233.687 0.9969 
1 1 1 6   20  7  o 3  1.37360e+01 9.47537e-01 3.89276e+02 149.734 -9.43360e+00 5.50511e+00  0.00000e+00 0.00000e+00 1.03804e+02 149.734 2.85472e+02 329.734 0.9531 
1 1 1 6   20  8  o 5  1.64723e+01 6.64593e-01 2.38972e+02 147.099 -8.59413e+00 5.56001e+00  0.00000e+00 0.00000e+00 3.50195e+02 147.099 1.11223e+02 147.099 0.9498 
1 1 1 6   20  9  o 19 1.59383e+01 7.58931e-01 2.06423e+02 89.374  1.13500e-01  1.03934e+01  0.00000e+00 0.00000e+00 3.63958e+02 89.374  1.57535e+02 89.374  0.9506 
1 1 1 6   20  10 o 12 1.46272e+01 1.06414e+00 1.56962e+02 308.650 5.91883e+00  -7.40103e+00 0.00000e+00 0.00000e+00 3.63603e+02 308.650 2.06642e+02 308.650 0.9457 
1 1 1 6   20  11 o 13 1.30235e+01 9.47968e-01 2.78830e+02 48.161  1.40107e+01  1.56488e+01  0.00000e+00 0.00000e+00 1.99287e+02 48.161  7.95428e+01 228.161 0.9759 
1 1 1 6   20  12 o 9  2.49116e+01 9.15453e-01 3.41013e+02 196.462 -6.02099e+01 -1.77911e+01 0.00000e+00 0.00000e+00 5.88204e+02 196.462 2.47191e+02 196.462 0.9920 
1 1 1 6   20  13 o 11 1.01197e+01 1.37397e+00 1.96149e+02 35.012  1.34017e+01  9.38829e+00  0.00000e+00 0.00000e+00 1.72353e+02 35.012  2.37969e+01 215.012 0.9689 
1 1 1 6   20  14 o 9  7.49143e+00 1.67111e+00 9.55495e+01 184.835 -5.67347e+00 -4.79920e-01 0.00000e+00 0.00000e+00 1.59748e+02 184.835 6.41987e+01 184.835 0.9073 
1 1 1 6   20  15 o 16 6.03089e+00 1.61362e+00 1.43219e+02 295.818 3.69544e+00  -7.63837e+00 0.00000e+00 0.00000e+00 6.93634e+01 295.818 7.38556e+01 115.818 0.9391 
1 1 1 6   20  16 o 3  5.41545e+00 1.81319e+00 1.21695e+02 199.479 -5.73234e+00 -2.02752e+00 0.00000e+00 0.00000e+00 6.38804e+01 199.479 5.78150e+01 19.479  0.9136 
1 1 1 6   21  0  o 13 1.53761e+01 4.14955e-01 8.86045e+01 31.623  1.10316e+00  6.79284e-01  0.00000e+00 0.00000e+00 2.24850e+02 31.623  1.36246e+02 31.623  0.5414 
1 1 1 6   21  1  o 10 1.77464e+01 4.40953e-01 3.68082e+02 243.653 -2.62746e+00 -5.30527e+00 0.00000e+00 0.00000e+00 2.40889e+02 243.653 1.27192e+02 63.653  0.9111 
1 1 1 6   21  2  o 16 1.09574e+01 6.26040e-01 3.79346e+02 10.291  4.30650e+00  7.81949e-01  0.00000e+00 0.00000e+00 1.75256e+01 190.291 3.96872e+02 190.291 0.8766 
1 1 1 6   21  3  o 1  1.14965e+01 4.48007e-01 1.31234e+02 214.129 -1.39171e+00 -9.43284e-01 0.00000e+00 0.00000e+00 1.45020e+02 214.129 1.37863e+01 214.129 0.6379 
1 1 1 6   21  4  o 18 4.98049e+01 1.08393e+00 1.18425e+03 78.384  1.43852e+01  6.99813e+01  0.00000e+00 0.00000e+00 6.78898e+02 78.384  5.05350e+02 258.384 0.9930 
1 1 1 6   21  5  o 6  2.73968e+01 6.14649e-01 5.59281e+02 312.990 1.37826e+01  -1.47852e+01 0.00000e+00 0.00000e+00 4.46953e+02 312.990 1.12327e+02 132.990 0.9749 
1 1 1 6   21  6  o 7  7.93235e+00 6.84688e-01 1.48621e+02 134.824 -1.45853e+00 1.46750e+00  0.00000e+00 0.00000e+00 6.31659e+01 134.824 8.54554e+01 314.824 0.7088 
1 1 1 6   21  7  o 19 4.29619e+01 8.30371e-01 7.82395e+02 96.429  -8.07951e+00 7.17031e+01  0.00000e+00 0.00000e+00 8.24418e+02 96.429  4.20224e+01 96.429  0.9930 
1 1 1 6   21  8  o 13 3.62624e+01 8.56978e-01 5.66110e+02 261.410 -8.26129e+00 -5.46893e+01 0.00000e+00 0.00000e+00 7.86938e+02 261.410 2.20827e+02 261.410 0.9909 
1 1 1 6   21  9  o 15 2.64093e+01 7.41813e-01 4.56763e+02 60.968  1.84775e+01  3.32903e+01  0.00000e+00 0.00000e+00 5.24251e+02 60.968  6.74876e+01 60.968  0.9868 
1 1 1 6   21  10 o 11 1.50219e+01 8.73063e-01 2.77603e+02 92.896  -9.36221e-01 1.85044e+01  0.00000e+00 0.00000e+00 2.72218e+02 92.896  5.38513e+00 272.896 0.9726 
1 1 1 6   21  11 o 16 1.09792e+01 1.05686e+00 3.01800e+02 165.058 -1.80558e+01 4.81836e+00  0.00000e+00 0.00000e+00 9.99916e+01 165.058 2.01809e+02 345.058 0.9729 
1 1 1 6   21  12 o 1  1.02967e+01 1.28364e+00 2.53527e+02 311.845 1.15514e+01  -1.28991e+01 0.00000e+00 0.00000e+00 1.22270e+02 311.845 1.31257e+02 131.845 0.9707 
1 1 1 6   21  13 o 18 1.86213e+01 1.06690e+00 3.60914e+02 202.753 -5.69437e+01 -2.38822e+01 0.00000e+00 0.00000e+00 3.33176e+02 202.753 2.77383e+01 22.753  0.9919 
1 1 1 6   21  14 o 7  8.72191e+00 1.77561e+00 2.28211e+02 10.416  1.47675e+01  2.71457e+00  0.00000e+00 0.00000e+00 8.82593e+01 10.416  1.39952e+02 190.416 0.9661 
1 1 1 6   21  15 o 19 7.68820e+00 1.87938e+00 1.50481e+02 300.278 4.89161e+00  -8.37841e+00 0.00000e+00 0.00000e+00 1.22781e+02 300.278 2.77000e+01 120.278 0.9470 
1 1 1 6   21  16 o 15 6.33287e+00 1.93701e+00 1.37076e+02 139.570 -5.64072e+00 4.80570e+00  0.00000e+00 0.00000e+00 8.37868e+01 139.570 5.32896e+01 319.570 0.9298 
1 1 1 6   22  0  f 0  3.00532e+01 5.83299e-01 6.18841e+02 136.076 -1.21477e+01 1.16998e+01  0.00000e+00 0.00000e+00 4.78681e+02 136.076 1.40159e+02 316.076 0.9699 
1 1 1 6   22  1  f 0  1.66536e+01 4.77110e-01 9.28944e+01 98.818  -2.54327e-01 1.63949e+00  0.00000e+00 0.00000e+00 3.04165e+02 98.818  2.11270e+02 98.818  0.6331 
1 1 1 6   22  2  o 4  1.81200e+01 5.65780e-01 4.46458e+02 339.041 7.88700e+00  -3.02104e+00 0.00000e+00 0.00000e+00 1.94284e+02 339.041 2.52174e+02 159.041 0.9388 
1 1 1 6   22  3  o 7  2.47482e+01 6.75094e-01 4.20645e+02 218.118 -9.02097e+00 -7.07804e+00 0.00000e+00 0.00000e+00 4.69996e+02 218.118 4.93510e+01 218.118 0.9553 
1 1 1 6   22  4  o 5  7.44421e+00 7.60155e-01 1.73119e+02 34.768  1.29364e+00  8.98035e-01  0.00000e+00 0.00000e+00 9.09377e-01 214.768 1.74028e+02 214.768 0.6141 
1 1 1 6   22  5  o 19 1.22514e+01 6.04043e-01 2.86592e+02 273.822 3.18736e-01  -4.77082e+00 0.00000e+00 0.00000e+00 1.23253e+02 273.822 1.63339e+02 93.822  0.8881 
1 1 1 6   22  6  o 13 2.27732e+01 5.72121e-01 4.18384e+02 128.178 -1.03471e+01 1.31594e+01  0.00000e+00 0.00000e+00 4.13372e+02 128.178 5.01267e+00 308.178 0.9697 
1 1 1 6   22  7  o 13 3.51212e+01 7.30118e-01 7.40245e+02 282.295 1.19285e+01  -5.47339e+01 0.00000e+00 0.00000e+00 5.70579e+02 282.295 1.69667e+02 102.295 0.9910 
1 1 1 6   22  8  o 15 2.54729e+01 6.77995e-01 5.88162e+02 104.320 -1.01070e+01 3.95939e+01  0.00000e+00 0.00000e+00 3.59145e+02 104.320 2.29016e+02 284.320 0.9877 
1 1 1 6   22  9  o 2  2.22445e+01 8.40897e-01 3.43703e+02 324.061 1.99812e+01  -1.44846e+01 0.00000e+00 0.00000e+00 4.76479e+02 324.061 1.32775e+02 324.061 0.9795 
1 1 1 6   22  10 o 5  1.64635e+01 8.20692e-01 1.29878e+02 31.416  8.14927e+00  4.97745e+00  0.00000e+00 0.00000e+00 4.56236e+02 31.416  3.26358e+02 31.416  0.9461 
1 1 1 6   22  11 o 10 9.68674e+00 1.17217e+00 1.08587e+02 108.969 -1.91237e+00 5.56355e+00  0.00000e+00 0.00000e+00 2.23163e+02 108.969 1.14576e+02 108.969 0.9105 
1 1 1 6   22  12 o 19 1.77928e+01 9.47012e-01 3.67491e+02 178.148 -5.18570e+01 1.67712e+00  0.00000e+00 0.00000e+00 2.94983e+02 178.148 7.25082e+01 358.148 0.9903 
1 1 1 6   22  13 o 9  5.64971e+00 1.52719e+00 4.19235e+01 199.678 -1.69717e+00 -6.06944e-01 0.00000e+00 0.00000e+00 9.87282e+01 199.678 5.68047e+01 199.678 0.6625 
1 1 1 6   22  14 o 16 7.32349e+00 1.73305e+00 1.71730e+02 356.652 1.02537e+01  -5.99880e-01 0.00000e+00 0.00000e+00 8.95541e+01 356.652 8.21756e+01 176.652 0.9500 
1 1 1 6   22  15 o 7  7.33308e+00 1.99687e+00 5.41917e+01 197.101 -2.93561e+00 -9.03197e-01 0.00000e+00 0.00000e+00 1.70147e+02 197.101 1.15956e+02 197.101 0.8151 
1 1 1 6   22  16 o 18 6.15793e+00 1.91970e+00 6.44090e+01 178.703 -3.41574e+00 7.73308e-02  0.00000e+00 0.00000e+00 1.28811e+02 178.703 6.44020e+01 178.703 0.8366 
1 1 1 6   23  0  o 6  3.63635e+01 8.55864e-01 6.78216e+02 301.514 1.15007e+01  -1.87572e+01 0.00000e+00 0.00000e+00 6.59419e+02 301.514 1.87968e+01 121.514 0.9770 
1 1 1 6   23  1  o 12 2.13205e+01 5.98435e-01 1.49432e+02 238.948 -1.74204e+00 -2.89331e+00 0.00000e+00 0.00000e+00 5.20534e+02 238.948 3.71103e+02 238.948 0.8344 
1 1 1 6   23  2  o 4  1.48110e+01 4.42205e-01 3.28163e+02 109.320 -1.66956e+00 4.76204e+00  0.00000e+00 0.00000e+00 1.70801e+02 109.320 1.57363e+02 289.321 0.8944 
1 1 1 6   23  3  o 14 1.53326e+01 5.07181e-01 3.38930e+02 200.358 -6.42886e+00 -2.38557e+00 0.00000e+00 0.00000e+00 1.94668e+02 200.358 1.44262e+02 20.358  0.9239 
1 1 1 6   23  4  o 14 1.40330e+01 5.96124e-01 1.62232e+02 83.081  3.58608e-01  2.95501e+00  0.00000e+00 0.00000e+00 2.65015e+02 83.081  1.02783e+02 83.081  0.8082 
1 1 1 6   23  5  o 12 3.29746e+01 6.62114e-01 5.16324e+02 65.880  9.42035e+00  2.10399e+01  0.00000e+00 0.00000e+00 6.98505e+02 65.880  1.82182e+02 65.880  0.9781 
1 1 1 6   23  6  o 10 4.50713e+00 7.88379e-01 1.29706e+02 11.153  9.74387e-01  1.92109e-01  0.00000e+00 0.00000e+00 5.43410e+01 191.153 1.84047e+02 191.153 0.4440 
1 1 1 6   23  7  o 3  2.34814e+01 6.16018e-01 4.29249e+02 28.392  1.96788e+01  1.06367e+01  0.00000e+00 0.00000e+00 4.35023e+02 28.392  5.77426e+00 28.392  0.9774 
1 1 1 6   23  8  o 11 3.37148e+01 7.43431e-01 6.07399e+02 189.580 -5.60927e+01 -9.46727e+00 0.00000e+00 0.00000e+00 6.50759e+02 189.580 4.33601e+01 189.580 0.9912 
1 1 1 6   23  9  f 0  1.97606e+01 7.44483e-01 2.68009e+02 3.298   1.86089e+01  1.07220e+00  0.00000e+00 0.00000e+00 4.55538e+02 3.298   1.87529e+02 3.298   0.9728 
1 1 1 6   23  10 o 16 8.14426e+00 1.14332e+00 2.30135e+02 303.358 4.59740e+00  -6.98352e+00 0.00000e+00 0.00000e+00 5.73520e+01 303.358 1.72783e+02 123.358 0.9381 
1 1 1 6   23  11 o 18 1.96931e+01 8.32396e-01 3.31895e+02 71.035  1.27725e+01  3.71675e+01  0.00000e+00 0.00000e+00 3.99314e+02 71.035  6.74199e+01 71.035  0.9872 
1 1 1 6   23  12 o 7  2.24911e+01 8.71550e-01 4.53902e+02 230.610 -5.23889e+01 -6.38014e+01 0.00000e+00 0.00000e+00 3.86504e+02 230.610 6.73984e+01 50.610  0.9939 
1 1 1 6   23  13 o 9  1.47276e+01 1.27161e+00 2.89817e+02 45.524  2.63054e+01  2.67912e+01  0.00000e+00 0.00000e+00 2.56152e+02 45.524  3.36656e+01 225.524 0.9866 
1 1 1 6   23  14 o 11 1.30524e+01 1.52652e+00 1.75110e+02 248.925 -7.47893e+00 -1.94078e+01 0.00000e+00 0.00000e+00 3.03113e+02 248.925 1.28003e+02 248.925 0.9757 
1 1 1 6   23  15 o 13 6.14601e+00 1.88518e+00 1.51133e+02 37.344  6.08773e+00  4.64499e+00  0.00000e+00 0.00000e+00 6.38842e+01 37.344  8.72486e+01 217.344 0.9322 
1 1 1 6   23  16 o 13 5.53989e+00 1.80753e+00 1.76905e+02 180.613 -9.04758e+00 -9.68353e-02 0.00000e+00 0.00000e+00 1.90128e+01 180.613 1.57892e+02 0.613   0.9430 
1 1 1 6   24  0  o 12 1.20227e+01 4.81067e-01 2.14435e+02 231.635 -1.70373e+00 -2.15226e+00 0.00000e+00 0.00000e+00 1.42789e+02 231.635 7.16465e+01 51.635  0.7892 
1 1 1 6   24  1  o 7  2.58817e+01 6.73616e-01 2.59906e+02 169.647 -6.92634e+00 1.26531e+00  0.00000e+00 0.00000e+00 6.42572e+02 169.647 3.82667e+02 169.647 0.9260 
1 1 1 6   24  2  o 13 2.23487e+01 6.32772e-01 2.70026e+02 211.410 -6.17025e+00 -3.76789e+00 0.00000e+00 0.00000e+00 5.11081e+02 211.410 2.41055e+02 211.410 0.9280 
1 1 1 6   24  3  o 18 1.68570e+01 4.64359e-01 3.55165e+02 160.254 -7.39449e+00 2.65431e+00  0.00000e+00 0.00000e+00 2.37857e+02 160.254 1.17308e+02 340.254 0.9340 
1 1 1 6   24  4  o 1  1.71896e+01 5.98835e-01 3.15375e+02 86.913  3.79906e-01  7.04428e+00  0.00000e+00 0.00000e+00 2.84271e+02 86.913  3.11044e+01 266.913 0.9261 
1 1 1 6   24  5  o 9  3.12331e+01 6.43636e-01 2.46880e+02 317.274 9.00147e+00  -8.31380e+00 0.00000e+00 0.00000e+00 8.80448e+02 317.274 6.33568e+02 317.274 0.9583 
1 1 1 6   24  6  o 1  1.28450e+01 5.70331e-01 3.56008e+02 255.358 -1.97458e+00 -7.55799e+00 0.00000e+00 0.00000e+00 9.56374e+01 255.358 2.60370e+02 75.358  0.9336 
1 1 1 6   24  7  o 15 1.01725e+01 6.90099e-01 3.25419e+02 82.191  9.91745e-01  7.23103e+00  0.00000e+00 0.00000e+00 3.03325e+01 82.191  2.95086e+02 262.191 0.9287 
1 1 1 6   24  8  o 18 1.66658e+01 6.82025e-01 1.81356e+02 70.805  2.76695e+00  7.94760e+00  0.00000e+00 0.00000e+00 4.07520e+02 70.805  2.26164e+02 70.805  0.9386 
1 1 1 6   24  9  o 16 2.59999e+01 7.50853e-01 4.37972e+02 70.279  1.34794e+01  3.76028e+01  0.00000e+00 0.00000e+00 5.28266e+02 70.279  9.02944e+01 70.279  0.9874 
1 1 1 6   24  10 f 0  8.95122e+00 1.15718e+00 1.84583e+02 244.664 -3.08094e+00 -6.50729e+00 0.00000e+00 0.00000e+00 1.27852e+02 244.664 5.67316e+01 64.664  0.9277 
1 1 1 6   24  11 o 11 9.13870e+00 1.23142e+00 2.19761e+02 189.665 -1.18231e+01 -2.01352e+00 0.00000e+00 0.00000e+00 1.09284e+02 189.665 1.10477e+02 9.665   0.9574 
1 1 1 6   24  12 o 11 5.04097e+00 1.35134e+00 7.61297e+01 178.770 -2.69873e+00 5.79205e-02  0.00000e+00 0.00000e+00 7.26373e+01 178.770 3.49239e+00 358.770 0.7850 
1 1 1 6   24  13 o 15 1.70488e+01 1.23028e+00 3.09937e+02 22.364  4.36861e+01  1.79744e+01  0.00000e+00 0.00000e+00 3.23812e+02 22.364  1.38752e+01 22.364  0.9894 
1 1 1 6   24  14 o 19 5.95190e+00 1.64479e+00 1.78186e+02 144.151 -7.15148e+00 5.16703e+00  0.00000e+00 0.00000e+00 3.22364e+01 144.151 1.45949e+02 324.151 0.9415 
1 1 1 6   24  15 o 7  8.06643e+00 2.11559e+00 1.02106e+02 274.085 4.24588e-01  -5.94563e+00 0.00000e+00 0.00000e+00 1.73884e+02 274.085 7.17778e+01 274.085 0.9117 
1 1 1 6   24  16 o 12 6.09920e+00 1.88403e+00 1.45680e+02 86.400  4.96829e-01  7.89774e+00  0.00000e+00 0.00000e+00 6.80581e+01 86.400  7.76215e+01 266.400 0.9345 
1 1 1 6   25  0  o 4  1.32297e+01 4.01735e-01 3.47731e+02 153.367 -4.34402e+00 2.17841e+00  0.00000e+00 0.00000e+00 9.55410e+01 153.367 2.52190e+02 333.367 0.8900 
1 1 1 6   25  1  o 15 3.49028e+01 7.36409e-01 3.97140e+02 277.982 1.99307e+00  -1.42146e+01 0.00000e+00 0.00000e+00 8.70444e+02 277.982 4.73304e+02 277.982 0.9645 
1 1 1 6   25  2  o 9  3.02170e+01 5.96084e-01 6.53925e+02 273.739 1.43117e+00  -2.18975e+01 0.00000e+00 0.00000e+00 4.57794e+02 273.739 1.96132e+02 93.739  0.9769 
1 1 1 6   25  3  o 3  3.18065e+01 8.15304e-01 8.30266e+02 127.073 -1.88141e+01 2.49011e+01  0.00000e+00 0.00000e+00 3.48307e+02 127.073 4.81959e+02 307.073 0.9838 
1 1 1 6   25  4  o 3  2.97906e+01 8.50754e-01 3.51683e+02 294.423 5.50542e+00  -1.21239e+01 0.00000e+00 0.00000e+00 7.27357e+02 294.423 3.75674e+02 294.423 0.9617 
1 1 1 6   25  5  o 9  4.86642e+01 8.86867e-01 8.46636e+02 25.914  5.79475e+01  2.81558e+01  0.00000e+00 0.00000e+00 9.71910e+02 25.914  1.25274e+02 25.914  0.9922 
1 1 1 6   25  6  o 13 3.20358e+01 6.75468e-01 5.53493e+02 186.609 -3.01909e+01 -3.49810e+00 0.00000e+00 0.00000e+00 6.32931e+02 186.609 7.94376e+01 186.609 0.9834 
1 1 1 6   25  7  o 18 2.00267e+01 7.17347e-01 4.73377e+02 201.332 -2.14431e+01 -8.37410e+00 0.00000e+00 0.00000e+00 2.64132e+02 201.332 2.09245e+02 21.332  0.9780 
1 1 1 6   25  8  o 7  1.38217e+01 7.71800e-01 2.19624e+02 348.793 8.87687e+00  -1.75882e+00 0.00000e+00 0.00000e+00 2.71044e+02 348.793 5.14204e+01 348.793 0.9430 
1 1 1 6   25  9  o 8  2.02798e+01 7.38276e-01 3.94483e+02 205.376 -2.47006e+01 -1.17163e+01 0.00000e+00 0.00000e+00 3.54650e+02 205.376 3.98336e+01 25.376  0.9815 
1 1 1 6   25  10 o 3  6.20928e+00 1.25996e+00 7.75681e+01 154.408 -1.85043e+00 8.86251e-01  0.00000e+00 0.00000e+00 8.73777e+01 154.408 9.80958e+00 154.408 0.7061 
1 1 1 6   25  11 o 13 1.44573e+01 9.26996e-01 2.28529e+02 348.593 2.08374e+01  -4.20409e+00 0.00000e+00 0.00000e+00 3.02218e+02 348.593 7.36884e+01 348.593 0.9762 
1 1 1 6   25  12 o 1  1.64024e+01 9.60919e-01 3.01653e+02 157.211 -3.63700e+01 1.52804e+01  0.00000e+00 0.00000e+00 3.07039e+02 157.211 5.38593e+00 157.211 0.9872 
1 1 1 6   25  13 o 15 1.08578e+01 1.52571e+00 2.02329e+02 44.478  1.20137e+01  1.17966e+01  0.00000e+00 0.00000e+00 1.93293e+02 44.478  9.03654e+00 224.478 0.9698 
1 1 1 6   25  14 o 10 1.35802e+01 1.51497e+00 2.22048e+02 229.537 -1.73784e+01 -2.03743e+01 0.00000e+00 0.00000e+00 2.78247e+02 229.537 5.61990e+01 229.537 0.9811 
1 1 1 6   25  15 o 11 5.29802e+00 1.70559e+00 1.20424e+02 25.645  5.26321e+00  2.52684e+00  0.00000e+00 0.00000e+00 6.04403e+01 25.645  5.99842e+01 205.645 0.9098 
1 1 1 6   25  16 o 16 8.99300e+00 2.42041e+00 1.35597e+02 75.689  1.93685e+00  7.59251e+00  0.00000e+00 0.00000e+00 1.79300e+02 75.689  4.37026e+01 75.689  0.9338 
1 1 1 6   26  0  o 6  8.51995e+00 3.98177e-01 2.66875e+02 41.454  1.77976e+00  1.57203e+00  0.00000e+00 0.00000e+00 2.61303e+01 221.453 2.93006e+02 221.453 0.7506 
1 1 1 6   26  1  o 1  2.79884e+01 6.25544e-01 4.29245e+02 312.658 9.78713e+00  -1.06218e+01 0.00000e+00 0.00000e+00 5.87392e+02 312.658 1.58147e+02 312.658 0.9647 
1 1 1 6   26  2  o 1  2.58963e+01 5.42085e-01 4.99225e+02 219.171 -1.10620e+01 -9.01261e+00 0.00000e+00 0.00000e+00 4.41130e+02 219.171 5.80945e+01 39.171  0.9643 
1 1 1 6   26  3  o 3  2.35308e+01 5.27905e-01 3.23762e+02 67.546  3.44516e+00  8.33634e+00  0.00000e+00 0.00000e+00 5.11746e+02 67.546  1.87984e+02 67.546  0.9428 
1 1 1 6   26  4  o 11 3.32284e+01 6.54481e-01 5.32369e+02 280.153 3.97039e+00  -2.21718e+01 0.00000e+00 0.00000e+00 6.90955e+02 280.153 1.58586e+02 280.153 0.9775 
1 1 1 6   26  5  o 9  2.51783e+01 5.77222e-01 6.10553e+02 108.963 -7.73230e+00 2.25038e+01  0.00000e+00 0.00000e+00 3.17521e+02 108.963 2.93033e+02 288.963 0.9788 
1 1 1 6   26  6  o 12 3.67966e+01 7.35999e-01 7.63281e+02 216.237 -3.86465e+01 -2.83238e+01 0.00000e+00 0.00000e+00 6.07815e+02 216.237 1.55465e+02 36.237  0.9895 
1 1 1 6   26  7  o 3  2.33057e+01 6.23099e-01 4.54886e+02 165.019 -2.46380e+01 6.59281e+00  0.00000e+00 0.00000e+00 4.05213e+02 165.019 4.96733e+01 345.019 0.9802 
1 1 1 6   26  8  o 3  2.95264e+01 7.20471e-01 4.11218e+02 333.081 3.08828e+01  -1.56807e+01 0.00000e+00 0.00000e+00 6.84065e+02 333.081 2.72847e+02 333.081 0.9855 
1 1 1 6   26  9  o 12 2.03880e+01 7.45180e-01 3.25259e+02 218.396 -1.77090e+01 -1.40338e+01 0.00000e+00 0.00000e+00 4.24811e+02 218.396 9.95524e+01 218.396 0.9776 
1 1 1 6   26  10 o 13 9.25116e+00 1.17078e+00 2.05321e+02 292.237 3.32737e+00  -8.13853e+00 0.00000e+00 0.00000e+00 1.22269e+02 292.237 8.30520e+01 112.237 0.9413 
1 1 1 6   26  11 o 7  2.10408e+01 8.40660e-01 3.77386e+02 28.193  4.73671e+01  2.53910e+01  0.00000e+00 0.00000e+00 4.06443e+02 28.193  2.90576e+01 28.193  0.9907 
1 1 1 6   26  12 o 15 6.33568e+00 1.34968e+00 1.26518e+02 105.510 -1.56974e+00 5.65644e+00  0.00000e+00 0.00000e+00 9.02587e+01 105.510 3.62589e+01 285.510 0.9103 
1 1 1 6   26  13 o 16 1.85663e+01 1.24130e+00 2.11600e+02 265.362 -2.87216e+00 -3.54024e+01 0.00000e+00 0.00000e+00 4.75997e+02 265.362 2.64397e+02 265.362 0.9858 
1 1 1 6   26  14 o 17 5.77554e+00 1.59717e+00 1.68464e+02 171.569 -8.57032e+00 1.27033e+00  0.00000e+00 0.00000e+00 3.54539e+01 171.569 1.33010e+02 351.569 0.9404 
1 1 1 6   26  15 o 4  5.90773e+00 1.79579e+00 9.10737e+01 259.544 -8.47101e-01 -4.59003e+00 0.00000e+00 0.00000e+00 1.05113e+02 259.544 1.40390e+01 259.544 0.8851 
1 1 1 6   26  16 o 11 6.47515e+00 1.88816e+00 1.75115e+02 83.939  1.03208e+00  9.72040e+00  0.00000e+00 0.00000e+00 5.48945e+01 83.939  1.20220e+02 263.939 0.9474 
1 1 1 6   27  0  o 16 3.44630e+01 7.21698e-01 4.69285e+02 278.515 2.87224e+00  -1.91842e+01 0.00000e+00 0.00000e+00 7.94031e+02 278.515 3.24746e+02 278.515 0.9739 
1 1 1 6   27  1  o 1  9.30081e+00 5.79839e-01 1.00279e+02 178.070 -1.11234e+00 3.74924e-02  0.00000e+00 0.00000e+00 6.95452e+01 178.070 3.07339e+01 358.070 0.4850 
1 1 1 6   27  2  o 2  2.16254e+01 6.20211e-01 1.49948e+02 316.678 3.09541e+00  -2.91921e+00 0.00000e+00 0.00000e+00 5.60640e+02 316.678 4.10692e+02 316.678 0.8727 
1 1 1 6   27  3  o 1  2.79876e+01 5.80995e-01 5.32503e+02 27.453  1.62512e+01  8.44285e+00  0.00000e+00 0.00000e+00 4.92249e+02 27.453  4.02547e+01 207.453 0.9723 
1 1 1 6   27  4  f 0  3.22770e+01 8.19950e-01 3.37042e+02 336.190 1.30593e+01  -5.76266e+00 0.00000e+00 0.00000e+00 8.35082e+02 336.190 4.98041e+02 336.190 0.9643 
1 1 1 6   27  5  o 15 1.89365e+01 5.34441e-01 3.87187e+02 158.500 -1.29616e+01 5.10574e+00  0.00000e+00 0.00000e+00 2.99820e+02 158.500 8.73670e+01 338.500 0.9634 
1 1 1 6   27  6  o 19 2.15853e+01 5.87643e-01 5.21082e+02 216.870 -1.88719e+01 -1.41538e+01 0.00000e+00 0.00000e+00 2.74269e+02 216.870 2.46813e+02 36.870  0.9786 
1 1 1 6   27  7  o 11 2.43886e+01 6.35580e-01 3.01639e+02 163.004 -1.68730e+01 5.15733e+00  0.00000e+00 0.00000e+00 5.90127e+02 163.004 2.88488e+02 163.004 0.9712 
1 1 1 6   27  8  o 4  5.97749e+00 9.76031e-01 2.49071e+02 302.484 2.22214e+00  -3.49023e+00 0.00000e+00 0.00000e+00 5.36406e+01 122.484 3.02711e+02 122.484 0.8686 
1 1 1 6   27  9  o 4  1.28172e+01 8.66766e-01 2.52542e+02 317.483 9.08170e+00  -8.32669e+00 0.00000e+00 0.00000e+00 2.09753e+02 317.483 4.27895e+01 137.483 0.9585 
1 1 1 6   27  10 o 2  1.70550e+01 8.18587e-01 2.54550e+02 163.109 -2.04144e+01 6.19896e+00  0.00000e+00 0.00000e+00 3.71780e+02 163.109 1.17230e+02 163.109 0.9763 
1 1 1 6   27  11 o 3  1.48684e+01 9.44676e-01 3.27548e+02 300.724 1.73027e+01  -2.91128e+01 0.00000e+00 0.00000e+00 2.23211e+02 300.724 1.04337e+02 120.724 0.9851 
1 1 1 6   27  12 o 15 6.34721e+00 1.46637e+00 1.13120e+02 2.405   5.01724e+00  2.10727e-01  0.00000e+00 0.00000e+00 1.00120e+02 2.405   1.29993e+01 182.405 0.8939 
1 1 1 6   27  13 o 15 6.09885e+00 1.55041e+00 1.82469e+02 260.653 -1.42356e+00 -8.64916e+00 0.00000e+00 0.00000e+00 3.31380e+01 260.653 1.49331e+02 80.653  0.9411 
1 1 1 6   27  14 o 12 5.84575e+00 1.67401e+00 6.91031e+01 24.298  3.15769e+00  1.42563e+00  0.00000e+00 0.00000e+00 1.15079e+02 24.298  4.59762e+01 24.298  0.8392 
1 1 1 6   27  15 o 9  7.63219e+00 1.98565e+00 1.25557e+02 25.040  6.76325e+00  3.15956e+00  0.00000e+00 0.00000e+00 1.40857e+02 25.040  1.53007e+01 25.040  0.9304 
1 1 1 6   27  16 o 3  5.42795e+00 1.70023e+00 8.32855e+01 281.178 8.90511e-01  -4.50633e+00 0.00000e+00 0.00000e+00 9.64128e+01 281.178 1.31273e+01 281.178 0.8830 
1 1 1 6   28  0  f 0  2.82259e+01 5.56089e-01 5.40268e+02 154.747 -1.64716e+01 7.76967e+00  0.00000e+00 0.00000e+00 4.92499e+02 154.747 4.77686e+01 334.747 0.9721 
1 1 1 6   28  1  o 1  1.13550e+01 4.63635e-01 2.07505e+02 296.898 1.18034e+00  -2.32681e+00 0.00000e+00 0.00000e+00 1.24362e+02 296.898 8.31436e+01 116.898 0.7764 
1 1 1 6   28  2  o 17 2.32035e+01 5.10653e-01 5.14805e+02 124.285 -8.79012e+00 1.28932e+01  0.00000e+00 0.00000e+00 3.30363e+02 124.285 1.84442e+02 304.285 0.9674 
1 1 1 6   28  3  o 6  1.86319e+01 4.83718e-01 1.32543e+02 64.431  1.39633e+00  2.91845e+00  0.00000e+00 0.00000e+00 4.46945e+02 64.431  3.14402e+02 64.431  0.8260 
1 1 1 6   28  4  o 15 3.30003e+01 6.89449e-01 7.89206e+02 206.556 -3.16564e+01 -1.58220e+01 0.00000e+00 0.00000e+00 4.35760e+02 206.556 3.53445e+02 26.556  0.9858 
1 1 1 6   28  5  o 6  1.57056e+01 6.36798e-01 9.62270e+01 71.289  9.12784e-01  2.69492e+00  0.00000e+00 0.00000e+00 3.75618e+02 71.289  2.79391e+02 71.289  0.7979 
1 1 1 6   28  6  o 5  6.07789e+00 8.33880e-01 1.01445e+02 269.177 -1.82741e-02 -1.27287e+00 0.00000e+00 0.00000e+00 2.09405e+01 269.177 8.05045e+01 89.177  0.5348 
1 1 1 6   28  7  o 10 1.60503e+01 6.30230e-01 3.31731e+02 338.015 1.31915e+01  -5.32561e+00 0.00000e+00 0.00000e+00 2.50846e+02 338.015 8.08850e+01 158.015 0.9642 
1 1 1 6   28  8  o 10 2.41557e+01 6.84513e-01 4.54872e+02 123.400 -1.93648e+01 2.93682e+01  0.00000e+00 0.00000e+00 4.41256e+02 123.400 1.36165e+01 303.400 0.9857 
1 1 1 6   28  9  o 14 1.98605e+01 7.75967e-01 3.14434e+02 175.190 -2.62754e+01 2.21123e+00  0.00000e+00 0.00000e+00 4.18537e+02 175.190 1.04103e+02 175.190 0.9809 
1 1 1 6   28  10 o 15 1.71474e+01 8.17321e-01 2.21491e+02 75.492  5.01283e+00  1.93726e+01  0.00000e+00 0.00000e+00 4.07159e+02 75.492  1.85668e+02 75.492  0.9747 
1 1 1 6   28  11 o 6  1.86974e+01 8.87763e-01 3.13989e+02 289.138 1.35379e+01  -3.90111e+01 0.00000e+00 0.00000e+00 3.80444e+02 289.138 6.64550e+01 289.138 0.9878 
1 1 1 6   28  12 o 18 1.05364e+01 1.36216e+00 2.13833e+02 324.296 1.33043e+01  -9.56150e+00 0.00000e+00 0.00000e+00 1.69859e+02 324.296 4.39739e+01 144.296 0.9690 
1 1 1 6   28  13 o 4  7.97528e+00 1.62236e+00 1.03585e+02 147.544 -5.08063e+00 3.23128e+00  0.00000e+00 0.00000e+00 1.69824e+02 147.544 6.62390e+01 147.544 0.9127 
1 1 1 6   28  14 o 8  3.75989e+00 1.31586e+00 6.03386e+01 131.966 -1.57089e+00 1.74676e+00  0.00000e+00 0.00000e+00 4.51752e+01 131.966 1.51633e+01 311.966 0.7476 
1 1 1 6   28  15 o 9  4.31921e+00 1.46270e+00 7.39865e+01 283.839 8.07793e-01  -3.27900e+00 0.00000e+00 0.00000e+00 6.12203e+01 283.839 1.27662e+01 103.839 0.8344 
1 1 1 6   28  16 o 16 1.24577e+01 1.86628e+00 1.27580e+02 7.131   1.43899e+01  1.80038e+00  0.00000e+00 0.00000e+00 3.23049e+02 7.131   1.95469e+02 7.131   0.9649 
1 1 1 6   29  0  o 2  2.95719e+01 5.74523e-01 4.26890e+02 153.387 -1.24661e+01 6.24616e+00  0.00000e+00 0.00000e+00 6.45359e+02 153.387 2.18469e+02 153.387 0.9634 
1 1 1 6   29  1  o 12 2.39751e+01 5.13775e-01 5.96828e+02 353.709 1.87376e+01  -2.06578e+00 0.00000e+00 0.00000e+00 2.81387e+02 353.709 3.15440e+02 173.709 0.9731 
1 1 1 6   29  2  o 17 1.85000e+01 4.88897e-01 3.98449e+02 17.431  8.35327e+00  2.62267e+00  0.00000e+00 0.00000e+00 2.56975e+02 17.431  1.41473e+02 197.431 0.9410 
1 1 1 6   29  3  o 16 1.17161e+01 4.61891e-01 1.11743e+02 342.433 1.62683e+00  -5.15022e-01 0.00000e+00 0.00000e+00 1.71981e+02 342.433 6.02381e+01 342.433 0.6432 
1 1 1 6   29  4  o 12 2.76635e+01 5.89587e-01 6.11171e+02 188.993 -2.26544e+01 -3.58532e+00 0.00000e+00 0.00000e+00 4.07474e+02 188.993 2.03697e+02 8.993   0.9780 
1 1 1 6   29  5  o 5  1.24122e+01 7.59093e-01 2.07424e+02 18.753  4.25301e+00  1.44394e+00  0.00000e+00 0.00000e+00 2.03872e+02 18.753  3.55126e+00 198.753 0.8801 
1 1 1 6   29  6  o 11 3.07831e+01 6.64662e-01 4.99772e+02 153.629 -2.86424e+01 1.42002e+01  0.00000e+00 0.00000e+00 6.40878e+02 153.629 1.41106e+02 153.629 0.9842 
1 1 1 6   29  7  o 2  2.63726e+01 6.86728e-01 3.63353e+02 180.386 -2.49214e+01 -1.68047e-01 0.00000e+00 0.00000e+00 6.09243e+02 180.386 2.45890e+02 180.386 0.9797 
1 1 1 6   29  8  o 3  2.24076e+01 6.83305e-01 3.99808e+02 72.476  8.34542e+00  2.64291e+01  0.00000e+00 0.00000e+00 4.28125e+02 72.476  2.83166e+01 72.476  0.9818 
1 1 1 6   29  9  o 14 2.32854e+01 7.40722e-01 4.65060e+02 280.756 8.54341e+00  -4.49758e+01 0.00000e+00 0.00000e+00 4.01398e+02 280.756 6.36622e+01 100.755 0.9890 
1 1 1 6   29  10 o 7  1.84425e+01 8.04985e-01 2.99934e+02 162.543 -3.05578e+01 9.60972e+00  0.00000e+00 0.00000e+00 3.82789e+02 162.543 8.28544e+01 162.543 0.9843 
1 1 1 6   29  11 o 14 2.18730e+01 8.63629e-01 3.98411e+02 327.949 5.25256e+01  -3.28869e+01 0.00000e+00 0.00000e+00 4.17258e+02 327.949 1.88472e+01 327.949 0.9919 
1 1 1 6   29  12 o 14 2.30104e+01 1.03245e+00 3.53609e+02 204.360 -6.03895e+01 -2.73437e+01 0.00000e+00 0.00000e+00 5.04539e+02 204.360 1.50931e+02 204.360 0.9924 
1 1 1 6   29  13 o 6  1.36054e+01 1.46209e+00 2.15258e+02 118.867 -1.10359e+01 2.00188e+01  0.00000e+00 0.00000e+00 2.84438e+02 118.867 6.91797e+01 118.867 0.9779 
1 1 1 6   29  14 o 11 7.70738e+00 1.82661e+00 1.47974e+02 162.805 -8.78481e+00 2.71846e+00  0.00000e+00 0.00000e+00 1.25122e+02 162.805 2.28516e+01 342.805 0.9440 
1 1 1 6   29  15 o 5  8.05177e+00 2.06686e+00 2.64356e+02 341.742 1.50196e+01  -4.95494e+00 0.00000e+00 0.00000e+00 2.79778e+01 341.742 2.36378e+02 161.742 0.9679 
1 1 1 6   29  16 o 18 5.09334e+00 1.62556e+00 1.59550e+02 54.932  5.11452e+00  7.28590e+00  0.00000e+00 0.00000e+00 2.03132e+01 54.932  1.39237e+02 234.932 0.9420 
1 1 1 6   30  0  o 3  2.03917e+01 5.18078e-01 4.43899e+02 187.906 -1.18057e+01 -1.63937e+00 0.00000e+00 0.00000e+00 2.90544e+02 187.906 1.53355e+02 7.906   0.9571 
1 1 1 6   30  1  o 15 1.76543e+01 4.46490e-01 4.40073e+02 322.412 8.05787e+00  -6.20280e+00 0.00000e+00 0.00000e+00 1.90857e+02 322.412 2.49216e+02 142.412 0.9495 
1 1 1 6   30  2  o 1  3.86868e+01 8.00633e-01 7.39638e+02 265.470 -2.76121e+00 -3.48509e+01 0.00000e+00 0.00000e+00 6.95757e+02 265.470 4.38815e+01 85.470  0.9856 
1 1 1 6   30  3  o 7  2.87275e+01 5.87917e-01 5.70924e+02 93.592  -1.31372e+00 2.09284e+01  0.00000e+00 0.00000e+00 4.84518e+02 93.592  8.64064e+01 273.592 0.9759 
1 1 1 6   30  4  o 18 1.53234e+01 5.02489e-01 2.66561e+02 119.206 -3.17740e+00 5.68379e+00  0.00000e+00 0.00000e+00 2.63998e+02 119.206 2.56292e+00 299.206 0.9196 
1 1 1 6   30  5  o 9  1.76048e+01 5.92062e-01 4.61348e+02 267.408 -6.29369e-01 -1.39039e+01 0.00000e+00 0.00000e+00 1.77171e+02 267.408 2.84177e+02 87.408  0.9634 
1 1 1 6   30  6  o 5  2.75916e+01 6.41331e-01 4.89494e+02 47.210  1.98862e+01  2.14825e+01  0.00000e+00 0.00000e+00 5.31292e+02 47.210  4.17986e+01 47.210  0.9828 
1 1 1 6   30  7  o 17 1.28199e+01 6.48492e-01 3.55171e+02 328.425 1.00936e+01  -6.20369e+00 0.00000e+00 0.00000e+00 1.06523e+02 328.425 2.48648e+02 148.425 0.9568 
1 1 1 6   30  8  o 6  2.63797e+01 7.03718e-01 4.48372e+02 138.571 -2.73077e+01 2.40999e+01  0.00000e+00 0.00000e+00 5.30598e+02 138.571 8.22258e+01 138.571 0.9862 
1 1 1 6   30  9  o 3  1.32432e+01 1.01184e+00 8.36134e+01 337.003 4.13624e+00  -1.75543e+00 0.00000e+00 0.00000e+00 3.54883e+02 337.003 2.71270e+02 337.003 0.8801 
1 1 1 6   30  10 o 16 1.55894e+01 8.26472e-01 2.82371e+02 59.322  1.29224e+01  2.17824e+01  0.00000e+00 0.00000e+00 2.92217e+02 59.322  9.84654e+00 59.322  0.9801 
1 1 1 6   30  11 o 18 1.80424e+01 8.65508e-01 3.44143e+02 267.562 -1.84308e+00 -4.32910e+01 0.00000e+00 0.00000e+00 3.26249e+02 267.562 1.78945e+01 87.562  0.9884 
1 1 1 6   30  12 o 10 9.12836e+00 1.60166e+00 1.85722e+02 174.446 -1.11677e+01 1.08585e+00  0.00000e+00 0.00000e+00 1.41619e+02 174.446 4.41036e+01 354.446 0.9543 
1 1 1 6   30  13 o 4  5.43243e+00 1.54194e+00 1.05878e+02 109.919 -1.56672e+00 4.32352e+00  0.00000e+00 0.00000e+00 7.43033e+01 109.919 3.15751e+01 289.919 0.8832 
1 1 1 6   30  14 o 1  9.27071e+00 1.89632e+00 7.75054e+01 122.502 -2.90975e+00 4.56698e+00  0.00000e+00 0.00000e+00 2.36428e+02 122.502 1.58923e+02 122.502 0.9022 
1 1 1 6   30  15 o 12 5.80676e+00 1.70660e+00 1.53708e+02 15.594  8.08021e+00  2.25506e+00  0.00000e+00 0.00000e+00 5.06752e+01 15.594  1.03033e+02 195.594 0.9384 
1 1 1 6   30  16 o 8  4.60094e+00 1.47834e+00 5.41961e+01 224.480 -2.06562e+00 -2.02843e+00 0.00000e+00 0.00000e+00 8.41010e+01 224.480 2.99049e+01 224.480 0.8019 
1 1 1 6   31  0  o 15 2.06058e+01 4.69714e-01 3.81772e+02 187.540 -1.01953e+01 -1.34943e+00 0.00000e+00 0.00000e+00 3.54876e+02 187.540 2.68959e+01 7.540   0.9501 
1 1 1 6   31  1  o 5  2.58425e+01 6.78368e-01 1.90700e+02 303.864 3.24530e+00  -4.83606e+00 0.00000e+00 0.00000e+00 6.93933e+02 303.864 5.03234e+02 303.864 0.9095 
1 1 1 6   31  2  o 4  2.73116e+01 6.31932e-01 5.80040e+02 208.478 -1.81776e+01 -9.86071e+00 0.00000e+00 0.00000e+00 4.22856e+02 208.478 1.57184e+02 28.478  0.9755 
1 1 1 6   31  3  f 0  1.37114e+01 5.37801e-01 1.99618e+02 241.337 -1.74134e+00 -3.18547e+00 0.00000e+00 0.00000e+00 2.37905e+02 241.337 3.82870e+01 241.337 0.8476 
1 1 1 6   31  4  o 7  1.16089e+01 5.06983e-01 6.69045e+01 74.502  3.22594e-01  1.16342e+00  0.00000e+00 0.00000e+00 1.58188e+02 74.502  9.12837e+01 74.502  0.5150 
1 1 1 6   31  5  o 16 2.68758e+01 6.06554e-01 5.47780e+02 274.466 1.95332e+00  -2.50079e+01 0.00000e+00 0.00000e+00 4.43592e+02 274.466 1.04187e+02 94.466  0.9799 
1 1 1 6   31  6  o 9  3.43594e+01 7.14022e-01 7.08268e+02 53.408  3.20195e+01  4.31267e+01  0.00000e+00 0.00000e+00 5.72984e+02 53.408  1.35284e+02 233.408 0.9906 
1 1 1 6   31  7  o 18 2.73300e+01 6.63015e-01 4.99095e+02 207.078 -3.31798e+01 -1.69626e+01 0.00000e+00 0.00000e+00 5.15599e+02 207.078 1.65043e+01 207.078 0.9865 
1 1 1 6   31  8  o 8  1.59046e+01 7.02582e-01 3.81628e+02 92.303  -7.74079e-01 1.92510e+01  0.00000e+00 0.00000e+00 2.01084e+02 92.303  1.80544e+02 272.303 0.9737 
1 1 1 6   31  9  o 9  1.37319e+01 8.61566e-01 3.04119e+02 190.470 -1.75253e+01 -3.23855e+00 0.00000e+00 0.00000e+00 1.97732e+02 190.470 1.06387e+02 10.470  0.9715 
1 1 1 6   31  10 o 8  2.03137e+01 7.79737e-01 4.18621e+02 32.481  3.99755e+01  2.54484e+01  0.00000e+00 0.00000e+00 3.37166e+02 32.481  8.14547e+01 212.481 0.9894 
1 1 1 6   31  11 o 1  1.99486e+01 9.80229e-01 3.69729e+02 254.250 -1.35572e+01 -4.80705e+01 0.00000e+00 0.00000e+00 3.72586e+02 254.250 2.85759e+00 254.250 0.9899 
1 1 1 6   31  12 o 10 2.08950e+01 1.08948e+00 3.68980e+02 160.768 -6.09893e+01 2.12773e+01  0.00000e+00 0.00000e+00 4.09993e+02 160.768 4.10129e+01 160.768 0.9922 
1 1 1 6   31  13 o 16 2.09319e+01 1.23580e+00 3.63090e+02 68.545  2.64970e+01  6.74206e+01  0.00000e+00 0.00000e+00 4.17515e+02 68.545  5.44258e+01 68.545  0.9931 
1 1 1 6   31  14 o 11 9.92753e+00 1.96482e+00 1.98292e+02 301.014 7.36203e+00  -1.22458e+01 0.00000e+00 0.00000e+00 1.61012e+02 301.014 3.72800e+01 121.014 0.9643 
1 1 1 6   31  15 o 19 5.48904e+00 1.63335e+00 6.65829e+01 180.322 -3.58688e+00 -2.01650e-02 0.00000e+00 0.00000e+00 1.07489e+02 180.322 4.09056e+01 180.322 0.8455 
1 1 1 6   31  16 o 4  4.89905e+00 1.60210e+00 1.00020e+02 248.390 -1.93313e+00 -4.87995e+00 0.00000e+00 0.00000e+00 6.50245e+01 248.390 3.49958e+01 68.390  0.8989 
1 1 1 6   32  0  o 2  3.02552e+01 5.89047e-01 5.12560e+02 349.317 1.80377e+01  -3.40266e+00 0.00000e+00 0.00000e+00 5.94345e+02 349.317 8.17843e+01 349.317 0.9724 
1 1 1 6   32  1  o 18 3.17717e+01 6.16881e-01 5.97160e+02 171.953 -2.30769e+01 3.26254e+00  0.00000e+00 0.00000e+00 5.72576e+02 171.953 2.45842e+01 351.953 0.9783 
1 1 1 6   32  2  o 9  2.80616e+01 5.72565e-01 5.83018e+02 164.694 -2.05073e+01 5.61238e+00  0.00000e+00 0.00000e+00 4.48046e+02 164.694 1.34972e+02 344.694 0.9762 
1 1 1 6   32  3  o 9  3.16916e+01 7.78171e-01 6.23309e+02 225.491 -1.87623e+01 -1.90864e+01 0.00000e+00 0.00000e+00 5.47132e+02 225.491 7.61765e+01 45.491  0.9811 
1 1 1 6   32  4  o 1  4.50973e+01 8.28727e-01 7.14505e+02 355.034 4.90130e+01  -4.25855e+00 0.00000e+00 0.00000e+00 9.65764e+02 355.034 2.51258e+02 355.034 0.9898 
1 1 1 6   32  5  o 14 2.23296e+01 5.73634e-01 5.04487e+02 358.763 1.93578e+01  -4.17936e-01 0.00000e+00 0.00000e+00 3.14043e+02 358.763 1.90444e+02 178.763 0.9738 
1 1 1 6   32  6  o 8  9.23716e+00 6.78105e-01 1.92998e+02 72.532  1.30533e+00  4.14818e+00  0.00000e+00 0.00000e+00 1.11462e+02 72.532  8.15358e+01 252.532 0.8757 
1 1 1 6   32  7  o 18 1.99780e+01 6.26017e-01 3.25504e+02 271.550 4.92764e-01  -1.82090e+01 0.00000e+00 0.00000e+00 4.05383e+02 271.550 7.98793e+01 271.550 0.9722 
1 1 1 6   32  8  o 18 2.22934e+01 6.75685e-01 3.41196e+02 102.481 -5.39297e+00 2.43646e+01  0.00000e+00 0.00000e+00 4.80601e+02 102.481 1.39406e+02 102.481 0.9798 
1 1 1 6   32  9  o 2  3.79435e+01 8.34222e-01 7.14409e+02 19.887  1.08884e+02  3.93871e+01  0.00000e+00 0.00000e+00 7.06627e+02 19.887  7.78143e+00 199.887 0.9957 
1 1 1 6   32  10 o 16 1.87196e+01 8.05828e-01 3.04743e+02 263.406 -3.66091e+00 -3.16709e+01 0.00000e+00 0.00000e+00 3.88012e+02 263.406 8.32684e+01 263.406 0.9842 
1 1 1 6   32  11 o 1  2.33966e+01 1.01372e+00 2.81086e+02 217.011 -3.70619e+01 -2.79392e+01 0.00000e+00 0.00000e+00 5.88782e+02 217.011 3.07697e+02 217.011 0.9892 
1 1 1 6   32  12 o 7  9.62559e+00 1.55416e+00 1.25724e+02 289.035 2.79533e+00  -8.10196e+00 0.00000e+00 0.00000e+00 2.14098e+02 289.035 8.83741e+01 289.035 0.9397 
1 1 1 6   32  13 o 11 6.19990e+00 1.70033e+00 6.56577e+01 144.766 -2.63719e+00 1.86268e+00  0.00000e+00 0.00000e+00 1.26536e+02 144.766 6.08784e+01 144.766 0.8256 
1 1 1 6   32  14 o 14 1.25494e+01 1.79862e+00 2.30761e+02 354.870 2.33645e+01  -2.09749e+00 0.00000e+00 0.00000e+00 2.30038e+02 354.870 7.23065e-01 174.870 0.9784 
1 1 1 6   32  15 o 7  1.26147e+01 1.67912e+00 3.06152e+02 166.465 -3.43511e+01 8.26922e+00  0.00000e+00 0.00000e+00 1.60198e+02 166.465 1.45954e+02 346.465 0.9857 
1 1 1 6   32  16 o 6  1.34278e+01 1.94945e+00 2.57156e+02 349.663 2.94839e+01  -5.37766e+00 0.00000e+00 0.00000e+00 2.37609e+02 349.663 1.95466e+01 169.663 0.9832 
1 1 1 6   33  0  o 7  3.72911e+01 7.29940e-01 7.85821e+02 279.107 5.67142e+00  -3.53813e+01 0.00000e+00 0.00000e+00 5.97425e+02 279.107 1.88396e+02 99.107  0.9859 
1 1 1 6   33  1  o 12 7.43017e+00 4.72615e-01 1.97763e+02 346.303 1.86988e+00  -4.55727e-01 0.00000e+00 0.00000e+00 6.23940e+00 166.303 2.04002e+02 166.303 0.6850 
1 1 1 6   33  2  o 15 2.88112e+01 9.65645e-01 4.01045e+02 164.418 -1.40216e+01 3.91023e+00  0.00000e+00 0.00000e+00 6.45347e+02 164.418 2.44301e+02 164.418 0.9650 
1 1 1 6   33  3  o 4  3.35995e+01 9.63031e-01 5.17506e+02 87.338  1.07915e+00  2.32122e+01  0.00000e+00 0.00000e+00 7.19625e+02 87.338  2.02119e+02 87.338  0.9782 
1 1 1 6   33  4  o 11 1.62893e+01 5.12355e-01 3.30339e+02 175.291 -1.01503e+01 8.36135e-01  0.00000e+00 0.00000e+00 2.51863e+02 175.291 7.84755e+01 355.291 0.9496 
1 1 1 6   33  5  o 10 1.04267e+01 6.46239e-01 1.78063e+02 282.601 8.47637e-01  -3.79169e+00 0.00000e+00 0.00000e+00 1.59035e+02 282.601 1.90284e+01 102.601 0.8590 
1 1 1 6   33  6  o 12 1.55773e+01 5.87564e-01 2.71796e+02 144.550 -8.42376e+00 5.99742e+00  0.00000e+00 0.00000e+00 2.85347e+02 144.550 1.35514e+01 144.550 0.9503 
1 1 1 6   33  7  o 16 1.99723e+01 6.27119e-01 2.62852e+02 152.111 -1.40180e+01 7.41855e+00  0.00000e+00 0.00000e+00 4.64600e+02 152.111 2.01748e+02 152.111 0.9679 
1 1 1 6   33  8  o 18 1.39168e+01 7.37087e-01 2.01740e+02 322.186 7.21349e+00  -5.59821e+00 0.00000e+00 0.00000e+00 2.92264e+02 322.186 9.05238e+01 322.186 0.9435 
1 1 1 6   33  9  o 10 3.72696e+01 9.53025e-01 5.58595e+02 67.652  3.46969e+01  8.43978e+01  0.00000e+00 0.00000e+00 8.35443e+02 67.652  2.76848e+02 67.652  0.9945 
1 1 1 6   33  10 o 2  1.74771e+01 8.19190e-01 2.55254e+02 259.894 -4.64115e+00 -2.60408e+01 0.00000e+00 0.00000e+00 3.89305e+02 259.894 1.34051e+02 259.894 0.9809 
1 1 1 6   33  11 o 18 1.17957e+01 1.27156e+00 1.76344e+02 89.595  1.02909e-01  1.45557e+01  0.00000e+00 0.00000e+00 2.51464e+02 89.595  7.51204e+01 89.595  0.9650 
1 1 1 6   33  12 o 4  1.83931e+01 1.15094e+00 2.29509e+02 101.942 -7.24215e+00 3.42431e+01  0.00000e+00 0.00000e+00 4.51496e+02 101.942 2.21987e+02 101.942 0.9856 
1 1 1 6   33  13 o 11 1.08989e+01 1.88383e+00 2.27524e+02 342.351 1.70563e+01  -5.42663e+00 0.00000e+00 0.00000e+00 1.70086e+02 342.351 5.74389e+01 162.351 0.9717 
1 1 1 6   33  14 o 1  1.45758e+01 1.73462e+00 2.19912e+02 191.573 -2.72597e+01 -5.58219e+00 0.00000e+00 0.00000e+00 3.17113e+02 191.573 9.72011e+01 191.573 0.9819 
1 1 1 6   33  15 o 13 7.38732e+00 1.82080e+00 1.31147e+02 111.038 -3.13214e+00 8.14340e+00  0.00000e+00 0.00000e+00 1.29483e+02 111.038 1.66416e+00 291.038 0.9408 
1 1 1 6   33  16 o 19 6.82118e+00 1.90247e+00 7.98971e+01 29.585  4.08024e+00  2.31646e+00  0.00000e+00 0.00000e+00 1.46503e+02 29.585  6.66063e+01 29.585  0.8857 
1 1 1 6   34  0  o 19 1.47848e+01 7.15743e-01 2.58603e+02 146.763 -4.15406e+00 2.72216e+00  0.00000e+00 0.00000e+00 2.37845e+02 146.763 2.07578e+01 326.763 0.8926 
1 1 1 6   34  1  o 5  3.99447e+01 9.32630e-01 4.13270e+02 312.466 1.42766e+01  -1.55986e+01 0.00000e+00 0.00000e+00 1.05373e+03 312.466 6.40457e+02 312.466 0.9761 
1 1 1 6   34  2  o 8  1.96996e+01 4.81887e-01 5.76917e+02 256.502 -3.51872e+00 -1.46592e+01 0.00000e+00 0.00000e+00 1.39394e+02 256.502 4.37523e+02 76.502  0.9662 
1 1 1 6   34  3  o 15 2.29451e+01 6.84308e-01 5.46614e+02 179.081 -1.98405e+01 3.18388e-01  0.00000e+00 0.00000e+00 2.94885e+02 179.081 2.51729e+02 359.081 0.9745 
1 1 1 6   34  4  o 14 3.22433e+01 6.53513e-01 4.54765e+02 253.397 -7.34049e+00 -2.46188e+01 0.00000e+00 0.00000e+00 7.34901e+02 253.397 2.80135e+02 253.397 0.9803 
1 1 1 6   34  5  o 5  3.62238e+01 8.09966e-01 5.70202e+02 76.245  1.01535e+01  4.14776e+01  0.00000e+00 0.00000e+00 7.77031e+02 76.245  2.06829e+02 76.245  0.9882 
1 1 1 6   34  6  o 9  4.30529e+01 8.25256e-01 6.84092e+02 322.086 5.50446e+01  -4.28731e+01 0.00000e+00 0.00000e+00 9.24412e+02 322.086 2.40321e+02 322.086 0.9928 
1 1 1 6   34  7  o 15 2.30412e+01 6.43064e-01 4.90278e+02 179.839 -3.39502e+01 9.50936e-02  0.00000e+00 0.00000e+00 3.63801e+02 179.839 1.26477e+02 359.839 0.9852 
1 1 1 6   34  8  o 9  1.94097e+01 7.51742e-01 3.27335e+02 276.799 2.63506e+00  -2.21009e+01 0.00000e+00 0.00000e+00 3.86217e+02 276.799 5.88814e+01 276.799 0.9773 
1 1 1 6   34  9  o 2  4.69267e+00 1.23062e+00 2.22964e+02 116.336 -2.03459e+00 4.11018e+00  0.00000e+00 0.00000e+00 6.71668e+01 296.336 2.90131e+02 296.336 0.8828 
1 1 1 6   34  10 o 3  1.34171e+01 9.45309e-01 2.15147e+02 281.419 3.29662e+00  -1.63215e+01 0.00000e+00 0.00000e+00 2.73873e+02 281.419 5.87257e+01 281.419 0.9695 
1 1 1 6   34  11 o 10 1.45232e+01 1.09829e+00 2.93831e+02 167.983 -2.93342e+01 6.24440e+00  0.00000e+00 0.00000e+00 2.42767e+02 167.983 5.10633e+01 347.983 0.9832 
1 1 1 6   34  12 o 5  6.15743e+00 1.57179e+00 1.39664e+02 287.253 1.79146e+00  -5.76852e+00 0.00000e+00 0.00000e+00 7.14963e+01 287.253 6.81678e+01 107.253 0.9130 
1 1 1 6   34  13 o 3  1.41962e+01 1.68962e+00 2.47454e+02 135.031 -2.03598e+01 2.03375e+01  0.00000e+00 0.00000e+00 2.76165e+02 135.031 2.87116e+01 135.031 0.9825 
1 1 1 6   34  14 o 7  1.01232e+01 1.89023e+00 1.91306e+02 247.419 -5.83426e+00 -1.40293e+01 0.00000e+00 0.00000e+00 1.75803e+02 247.419 1.55031e+01 67.419  0.9665 
1 1 1 6   34  15 o 8  9.99957e+00 1.90712e+00 1.80995e+02 73.674  4.16927e+00  1.42343e+01  0.00000e+00 0.00000e+00 1.81085e+02 73.674  8.97394e-02 73.674  0.9657 
1 1 1 6   34  16 o 3  5.05861e+00 1.62763e+00 9.53753e+01 308.770 3.26090e+00  -4.06012e+00 0.00000e+00 0.00000e+00 7.48343e+01 308.770 2.05410e+01 128.770 0.8980 
1 1 1 6   35  0  o 4  3.03722e+01 5.93157e-01 5.16528e+02 245.563 -8.32357e+00 -1.83174e+01 0.00000e+00 0.00000e+00 5.97158e+02 245.563 8.06299e+01 245.563 0.9748 
1 1 1 6   35  1  o 18 3.10833e+01 9.89304e-01 2.59730e+02 327.165 8.52170e+00  -5.49919e+00 0.00000e+00 0.00000e+00 8.50472e+02 327.165 5.90742e+02 327.165 0.9493 
1 1 1 6   35  2  o 19 3.05382e+01 6.04937e-01 4.38379e+02 91.303  -4.14233e-01 1.82130e+01  0.00000e+00 0.00000e+00 6.78732e+02 91.303  2.40353e+02 91.303  0.9722 
1 1 1 6   35  3  o 9  2.89968e+01 7.18058e-01 5.88318e+02 162.734 -2.50892e+01 7.79791e+00  0.00000e+00 0.00000e+00 4.81913e+02 162.734 1.06405e+02 342.734 0.9808 
1 1 1 6   35  4  o 9  3.57890e+01 7.00317e-01 6.94705e+02 126.484 -2.51820e+01 3.40512e+01  0.00000e+00 0.00000e+00 6.36143e+02 126.484 5.85620e+01 306.484 0.9881 
1 1 1 6   35  5  o 16 1.24406e+01 7.00416e-01 2.04751e+02 230.330 -3.52268e+00 -4.24762e+00 0.00000e+00 0.00000e+00 2.18542e+02 230.330 1.37906e+01 230.330 0.9042 
1 1 1 6   35  6  o 7  2.84825e+01 6.54790e-01 4.86788e+02 355.108 3.68320e+01  -3.15257e+00 0.00000e+00 0.00000e+00 5.70360e+02 355.108 8.35727e+01 355.108 0.9864 
1 1 1 6   35  7  o 13 1.05055e+01 9.45385e-01 2.02192e+02 187.998 -5.86350e+00 -8.23895e-01 0.00000e+00 0.00000e+00 1.57919e+02 187.998 4.42729e+01 7.998   0.9111 
1 1 1 6   35  8  o 12 1.58711e+01 7.44133e-01 1.62959e+02 154.552 -7.96059e+00 3.78810e+00  0.00000e+00 0.00000e+00 3.99065e+02 154.552 2.36106e+02 154.552 0.9415 
1 1 1 6   35  9  o 5  4.00182e+01 9.80930e-01 5.74386e+02 5.824   1.02667e+02  1.04722e+01  0.00000e+00 0.00000e+00 9.23139e+02 5.824   3.48753e+02 5.824   0.9951 
1 1 1 6   35  10 o 11 7.70077e+00 1.26115e+00 1.78980e+02 282.133 1.58063e+00  -7.35213e+00 0.00000e+00 0.00000e+00 9.05025e+01 282.133 8.84770e+01 102.133 0.9309 
1 1 1 6   35  11 o 7  1.58320e+01 1.08326e+00 2.54854e+02 52.760  1.71881e+01  2.26116e+01  0.00000e+00 0.00000e+00 3.29480e+02 52.760  7.46264e+01 52.760  0.9822 
1 1 1 6   35  12 o 18 7.23144e+00 1.69637e+00 1.61311e+02 292.732 3.22108e+00  -7.68795e+00 0.00000e+00 0.00000e+00 9.34381e+01 292.732 6.78726e+01 112.733 0.9379 
1 1 1 6   35  13 o 17 8.04751e+00 1.94178e+00 1.77765e+02 106.088 -2.84288e+00 9.85710e+00  0.00000e+00 0.00000e+00 1.09207e+02 106.088 6.85580e+01 286.088 0.9499 
1 1 1 6   35  14 o 1  6.08737e+00 1.57223e+00 1.33401e+02 29.465  6.61387e+00  3.73668e+00  0.00000e+00 0.00000e+00 7.93685e+01 29.465  5.40326e+01 209.465 0.9316 
1 1 1 6   35  15 o 15 5.63291e+00 1.68277e+00 8.27064e+01 324.427 3.76211e+00  -2.69073e+00 0.00000e+00 0.00000e+00 1.03969e+02 324.427 2.12625e+01 324.427 0.8839 
1 1 1 6   35  16 o 18 1.08351e+01 2.02963e+00 1.68356e+02 107.946 -4.64335e+00 1.43363e+01  0.00000e+00 0.00000e+00 2.23890e+02 107.946 5.55332e+01 107.946 0.9662 
1 1 1 6   36  0  o 6  4.78735e+01 9.57188e-01 9.44765e+02 29.988  4.92091e+01  2.83977e+01  0.00000e+00 0.00000e+00 8.39903e+02 29.988  1.04862e+02 209.988 0.9912 
1 1 1 6   36  1  o 9  3.19991e+01 6.22128e-01 6.26694e+02 186.537 -2.62702e+01 -3.01055e+00 0.00000e+00 0.00000e+00 5.54103e+02 186.537 7.25913e+01 6.538   0.9809 
1 1 1 6   36  2  o 5  2.38795e+01 6.81962e-01 4.22463e+02 248.382 -5.90695e+00 -1.49059e+01 0.00000e+00 0.00000e+00 4.47514e+02 248.382 2.50512e+01 248.382 0.9683 
1 1 1 6   36  3  o 12 3.53141e+01 8.18430e-01 6.70646e+02 109.228 -1.45997e+01 4.18576e+01  0.00000e+00 0.00000e+00 6.43088e+02 109.228 2.75579e+01 289.228 0.9887 
1 1 1 6   36  4  f 0  1.11831e+01 5.39348e-01 3.69017e+02 147.491 -5.99636e+00 3.82138e+00  0.00000e+00 0.00000e+00 2.09686e+01 147.491 3.48048e+02 327.491 0.9267 
1 1 1 6   36  5  o 7  3.04346e+01 8.48695e-01 5.17822e+02 213.855 -2.79685e+01 -1.87621e+01 0.00000e+00 0.00000e+00 6.10241e+02 213.855 9.24191e+01 213.855 0.9850 
1 1 1 6   36  6  o 12 1.70394e+01 6.07799e-01 3.21877e+02 180.801 -1.43202e+01 -2.00282e-01 0.00000e+00 0.00000e+00 2.96419e+02 180.801 2.54582e+01 0.801   0.9644 
1 1 1 6   36  7  o 11 2.00083e+01 6.25588e-01 3.96842e+02 279.198 4.07838e+00  -2.51862e+01 0.00000e+00 0.00000e+00 3.40941e+02 279.198 5.59011e+01 99.198  0.9802 
1 1 1 6   36  8  f 0  2.25227e+01 6.97383e-01 3.31397e+02 135.109 -2.05068e+01 2.04289e+01  0.00000e+00 0.00000e+00 5.00929e+02 135.109 1.69532e+02 135.109 0.9826 
1 1 1 6   36  9  o 19 2.72548e+01 7.68638e-01 4.34662e+02 269.577 -4.34274e-01 -5.88356e+01 0.00000e+00 0.00000e+00 5.81372e+02 269.577 1.46710e+02 269.577 0.9915 
1 1 1 6   36  10 o 19 8.27674e+00 1.36462e+00 8.69527e+01 155.442 -3.75778e+00 1.71709e+00  0.00000e+00 0.00000e+00 1.83206e+02 155.442 9.62528e+01 155.442 0.8684 
1 1 1 6   36  11 o 4  5.85090e+00 1.50550e+00 9.82236e+01 269.411 -3.88745e-02 -3.77877e+00 0.00000e+00 0.00000e+00 8.96119e+01 269.411 8.61163e+00 89.411  0.8545 
1 1 1 6   36  12 o 18 7.00693e+00 1.75550e+00 4.57662e+01 156.060 -2.01460e+00 8.94424e-01  0.00000e+00 0.00000e+00 1.45966e+02 156.060 1.00200e+02 156.060 0.7286 
1 1 1 6   36  13 o 14 5.36702e+00 1.63545e+00 5.06855e+01 101.814 -4.50797e-01 2.15525e+00  0.00000e+00 0.00000e+00 9.60316e+01 101.814 4.53461e+01 101.814 0.7283 
1 1 1 6   36  14 o 4  4.06084e+00 1.32401e+00 1.04694e+02 142.156 -3.54696e+00 2.75571e+00  0.00000e+00 0.00000e+00 2.93756e+01 142.156 7.53179e+01 322.156 0.8801 
1 1 1 6   36  15 o 10 4.24255e+00 1.40223e+00 9.87548e+01 81.904  6.97505e-01  4.90335e+00  0.00000e+00 0.00000e+00 4.31620e+01 81.904  5.55929e+01 261.904 0.8923 
1 1 1 6   36  16 o 2  7.61209e+00 1.96176e+00 8.31607e+01 307.262 3.30239e+00  -4.34093e+00 0.00000e+00 0.00000e+00 1.74335e+02 307.262 9.11744e+01 307.262 0.9030 
1 1 1 6   37  0  o 14 2.35069e+01 7.44001e-01 4.83408e+02 75.649  3.69212e+00  1.44314e+01  0.00000e+00 0.00000e+00 3.70419e+02 75.649  1.12989e+02 255.649 0.9658 
1 1 1 6   37  1  f 0  9.15487e+00 5.48358e-01 1.23811e+02 281.893 3.17688e-01  -1.50844e+00 0.00000e+00 0.00000e+00 8.49537e+01 281.893 3.88577e+01 101.893 0.6062 
1 1 1 6   37  2  o 19 2.20211e+01 6.43336e-01 2.29012e+02 62.859  3.63390e+00  7.08884e+00  0.00000e+00 0.00000e+00 5.45552e+02 62.859  3.16540e+02 62.859  0.9349 
1 1 1 6   37  3  o 2  3.47478e+01 7.13694e-01 6.75659e+02 123.956 -2.29733e+01 3.41152e+01  0.00000e+00 0.00000e+00 6.15719e+02 123.956 5.99400e+01 303.956 0.9878 
1 1 1 6   37  4  o 7  2.68805e+01 7.23408e-01 3.61983e+02 313.898 1.40860e+01  -1.46384e+01 0.00000e+00 0.00000e+00 6.24194e+02 313.898 2.62211e+02 313.898 0.9751 
1 1 1 6   37  5  o 17 1.83342e+01 7.37707e-01 3.75076e+02 343.454 1.44977e+01  -4.30705e+00 0.00000e+00 0.00000e+00 2.91525e+02 343.454 8.35504e+01 163.454 0.9664 
1 1 1 6   37  6  o 14 2.68746e+01 6.46890e-01 4.75976e+02 293.376 1.38927e+01  -3.21406e+01 0.00000e+00 0.00000e+00 5.20523e+02 293.376 4.45466e+01 293.376 0.9856 
1 1 1 6   37  7  o 7  1.02715e+01 7.88125e-01 1.31138e+02 177.818 -4.11984e+00 1.56965e-01  0.00000e+00 0.00000e+00 2.04257e+02 177.818 7.31187e+01 177.818 0.8681 
1 1 1 6   37  8  o 18 2.41072e+01 8.45770e-01 4.51557e+02 225.694 -3.17731e+01 -3.25525e+01 0.00000e+00 0.00000e+00 4.45017e+02 225.694 6.54066e+00 45.694  0.9889 
1 1 1 6   37  9  o 9  1.58127e+01 7.95796e-01 3.06738e+02 334.176 2.15056e+01  -1.04073e+01 0.00000e+00 0.00000e+00 2.75184e+02 334.176 3.15545e+01 154.176 0.9788 
1 1 1 6   37  10 o 16 1.49537e+01 1.05729e+00 3.40714e+02 134.103 -2.27966e+01 2.35214e+01  0.00000e+00 0.00000e+00 2.12653e+02 134.103 1.28061e+02 314.103 0.9846 
1 1 1 6   37  11 o 11 8.43815e+00 1.45833e+00 2.57995e+02 329.577 1.26823e+01  -7.44734e+00 0.00000e+00 0.00000e+00 4.80392e+01 329.577 2.09956e+02 149.577 0.9654 
1 1 1 6   37  12 o 10 7.78517e+00 1.48284e+00 1.51839e+02 166.967 -9.23619e+00 2.13798e+00  0.00000e+00 0.00000e+00 1.24627e+02 166.967 2.72126e+01 346.967 0.9457 
1 1 1 6   37  13 o 13 1.06463e+01 1.91835e+00 1.77371e+02 33.918  1.15945e+01  7.79662e+00  0.00000e+00 0.00000e+00 2.07628e+02 33.918  3.02568e+01 33.918  0.9635 
1 1 1 6   37  14 o 4  4.88976e+00 1.46569e+00 9.88195e+01 11.614  5.07461e+00  1.04301e+00  0.00000e+00 0.00000e+00 6.57782e+01 11.614  3.30413e+01 191.614 0.8974 
1 1 1 6   37  15 o 19 1.11762e+01 1.78280e+00 2.09680e+02 230.905 -1.32878e+01 -1.63533e+01 0.00000e+00 0.00000e+00 1.99202e+02 230.905 1.04775e+01 50.905  0.9760 
1 1 1 6   37  16 o 12 5.07824e+00 1.59228e+00 7.87736e+01 320.120 3.47105e+00  -2.90017e+00 0.00000e+00 0.00000e+00 8.88178e+01 320.120 1.00443e+01 320.120 0.8810 
1 1 1 6   38  0  o 5  1.59396e+01 4.40858e-01 3.62610e+02 3.311   7.85523e+00  4.54423e-01  0.00000e+00 0.00000e+00 1.97283e+02 3.311   1.65327e+02 183.311 0.9341 
1 1 1 6   38  1  o 12 3.43539e+01 6.54974e-01 5.47570e+02 250.009 -1.01997e+01 -2.80381e+01 0.00000e+00 0.00000e+00 7.22693e+02 250.009 1.75123e+02 250.009 0.9831 
1 1 1 6   38  2  o 14 3.17631e+01 7.97881e-01 4.40309e+02 355.323 2.13229e+01  -1.74456e+00 0.00000e+00 0.00000e+00 7.26264e+02 355.323 2.85955e+02 355.323 0.9763 
1 1 1 6   38  3  o 16 1.19290e+01 4.96861e-01 2.30693e+02 344.904 4.66599e+00  -1.25865e+00 0.00000e+00 0.00000e+00 1.68429e+02 344.904 6.22639e+01 164.904 0.8894 
1 1 1 6   38  4  f 0  1.09819e+01 6.75472e-01 2.21140e+02 67.148  1.96422e+00  4.66083e+00  0.00000e+00 0.00000e+00 1.48515e+02 67.148  7.26248e+01 247.148 0.8947 
1 1 1 6   38  5  o 2  3.82086e+01 9.29617e-01 7.45670e+02 249.401 -2.39312e+01 -6.36727e+01 0.00000e+00 0.00000e+00 6.81150e+02 249.401 6.45201e+01 69.401  0.9926 
1 1 1 6   38  6  o 12 1.74870e+01 6.05905e-01 4.91206e+02 187.068 -2.39216e+01 -2.96602e+00 0.00000e+00 0.00000e+00 1.52808e+02 187.068 3.38398e+02 7.068   0.9790 
1 1 1 6   38  7  o 5  1.78438e+01 6.57824e-01 3.73300e+02 119.556 -1.04755e+01 1.84730e+01  0.00000e+00 0.00000e+00 2.81825e+02 119.556 9.14747e+01 299.556 0.9762 
1 1 1 6   38  8  o 13 2.36759e+01 7.11963e-01 4.75901e+02 35.496  3.87802e+01  2.76574e+01  0.00000e+00 0.00000e+00 4.04984e+02 35.496  7.09161e+01 215.496 0.9894 
1 1 1 6   38  9  o 15 7.63125e+00 1.11492e+00 1.53745e+02 92.899  -2.95220e-01 5.83048e+00  0.00000e+00 0.00000e+00 1.07245e+02 92.899  4.64999e+01 272.899 0.9098 
1 1 1 6   38  10 o 16 2.13134e+01 9.36824e-01 2.49879e+02 246.315 -1.48859e+01 -3.39354e+01 0.00000e+00 0.00000e+00 5.40190e+02 246.315 2.90311e+02 246.315 0.9864 
1 1 1 6   38  11 o 7  1.13749e+01 1.19521e+00 1.76456e+02 89.262  1.99868e-01  1.55265e+01  0.00000e+00 0.00000e+00 2.36841e+02 89.262  6.03860e+01 89.262  0.9672 
1 1 1 6   38  12 o 16 5.64752e+00 1.59207e+00 1.77307e+02 199.141 -7.03935e+00 -2.44326e+00 0.00000e+00 0.00000e+00 1.99529e+01 199.141 1.57354e+02 19.141  0.9303 
1 1 1 6   38  13 o 8  8.29609e+00 1.92919e+00 1.80428e+02 90.112  -2.10012e-02 1.07488e+01  0.00000e+00 0.00000e+00 1.16050e+02 90.112  6.43783e+01 270.112 0.9523 
1 1 1 6   38  14 o 17 7.34656e+00 1.64788e+00 1.76304e+02 298.603 5.87571e+00  -1.07753e+01 0.00000e+00 0.00000e+00 8.77596e+01 298.603 8.85448e+01 118.603 0.9584 
1 1 1 6   38  15 o 15 5.68805e+00 1.65944e+00 6.53280e+01 50.635  2.39486e+00  2.91916e+00  0.00000e+00 0.00000e+00 1.16810e+02 50.635  5.14819e+01 50.635  0.8543 
1 1 1 6   38  16 o 7  3.96432e+00 1.36402e+00 7.91027e+01 125.329 -2.24188e+00 3.16298e+00  0.00000e+00 0.00000e+00 4.83889e+01 125.329 3.07139e+01 305.329 0.8586 
1 1 1 6   39  0  o 18 2.80359e+01 6.34059e-01 4.98254e+02 345.993 2.14653e+01  -5.35479e+00 0.00000e+00 0.00000e+00 5.31781e+02 345.993 3.35280e+01 345.993 0.9771 
1 1 1 6   39  1  o 14 2.58015e+01 6.91876e-01 2.50561e+02 289.436 3.31755e+00  -9.40202e+00 0.00000e+00 0.00000e+00 6.69743e+02 289.436 4.19182e+02 289.436 0.9484 
1 1 1 6   39  2  o 3  1.78714e+01 5.56487e-01 3.00663e+02 45.094  7.16342e+00  7.18699e+00  0.00000e+00 0.00000e+00 3.37504e+02 45.094  3.68411e+01 45.094  0.9494 
1 1 1 6   39  3  o 18 2.02303e+01 5.49187e-01 3.11707e+02 352.618 1.06704e+01  -1.38245e+00 0.00000e+00 0.00000e+00 4.13012e+02 352.618 1.01305e+02 352.618 0.9523 
1 1 1 6   39  4  o 17 2.45119e+01 5.76287e-01 3.72491e+02 260.873 -3.02138e+00 -1.88071e+01 0.00000e+00 0.00000e+00 5.25050e+02 260.873 1.52559e+02 260.873 0.9734 
1 1 1 6   39  5  o 16 2.92647e+01 8.41435e-01 6.60837e+02 184.561 -4.56171e+01 -3.63938e+00 0.00000e+00 0.00000e+00 4.27903e+02 184.561 2.32934e+02 4.561   0.9890 
1 1 1 6   39  6  o 18 3.18485e+01 6.98655e-01 6.08979e+02 96.803  -6.38236e+00 5.35013e+01  0.00000e+00 0.00000e+00 5.77765e+02 96.803  3.12139e+01 276.803 0.9907 
1 1 1 6   39  7  o 13 8.43817e+00 8.82944e-01 2.33429e+02 155.474 -5.76320e+00 2.62955e+00  0.00000e+00 0.00000e+00 5.76512e+01 155.474 1.75778e+02 335.474 0.9173 
1 1 1 6   39  8  o 2  1.36105e+01 7.99614e-01 1.93737e+02 263.428 -1.29835e+00 -1.12701e+01 0.00000e+00 0.00000e+00 2.94901e+02 263.428 1.01163e+02 263.428 0.9549 
1 1 1 6   39  9  o 4  1.12840e+01 9.48287e-01 1.92300e+02 302.363 6.52975e+00  -1.03039e+01 0.00000e+00 0.00000e+00 2.14072e+02 302.363 2.17721e+01 302.363 0.9581 
1 1 1 6   39  10 o 7  1.03656e+01 1.27111e+00 3.08662e+02 121.436 -1.06308e+01 1.73914e+01  0.00000e+00 0.00000e+00 7.11546e+01 121.436 2.37507e+02 301.436 0.9752 
1 1 1 6   39  11 o 10 1.18727e+01 1.12979e+00 2.50676e+02 293.614 9.41593e+00  -2.15378e+01 0.00000e+00 0.00000e+00 1.85679e+02 293.614 6.49975e+01 113.614 0.9785 
1 1 1 6   39  12 o 18 5.92146e+00 1.59839e+00 9.38858e+01 103.456 -9.97119e-01 4.16736e+00  0.00000e+00 0.00000e+00 1.00337e+02 103.456 6.45149e+00 103.456 0.8737 
1 1 1 6   39  13 o 7  8.13898e+00 1.53416e+00 1.14015e+02 323.561 6.56316e+00  -4.84569e+00 0.00000e+00 0.00000e+00 1.72011e+02 323.561 5.79962e+01 323.561 0.9365 
1 1 1 6   39  14 o 3  8.51323e+00 1.65732e+00 1.71770e+02 184.269 -1.37920e+01 -1.02954e+00 0.00000e+00 0.00000e+00 1.35725e+02 184.269 3.60456e+01 4.269   0.9631 
1 1 1 6   39  15 o 9  7.83596e+00 1.82923e+00 1.60631e+02 107.288 -3.40807e+00 1.09501e+01  0.00000e+00 0.00000e+00 1.19932e+02 107.288 4.06996e+01 287.288 0.9554 
1 1 1 6   39  16 o 4  5.35771e+00 1.67354e+00 1.38907e+02 204.245 -7.12839e+00 -3.21042e+00 0.00000e+00 0.00000e+00 4.84360e+01 204.245 9.04709e+01 24.245  0.9337 
1 1 1 6   40  0  o 14 2.92502e+01 7.41738e-01 5.74295e+02 226.097 -1.78894e+01 -1.85881e+01 0.00000e+00 0.00000e+00 5.03857e+02 226.097 7.04376e+01 46.097  0.9804 
1 1 1 6   40  1  o 15 3.58270e+01 6.77144e-01 5.08061e+02 44.436  2.45005e+01  2.40229e+01  0.00000e+00 0.00000e+00 8.19382e+02 44.436  3.11320e+02 44.436  0.9853 
1 1 1 6   40  2  o 9  1.54757e+01 4.75517e-01 3.77542e+02 135.507 -7.33923e+00 7.21046e+00  0.00000e+00 0.00000e+00 1.75434e+02 135.507 2.02108e+02 315.507 0.9501 
1 1 1 6   40  3  o 15 1.39991e+01 7.53272e-01 1.84208e+02 186.810 -4.36160e+00 -5.20867e-01 0.00000e+00 0.00000e+00 2.77613e+02 186.810 9.34050e+01 186.810 0.8771 
1 1 1 6   40  4  o 17 2.64663e+01 5.95560e-01 6.17995e+02 70.268  1.19782e+01  3.33949e+01  0.00000e+00 0.00000e+00 3.63366e+02 70.268  2.54629e+02 250.268 0.9858 
1 1 1 6   40  5  o 12 4.28226e+00 9.67720e-01 1.94566e+02 58.643  1.12685e+00  1.84918e+00  0.00000e+00 0.00000e+00 7.80892e+01 238.643 2.72655e+02 238.643 0.7232 
1 1 1 6   40  6  o 1  1.97157e+01 6.12901e-01 5.42530e+02 70.839  1.05659e+01  3.04085e+01  0.00000e+00 0.00000e+00 1.87344e+02 70.839  3.55185e+02 250.839 0.9843 
1 1 1 6   40  7  o 1  2.13924e+01 7.08462e-01 3.38718e+02 269.719 -1.25164e-01 -2.55641e+01 0.00000e+00 0.00000e+00 4.49807e+02 269.719 1.11089e+02 269.719 0.9802 
1 1 1 6   40  8  o 6  1.65674e+01 7.08218e-01 3.92321e+02 170.409 -2.77843e+01 4.69492e+00  0.00000e+00 0.00000e+00 2.19374e+02 170.409 1.72947e+02 350.409 0.9821 
1 1 1 6   40  9  f 0  1.23953e+01 1.03638e+00 3.30432e+02 241.203 -1.04732e+01 -1.90533e+01 0.00000e+00 0.00000e+00 1.24594e+02 241.203 2.05838e+02 61.203  0.9767 
1 1 1 6   40  10 o 9  9.09033e+00 1.34910e+00 2.02004e+02 261.175 -1.72281e+00 -1.10963e+01 0.00000e+00 0.00000e+00 1.23953e+02 261.175 7.80516e+01 81.175  0.9544 
1 1 1 6   40  11 f 0  8.60243e+00 1.62730e+00 2.34539e+02 115.617 -5.71986e+00 1.19292e+01  0.00000e+00 0.00000e+00 7.60782e+01 115.617 1.58461e+02 295.617 0.9614 
1 1 1 6   40  12 o 13 5.79236e+00 1.63876e+00 5.79041e+01 262.085 -3.34159e-01 -2.40349e+00 0.00000e+00 0.00000e+00 1.06649e+02 262.085 4.87452e+01 262.085 0.7568 
1 1 1 6   40  13 o 15 1.00540e+01 1.37412e+00 1.52523e+02 80.005  2.66272e+00  1.51082e+01  0.00000e+00 0.00000e+00 2.12192e+02 80.005  5.96683e+01 80.005  0.9668 
1 1 1 6   40  14 o 9  4.15364e+00 1.30470e+00 3.92006e+01 268.339 -5.44430e-02 -1.87743e+00 0.00000e+00 0.00000e+00 6.62014e+01 268.339 2.70009e+01 268.339 0.6767 
1 1 1 6   40  15 o 7  4.69248e+00 1.46952e+00 6.33488e+01 2.044   3.44481e+00  1.22956e-01  0.00000e+00 0.00000e+00 8.40596e+01 2.044   2.07109e+01 2.044   0.8383 
1 1 1 6   40  16 o 14 6.70983e+00 1.87523e+00 4.94360e+01 174.875 -3.07107e+00 2.75414e-01  0.00000e+00 0.00000e+00 1.55588e+02 174.875 1.06152e+02 174.875 0.8160 
1 1 1 6   41  0  o 15 4.13008e+01 9.69199e-01 8.43957e+02 114.365 -2.65925e+01 5.87170e+01  0.00000e+00 0.00000e+00 6.96508e+02 114.365 1.47449e+02 294.365 0.9922 
1 1 1 6   41  1  o 7  4.20591e+01 7.69383e-01 6.86700e+02 106.501 -1.43168e+01 4.83284e+01  0.00000e+00 0.00000e+00 8.78929e+02 106.501 1.92229e+02 106.501 0.9900 
1 1 1 6   41  2  o 11 1.73328e+01 4.84117e-01 3.04346e+02 330.804 7.88830e+00  -4.40789e+00 0.00000e+00 0.00000e+00 3.10254e+02 330.804 5.90802e+00 330.804 0.9429 
1 1 1 6   41  3  o 11 3.91905e+01 7.44732e-01 7.59037e+02 324.741 5.04144e+01  -3.56408e+01 0.00000e+00 0.00000e+00 7.02869e+02 324.741 5.61680e+01 144.741 0.9919 
1 1 1 6   41  4  o 6  3.03191e+01 7.25484e-01 5.65971e+02 291.091 1.35853e+01  -3.52241e+01 0.00000e+00 0.00000e+00 5.59109e+02 291.091 6.86229e+00 111.091 0.9867 
1 1 1 6   41  5  o 2  5.36216e+00 8.85039e-01 3.65417e+01 337.402 4.62629e-01  -1.92558e-01 0.00000e+00 0.00000e+00 1.24624e+01 337.402 2.40793e+01 157.402 0.2430 
1 1 1 6   41  6  o 6  5.55676e+00 1.00723e+00 2.22585e+02 56.420  1.89232e+00  2.85036e+00  0.00000e+00 0.00000e+00 4.77090e+01 236.420 2.70294e+02 236.420 0.8369 
1 1 1 6   41  7  o 7  1.42428e+01 6.93198e-01 3.83378e+02 198.887 -1.77221e+01 -6.06328e+00 0.00000e+00 0.00000e+00 1.37637e+02 198.887 2.45740e+02 18.887  0.9729 
1 1 1 6   41  8  o 12 1.24221e+01 7.76084e-01 3.32399e+02 359.509 1.85314e+01  -1.58723e-01 0.00000e+00 0.00000e+00 1.21776e+02 359.509 2.10623e+02 179.509 0.9726 
1 1 1 6   41  9  o 12 9.31981e+00 1.18757e+00 1.43289e+02 144.062 -5.58790e+00 4.05054e+00  0.00000e+00 0.00000e+00 1.80479e+02 144.062 3.71892e+01 144.062 0.9244 
1 1 1 6   41  10 o 18 1.11949e+01 1.24187e+00 2.01550e+02 190.037 -1.46901e+01 -2.60009e+00 0.00000e+00 0.00000e+00 2.04664e+02 190.037 3.11402e+00 190.037 0.9659 
1 1 1 6   41  11 o 9  1.08024e+01 1.51996e+00 2.25224e+02 131.503 -1.14865e+01 1.29817e+01  0.00000e+00 0.00000e+00 1.68551e+02 131.503 5.66729e+01 311.503 0.9707 
1 1 1 6   41  12 o 12 5.52721e+00 1.58969e+00 7.36515e+01 87.684  1.28745e-01  3.18273e+00  0.00000e+00 0.00000e+00 9.70515e+01 87.684  2.34000e+01 87.684  0.8228 
1 1 1 6   41  13 o 7  5.46084e+00 1.41886e+00 7.16811e+01 81.991  5.35229e-01  3.80417e+00  0.00000e+00 0.00000e+00 1.03919e+02 81.991  3.22382e+01 81.991  0.8571 
1 1 1 6   41  14 o 11 5.65245e+00 1.37095e+00 8.89212e+01 239.802 -2.81893e+00 -4.84371e+00 0.00000e+00 0.00000e+00 1.03033e+02 239.802 1.41118e+01 239.802 0.9057 
1 1 1 6   41  15 o 12 4.16138e+00 1.37683e+00 5.19916e+01 109.903 -8.69569e-01 2.40178e+00  0.00000e+00 0.00000e+00 6.81926e+01 109.903 1.62009e+01 109.903 0.7708 
1 1 1 6   41  16 o 17 7.66080e+00 1.96494e+00 1.26495e+02 104.299 -2.11428e+00 8.29507e+00  0.00000e+00 0.00000e+00 1.43035e+02 104.299 1.65398e+01 104.299 0.9396 
1 1 1 6   42  0  o 13 6.15150e+01 1.12705e+00 1.16742e+03 283.968 2.95249e+01  -1.18702e+02 0.00000e+00 0.00000e+00 1.13528e+03 283.968 3.21379e+01 103.968 0.9959 
1 1 1 6   42  1  o 5  1.70263e+01 4.73115e-01 2.53503e+02 176.952 -7.40795e+00 3.94439e-01  0.00000e+00 0.00000e+00 3.41749e+02 176.952 8.82467e+01 176.952 0.9299 
1 1 1 6   42  2  o 7  7.04285e+00 5.75690e-01 2.14090e+02 316.547 1.87958e+00  -1.78073e+00 0.00000e+00 0.00000e+00 9.02708e+00 136.547 2.23117e+02 136.547 0.7744 
1 1 1 6   42  3  o 7  2.71095e+01 5.94666e-01 3.33649e+02 297.757 8.78051e+00  -1.66842e+01 0.00000e+00 0.00000e+00 6.58364e+02 297.757 3.24715e+02 297.757 0.9731 
1 1 1 6   42  4  o 4  2.46772e+01 5.86178e-01 3.44611e+02 150.574 -1.80912e+01 1.02049e+01  0.00000e+00 0.00000e+00 5.60758e+02 150.574 2.16147e+02 150.574 0.9756 
1 1 1 6   42  5  o 3  3.16785e+01 8.94475e-01 5.72128e+02 255.659 -1.20369e+01 -4.70827e+01 0.00000e+00 0.00000e+00 6.06785e+02 255.659 3.46569e+01 255.659 0.9897 
1 1 1 6   42  6  o 5  2.71293e+01 6.63162e-01 4.98287e+02 62.487  1.99672e+01  3.83349e+01  0.00000e+00 0.00000e+00 5.09915e+02 62.487  1.16280e+01 62.487  0.9884 
1 1 1 6   42  7  o 12 1.39053e+01 7.25294e-01 2.89909e+02 262.011 -2.16926e+00 -1.54559e+01 0.00000e+00 0.00000e+00 2.15821e+02 262.011 7.40880e+01 82.011  0.9674 
1 1 1 6   42  8  o 17 2.44162e+01 7.15396e-01 4.15702e+02 134.503 -3.39227e+01 3.45158e+01  0.00000e+00 0.00000e+00 4.92483e+02 134.503 7.67812e+01 134.503 0.9896 
1 1 1 6   42  9  o 1  5.36926e+00 1.30352e+00 2.33520e+02 289.608 2.23338e+00  -6.26911e+00 0.00000e+00 0.00000e+00 4.76094e+01 109.609 2.81129e+02 109.609 0.9215 
1 1 1 6   42  10 o 19 6.95946e+00 1.47287e+00 5.92195e+01 308.201 1.66346e+00  -2.11377e+00 0.00000e+00 0.00000e+00 1.45775e+02 308.201 8.65553e+01 308.201 0.7842 
1 1 1 6   42  11 o 5  5.72299e+00 1.56395e+00 1.14354e+02 98.123  -6.52298e-01 4.57024e+00  0.00000e+00 0.00000e+00 7.55334e+01 98.123  3.88209e+01 278.123 0.8837 
1 1 1 6   42  12 o 5  5.77703e+00 1.52443e+00 5.78093e+01 276.388 3.10044e-01  -2.76922e+00 0.00000e+00 0.00000e+00 1.14100e+02 276.388 5.62902e+01 276.388 0.7929 
1 1 1 6   42  13 o 12 1.07002e+01 1.33766e+00 1.69920e+02 314.570 1.34231e+01  -1.36262e+01 0.00000e+00 0.00000e+00 2.20821e+02 314.570 5.09008e+01 314.570 0.9735 
1 1 1 6   42  14 o 14 3.66761e+00 1.23251e+00 1.15414e+02 153.889 -4.58393e+00 2.24676e+00  0.00000e+00 0.00000e+00 7.75023e+00 153.889 1.07664e+02 333.889 0.8958 
1 1 1 6   42  15 o 15 6.71050e+00 1.78151e+00 6.52104e+01 305.204 2.43162e+00  -3.44649e+00 0.00000e+00 0.00000e+00 1.53871e+02 305.204 8.86608e+01 305.204 0.8714 
1 1 1 6   42  16 o 11 5.66960e+00 1.87562e+00 1.93424e+02 61.130  4.99523e+00  9.06021e+00  0.00000e+00 0.00000e+00 8.30517e+00 61.130  1.85118e+02 241.130 0.9504 
1 1 1 6   43  0  o 10 2.76858e+01 1.01599e+00 5.91072e+02 82.153  3.73254e+00  2.70847e+01  0.00000e+00 0.00000e+00 4.30230e+02 82.153  1.60842e+02 262.153 0.9815 
1 1 1 6   43  1  o 16 3.54207e+01 9.79476e-01 5.77533e+02 261.220 -5.26171e+00 -3.40654e+01 0.00000e+00 0.00000e+00 7.34497e+02 261.220 1.56965e+02 261.220 0.9854 
1 1 1 6   43  2  o 4  2.44170e+01 5.52098e-01 5.07209e+02 219.831 -1.99499e+01 -1.66399e+01 0.00000e+00 0.00000e+00 3.92936e+02 219.831 1.14273e+02 39.831  0.9806 
1 1 1 6   43  3  o 1  1.53798e+01 6.58214e-01 2.22219e+02 6.821   7.33457e+00  8.77290e-01  0.00000e+00 0.00000e+00 3.15356e+02 6.821   9.31367e+01 6.821   0.9296 
1 1 1 6   43  4  o 3  2.76214e+01 6.16537e-01 3.69593e+02 181.461 -2.44795e+01 -6.24516e-01 0.00000e+00 0.00000e+00 6.47560e+02 181.461 2.77967e+02 181.461 0.9794 
1 1 1 6   43  5  o 11 1.12345e+01 6.64269e-01 2.49376e+02 288.479 2.47769e+00  -7.41381e+00 0.00000e+00 0.00000e+00 1.45009e+02 288.479 1.04367e+02 108.480 0.9337 
1 1 1 6   43  6  o 15 1.37972e+01 6.67716e-01 2.13040e+02 356.075 9.04422e+00  -6.20584e-01 0.00000e+00 0.00000e+00 2.76173e+02 356.075 6.31335e+01 356.075 0.9431 
1 1 1 6   43  7  o 6  1.86558e+01 6.95291e-01 4.08419e+02 277.747 4.37491e+00  -3.21588e+01 0.00000e+00 0.00000e+00 2.81965e+02 277.747 1.26454e+02 97.747  0.9845 
1 1 1 6   43  8  o 13 1.58945e+01 7.58115e-01 2.61363e+02 109.936 -6.55009e+00 1.80592e+01  0.00000e+00 0.00000e+00 3.20222e+02 109.936 5.88593e+01 109.936 0.9736 
1 1 1 6   43  9  o 13 7.04114e+00 1.34402e+00 1.43649e+02 250.450 -1.80644e+00 -5.08718e+00 0.00000e+00 0.00000e+00 9.49375e+01 250.450 4.87114e+01 70.450  0.9019 
1 1 1 6   43  10 o 3  1.49642e+01 9.03287e-01 2.27759e+02 103.348 -5.82787e+00 2.45623e+01  0.00000e+00 0.00000e+00 3.23033e+02 103.348 9.52737e+01 103.348 0.9800 
1 1 1 6   43  11 o 10 6.24565e+00 1.51120e+00 1.38440e+02 325.143 5.11671e+00  -3.56373e+00 0.00000e+00 0.00000e+00 7.63177e+01 325.143 6.21228e+01 145.143 0.9159 
1 1 1 6   43  12 o 6  4.20574e+00 1.27041e+00 9.06312e+01 173.936 -3.71110e+00 3.94213e-01  0.00000e+00 0.00000e+00 4.38945e+01 173.936 4.67367e+01 353.936 0.8524 
1 1 1 6   43  13 o 1  3.63264e+00 1.16546e+00 7.47743e+01 46.866  2.04414e+00  2.18181e+00  0.00000e+00 0.00000e+00 3.54822e+01 46.866  3.92921e+01 226.866 0.8092 
1 1 1 6   43  14 o 1  6.20017e+00 1.65169e+00 6.66636e+01 295.119 1.70447e+00  -3.63548e+00 0.00000e+00 0.00000e+00 1.34166e+02 295.119 6.75027e+01 295.119 0.8641 
1 1 1 6   43  15 o 6  5.35019e+00 1.57658e+00 9.88662e+01 133.738 -4.13948e+00 4.32590e+00  0.00000e+00 0.00000e+00 8.39525e+01 133.738 1.49138e+01 313.738 0.9122 
1 1 1 6   43  16 o 17 5.21940e+00 1.60061e+00 1.16924e+02 36.677  5.60890e+00  4.17728e+00  0.00000e+00 0.00000e+00 6.38975e+01 36.677  5.30267e+01 216.677 0.9255 
1 1 1 6   44  0  o 17 1.45209e+01 4.66236e-01 2.67293e+02 268.590 -1.64548e-01 -6.68558e+00 0.00000e+00 0.00000e+00 2.35742e+02 268.590 3.15507e+01 88.590  0.9219 
1 1 1 6   44  1  o 15 2.29139e+01 5.30959e-01 3.40758e+02 221.905 -1.22263e+01 -1.09719e+01 0.00000e+00 0.00000e+00 4.93849e+02 221.905 1.53091e+02 221.905 0.9691 
1 1 1 6   44  2  o 18 2.75656e+01 5.91324e-01 3.43344e+02 59.940  9.88780e+00  1.70850e+01  0.00000e+00 0.00000e+00 6.66303e+02 59.940  3.22959e+02 59.940  0.9743 
1 1 1 6   44  3  o 14 2.63360e+01 6.81865e-01 5.03481e+02 135.638 -2.08951e+01 2.04347e+01  0.00000e+00 0.00000e+00 4.69539e+02 135.638 3.39413e+01 315.638 0.9827 
1 1 1 6   44  4  o 7  9.37109e+00 6.41101e-01 1.81588e+02 85.179  3.80905e-01  4.51628e+00  0.00000e+00 0.00000e+00 1.28900e+02 85.179  5.26880e+01 265.179 0.8813 
1 1 1 6   44  5  o 18 4.02483e+01 9.56217e-01 6.85274e+02 264.769 -7.35773e+00 -8.03724e+01 0.00000e+00 0.00000e+00 8.18458e+02 264.769 1.33184e+02 264.769 0.9938 
1 1 1 6   44  6  o 7  3.33516e+01 7.24298e-01 4.81693e+02 68.089  1.89396e+01  4.70881e+01  0.00000e+00 0.00000e+00 7.59630e+02 68.089  2.77938e+02 68.089  0.9901 
1 1 1 6   44  7  o 10 3.62427e+01 7.78301e-01 6.13334e+02 173.540 -9.26572e+01 1.04920e+01  0.00000e+00 0.00000e+00 7.41548e+02 173.540 1.28214e+02 173.540 0.9946 
1 1 1 6   44  8  o 8  1.42022e+01 9.23805e-01 1.76797e+02 18.664  1.14779e+01  3.87702e+00  0.00000e+00 0.00000e+00 3.34361e+02 18.664  1.57564e+02 18.664  0.9578 
1 1 1 6   44  9  o 19 2.27647e+01 8.89357e-01 3.51267e+02 73.615  1.46290e+01  4.97521e+01  0.00000e+00 0.00000e+00 4.95651e+02 73.615  1.44385e+02 73.615  0.9903 
1 1 1 6   44  10 o 13 4.77207e+00 1.39928e+00 1.09435e+02 99.401  -5.84023e-01 3.52722e+00  0.00000e+00 0.00000e+00 4.19883e+01 99.401  6.74467e+01 279.401 0.8449 
1 1 1 6   44  11 o 19 7.82657e+00 1.57193e+00 1.76962e+02 161.006 -9.90719e+00 3.41013e+00  0.00000e+00 0.00000e+00 1.02450e+02 161.006 7.45119e+01 341.006 0.9510 
1 1 1 6   44  12 o 8  4.99324e+00 1.36967e+00 7.50693e+01 241.866 -1.70540e+00 -3.18939e+00 0.00000e+00 0.00000e+00 8.36172e+01 241.866 8.54792e+00 241.866 0.8470 
1 1 1 6   44  13 o 7  5.06463e+00 1.42334e+00 9.24722e+01 251.840 -1.44762e+00 -4.41346e+00 0.00000e+00 0.00000e+00 7.55145e+01 251.840 1.69577e+01 71.840  0.8844 
1 1 1 6   44  14 o 3  5.44957e+00 1.56443e+00 9.01249e+01 318.691 3.60700e+00  -3.16983e+00 0.00000e+00 0.00000e+00 9.13699e+01 318.691 1.24503e+00 318.691 0.8886 
1 1 1 6   44  15 o 2  5.32026e+00 1.59478e+00 8.01188e+01 340.149 4.31709e+00  -1.55860e+00 0.00000e+00 0.00000e+00 9.58265e+01 340.149 1.57077e+01 340.149 0.8829 
1 1 1 6   44  16 o 19 6.86917e+00 1.89886e+00 1.02156e+02 296.997 3.05013e+00  -5.98710e+00 0.00000e+00 0.00000e+00 1.34968e+02 296.997 3.28121e+01 296.997 0.9223 
1 1 1 6   45  0  o 6  1.94603e+01 5.50305e-01 3.06995e+02 349.643 1.23244e+01  -2.25240e+00 0.00000e+00 0.00000e+00 3.94382e+02 349.643 8.73865e+01 349.643 0.9592 
1 1 1 6   45  1  o 7  2.09351e+01 5.12996e-01 3.85704e+02 94.365  -1.28844e+00 1.68783e+01  0.00000e+00 0.00000e+00 3.77465e+02 94.365  8.23993e+00 274.365 0.9700 
1 1 1 6   45  2  o 13 2.03896e+01 6.15208e-01 3.84264e+02 28.507  1.49175e+01  8.10180e+00  0.00000e+00 0.00000e+00 3.59199e+02 28.507  2.50645e+01 208.507 0.9701 
1 1 1 6   45  3  o 11 2.01858e+01 7.94439e-01 2.82368e+02 311.968 9.17817e+00  -1.02050e+01 0.00000e+00 0.00000e+00 4.48242e+02 311.968 1.65874e+02 311.968 0.9629 
1 1 1 6   45  4  o 11 2.83711e+01 6.32459e-01 5.46891e+02 141.597 -3.16333e+01 2.50749e+01  0.00000e+00 0.00000e+00 5.06331e+02 141.597 4.05596e+01 321.597 0.9875 
1 1 1 6   45  5  o 11 2.76609e+01 6.43434e-01 5.12933e+02 297.436 1.86940e+01  -3.60086e+01 0.00000e+00 0.00000e+00 5.13959e+02 297.436 1.02630e+00 297.436 0.9876 
1 1 1 6   45  6  o 6  2.60266e+01 6.67030e-01 5.13463e+02 135.873 -3.13673e+01 3.04257e+01  0.00000e+00 0.00000e+00 4.53537e+02 135.873 5.99261e+01 315.873 0.9885 
1 1 1 6   45  7  o 9  7.79342e+00 9.73522e-01 1.61868e+02 72.451  1.59592e+00  5.04649e+00  0.00000e+00 0.00000e+00 1.01658e+02 72.451  6.02094e+01 252.451 0.8998 
1 1 1 6   45  8  o 12 1.97429e+01 8.46773e-01 3.14810e+02 29.480  3.10876e+01  1.75742e+01  0.00000e+00 0.00000e+00 4.16529e+02 29.480  1.01719e+02 29.480  0.9859 
1 1 1 6   45  9  o 6  5.31665e+00 1.35787e+00 1.07974e+02 173.290 -3.36594e+00 3.95981e-01  0.00000e+00 0.00000e+00 5.88002e+01 173.290 4.91740e+01 353.290 0.8351 
1 1 1 6   45  10 o 12 6.43854e+00 1.53299e+00 1.34147e+02 73.983  1.56693e+00  5.45852e+00  0.00000e+00 0.00000e+00 8.51495e+01 73.983  4.89979e+01 253.983 0.9071 
1 1 1 6   45  11 o 17 6.61463e+00 1.60461e+00 1.82428e+02 307.309 5.38176e+00  -7.06233e+00 0.00000e+00 0.00000e+00 5.14211e+01 307.309 1.31007e+02 127.309 0.9419 
1 1 1 6   45  12 o 6  5.31485e+00 1.36668e+00 1.20383e+02 272.659 2.86194e-01  -6.16173e+00 0.00000e+00 0.00000e+00 6.20478e+01 272.659 5.83348e+01 92.659  0.9149 
1 1 1 6   45  13 o 6  8.29053e+00 1.54829e+00 1.80231e+02 340.574 1.35759e+01  -4.78781e+00 0.00000e+00 0.00000e+00 1.19646e+02 340.574 6.05854e+01 160.574 0.9646 
1 1 1 6   45  14 o 8  6.79277e+00 1.64580e+00 1.43223e+02 113.182 -3.84324e+00 8.97466e+00  0.00000e+00 0.00000e+00 9.79309e+01 113.182 4.52920e+01 293.182 0.9473 
1 1 1 6   45  15 o 9  6.61263e+00 1.73900e+00 4.69652e+01 216.247 -2.48847e+00 -1.82441e+00 0.00000e+00 0.00000e+00 1.55151e+02 216.247 1.08186e+02 216.247 0.8161 
1 1 1 6   45  16 o 10 6.41853e+00 1.83982e+00 1.25082e+02 139.074 -6.02206e+00 5.22118e+00  0.00000e+00 0.00000e+00 9.95172e+01 139.074 2.55643e+01 319.074 0.9350 
1 1 1 6   46  0  o 1  2.41992e+01 5.07344e-01 3.17264e+02 118.774 -7.73114e+00 1.40780e+01  0.00000e+00 0.00000e+00 5.63101e+02 118.774 2.45837e+02 118.774 0.9684 
1 1 1 6   46  1  f 0  3.60214e+01 6.46259e-01 7.56444e+02 330.608 5.14371e+01  -2.89740e+01 0.00000e+00 0.00000e+00 5.85616e+02 330.608 1.70828e+02 150.608 0.9915 
1 1 1 6   46  2  o 11 4.73224e+01 8.61471e-01 8.18191e+02 167.615 -8.24048e+01 1.80957e+01  0.00000e+00 0.00000e+00 9.49735e+02 167.615 1.31545e+02 167.615 0.9941 
1 1 1 6   46  3  o 16 1.82319e+01 5.35925e-01 2.70708e+02 63.449  5.30797e+00  1.06223e+01  0.00000e+00 0.00000e+00 3.85035e+02 63.449  1.14327e+02 63.449  0.9569 
1 1 1 6   46  4  o 1  3.28287e+01 7.72567e-01 5.97741e+02 85.494  4.16784e+00  5.28894e+01  0.00000e+00 0.00000e+00 6.24505e+02 85.494  2.67641e+01 85.494  0.9905 
1 1 1 6   46  5  o 2  1.33691e+01 7.31154e-01 1.83765e+02 261.149 -1.20288e+00 -7.72479e+00 0.00000e+00 0.00000e+00 2.85389e+02 261.149 1.01624e+02 261.149 0.9337 
1 1 1 6   46  6  o 18 3.05131e+01 7.05919e-01 4.68934e+02 29.234  4.38501e+01  2.45416e+01  0.00000e+00 0.00000e+00 6.66348e+02 29.234  1.97414e+02 29.234  0.9900 
1 1 1 6   46  7  o 11 3.03503e+01 8.27191e-01 5.75515e+02 21.574  7.26362e+01  2.87205e+01  0.00000e+00 0.00000e+00 5.57614e+02 21.574  1.79016e+01 201.574 0.9936 
1 1 1 6   46  8  o 12 2.05388e+01 8.33113e-01 3.60531e+02 323.462 3.28986e+01  -2.43776e+01 0.00000e+00 0.00000e+00 4.01596e+02 323.462 4.10653e+01 323.462 0.9877 
1 1 1 6   46  9  o 13 1.14111e+01 1.10605e+00 1.93673e+02 344.998 1.41815e+01  -3.80056e+00 0.00000e+00 0.00000e+00 2.20041e+02 344.998 2.63676e+01 344.998 0.9653 
1 1 1 6   46  10 f 0  9.59352e+00 1.44265e+00 1.65147e+02 272.555 4.99247e-01  -1.11890e+01 0.00000e+00 0.00000e+00 1.78567e+02 272.555 1.34198e+01 272.555 0.9543 
1 1 1 6   46  11 o 13 1.57786e+01 1.16399e+00 3.34235e+02 302.217 2.58295e+01  -4.09891e+01 0.00000e+00 0.00000e+00 2.51793e+02 302.217 8.24418e+01 122.217 0.9896 
1 1 1 6   46  12 f 0  4.73331e+00 1.30710e+00 6.95231e+01 110.560 -1.09608e+00 2.92229e+00  0.00000e+00 0.00000e+00 7.58187e+01 110.560 6.29565e+00 110.560 0.8186 
1 1 1 6   46  13 o 15 4.92394e+00 1.41616e+00 9.04238e+01 151.318 -3.93322e+00 2.15180e+00  0.00000e+00 0.00000e+00 7.20072e+01 151.318 1.84166e+01 331.318 0.8798 
1 1 1 6   46  14 o 13 4.69328e+00 1.44937e+00 1.10720e+02 308.296 3.45347e+00  -4.37342e+00 0.00000e+00 0.00000e+00 4.84644e+01 308.296 6.22560e+01 128.296 0.9052 
1 1 1 6   46  15 o 9  4.16936e+00 1.37107e+00 5.44128e+01 161.811 -2.57808e+00 8.47094e-01  0.00000e+00 0.00000e+00 6.83640e+01 161.811 1.39512e+01 161.811 0.7864 
1 1 1 6   47  0  o 3  2.97186e+01 5.66480e-01 5.60164e+02 354.648 3.59651e+01  -3.36927e+00 0.00000e+00 0.00000e+00 5.40628e+02 354.648 1.95363e+01 174.648 0.9861 
1 1 1 6   47  1  o 15 2.58976e+01 5.91492e-01 4.28083e+02 257.174 -5.45681e+00 -2.39687e+01 0.00000e+00 0.00000e+00 5.24945e+02 257.174 9.68618e+01 257.174 0.9794 
1 1 1 6   47  2  o 3  2.28041e+01 5.47206e-01 5.59416e+02 116.059 -1.36968e+01 2.80090e+01  0.00000e+00 0.00000e+00 2.83658e+02 116.059 2.75758e+02 296.059 0.9838 
1 1 1 6   47  3  o 4  1.42593e+01 5.43465e-01 2.41334e+02 248.558 -3.29577e+00 -8.39168e+00 0.00000e+00 0.00000e+00 2.63892e+02 248.558 2.25586e+01 248.558 0.9428 
1 1 1 6   47  4  o 7  4.27463e+01 1.15648e+00 7.09189e+02 105.723 -2.18363e+01 7.75651e+01  0.00000e+00 0.00000e+00 8.87310e+02 105.723 1.78121e+02 105.723 0.9938 
1 1 1 6   47  5  o 4  4.62317e+01 8.78224e-01 8.11209e+02 10.166  1.11787e+02  2.00456e+01  0.00000e+00 0.00000e+00 9.18559e+02 10.166  1.07350e+02 10.166  0.9956 
1 1 1 6   47  6  o 6  2.69794e+01 6.80767e-01 4.33747e+02 316.705 3.31029e+01  -3.11887e+01 0.00000e+00 0.00000e+00 5.68861e+02 316.705 1.35114e+02 316.705 0.9889 
1 1 1 6   47  7  o 1  1.61775e+01 8.33097e-01 2.78886e+02 89.860  5.19687e-02  2.12043e+01  0.00000e+00 0.00000e+00 3.14418e+02 89.860  3.55320e+01 89.860  0.9761 
1 1 1 6   47  8  o 3  1.07226e+01 1.03693e+00 2.13673e+02 255.217 -3.12574e+00 -1.18451e+01 0.00000e+00 0.00000e+00 1.72298e+02 255.217 4.13741e+01 75.217  0.9583 
1 1 1 6   47  9  o 11 3.78992e+00 1.17893e+00 9.66040e+01 233.876 -1.41031e+00 -1.93229e+00 0.00000e+00 0.00000e+00 1.05290e+01 233.876 8.60750e+01 53.876  0.7527 
1 1 1 6   47  10 o 12 1.50926e+01 1.15002e+00 2.57624e+02 289.417 1.01374e+01  -2.87601e+01 0.00000e+00 0.00000e+00 2.99590e+02 289.417 4.19659e+01 289.417 0.9835 
1 1 1 6   47  11 o 6  6.96404e+00 1.37451e+00 2.68315e+02 152.307 -1.35259e+01 7.09908e+00  0.00000e+00 0.00000e+00 1.56919e+01 332.307 2.84007e+02 332.307 0.9667 
1 1 1 6   47  12 o 1  1.47747e+01 1.03890e+00 1.89182e+02 183.028 -3.23008e+01 -1.70875e+00 0.00000e+00 0.00000e+00 3.56354e+02 183.028 1.67172e+02 183.028 0.9844 
1 1 1 6   47  13 o 10 6.27966e+00 1.53671e+00 9.69008e+01 107.749 -1.90768e+00 5.96003e+00  0.00000e+00 0.00000e+00 1.18784e+02 107.749 2.18827e+01 107.749 0.9162 
1 1 1 6   47  14 o 8  7.48591e+00 1.65746e+00 1.70450e+02 354.702 1.28096e+01  -1.18784e+00 0.00000e+00 0.00000e+00 9.88893e+01 354.702 7.15611e+01 174.702 0.9603 
1 1 1 6   47  15 o 4  5.78061e+00 1.62735e+00 1.00391e+02 45.814  4.36393e+00  4.48970e+00  0.00000e+00 0.00000e+00 9.79194e+01 45.814  2.47115e+00 225.814 0.9162 
1 1 1 6   48  0  o 18 2.67175e+01 5.85398e-01 4.71346e+02 161.216 -2.63837e+01 8.97356e+00  0.00000e+00 0.00000e+00 5.13972e+02 161.216 4.26258e+01 161.216 0.9819 
1 1 1 6   48  1  o 16 1.08158e+01 6.93590e-01 1.25070e+02 223.235 -2.39193e+00 -2.24890e+00 0.00000e+00 0.00000e+00 2.11737e+02 223.235 8.66671e+01 223.235 0.8289 
1 1 1 6   48  2  o 15 1.85768e+01 5.19309e-01 1.30389e+02 263.880 -6.21517e-01 -5.79638e+00 0.00000e+00 0.00000e+00 5.04517e+02 263.880 3.74128e+02 263.880 0.9096 
1 1 1 6   48  3  o 9  1.69981e+01 6.02328e-01 3.65548e+02 331.751 1.50094e+01  -8.06435e+00 0.00000e+00 0.00000e+00 2.54141e+02 331.751 1.11407e+02 151.751 0.9702 
1 1 1 6   48  4  o 17 2.63012e+01 7.64155e-01 5.23681e+02 31.465  3.33438e+01  2.04048e+01  0.00000e+00 0.00000e+00 4.51923e+02 31.465  7.17571e+01 211.465 0.9871 
1 1 1 6   48  5  o 7  1.68812e+01 7.34352e-01 2.27223e+02 343.304 1.15979e+01  -3.47863e+00 0.00000e+00 0.00000e+00 3.80319e+02 343.304 1.53096e+02 343.304 0.9578 
1 1 1 6   48  6  o 12 1.72921e+01 6.51024e-01 3.91940e+02 63.019  1.31434e+01  2.58168e+01  0.00000e+00 0.00000e+00 2.46454e+02 63.019  1.45486e+02 243.019 0.9826 
1 1 1 6   48  7  o 5  6.25894e+00 1.22722e+00 7.06970e+01 29.214  1.65569e+00  9.25874e-01  0.00000e+00 0.00000e+00 8.92156e+01 29.214  1.85186e+01 29.214  0.6801 
1 1 1 6   48  8  o 14 1.88977e+01 8.53906e-01 3.85377e+02 294.292 1.76188e+01  -3.90359e+01 0.00000e+00 0.00000e+00 3.16058e+02 294.292 6.93192e+01 114.292 0.9883 
1 1 1 6   48  9  o 6  7.41325e+00 1.32750e+00 1.87062e+02 83.034  1.08229e+00  8.85819e+00  0.00000e+00 0.00000e+00 7.51983e+01 83.034  1.11864e+02 263.034 0.9422 
1 1 1 6   48  10 o 19 1.47946e+01 1.11430e+00 2.58088e+02 253.935 -8.37421e+00 -2.90802e+01 0.00000e+00 0.00000e+00 2.87978e+02 253.935 2.98903e+01 253.935 0.9833 
1 1 1 6   48  11 o 3  3.93434e+00 1.15389e+00 8.75081e+01 324.248 2.61416e+00  -1.88207e+00 0.00000e+00 0.00000e+00 3.42909e+01 324.248 5.32173e+01 144.248 0.8251 
1 1 1 6   48  12 o 9  7.66758e+00 1.33522e+00 9.33214e+01 104.703 -1.76357e+00 6.72087e+00  0.00000e+00 0.00000e+00 1.72656e+02 104.703 7.93347e+01 104.703 0.9250 
1 1 1 6   48  13 o 8  1.12978e+01 1.27419e+00 1.56771e+02 73.499  5.91560e+00  1.99690e+01  0.00000e+00 0.00000e+00 2.56415e+02 73.499  9.96441e+01 73.499  0.9757 
1 1 1 6   48  14 f 0  3.66771e+00 1.24700e+00 2.18498e+01 308.710 6.20376e-01  -7.74082e-01 0.00000e+00 0.00000e+00 3.90932e+01 308.710 1.72434e+01 308.710 0.4435 
1 1 1 6   48  15 o 16 4.43650e+00 1.44109e+00 7.01715e+01 221.717 -2.80402e+00 -2.49978e+00 0.00000e+00 0.00000e+00 7.15811e+01 221.717 1.40958e+00 221.717 0.8535 
1 1 1 6   49  0  o 6  1.81033e+01 4.67705e-01 2.83209e+02 47.880  8.42401e+00  9.31653e+00  0.00000e+00 0.00000e+00 3.68996e+02 47.880  8.57864e+01 47.880  0.9593 
1 1 1 6   49  1  o 13 2.04334e+01 5.87144e-01 3.24882e+02 15.096  1.53854e+01  4.15027e+00  0.00000e+00 0.00000e+00 4.18156e+02 15.096  9.32733e+01 15.096  0.9681 
1 1 1 6   49  2  o 5  3.06740e+01 5.93925e-01 4.55361e+02 330.754 3.18209e+01  -1.78177e+01 0.00000e+00 0.00000e+00 6.81088e+02 330.754 2.25727e+02 330.754 0.9862 
1 1 1 6   49  3  o 1  1.66418e+01 5.35328e-01 3.55852e+02 296.612 7.45976e+00  -1.48887e+01 0.00000e+00 0.00000e+00 2.50328e+02 296.612 1.05524e+02 116.612 0.9695 
1 1 1 6   49  4  o 13 2.68090e+01 7.54522e-01 4.18696e+02 85.804  2.61097e+00  3.55901e+01  0.00000e+00 0.00000e+00 5.74365e+02 85.804  1.55669e+02 85.804  0.9859 
1 1 1 6   49  5  o 4  1.68614e+01 6.03483e-01 3.39339e+02 252.364 -5.69435e+00 -1.79120e+01 0.00000e+00 0.00000e+00 2.77072e+02 252.364 6.22666e+01 72.364  0.9730 
1 1 1 6   49  6  o 2  2.86841e+01 6.85742e-01 4.77865e+02 318.376 4.33699e+01  -3.85383e+01 0.00000e+00 0.00000e+00 5.90399e+02 318.376 1.12534e+02 318.376 0.9913 
1 1 1 6   49  7  o 15 1.43899e+01 8.48924e-01 1.70611e+02 41.075  9.05466e+00  7.89196e+00  0.00000e+00 0.00000e+00 3.46883e+02 41.075  1.76271e+02 41.075  0.9574 
1 1 1 6   49  8  o 12 1.97578e+01 8.54025e-01 3.54837e+02 251.757 -1.31342e+01 -3.98473e+01 0.00000e+00 0.00000e+00 3.78243e+02 251.757 2.34055e+01 251.757 0.9880 
1 1 1 6   49  9  f 0  4.44655e+00 1.26295e+00 1.50940e+02 206.582 -4.21139e+00 -2.10725e+00 0.00000e+00 0.00000e+00 3.00531e+00 26.582  1.53946e+02 26.582  0.8862 
1 1 1 6   49  10 o 10 5.33095e+00 1.46210e+00 9.26612e+01 34.384  2.97022e+00  2.03251e+00  0.00000e+00 0.00000e+00 7.66236e+01 34.384  1.60376e+01 214.384 0.8461 
1 1 1 6   49  11 o 6  3.51367e+00 1.09941e+00 1.28599e+02 181.497 -4.08070e+00 -1.06662e-01 0.00000e+00 0.00000e+00 1.43656e+01 1.497   1.42965e+02 1.497   0.8666 
1 1 1 6   49  12 o 15 8.70171e+00 1.32211e+00 1.66262e+02 70.310  5.00944e+00  1.39984e+01  0.00000e+00 0.00000e+00 1.48864e+02 70.310  1.73989e+01 250.310 0.9658 
1 1 1 6   49  13 o 18 5.69641e+00 1.29917e+00 4.14384e+01 353.915 2.73290e+00  -2.91352e-01 0.00000e+00 0.00000e+00 1.27118e+02 353.915 8.56794e+01 353.915 0.7895 
1 1 1 6   49  14 o 13 7.08191e+00 1.68763e+00 1.51287e+02 289.482 3.56651e+00  -1.00815e+01 0.00000e+00 0.00000e+00 1.01253e+02 289.482 5.00343e+01 109.482 0.9520 
1 1 1 6   49  15 o 18 5.38380e+00 1.63408e+00 1.75291e+02 73.313  2.82390e+00  9.42052e+00  0.00000e+00 0.00000e+00 1.57007e+01 73.313  1.59590e+02 253.313 0.9477 
1 1 1 6   50  0  o 19 2.00744e+01 5.40073e-01 1.88790e+02 72.796  3.00691e+00  9.71142e+00  0.00000e+00 0.00000e+00 5.26897e+02 72.796  3.38106e+02 72.796  0.9495 
1 1 1 6   50  1  o 10 3.08185e+01 7.57918e-01 5.69357e+02 196.451 -4.43957e+01 -1.31094e+01 0.00000e+00 0.00000e+00 5.75528e+02 196.451 6.17068e+00 196.451 0.9891 
1 1 1 6   50  2  o 7  2.54598e+01 9.03774e-01 4.11652e+02 341.017 2.65348e+01  -9.12796e+00 0.00000e+00 0.00000e+00 5.27493e+02 341.017 1.15841e+02 341.017 0.9820 
1 1 1 6   50  3  o 9  1.13566e+01 7.83835e-01 1.15153e+02 61.280  1.86801e+00  3.40915e+00  0.00000e+00 0.00000e+00 2.51338e+02 61.280  1.36185e+02 61.280  0.8590 
1 1 1 6   50  4  o 7  2.37349e+01 7.20665e-01 5.01413e+02 292.605 1.40642e+01  -3.37779e+01 0.00000e+00 0.00000e+00 3.77969e+02 292.605 1.23444e+02 112.605 0.9862 
1 1 1 6   50  5  o 3  9.84776e+00 7.40595e-01 1.57305e+02 349.516 5.19708e+00  -9.61736e-01 0.00000e+00 0.00000e+00 1.75495e+02 349.516 1.81895e+01 349.516 0.8996 
1 1 1 6   50  6  o 15 1.85967e+01 6.56785e-01 3.65780e+02 242.123 -1.38822e+01 -2.62447e+01 0.00000e+00 0.00000e+00 3.20890e+02 242.123 4.48899e+01 62.123  0.9830 
1 1 1 6   50  7  o 4  1.74683e+01 7.89515e-01 2.66131e+02 281.469 4.88107e+00  -2.40584e+01 0.00000e+00 0.00000e+00 3.76415e+02 281.469 1.10285e+02 281.469 0.9794 
1 1 1 6   50  8  o 2  6.69831e+00 1.12033e+00 8.78563e+01 272.110 1.32977e-01  -3.60873e+00 0.00000e+00 0.00000e+00 1.25100e+02 272.110 3.72433e+01 272.110 0.8467 
1 1 1 6   50  9  o 19 1.18567e+01 1.07428e+00 2.25482e+02 339.870 1.77353e+01  -6.50076e+00 0.00000e+00 0.00000e+00 2.07648e+02 339.870 1.78336e+01 159.870 0.9732 
1 1 1 6   50  10 o 16 3.71419e+01 9.49596e-01 6.68877e+02 248.622 -8.01965e+01 -2.04866e+02 0.00000e+00 0.00000e+00 7.21714e+02 248.622 5.28368e+01 248.622 0.9977 
1 1 1 6   50  11 o 2  9.56961e+00 1.18354e+00 2.18849e+02 75.644  4.85913e+00  1.89861e+01  0.00000e+00 0.00000e+00 1.30829e+02 75.644  8.80202e+01 255.644 0.9741 
1 1 1 6   50  12 o 13 8.01917e+00 1.35976e+00 1.70443e+02 320.854 1.07257e+01  -8.73086e+00 0.00000e+00 0.00000e+00 1.19137e+02 320.854 5.13066e+01 140.854 0.9631 
1 1 1 6   50  13 o 6  4.28967e+00 1.31436e+00 5.13008e+01 201.835 -2.34255e+00 -9.38627e-01 0.00000e+00 0.00000e+00 7.20804e+01 201.835 2.07796e+01 201.835 0.7675 
1 1 1 6   50  14 o 15 4.79584e+00 1.47571e+00 3.15025e+01 151.264 -1.50684e+00 8.26216e-01  0.00000e+00 0.00000e+00 8.44715e+01 151.264 5.29691e+01 151.264 0.6457 
1 1 1 6   50  15 o 2  1.01649e+01 1.95271e+00 9.83922e+01 69.885  3.01493e+00  8.23180e+00  0.00000e+00 0.00000e+00 2.59650e+02 69.885  1.61258e+02 69.885  0.9411 
1 1 1 6   51  0  o 19 1.64837e+01 6.09838e-01 2.66043e+02 31.884  9.70091e+00  6.03452e+00  0.00000e+00 0.00000e+00 3.25084e+02 31.884  5.90405e+01 31.884  0.9552 
1 1 1 6   51  1  o 18 2.31090e+01 5.13993e-01 3.86556e+02 80.350  4.12616e+00  2.42666e+01  0.00000e+00 0.00000e+00 4.63418e+02 80.350  7.68624e+01 80.350  0.9795 
1 1 1 6   51  2  o 15 1.93821e+01 5.02724e-01 1.38077e+02 155.480 -6.85195e+00 3.12544e+00  0.00000e+00 0.00000e+00 5.39657e+02 155.480 4.01580e+02 155.480 0.9310 
1 1 1 6   51  3  o 11 3.27274e+01 6.74041e-01 6.13800e+02 217.414 -4.54509e+01 -3.47679e+01 0.00000e+00 0.00000e+00 6.04683e+02 217.414 9.11735e+00 37.414  0.9912 
1 1 1 6   51  4  o 14 1.31477e+01 9.01442e-01 2.69839e+02 125.915 -6.46788e+00 8.93000e+00  0.00000e+00 0.00000e+00 2.01058e+02 125.915 6.87816e+01 305.915 0.9535 
1 1 1 6   51  5  o 5  2.58738e+01 6.92237e-01 4.23452e+02 138.176 -3.16580e+01 2.83296e+01  0.00000e+00 0.00000e+00 5.36881e+02 138.176 1.13428e+02 138.176 0.9882 
1 1 1 6   51  6  o 18 1.16707e+01 8.67679e-01 1.59172e+02 244.288 -3.57303e+00 -7.42018e+00 0.00000e+00 0.00000e+00 2.51604e+02 244.288 9.24325e+01 244.288 0.9372 
1 1 1 6   51  7  o 9  1.13387e+01 8.75974e-01 1.87755e+02 147.273 -1.01970e+01 6.55305e+00  0.00000e+00 0.00000e+00 2.20070e+02 147.273 3.23146e+01 147.273 0.9578 
1 1 1 6   51  8  o 18 1.24217e+01 1.03135e+00 2.55233e+02 204.615 -1.86144e+01 -8.52830e+00 0.00000e+00 0.00000e+00 1.99582e+02 204.615 5.56518e+01 24.615  0.9753 
1 1 1 6   51  9  o 10 7.76915e+00 1.26530e+00 9.45943e+01 101.375 -1.03851e+00 5.16185e+00  0.00000e+00 0.00000e+00 1.67608e+02 101.375 7.30141e+01 101.375 0.8992 
1 1 1 6   51  10 f 0  3.13920e+00 1.00041e+00 1.28584e+02 239.652 -1.77588e+00 -3.03318e+00 0.00000e+00 0.00000e+00 2.94252e+01 59.652  1.58009e+02 59.652  0.8419 
1 1 1 6   51  11 f 0  6.94072e+00 1.25874e+00 1.60181e+02 73.157  3.17060e+00  1.04733e+01  0.00000e+00 0.00000e+00 8.79364e+01 73.157  7.22442e+01 253.157 0.9532 
1 1 1 6   51  12 o 7  4.35579e+00 1.20826e+00 4.75137e+01 327.345 1.88085e+00  -1.20540e+00 0.00000e+00 0.00000e+00 7.21261e+01 327.345 2.46123e+01 327.345 0.7327 
1 1 1 6   51  13 o 7  3.65636e+00 1.19305e+00 8.71950e+01 206.740 -3.50596e+00 -1.76639e+00 0.00000e+00 0.00000e+00 3.07062e+01 206.740 5.64887e+01 26.740  0.8606 
1 1 1 6   51  14 o 3  6.51665e+00 1.64123e+00 9.87422e+01 143.542 -5.19581e+00 3.83880e+00  0.00000e+00 0.00000e+00 1.25508e+02 143.542 2.67660e+01 143.542 0.9190 
1 1 1 6   51  15 o 12 4.65348e+00 1.50169e+00 6.81083e+01 0.665   3.77522e+00  4.38499e-02  0.00000e+00 0.00000e+00 8.06624e+01 0.665   1.25542e+01 0.665   0.8543 
1 1 1 6   52  0  o 12 1.05874e+01 4.94247e-01 2.91698e+02 20.115  7.98159e+00  2.92316e+00  0.00000e+00 0.00000e+00 8.15733e+01 20.115  2.10125e+02 200.115 0.9392 
1 1 1 6   52  1  o 7  1.78460e+01 4.85489e-01 2.49748e+02 352.091 1.24417e+01  -1.72836e+00 0.00000e+00 0.00000e+00 3.93059e+02 352.091 1.43312e+02 352.091 0.9593 
1 1 1 6   52  2  o 6  9.83571e+00 5.47624e-01 1.80569e+02 217.000 -4.28528e+00 -3.22920e+00 0.00000e+00 0.00000e+00 1.52302e+02 217.000 2.82676e+01 37.000  0.9012 
1 1 1 6   52  3  o 13 1.25063e+01 5.45612e-01 1.26987e+02 95.294  -4.71897e-01 5.09287e+00  0.00000e+00 0.00000e+00 2.93838e+02 95.294  1.66851e+02 95.294  0.8960 
1 1 1 6   52  4  o 12 2.85930e+01 6.88316e-01 4.38762e+02 286.886 1.18910e+01  -3.91727e+01 0.00000e+00 0.00000e+00 6.21899e+02 286.886 1.83138e+02 286.886 0.9877 
1 1 1 6   52  5  o 4  2.02038e+01 6.19642e-01 4.31860e+02 130.765 -2.43886e+01 2.82889e+01  0.00000e+00 0.00000e+00 3.16676e+02 130.765 1.15184e+02 310.765 0.9865 
1 1 1 6   52  6  o 4  2.52296e+01 8.64091e-01 4.10944e+02 220.905 -3.65653e+01 -3.16794e+01 0.00000e+00 0.00000e+00 5.26632e+02 220.905 1.15688e+02 220.905 0.9896 
1 1 1 6   52  7  f 0  7.56582e+00 1.21450e+00 1.36522e+02 184.720 -5.29127e+00 -4.36836e-01 0.00000e+00 0.00000e+00 1.19165e+02 184.720 1.73567e+01 4.720   0.9001 
1 1 1 6   52  8  o 14 4.16123e+00 1.18056e+00 9.32348e+01 320.410 1.95615e+00  -1.61769e+00 0.00000e+00 0.00000e+00 2.69031e+01 320.410 6.63317e+01 140.410 0.7691 
1 1 1 6   52  9  o 4  1.00930e+01 1.15991e+00 1.80438e+02 300.758 6.97697e+00  -1.17233e+01 0.00000e+00 0.00000e+00 1.84171e+02 300.758 3.73365e+00 300.758 0.9626 
1 1 1 6   52  10 o 1  1.72402e+01 8.12936e-01 3.27750e+02 113.269 -2.23263e+01 5.19188e+01  0.00000e+00 0.00000e+00 3.13265e+02 113.269 1.44845e+01 293.269 0.9911 
1 1 1 6   52  11 o 3  1.58406e+01 8.78483e-01 2.52766e+02 344.359 4.64665e+01  -1.30098e+01 0.00000e+00 0.00000e+00 3.35068e+02 344.359 8.23012e+01 344.359 0.9896 
1 1 1 6   52  12 o 8  4.60919e+00 1.18697e+00 8.72686e+01 339.378 4.22112e+00  -1.58849e+00 0.00000e+00 0.00000e+00 6.48725e+01 339.378 2.23961e+01 159.378 0.8806 
1 1 1 6   52  13 o 18 1.46134e+01 1.14218e+00 2.31233e+02 131.464 -2.83101e+01 3.20398e+01  0.00000e+00 0.00000e+00 3.09787e+02 131.464 7.85541e+01 131.464 0.9882 
1 1 1 6   52  14 o 8  1.00067e+01 1.67293e+00 1.60318e+02 130.704 -1.08186e+01 1.25761e+01  0.00000e+00 0.00000e+00 2.02869e+02 130.704 4.25508e+01 130.704 0.9694 
1 1 1 6   52  15 o 8  4.37981e+00 1.41311e+00 1.68363e+02 312.421 6.35071e+00  -6.94969e+00 0.00000e+00 0.00000e+00 1.34485e+01 132.421 1.81812e+02 132.421 0.9453 
1 1 1 6   53  0  o 10 8.21046e+00 5.55198e-01 2.21126e+02 336.436 4.66019e+00  -2.03253e+00 0.00000e+00 0.00000e+00 5.47746e+01 336.436 1.66351e+02 156.436 0.8953 
1 1 1 6   53  1  o 7  1.03470e+01 5.19620e-01 1.65370e+02 264.990 -4.52552e-01 -5.16214e+00 0.00000e+00 0.00000e+00 1.83229e+02 264.990 1.78596e+01 264.990 0.8974 
1 1 1 6   53  2  o 9  2.50928e+01 5.45777e-01 3.81613e+02 94.224  -2.02269e+00 2.73868e+01  0.00000e+00 0.00000e+00 5.43229e+02 94.224  1.61616e+02 94.224  0.9816 
1 1 1 6   53  3  o 18 2.78115e+01 5.87387e-01 4.08505e+02 46.617  2.49865e+01  2.64385e+01  0.00000e+00 0.00000e+00 6.21369e+02 46.617  2.12864e+02 46.617  0.9862 
1 1 1 6   53  4  o 7  1.42610e+01 6.09780e-01 3.05712e+02 245.557 -6.22402e+00 -1.36935e+01 0.00000e+00 0.00000e+00 2.11690e+02 245.557 9.40224e+01 65.557  0.9662 
1 1 1 6   53  5  o 19 6.30313e+00 9.76097e-01 9.93921e+01 348.627 2.49862e+00  -5.02573e-01 0.00000e+00 0.00000e+00 8.28983e+01 348.627 1.64938e+01 168.627 0.7702 
1 1 1 6   53  6  o 8  4.23521e+00 1.21745e+00 1.69174e+02 216.894 -2.62361e+00 -1.96947e+00 0.00000e+00 0.00000e+00 3.73863e+01 36.895  2.06561e+02 36.895  0.8288 
1 1 1 6   53  7  o 9  1.84799e+01 8.49041e-01 3.09335e+02 100.723 -6.25736e+00 3.30431e+01  0.00000e+00 0.00000e+00 3.74018e+02 100.723 6.46824e+01 100.723 0.9850 
1 1 1 6   53  8  o 15 3.52739e+00 1.10763e+00 1.20836e+02 37.429  2.21832e+00  1.69783e+00  0.00000e+00 0.00000e+00 1.57859e+01 217.429 1.36622e+02 217.429 0.7935 
1 1 1 6   53  9  o 17 1.72053e+01 9.84880e-01 2.79764e+02 112.376 -1.51502e+01 3.68012e+01  0.00000e+00 0.00000e+00 3.57653e+02 112.376 7.78885e+01 112.376 0.9874 
1 1 1 6   53  10 o 14 8.25340e+00 1.16378e+00 1.93660e+02 330.217 1.27414e+01  -7.29216e+00 0.00000e+00 0.00000e+00 1.05183e+02 330.217 8.84773e+01 150.217 0.9653 
1 1 1 6   53  11 o 12 3.40166e+00 1.03747e+00 3.93964e+01 251.888 -4.68384e-01 -1.43198e+00 0.00000e+00 0.00000e+00 3.68452e+01 251.888 2.55116e+00 71.888  0.5978 
1 1 1 6   53  12 o 7  3.83834e+00 1.14979e+00 1.04532e+02 136.094 -3.45738e+00 3.32784e+00  0.00000e+00 0.00000e+00 2.32783e+01 136.094 8.12535e+01 316.094 0.8885 
1 1 1 6   53  13 o 2  7.93375e+00 1.39000e+00 1.40693e+02 81.913  1.69540e+00  1.19320e+01  0.00000e+00 0.00000e+00 1.43877e+02 81.913  3.18348e+00 81.913  0.9576 
1 1 1 6   53  14 o 18 7.81039e+00 1.71177e+00 1.03624e+02 61.629  3.97803e+00  7.36615e+00  0.00000e+00 0.00000e+00 1.70701e+02 61.629  6.70772e+01 61.629  0.9382 
1 1 1 6   53  15 o 8  1.02709e+01 1.92749e+00 1.85005e+02 310.209 1.11807e+01  -1.32262e+01 0.00000e+00 0.00000e+00 1.87981e+02 310.209 2.97610e+00 310.209 0.9707 
1 1 1 6   54  0  o 7  1.51197e+01 4.84001e-01 3.22991e+02 93.413  -8.39863e-01 1.40817e+01  0.00000e+00 0.00000e+00 2.23923e+02 93.413  9.90681e+01 273.413 0.9639 
1 1 1 6   54  1  o 15 3.81381e+01 6.80067e-01 7.13847e+02 226.920 -5.28886e+01 -5.65568e+01 0.00000e+00 0.00000e+00 7.08422e+02 226.920 5.42513e+00 46.920  0.9935 
1 1 1 6   54  2  o 4  2.32976e+01 5.38089e-01 3.75661e+02 44.856  1.93349e+01  1.92383e+01  0.00000e+00 0.00000e+00 4.82777e+02 44.856  1.07116e+02 44.856  0.9815 
1 1 1 6   54  3  o 3  2.01398e+01 5.33462e-01 3.74424e+02 200.579 -2.33432e+01 -8.76442e+00 0.00000e+00 0.00000e+00 3.66397e+02 200.579 8.02711e+00 20.579  0.9797 
1 1 1 6   54  4  o 7  1.10347e+01 6.76941e-01 2.21640e+02 284.468 2.37173e+00  -9.19182e+00 0.00000e+00 0.00000e+00 1.70196e+02 284.468 5.14437e+01 104.468 0.9458 
1 1 1 6   54  5  o 3  8.20356e+00 9.48290e-01 1.11272e+02 213.068 -3.20865e+00 -2.08916e+00 0.00000e+00 0.00000e+00 1.52561e+02 213.068 4.12894e+01 213.068 0.8566 
1 1 1 6   54  6  o 4  8.82651e+00 1.11751e+00 1.43265e+02 166.735 -6.12394e+00 1.44373e+00  0.00000e+00 0.00000e+00 1.60478e+02 166.735 1.72131e+01 166.735 0.9167 
1 1 1 6   54  7  o 1  7.04142e+00 1.14230e+00 5.14723e+01 294.272 8.36756e-01  -1.85559e+00 0.00000e+00 0.00000e+00 1.34470e+02 294.272 8.29973e+01 294.272 0.7035 
1 1 1 6   54  8  o 16 3.56556e+00 1.05273e+00 4.53763e+01 339.056 1.05380e+00  -4.03331e-01 0.00000e+00 0.00000e+00 2.01911e+01 339.056 2.51851e+01 159.056 0.4900 
1 1 1 6   54  9  o 17 3.52766e+00 1.07192e+00 9.47839e+01 62.740  1.23086e+00  2.38883e+00  0.00000e+00 0.00000e+00 8.96504e+00 62.740  8.58188e+01 242.740 0.7839 
1 1 1 6   54  10 o 13 5.59176e+00 1.19100e+00 1.79105e+02 210.706 -7.58256e+00 -4.50322e+00 0.00000e+00 0.00000e+00 1.83340e+01 210.706 1.60771e+02 30.706  0.9415 
1 1 1 6   54  11 o 12 4.50634e+00 1.24861e+00 7.40283e+01 183.666 -3.24010e+00 -2.07609e-01 0.00000e+00 0.00000e+00 6.56316e+01 183.666 8.39666e+00 3.666   0.8267 
1 1 1 6   54  12 o 10 1.20373e+01 1.11297e+00 1.65984e+02 213.991 -1.97694e+01 -1.33302e+01 0.00000e+00 0.00000e+00 2.75513e+02 213.991 1.09530e+02 213.991 0.9788 
1 1 1 6   54  13 o 10 8.72608e+00 1.51506e+00 2.05078e+02 85.515  1.52227e+00  1.94086e+01  0.00000e+00 0.00000e+00 1.13224e+02 85.515  9.18540e+01 265.515 0.9740 
1 1 1 6   54  14 o 8  5.86964e+00 1.61763e+00 1.74606e+02 268.054 -3.69139e-01 -1.08638e+01 0.00000e+00 0.00000e+00 3.47324e+01 268.054 1.39874e+02 88.054  0.9528 
1 1 1 6   54  15 o 9  4.26495e+00 1.41355e+00 1.11209e+02 41.962  4.74591e+00  4.26757e+00  0.00000e+00 0.00000e+00 3.52321e+01 41.962  7.59766e+01 221.962 0.9179 
1 1 1 6   55  0  o 8  1.54306e+01 4.80066e-01 1.93153e+02 187.950 -9.56009e+00 -1.33501e+00 0.00000e+00 0.00000e+00 3.54973e+02 187.950 1.61820e+02 187.950 0.9467 
1 1 1 6   55  1  o 19 1.78257e+01 5.85989e-01 3.26608e+02 117.211 -8.27372e+00 1.60912e+01  0.00000e+00 0.00000e+00 3.23636e+02 117.211 2.97214e+00 297.211 0.9720 
1 1 1 6   55  2  o 12 4.99292e+01 8.41910e-01 8.14931e+02 20.340  1.19287e+02  4.42195e+01  0.00000e+00 0.00000e+00 1.05182e+03 20.340  2.36888e+02 20.340  0.9961 
1 1 1 6   55  3  o 11 3.43954e+01 6.56306e-01 5.24852e+02 85.579  4.91123e+00  6.35202e+01  0.00000e+00 0.00000e+00 7.56146e+02 85.579  2.31295e+02 85.579  0.9921 
1 1 1 6   55  4  o 1  1.46356e+01 5.77208e-01 3.34765e+02 7.313   2.08702e+01  2.67841e+00  0.00000e+00 0.00000e+00 2.01440e+02 7.313   1.33325e+02 187.313 0.9759 
1 1 1 6   55  5  o 1  7.07870e+00 1.02030e+00 6.77020e+01 287.541 6.58170e-01  -2.08221e+00 0.00000e+00 0.00000e+00 1.25151e+02 287.541 5.74488e+01 287.541 0.7258 
1 1 1 6   55  6  o 13 6.66264e+00 1.16392e+00 1.16666e+02 95.771  -4.18831e-01 4.14431e+00  0.00000e+00 0.00000e+00 1.00807e+02 95.771  1.58586e+01 275.771 0.8696 
1 1 1 6   55  7  o 5  9.41656e+00 1.10478e+00 2.27201e+02 323.499 1.05820e+01  -7.83059e+00 0.00000e+00 0.00000e+00 1.12499e+02 323.499 1.14702e+02 143.499 0.9612 
1 1 1 6   55  8  o 9  5.42795e+00 1.26878e+00 1.14949e+02 257.491 -9.43840e-01 -4.25425e+00 0.00000e+00 0.00000e+00 6.34595e+01 257.491 5.14896e+01 77.491  0.8760 
1 1 1 6   55  9  o 18 1.10271e+01 9.20421e-01 2.01641e+02 41.781  1.46661e+01  1.31041e+01  0.00000e+00 0.00000e+00 2.01339e+02 41.781  3.02754e-01 221.781 0.9742 
1 1 1 6   55  10 o 9  8.17222e+00 1.13749e+00 1.53781e+02 55.192  6.74954e+00  9.70837e+00  0.00000e+00 0.00000e+00 1.39404e+02 55.192  1.43775e+01 235.192 0.9567 
1 1 1 6   55  11 o 15 1.41534e+01 9.50993e-01 1.97733e+02 255.182 -8.27762e+00 -3.12906e+01 0.00000e+00 0.00000e+00 3.24525e+02 255.182 1.26792e+02 255.182 0.9844 
1 1 1 6   55  12 o 8  8.53280e+00 1.35012e+00 1.62098e+02 67.459  6.08418e+00  1.46586e+01  0.00000e+00 0.00000e+00 1.47351e+02 67.459  1.47478e+01 247.459 0.9680 
1 1 1 6   55  13 o 13 7.33561e+00 1.56868e+00 9.17069e+01 26.324  6.02678e+00  2.98176e+00  0.00000e+00 0.00000e+00 1.61647e+02 26.324  6.99397e+01 26.324  0.9223 
1 1 1 6   55  14 o 10 8.60804e+00 1.52271e+00 1.95604e+02 299.798 9.11962e+00  -1.59249e+01 0.00000e+00 0.00000e+00 1.17645e+02 299.798 7.79585e+01 119.798 0.9724 
1 1 1 6   55  15 o 12 7.65860e+00 1.89858e+00 1.51504e+02 229.630 -7.17093e+00 -8.43471e+00 0.00000e+00 0.00000e+00 1.21673e+02 229.630 2.98315e+01 49.630  0.9537 
1 1 1 6   56  0  o 5  1.18698e+01 5.05248e-01 2.93372e+02 152.272 -9.59982e+00 5.04594e+00  0.00000e+00 0.00000e+00 1.30887e+02 152.272 1.62485e+02 332.272 0.9527 
1 1 1 6   56  1  o 15 1.04301e+01 5.48178e-01 1.57557e+02 337.918 4.87973e+00  -1.97965e+00 0.00000e+00 0.00000e+00 1.94377e+02 337.918 3.68203e+01 337.918 0.8992 
1 1 1 6   56  2  o 15 1.52487e+01 5.22153e-01 3.94755e+02 346.893 1.93577e+01  -4.50732e+00 0.00000e+00 0.00000e+00 1.62942e+02 346.893 2.31813e+02 166.893 0.9745 
1 1 1 6   56  3  o 18 1.68579e+01 5.41858e-01 3.44952e+02 304.537 1.13879e+01  -1.65468e+01 0.00000e+00 0.00000e+00 2.71828e+02 304.537 7.31240e+01 124.537 0.9748 
1 1 1 6   56  4  o 19 2.04095e+01 5.74799e-01 3.81227e+02 166.047 -3.22149e+01 8.00386e+00  0.00000e+00 0.00000e+00 3.73203e+02 166.047 8.02363e+00 346.047 0.9848 
1 1 1 6   56  5  o 11 7.53157e+00 1.10596e+00 1.21371e+02 284.517 1.00359e+00  -3.87588e+00 0.00000e+00 0.00000e+00 1.22773e+02 284.517 1.40255e+00 284.517 0.8637 
1 1 1 6   56  6  o 8  6.73004e+00 1.15628e+00 1.12962e+02 246.759 -1.56269e+00 -3.63879e+00 0.00000e+00 0.00000e+00 1.04752e+02 246.759 8.21077e+00 66.759  0.8620 
1 1 1 6   56  7  f 0  4.85000e+00 1.25700e+00 5.10024e+01 283.678 3.72486e-01  -1.53057e+00 0.00000e+00 0.00000e+00 6.07745e+01 283.678 9.77210e+00 283.678 0.6142 
1 1 1 6   56  8  o 15 1.08959e+01 1.04995e+00 1.86962e+02 347.202 1.52670e+01  -3.46805e+00 0.00000e+00 0.00000e+00 2.08526e+02 347.202 2.15639e+01 347.202 0.9675 
1 1 1 6   56  9  o 8  1.23097e+01 8.04202e-01 2.85903e+02 94.795  -2.71873e+00 3.24129e+01  0.00000e+00 0.00000e+00 1.68623e+02 94.795  1.17280e+02 274.795 0.9845 
1 1 1 6   56  10 o 3  4.41810e+00 1.15791e+00 7.92100e+01 11.157  3.25094e+00  6.41153e-01  0.00000e+00 0.00000e+00 5.83986e+01 11.157  2.08115e+01 191.157 0.8307 
1 1 1 6   56  11 o 8  1.11907e+01 1.02855e+00 1.90976e+02 359.657 2.53349e+01  -1.51748e-01 0.00000e+00 0.00000e+00 2.20062e+02 359.657 2.90854e+01 359.657 0.9801 
1 1 1 6   56  12 o 9  3.68904e+00 1.13166e+00 9.64672e+01 123.942 -2.52639e+00 3.75377e+00  0.00000e+00 0.00000e+00 2.52880e+01 123.942 7.11792e+01 303.942 0.8811 
1 1 1 6   56  13 o 6  3.77846e+00 1.22358e+00 7.51817e+01 317.127 2.61417e+00  -2.42692e+00 0.00000e+00 0.00000e+00 4.42927e+01 317.127 3.08890e+01 137.127 0.8445 
1 1 1 6   56  14 o 6  5.58879e+00 1.56272e+00 1.61101e+02 309.340 6.42767e+00  -7.84182e+00 0.00000e+00 0.00000e+00 3.74290e+01 309.340 1.23672e+02 129.340 0.9493 
1 1 1 6   57  0  o 1  2.05716e+01 5.13217e-01 2.75768e+02 290.290 6.29519e+00  -1.70272e+01 0.00000e+00 0.00000e+00 4.74323e+02 290.290 1.98556e+02 290.290 0.9721 
1 1 1 6   57  1  o 7  1.40327e+01 5.08693e-01 8.28752e+01 109.253 -1.26746e+00 3.62881e+00  0.00000e+00 0.00000e+00 3.68448e+02 109.253 2.85573e+02 109.253 0.8572 
1 1 1 6   57  2  o 16 2.38926e+01 5.52131e-01 3.80856e+02 115.278 -1.34510e+01 2.84843e+01  0.00000e+00 0.00000e+00 5.01347e+02 115.278 1.20491e+02 115.278 0.9840 
1 1 1 6   57  3  o 16 3.85653e+01 7.10130e-01 7.36850e+02 347.775 1.17764e+02  -2.55150e+01 0.00000e+00 0.00000e+00 7.04396e+02 347.775 3.24542e+01 167.775 0.9958 
1 1 1 6   57  4  o 9  4.17924e+00 1.01672e+00 1.00589e+02 55.922  1.02184e+00  1.51051e+00  0.00000e+00 0.00000e+00 3.95928e+00 55.922  9.66297e+01 235.922 0.6666 
1 1 1 6   57  5  o 11 2.17023e+01 6.92091e-01 4.83627e+02 170.092 -5.15881e+01 9.01122e+00  0.00000e+00 0.00000e+00 3.22991e+02 170.092 1.60637e+02 350.092 0.9904 
1 1 1 6   57  6  o 11 6.29434e+00 9.74920e-01 4.29367e+01 38.318  1.21611e+00  9.61042e-01  0.00000e+00 0.00000e+00 1.00726e+02 38.318  5.77888e+01 38.318  0.6083 
1 1 1 6   57  7  o 1  1.99996e+01 8.30797e-01 3.42908e+02 227.558 -3.30842e+01 -3.61783e+01 0.00000e+00 0.00000e+00 3.99747e+02 227.558 5.68390e+01 227.558 0.9897 
1 1 1 6   57  8  o 6  3.18466e+00 1.01713e+00 9.84621e+01 245.901 -1.00332e+00 -2.24305e+00 0.00000e+00 0.00000e+00 7.64406e+00 65.901  1.06106e+02 65.901  0.7603 
1 1 1 6   57  9  o 8  1.16404e+01 9.22361e-01 2.11371e+02 12.128  2.36250e+01  5.07704e+00  0.00000e+00 0.00000e+00 2.16009e+02 12.128  4.63776e+00 12.128  0.9791 
1 1 1 6   57  10 o 6  1.78039e+01 8.94469e-01 2.62752e+02 317.433 3.76857e+01  -3.46141e+01 0.00000e+00 0.00000e+00 3.98104e+02 317.433 1.35352e+02 317.433 0.9902 
1 1 1 6   57  11 o 5  5.40371e+00 1.26427e+00 9.66157e+01 124.587 -3.14806e+00 4.56555e+00  0.00000e+00 0.00000e+00 8.65677e+01 124.587 1.00480e+01 304.587 0.9047 
1 1 1 6   57  12 o 16 5.81228e+00 1.36094e+00 1.13616e+02 262.343 -9.88420e-01 -7.35188e+00 0.00000e+00 0.00000e+00 8.88257e+01 262.343 2.47898e+01 82.343  0.9299 
1 1 1 6   57  13 o 15 9.33891e+00 1.47707e+00 2.04918e+02 297.893 1.02119e+01  -1.92926e+01 0.00000e+00 0.00000e+00 1.36580e+02 297.893 6.83380e+01 117.893 0.9768 
1 1 1 6   57  14 f 0  3.97143e+00 1.30296e+00 9.12410e+01 191.464 -4.68603e+00 -9.50326e-01 0.00000e+00 0.00000e+00 4.07096e+01 191.464 5.05313e+01 11.464  0.8881 
1 1 1 6   58  0  o 4  5.36432e+01 8.89274e-01 9.12624e+02 173.633 -1.67806e+02 1.87250e+01  0.00000e+00 0.00000e+00 1.09328e+03 173.633 1.80660e+02 173.633 0.9970 
1 1 1 6   58  1  o 17 1.96357e+01 5.13416e-01 3.17552e+02 111.629 -7.97738e+00 2.01192e+01  0.00000e+00 0.00000e+00 4.01814e+02 111.629 8.42620e+01 111.629 0.9766 
1 1 1 6   58  2  o 15 3.99483e+01 7.18287e-01 7.27242e+02 326.407 9.34114e+01  -6.20452e+01 0.00000e+00 0.00000e+00 7.64853e+02 326.407 3.76105e+01 326.407 0.9955 
1 1 1 6   58  3  o 12 2.64638e+01 5.78753e-01 5.43538e+02 83.070  7.40748e+00  6.09404e+01  0.00000e+00 0.00000e+00 4.41306e+02 83.070  1.02232e+02 263.069 0.9918 
1 1 1 6   58  4  o 12 1.65334e+01 6.70157e-01 2.42155e+02 291.457 7.01920e+00  -1.78587e+01 0.00000e+00 0.00000e+00 3.61835e+02 291.457 1.19680e+02 291.457 0.9736 
1 1 1 6   58  5  o 4  1.34023e+01 7.30195e-01 2.25191e+02 344.052 1.69736e+01  -4.85050e+00 0.00000e+00 0.00000e+00 2.63224e+02 344.052 3.80331e+01 344.052 0.9713 
1 1 1 6   58  6  o 11 1.77595e+01 7.93613e-01 4.11999e+02 243.350 -1.98285e+01 -3.95101e+01 0.00000e+00 0.00000e+00 2.46723e+02 243.350 1.65276e+02 63.350  0.9886 
1 1 1 6   58  7  o 16 1.58993e+01 8.56512e-01 3.32526e+02 277.405 4.74124e+00  -3.64793e+01 0.00000e+00 0.00000e+00 2.55727e+02 277.405 7.67986e+01 97.405  0.9863 
1 1 1 6   58  8  o 9  4.04628e+00 1.11727e+00 7.23118e+01 286.945 6.75974e-01  -2.21861e+00 0.00000e+00 0.00000e+00 4.05654e+01 286.945 3.17464e+01 106.945 0.7438 
1 1 1 6   58  9  o 11 8.18764e+00 1.02631e+00 1.38628e+02 16.752  1.01128e+01  3.04402e+00  0.00000e+00 0.00000e+00 1.53439e+02 16.752  1.48111e+01 16.752  0.9514 
1 1 1 6   58  10 o 6  1.23903e+01 8.87427e-01 2.88191e+02 195.999 -3.95370e+01 -1.13367e+01 0.00000e+00 0.00000e+00 1.70528e+02 195.999 1.17663e+02 15.999  0.9878 
1 1 1 6   58  11 o 17 1.18733e+01 1.04296e+00 2.04617e+02 276.549 3.23309e+00  -2.81613e+01 0.00000e+00 0.00000e+00 2.32308e+02 276.549 2.76903e+01 276.549 0.9822 
1 1 1 6   58  12 o 5  4.58589e+00 1.17866e+00 4.04142e+01 17.658  2.19386e+00  6.98392e-01  0.00000e+00 0.00000e+00 8.69575e+01 17.658  4.65432e+01 17.658  0.7417 
1 1 1 6   58  13 o 4  8.34521e+00 1.58430e+00 1.45124e+02 168.156 -1.25951e+01 2.64128e+00  0.00000e+00 0.00000e+00 1.54837e+02 168.156 9.71279e+00 168.156 0.9603 
1 1 1 6   58  14 o 9  3.92990e+00 1.30620e+00 5.37792e+01 145.784 -2.24197e+00 1.52458e+00  0.00000e+00 0.00000e+00 6.17894e+01 145.784 8.01023e+00 145.784 0.7861 
1 1 1 6   59  0  o 1  1.90581e+01 5.64913e-01 3.95477e+02 121.886 -1.37291e+01 2.20688e+01  0.00000e+00 0.00000e+00 3.05293e+02 121.886 9.01843e+01 301.886 0.9806 
1 1 1 6   59  1  o 8  1.99709e+01 5.15093e-01 4.64249e+02 47.382  2.46777e+01  2.68199e+01  0.00000e+00 0.00000e+00 2.74444e+02 47.382  1.89805e+02 227.382 0.9862 
1 1 1 6   59  2  o 7  2.96310e+01 7.46424e-01 4.03748e+02 191.441 -4.93731e+01 -9.99178e+00 0.00000e+00 0.00000e+00 6.96692e+02 191.441 2.92944e+02 191.441 0.9900 
1 1 1 6   59  3  o 5  8.94174e+00 6.43953e-01 1.63306e+02 359.444 6.67436e+00  -6.47942e-02 0.00000e+00 0.00000e+00 1.45886e+02 359.444 1.74205e+01 179.444 0.9217 
1 1 1 6   59  4  o 3  1.87696e+01 7.19141e-01 3.82715e+02 24.847  3.02416e+01  1.40036e+01  0.00000e+00 0.00000e+00 3.10813e+02 24.847  7.19026e+01 204.847 0.9849 
1 1 1 6   59  5  o 5  1.38069e+01 7.11137e-01 1.71832e+02 260.145 -2.28153e+00 -1.31335e+01 0.00000e+00 0.00000e+00 3.26316e+02 260.145 1.54484e+02 260.145 0.9617 
1 1 1 6   59  6  o 3  1.31575e+01 7.83488e-01 2.57417e+02 114.589 -9.64117e+00 2.10690e+01  0.00000e+00 0.00000e+00 2.25374e+02 114.589 3.20429e+01 294.589 0.9782 
1 1 1 6   59  7  o 10 7.55434e+00 1.19679e+00 1.80877e+02 225.170 -6.89955e+00 -6.94072e+00 0.00000e+00 0.00000e+00 8.75662e+01 225.170 9.33104e+01 45.170  0.9474 
1 1 1 6   59  8  o 18 5.18604e+00 1.10866e+00 1.30038e+02 34.037  4.43650e+00  2.99665e+00  0.00000e+00 0.00000e+00 4.51734e+01 34.037  8.48644e+01 214.037 0.9010 
1 1 1 6   59  9  o 19 7.58756e+00 1.06758e+00 1.96116e+02 129.665 -9.04661e+00 1.09102e+01  0.00000e+00 0.00000e+00 7.80973e+01 129.665 1.18019e+02 309.665 0.9640 
1 1 1 6   59  10 o 11 4.63709e+00 1.17506e+00 6.69302e+01 248.725 -1.18983e+00 -3.05565e+00 0.00000e+00 0.00000e+00 7.70728e+01 248.725 1.01426e+01 248.725 0.8287 
1 1 1 6   59  11 o 5  5.78664e+00 1.27482e+00 5.70427e+01 142.682 -2.81373e+00 2.14491e+00  0.00000e+00 0.00000e+00 1.25706e+02 142.682 6.86634e+01 142.682 0.8431 
1 1 1 6   59  12 o 10 3.55567e+00 1.12898e+00 7.42835e+01 114.718 -1.40872e+00 3.06020e+00  0.00000e+00 0.00000e+00 3.67433e+01 114.718 3.75401e+01 294.718 0.8339 
1 1 1 6   59  13 o 7  6.97188e+00 1.57207e+00 8.28558e+01 99.166  -9.64136e-01 5.97518e+00  0.00000e+00 0.00000e+00 1.55398e+02 99.166  7.25422e+01 99.166  0.9132 
1 1 1 6   59  14 o 2  3.87778e+00 1.28721e+00 1.98909e+01 196.306 -1.00317e+00 -2.93465e-01 0.00000e+00 0.00000e+00 4.71412e+01 196.306 2.72504e+01 196.306 0.4622 
1 1 1 6   60  0  f 0  1.28194e+01 6.85893e-01 1.62706e+02 191.395 -8.69230e+00 -1.75182e+00 0.00000e+00 0.00000e+00 2.89954e+02 191.395 1.27247e+02 191.395 0.9418 
1 1 1 6   60  1  o 9  1.38340e+01 5.11367e-01 2.40517e+02 250.609 -4.76200e+00 -1.35292e+01 0.00000e+00 0.00000e+00 2.59841e+02 250.609 1.93234e+01 250.609 0.9645 
1 1 1 6   60  2  o 18 7.80688e+00 7.73626e-01 1.88499e+02 284.944 1.63327e+00  -6.11927e+00 0.00000e+00 0.00000e+00 8.00769e+01 284.944 1.08422e+02 104.944 0.9172 
1 1 1 6   60  3  o 18 1.25914e+01 6.49592e-01 1.72042e+02 310.685 6.78592e+00  -7.89345e+00 0.00000e+00 0.00000e+00 2.76963e+02 310.685 1.04922e+02 310.685 0.9507 
1 1 1 6   60  4  o 4  2.31290e+01 6.72009e-01 3.54619e+02 358.338 4.40490e+01  -1.27832e+00 0.00000e+00 0.00000e+00 5.03062e+02 358.338 1.48443e+02 358.338 0.9886 
1 1 1 6   60  5  o 10 2.05227e+01 6.02278e-01 3.64594e+02 162.259 -4.36669e+01 1.39706e+01  0.00000e+00 0.00000e+00 3.96759e+02 162.259 3.21650e+01 162.259 0.9890 
1 1 1 6   60  6  f 0  1.47172e+01 7.61790e-01 2.83264e+02 66.282  1.21091e+01  2.75622e+01  0.00000e+00 0.00000e+00 2.59469e+02 66.282  2.37954e+01 246.282 0.9832 
1 1 1 6   60  7  f 0  3.40877e+00 1.01789e+00 1.25258e+02 331.515 2.68835e+00  -1.45875e+00 0.00000e+00 0.00000e+00 2.11759e+01 151.515 1.46434e+02 151.515 0.8142 
1 1 1 6   60  8  o 7  1.19331e+01 7.75215e-01 1.99545e+02 147.772 -1.85628e+01 1.17022e+01  0.00000e+00 0.00000e+00 2.37535e+02 147.772 3.79900e+01 147.772 0.9769 
1 1 1 6   60  9  o 2  5.33701e+00 1.06114e+00 7.96708e+01 58.568  2.15232e+00  3.52167e+00  0.00000e+00 0.00000e+00 9.40120e+01 58.568  1.43412e+01 58.568  0.8682 
1 1 1 6   60  10 o 15 5.50118e+00 1.11565e+00 1.12874e+02 214.966 -5.25322e+00 -3.67372e+00 0.00000e+00 0.00000e+00 7.64078e+01 214.966 3.64660e+01 34.966  0.9183 
1 1 1 6   60  11 o 17 4.37629e+00 1.22903e+00 9.14907e+01 308.382 2.85070e+00  -3.59898e+00 0.00000e+00 0.00000e+00 5.32327e+01 308.382 3.82580e+01 128.382 0.8830 
1 1 1 6   60  12 o 12 4.31684e+00 1.26059e+00 9.93743e+01 132.500 -3.54785e+00 3.87185e+00  0.00000e+00 0.00000e+00 4.58959e+01 132.500 5.34784e+01 312.500 0.8989 
1 1 1 6   60  13 o 11 8.05579e+00 1.58472e+00 1.89812e+02 350.704 1.65204e+01  -2.70415e+00 0.00000e+00 0.00000e+00 1.02465e+02 350.704 8.73472e+01 170.704 0.9697 
1 1 1 6   60  14 o 1  6.20862e+00 1.66545e+00 8.76485e+01 101.655 -1.17294e+00 5.68664e+00  0.00000e+00 0.00000e+00 1.23452e+02 101.655 3.58035e+01 101.655 0.9092 
1 1 1 6   61  0  o 18 2.91149e+01 5.58488e-01 4.83742e+02 23.718  5.51060e+01  2.42109e+01  0.00000e+00 0.00000e+00 5.98566e+02 23.718  1.14824e+02 23.718  0.9917 
1 1 1 6   61  1  o 5  2.99186e+01 5.97792e-01 6.36286e+02 152.008 -7.37625e+01 3.92063e+01  0.00000e+00 0.00000e+00 4.78756e+02 152.008 1.57531e+02 332.008 0.9940 
1 1 1 6   61  2  o 17 1.93999e+01 5.26888e-01 5.30391e+02 259.420 -8.70875e+00 -4.66237e+01 0.00000e+00 0.00000e+00 1.89393e+02 259.420 3.40998e+02 79.420  0.9894 
1 1 1 6   61  3  o 18 3.38207e+01 7.64818e-01 5.95286e+02 230.060 -5.96213e+01 -7.12049e+01 0.00000e+00 0.00000e+00 6.66255e+02 230.060 7.09690e+01 230.060 0.9946 
1 1 1 6   61  4  o 8  2.17117e+01 6.71535e-01 4.09840e+02 98.214  -7.48513e+00 5.18552e+01  0.00000e+00 0.00000e+00 3.96634e+02 98.214  1.32059e+01 278.214 0.9904 
1 1 1 6   61  5  o 2  1.37070e+01 9.03220e-01 2.01168e+02 53.066  9.80818e+00  1.30473e+01  0.00000e+00 0.00000e+00 2.96883e+02 53.066  9.57148e+01 53.066  0.9689 
1 1 1 6   61  6  o 15 1.33734e+01 7.80591e-01 2.16037e+02 179.234 -2.08467e+01 2.78828e-01  0.00000e+00 0.00000e+00 2.73279e+02 179.234 5.72428e+01 179.234 0.9757 
1 1 1 6   61  7  o 4  2.97502e+00 8.99997e-01 1.43019e+02 174.741 -3.43607e+00 3.16301e-01  0.00000e+00 0.00000e+00 4.94906e+01 354.741 1.92509e+02 354.741 0.8385 
1 1 1 6   61  8  o 14 5.74438e+00 1.07144e+00 1.11585e+02 222.579 -4.02012e+00 -3.69404e+00 0.00000e+00 0.00000e+00 8.28705e+01 222.579 2.87149e+01 42.580  0.9031 
1 1 1 6   61  9  o 7  1.13079e+01 8.63943e-01 2.37961e+02 173.917 -2.62085e+01 2.79278e+00  0.00000e+00 0.00000e+00 1.77688e+02 173.917 6.02729e+01 353.917 0.9808 
1 1 1 6   61  10 f 0  1.07330e+01 9.49138e-01 1.11231e+02 326.894 1.15698e+01  -7.54403e+00 0.00000e+00 0.00000e+00 2.76014e+02 326.894 1.64783e+02 326.894 0.9631 
1 1 1 6   61  11 o 1  4.65575e+00 1.26328e+00 7.37268e+01 54.021  2.19884e+00  3.02876e+00  0.00000e+00 0.00000e+00 7.49642e+01 54.021  1.23741e+00 54.021  0.8528 
1 1 1 6   61  12 o 19 5.97244e+00 1.41967e+00 1.11058e+02 0.690   7.65280e+00  9.22195e-02  0.00000e+00 0.00000e+00 9.73295e+01 0.690   1.37286e+01 180.690 0.9322 
1 1 1 6   61  13 o 19 4.42091e+00 1.34880e+00 7.19930e+01 157.864 -3.88332e+00 1.57973e+00  0.00000e+00 0.00000e+00 7.19837e+01 157.864 9.26257e-03 337.864 0.8705 
1 1 1 6   61  14 o 16 6.23414e+00 1.76768e+00 5.79083e+01 322.161 2.89121e+00  -2.24578e+00 0.00000e+00 0.00000e+00 1.40004e+02 322.161 8.20958e+01 322.161 0.8491 
1 1 1 6   62  0  o 11 5.78977e+00 6.99336e-01 1.44945e+02 30.679  3.27560e+00  1.94325e+00  0.00000e+00 0.00000e+00 4.07513e+01 30.679  1.04194e+02 210.678 0.8557 
1 1 1 6   62  1  o 4  7.95247e+00 6.81358e-01 1.22424e+02 326.886 3.69784e+00  -2.41186e+00 0.00000e+00 0.00000e+00 1.39260e+02 326.886 1.68362e+01 326.886 0.8778 
1 1 1 6   62  2  o 1  1.27387e+01 6.41415e-01 2.10330e+02 266.344 -8.02645e-01 -1.25625e+01 0.00000e+00 0.00000e+00 2.47910e+02 266.344 3.75802e+01 266.344 0.9594 
1 1 1 6   62  3  o 17 2.02806e+01 6.37873e-01 3.13911e+02 62.424  1.59042e+01  3.04527e+01  0.00000e+00 0.00000e+00 4.35399e+02 62.424  1.21488e+02 62.424  0.9853 
1 1 1 6   62  4  o 10 3.51027e+01 7.99724e-01 6.54878e+02 9.427   1.26584e+02  2.10183e+01  0.00000e+00 0.00000e+00 6.56266e+02 9.427   1.38873e+00 9.427   0.9961 
1 1 1 6   62  5  o 3  6.78836e+00 1.00287e+00 1.19041e+02 230.669 -3.22879e+00 -3.94043e+00 0.00000e+00 0.00000e+00 1.08908e+02 230.669 1.01331e+01 50.669  0.8955 
1 1 1 6   62  6  o 1  1.01284e+01 8.65359e-01 2.06255e+02 149.911 -1.32245e+01 7.66272e+00  0.00000e+00 0.00000e+00 1.60851e+02 149.911 4.54044e+01 329.911 0.9667 
1 1 1 6   62  7  o 9  5.43998e+00 1.03814e+00 1.68689e+02 180.589 -7.46710e+00 -7.67926e-02 0.00000e+00 0.00000e+00 2.10499e+01 180.589 1.47639e+02 0.589   0.9304 
1 1 1 6   62  8  o 19 4.77249e+00 1.02227e+00 1.22074e+02 59.878  2.76893e+00  4.77242e+00  0.00000e+00 0.00000e+00 3.96496e+01 59.878  8.24248e+01 239.878 0.9041 
1 1 1 6   62  9  o 1  3.53187e+00 1.04505e+00 1.43596e+02 172.670 -5.19469e+00 6.68258e-01  0.00000e+00 0.00000e+00 2.46779e+01 352.669 1.68274e+02 352.669 0.8986 
1 1 1 6   62  10 o 10 1.41432e+01 8.80714e-01 1.60538e+02 323.837 2.31675e+01  -1.69328e+01 0.00000e+00 0.00000e+00 3.59899e+02 323.837 1.99361e+02 323.837 0.9824 
1 1 1 6   62  11 o 9  7.29627e+00 1.21003e+00 1.39151e+02 319.764 9.62801e+00  -8.14662e+00 0.00000e+00 0.00000e+00 1.22966e+02 319.764 1.61857e+01 139.764 0.9595 
1 1 1 6   62  12 o 8  7.91695e+00 1.31659e+00 9.83008e+01 31.338  7.68970e+00  4.68245e+00  0.00000e+00 0.00000e+00 1.81009e+02 31.338  8.27085e+01 31.338  0.9427 
1 1 1 6   62  13 o 1  6.12900e+00 1.60889e+00 1.09886e+02 274.412 5.60294e-01  -7.26155e+00 0.00000e+00 0.00000e+00 1.02990e+02 274.412 6.89619e+00 94.412  0.9286 
1 1 1 6   62  14 o 13 4.66851e+00 1.49906e+00 1.16419e+02 60.642  3.27284e+00  5.81823e+00  0.00000e+00 0.00000e+00 4.44405e+01 60.642  7.19788e+01 240.642 0.9217 
1 1 1 6   63  0  o 16 2.25478e+01 5.92028e-01 3.03258e+02 202.091 -3.06099e+01 -1.24241e+01 0.00000e+00 0.00000e+00 5.28801e+02 202.091 2.25543e+02 202.091 0.9847 
1 1 1 6   63  1  f 0  1.44985e+01 4.95445e-01 3.91847e+02 57.438  1.45717e+01  2.28181e+01  0.00000e+00 0.00000e+00 1.41449e+02 57.438  2.50397e+02 237.438 0.9814 
1 1 1 6   63  2  f 0  1.73794e+01 6.17734e-01 2.13146e+02 199.733 -1.75667e+01 -6.30107e+00 0.00000e+00 0.00000e+00 4.20655e+02 199.733 2.07509e+02 199.733 0.9728 
1 1 1 6   63  3  o 8  1.47107e+01 6.48110e-01 2.80025e+02 36.983  1.94352e+01  1.46363e+01  0.00000e+00 0.00000e+00 2.60031e+02 36.983  1.99941e+01 216.983 0.9792 
1 1 1 6   63  4  o 13 1.12534e+01 7.20247e-01 1.94968e+02 323.607 1.05989e+01  -7.81209e+00 0.00000e+00 0.00000e+00 2.10589e+02 323.607 1.56206e+01 323.607 0.9612 
1 1 1 6   63  5  o 2  1.23178e+01 7.38917e-01 2.09010e+02 143.410 -1.49964e+01 1.11331e+01  0.00000e+00 0.00000e+00 2.40250e+02 143.410 3.12396e+01 143.410 0.9729 
1 1 1 6   63  6  o 7  8.82309e+00 9.30207e-01 2.21858e+02 330.580 1.31849e+01  -7.43536e+00 0.00000e+00 0.00000e+00 9.77722e+01 330.580 1.24086e+02 150.580 0.9664 
1 1 1 6   63  7  o 11 9.68976e+00 7.34213e-01 1.79941e+02 273.851 1.03619e+00  -1.53915e+01 0.00000e+00 0.00000e+00 1.71265e+02 273.851 8.67577e+00 93.851  0.9670 
1 1 1 6   63  8  o 1  9.74643e+00 8.61581e-01 1.78137e+02 164.277 -1.64160e+01 4.62156e+00  0.00000e+00 0.00000e+00 1.76215e+02 164.277 1.92268e+00 344.277 0.9702 
1 1 1 6   63  9  o 13 1.84928e+01 7.66797e-01 2.97875e+02 87.263  3.16671e+00  6.62418e+01  0.00000e+00 0.00000e+00 3.89668e+02 87.263  9.17932e+01 87.263  0.9924 
1 1 1 6   63  10 o 17 7.70294e+00 1.15477e+00 6.97429e+01 7.224   6.16264e+00  7.81131e-01  0.00000e+00 0.00000e+00 1.94364e+02 7.224   1.24621e+02 7.224   0.9155 
1 1 1 6   63  11 o 3  4.40594e+00 1.24683e+00 7.85582e+01 13.502  4.03512e+00  9.68870e-01  0.00000e+00 0.00000e+00 6.47783e+01 13.502  1.37799e+01 193.502 0.8690 
1 1 1 6   63  12 o 11 8.85483e+00 1.62740e+00 1.53539e+02 4.115   1.33983e+01  9.63942e-01  0.00000e+00 0.00000e+00 1.65206e+02 4.115   1.16676e+01 4.115   0.9620 
1 1 1 6   63  13 o 16 5.92723e+00 1.56094e+00 8.97478e+01 128.666 -3.53303e+00 4.41533e+00  0.00000e+00 0.00000e+00 1.11224e+02 128.666 2.14761e+01 128.666 0.9066 
1 1 1 6   63  14 o 6  3.83124e+00 1.30142e+00 3.15151e+01 16.315  1.67765e+00  4.91071e-01  0.00000e+00 0.00000e+00 6.18134e+01 16.315  3.02982e+01 16.315  0.6517 
1 1 1 6   64  0  o 7  3.07595e+01 6.89119e-01 4.45850e+02 213.072 -5.75417e+01 -3.74716e+01 0.00000e+00 0.00000e+00 6.98197e+02 213.072 2.52347e+02 213.072 0.9927 
1 1 1 6   64  1  o 12 1.29360e+01 5.69956e-01 2.46165e+02 357.958 1.61091e+01  -5.74372e-01 0.00000e+00 0.00000e+00 2.23324e+02 357.958 2.28417e+01 177.958 0.9685 
1 1 1 6   64  2  o 17 1.37218e+01 7.52822e-01 3.76566e+02 306.342 1.78385e+01  -2.42470e+01 0.00000e+00 0.00000e+00 1.29120e+02 306.342 2.47446e+02 126.342 0.9832 
1 1 1 6   64  3  o 11 1.04645e+01 7.30355e-01 1.86066e+02 189.563 -1.08328e+01 -1.82507e+00 0.00000e+00 0.00000e+00 1.87882e+02 189.563 1.81609e+00 189.563 0.9533 
1 1 1 6   64  4  o 17 2.20503e+01 6.92552e-01 4.25260e+02 348.310 6.18729e+01  -1.28023e+01 0.00000e+00 0.00000e+00 3.94729e+02 348.310 3.05303e+01 168.310 0.9921 
1 1 1 6   64  5  o 5  8.13095e+00 9.71688e-01 2.27855e+02 213.540 -1.06571e+01 -7.06452e+00 0.00000e+00 0.00000e+00 6.47512e+01 213.540 1.63104e+02 33.540  0.9601 
1 1 1 6   64  6  o 16 5.70032e+00 9.25410e-01 7.24088e+01 165.658 -3.18185e+00 8.13514e-01  0.00000e+00 0.00000e+00 1.04703e+02 165.658 3.22946e+01 165.658 0.8290 
1 1 1 6   64  7  o 9  1.14493e+01 8.23142e-01 1.82108e+02 101.356 -3.73351e+00 1.85891e+01  0.00000e+00 0.00000e+00 2.35475e+02 101.356 5.33679e+01 101.356 0.9733 
1 1 1 6   64  8  o 4  3.10890e+00 9.41709e-01 1.12699e+02 177.891 -3.37896e+00 1.24455e-01  0.00000e+00 0.00000e+00 1.54799e+01 357.891 1.28179e+02 357.891 0.8347 
1 1 1 6   64  9  o 9  8.95980e+00 9.82398e-01 1.46317e+02 6.399   1.49982e+01  1.68211e+00  0.00000e+00 0.00000e+00 1.77965e+02 6.399   3.16478e+01 6.399   0.9663 
1 1 1 6   64  10 f 0  1.09356e+01 1.00434e+00 1.40772e+02 339.202 1.70649e+01  -6.48166e+00 0.00000e+00 0.00000e+00 2.57313e+02 339.202 1.16541e+02 339.202 0.9722 
1 1 1 6   64  11 o 9  7.37767e+00 1.42657e+00 2.15591e+02 250.795 -5.62529e+00 -1.61489e+01 0.00000e+00 0.00000e+00 5.23435e+01 250.795 1.63247e+02 70.795  0.9703 
1 1 1 6   64  12 o 17 3.57388e+00 1.18773e+00 3.77246e+01 347.161 1.79373e+00  -4.08811e-01 0.00000e+00 0.00000e+00 5.18051e+01 347.161 1.40805e+01 347.161 0.6696 
1 1 1 6   64  13 o 14 3.95392e+00 1.20786e+00 5.01187e+01 257.559 -5.98931e-01 -2.71472e+00 0.00000e+00 0.00000e+00 6.70184e+01 257.559 1.68997e+01 257.559 0.7923 
1 1 1 6   64  14 o 7  4.11491e+00 1.32759e+00 5.16387e+01 201.949 -2.84354e+00 -1.14590e+00 0.00000e+00 0.00000e+00 7.36450e+01 201.949 2.20063e+01 201.949 0.8147 
1 1 1 6   65  0  o 2  2.65620e+01 6.39631e-01 4.66400e+02 204.439 -6.07490e+01 -2.76065e+01 0.00000e+00 0.00000e+00 5.21141e+02 204.439 5.47414e+01 204.439 0.9925 
1 1 1 6   65  1  o 2  3.89326e+01 8.10391e-01 7.99955e+02 61.283  8.62748e+01  1.57476e+02  0.00000e+00 0.00000e+00 6.54722e+02 61.283  1.45233e+02 241.283 0.9972 
1 1 1 6   65  2  o 4  1.56714e+01 6.94572e-01 1.76939e+02 291.272 5.66109e+00  -1.45409e+01 0.00000e+00 0.00000e+00 3.91190e+02 291.272 2.14251e+02 291.272 0.9674 
1 1 1 6   65  3  o 2  4.27480e+00 9.03178e-01 1.48781e+02 221.704 -2.75569e+00 -2.45555e+00 0.00000e+00 0.00000e+00 1.25257e+01 41.704  1.61307e+02 41.704  0.8505 
1 1 1 6   65  4  o 19 1.00894e+01 1.06919e+00 2.16482e+02 17.271  1.33266e+01  4.14332e+00  0.00000e+00 0.00000e+00 1.47843e+02 17.271  6.86395e+01 197.271 0.9635 
1 1 1 6   65  5  o 19 4.20728e+00 1.51180e+00 7.82822e+01 162.907 -1.90160e+00 5.84753e-01  0.00000e+00 0.00000e+00 3.14674e+01 162.907 4.68148e+01 342.907 0.6960 
1 1 1 6   65  6  o 19 4.08644e+00 1.01744e+00 8.38019e+01 333.859 2.40435e+00  -1.18001e+00 0.00000e+00 0.00000e+00 3.61136e+01 333.859 4.76883e+01 153.859 0.7831 
1 1 1 6   65  7  o 5  5.63917e+00 1.06509e+00 1.18860e+02 134.082 -3.97894e+00 4.10848e+00  0.00000e+00 0.00000e+00 7.29398e+01 134.082 4.59202e+01 314.082 0.9078 
1 1 1 6   65  8  o 1  4.16481e+00 1.04458e+00 7.04681e+01 279.052 4.26089e-01  -2.67445e+00 0.00000e+00 0.00000e+00 5.21367e+01 279.052 1.83313e+01 99.052  0.7859 
1 1 1 6   65  9  o 12 8.11237e+00 1.23007e+00 1.59363e+02 50.641  8.04511e+00  9.80874e+00  0.00000e+00 0.00000e+00 1.32209e+02 50.641  2.71540e+01 230.641 0.9597 
1 1 1 6   65  10 o 3  5.42722e+00 1.32468e+00 5.38026e+01 203.155 -2.92758e+00 -1.25204e+00 0.00000e+00 0.00000e+00 1.13356e+02 203.155 5.95531e+01 203.155 0.8227 
1 1 1 6   65  11 o 19 3.19789e+00 1.05237e+00 2.64167e+01 92.172  -4.25271e-02 1.12155e+00  0.00000e+00 0.00000e+00 3.19905e+01 92.172  5.57385e+00 92.172  0.4881 
1 1 1 6   65  12 o 2  4.42041e+00 1.32537e+00 7.31928e+01 61.494  1.96241e+00  3.61338e+00  0.00000e+00 0.00000e+00 7.02737e+01 61.494  2.91902e+00 241.494 0.8677 
1 1 1 6   65  13 o 14 6.07484e+00 1.54108e+00 1.30969e+02 234.260 -5.43875e+00 -7.55764e+00 0.00000e+00 0.00000e+00 8.35723e+01 234.260 4.73971e+01 54.260  0.9447 
1 1 1 6   65  14 f 0  5.13851e+00 1.50451e+00 4.31509e+01 56.730  1.54520e+00  2.35500e+00  0.00000e+00 0.00000e+00 1.09571e+02 56.730  6.64198e+01 56.730  0.7955 
1 1 1 6   66  0  o 1  1.61171e+01 5.74323e-01 2.31540e+02 55.954  1.19743e+01  1.77218e+01  0.00000e+00 0.00000e+00 3.57819e+02 55.954  1.26279e+02 55.954  0.9763 
1 1 1 6   66  1  o 1  1.60841e+01 7.00671e-01 2.90163e+02 285.036 6.80184e+00  -2.53212e+01 0.00000e+00 0.00000e+00 3.00771e+02 285.036 1.06082e+01 285.036 0.9807 
1 1 1 6   66  2  o 4  2.64332e+01 8.20391e-01 4.47107e+02 340.311 6.57404e+01  -2.35239e+01 0.00000e+00 0.00000e+00 5.36156e+02 340.311 8.90493e+01 340.311 0.9928 
1 1 1 6   66  3  o 6  1.36643e+01 6.75132e-01 2.24899e+02 230.449 -1.32139e+01 -1.60006e+01 0.00000e+00 0.00000e+00 2.74618e+02 230.449 4.97188e+01 230.449 0.9756 
1 1 1 6   66  4  o 7  2.04904e+01 9.18348e-01 4.57564e+02 270.711 8.14492e-01  -6.56452e+01 0.00000e+00 0.00000e+00 3.04375e+02 270.711 1.53189e+02 90.711  0.9924 
1 1 1 6   66  5  o 6  6.48023e+00 1.50262e+00 1.22654e+02 178.005 -4.89591e+00 1.70500e-01  0.00000e+00 0.00000e+00 9.36928e+01 178.005 2.89607e+01 358.005 0.8910 
1 1 1 6   66  6  o 1  6.49340e+00 1.01143e+00 1.02643e+02 35.402  4.45000e+00  3.16264e+00  0.00000e+00 0.00000e+00 1.17058e+02 35.402  1.44153e+01 35.402  0.9030 
1 1 1 6   66  7  o 10 3.18145e+00 9.75420e-01 1.10802e+02 220.406 -2.58349e+00 -2.19920e+00 0.00000e+00 0.00000e+00 1.12500e+01 40.406  1.22052e+02 40.406  0.8353 
1 1 1 6   66  8  o 16 4.30407e+00 1.13301e+00 1.75728e+02 149.325 -6.21498e+00 3.68647e+00  0.00000e+00 0.00000e+00 2.61389e+01 329.325 2.01867e+02 329.325 0.9280 
1 1 1 6   66  9  o 4  1.60709e+01 9.11362e-01 2.80732e+02 84.105  5.44126e+00  5.26989e+01  0.00000e+00 0.00000e+00 3.15298e+02 84.105  3.45657e+01 84.105  0.9905 
1 1 1 6   66  10 o 16 1.76275e+01 9.85683e-01 3.85566e+02 299.617 4.26118e+01  -7.49574e+01 0.00000e+00 0.00000e+00 2.70392e+02 299.617 1.15174e+02 119.617 0.9942 
1 1 1 6   66  11 o 17 7.98183e+00 1.45260e+00 1.68642e+02 89.735  6.80605e-02  1.47197e+01  0.00000e+00 0.00000e+00 1.19669e+02 89.735  4.89732e+01 269.735 0.9654 
1 1 1 6   66  12 o 6  4.67754e+00 1.17667e+00 6.50051e+01 54.495  2.34792e+00  3.29100e+00  0.00000e+00 0.00000e+00 8.63342e+01 54.495  2.13290e+01 54.495  0.8651 
1 1 1 6   66  13 o 16 6.52294e+00 1.45424e+00 1.00217e+02 343.245 7.60133e+00  -2.28840e+00 0.00000e+00 0.00000e+00 1.27680e+02 343.245 2.74635e+01 343.245 0.9347 
1 1 1 6   66  14 o 10 5.06097e+00 1.44609e+00 6.66825e+01 185.411 -4.42116e+00 -4.18787e-01 0.00000e+00 0.00000e+00 9.94198e+01 185.411 3.27373e+01 185.411 0.8786 
1 1 1 6   67  0  o 5  1.12727e+01 6.93888e-01 1.96909e+02 68.736  4.55819e+00  1.17129e+01  0.00000e+00 0.00000e+00 2.08062e+02 68.736  1.11522e+01 68.736  0.9594 
1 1 1 6   67  1  o 5  1.26110e+01 6.98130e-01 3.64958e+02 30.772  2.38333e+01  1.41918e+01  0.00000e+00 0.00000e+00 9.87912e+01 30.772  2.66167e+02 210.772 0.9818 
1 1 1 6   67  2  o 15 1.38685e+01 7.21946e-01 1.65153e+02 239.146 -7.17435e+00 -1.20094e+01 0.00000e+00 0.00000e+00 3.35439e+02 239.146 1.70285e+02 239.146 0.9636 
1 1 1 6   67  3  o 10 1.43810e+01 9.04805e-01 2.18232e+02 74.818  5.45929e+00  2.01180e+01  0.00000e+00 0.00000e+00 3.07450e+02 74.818  8.92182e+01 74.818  0.9757 
1 1 1 6   67  4  o 2  5.44602e+00 1.29847e+00 7.19025e+01 143.463 -1.94574e+00 1.44171e+00  0.00000e+00 0.00000e+00 8.23882e+01 143.463 1.04858e+01 143.463 0.7562 
1 1 1 6   67  5  o 4  7.44808e+00 8.89886e-01 1.16833e+02 68.700  2.53700e+00  6.50704e+00  0.00000e+00 0.00000e+00 1.41370e+02 68.700  2.45369e+01 68.700  0.9254 
1 1 1 6   67  6  o 17 8.39521e+00 7.83348e-01 1.77912e+02 357.459 1.37354e+01  -6.09465e-01 0.00000e+00 0.00000e+00 1.24912e+02 357.459 5.30001e+01 177.459 0.9629 
1 1 1 6   67  7  o 10 5.37247e+00 1.29264e+00 1.39806e+02 352.431 6.48308e+00  -8.61477e-01 0.00000e+00 0.00000e+00 4.53200e+01 352.431 9.44858e+01 172.431 0.9200 
1 1 1 6   67  8  o 13 3.42846e+00 1.05334e+00 1.15793e+02 152.367 -3.79102e+00 1.98471e+00  0.00000e+00 0.00000e+00 3.65625e+00 332.367 1.19449e+02 332.367 0.8735 
1 1 1 6   67  9  o 18 7.15353e+00 1.37603e+00 1.74733e+02 70.478  4.17268e+00  1.17687e+01  0.00000e+00 0.00000e+00 8.21071e+01 70.478  9.26258e+01 250.478 0.9591 
1 1 1 6   67  10 o 1  5.07589e+00 1.15601e+00 1.23889e+02 259.699 -1.44018e+00 -7.92396e+00 0.00000e+00 0.00000e+00 5.38501e+01 259.699 7.00385e+01 79.699  0.9357 
1 1 1 6   67  11 o 19 8.58378e+00 1.14633e+00 2.39631e+02 128.096 -1.72502e+01 2.20035e+01  0.00000e+00 0.00000e+00 7.56771e+01 128.096 1.63954e+02 308.096 0.9820 
1 1 1 6   67  12 o 9  5.37346e+00 1.43788e+00 1.37325e+02 344.105 8.81509e+00  -2.51028e+00 0.00000e+00 0.00000e+00 5.22942e+01 344.105 8.50306e+01 164.105 0.9438 
1 1 1 6   67  13 f 0  3.20576e+00 1.08556e+00 6.64401e+01 97.474  -4.40002e-01 3.35375e+00  0.00000e+00 0.00000e+00 3.35626e+01 97.474  3.28775e+01 277.474 0.8347 
1 1 1 6   67  14 o 3  4.66446e+00 1.43258e+00 9.72514e+01 329.013 5.39577e+00  -3.24042e+00 0.00000e+00 0.00000e+00 6.24518e+01 329.013 3.47995e+01 149.013 0.9167 
1 1 1 6   68  0  o 16 2.07044e+01 5.88420e-01 3.38146e+02 203.470 -4.00826e+01 -1.74034e+01 0.00000e+00 0.00000e+00 4.28106e+02 203.470 8.99601e+01 203.470 0.9885 
1 1 1 6   68  1  o 18 2.50294e+01 7.70977e-01 3.86874e+02 221.016 -4.42153e+01 -3.84581e+01 0.00000e+00 0.00000e+00 5.42394e+02 221.016 1.55520e+02 221.016 0.9914 
1 1 1 6   68  2  o 4  5.04761e+00 9.73575e-01 7.67340e+01 102.125 -5.32656e-01 2.47925e+00  0.00000e+00 0.00000e+00 6.86156e+01 102.125 8.11835e+00 282.125 0.7688 
1 1 1 6   68  3  o 10 1.22589e+01 9.53254e-01 2.52390e+02 200.866 -2.00538e+01 -7.64429e+00 0.00000e+00 0.00000e+00 1.95962e+02 200.866 5.64285e+01 20.866  0.9764 
1 1 1 6   68  4  o 19 6.39379e+00 1.18851e+00 1.80079e+02 139.001 -6.23117e+00 5.41652e+00  0.00000e+00 0.00000e+00 4.44083e+01 139.001 1.35671e+02 319.001 0.9373 
1 1 1 6   68  5  o 6  3.24943e+00 8.73119e-01 8.65763e+01 2.636   2.40424e+00  1.10700e-01  0.00000e+00 0.00000e+00 5.25190e+00 2.636   8.13244e+01 182.636 0.7545 
1 1 1 6   68  6  o 18 1.73977e+01 7.07569e-01 3.29114e+02 303.528 2.99678e+01  -4.52284e+01 0.00000e+00 0.00000e+00 3.16451e+02 303.528 1.26626e+01 123.528 0.9907 
1 1 1 6   68  7  o 15 9.77522e+00 1.31817e+00 1.30874e+02 115.697 -4.63599e+00 9.63407e+00  0.00000e+00 0.00000e+00 2.17618e+02 115.697 8.67435e+01 115.697 0.9520 
1 1 1 6   68  8  o 6  2.67541e+00 8.38387e-01 5.59938e+01 69.935  6.28039e-01  1.71942e+00  0.00000e+00 0.00000e+00 1.09051e+01 69.935  4.50887e+01 249.935 0.6679 
1 1 1 6   68  9  o 2  6.11482e+00 1.03000e+00 3.98735e+01 312.506 2.02296e+00  -2.20721e+00 0.00000e+00 0.00000e+00 1.45407e+02 312.506 1.05533e+02 312.506 0.8095 
1 1 1 6   68  10 o 2  1.01769e+01 9.54540e-01 1.40130e+02 195.840 -1.91020e+01 -5.41987e+00 0.00000e+00 0.00000e+00 2.30934e+02 195.840 9.08046e+01 195.840 0.9745 
1 1 1 6   68  11 o 19 1.37259e+01 1.05044e+00 1.85190e+02 3.386   3.71078e+01  2.19538e+00  0.00000e+00 0.00000e+00 3.21224e+02 3.386   1.36033e+02 3.386   0.9865 
1 1 1 6   68  12 o 10 5.69533e+00 1.30879e+00 1.03695e+02 26.043  6.85618e+00  3.35028e+00  0.00000e+00 0.00000e+00 9.47338e+01 26.043  8.96109e+00 206.042 0.9320 
1 1 1 6   68  13 o 13 5.75083e+00 1.51626e+00 1.04362e+02 274.420 5.55973e-01  -7.19194e+00 0.00000e+00 0.00000e+00 9.50098e+01 274.420 9.35212e+00 94.420  0.9278 
1 1 1 6   68  14 o 12 4.51705e+00 1.35777e+00 1.27753e+02 182.828 -8.36415e+00 -4.13168e-01 0.00000e+00 0.00000e+00 3.05092e+01 182.828 9.72434e+01 2.828   0.9382 
1 1 1 6   69  0  o 4  6.24094e+00 7.62904e-01 9.55895e+01 291.824 1.47024e+00  -3.67133e+00 0.00000e+00 0.00000e+00 1.05732e+02 291.824 1.01430e+01 291.824 0.8618 
1 1 1 6   69  1  o 14 7.34715e+00 8.24304e-01 8.18094e+01 17.595  3.87550e+00  1.22900e+00  0.00000e+00 0.00000e+00 1.56414e+02 17.595  7.46042e+01 17.595  0.8660 
1 1 1 6   69  2  o 17 7.35331e+00 7.45230e-01 1.39492e+02 148.447 -6.31419e+00 3.87740e+00  0.00000e+00 0.00000e+00 1.16545e+02 148.447 2.29472e+01 328.447 0.9298 
1 1 1 6   69  3  o 14 3.47592e+01 1.08788e+00 5.54021e+02 324.783 1.08609e+02  -7.66638e+01 0.00000e+00 0.00000e+00 7.42799e+02 324.783 1.88778e+02 324.783 0.9962 
1 1 1 6   69  4  o 2  5.23175e+00 1.30190e+00 7.71508e+01 198.141 -2.71363e+00 -8.89108e-01 0.00000e+00 0.00000e+00 7.93443e+01 198.141 2.19351e+00 198.141 0.7987 
1 1 1 6   69  5  o 18 6.88032e+00 8.29690e-01 1.76429e+02 350.814 1.03341e+01  -1.67117e+00 0.00000e+00 0.00000e+00 6.86025e+01 350.814 1.07826e+02 170.814 0.9510 
1 1 1 6   69  6  o 6  1.67155e+01 6.85812e-01 3.49041e+02 47.372  4.16736e+01  4.52760e+01  0.00000e+00 0.00000e+00 2.71781e+02 47.372  7.72594e+01 227.372 0.9918 
1 1 1 6   69  7  o 10 1.40373e+01 1.26884e+00 2.22760e+02 250.549 -8.80695e+00 -2.49383e+01 0.00000e+00 0.00000e+00 2.92767e+02 250.549 7.00077e+01 250.549 0.9809 
1 1 1 6   69  8  o 16 5.58869e+00 1.08669e+00 1.23770e+02 80.823  1.15329e+00  7.13896e+00  0.00000e+00 0.00000e+00 7.03716e+01 80.823  5.33980e+01 260.823 0.9280 
1 1 1 6   69  9  o 16 8.89401e+00 1.00245e+00 1.30377e+02 25.185  1.28522e+01  6.04368e+00  0.00000e+00 0.00000e+00 1.90512e+02 25.185  6.01349e+01 25.185  0.9641 
1 1 1 6   69  10 o 9  5.26316e+00 1.21107e+00 1.56557e+02 78.627  1.97301e+00  9.80925e+00  0.00000e+00 0.00000e+00 3.02194e+01 78.627  1.26337e+02 258.627 0.9486 
1 1 1 6   69  11 o 11 8.68434e+00 1.22003e+00 1.45217e+02 270.353 9.75694e-02  -1.58471e+01 0.00000e+00 0.00000e+00 1.69108e+02 270.353 2.38913e+01 270.353 0.9679 
1 1 1 6   69  12 o 11 7.69557e+00 1.47649e+00 1.75428e+02 267.003 -7.90934e-01 -1.51094e+01 0.00000e+00 0.00000e+00 1.02534e+02 267.003 7.28940e+01 87.003  0.9664 
1 1 1 6   69  13 o 6  4.38036e+00 1.32651e+00 4.41755e+01 23.593  2.53777e+00  1.10838e+00  0.00000e+00 0.00000e+00 8.53228e+01 23.593  4.11473e+01 23.593  0.7914 
1 1 1 6   69  14 o 18 3.46335e+00 1.17613e+00 8.94625e+01 213.151 -4.32960e+00 -2.82795e+00 0.00000e+00 0.00000e+00 2.65526e+01 213.151 6.29099e+01 33.151  0.8972 
1 1 1 6   70  0  o 3  2.19891e+01 6.37515e-01 3.07660e+02 305.139 2.87432e+01  -4.08380e+01 0.00000e+00 0.00000e+00 5.07020e+02 305.139 1.99360e+02 305.139 0.9899 
1 1 1 6   70  1  o 8  2.44003e+00 7.67959e-01 1.05899e+02 219.330 -1.44700e+00 -1.18562e+00 0.00000e+00 0.00000e+00 4.42124e+01 39.330  1.50111e+02 39.330  0.6754 
1 1 1 6   70  2  o 16 1.02790e+01 7.26583e-01 1.60102e+02 224.520 -8.38459e+00 -8.24539e+00 0.00000e+00 0.00000e+00 2.07992e+02 224.520 4.78893e+01 224.520 0.9565 
1 1 1 6   70  3  o 10 5.13566e+00 1.26503e+00 7.57811e+01 349.744 2.67503e+00  -4.84027e-01 0.00000e+00 0.00000e+00 7.55168e+01 349.744 2.64381e-01 169.744 0.7868 
1 1 1 6   70  4  o 11 8.40998e+00 7.34439e-01 2.03402e+02 224.852 -1.02254e+01 -1.01729e+01 0.00000e+00 0.00000e+00 1.00379e+02 224.852 1.03024e+02 44.852  0.9647 
1 1 1 6   70  5  o 8  6.19879e+00 8.75259e-01 1.04539e+02 22.131  5.37597e+00  2.18634e+00  0.00000e+00 0.00000e+00 1.06484e+02 22.131  1.94513e+00 22.131  0.9092 
1 1 1 6   70  6  o 17 1.27481e+01 7.03837e-01 2.60391e+02 231.502 -2.12547e+01 -2.67226e+01 0.00000e+00 0.00000e+00 2.09843e+02 231.502 5.05474e+01 51.502  0.9852 
1 1 1 6   70  7  o 19 6.28249e+00 1.35720e+00 1.33426e+02 290.421 2.63752e+00  -7.08424e+00 0.00000e+00 0.00000e+00 8.55893e+01 290.421 4.78365e+01 110.421 0.9313 
1 1 1 6   70  8  o 18 6.57372e+00 1.04300e+00 1.06877e+02 318.823 6.09491e+00  -5.33146e+00 0.00000e+00 0.00000e+00 1.23411e+02 318.823 1.65337e+01 318.823 0.9360 
1 1 1 6   70  9  o 10 1.16960e+01 8.56473e-01 1.77950e+02 262.519 -3.72857e+00 -2.83945e+01 0.00000e+00 0.00000e+00 2.51944e+02 262.519 7.39937e+01 262.519 0.9824 
1 1 1 6   70  10 o 6  5.54834e+00 1.18637e+00 8.14106e+01 323.134 4.46912e+00  -3.35132e+00 0.00000e+00 0.00000e+00 1.06479e+02 323.134 2.50680e+01 323.134 0.9054 
1 1 1 6   70  11 o 3  1.49726e+01 1.83197e+00 2.60059e+02 296.168 1.56298e+01  -3.18085e+01 0.00000e+00 0.00000e+00 2.91769e+02 296.168 3.17100e+01 296.168 0.9858 
1 1 1 6   70  12 f 0  5.10635e+00 1.37256e+00 1.32956e+02 90.935  -1.39854e-01 8.56966e+00  0.00000e+00 0.00000e+00 4.63629e+01 90.935  8.65935e+01 270.935 0.9397 
1 1 1 6   70  13 o 14 4.72501e+00 1.37450e+00 7.64840e+01 208.065 -4.38103e+00 -2.33582e+00 0.00000e+00 0.00000e+00 8.10359e+01 208.065 4.55184e+00 208.065 0.8926 
1 1 1 6   70  14 o 11 5.35420e+00 1.52624e+00 1.30007e+02 50.528  5.91016e+00  7.17683e+00  0.00000e+00 0.00000e+00 5.87823e+01 50.528  7.12243e+01 230.528 0.9446 
1 1 1 6   71  0  o 18 1.19364e+01 5.98967e-01 1.50284e+02 232.417 -8.00920e+00 -1.04066e+01 0.00000e+00 0.00000e+00 2.79000e+02 232.417 1.28716e+02 232.417 0.9611 
1 1 1 6   71  1  o 7  1.70547e+01 6.09888e-01 2.85942e+02 188.981 -3.51109e+01 -5.54880e+00 0.00000e+00 0.00000e+00 3.43312e+02 188.981 5.73697e+01 188.981 0.9858 
1 1 1 6   71  2  o 12 1.90838e+01 7.14168e-01 3.15697e+02 74.727  1.29523e+01  4.74329e+01  0.00000e+00 0.00000e+00 3.91349e+02 74.727  7.56528e+01 74.727  0.9898 
1 1 1 6   71  3  o 12 9.30597e+00 8.40365e-01 1.79145e+02 356.101 1.35200e+01  -9.21480e-01 0.00000e+00 0.00000e+00 1.56118e+02 356.101 2.30268e+01 176.101 0.9624 
1 1 1 6   71  4  o 18 1.50793e+01 5.84220e-01 2.86416e+02 228.582 -2.61212e+01 -2.96095e+01 0.00000e+00 0.00000e+00 2.70905e+02 228.582 1.55111e+01 48.582  0.9873 
1 1 1 6   71  5  o 3  8.84116e+00 7.88325e-01 1.65118e+02 305.834 7.93814e+00  -1.09928e+01 0.00000e+00 0.00000e+00 1.53405e+02 305.834 1.17123e+01 125.834 0.9624 
1 1 1 6   71  6  o 18 1.01503e+01 7.60284e-01 1.64687e+02 19.608  1.60817e+01  5.72895e+00  0.00000e+00 0.00000e+00 2.03955e+02 19.608  3.92683e+01 19.608  0.9703 
1 1 1 6   71  7  o 19 3.76650e+00 1.07137e+00 6.80446e+01 159.049 -2.55695e+00 9.78991e-01  0.00000e+00 0.00000e+00 4.31174e+01 159.049 2.49272e+01 339.049 0.7886 
1 1 1 6   71  8  o 14 7.74544e+00 9.75904e-01 9.72572e+01 328.276 7.76808e+00  -4.80212e+00 0.00000e+00 0.00000e+00 1.76200e+02 328.276 7.89429e+01 328.276 0.9436 
1 1 1 6   71  9  o 10 6.44000e+00 1.01087e+00 7.16115e+01 274.043 4.01415e-01  -5.67894e+00 0.00000e+00 0.00000e+00 1.46963e+02 274.043 7.53514e+01 274.043 0.9073 
1 1 1 6   71  10 o 5  3.60696e+00 1.05950e+00 7.86099e+01 213.591 -3.23650e+00 -2.14958e+00 0.00000e+00 0.00000e+00 3.72483e+01 213.591 4.13615e+01 33.591  0.8590 
1 1 1 6   71  11 o 3  3.60176e+00 1.10313e+00 4.04595e+01 0.395   2.12188e+00  1.46231e-02  0.00000e+00 0.00000e+00 5.60477e+01 0.395   1.55881e+01 0.395   0.7168 
1 1 1 6   71  12 o 12 6.55644e+00 1.36160e+00 7.09935e+01 223.200 -4.48172e+00 -4.20868e+00 0.00000e+00 0.00000e+00 1.53052e+02 223.200 8.20585e+01 223.200 0.9146 
1 1 1 6   71  13 o 10 3.69017e+00 1.19841e+00 5.57335e+01 153.706 -3.03559e+00 1.49987e+00  0.00000e+00 0.00000e+00 5.93196e+01 153.706 3.58609e+00 153.706 0.8349 
1 1 1 6   71  14 o 10 4.76133e+00 1.38820e+00 2.60261e+01 31.929  1.65857e+00  1.03353e+00  0.00000e+00 0.00000e+00 9.66065e+01 31.929  7.05804e+01 31.929  0.6901 
1 1 1 6   72  0  o 19 2.41770e+01 6.65734e-01 3.89125e+02 107.758 -2.18395e+01 6.81925e+01  0.00000e+00 0.00000e+00 5.09027e+02 107.758 1.19902e+02 107.758 0.9930 
1 1 1 6   72  1  o 17 9.60642e+00 6.86831e-01 2.27764e+02 90.526  -1.64820e-01 1.79378e+01  0.00000e+00 0.00000e+00 1.21533e+02 90.526  1.06231e+02 270.526 0.9717 
1 1 1 6   72  2  o 6  1.49084e+01 7.23275e-01 2.29188e+02 42.716  1.92615e+01  1.77841e+01  0.00000e+00 0.00000e+00 3.18009e+02 42.716  8.88211e+01 42.716  0.9807 
1 1 1 6   72  3  o 14 1.76965e+01 7.40578e-01 2.84313e+02 214.914 -3.65272e+01 -2.54953e+01 0.00000e+00 0.00000e+00 3.70557e+02 214.914 8.62444e+01 214.914 0.9887 
1 1 1 6   72  4  o 12 4.17458e+00 8.94337e-01 3.96756e+01 136.478 -1.07024e+00 1.01639e+00  0.00000e+00 0.00000e+00 5.25333e+01 136.478 1.28577e+01 136.478 0.5901 
1 1 1 6   72  5  o 3  7.82519e+00 7.63377e-01 1.65831e+02 85.404  1.07089e+00  1.33206e+01  0.00000e+00 0.00000e+00 1.15869e+02 85.404  4.99617e+01 265.404 0.9618 
1 1 1 6   72  6  o 4  1.96911e+00 6.59513e-01 7.16361e+01 308.995 9.22533e-01  -1.13944e+00 0.00000e+00 0.00000e+00 2.83316e+01 128.995 9.99677e+01 128.995 0.5876 
1 1 1 6   72  7  o 11 4.35400e+00 9.86713e-01 1.00615e+02 91.630  -1.43025e-01 5.02743e+00  0.00000e+00 0.00000e+00 4.50464e+01 91.630  5.55684e+01 271.630 0.8941 
1 1 1 6   72  8  o 8  1.66612e+01 7.01085e-01 2.97203e+02 226.335 -4.82909e+01 -5.05957e+01 0.00000e+00 0.00000e+00 3.21631e+02 226.335 2.44277e+01 226.335 0.9928 
1 1 1 6   72  9  o 6  1.02607e+01 8.16230e-01 1.32486e+02 220.644 -1.53555e+01 -1.31819e+01 0.00000e+00 0.00000e+00 2.41660e+02 220.644 1.09174e+02 220.644 0.9750 
1 1 1 6   72  10 o 8  1.19856e+01 8.83616e-01 1.90488e+02 279.590 5.97880e+00  -3.53874e+01 0.00000e+00 0.00000e+00 2.51334e+02 279.590 6.08458e+01 279.590 0.9860 
1 1 1 6   72  11 o 7  6.54616e+00 1.30240e+00 7.85209e+01 160.748 -6.37506e+00 2.22649e+00  0.00000e+00 0.00000e+00 1.47205e+02 160.748 6.86842e+01 160.748 0.9227 
1 1 1 6   72  12 o 15 6.89253e+00 1.40393e+00 1.20496e+02 274.860 8.83200e-01  -1.03861e+01 0.00000e+00 0.00000e+00 1.24296e+02 274.860 3.79957e+00 274.860 0.9508 
1 1 1 6   72  13 o 10 4.10884e+00 1.26276e+00 3.61997e+01 296.026 9.79241e-01  -2.00540e+00 0.00000e+00 0.00000e+00 7.61527e+01 296.026 3.99530e+01 296.026 0.7324 
1 1 1 6   72  14 o 18 8.12328e+00 1.59776e+00 1.09454e+02 233.929 -7.11483e+00 -9.76736e+00 0.00000e+00 0.00000e+00 1.80832e+02 233.929 7.13787e+01 233.929 0.9577 
1 1 1 6   73  0  o 17 4.51714e+00 8.33952e-01 1.40231e+02 41.246  3.56956e+00  3.12997e+00  0.00000e+00 0.00000e+00 9.66527e+00 41.246  1.30566e+02 221.246 0.8872 
1 1 1 6   73  1  o 19 4.46293e+00 9.51555e-01 7.71739e+01 81.263  4.12833e-01  2.68637e+00  0.00000e+00 0.00000e+00 5.41877e+01 81.263  2.29862e+01 261.263 0.7868 
1 1 1 6   73  2  o 4  1.83098e+01 7.16975e-01 2.81084e+02 119.735 -2.16010e+01 3.78175e+01  0.00000e+00 0.00000e+00 3.96108e+02 119.735 1.15025e+02 119.735 0.9885 
1 1 1 6   73  3  o 18 1.57884e+01 5.51087e-01 2.91381e+02 10.050  4.16134e+01  7.37514e+00  0.00000e+00 0.00000e+00 2.92401e+02 10.050  1.02009e+00 10.050  0.9881 
1 1 1 6   73  4  o 13 9.62446e+00 6.25139e-01 1.59687e+02 340.573 1.39912e+01  -4.93434e+00 0.00000e+00 0.00000e+00 1.88119e+02 340.573 2.84314e+01 340.573 0.9657 
1 1 1 6   73  5  o 3  8.57676e+00 6.94588e-01 1.96815e+02 261.222 -2.77819e+00 -1.79925e+01 0.00000e+00 0.00000e+00 1.15189e+02 261.222 8.16262e+01 81.222  0.9721 
1 1 1 6   73  6  o 14 1.63326e+01 6.21645e-01 2.01041e+02 100.242 -6.63275e+00 3.67092e+01  0.00000e+00 0.00000e+00 4.01828e+02 100.242 2.00788e+02 100.242 0.9865 
1 1 1 6   73  7  o 6  7.10171e+00 8.17954e-01 1.12487e+02 278.279 1.45971e+00  -1.00310e+01 0.00000e+00 0.00000e+00 1.39730e+02 278.279 2.72424e+01 278.279 0.9493 
1 1 1 6   73  8  o 5  3.83733e+00 8.88478e-01 8.61967e+01 40.923  3.21887e+00  2.79057e+00  0.00000e+00 0.00000e+00 3.90786e+01 40.923  4.71181e+01 220.923 0.8728 
1 1 1 6   73  9  o 7  2.44878e+00 7.95558e-01 5.64636e+01 43.433  1.51530e+00  1.43462e+00  0.00000e+00 0.00000e+00 8.68665e+00 43.433  4.77770e+01 223.433 0.7115 
1 1 1 6   73  10 o 3  4.08013e+00 1.07900e+00 7.36321e+01 302.991 2.35206e+00  -3.62314e+00 0.00000e+00 0.00000e+00 5.97851e+01 302.991 1.38471e+01 122.991 0.8748 
1 1 1 6   73  11 o 3  9.67105e+00 1.09703e+00 1.84954e+02 162.319 -2.51301e+01 8.01084e+00  0.00000e+00 0.00000e+00 1.69488e+02 162.319 1.54664e+01 342.319 0.9809 
1 1 1 6   73  12 o 10 4.37794e+00 1.22552e+00 1.49546e+02 329.678 8.18426e+00  -4.78670e+00 0.00000e+00 0.00000e+00 5.08152e+00 329.678 1.44465e+02 149.678 0.9457 
1 1 1 6   73  13 o 16 4.21410e+00 1.24810e+00 6.23914e+01 353.192 4.18341e+00  -4.99418e-01 0.00000e+00 0.00000e+00 7.46599e+01 353.192 1.22685e+01 353.192 0.8712 
1 1 1 6   73  14 o 13 3.02627e+00 1.04734e+00 4.28848e+01 62.419  1.20062e+00  2.29843e+00  0.00000e+00 0.00000e+00 4.45851e+01 62.419  1.70031e+00 62.419  0.7748 
1 1 1 6   74  0  o 13 1.47395e+01 6.06574e-01 2.57295e+02 297.818 1.53424e+01  -2.90775e+01 0.00000e+00 0.00000e+00 2.85458e+02 297.818 2.81633e+01 297.818 0.9847 
1 1 1 6   74  1  o 15 1.76857e+01 8.84226e-01 2.62583e+02 90.710  -4.66824e-01 3.76531e+01  0.00000e+00 0.00000e+00 3.90093e+02 90.710  1.27509e+02 90.710  0.9866 
1 1 1 6   74  2  o 18 4.95129e+00 1.02126e+00 8.24164e+01 143.012 -2.65902e+00 2.00285e+00  0.00000e+00 0.00000e+00 7.16262e+01 143.012 1.07902e+01 323.012 0.8316 
1 1 1 6   74  3  o 3  9.63992e+00 5.78783e-01 2.09396e+02 337.206 1.79425e+01  -7.54025e+00 0.00000e+00 0.00000e+00 1.41872e+02 337.206 6.75240e+01 157.206 0.9740 
1 1 1 6   74  4  o 11 8.63293e+00 6.80319e-01 1.45699e+02 172.799 -1.31598e+01 1.66269e+00  0.00000e+00 0.00000e+00 1.64871e+02 172.799 1.91720e+01 172.799 0.9615 
1 1 1 6   74  5  o 17 7.27395e+00 7.28871e-01 1.66207e+02 91.043  -2.39262e-01 1.31402e+01  0.00000e+00 0.00000e+00 9.53655e+01 91.043  7.08413e+01 271.043 0.9612 
1 1 1 6   74  6  o 12 8.95016e+00 7.18180e-01 1.92843e+02 199.927 -1.98367e+01 -7.19154e+00 0.00000e+00 0.00000e+00 1.33944e+02 199.927 5.88984e+01 19.927  0.9760 
1 1 1 6   74  7  o 15 4.04177e+00 8.73795e-01 3.31419e+01 287.605 4.81942e-01  -1.51877e+00 0.00000e+00 0.00000e+00 6.03440e+01 287.605 2.72020e+01 287.605 0.6184 
1 1 1 6   74  8  o 6  9.82032e+00 7.76244e-01 2.22952e+02 34.679  2.56250e+01  1.77300e+01  0.00000e+00 0.00000e+00 1.38343e+02 34.679  8.46094e+01 214.679 0.9838 
1 1 1 6   74  9  o 8  6.47451e+00 1.05046e+00 1.07947e+02 237.420 -5.00083e+00 -7.82551e+00 0.00000e+00 0.00000e+00 1.20674e+02 237.420 1.27272e+01 237.420 0.9445 
1 1 1 6   74  10 o 15 1.15876e+01 8.98729e-01 1.45156e+02 215.255 -2.05292e+01 -1.45115e+01 0.00000e+00 0.00000e+00 2.79200e+02 215.255 1.34044e+02 215.255 0.9799 
1 1 1 6   74  11 o 15 9.45992e+00 1.09225e+00 1.89701e+02 303.764 1.41029e+01  -2.10952e+01 0.00000e+00 0.00000e+00 1.56663e+02 303.764 3.30375e+01 123.764 0.9801 
1 1 1 6   74  12 o 2  7.45014e+00 1.26864e+00 1.21044e+02 283.449 3.02150e+00  -1.26349e+01 0.00000e+00 0.00000e+00 1.46216e+02 283.449 2.51719e+01 283.449 0.9607 
1 1 1 6   74  13 o 19 3.73195e+00 1.17365e+00 7.40147e+01 134.700 -3.27941e+00 3.31390e+00  0.00000e+00 0.00000e+00 4.92355e+01 134.700 2.47792e+01 314.700 0.8849 
1 1 1 6   74  14 o 4  5.53611e+00 1.47194e+00 4.20205e+01 46.032  2.40399e+00  2.49222e+00  0.00000e+00 0.00000e+00 1.31254e+02 46.032  8.92331e+01 46.032  0.8391 
1 1 1 6   75  0  o 6  1.25711e+01 7.76058e-01 2.50658e+02 105.523 -7.37888e+00 2.65659e+01  0.00000e+00 0.00000e+00 2.10754e+02 105.523 3.99046e+01 285.523 0.9817 
1 1 1 6   75  1  o 13 7.30247e+00 9.03317e-01 9.37025e+01 112.479 -2.20848e+00 5.33739e+00  0.00000e+00 0.00000e+00 1.54462e+02 112.479 6.07590e+01 112.479 0.9087 
1 1 1 6   75  2  o 15 1.00094e+01 6.55976e-01 1.82807e+02 301.801 9.14892e+00  -1.47552e+01 0.00000e+00 0.00000e+00 1.80617e+02 301.801 2.19015e+00 121.801 0.9708 
1 1 1 6   75  3  o 3  1.20003e+01 5.56364e-01 1.71871e+02 161.817 -1.92149e+01 6.31108e+00  0.00000e+00 0.00000e+00 2.65763e+02 161.817 9.38917e+01 161.817 0.9750 
1 1 1 6   75  4  o 19 9.10013e+00 6.20662e-01 1.67931e+02 188.588 -1.66252e+01 -2.51075e+00 0.00000e+00 0.00000e+00 1.62190e+02 188.588 5.74101e+00 8.588   0.9698 
1 1 1 6   75  5  o 19 2.58005e+00 7.88662e-01 6.54262e+01 329.740 1.45835e+00  -8.50831e-01 0.00000e+00 0.00000e+00 3.72153e+00 149.740 6.91478e+01 149.740 0.6394 
1 1 1 6   75  6  o 11 1.51465e+01 6.30997e-01 2.58792e+02 96.862  -6.13255e+00 5.09610e+01  0.00000e+00 0.00000e+00 3.02168e+02 96.862  4.33761e+01 96.862  0.9902 
1 1 1 6   75  7  o 7  1.55977e+01 7.22389e-01 2.28941e+02 294.237 1.97923e+01  -4.39650e+01 0.00000e+00 0.00000e+00 3.48271e+02 294.237 1.19329e+02 294.237 0.9896 
1 1 1 6   75  8  o 13 1.04021e+01 7.65773e-01 2.50763e+02 67.555  1.36586e+01  3.30641e+01  0.00000e+00 0.00000e+00 1.32676e+02 67.555  1.18087e+02 247.555 0.9859 
1 1 1 6   75  9  o 4  1.27953e+01 9.11206e-01 2.11108e+02 247.704 -1.51894e+01 -3.70433e+01 0.00000e+00 0.00000e+00 2.61136e+02 247.704 5.00277e+01 247.704 0.9874 
1 1 1 6   75  10 o 19 7.91039e+00 1.07943e+00 1.46212e+02 343.711 1.60957e+01  -4.70338e+00 0.00000e+00 0.00000e+00 1.40405e+02 343.711 5.80625e+00 163.711 0.9697 
1 1 1 6   75  11 o 19 7.04941e+00 1.26138e+00 1.67474e+02 136.298 -1.17011e+01 1.11826e+01  0.00000e+00 0.00000e+00 8.75526e+01 136.298 7.99215e+01 316.298 0.9686 
1 1 1 6   75  12 o 5  8.57246e+00 1.34121e+00 1.77811e+02 350.597 2.12807e+01  -3.52404e+00 0.00000e+00 0.00000e+00 1.34713e+02 350.597 4.30977e+01 170.597 0.9765 
1 1 1 6   75  13 f 0  3.46283e+00 1.12594e+00 1.15711e+01 88.865  1.37509e-02  6.93854e-01  0.00000e+00 0.00000e+00 3.07648e+01 88.865  1.91937e+01 88.865  0.3277 
1 1 1 6   75  14 o 19 1.21673e+01 1.52295e+00 2.02405e+02 269.945 -3.42192e-02 -3.56829e+01 0.00000e+00 0.00000e+00 2.44928e+02 269.945 4.25234e+01 269.945 0.9859 
1 1 1 6   76  0  o 18 7.31930e+00 7.84923e-01 1.97811e+02 37.615  9.97996e+00  7.68966e+00  0.00000e+00 0.00000e+00 6.46977e+01 37.615  1.33113e+02 217.615 0.9595 
1 1 1 6   76  1  o 7  9.84775e+00 6.94107e-01 1.34653e+02 218.922 -9.68731e+00 -7.82287e+00 0.00000e+00 0.00000e+00 2.18433e+02 218.922 8.37804e+01 218.922 0.9590 
1 1 1 6   76  2  o 13 1.14405e+01 5.82225e-01 1.92567e+02 242.202 -1.00018e+01 -1.89715e+01 0.00000e+00 0.00000e+00 2.25149e+02 242.202 3.25823e+01 242.202 0.9764 
1 1 1 6   76  3  o 13 5.46747e+00 7.81040e-01 1.56194e+02 133.798 -5.95436e+00 6.20962e+00  0.00000e+00 0.00000e+00 3.59985e+01 133.798 1.20195e+02 313.798 0.9399 
1 1 1 6   76  4  o 17 4.37472e+00 8.80430e-01 1.02864e+02 325.019 3.81892e+00  -2.67213e+00 0.00000e+00 0.00000e+00 4.19100e+01 325.019 6.09542e+01 145.019 0.8849 
1 1 1 6   76  5  o 17 6.74927e+00 7.47089e-01 1.71424e+02 82.228  1.79660e+00  1.31639e+01  0.00000e+00 0.00000e+00 7.12893e+01 82.228  1.00135e+02 262.228 0.9616 
1 1 1 6   76  6  o 4  9.96734e+00 7.14512e-01 9.26437e+01 154.171 -1.09531e+01 5.30176e+00  0.00000e+00 0.00000e+00 2.64416e+02 154.171 1.71773e+02 154.171 0.9580 
1 1 1 6   76  7  o 1  1.02327e+01 7.04983e-01 1.53255e+02 115.711 -9.09542e+00 1.88898e+01  0.00000e+00 0.00000e+00 2.20088e+02 115.711 6.68329e+01 115.711 0.9759 
1 1 1 6   76  8  o 11 6.93923e+00 8.94407e-01 1.38781e+02 6.593   1.37202e+01  1.58587e+00  0.00000e+00 0.00000e+00 1.11034e+02 6.593   2.77468e+01 186.593 0.9631 
1 1 1 6   76  9  o 10 3.38654e+00 9.57637e-01 6.23106e+01 71.449  1.01516e+00  3.02506e+00  0.00000e+00 0.00000e+00 4.18639e+01 71.449  2.04467e+01 251.449 0.8232 
1 1 1 6   76  10 o 1  1.05817e+01 9.57727e-01 1.88371e+02 243.241 -1.35031e+01 -2.67797e+01 0.00000e+00 0.00000e+00 2.00283e+02 243.241 1.19116e+01 243.241 0.9832 
1 1 1 6   76  11 f 0  5.00792e+00 1.21017e+00 9.07493e+01 62.756  3.04093e+00  5.90583e+00  0.00000e+00 0.00000e+00 8.15422e+01 62.756  9.20718e+00 242.756 0.9213 
1 1 1 6   76  12 o 3  4.42807e+00 1.25189e+00 8.99047e+01 289.534 2.02785e+00  -5.71561e+00 0.00000e+00 0.00000e+00 6.10522e+01 289.534 2.88526e+01 109.534 0.9134 
1 1 1 6   76  13 o 4  3.17834e+00 1.07307e+00 2.78216e+01 169.625 -1.64476e+00 3.01123e-01  0.00000e+00 0.00000e+00 4.75754e+01 169.625 1.97538e+01 169.625 0.6359 
1 1 1 6   76  14 o 18 6.85097e+00 1.62653e+00 9.03248e+01 258.038 -1.69461e+00 -7.99871e+00 0.00000e+00 0.00000e+00 1.48933e+02 258.038 5.86084e+01 258.038 0.9367 
1 1 1 6   77  0  o 9  2.57538e+01 6.94305e-01 4.73818e+02 71.383  3.69654e+01  1.09734e+02  0.00000e+00 0.00000e+00 4.84513e+02 71.383  1.06951e+01 71.383  0.9957 
1 1 1 6   77  1  o 7  3.02637e+01 7.44869e-01 5.42166e+02 244.783 -6.55704e+01 -1.39234e+02 0.00000e+00 0.00000e+00 5.85438e+02 244.783 4.32714e+01 244.783 0.9967 
1 1 1 6   77  2  o 13 6.58631e+00 6.61593e-01 1.50304e+02 120.147 -5.26242e+00 9.06116e+00  0.00000e+00 0.00000e+00 8.38740e+01 120.147 6.64296e+01 300.146 0.9510 
1 1 1 6   77  3  o 8  1.16615e+01 5.27610e-01 1.98375e+02 62.637  1.19382e+01  2.30681e+01  0.00000e+00 0.00000e+00 2.29169e+02 62.637  3.07941e+01 62.637  0.9806 
1 1 1 6   77  4  o 13 3.76453e+00 7.89051e-01 5.42041e+01 16.597  1.95568e+00  5.82902e-01  0.00000e+00 0.00000e+00 4.49392e+01 16.597  9.26487e+00 196.597 0.7043 
1 1 1 6   77  5  o 1  5.15396e+00 8.51326e-01 7.21106e+01 191.837 -4.41994e+00 -9.26369e-01 0.00000e+00 0.00000e+00 9.76237e+01 191.837 2.55130e+01 191.837 0.8808 
1 1 1 6   77  6  o 2  3.20185e+00 8.79450e-01 2.78042e+01 314.693 7.91785e-01  -8.00324e-01 0.00000e+00 0.00000e+00 3.07547e+01 314.693 2.95057e+00 314.693 0.4892 
1 1 1 6   77  7  o 18 6.76492e+00 8.93749e-01 1.11314e+02 10.234  1.00296e+01  1.81077e+00  0.00000e+00 0.00000e+00 1.28816e+02 10.234  1.75020e+01 10.234  0.9496 
1 1 1 6   77  8  o 8  8.25240e+00 8.39435e-01 1.49165e+02 242.496 -8.34737e+00 -1.60322e+01 0.00000e+00 0.00000e+00 1.50589e+02 242.496 1.42370e+00 242.496 0.9719 
1 1 1 6   77  9  o 16 6.52871e+00 9.97704e-01 5.42091e+01 44.358  3.48058e+00  3.40339e+00  0.00000e+00 0.00000e+00 1.62940e+02 44.358  1.08731e+02 44.358  0.8902 
1 1 1 6   77  10 o 9  4.44810e+00 1.17766e+00 2.45090e+01 299.727 7.97406e-01  -1.39647e+00 0.00000e+00 0.00000e+00 7.87830e+01 299.727 5.42741e+01 299.727 0.6217 
1 1 1 6   77  11 o 2  8.88301e+00 1.18249e+00 1.45973e+02 64.221  8.17598e+00  1.69290e+01  0.00000e+00 0.00000e+00 1.76723e+02 64.221  3.07502e+01 64.221  0.9730 
1 1 1 6   77  12 o 1  6.72057e+00 1.37187e+00 1.26656e+02 186.609 -1.18098e+01 -1.36836e+00 0.00000e+00 0.00000e+00 1.13346e+02 186.609 1.33101e+01 6.609   0.9570 
1 1 1 6   77  13 o 16 4.86190e+00 1.38024e+00 5.20240e+01 278.867 6.18870e-01  -3.96694e+00 0.00000e+00 0.00000e+00 1.04669e+02 278.867 5.26446e+01 278.867 0.8641 
1 1 1 6   77  14 o 8  3.51321e+00 1.16878e+00 9.24485e+01 212.317 -5.93406e+00 -3.75386e+00 0.00000e+00 0.00000e+00 2.87889e+01 212.317 6.36596e+01 32.317  0.9258 
1 1 1 6   78  0  o 14 1.03674e+01 6.87549e-01 1.73260e+02 302.359 1.01097e+01  -1.59556e+01 0.00000e+00 0.00000e+00 2.03720e+02 302.359 3.04599e+01 302.359 0.9732 
1 1 1 6   78  1  o 15 7.43059e+00 6.18539e-01 1.53019e+02 128.074 -7.37544e+00 9.41501e+00  0.00000e+00 0.00000e+00 1.12809e+02 128.074 4.02100e+01 308.074 0.9572 
1 1 1 6   78  2  o 16 4.60546e+00 7.74263e-01 6.16181e+01 55.872  1.67570e+00  2.47235e+00  0.00000e+00 0.00000e+00 7.76475e+01 55.872  1.60293e+01 55.872  0.8090 
1 1 1 6   78  3  o 15 3.00291e+00 7.83832e-01 4.51729e+01 138.512 -1.08413e+00 9.58740e-01  0.00000e+00 0.00000e+00 2.02512e+01 138.512 2.49217e+01 318.512 0.5828 
1 1 1 6   78  4  o 8  8.14087e+00 6.63648e-01 1.58260e+02 69.752  5.25198e+00  1.42376e+01  0.00000e+00 0.00000e+00 1.35866e+02 69.752  2.23938e+01 249.752 0.9665 
1 1 1 6   78  5  o 5  8.35433e+00 6.36884e-01 1.58286e+02 205.191 -1.47287e+01 -6.92800e+00 0.00000e+00 0.00000e+00 1.44262e+02 205.191 1.40237e+01 25.191  0.9688 
1 1 1 6   78  6  o 10 4.60262e+00 9.95268e-01 1.42456e+02 73.220  2.28402e+00  7.57456e+00  0.00000e+00 0.00000e+00 1.83100e+01 73.220  1.24146e+02 253.220 0.9345 
1 1 1 6   78  7  o 2  8.27214e+00 7.67022e-01 1.24822e+02 58.470  7.40595e+00  1.20713e+01  0.00000e+00 0.00000e+00 1.73205e+02 58.470  4.83833e+01 58.470  0.9640 
1 1 1 6   78  8  o 18 4.99829e+00 1.03303e+00 8.11015e+01 353.308 5.39232e+00  -6.32677e-01 0.00000e+00 0.00000e+00 8.74420e+01 353.308 6.34050e+00 353.308 0.9025 
1 1 1 6   78  9  o 1  7.42280e+00 1.01474e+00 9.10503e+01 238.725 -4.93919e+00 -8.13148e+00 0.00000e+00 0.00000e+00 1.71217e+02 238.725 8.01668e+01 238.725 0.9459 
1 1 1 6   78  10 o 16 8.39523e+00 1.08299e+00 1.91046e+02 197.595 -2.31657e+01 -7.34651e+00 0.00000e+00 0.00000e+00 1.15924e+02 197.595 7.51220e+01 17.595  0.9792 
1 1 1 6   78  11 o 10 3.14526e+00 1.01087e+00 9.98257e+01 323.947 4.22373e+00  -3.07474e+00 0.00000e+00 0.00000e+00 5.64023e+00 323.947 9.41855e+01 143.947 0.8983 
1 1 1 6   78  12 o 16 4.92892e+00 1.33491e+00 7.99970e+01 221.958 -4.40765e+00 -3.96289e+00 0.00000e+00 0.00000e+00 8.75697e+01 221.958 7.57270e+00 221.958 0.9112 
1 1 1 6   78  13 o 12 4.74735e+00 1.36767e+00 1.00217e+02 88.625  1.87656e-01  7.81540e+00  0.00000e+00 0.00000e+00 6.50670e+01 88.625  3.51497e+01 268.624 0.9337 
1 1 1 6   78  14 o 18 2.88641e+00 1.00571e+00 2.33776e+01 243.002 -7.22547e-01 -1.41817e+00 0.00000e+00 0.00000e+00 4.30993e+01 243.002 1.97217e+01 243.002 0.6180 
1 1 1 6   79  0  o 10 6.63604e+00 8.04897e-01 1.41242e+02 292.525 3.74406e+00  -9.02763e+00 0.00000e+00 0.00000e+00 9.36136e+01 292.525 4.76286e+01 112.525 0.9474 
1 1 1 6   79  1  o 1  1.15586e+01 5.67523e-01 2.17588e+02 145.201 -2.21699e+01 1.54080e+01  0.00000e+00 0.00000e+00 2.06223e+02 145.201 1.13655e+01 325.201 0.9813 
1 1 1 6   79  2  o 16 1.78336e+01 5.20135e-01 2.87815e+02 355.559 5.86504e+01  -4.55490e+00 0.00000e+00 0.00000e+00 3.72949e+02 355.559 8.51337e+01 355.559 0.9915 
1 1 1 6   79  3  o 12 2.85991e+00 7.91417e-01 5.51224e+01 245.809 -6.98182e-01 -1.55418e+00 0.00000e+00 0.00000e+00 1.35657e+01 245.809 4.15568e+01 65.809  0.6426 
1 1 1 6   79  4  o 4  1.05100e+01 6.02837e-01 1.65738e+02 194.560 -2.23109e+01 -5.79499e+00 0.00000e+00 0.00000e+00 2.18458e+02 194.560 5.27201e+01 194.560 0.9781 
1 1 1 6   79  5  o 8  9.56421e+00 6.22978e-01 1.84396e+02 125.917 -1.34366e+01 1.85506e+01  0.00000e+00 0.00000e+00 1.65162e+02 125.917 1.92345e+01 305.916 0.9779 
1 1 1 6   79  6  f 0  2.95911e+00 8.33278e-01 1.38078e+02 327.754 4.39845e+00  -2.77480e+00 0.00000e+00 0.00000e+00 3.87935e+01 147.754 1.76872e+02 147.754 0.8978 
1 1 1 6   79  7  o 14 5.67322e+00 9.64688e-01 1.32292e+02 351.035 1.05020e+01  -1.65679e+00 0.00000e+00 0.00000e+00 6.94547e+01 351.035 6.28377e+01 171.035 0.9517 
1 1 1 6   79  8  o 8  2.05599e+00 7.02252e-01 4.71884e+01 154.147 -1.42519e+00 6.90601e-01  0.00000e+00 0.00000e+00 1.34660e-01 154.147 4.70538e+01 334.147 0.6162 
1 1 1 6   79  9  o 13 4.92490e+00 1.07330e+00 1.00092e+02 117.123 -3.27034e+00 6.38443e+00  0.00000e+00 0.00000e+00 7.04835e+01 117.123 2.96084e+01 297.123 0.9274 
1 1 1 6   79  10 o 12 2.73224e+00 9.05288e-01 1.04326e+02 45.755  3.11253e+00  3.19563e+00  0.00000e+00 0.00000e+00 1.46478e+01 225.755 1.18974e+02 225.755 0.8792 
1 1 1 6   79  11 o 18 4.73897e+00 1.23501e+00 4.42092e+01 273.628 1.95346e-01  -3.08105e+00 0.00000e+00 0.00000e+00 1.00142e+02 273.628 5.59330e+01 273.628 0.8162 
1 1 1 6   79  12 o 13 4.28317e+00 1.26095e+00 1.01711e+02 158.720 -6.42876e+00 2.50388e+00  0.00000e+00 0.00000e+00 4.59764e+01 158.720 5.57343e+01 338.720 0.9244 
1 1 1 6   79  13 o 10 6.36695e+00 1.49632e+00 1.39629e+02 112.479 -4.76227e+00 1.15091e+01  0.00000e+00 0.00000e+00 8.80044e+01 112.479 5.16242e+01 292.479 0.9590 
1 1 1 6   79  14 o 18 3.34097e+00 1.12314e+00 2.05507e+01 301.890 8.37303e-01  -1.34569e+00 0.00000e+00 0.00000e+00 5.61858e+01 301.890 3.56351e+01 301.890 0.6164 
1 1 1 6   80  0  o 6  5.45930e+00 9.51854e-01 1.05306e+02 15.133  5.59948e+00  1.51430e+00  0.00000e+00 0.00000e+00 8.00674e+01 15.133  2.52390e+01 195.133 0.9091 
1 1 1 6   80  1  o 13 8.39171e+00 5.76370e-01 1.28214e+02 314.343 8.49447e+00  -8.69144e+00 0.00000e+00 0.00000e+00 1.72085e+02 314.343 4.38713e+01 314.343 0.9579 
1 1 1 6   80  2  o 9  6.78334e+00 6.74691e-01 1.59929e+02 215.288 -9.91833e+00 -7.01944e+00 0.00000e+00 0.00000e+00 8.28494e+01 215.288 7.70792e+01 35.288  0.9579 
1 1 1 6   80  3  f 0  4.37401e+00 8.16146e-01 4.70539e+01 19.089  2.29740e+00  7.95061e-01  0.00000e+00 0.00000e+00 7.67160e+01 19.089  2.96620e+01 19.089  0.7573 
1 1 1 6   80  4  o 14 1.87943e+01 5.53464e-01 3.31430e+02 354.528 7.80708e+01  -7.47861e+00 0.00000e+00 0.00000e+00 3.66360e+02 354.528 3.49308e+01 354.528 0.9936 
1 1 1 6   80  5  o 8  5.40389e+00 8.45044e-01 7.03671e+01 155.731 -4.46443e+00 2.01282e+00  0.00000e+00 0.00000e+00 1.09532e+02 155.731 3.91647e+01 155.731 0.8909 
1 1 1 6   80  6  o 12 4.30850e+00 9.25396e-01 4.25737e+01 86.448  1.51488e-01  2.44022e+00  0.00000e+00 0.00000e+00 7.95849e+01 86.448  3.70112e+01 86.448  0.7589 
1 1 1 6   80  7  o 8  5.47347e+00 9.56172e-01 1.44171e+02 358.020 1.10204e+01  -3.80979e-01 0.00000e+00 0.00000e+00 5.07931e+01 358.020 9.33783e+01 178.020 0.9535 
1 1 1 6   80  8  o 18 1.23687e+01 7.48318e-01 1.81764e+02 201.726 -3.50675e+01 -1.39738e+01 0.00000e+00 0.00000e+00 2.74022e+02 201.726 9.22580e+01 201.726 0.9867 
1 1 1 6   80  9  o 9  1.15598e+01 7.92416e-01 2.15784e+02 136.782 -2.97672e+01 2.79706e+01  0.00000e+00 0.00000e+00 2.10517e+02 136.782 5.26783e+00 316.782 0.9877 
1 1 1 6   80  10 o 11 8.85695e+00 1.00333e+00 1.47864e+02 34.489  1.71568e+01  1.17868e+01  0.00000e+00 0.00000e+00 1.74681e+02 34.489  2.68169e+01 34.489  0.9757 
1 1 1 6   80  11 o 15 1.03265e+01 1.05629e+00 2.08432e+02 252.305 -1.12284e+01 -3.51931e+01 0.00000e+00 0.00000e+00 1.71600e+02 252.305 3.68317e+01 72.305  0.9864 
1 1 1 6   80  12 o 1  1.01366e+01 1.26214e+00 1.35189e+02 140.351 -1.64019e+01 1.35925e+01  0.00000e+00 0.00000e+00 2.33854e+02 140.351 9.86648e+01 140.351 0.9762 
1 1 1 6   80  13 o 5  7.64582e+00 1.59645e+00 1.58046e+02 58.051  8.60208e+00  1.37937e+01  0.00000e+00 0.00000e+00 1.18031e+02 58.051  4.00152e+01 238.051 0.9687 
1 1 1 6   81  0  o 18 6.11841e+00 6.62419e-01 1.85076e+02 21.560  1.18374e+01  4.67718e+00  0.00000e+00 0.00000e+00 3.42224e+01 21.560  1.50854e+02 201.560 0.9599 
1 1 1 6   81  1  o 7  5.62427e+00 7.00588e-01 1.25534e+02 284.022 1.89913e+00  -7.60454e+00 0.00000e+00 0.00000e+00 7.06277e+01 284.022 5.49058e+01 104.022 0.9338 
1 1 1 6   81  2  o 15 5.49611e+00 7.08859e-01 7.81899e+01 340.127 4.95402e+00  -1.79072e+00 0.00000e+00 0.00000e+00 1.06427e+02 340.127 2.82371e+01 340.127 0.8992 
1 1 1 6   81  3  o 13 4.35785e+00 7.97146e-01 4.54886e+01 276.110 2.60893e-01  -2.43727e+00 0.00000e+00 0.00000e+00 7.81702e+01 276.110 3.26816e+01 276.110 0.7596 
1 1 1 6   81  4  o 17 2.72360e+00 7.95448e-01 6.28515e+01 342.601 2.00170e+00  -6.27249e-01 0.00000e+00 0.00000e+00 9.71433e+00 342.601 5.31372e+01 162.601 0.7132 
1 1 1 6   81  5  o 13 1.23954e+01 5.80316e-01 2.06176e+02 151.312 -3.12266e+01 1.70877e+01  0.00000e+00 0.00000e+00 2.50333e+02 151.312 4.41576e+01 151.312 0.9859 
1 1 1 6   81  6  o 9  4.08515e+00 9.83437e-01 4.35245e+01 122.288 -1.18628e+00 1.87736e+00  0.00000e+00 0.00000e+00 6.80064e+01 122.288 2.44818e+01 122.288 0.7309 
1 1 1 6   81  7  f 0  3.42403e+00 9.21589e-01 8.19997e+01 100.761 -7.42853e-01 3.90856e+00  0.00000e+00 0.00000e+00 2.83217e+01 100.761 5.36780e+01 280.761 0.8627 
1 1 1 6   81  8  o 15 6.52759e+00 9.90627e-01 6.94328e+01 114.780 -2.86900e+00 6.21488e+00  0.00000e+00 0.00000e+00 1.55724e+02 114.780 8.62914e+01 114.780 0.9238 
1 1 1 6   81  9  o 14 1.32256e+01 7.63257e-01 2.46455e+02 6.626   6.13300e+01  7.12456e+00  0.00000e+00 0.00000e+00 2.43235e+02 6.626   3.22030e+00 186.626 0.9919 
1 1 1 6   81  10 o 18 3.75430e+00 1.08405e+00 6.14380e+01 34.096  2.80260e+00  1.89720e+00  0.00000e+00 0.00000e+00 5.55205e+01 34.096  5.91757e+00 214.096 0.8348 
1 1 1 6   81  11 o 17 3.88599e+00 1.16432e+00 9.38645e+01 320.842 4.58137e+00  -3.73090e+00 0.00000e+00 0.00000e+00 3.81766e+01 320.842 5.56878e+01 140.842 0.9109 
1 1 1 6   81  12 o 9  5.67779e+00 1.39150e+00 1.21969e+02 132.336 -6.90228e+00 7.57593e+00  0.00000e+00 0.00000e+00 7.91172e+01 132.336 4.28519e+01 312.336 0.9499 
1 1 1 6   81  13 o 8  3.93093e+00 1.22440e+00 2.06066e+01 155.378 -1.33305e+00 6.10949e-01  0.00000e+00 0.00000e+00 6.54860e+01 155.378 4.48794e+01 155.378 0.5877 
1 1 1 6   82  0  o 1  5.45659e+00 7.64002e-01 7.10348e+01 300.794 2.38783e+00  -4.00660e+00 0.00000e+00 0.00000e+00 1.09239e+02 300.794 3.82042e+01 300.794 0.8850 
1 1 1 6   82  1  o 17 1.13439e+01 5.34183e-01 1.96180e+02 148.034 -2.43226e+01 1.51782e+01  0.00000e+00 0.00000e+00 2.19950e+02 148.034 2.37701e+01 148.034 0.9824 
1 1 1 6   82  2  o 3  7.21967e+00 6.48846e-01 1.06206e+02 353.904 9.92061e+00  -1.05957e+00 0.00000e+00 0.00000e+00 1.49527e+02 353.904 4.33214e+01 353.904 0.9485 
1 1 1 6   82  3  o 11 3.34615e+00 7.15581e-01 9.22758e+01 114.347 -1.67486e+00 3.70125e+00  0.00000e+00 0.00000e+00 1.59389e+01 114.347 7.63368e+01 294.347 0.8659 
1 1 1 6   82  4  o 4  1.08743e+01 6.06392e-01 1.90370e+02 269.056 -4.79093e-01 -2.90647e+01 0.00000e+00 0.00000e+00 2.08739e+02 269.056 1.83687e+01 269.056 0.9826 
1 1 1 6   82  5  o 8  5.78935e+00 8.09431e-01 8.80435e+01 344.074 6.50506e+00  -1.85619e+00 0.00000e+00 0.00000e+00 1.11492e+02 344.074 2.34481e+01 344.074 0.9228 
1 1 1 6   82  6  o 6  1.50275e+01 6.98964e-01 2.42695e+02 98.099  -8.03389e+00 5.64558e+01  0.00000e+00 0.00000e+00 3.13572e+02 98.099  7.08767e+01 98.099  0.9912 
1 1 1 6   82  7  o 2  4.30721e+00 1.00202e+00 6.83852e+01 3.161   4.15449e+00  2.29425e-01  0.00000e+00 0.00000e+00 7.14454e+01 3.161   3.06026e+00 3.161   0.8694 
1 1 1 6   82  8  o 8  4.07746e+00 1.01450e+00 8.47630e+01 356.881 5.21405e+00  -2.84128e-01 0.00000e+00 0.00000e+00 5.19721e+01 356.881 3.27909e+01 176.881 0.8983 
1 1 1 6   82  9  o 13 3.45411e+00 1.00609e+00 5.09875e+01 217.674 -2.21178e+00 -1.70788e+00 0.00000e+00 0.00000e+00 5.13112e+01 217.674 3.23708e-01 217.674 0.7936 
1 1 1 6   82  10 o 8  3.62227e+00 1.07002e+00 1.14832e+02 174.424 -6.54276e+00 6.38790e-01  0.00000e+00 0.00000e+00 9.55838e+00 174.424 1.05273e+02 354.424 0.9204 
1 1 1 6   82  11 o 11 3.13296e+00 1.01551e+00 8.92785e+01 307.316 3.03967e+00  -3.98776e+00 0.00000e+00 0.00000e+00 1.51423e+01 307.316 7.41362e+01 127.316 0.8937 
1 1 1 6   82  12 o 5  1.03150e+01 1.18065e+00 1.61844e+02 136.373 -2.21235e+01 2.10880e+01  0.00000e+00 0.00000e+00 2.16318e+02 136.373 5.44740e+01 136.373 0.9835 
1 1 1 6   82  13 o 8  4.31392e+00 1.29618e+00 8.56271e+01 146.091 -5.42479e+00 3.64649e+00  0.00000e+00 0.00000e+00 6.22324e+01 146.091 2.33947e+01 326.091 0.9200 
1 1 1 6   83  0  o 5  4.97103e+00 7.51282e-01 8.92974e+01 338.187 5.18093e+00  -2.07358e+00 0.00000e+00 0.00000e+00 7.86714e+01 338.187 1.06260e+01 158.187 0.9053 
1 1 1 6   83  1  o 3  6.02910e+00 6.65562e-01 7.19256e+01 177.655 -5.60162e+00 2.29340e-01  0.00000e+00 0.00000e+00 1.31943e+02 177.655 6.00175e+01 177.655 0.9058 
1 1 1 6   83  2  o 6  1.36564e+01 5.24469e-01 2.21539e+02 215.351 -3.44837e+01 -2.44615e+01 0.00000e+00 0.00000e+00 2.82290e+02 215.351 6.07503e+01 215.351 0.9881 
1 1 1 6   83  3  f 0  1.26958e+01 5.44216e-01 2.29122e+02 100.426 -7.49075e+00 4.07103e+01  0.00000e+00 0.00000e+00 2.39185e+02 100.426 1.00638e+01 100.426 0.9878 
1 1 1 6   83  4  o 10 9.18621e+00 6.20662e-01 1.89301e+02 41.319  1.79509e+01  1.57808e+01  0.00000e+00 0.00000e+00 1.46473e+02 41.319  4.28279e+01 221.319 0.9789 
1 1 1 6   83  5  o 13 8.76825e+00 6.59530e-01 1.62690e+02 209.439 -1.80206e+01 -1.01703e+01 0.00000e+00 0.00000e+00 1.56709e+02 209.439 5.98116e+00 29.439  0.9755 
1 1 1 6   83  6  o 5  1.94579e+00 6.69755e-01 5.11235e+01 88.029  5.39851e-02  1.56842e+00  0.00000e+00 0.00000e+00 6.60251e+00 268.029 5.77260e+01 268.029 0.6128 
1 1 1 6   83  7  o 17 8.50240e+00 7.84194e-01 1.50873e+02 57.199  1.14704e+01  1.77981e+01  0.00000e+00 0.00000e+00 1.58944e+02 57.199  8.07086e+00 57.199  0.9761 
1 1 1 6   83  8  o 9  1.13940e+01 8.69402e-01 2.34425e+02 280.394 8.02341e+00  -4.37427e+01 0.00000e+00 0.00000e+00 1.86026e+02 280.394 4.83987e+01 100.394 0.9887 
1 1 1 6   83  9  o 18 6.25295e+00 1.03208e+00 6.17833e+01 122.014 -3.24763e+00 5.19440e+00  0.00000e+00 0.00000e+00 1.51531e+02 122.014 8.97474e+01 122.014 0.9143 
1 1 1 6   83  10 o 11 4.81297e+00 1.21016e+00 7.85548e+01 176.133 -5.57792e+00 3.77010e-01  0.00000e+00 0.00000e+00 8.40027e+01 176.133 5.44788e+00 176.133 0.9055 
1 1 1 6   83  11 o 13 3.27129e+00 1.04635e+00 8.08112e+01 192.532 -4.79982e+00 -1.06687e+00 0.00000e+00 0.00000e+00 2.79159e+01 192.532 5.28953e+01 12.532  0.8914 
1 1 1 6   83  12 o 14 2.90771e+00 9.78372e-01 7.81423e+01 316.829 3.78158e+00  -3.54754e+00 0.00000e+00 0.00000e+00 1.91157e+01 316.829 5.90266e+01 136.829 0.8975 
1 1 1 6   83  13 o 10 3.40059e+00 1.11136e+00 3.47771e+01 1.706   2.63603e+00  7.85220e-02  0.00000e+00 0.00000e+00 6.39133e+01 1.706   2.91362e+01 1.706   0.7791 
1 1 1 6   84  0  o 10 8.42248e+00 5.56034e-01 1.60050e+02 59.942  8.47644e+00  1.46471e+01  0.00000e+00 0.00000e+00 1.44805e+02 59.942  1.52449e+01 239.942 0.9700 
1 1 1 6   84  1  o 2  7.99120e+00 6.07247e-01 1.44839e+02 346.688 1.53418e+01  -3.62997e+00 0.00000e+00 0.00000e+00 1.43798e+02 346.688 1.04097e+00 166.688 0.9677 
1 1 1 6   84  2  o 5  6.56521e+00 6.72212e-01 1.75591e+02 307.205 9.52748e+00  -1.25495e+01 0.00000e+00 0.00000e+00 6.15720e+01 307.205 1.14019e+02 127.205 0.9677 
1 1 1 6   84  3  o 8  1.76745e+01 5.45694e-01 3.02949e+02 57.085  4.32434e+01  6.68051e+01  0.00000e+00 0.00000e+00 3.52721e+02 57.085  4.97721e+01 57.085  0.9937 
1 1 1 6   84  4  o 8  2.05602e+00 6.77668e-01 4.03382e+01 241.287 -5.89379e-01 -1.07594e+00 0.00000e+00 0.00000e+00 3.47183e-01 61.287  4.06854e+01 61.287  0.5210 
1 1 1 6   84  5  o 12 9.93012e+00 6.39336e-01 1.51907e+02 261.989 -3.45276e+00 -2.45349e+01 0.00000e+00 0.00000e+00 2.11244e+02 261.989 5.93363e+01 261.989 0.9796 
1 1 1 6   84  6  o 12 1.05109e+01 6.78481e-01 2.15872e+02 70.339  1.20645e+01  3.37674e+01  0.00000e+00 0.00000e+00 1.70973e+02 70.339  4.48995e+01 250.339 0.9860 
1 1 1 6   84  7  o 10 1.00601e+01 7.11508e-01 1.52132e+02 164.941 -2.57700e+01 6.93350e+00  0.00000e+00 0.00000e+00 2.16233e+02 164.941 6.41015e+01 164.941 0.9811 
1 1 1 6   84  8  o 15 7.61417e+00 1.15406e+00 1.11137e+02 270.954 2.03347e-01  -1.22061e+01 0.00000e+00 0.00000e+00 1.61085e+02 270.954 4.99474e+01 270.954 0.9581 
1 1 1 6   84  9  o 3  3.43946e+00 1.00627e+00 1.14985e+02 123.522 -3.64329e+00 5.49980e+00  0.00000e+00 0.00000e+00 3.15153e+00 123.522 1.11834e+02 303.522 0.9207 
1 1 1 6   84  10 o 9  5.85364e+00 1.17405e+00 9.26499e+01 140.036 -6.61828e+00 5.54629e+00  0.00000e+00 0.00000e+00 1.12583e+02 140.036 1.99329e+01 140.036 0.9402 
1 1 1 6   84  11 o 15 6.49225e+00 1.11974e+00 1.59167e+02 343.840 1.74261e+01  -5.04961e+00 0.00000e+00 0.00000e+00 7.60759e+01 343.840 8.30908e+01 163.840 0.9720 
1 1 1 6   84  12 o 10 4.59307e+00 1.30594e+00 7.72904e+01 301.046 2.98065e+00  -4.95163e+00 0.00000e+00 0.00000e+00 7.82359e+01 301.046 9.45538e-01 301.046 0.9088 
1 1 1 6   84  13 o 9  6.72018e+00 1.52628e+00 1.58351e+02 109.408 -5.34717e+00 1.51775e+01  0.00000e+00 0.00000e+00 8.40039e+01 109.408 7.43467e+01 289.408 0.9684 
1 1 1 6   85  0  o 16 3.69913e+00 8.23295e-01 9.59788e+01 286.423 1.21477e+00  -4.12131e+00 0.00000e+00 0.00000e+00 2.46395e+01 286.423 7.13393e+01 106.423 0.8740 
1 1 1 6   85  1  o 9  5.51031e+00 7.52007e-01 9.87707e+01 240.391 -3.56651e+00 -6.27593e+00 0.00000e+00 0.00000e+00 9.20184e+01 240.391 6.75236e+00 60.391  0.9279 
1 1 1 6   85  2  o 14 1.13282e+01 5.46248e-01 1.75292e+02 90.826  -4.25501e-01 2.95058e+01  0.00000e+00 0.00000e+00 2.40252e+02 90.826  6.49604e+01 90.826  0.9829 
1 1 1 6   85  3  o 10 3.74030e+00 8.37995e-01 5.44107e+01 118.691 -1.28299e+00 2.34430e+00  0.00000e+00 0.00000e+00 5.48297e+01 118.691 4.19022e-01 118.691 0.7825 
1 1 1 6   85  4  o 17 6.77436e+00 7.38606e-01 9.31406e+01 48.393  5.80321e+00  6.53466e+00  0.00000e+00 0.00000e+00 1.44771e+02 48.393  5.16300e+01 48.393  0.9409 
1 1 1 6   85  5  o 6  3.77818e+00 9.07542e-01 4.52716e+01 199.374 -2.30773e+00 -8.11515e-01 0.00000e+00 0.00000e+00 6.17612e+01 199.374 1.64896e+01 199.374 0.7590 
1 1 1 6   85  6  o 10 6.26638e+00 8.82345e-01 1.08250e+02 224.362 -6.81263e+00 -6.66263e+00 0.00000e+00 0.00000e+00 1.12976e+02 224.362 4.72563e+00 224.362 0.9460 
1 1 1 6   85  7  o 14 4.26056e+00 9.70566e-01 9.64920e+01 350.687 6.28278e+00  -1.03030e+00 0.00000e+00 0.00000e+00 4.94032e+01 350.687 4.70887e+01 170.687 0.9177 
1 1 1 6   85  8  f 0  6.77871e+00 1.22378e+00 1.78077e+02 183.356 -1.64293e+01 -9.63353e-01 0.00000e+00 0.00000e+00 6.70010e+01 183.356 1.11076e+02 3.356   0.9691 
1 1 1 6   85  9  o 6  9.18381e+00 9.37435e-01 1.95036e+02 271.044 5.50902e-01  -3.02185e+01 0.00000e+00 0.00000e+00 1.41764e+02 271.044 5.32717e+01 91.044  0.9833 
1 1 1 6   85  10 o 19 6.10187e+00 1.12767e+00 8.44651e+01 75.296  2.17525e+00  8.28911e+00  0.00000e+00 0.00000e+00 1.29314e+02 75.296  4.48486e+01 75.296  0.9397 
1 1 1 6   85  11 o 10 5.30048e+00 1.21371e+00 5.93514e+01 310.431 3.31149e+00  -3.88675e+00 0.00000e+00 0.00000e+00 1.17601e+02 310.431 5.82499e+01 310.431 0.8958 
1 1 1 6   85  12 o 7  4.20151e+00 1.23513e+00 1.00374e+02 246.861 -2.99825e+00 -7.01617e+00 0.00000e+00 0.00000e+00 4.54865e+01 246.861 5.48874e+01 66.861  0.9320 
1 1 1 6   85  13 o 18 4.83745e+00 1.32526e+00 5.60525e+01 69.575  1.76957e+00  4.75187e+00  0.00000e+00 0.00000e+00 1.05141e+02 69.575  4.90885e+01 69.575  0.8950 
1 1 1 6   86  0  o 18 5.33498e+00 6.88282e-01 7.67424e+01 196.366 -5.35538e+00 -1.57275e+00 0.00000e+00 0.00000e+00 1.03403e+02 196.366 2.66602e+01 196.366 0.9053 
1 1 1 6   86  1  o 16 7.25574e+00 6.33787e-01 1.27652e+02 32.784  1.12353e+01  7.23626e+00  0.00000e+00 0.00000e+00 1.32696e+02 32.784  5.04434e+00 32.784  0.9618 
1 1 1 6   86  2  o 2  4.30693e+00 8.41692e-01 8.66692e+01 351.698 4.84357e+00  -7.06722e-01 0.00000e+00 0.00000e+00 5.64943e+01 351.698 3.01748e+01 171.699 0.8909 
1 1 1 6   86  3  o 6  3.87513e+00 8.61202e-01 7.73917e+01 12.960  3.91657e+00  9.01298e-01  0.00000e+00 0.00000e+00 4.75780e+01 12.960  2.98136e+01 192.959 0.8642 
1 1 1 6   86  4  o 8  3.34359e+00 8.31844e-01 8.34600e+01 244.219 -1.79091e+00 -3.70787e+00 0.00000e+00 0.00000e+00 2.48271e+01 244.219 5.86329e+01 64.219  0.8679 
1 1 1 6   86  5  o 4  1.28666e+01 6.15101e-01 2.09078e+02 343.484 4.16992e+01  -1.23647e+01 0.00000e+00 0.00000e+00 2.65483e+02 343.484 5.64046e+01 343.484 0.9884 
1 1 1 6   86  6  o 3  4.18653e+00 9.20507e-01 5.47640e+01 306.051 1.92983e+00  -2.65119e+00 0.00000e+00 0.00000e+00 7.46789e+01 306.051 1.99149e+01 306.051 0.8287 
1 1 1 6   86  7  o 5  8.00974e+00 8.12983e-01 1.48937e+02 92.287  -8.16422e-01 2.04421e+01  0.00000e+00 0.00000e+00 1.42472e+02 92.287  6.46461e+00 272.287 0.9752 
1 1 1 6   86  8  o 7  4.29772e+00 1.21605e+00 1.11708e+02 132.988 -4.29863e+00 4.61169e+00  0.00000e+00 0.00000e+00 3.52558e+01 132.988 7.64520e+01 312.988 0.9168 
1 1 1 6   86  9  o 13 2.49125e+00 8.30723e-01 5.38016e+01 98.006  -3.46219e-01 2.46149e+00  0.00000e+00 0.00000e+00 1.71143e+01 98.006  3.66873e+01 278.006 0.7634 
1 1 1 6   86  10 f 0  1.06158e+01 9.84497e-01 1.59750e+02 337.516 2.86940e+01  -1.18758e+01 0.00000e+00 0.00000e+00 2.29519e+02 337.516 6.97689e+01 337.516 0.9838 
1 1 1 6   86  11 o 16 4.69123e+00 1.25642e+00 9.68518e+01 43.356  5.42447e+00  5.12171e+00  0.00000e+00 0.00000e+00 6.57642e+01 43.356  3.10875e+01 223.356 0.9303 
1 1 1 6   86  12 o 9  4.07295e+00 1.22530e+00 6.85843e+01 256.611 -1.16977e+00 -4.91441e+00 0.00000e+00 0.00000e+00 6.71085e+01 256.611 1.47583e+00 76.611  0.8946 
1 1 1 6   86  13 o 5  3.27074e+00 1.07960e+00 4.64644e+01 337.673 3.24014e+00  -1.33062e+00 0.00000e+00 0.00000e+00 5.59537e+01 337.673 9.48924e+00 337.673 0.8412 
1 1 1 6   87  0  o 3  1.29944e+01 5.20748e-01 2.40344e+02 20.068  4.30610e+01  1.57312e+01  0.00000e+00 0.00000e+00 2.38893e+02 20.068  1.45128e+00 200.068 0.9890 
1 1 1 6   87  1  o 3  8.99145e+00 6.01590e-01 2.06215e+02 148.880 -2.27052e+01 1.37076e+01  0.00000e+00 0.00000e+00 1.22755e+02 148.880 8.34596e+01 328.880 0.9810 
1 1 1 6   87  2  o 13 3.41417e+00 7.92096e-01 3.06506e+01 339.271 1.35014e+00  -5.10951e-01 0.00000e+00 0.00000e+00 4.34558e+01 339.271 1.28052e+01 339.271 0.5819 
1 1 1 6   87  3  o 17 4.51227e+00 8.82809e-01 7.78438e+01 16.361  4.97195e+00  1.45962e+00  0.00000e+00 0.00000e+00 7.32252e+01 16.361  4.61868e+00 196.361 0.8974 
1 1 1 6   87  4  o 4  1.02303e+01 6.25478e-01 1.76198e+02 51.001  1.81948e+01  2.24698e+01  0.00000e+00 0.00000e+00 1.98803e+02 51.001  2.26052e+01 51.001  0.9826 
1 1 1 6   87  5  o 17 4.05944e+00 9.40870e-01 4.15222e+01 303.300 1.34806e+00  -2.05220e+00 0.00000e+00 0.00000e+00 7.35804e+01 303.300 3.20582e+01 303.300 0.7601 
1 1 1 6   87  6  o 12 4.35330e+00 9.77109e-01 8.08903e+01 348.090 4.94694e+00  -1.04341e+00 0.00000e+00 0.00000e+00 6.43916e+01 348.090 1.64987e+01 168.090 0.8947 
1 1 1 6   87  7  o 10 4.01886e+00 9.52163e-01 4.70503e+01 184.943 -3.06753e+00 -2.65318e-01 0.00000e+00 0.00000e+00 7.52080e+01 184.943 2.81577e+01 184.943 0.8157 
1 1 1 6   87  8  o 19 6.16061e+00 1.19864e+00 1.32124e+02 89.521  9.59094e-02  1.14757e+01  0.00000e+00 0.00000e+00 8.73463e+01 89.521  4.47773e+01 269.521 0.9554 
1 1 1 6   87  9  o 2  4.01974e+00 1.11015e+00 4.83114e+01 268.033 -1.06799e-01 -3.10916e+00 0.00000e+00 0.00000e+00 7.42442e+01 268.033 2.59329e+01 268.033 0.8179 
1 1 1 6   87  10 o 15 6.56779e+00 1.23853e+00 7.12060e+01 178.553 -7.54794e+00 1.90618e-01  0.00000e+00 0.00000e+00 1.56708e+02 178.553 8.55019e+01 178.553 0.9312 
1 1 1 6   87  11 o 5  4.25685e+00 1.16679e+00 7.02492e+01 337.914 5.23574e+00  -2.12454e+00 0.00000e+00 0.00000e+00 7.35037e+01 337.914 3.25450e+00 337.914 0.9066 
1 1 1 6   87  12 f 0  3.48162e+00 1.11449e+00 3.69971e+01 330.505 2.31750e+00  -1.31093e+00 0.00000e+00 0.00000e+00 6.43213e+01 330.505 2.73242e+01 330.505 0.7816 
1 1 1 6   87  13 o 2  2.73666e+00 9.51861e-01 5.93400e+01 334.807 3.99533e+00  -1.87949e+00 0.00000e+00 0.00000e+00 3.00553e+01 334.807 2.92846e+01 154.807 0.8778 
1 1 1 6   88  0  o 13 1.46449e+01 5.16042e-01 2.92043e+02 237.684 -3.47576e+01 -5.49462e+01 0.00000e+00 0.00000e+00 2.49706e+02 237.684 4.23369e+01 57.684  0.9923 
1 1 1 6   88  1  f 0  1.15534e+01 5.47814e-01 1.08688e+02 116.653 -8.47312e+00 1.68813e+01  0.00000e+00 0.00000e+00 3.10554e+02 116.653 2.01865e+02 116.653 0.9732 
1 1 1 6   88  2  o 17 1.58455e+01 5.47250e-01 2.98205e+02 327.514 6.77375e+01  -4.31296e+01 0.00000e+00 0.00000e+00 2.89040e+02 327.514 9.16527e+00 147.514 0.9938 
1 1 1 6   88  3  o 1  4.46394e+00 8.19910e-01 8.53436e+01 240.307 -2.81406e+00 -4.93493e+00 0.00000e+00 0.00000e+00 6.56802e+01 240.307 1.96634e+01 60.307  0.9071 
1 1 1 6   88  4  o 19 1.80994e+01 5.84580e-01 2.86541e+02 258.300 -1.72119e+01 -8.31106e+01 0.00000e+00 0.00000e+00 3.84542e+02 258.300 9.80009e+01 258.300 0.9941 
1 1 1 6   88  5  o 8  1.01035e+01 6.58494e-01 1.99610e+02 5.554   3.22881e+01  3.13945e+00  0.00000e+00 0.00000e+00 1.71363e+02 5.554   2.82474e+01 185.554 0.9845 
1 1 1 6   88  6  o 12 8.67534e+00 8.05802e-01 1.32142e+02 187.110 -1.91584e+01 -2.38961e+00 0.00000e+00 0.00000e+00 1.82896e+02 187.110 5.07547e+01 187.110 0.9737 
1 1 1 6   88  7  o 4  3.57906e+00 8.97499e-01 6.15244e+01 29.634  3.16490e+00  1.80043e+00  0.00000e+00 0.00000e+00 5.16647e+01 29.634  9.85972e+00 209.634 0.8482 
1 1 1 6   88  8  o 8  7.93544e+00 9.76784e-01 1.71795e+02 352.446 2.11038e+01  -2.79874e+00 0.00000e+00 0.00000e+00 1.16999e+02 352.446 5.47961e+01 172.446 0.9762 
1 1 1 6   88  9  o 10 6.03414e+00 1.15782e+00 6.01345e+01 221.771 -4.32996e+00 -3.86752e+00 0.00000e+00 0.00000e+00 1.44339e+02 221.771 8.42046e+01 221.771 0.9092 
1 1 1 6   88  10 o 2  1.21005e+01 9.60671e-01 1.93706e+02 296.965 2.09256e+01  -4.11315e+01 0.00000e+00 0.00000e+00 2.52203e+02 296.965 5.84969e+01 296.965 0.9891 
1 1 1 6   88  11 o 18 3.82991e+00 1.15868e+00 5.43844e+01 24.579  3.72257e+00  1.70264e+00  0.00000e+00 0.00000e+00 6.92806e+01 24.579  1.48962e+01 24.579  0.8670 
1 1 1 6   88  12 o 5  3.32389e+00 1.07588e+00 8.28375e+01 190.674 -6.23091e+00 -1.17440e+00 0.00000e+00 0.00000e+00 3.06655e+01 190.674 5.21720e+01 10.674  0.9173 
1 1 1 6   88  13 o 8  3.30583e+00 1.08970e+00 2.29653e+01 323.240 1.55522e+00  -1.16176e+00 0.00000e+00 0.00000e+00 6.16399e+01 323.240 3.86745e+01 323.240 0.6879 
1 1 1 6   89  0  o 10 8.85182e+00 5.61577e-01 1.87726e+02 248.728 -1.01896e+01 -2.61726e+01 0.00000e+00 0.00000e+00 1.36263e+02 248.728 5.14628e+01 68.728  0.9820 
1 1 1 6   89  1  o 5  1.31915e+01 5.36413e-01 2.34212e+02 44.590  3.74896e+01  3.69570e+01  0.00000e+00 0.00000e+00 2.52860e+02 44.590  1.86478e+01 44.590  0.9905 
1 1 1 6   89  2  o 19 8.76888e+00 6.14800e-01 1.88854e+02 203.556 -2.46527e+01 -1.07478e+01 0.00000e+00 0.00000e+00 1.31953e+02 203.556 5.69017e+01 23.556  0.9812 
1 1 1 6   89  3  o 19 6.95363e+00 6.85782e-01 1.27913e+02 178.244 -1.39909e+01 4.28840e-01  0.00000e+00 0.00000e+00 1.21933e+02 178.244 5.98035e+00 358.244 0.9636 
1 1 1 6   89  4  o 6  1.14557e+01 6.16173e-01 2.37878e+02 38.292  3.35243e+01  2.64684e+01  0.00000e+00 0.00000e+00 1.84263e+02 38.292  5.36151e+01 218.292 0.9882 
1 1 1 6   89  5  o 6  7.94204e+00 7.56540e-01 1.52509e+02 108.678 -6.20629e+00 1.83592e+01  0.00000e+00 0.00000e+00 1.35887e+02 108.678 1.66223e+01 288.678 0.9738 
1 1 1 6   89  6  o 14 6.45365e+00 8.97245e-01 1.01151e+02 319.496 7.70170e+00  -6.57885e+00 0.00000e+00 0.00000e+00 1.27263e+02 319.496 2.61125e+01 319.496 0.9493 
1 1 1 6   89  7  o 5  5.41420e+00 1.00079e+00 1.44633e+02 314.966 8.22177e+00  -8.23144e+00 0.00000e+00 0.00000e+00 4.83205e+01 314.966 9.63125e+01 134.966 0.9560 
1 1 1 6   89  8  o 8  4.16325e+00 1.04809e+00 6.99258e+01 166.558 -4.53527e+00 1.08395e+00  0.00000e+00 0.00000e+00 6.73855e+01 166.558 2.54034e+00 346.558 0.8849 
1 1 1 6   89  9  o 10 6.22156e+00 1.09202e+00 1.06118e+02 312.803 7.98276e+00  -8.61979e+00 0.00000e+00 0.00000e+00 1.15601e+02 312.803 9.48328e+00 312.803 0.9564 
1 1 1 6   89  10 o 15 5.74796e+00 1.23835e+00 7.96619e+01 119.984 -3.64715e+00 6.32115e+00  0.00000e+00 0.00000e+00 1.19173e+02 119.984 3.95110e+01 119.984 0.9287 
1 1 1 6   89  11 o 19 2.33943e+00 8.20903e-01 5.18630e+01 205.133 -2.81847e+00 -1.32224e+00 0.00000e+00 0.00000e+00 1.93885e+01 205.133 3.24745e+01 25.133  0.8180 
1 1 1 6   89  12 o 9  3.84244e+00 1.14012e+00 5.19469e+01 265.098 -3.62976e-01 -4.23249e+00 0.00000e+00 0.00000e+00 7.28079e+01 265.098 2.08610e+01 265.098 0.8724 
1 1 1 6   89  13 o 12 3.98773e+00 1.18967e+00 8.79373e+01 153.190 -7.34822e+00 3.71348e+00  0.00000e+00 0.00000e+00 5.10665e+01 153.190 3.68708e+01 333.190 0.9371 
1 1 1 6   90  0  o 8  3.28827e+00 8.08562e-01 6.56205e+01 37.008  2.58169e+00  1.94597e+00  0.00000e+00 0.00000e+00 3.55666e+01 37.008  3.00539e+01 217.008 0.8258 
1 1 1 6   90  1  o 10 3.50417e+00 8.05715e-01 1.03200e+02 192.063 -5.29898e+00 -1.13246e+00 0.00000e+00 0.00000e+00 1.46350e+01 192.063 8.85654e+01 12.063  0.9023 
1 1 1 6   90  2  o 8  6.13120e+00 7.89626e-01 1.09685e+02 115.404 -4.34450e+00 9.14797e+00  0.00000e+00 0.00000e+00 1.07263e+02 115.404 2.42254e+00 295.404 0.9493 
1 1 1 6   90  3  o 9  3.36377e+00 8.47216e-01 1.08529e+02 117.366 -2.56160e+00 4.94893e+00  0.00000e+00 0.00000e+00 4.97514e+00 117.366 1.03554e+02 297.366 0.9052 
1 1 1 6   90  4  o 10 5.22592e+00 7.75646e-01 6.10500e+01 242.875 -2.22422e+00 -4.34187e+00 0.00000e+00 0.00000e+00 1.12435e+02 242.875 5.13854e+01 242.875 0.8905 
1 1 1 6   90  5  o 13 1.83943e+01 5.95501e-01 2.81409e+02 250.913 -3.14221e+01 -9.08090e+01 0.00000e+00 0.00000e+00 4.00726e+02 250.913 1.19317e+02 250.913 0.9948 
1 1 1 6   90  6  o 11 7.68698e+00 8.66050e-01 1.57786e+02 71.158  6.99608e+00  2.05010e+01  0.00000e+00 0.00000e+00 1.22053e+02 71.158  3.57328e+01 251.157 0.9766 
1 1 1 6   90  7  o 18 3.39061e+00 9.78139e-01 3.96573e+01 312.209 1.45641e+00  -1.60570e+00 0.00000e+00 0.00000e+00 5.17671e+01 312.209 1.21098e+01 312.209 0.7235 
1 1 1 6   90  8  o 11 3.05381e+00 8.79080e-01 6.34722e+01 227.122 -2.40778e+00 -2.59307e+00 0.00000e+00 0.00000e+00 3.24620e+01 227.122 3.10102e+01 47.122  0.8431 
1 1 1 6   90  9  o 13 3.30523e+00 9.65865e-01 3.05888e+01 113.347 -7.37002e-01 1.70747e+00  0.00000e+00 0.00000e+00 5.23147e+01 113.347 2.17260e+01 113.347 0.6733 
1 1 1 6   90  10 o 17 1.09252e+01 1.01748e+00 1.94614e+02 277.805 5.68373e+00  -4.14663e+01 0.00000e+00 0.00000e+00 2.07332e+02 277.805 1.27179e+01 277.805 0.9880 
1 1 1 6   90  11 o 4  7.50343e+00 1.54416e+00 1.76527e+02 145.397 -1.52106e+01 1.04942e+01  0.00000e+00 0.00000e+00 9.51099e+01 145.397 8.14173e+01 325.397 0.9726 
1 1 1 6   90  12 o 18 5.17267e+00 1.33603e+00 1.26506e+02 22.345  1.16487e+01  4.78819e+00  0.00000e+00 0.00000e+00 5.81438e+01 22.345  6.83618e+01 202.345 0.9594 
1 1 1 6   91  0  o 18 3.52167e+00 8.14801e-01 7.54945e+01 165.469 -3.83057e+00 9.92892e-01  0.00000e+00 0.00000e+00 3.75739e+01 165.469 3.79206e+01 345.469 0.8619 
1 1 1 6   91  1  o 1  1.08882e+01 5.65751e-01 1.55919e+02 267.572 -1.18439e+00 -2.79370e+01 0.00000e+00 0.00000e+00 2.42458e+02 267.572 8.65391e+01 267.572 0.9820 
1 1 1 6   91  2  o 9  1.97259e+00 6.48982e-01 3.89291e+01 76.676  2.94985e-01  1.24556e+00  0.00000e+00 0.00000e+00 5.36431e-01 76.676  3.83927e+01 256.676 0.5369 
1 1 1 6   91  3  o 12 8.13849e+00 6.59209e-01 1.34146e+02 110.975 -6.81959e+00 1.77891e+01  0.00000e+00 0.00000e+00 1.61100e+02 110.975 2.69538e+01 110.975 0.9734 
1 1 1 6   91  4  o 11 6.56249e+00 8.42153e-01 1.34572e+02 341.676 1.28696e+01  -4.26214e+00 0.00000e+00 0.00000e+00 1.00814e+02 341.676 3.37579e+01 161.676 0.9624 
1 1 1 6   91  5  o 15 7.90113e+00 7.57847e-01 1.16422e+02 49.269  9.98094e+00  1.15913e+01  0.00000e+00 0.00000e+00 1.68253e+02 49.269  5.18318e+01 49.269  0.9667 
1 1 1 6   91  6  o 11 4.73298e+00 9.69767e-01 6.86172e+01 208.995 -4.59707e+00 -2.54763e+00 0.00000e+00 0.00000e+00 8.99461e+01 208.995 2.13289e+01 208.995 0.8990 
1 1 1 6   91  7  o 12 4.40148e+00 1.05720e+00 9.64199e+01 323.779 5.37293e+00  -3.93546e+00 0.00000e+00 0.00000e+00 5.47099e+01 323.779 4.17100e+01 143.779 0.9215 
1 1 1 6   91  8  o 13 5.77587e+00 1.07214e+00 3.13420e+01 141.826 -2.42884e+00 1.90953e+00  0.00000e+00 0.00000e+00 1.44316e+02 141.826 1.12974e+02 141.826 0.8164 
1 1 1 6   91  9  o 11 4.16445e+00 1.11429e+00 6.56155e+01 43.743  3.46480e+00  3.31600e+00  0.00000e+00 0.00000e+00 7.21709e+01 43.743  6.55539e+00 43.743  0.8884 
1 1 1 6   91  10 o 8  2.86306e+00 9.49045e-01 4.36061e+01 22.873  2.69222e+00  1.13576e+00  0.00000e+00 0.00000e+00 4.20965e+01 22.873  1.50967e+00 202.873 0.8040 
1 1 1 6   91  11 o 8  5.62859e+00 1.34118e+00 6.99760e+01 165.337 -6.49181e+00 1.69859e+00  0.00000e+00 0.00000e+00 1.23180e+02 165.337 5.32038e+01 165.337 0.9221 
1 1 1 6   91  12 o 18 4.51189e+00 1.32016e+00 6.57841e+01 53.467  3.46937e+00  4.68293e+00  0.00000e+00 0.00000e+00 8.68731e+01 53.467  2.10890e+01 53.467  0.9096 
1 1 1 6   92  0  o 1  7.61630e+00 6.65054e-01 1.46940e+02 255.350 -4.68478e+00 -1.79212e+01 0.00000e+00 0.00000e+00 1.28950e+02 255.350 1.79901e+01 75.350  0.9726 
1 1 1 6   92  1  o 1  8.86911e+00 6.12522e-01 2.00115e+02 34.733  2.28816e+01  1.58632e+01  0.00000e+00 0.00000e+00 1.24282e+02 34.733  7.58332e+01 214.733 0.9819 
1 1 1 6   92  2  o 15 3.86700e+00 8.34438e-01 3.03420e+01 141.811 -1.48283e+00 1.16643e+00  0.00000e+00 0.00000e+00 6.73746e+01 141.811 3.70325e+01 141.811 0.6782 
1 1 1 6   92  3  o 7  4.02828e+00 8.69477e-01 5.89412e+01 342.137 3.63839e+00  -1.17256e+00 0.00000e+00 0.00000e+00 6.95907e+01 342.137 1.06495e+01 342.137 0.8563 
1 1 1 6   92  4  o 3  4.28801e+00 8.90460e-01 6.93294e+01 245.744 -1.96567e+00 -4.36238e+00 0.00000e+00 0.00000e+00 7.25745e+01 245.744 3.24517e+00 245.744 0.8881 
1 1 1 6   92  5  o 5  3.62649e+00 8.72849e-01 1.27606e+01 318.917 6.20533e-01  -5.41000e-01 0.00000e+00 0.00000e+00 3.86241e+01 318.917 2.58635e+01 318.917 0.3803 
1 1 1 6   92  6  f 0  2.35467e+00 7.66917e-01 4.75751e+01 25.147  1.86725e+00  8.76551e-01  0.00000e+00 0.00000e+00 1.45191e+01 25.147  3.30560e+01 205.147 0.7078 
1 1 1 6   92  7  o 8  9.38740e+00 7.96437e-01 1.68372e+02 345.371 2.89049e+01  -7.54486e+00 0.00000e+00 0.00000e+00 1.75411e+02 345.371 7.03831e+00 345.371 0.9831 
1 1 1 6   92  8  o 8  9.90613e+00 8.87655e-01 1.73767e+02 126.909 -2.12527e+01 2.82971e+01  0.00000e+00 0.00000e+00 1.89912e+02 126.909 1.61457e+01 126.909 0.9858 
1 1 1 6   92  9  o 2  3.09427e+00 9.68592e-01 3.07857e+01 253.666 -5.13923e-01 -1.75361e+00 0.00000e+00 0.00000e+00 4.60901e+01 253.666 1.53045e+01 253.666 0.6673 
1 1 1 6   92  10 o 3  8.04860e+00 1.20326e+00 1.26679e+02 205.262 -1.62966e+01 -7.69019e+00 0.00000e+00 0.00000e+00 1.64453e+02 205.262 3.77737e+01 205.262 0.9718 
1 1 1 6   92  11 o 19 5.53751e+00 1.25795e+00 1.03215e+02 33.605  9.27889e+00  6.16595e+00  0.00000e+00 0.00000e+00 9.33306e+01 33.605  9.88475e+00 213.605 0.9540 
1 1 1 6   92  12 o 19 2.86881e+00 9.59226e-01 1.95833e+01 180.725 -1.53213e+00 -1.93991e-02 0.00000e+00 0.00000e+00 4.48544e+01 180.725 2.52712e+01 180.725 0.6040 
1 1 1 6   93  0  o 9  5.96734e+00 6.85836e-01 1.29593e+02 168.955 -1.30828e+01 2.55367e+00  0.00000e+00 0.00000e+00 8.40902e+01 168.955 4.55029e+01 348.955 0.9617 
1 1 1 6   93  1  o 1  5.28814e+00 7.76108e-01 1.18658e+02 67.304  3.69944e+00  8.84542e+00  0.00000e+00 0.00000e+00 6.77101e+01 67.304  5.09476e+01 247.304 0.9463 
1 1 1 6   93  2  o 3  4.80854e+00 7.89538e-01 7.85067e+01 250.313 -2.13191e+00 -5.95837e+00 0.00000e+00 0.00000e+00 8.57644e+01 250.313 7.25770e+00 250.313 0.9172 
1 1 1 6   93  3  f 0  3.27873e+00 8.48682e-01 7.31036e+01 215.778 -3.20397e+00 -2.30892e+00 0.00000e+00 0.00000e+00 3.21207e+01 215.778 4.09830e+01 35.778  0.8615 
1 1 1 6   93  4  o 3  1.35869e+01 6.16063e-01 2.59938e+02 232.150 -4.20289e+01 -5.40855e+01 0.00000e+00 0.00000e+00 2.42488e+02 232.150 1.74495e+01 52.150  0.9927 
1 1 1 6   93  5  o 4  2.25481e+00 7.43338e-01 2.96685e+01 142.895 -9.77720e-01 7.39590e-01  0.00000e+00 0.00000e+00 1.40701e+01 142.895 1.55984e+01 322.895 0.5207 
1 1 1 6   93  6  o 19 8.41971e+00 7.91252e-01 1.29868e+02 68.223  7.00723e+00  1.75393e+01  0.00000e+00 0.00000e+00 1.75323e+02 68.223  4.54553e+01 68.223  0.9732 
1 1 1 6   93  7  o 13 1.28142e+01 8.07833e-01 2.14634e+02 212.846 -4.47303e+01 -2.88775e+01 0.00000e+00 0.00000e+00 2.58080e+02 212.846 4.34461e+01 212.846 0.9906 
1 1 1 6   93  8  f 0  6.58768e+00 1.09321e+00 9.64022e+01 85.540  8.33821e-01  1.06891e+01  0.00000e+00 0.00000e+00 1.37143e+02 85.540  4.07408e+01 85.540  0.9522 
1 1 1 6   93  9  o 4  1.31252e+01 8.93885e-01 1.81815e+02 272.442 2.19094e+00  -5.13744e+01 0.00000e+00 0.00000e+00 3.01969e+02 272.442 1.20154e+02 272.442 0.9902 
1 1 1 6   93  10 f 0  2.68971e+00 9.04723e-01 5.16471e+01 243.343 -1.48074e+00 -2.94964e+00 0.00000e+00 0.00000e+00 3.14191e+01 243.343 2.02280e+01 63.343  0.8300 
1 1 1 6   93  11 o 14 3.33898e+00 1.05535e+00 7.36555e+01 90.578  -5.70332e-02 5.65259e+00  0.00000e+00 0.00000e+00 3.89395e+01 90.578  3.47160e+01 270.578 0.9066 
1 1 1 6   93  12 o 16 3.52705e+00 1.12562e+00 4.87559e+01 247.471 -1.56573e+00 -3.77466e+00 0.00000e+00 0.00000e+00 6.49026e+01 247.471 1.61467e+01 247.471 0.8668 
1 1 1 6   94  0  o 14 5.28387e+00 7.73075e-01 7.09008e+01 243.756 -2.62846e+00 -5.33141e+00 0.00000e+00 0.00000e+00 1.08377e+02 243.756 3.74766e+01 243.756 0.9115 
1 1 1 6   94  1  o 11 4.95112e+00 8.46879e-01 1.26167e+02 21.821  8.87665e+00  3.55422e+00  0.00000e+00 0.00000e+00 4.82504e+01 21.821  7.79170e+01 201.821 0.9462 
1 1 1 6   94  2  o 7  2.50657e+00 7.73877e-01 2.63157e+01 169.687 -1.11036e+00 2.02047e-01  0.00000e+00 0.00000e+00 1.94299e+01 169.687 6.88577e+00 349.687 0.4901 
1 1 1 6   94  3  o 16 4.93457e+00 8.73551e-01 9.85292e+01 171.124 -7.54466e+00 1.17820e+00  0.00000e+00 0.00000e+00 7.27460e+01 171.124 2.57833e+01 351.124 0.9320 
1 1 1 6   94  4  o 7  1.16146e+01 6.35201e-01 1.96583e+02 197.755 -4.10423e+01 -1.31415e+01 0.00000e+00 0.00000e+00 2.30923e+02 197.755 3.43403e+01 197.755 0.9883 
1 1 1 6   94  5  o 11 7.74454e+00 8.02028e-01 1.10422e+02 64.245  6.71430e+00  1.39174e+01  0.00000e+00 0.00000e+00 1.68498e+02 64.245  5.80758e+01 64.245  0.9671 
1 1 1 6   94  6  o 19 2.53046e+00 8.07027e-01 7.03410e+01 172.232 -3.26078e+00 4.44807e-01  0.00000e+00 0.00000e+00 7.81066e+00 172.232 6.25303e+01 352.232 0.8294 
1 1 1 6   94  7  o 10 2.29006e+00 7.79942e-01 9.49675e+01 281.633 8.96564e-01  -4.35502e+00 0.00000e+00 0.00000e+00 2.00442e+01 101.633 1.15012e+02 101.633 0.8787 
1 1 1 6   94  8  o 13 6.58527e+00 1.03727e+00 1.09357e+02 342.763 1.27642e+01  -3.96020e+00 0.00000e+00 0.00000e+00 1.26413e+02 342.763 1.70558e+01 342.763 0.9618 
1 1 1 6   94  9  o 3  4.42536e+00 1.21090e+00 7.67931e+01 169.866 -6.10187e+00 1.09063e+00  0.00000e+00 0.00000e+00 7.39468e+01 169.866 2.84624e+00 349.866 0.9153 
1 1 1 6   94  10 o 9  6.35039e+00 1.28594e+00 9.63683e+01 42.351  7.78180e+00  7.09358e+00  0.00000e+00 0.00000e+00 1.28356e+02 42.351  3.19881e+01 42.351  0.9513 
1 1 1 6   94  11 o 6  4.01965e+00 1.19628e+00 4.92559e+01 314.096 2.90434e+00  -2.99742e+00 0.00000e+00 0.00000e+00 8.07690e+01 314.096 3.15130e+01 314.096 0.8699 
1 1 1 6   94  12 o 15 8.56179e+00 1.40846e+00 1.24530e+02 87.579  8.00470e-01  1.89350e+01  0.00000e+00 0.00000e+00 1.85188e+02 87.579  6.06577e+01 87.579  0.9732 
1 1 1 6   95  0  o 13 7.39320e+00 6.58631e-01 1.02420e+02 274.011 9.55940e-01  -1.36319e+01 0.00000e+00 0.00000e+00 1.62449e+02 274.011 6.00290e+01 274.011 0.9627 
1 1 1 6   95  1  o 6  1.47379e+01 5.54328e-01 2.22818e+02 87.663  2.52013e+00  6.17503e+01  0.00000e+00 0.00000e+00 3.21308e+02 87.663  9.84896e+01 87.663  0.9919 
1 1 1 6   95  2  o 19 1.02170e+01 6.14791e-01 1.84373e+02 212.546 -2.80939e+01 -1.79298e+01 0.00000e+00 0.00000e+00 1.90235e+02 212.546 5.86194e+00 212.546 0.9849 
1 1 1 6   95  3  o 7  3.69844e+00 9.12638e-01 8.18874e+01 100.622 -9.69919e-01 5.17175e+00  0.00000e+00 0.00000e+00 4.19201e+01 100.622 3.99672e+01 280.622 0.8991 
1 1 1 6   95  4  o 4  6.06360e+00 8.56197e-01 1.07001e+02 111.061 -3.74213e+00 9.71773e+00  0.00000e+00 0.00000e+00 1.07632e+02 111.061 6.31118e-01 111.061 0.9507 
1 1 1 6   95  5  o 6  7.85048e+00 7.76232e-01 1.34605e+02 43.531  1.33307e+01  1.26641e+01  0.00000e+00 0.00000e+00 1.49615e+02 43.531  1.50098e+01 43.531  0.9724 
1 1 1 6   95  6  o 19 3.49742e+00 9.52660e-01 8.05525e+01 201.469 -4.57670e+00 -1.79991e+00 0.00000e+00 0.00000e+00 3.55145e+01 201.469 4.50381e+01 21.469  0.8914 
1 1 1 6   95  7  o 11 4.60865e+00 1.16574e+00 1.42270e+02 55.590  6.24315e+00  9.11464e+00  0.00000e+00 0.00000e+00 2.13148e+01 55.590  1.20956e+02 235.590 0.9536 
1 1 1 6   95  8  o 13 3.40515e+00 9.59118e-01 2.68213e+01 162.279 -1.67974e+00 5.36739e-01  0.00000e+00 0.00000e+00 5.61590e+01 162.279 2.93378e+01 162.279 0.6548 
1 1 1 6   95  9  o 15 4.09306e+00 1.11929e+00 7.71771e+01 266.671 -3.72983e-01 -6.41250e+00 0.00000e+00 0.00000e+00 6.26848e+01 266.671 1.44923e+01 86.671  0.9185 
1 1 1 6   95  10 o 12 3.03926e+00 9.86164e-01 5.00512e+01 148.187 -2.98026e+00 1.84877e+00  0.00000e+00 0.00000e+00 4.50634e+01 148.187 4.98778e+00 328.187 0.8415 
1 1 1 6   95  11 o 12 3.60174e+00 1.11768e+00 3.92084e+01 97.220  -4.25229e-01 3.35670e+00  0.00000e+00 0.00000e+00 7.25676e+01 97.220  3.33592e+01 97.220  0.8348 
1 1 1 6   95  12 o 19 3.10833e+00 1.03279e+00 8.20362e+01 218.741 -5.62959e+00 -4.51676e+00 0.00000e+00 0.00000e+00 2.51370e+01 218.741 5.68992e+01 38.741  0.9279 
1 1 1 6   96  0  o 13 7.46507e+00 6.71345e-01 1.25667e+02 123.180 -8.86411e+00 1.35560e+01  0.00000e+00 0.00000e+00 1.43355e+02 123.180 1.76884e+01 123.180 0.9686 
1 1 1 6   96  1  o 16 1.16093e+01 5.92120e-01 2.37020e+02 244.654 -2.30606e+01 -4.86841e+01 0.00000e+00 0.00000e+00 1.90965e+02 244.654 4.60545e+01 64.654  0.9907 
1 1 1 6   96  2  f 0  1.20868e+01 6.16012e-01 1.60856e+02 52.255  2.42228e+01  3.12902e+01  0.00000e+00 0.00000e+00 2.83273e+02 52.255  1.22416e+02 52.255  0.9873 
1 1 1 6   96  3  o 14 5.26539e+00 8.37114e-01 1.16667e+02 9.322   1.05679e+01  1.73477e+00  0.00000e+00 0.00000e+00 6.99321e+01 9.322   4.67352e+01 189.322 0.9521 
1 1 1 6   96  4  o 4  5.75997e+00 8.59008e-01 1.50995e+02 149.142 -1.28785e+01 7.69481e+00  0.00000e+00 0.00000e+00 5.61329e+01 149.142 9.48624e+01 329.142 0.9661 
1 1 1 6   96  5  o 15 5.14998e+00 9.78433e-01 7.09922e+01 221.250 -4.59659e+00 -4.03109e+00 0.00000e+00 0.00000e+00 1.04230e+02 221.250 3.32378e+01 221.250 0.9141 
1 1 1 6   96  6  o 1  2.37419e+00 7.80647e-01 4.16550e+01 56.999  1.10948e+00  1.70841e+00  0.00000e+00 0.00000e+00 2.05318e+01 56.999  2.11233e+01 236.999 0.7038 
1 1 1 6   96  7  o 9  3.52722e+00 1.04978e+00 7.69967e+01 286.677 1.44711e+00  -4.83054e+00 0.00000e+00 0.00000e+00 4.03933e+01 286.677 3.66034e+01 106.677 0.8944 
1 1 1 6   96  8  o 17 9.00187e+00 9.53248e-01 1.15820e+02 191.443 -2.10880e+01 -4.26846e+00 0.00000e+00 0.00000e+00 2.11209e+02 191.443 9.53893e+01 191.443 0.9765 
1 1 1 6   96  9  o 3  4.76481e+00 1.19551e+00 6.57360e+01 40.986  4.46024e+00  3.87527e+00  0.00000e+00 0.00000e+00 9.56978e+01 40.986  2.99618e+01 40.986  0.9109 
1 1 1 6   96  10 o 12 4.85697e+00 1.23038e+00 7.14743e+01 252.003 -2.07337e+00 -6.38244e+00 0.00000e+00 0.00000e+00 9.50558e+01 252.003 2.35815e+01 252.003 0.9222 
1 1 1 6   96  11 o 12 3.41429e+00 1.08969e+00 5.44961e+01 24.386  4.07062e+00  1.84528e+00  0.00000e+00 0.00000e+00 5.70998e+01 24.386  2.60375e+00 24.386  0.8794 
1 1 1 6   97  0  o 4  9.77066e+00 6.05050e-01 1.68633e+02 250.451 -1.12700e+01 -3.17388e+01 0.00000e+00 0.00000e+00 1.89351e+02 250.451 2.07176e+01 250.451 0.9850 
1 1 1 6   97  1  o 5  3.17887e+00 8.16352e-01 4.17834e+01 90.019  -7.48983e-04 2.29261e+00  0.00000e+00 0.00000e+00 4.57821e+01 90.019  3.99866e+00 90.019  0.7404 
1 1 1 6   97  2  o 4  1.16453e+01 6.04186e-01 1.70895e+02 81.355  5.84984e+00  3.84752e+01  0.00000e+00 0.00000e+00 2.56805e+02 81.355  8.59098e+01 81.355  0.9871 
1 1 1 6   97  3  o 6  2.09901e+00 7.00811e-01 4.78695e+01 335.527 1.71507e+00  -7.80618e-01 0.00000e+00 0.00000e+00 5.07525e+00 335.527 4.27943e+01 155.527 0.6778 
1 1 1 6   97  4  o 7  8.87260e+00 7.15700e-01 1.48712e+02 312.312 1.69227e+01  -1.85898e+01 0.00000e+00 0.00000e+00 1.74828e+02 312.312 2.61160e+01 312.312 0.9799 
1 1 1 6   97  5  o 11 9.38927e+00 7.62462e-01 1.60874e+02 217.609 -2.33535e+01 -1.79904e+01 0.00000e+00 0.00000e+00 1.82538e+02 217.609 2.16634e+01 217.609 0.9829 
1 1 1 6   97  6  o 3  4.51169e+00 1.04774e+00 5.34931e+01 316.839 3.23450e+00  -3.03327e+00 0.00000e+00 0.00000e+00 9.39597e+01 316.839 4.04667e+01 316.839 0.8784 
1 1 1 6   97  7  o 7  4.29485e+00 1.16567e+00 5.27604e+01 358.873 3.84761e+00  -7.56849e-02 0.00000e+00 0.00000e+00 8.42382e+01 358.873 3.14779e+01 358.873 0.8574 
1 1 1 6   97  8  o 8  8.18881e+00 9.47481e-01 1.36546e+02 156.833 -2.32268e+01 9.93919e+00  0.00000e+00 0.00000e+00 1.61941e+02 156.833 2.53953e+01 156.833 0.9800 
1 1 1 6   97  9  o 2  5.89046e+00 1.20975e+00 8.18613e+01 215.496 -7.39933e+00 -5.27717e+00 0.00000e+00 0.00000e+00 1.24743e+02 215.496 4.28818e+01 215.496 0.9433 
1 1 1 6   97  10 o 2  3.93957e+00 1.14257e+00 2.43878e+01 227.136 -1.48071e+00 -1.59542e+00 0.00000e+00 0.00000e+00 8.17448e+01 227.136 5.73571e+01 227.136 0.7248 
1 1 1 6   97  11 o 17 3.00049e+00 9.91890e-01 4.88169e+01 134.049 -2.76590e+00 2.85930e+00  0.00000e+00 0.00000e+00 4.73611e+01 134.049 1.45582e+00 314.049 0.8627 
1 1 1 6   98  0  o 16 5.38932e+00 8.30528e-01 1.45102e+02 102.129 -2.67250e+00 1.24350e+01  0.00000e+00 0.00000e+00 4.72536e+01 102.129 9.78484e+01 282.129 0.9598 
1 1 1 6   98  1  o 11 2.72782e+00 8.09313e-01 8.26422e+01 25.515  3.33881e+00  1.59357e+00  0.00000e+00 0.00000e+00 3.68553e+00 25.515  7.89567e+01 205.515 0.8509 
1 1 1 6   98  2  o 15 3.00792e+00 8.27269e-01 9.93238e+01 292.024 1.96755e+00  -4.86391e+00 0.00000e+00 0.00000e+00 1.24424e+00 292.024 9.80796e+01 112.024 0.8988 
1 1 1 6   98  3  o 1  5.93073e+00 8.63214e-01 1.38441e+02 124.134 -7.65553e+00 1.12927e+01  0.00000e+00 0.00000e+00 7.39468e+01 124.134 6.44943e+01 304.134 0.9626 
1 1 1 6   98  4  f 0  2.75068e+00 8.01052e-01 1.24728e+02 132.728 -4.38355e+00 4.74577e+00  0.00000e+00 0.00000e+00 3.06867e+01 312.728 1.55414e+02 312.728 0.9190 
1 1 1 6   98  5  o 9  3.13146e+00 8.69982e-01 3.16095e+01 40.835  1.45032e+00  1.25341e+00  0.00000e+00 0.00000e+00 4.80321e+01 40.835  1.64226e+01 40.835  0.6836 
1 1 1 6   98  6  o 3  3.02875e+00 8.90108e-01 5.68778e+01 261.723 -4.78985e-01 -3.29276e+00 0.00000e+00 0.00000e+00 3.68084e+01 261.723 2.00694e+01 81.723  0.8316 
1 1 1 6   98  7  o 3  6.19565e+00 1.10409e+00 7.17406e+01 162.642 -7.45806e+00 2.33126e+00  0.00000e+00 0.00000e+00 1.43396e+02 162.642 7.16559e+01 162.642 0.9336 
1 1 1 6   98  8  o 6  4.99184e+00 1.12870e+00 7.64987e+01 144.538 -6.27276e+00 4.46810e+00  0.00000e+00 0.00000e+00 9.66121e+01 144.538 2.01133e+01 144.538 0.9326 
1 1 1 6   98  9  o 14 5.86374e+00 1.17822e+00 1.18064e+02 39.477  1.04662e+01  8.62077e+00  0.00000e+00 0.00000e+00 9.17167e+01 39.477  2.63472e+01 219.477 0.9624 
1 1 1 6   98  10 f 0  2.27252e+00 7.92296e-01 3.74516e+01 270.474 2.31255e-02  -2.79296e+00 0.00000e+00 0.00000e+00 2.95547e+01 270.474 7.89693e+00 90.474  0.7934 
1 1 1 6   98  11 o 10 4.27415e+00 1.19550e+00 6.28917e+01 248.694 -2.12523e+00 -5.44931e+00 0.00000e+00 0.00000e+00 8.15809e+01 248.694 1.86892e+01 248.694 0.9099 
1 1 1 6   99  0  o 15 5.04682e+00 8.40097e-01 9.34514e+01 200.730 -7.68731e+00 -2.90936e+00 0.00000e+00 0.00000e+00 8.23512e+01 200.730 1.11002e+01 20.730  0.9370 
1 1 1 6   99  1  o 8  4.40814e+00 8.88525e-01 4.24650e+01 33.910  2.78072e+00  1.86928e+00  0.00000e+00 0.00000e+00 9.40543e+01 33.910  5.15892e+01 33.910  0.8329 
1 1 1 6   99  2  o 14 4.15704e+00 9.07610e-01 7.79294e+01 329.892 4.54395e+00  -2.63490e+00 0.00000e+00 0.00000e+00 6.10398e+01 329.892 1.68896e+01 149.892 0.8989 
1 1 1 6   99  3  o 14 6.90526e+00 7.73394e-01 1.26681e+02 130.681 -1.07231e+01 1.24750e+01  0.00000e+00 0.00000e+00 1.22206e+02 130.681 4.47491e+00 310.681 0.9691 
1 1 1 6   99  4  o 8  1.00548e+01 6.88115e-01 1.76038e+02 280.201 6.47706e+00  -3.59958e+01 0.00000e+00 0.00000e+00 1.92781e+02 280.201 1.67432e+01 280.201 0.9862 
1 1 1 6   99  5  o 6  2.41164e+00 7.96689e-01 8.31542e+01 106.737 -1.25975e+00 4.18922e+00  0.00000e+00 0.00000e+00 4.53625e+00 286.737 8.76904e+01 286.737 0.8765 
1 1 1 6   99  6  o 13 4.31007e+00 9.57312e-01 7.10509e+01 259.960 -1.04769e+00 -5.91742e+00 0.00000e+00 0.00000e+00 7.52087e+01 259.960 4.15772e+00 259.960 0.9125 
1 1 1 6   99  7  o 3  3.47618e+00 1.01286e+00 2.18951e+01 242.693 -6.89385e-01 -1.33528e+00 0.00000e+00 0.00000e+00 5.52442e+01 242.693 3.33491e+01 242.693 0.5968 
1 1 1 6   99  8  o 15 3.02602e+00 9.61495e-01 3.44715e+01 249.169 -8.49924e-01 -2.23375e+00 0.00000e+00 0.00000e+00 5.01752e+01 249.169 1.57036e+01 249.169 0.7525 
1 1 1 6   99  9  o 12 5.81405e+00 1.13660e+00 1.04118e+02 345.381 1.27597e+01  -3.32817e+00 0.00000e+00 0.00000e+00 1.03593e+02 345.381 5.25191e-01 165.381 0.9613 
1 1 1 6   99  10 o 10 7.35112e+00 1.16789e+00 1.23245e+02 192.958 -1.95053e+01 -4.48794e+00 0.00000e+00 0.00000e+00 1.42947e+02 192.958 1.97014e+01 192.958 0.9747 
1 1 1 6   99  11 o 15 3.22363e+00 1.04352e+00 7.46078e+01 41.619  5.10648e+00  4.53673e+00  0.00000e+00 0.00000e+00 3.59594e+01 41.619  3.86484e+01 221.619 0.9236 
1 1 1 6   100 0  o 14 8.05021e+00 6.68098e-01 1.15262e+02 345.464 1.64161e+01  -4.25638e+00 0.00000e+00 0.00000e+00 1.74964e+02 345.464 5.97014e+01 345.464 0.9701 
1 1 1 6   100 1  o 15 2.82987e+00 8.28866e-01 7.42482e+01 133.028 -2.56825e+00 2.75138e+00  0.00000e+00 0.00000e+00 1.55648e+01 133.028 5.86835e+01 313.028 0.8538 
1 1 1 6   100 2  o 3  9.47711e+00 6.45073e-01 1.64325e+02 231.314 -1.95367e+01 -2.43979e+01 0.00000e+00 0.00000e+00 1.82336e+02 231.314 1.80111e+01 231.314 0.9839 
1 1 1 6   100 3  o 18 3.92504e+00 9.38848e-01 8.90583e+01 65.397  2.60221e+00  5.68297e+00  0.00000e+00 0.00000e+00 4.46344e+01 65.397  4.44239e+01 245.397 0.9161 
1 1 1 6   100 4  o 18 5.44642e+00 8.79532e-01 6.12718e+01 28.024  5.79228e+00  3.08297e+00  0.00000e+00 0.00000e+00 1.25098e+02 28.024  6.38264e+01 28.024  0.9203 
1 1 1 6   100 5  o 2  3.36237e+00 9.36597e-01 1.54705e+01 76.373  2.29545e-01  9.46898e-01  0.00000e+00 0.00000e+00 3.91897e+01 76.373  2.37192e+01 76.373  0.4372 
1 1 1 6   100 6  o 14 5.07439e+00 1.06295e+00 1.08390e+02 14.345  9.65856e+00  2.46996e+00  0.00000e+00 0.00000e+00 7.05378e+01 14.345  3.78524e+01 194.345 0.9484 
1 1 1 6   100 7  o 5  9.72818e+00 9.51634e-01 1.11062e+02 261.364 -3.78612e+00 -2.49277e+01 0.00000e+00 0.00000e+00 2.43311e+02 261.364 1.32249e+02 261.364 0.9800 
1 1 1 6   100 8  f 0  4.36672e+00 1.13981e+00 9.23704e+01 107.880 -2.40488e+00 7.45440e+00  0.00000e+00 0.00000e+00 5.91710e+01 107.880 3.31994e+01 287.880 0.9338 
1 1 1 6   100 9  o 3  4.65691e+00 1.25699e+00 1.29797e+02 38.989  9.00213e+00  7.28701e+00  0.00000e+00 0.00000e+00 3.55781e+01 38.989  9.42192e+01 218.989 0.9558 
1 1 1 6   100 10 o 15 4.88701e+00 1.17891e+00 9.32475e+01 248.216 -3.94654e+00 -9.87526e+00 0.00000e+00 0.00000e+00 7.95055e+01 248.216 1.37420e+01 68.216  0.9518 
1 1 1 6   101 0  f 0  9.35395e+00 6.53446e-01 1.14122e+02 44.457  1.55090e+01  1.52178e+01  0.00000e+00 0.00000e+00 2.25327e+02 44.457  1.11205e+02 44.457  0.9767 
1 1 1 6   101 1  o 13 5.19858e+00 8.84329e-01 1.06149e+02 141.180 -7.70353e+00 6.19819e+00  0.00000e+00 0.00000e+00 7.69967e+01 141.180 2.91526e+01 321.180 0.9480 
1 1 1 6   101 2  o 7  3.43263e+00 8.50214e-01 1.13968e+01 246.574 -2.93418e-01 -6.77195e-01 0.00000e+00 0.00000e+00 3.27443e+01 246.574 2.13475e+01 246.574 0.3460 
1 1 1 6   101 3  o 12 3.81826e+00 9.01619e-01 8.38433e+01 33.705  5.04921e+00  3.36808e+00  0.00000e+00 0.00000e+00 4.57993e+01 33.705  3.80440e+01 213.705 0.9134 
1 1 1 6   101 4  o 15 2.35560e+00 7.72758e-01 6.33496e+01 131.764 -2.08283e+00 2.33250e+00  0.00000e+00 0.00000e+00 8.36149e+00 131.764 5.49881e+01 311.763 0.8190 
1 1 1 6   101 5  o 18 5.00866e+00 9.52205e-01 8.25383e+01 17.871  7.79780e+00  2.51428e+00  0.00000e+00 0.00000e+00 9.18778e+01 17.871  9.33949e+00 17.871  0.9368 
1 1 1 6   101 6  o 5  5.47837e+00 1.05068e+00 5.43622e+01 309.647 3.65012e+00  -4.40491e+00 0.00000e+00 0.00000e+00 1.30481e+02 309.647 7.61186e+01 309.647 0.9078 
1 1 1 6   101 7  o 10 2.79802e+00 9.08704e-01 6.19139e+01 194.080 -3.72821e+00 -9.35108e-01 0.00000e+00 0.00000e+00 2.72210e+01 194.080 3.46929e+01 14.080  0.8572 
1 1 1 6   101 8  o 9  3.61437e+00 1.03169e+00 3.38718e+01 85.740  2.01796e-01  2.70884e+00  0.00000e+00 0.00000e+00 7.17611e+01 85.740  3.78893e+01 85.740  0.7866 
1 1 1 6   101 9  f 0  3.27605e+00 1.07025e+00 1.05676e+02 254.739 -2.27414e+00 -8.33531e+00 0.00000e+00 0.00000e+00 8.73321e+00 254.739 9.69430e+01 74.739  0.9402 
1 1 1 6   101 10 o 14 3.56930e+00 1.10029e+00 8.96786e+01 109.729 -2.78628e+00 7.76926e+00  0.00000e+00 0.00000e+00 3.45444e+01 109.729 5.51342e+01 289.729 0.9373 
1 1 1 6   102 0  o 1  6.41543e+00 7.59033e-01 1.14630e+02 89.526  1.20965e-01  1.46113e+01  0.00000e+00 0.00000e+00 1.15363e+02 89.526  7.33585e-01 89.526  0.9652 
1 1 1 6   102 1  o 8  6.69260e+00 7.98370e-01 5.71399e+01 224.997 -5.51347e+00 -5.51291e+00 0.00000e+00 0.00000e+00 1.74964e+02 224.997 1.17824e+02 224.997 0.9335 
1 1 1 6   102 2  o 3  4.19944e+00 8.86477e-01 1.09803e+02 331.397 7.74463e+00  -4.22295e+00 0.00000e+00 0.00000e+00 3.71081e+01 331.397 7.26950e+01 151.398 0.9415 
1 1 1 6   102 3  o 3  1.31443e+01 6.32229e-01 2.03286e+02 31.327  5.49405e+01  3.34393e+01  0.00000e+00 0.00000e+00 2.81360e+02 31.327  7.80736e+01 31.327  0.9922 
1 1 1 6   102 4  o 7  3.13227e+00 9.16991e-01 8.44966e+01 307.241 3.26294e+00  -4.29245e+00 0.00000e+00 0.00000e+00 2.04679e+01 307.241 6.40286e+01 127.241 0.9017 
1 1 1 6   102 5  o 5  4.77296e+00 9.87353e-01 8.04382e+01 50.696  4.64678e+00  5.67638e+00  0.00000e+00 0.00000e+00 8.43543e+01 50.696  3.91605e+00 50.696  0.9291 
1 1 1 6   102 6  o 3  4.59623e+00 1.07817e+00 4.63432e+01 350.502 4.26658e+00  -7.13848e-01 0.00000e+00 0.00000e+00 1.03089e+02 350.502 5.67461e+01 350.502 0.8750 
1 1 1 6   102 7  o 6  9.89388e+00 8.84224e-01 1.46083e+02 198.539 -3.39883e+01 -1.13980e+01 0.00000e+00 0.00000e+00 2.16327e+02 198.539 7.02437e+01 198.539 0.9860 
1 1 1 6   102 8  o 18 2.89734e+00 8.96258e-01 5.90094e+01 347.178 4.32737e+00  -9.84938e-01 0.00000e+00 0.00000e+00 3.55306e+01 347.178 2.34788e+01 167.178 0.8785 
1 1 1 6   102 9  o 10 2.49543e+00 8.82363e-01 3.28480e+01 260.274 -4.19249e-01 -2.44611e+00 0.00000e+00 0.00000e+00 3.78542e+01 260.274 5.00626e+00 260.274 0.7630 
1 1 1 6   102 10 o 16 3.50837e+00 1.07755e+00 6.34085e+01 199.035 -5.67694e+00 -1.95859e+00 0.00000e+00 0.00000e+00 5.54218e+01 199.035 7.98673e+00 19.035  0.9124 
1 1 1 6   103 0  o 6  2.13889e+00 7.07762e-01 1.32879e+01 218.241 -4.74638e-01 -3.74051e-01 0.00000e+00 0.00000e+00 9.67822e+00 218.241 3.60971e+00 38.241  0.2892 
1 1 1 6   103 1  o 7  1.01699e+01 6.53782e-01 2.12764e+02 343.323 4.65603e+01  -1.39482e+01 0.00000e+00 0.00000e+00 1.61058e+02 343.323 5.17068e+01 163.323 0.9897 
1 1 1 6   103 2  o 18 9.67653e+00 6.94653e-01 1.42032e+02 101.284 -5.90079e+00 2.95726e+01  0.00000e+00 0.00000e+00 2.11415e+02 101.284 6.93826e+01 101.284 0.9833 
1 1 1 6   103 3  o 2  4.52291e+00 8.07434e-01 6.19498e+01 353.311 6.11119e+00  -7.16662e-01 0.00000e+00 0.00000e+00 9.17420e+01 353.311 2.97922e+01 353.311 0.9147 
1 1 1 6   103 4  o 17 3.45496e+00 9.37367e-01 4.53016e+01 121.517 -1.60433e+00 2.61631e+00  0.00000e+00 0.00000e+00 5.93050e+01 121.517 1.40034e+01 121.517 0.8150 
1 1 1 6   103 5  o 19 3.15611e+00 9.16657e-01 8.27604e+01 112.675 -2.13317e+00 5.10575e+00  0.00000e+00 0.00000e+00 2.32864e+01 112.675 5.94740e+01 292.675 0.9044 
1 1 1 6   103 6  o 10 3.54922e+00 1.00758e+00 3.42536e+01 300.388 1.26641e+00  -2.15960e+00 0.00000e+00 0.00000e+00 6.66564e+01 300.388 3.24028e+01 300.388 0.7654 
1 1 1 6   103 7  o 11 3.80421e+00 1.06235e+00 4.71457e+01 130.747 -2.46929e+00 2.86605e+00  0.00000e+00 0.00000e+00 7.36076e+01 130.747 2.64619e+01 130.747 0.8546 
1 1 1 6   103 8  f 0  5.27537e+00 1.16356e+00 1.40595e+02 284.392 4.09344e+00  -1.59516e+01 0.00000e+00 0.00000e+00 4.92528e+01 284.392 9.13419e+01 104.392 0.9691 
1 1 1 6   103 9  o 3  3.67642e+00 1.12670e+00 6.91728e+01 134.944 -4.42489e+00 4.43355e+00  0.00000e+00 0.00000e+00 5.58795e+01 134.944 1.32933e+01 314.944 0.9163 
1 1 1 6   104 0  o 1  4.25495e+00 8.58229e-01 5.54221e+01 167.586 -4.57462e+00 1.00696e+00  0.00000e+00 0.00000e+00 8.44502e+01 167.586 2.90281e+01 167.586 0.8855 
1 1 1 6   104 1  o 17 3.43600e+00 9.09809e-01 1.50874e+01 81.748  1.41916e-01  9.78498e-01  0.00000e+00 0.00000e+00 4.13532e+01 81.748  2.62658e+01 81.748  0.4424 
1 1 1 6   104 2  o 10 3.23403e+00 8.97060e-01 8.90494e+01 208.552 -5.22604e+00 -2.84362e+00 0.00000e+00 0.00000e+00 2.04313e+01 208.552 6.86181e+01 28.552  0.9116 
1 1 1 6   104 3  o 11 7.44040e+00 8.32970e-01 1.80819e+02 36.446  2.32296e+01  1.71551e+01  0.00000e+00 0.00000e+00 9.06904e+01 36.446  9.01290e+01 216.446 0.9825 
1 1 1 6   104 4  o 7  1.38875e+01 6.64847e-01 1.71229e+02 210.647 -5.14210e+01 -3.04676e+01 0.00000e+00 0.00000e+00 3.40235e+02 210.647 1.69005e+02 210.647 0.9916 
1 1 1 6   104 5  o 10 5.77814e+00 1.01985e+00 9.33940e+01 18.963  1.12517e+01  3.86612e+00  0.00000e+00 0.00000e+00 1.11979e+02 18.963  1.85848e+01 18.963  0.9570 
1 1 1 6   104 6  o 7  6.74174e+00 1.02499e+00 8.19158e+01 351.114 1.17454e+01  -1.83632e+00 0.00000e+00 0.00000e+00 1.57675e+02 351.114 7.57595e+01 351.114 0.9570 
1 1 1 6   104 7  o 14 4.59085e+00 1.10024e+00 9.76754e+01 331.202 9.06006e+00  -4.98035e+00 0.00000e+00 0.00000e+00 6.43197e+01 331.202 3.33557e+01 151.202 0.9503 
1 1 1 6   104 8  o 14 3.68854e+00 1.03239e+00 4.23213e+01 143.077 -3.23125e+00 2.42810e+00  0.00000e+00 0.00000e+00 7.61372e+01 143.077 3.38159e+01 143.077 0.8651 
1 1 1 6   104 9  o 1  3.57858e+00 1.08700e+00 5.42559e+01 51.449  3.16509e+00  3.97178e+00  0.00000e+00 0.00000e+00 6.46318e+01 51.449  1.03759e+01 51.449  0.8952 
1 1 1 6   105 0  o 9  5.15198e+00 8.87969e-01 1.23343e+02 115.147 -5.60867e+00 1.19475e+01  0.00000e+00 0.00000e+00 6.04692e+01 115.147 6.28734e+01 295.147 0.9613 
1 1 1 6   105 1  o 3  7.08316e+00 8.01807e-01 1.20844e+02 277.684 2.49388e+00  -1.84840e+01 0.00000e+00 0.00000e+00 1.34939e+02 277.684 1.40952e+01 277.684 0.9728 
1 1 1 6   105 2  o 18 5.17683e+00 8.79581e-01 6.08703e+01 159.338 -6.12871e+00 2.31118e+00  0.00000e+00 0.00000e+00 1.15976e+02 159.338 5.51061e+01 159.338 0.9201 
1 1 1 6   105 3  o 11 1.31138e+01 6.59199e-01 1.91031e+02 336.995 5.82138e+01  -2.47166e+01 0.00000e+00 0.00000e+00 2.92012e+02 336.995 1.00981e+02 336.995 0.9921 
1 1 1 6   105 4  o 14 4.20006e+00 1.01713e+00 1.33662e+02 160.676 -1.13184e+01 3.96896e+00  0.00000e+00 0.00000e+00 1.56387e+01 160.676 1.18023e+02 340.676 0.9574 
1 1 1 6   105 5  o 19 1.35645e+01 7.08816e-01 1.97810e+02 338.306 6.37778e+01  -2.53720e+01 0.00000e+00 0.00000e+00 3.02149e+02 338.306 1.04339e+02 338.306 0.9927 
1 1 1 6   105 6  o 13 3.23355e+00 9.09695e-01 3.36245e+01 9.035   2.56878e+00  4.08460e-01  0.00000e+00 0.00000e+00 5.94797e+01 9.035   2.58552e+01 9.035   0.7756 
1 1 1 6   105 7  o 6  2.38343e+00 8.07694e-01 5.99605e+01 221.941 -3.04269e+00 -2.73398e+00 0.00000e+00 0.00000e+00 1.67381e+01 221.941 4.32224e+01 41.941  0.8669 
1 1 1 6   105 8  f 0  3.62314e+00 1.05626e+00 6.42132e+01 41.731  4.26886e+00  3.80750e+00  0.00000e+00 0.00000e+00 5.78487e+01 41.731  6.36452e+00 221.731 0.9078 
1 1 1 6   105 9  o 18 2.48201e+00 8.43481e-01 4.00712e+01 182.461 -3.46279e+00 -1.48858e-01 0.00000e+00 0.00000e+00 3.72178e+01 182.461 2.85342e+00 2.462   0.8393 
1 1 1 6   106 0  o 1  5.13315e+00 8.78286e-01 8.33051e+01 358.359 8.71435e+00  -2.49646e-01 0.00000e+00 0.00000e+00 9.58643e+01 358.359 1.25593e+01 358.359 0.9408 
1 1 1 6   106 1  o 12 3.26010e+00 8.83774e-01 8.08986e+01 25.095  4.90304e+00  2.29623e+00  0.00000e+00 0.00000e+00 2.82484e+01 25.095  5.26502e+01 205.095 0.9022 
1 1 1 6   106 2  o 8  9.87153e+00 6.72540e-01 9.70629e+01 348.060 2.34488e+01  -4.95870e+00 0.00000e+00 0.00000e+00 2.61597e+02 348.060 1.64534e+02 348.060 0.9789 
1 1 1 6   106 3  o 19 4.19058e+00 9.78990e-01 4.99258e+01 255.222 -1.14667e+00 -4.34668e+00 0.00000e+00 0.00000e+00 8.69879e+01 255.222 3.70622e+01 255.222 0.8802 
1 1 1 6   106 4  o 15 8.38853e+00 8.42688e-01 1.36858e+02 39.254  2.27206e+01  1.85660e+01  0.00000e+00 0.00000e+00 1.69169e+02 39.254  3.23111e+01 39.254  0.9828 
1 1 1 6   106 5  o 5  9.17659e+00 8.32917e-01 1.71748e+02 221.046 -3.07055e+01 -2.67349e+01 0.00000e+00 0.00000e+00 1.64665e+02 221.046 7.08272e+00 41.046  0.9876 
1 1 1 6   106 6  o 9  2.08181e+00 7.17582e-01 3.96744e+01 60.738  1.32580e+00  2.36619e+00  0.00000e+00 0.00000e+00 2.10758e+01 60.738  1.85987e+01 240.738 0.7862 
1 1 1 6   106 7  o 7  3.58537e+00 9.81106e-01 6.36230e+01 207.906 -5.20356e+00 -2.75586e+00 0.00000e+00 0.00000e+00 5.75312e+01 207.906 6.09180e+00 27.906  0.9106 
1 1 1 6   106 8  o 1  2.22184e+00 7.66761e-01 3.43412e+01 334.019 2.45043e+00  -1.19417e+00 0.00000e+00 0.00000e+00 3.05741e+01 334.019 3.76714e+00 154.019 0.7875 
1 1 1 6   106 9  o 14 2.33360e+00 8.06378e-01 2.21456e+01 323.396 1.60208e+00  -1.18999e+00 0.00000e+00 0.00000e+00 3.81891e+01 323.396 1.60435e+01 323.396 0.6971 
1 1 1 6   107 0  o 15 2.80510e+00 8.29990e-01 6.43873e+01 108.637 -1.29946e+00 3.85313e+00  0.00000e+00 0.00000e+00 2.57179e+01 108.637 3.86694e+01 288.636 0.8660 
1 1 1 6   107 1  o 1  4.28839e+00 9.12021e-01 7.46708e+01 327.169 5.72025e+00  -3.69089e+00 0.00000e+00 0.00000e+00 7.22245e+01 327.169 2.44625e+00 147.169 0.9233 
1 1 1 6   107 2  o 2  4.55294e+00 9.67931e-01 1.15771e+02 315.195 8.31256e+00  -8.25600e+00 0.00000e+00 0.00000e+00 4.57850e+01 315.195 6.99861e+01 135.196 0.9563 
1 1 1 6   107 3  o 9  6.45553e+00 9.10685e-01 3.78587e+01 143.650 -4.76476e+00 3.50650e+00  0.00000e+00 0.00000e+00 1.80380e+02 143.650 1.42522e+02 143.650 0.9110 
1 1 1 6   107 4  o 4  2.99664e+00 9.00244e-01 3.37126e+01 67.859  9.07692e-01  2.23079e+00  0.00000e+00 0.00000e+00 5.02064e+01 67.859  1.64938e+01 67.859  0.7547 
1 1 1 6   107 5  o 9  2.50330e+00 8.15560e-01 3.06131e+01 53.804  1.16519e+00  1.59225e+00  0.00000e+00 0.00000e+00 3.37886e+01 53.804  3.17553e+00 53.804  0.6933 
1 1 1 6   107 6  o 11 2.71343e+00 8.63153e-01 2.84632e+01 109.740 -7.11730e-01 1.98345e+00  0.00000e+00 0.00000e+00 4.34853e+01 109.740 1.50220e+01 109.740 0.7146 
1 1 1 6   107 7  o 7  2.39799e+00 7.93925e-01 5.93747e+01 209.099 -4.11021e+00 -2.28761e+00 0.00000e+00 0.00000e+00 1.94480e+01 209.099 3.99266e+01 29.099  0.8860 
1 1 1 6   107 8  o 9  3.98255e+00 1.10257e+00 8.05662e+01 261.758 -1.09640e+00 -7.56908e+00 0.00000e+00 0.00000e+00 5.71221e+01 261.758 2.34441e+01 81.758  0.9321 
1 1 1 6   108 0  o 9  3.44284e+00 9.08744e-01 4.48587e+01 151.052 -3.14500e+00 1.73957e+00  0.00000e+00 0.00000e+00 6.31261e+01 151.052 1.82674e+01 151.052 0.8459 
1 1 1 6   108 1  o 9  4.02442e+00 9.54583e-01 6.89603e+01 344.614 6.22840e+00  -1.71399e+00 0.00000e+00 0.00000e+00 6.82017e+01 344.614 7.58602e-01 164.614 0.9190 
1 1 1 6   108 2  o 1  2.94804e+00 8.55641e-01 7.73285e+01 92.857  -2.87345e-01 5.75849e+00  0.00000e+00 0.00000e+00 2.20254e+01 92.857  5.53030e+01 272.857 0.9086 
1 1 1 6   108 3  o 3  3.68562e+00 9.55372e-01 7.11319e+01 153.418 -5.39784e+00 2.70092e+00  0.00000e+00 0.00000e+00 5.36864e+01 153.418 1.74455e+01 333.418 0.9129 
1 1 1 6   108 4  o 12 2.91931e+00 8.78788e-01 6.78903e+01 189.864 -4.67524e+00 -8.12961e-01 0.00000e+00 0.00000e+00 2.81856e+01 189.864 3.97047e+01 9.864   0.8871 
1 1 1 6   108 5  o 1  2.91275e+00 8.92053e-01 4.93876e+01 155.285 -3.56200e+00 1.63950e+00  0.00000e+00 0.00000e+00 4.35841e+01 155.285 5.80351e+00 335.284 0.8604 
1 1 1 6   108 6  o 8  3.28436e+00 9.59004e-01 5.59950e+01 359.452 4.84733e+00  -4.63954e-02 0.00000e+00 0.00000e+00 5.23979e+01 359.452 3.59705e+00 179.452 0.8897 
1 1 1 6   108 7  o 12 2.95004e+00 9.30130e-01 5.06635e+01 212.583 -3.52853e+00 -2.25510e+00 0.00000e+00 0.00000e+00 4.45631e+01 212.583 6.10036e+00 32.583  0.8704 
1 1 1 6   108 8  o 18 3.74475e+00 1.08519e+00 5.43268e+01 39.024  4.22861e+00  3.42725e+00  0.00000e+00 0.00000e+00 7.10212e+01 39.024  1.66943e+01 39.024  0.9027 
1 1 1 6   109 0  o 16 2.92479e+00 8.18075e-01 6.31271e+01 63.572  2.13918e+00  4.30404e+00  0.00000e+00 0.00000e+00 3.32243e+01 63.572  2.99028e+01 243.572 0.8887 
1 1 1 6   109 1  o 1  2.52218e+00 7.88775e-01 4.60610e+01 320.767 2.17739e+00  -1.77791e+00 0.00000e+00 0.00000e+00 2.82819e+01 320.767 1.77790e+01 140.767 0.7950 
1 1 1 6   109 2  o 15 6.55396e+00 8.83514e-01 1.21337e+02 271.584 5.30952e-01  -1.92010e+01 0.00000e+00 0.00000e+00 1.15288e+02 271.584 6.04842e+00 91.584  0.9736 
1 1 1 6   109 3  o 13 3.55953e+00 9.50770e-01 2.05872e+01 220.635 -1.25878e+00 -1.08022e+00 0.00000e+00 0.00000e+00 6.29732e+01 220.635 4.23860e+01 220.635 0.6330 
1 1 1 6   109 4  o 8  4.90129e+00 1.04330e+00 6.52700e+01 46.594  5.35239e+00  5.65884e+00  0.00000e+00 0.00000e+00 1.04399e+02 46.594  3.91291e+01 46.594  0.9334 
1 1 1 6   109 5  o 17 5.02021e+00 1.01136e+00 5.95444e+01 287.153 2.10683e+00  -6.82584e+00 0.00000e+00 0.00000e+00 1.13062e+02 287.153 5.35174e+01 287.153 0.9271 
1 1 1 6   109 6  o 6  2.62882e+00 8.52328e-01 1.14764e+01 99.301  -1.52145e-01 9.28960e-01  0.00000e+00 0.00000e+00 2.99748e+01 99.301  1.84984e+01 99.301  0.4252 
1 1 1 6   109 7  o 11 3.20204e+00 9.47823e-01 4.80219e+01 37.147  3.71715e+00  2.81606e+00  0.00000e+00 0.00000e+00 5.70389e+01 37.147  9.01702e+00 37.147  0.8849 
1 1 1 6   109 8  o 12 2.54323e+00 8.65361e-01 8.08307e+01 206.118 -6.47240e+00 -3.17334e+00 0.00000e+00 0.00000e+00 6.63544e+00 206.118 7.41953e+01 26.118  0.9278 
1 1 1 6   110 0  o 15 3.00883e+00 8.64259e-01 4.54119e+01 75.017  8.65273e-01  3.23300e+00  0.00000e+00 0.00000e+00 4.74335e+01 75.017  2.02162e+00 75.017  0.8327 
1 1 1 6   110 1  f 0  5.45052e+00 9.09078e-01 5.88977e+01 206.589 -6.97032e+00 -3.48875e+00 0.00000e+00 0.00000e+00 1.29687e+02 206.589 7.07894e+01 206.589 0.9335 
1 1 1 6   110 2  o 17 4.33482e+00 9.77090e-01 6.42704e+01 194.230 -5.98005e+00 -1.51652e+00 0.00000e+00 0.00000e+00 8.27544e+01 194.230 1.84840e+01 194.230 0.9149 
1 1 1 6   110 3  o 15 9.35133e+00 7.74388e-01 1.28352e+02 337.686 3.04314e+01  -1.24895e+01 0.00000e+00 0.00000e+00 2.13036e+02 337.686 8.46844e+01 337.686 0.9847 
1 1 1 6   110 4  o 5  2.54147e+00 8.06802e-01 5.80757e+01 92.460  -1.77148e-01 4.12265e+00  0.00000e+00 0.00000e+00 2.37334e+01 92.460  3.43423e+01 272.460 0.8682 
1 1 1 6   110 5  f 0  3.04891e+00 9.00203e-01 1.52500e+01 68.304  5.07588e-01  1.27574e+00  0.00000e+00 0.00000e+00 4.84054e+01 68.304  3.31553e+01 68.304  0.5631 
1 1 1 6   110 6  o 11 4.26759e+00 1.02576e+00 1.03456e+02 265.204 -9.42753e-01 -1.12357e+01 0.00000e+00 0.00000e+00 4.75604e+01 265.204 5.58959e+01 85.204  0.9546 
1 1 1 6   110 7  o 3  3.52102e+00 1.00075e+00 6.92947e+01 132.038 -4.79462e+00 5.31780e+00  0.00000e+00 0.00000e+00 5.17224e+01 132.038 1.75722e+01 312.038 0.9273 
1 1 1 6   111 0  o 2  2.29570e+00 7.38426e-01 5.35944e+01 8.075   3.32912e+00  4.72300e-01  0.00000e+00 0.00000e+00 1.73006e+01 8.075   3.62938e+01 188.075 0.8336 
1 1 1 6   111 1  o 3  2.91341e+00 8.36054e-01 6.60242e+01 259.579 -8.81049e-01 -4.79035e+00 0.00000e+00 0.00000e+00 3.00880e+01 259.579 3.59362e+01 79.579  0.8903 
1 1 1 6   111 2  o 16 4.91193e+00 1.00864e+00 1.09659e+02 299.344 6.63940e+00  -1.18098e+01 0.00000e+00 0.00000e+00 6.55259e+01 299.344 4.41331e+01 119.344 0.9624 
1 1 1 6   111 3  o 5  5.29697e+00 9.72146e-01 6.73455e+01 314.884 6.10979e+00  -6.13456e+00 0.00000e+00 0.00000e+00 1.17267e+02 314.884 4.99214e+01 314.884 0.9403 
1 1 1 6   111 4  o 2  4.79871e+00 1.00276e+00 7.88473e+01 287.388 2.86177e+00  -9.13880e+00 0.00000e+00 0.00000e+00 8.94553e+01 287.388 1.06081e+01 287.388 0.9463 
1 1 1 6   111 5  o 12 3.40249e+00 9.49327e-01 5.71989e+01 122.077 -2.81743e+00 4.49546e+00  0.00000e+00 0.00000e+00 5.62999e+01 122.077 8.99047e-01 302.076 0.9000 
1 1 1 6   111 6  o 6  2.86675e+00 8.92946e-01 6.29027e+01 138.618 -4.35026e+00 3.83290e+00  0.00000e+00 0.00000e+00 3.36814e+01 138.618 2.92213e+01 318.618 0.9091 
1 1 1 6   111 7  o 15 2.83809e+00 8.86332e-01 5.19378e+01 251.739 -1.62562e+00 -4.92681e+00 0.00000e+00 0.00000e+00 4.24531e+01 251.739 9.48461e+00 71.739  0.8976 
1 1 1 6   112 0  o 18 4.10748e+00 9.38216e-01 8.53550e+01 45.251  6.62678e+00  6.68515e+00  0.00000e+00 0.00000e+00 5.84448e+01 45.251  2.69103e+01 225.251 0.9453 
1 1 1 6   112 1  f 0  4.10307e+00 9.41814e-01 4.75903e+01 221.370 -3.81648e+00 -3.36116e+00 0.00000e+00 0.00000e+00 8.84923e+01 221.370 4.09020e+01 221.370 0.8953 
1 1 1 6   112 2  o 15 7.68024e+00 8.16149e-01 1.18963e+02 358.246 2.53209e+01  -7.75271e-01 0.00000e+00 0.00000e+00 1.59908e+02 358.246 4.09453e+01 358.246 0.9801 
1 1 1 6   112 3  o 3  5.11706e+00 1.02633e+00 1.18444e+02 266.127 -1.01375e+00 -1.49757e+01 0.00000e+00 0.00000e+00 6.47253e+01 266.127 5.37189e+01 86.127  0.9661 
1 1 1 6   112 4  o 6  7.32329e+00 9.10466e-01 1.28884e+02 90.443  -2.15199e-01 2.78108e+01  0.00000e+00 0.00000e+00 1.37544e+02 90.443  8.66054e+00 90.443  0.9819 
1 1 1 6   112 5  o 16 2.69310e+00 8.33183e-01 2.96496e+01 263.038 -3.23034e-01 -2.64535e+00 0.00000e+00 0.00000e+00 4.83635e+01 263.038 1.87139e+01 263.038 0.7818 
1 1 1 6   112 6  f 0  2.76690e+00 8.82319e-01 2.13349e+01 171.936 -1.95177e+00 2.76514e-01  0.00000e+00 0.00000e+00 4.97041e+01 171.936 2.83692e+01 171.936 0.6930 
1 1 1 6   112 7  o 17 2.60533e+00 8.56406e-01 5.99605e+01 74.351  1.51127e+00  5.39483e+00  0.00000e+00 0.00000e+00 2.74479e+01 74.351  3.25126e+01 254.351 0.9057 
1 1 1 6   113 0  f 0  2.48941e+00 7.90628e-01 6.40621e+01 303.203 2.53402e+00  -3.87199e+00 0.00000e+00 0.00000e+00 1.74110e+01 303.203 4.66511e+01 123.203 0.8840 
1 1 1 6   113 1  o 19 3.29967e+00 9.21208e-01 5.11479e+01 344.406 4.55943e+00  -1.27252e+00 0.00000e+00 0.00000e+00 5.72149e+01 344.406 6.06699e+00 344.406 0.8868 
1 1 1 6   113 2  o 10 4.38212e+00 9.07170e-01 3.86989e+01 304.982 2.69012e+00  -3.84451e+00 0.00000e+00 0.00000e+00 1.05056e+02 304.982 6.63570e+01 304.982 0.8857 
1 1 1 6   113 3  o 11 6.88731e+00 9.05567e-01 1.18617e+02 185.696 -2.19624e+01 -2.19070e+00 0.00000e+00 0.00000e+00 1.30646e+02 185.696 1.20288e+01 185.696 0.9771 
1 1 1 6   113 4  o 5  2.67330e+00 8.38689e-01 3.32848e+01 298.935 1.31716e+00  -2.38255e+00 0.00000e+00 0.00000e+00 4.46638e+01 298.935 1.13789e+01 298.935 0.7872 
1 1 1 6   113 5  f 0  3.10293e+00 9.22697e-01 1.92497e+01 38.233  1.33273e+00  1.05000e+00  0.00000e+00 0.00000e+00 5.44376e+01 38.233  3.51879e+01 38.233  0.6411 
1 1 1 6   113 6  o 1  2.75545e+00 8.67237e-01 1.41262e+01 37.499  1.11099e+00  8.52477e-01  0.00000e+00 0.00000e+00 4.40977e+01 37.499  2.99715e+01 37.499  0.5705 
1 1 1 6   114 0  o 6  2.02345e+00 6.79563e-01 9.48563e+00 62.015  3.28685e-01  6.18546e-01  0.00000e+00 0.00000e+00 1.52566e+01 62.015  5.77093e+00 62.015  0.3304 
1 1 1 6   114 1  o 17 5.90487e+00 9.45796e-01 4.07052e+01 119.326 -3.32123e+00 5.91196e+00  0.00000e+00 0.00000e+00 1.61063e+02 119.326 1.20358e+02 119.326 0.9230 
1 1 1 6   114 2  o 3  2.40005e+00 7.45122e-01 2.70064e+01 106.450 -6.35486e-01 2.15224e+00  0.00000e+00 0.00000e+00 3.82244e+01 106.450 1.12180e+01 106.450 0.7341 
1 1 1 6   114 3  o 7  6.93507e+00 8.99319e-01 8.68999e+01 262.044 -2.40929e+00 -1.72390e+01 0.00000e+00 0.00000e+00 1.62411e+02 262.044 7.55112e+01 262.044 0.9708 
1 1 1 6   114 4  o 14 4.53815e+00 1.01817e+00 8.44639e+01 346.612 1.04959e+01  -2.49805e+00 0.00000e+00 0.00000e+00 7.55969e+01 346.612 8.86696e+00 166.613 0.9525 
1 1 1 6   114 5  o 14 2.39461e+00 7.68903e-01 6.75967e+01 116.398 -2.77065e+00 5.58191e+00  0.00000e+00 0.00000e+00 1.36088e+01 116.398 5.39878e+01 296.398 0.9158 
1 1 1 6   114 6  o 6  3.07831e+00 9.42647e-01 5.00820e+01 292.245 1.89724e+00  -4.63855e+00 0.00000e+00 0.00000e+00 5.17728e+01 292.245 1.69084e+00 292.245 0.8937 
1 1 1 6   115 0  o 4  4.39275e+00 9.73956e-01 9.91906e+01 146.497 -1.00374e+01 6.64434e+00  0.00000e+00 0.00000e+00 5.64402e+01 146.497 4.27504e+01 326.497 0.9575 
1 1 1 6   115 1  o 14 2.68566e+00 8.37833e-01 7.55852e+01 303.648 3.40573e+00  -5.11669e+00 0.00000e+00 0.00000e+00 1.53175e+01 303.648 6.02677e+01 123.648 0.9146 
1 1 1 6   115 2  o 4  6.17565e+00 1.02215e+00 9.70011e+01 223.216 -1.11874e+01 -1.05114e+01 0.00000e+00 0.00000e+00 1.24011e+02 223.216 2.70095e+01 223.216 0.9669 
1 1 1 6   115 3  o 13 2.96655e+00 8.77808e-01 6.73849e+01 265.348 -5.29958e-01 -6.51329e+00 0.00000e+00 0.00000e+00 3.36379e+01 265.348 3.37470e+01 85.348  0.9199 
1 1 1 6   115 4  o 4  4.45939e+00 9.88898e-01 8.37028e+01 299.136 5.40313e+00  -9.69325e+00 0.00000e+00 0.00000e+00 7.37548e+01 299.136 9.94802e+00 119.136 0.9538 
1 1 1 6   115 5  o 9  2.92677e+00 9.02840e-01 3.48410e+01 257.241 -7.56763e-01 -3.34186e+00 0.00000e+00 0.00000e+00 5.58591e+01 257.241 2.10181e+01 257.241 0.8372 
1 1 1 6   115 6  o 3  2.13886e+00 7.33360e-01 5.81394e+01 97.062  -6.70480e-01 5.41215e+00  0.00000e+00 0.00000e+00 1.33441e+01 97.062  4.47953e+01 277.062 0.9029 
1 1 1 6   116 0  o 18 4.29380e+00 9.59327e-01 5.58271e+01 173.467 -6.97517e+00 7.98789e-01  0.00000e+00 0.00000e+00 9.12068e+01 173.467 3.53797e+01 173.467 0.9258 
1 1 1 6   116 1  o 6  3.01840e+00 8.66863e-01 6.55393e+01 67.088  2.36940e+00  5.60579e+00  0.00000e+00 0.00000e+00 3.64926e+01 67.088  2.90467e+01 247.088 0.9137 
1 1 1 6   116 2  o 11 3.57211e+00 9.52741e-01 2.61641e+01 90.864  -4.24958e-02 2.81869e+00  0.00000e+00 0.00000e+00 7.90042e+01 90.864  5.28401e+01 90.864  0.7957 
1 1 1 6   116 3  o 6  5.72023e+00 1.00658e+00 8.92919e+01 287.275 4.19508e+00  -1.34898e+01 0.00000e+00 0.00000e+00 1.14755e+02 287.275 2.54632e+01 287.275 0.9639 
1 1 1 6   116 4  o 4  5.44866e+00 1.07845e+00 1.01054e+02 170.801 -1.53540e+01 2.48652e+00  0.00000e+00 0.00000e+00 9.39906e+01 170.801 7.06327e+00 350.801 0.9673 
1 1 1 6   116 5  o 4  2.78151e+00 8.41133e-01 6.96947e+01 53.049  4.42076e+00  5.87702e+00  0.00000e+00 0.00000e+00 2.59583e+01 53.049  4.37364e+01 233.049 0.9293 
1 1 1 6   117 0  o 10 3.01660e+00 8.78254e-01 3.80284e+01 349.726 3.34679e+00  -6.06629e-01 0.00000e+00 0.00000e+00 5.51993e+01 349.726 1.71708e+01 349.726 0.8358 
1 1 1 6   117 1  o 17 2.94551e+00 8.47905e-01 6.93870e+01 161.421 -6.31725e+00 2.12343e+00  0.00000e+00 0.00000e+00 3.10106e+01 161.421 3.83764e+01 341.421 0.9216 
1 1 1 6   117 2  o 19 3.77560e+00 9.46489e-01 8.12914e+01 156.806 -8.78041e+00 3.76214e+00  0.00000e+00 0.00000e+00 5.08450e+01 156.806 3.04464e+01 336.806 0.9461 
1 1 1 6   117 3  o 1  6.04268e+00 1.03189e+00 8.42645e+01 262.136 -2.07510e+00 -1.50240e+01 0.00000e+00 0.00000e+00 1.31779e+02 262.136 4.75145e+01 262.136 0.9664 
1 1 1 6   117 4  o 19 3.10119e+00 9.14677e-01 2.10674e+01 131.597 -1.45539e+00 1.63942e+00  0.00000e+00 0.00000e+00 6.23341e+01 131.597 4.12668e+01 131.597 0.7269 
1 1 1 6   117 5  o 16 3.53874e+00 9.69185e-01 6.57833e+01 267.605 -3.07743e-01 -7.35933e+00 0.00000e+00 0.00000e+00 5.58865e+01 267.605 9.89687e+00 87.605  0.9294 
1 1 1 6   118 0  o 6  4.11586e+00 9.72021e-01 4.67839e+01 178.579 -5.91950e+00 1.46847e-01  0.00000e+00 0.00000e+00 9.18383e+01 178.579 4.50544e+01 178.579 0.9111 
1 1 1 6   118 1  o 15 1.74043e+00 6.11294e-01 1.71213e+01 116.875 -6.12482e-01 1.20859e+00  0.00000e+00 0.00000e+00 1.87968e+01 116.875 1.67547e+00 116.875 0.5582 
1 1 1 6   118 2  o 4  2.91483e+00 8.78891e-01 4.75678e+01 352.710 4.75125e+00  -6.07801e-01 0.00000e+00 0.00000e+00 4.81764e+01 352.710 6.08572e-01 352.710 0.8883 
1 1 1 6   118 3  o 4  3.34407e+00 8.88311e-01 5.05994e+01 92.319  -2.36789e-01 5.84682e+00  0.00000e+00 0.00000e+00 6.19397e+01 92.319  1.13404e+01 92.319  0.9100 
1 1 1 6   118 4  o 5  3.13556e+00 9.30293e-01 8.93428e+01 14.869  9.37914e+00  2.49016e+00  0.00000e+00 0.00000e+00 2.04719e+01 14.869  6.88709e+01 194.869 0.9470 
1 1 1 6   118 5  o 11 4.10769e+00 1.06971e+00 7.17993e+01 209.097 -7.64619e+00 -4.25533e+00 0.00000e+00 0.00000e+00 7.11479e+01 209.097 6.51479e-01 29.097  0.9410 
1 1 1 6   119 0  o 6  3.28912e+00 8.87171e-01 6.12548e+01 176.885 -6.87863e+00 3.74281e-01  0.00000e+00 0.00000e+00 5.10848e+01 176.885 1.01699e+01 356.885 0.9243 
1 1 1 6   119 1  f 0  2.21218e+00 7.37764e-01 6.10405e+01 87.999  1.83436e-01  5.24993e+00  0.00000e+00 0.00000e+00 1.24614e+01 87.999  4.85791e+01 267.999 0.8989 
1 1 1 6   119 2  o 7  3.99079e+00 9.57999e-01 8.35435e+01 90.403  -7.76000e-02 1.10292e+01  0.00000e+00 0.00000e+00 5.71279e+01 90.403  2.64156e+01 270.403 0.9535 
1 1 1 6   119 3  o 16 3.47723e+00 9.56241e-01 5.37543e+01 279.034 9.85974e-01  -6.20146e+00 0.00000e+00 0.00000e+00 6.40643e+01 279.034 1.03100e+01 279.034 0.9165 
1 1 1 6   119 4  o 8  2.95820e+00 9.10269e-01 9.66634e+01 162.234 -1.02823e+01 3.29448e+00  0.00000e+00 0.00000e+00 7.50992e+00 162.234 8.91535e+01 342.234 0.9525 
1 1 1 6   120 0  o 10 3.63429e+00 9.41437e-01 3.64784e+01 109.460 -1.48849e+00 4.21273e+00  0.00000e+00 0.00000e+00 8.15835e+01 109.460 4.51051e+01 109.460 0.8794 
1 1 1 6   120 1  o 16 2.73172e+00 8.32138e-01 5.49064e+01 159.550 -5.43115e+00 2.02525e+00  0.00000e+00 0.00000e+00 3.68508e+01 159.550 1.80556e+01 339.550 0.9091 
1 1 1 6   120 2  o 14 1.93556e+00 6.66210e-01 1.39002e+01 15.761  1.22746e+00  3.46444e-01  0.00000e+00 0.00000e+00 2.44046e+01 15.761  1.05044e+01 15.761  0.5355 
1 1 1 6   120 3  o 5  2.47688e+00 8.03184e-01 2.70399e+01 299.056 1.40880e+00  -2.53567e+00 0.00000e+00 0.00000e+00 4.64095e+01 299.056 1.93696e+01 299.056 0.8024 
1 1 1 6   120 4  f 0  2.47505e+00 8.01143e-01 6.04946e+01 321.931 5.28813e+00  -4.14174e+00 0.00000e+00 0.00000e+00 2.38667e+01 321.931 3.66278e+01 141.931 0.9222 
1 1 1 6   121 0  o 16 4.02486e+00 9.80805e-01 6.72518e+01 110.971 -3.02451e+00 7.89086e+00  0.00000e+00 0.00000e+00 7.22897e+01 110.971 5.03782e+00 110.971 0.9388 
1 1 1 6   121 1  o 11 3.09646e+00 8.47583e-01 4.91905e+01 66.235  2.35016e+00  5.33730e+00  0.00000e+00 0.00000e+00 5.48514e+01 66.235  5.66087e+00 66.235  0.9097 
1 1 1 6   121 2  o 4  2.39240e+00 7.74242e-01 4.67016e+01 304.233 2.82330e+00  -4.14924e+00 0.00000e+00 0.00000e+00 3.22950e+01 304.233 1.44066e+01 124.233 0.8938 
1 1 1 6   121 3  o 2  2.10324e+00 7.13501e-01 2.44259e+01 188.187 -2.56359e+00 -3.68837e-01 0.00000e+00 0.00000e+00 3.57527e+01 188.187 1.13268e+01 188.187 0.7744 
1 1 1 6   122 0  o 16 2.66198e+00 8.33798e-01 7.43963e+01 75.754  1.91757e+00  7.55276e+00  0.00000e+00 0.00000e+00 1.73343e+01 75.754  5.70621e+01 255.754 0.9334 
1 1 1 7   0   0  o 5  3.42758e+01 1.02547e+00 8.66885e+02 180.000 -1.41452e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.25865e+02 180.000 4.41019e+02 0.000   1.0000 
1 1 1 7   0   1  o 3  4.68168e+01 1.91129e+00 9.99754e+02 0.000   2.07606e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.66437e+02 0.000   2.33317e+02 180.000 1.0000 
1 1 1 7   0   2  o 19 1.65499e+01 7.05938e-01 1.28125e+02 180.000 -1.12487e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.77234e+02 180.000 2.49108e+02 180.000 0.8093 
1 1 1 7   0   3  o 10 2.17397e+01 1.13420e+00 2.75369e+02 180.000 -3.55189e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.43689e+02 180.000 2.68320e+02 180.000 0.9984 
1 1 1 7   0   4  o 14 3.50429e+01 1.08000e+00 1.02215e+03 180.000 -2.10899e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.00377e+02 180.000 7.21773e+02 0.000   1.0000 
1 1 1 7   0   5  o 14 1.34317e+01 7.99060e-01 1.55058e+02 180.000 -1.37858e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.91350e+02 180.000 1.36293e+02 180.000 0.8806 
1 1 1 7   0   6  o 3  5.82855e+01 1.66231e+00 1.04732e+03 0.000   5.20802e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.15229e+03 0.000   1.04970e+02 0.000   1.0000 
1 1 1 7   0   7  o 17 5.84519e+01 1.68594e+00 1.01474e+03 180.000 -6.19189e+01 0.00000e+00  0.00000e+00 0.00000e+00 1.19088e+03 180.000 1.76141e+02 180.000 1.0000 
1 1 1 7   0   8  o 10 2.35712e+01 1.03429e+00 5.18825e+02 0.000   1.66668e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.70455e+02 0.000   1.48370e+02 180.000 1.0000 
1 1 1 7   0   9  o 16 1.37803e+01 1.68008e+00 3.31548e+02 0.000   7.09311e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.88223e+02 0.000   1.43325e+02 180.000 1.0000 
1 1 1 7   0   10 o 3  2.00282e+01 1.25519e+00 2.12496e+02 180.000 -9.44175e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.42714e+02 180.000 3.30218e+02 180.000 1.0000 
1 1 1 7   0   11 o 12 8.89167e+00 2.21852e+00 8.66778e+01 0.000   1.90262e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.33890e+02 0.000   1.47212e+02 0.000   0.9565 
1 1 1 7   0   12 o 4  3.03149e+00 2.00122e+00 9.72837e+01 0.000   9.36775e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.34762e+01 180.000 1.10760e+02 180.000 0.7337 
1 1 1 7   0   13 o 4  6.24363e+00 2.86237e+00 1.71018e+02 180.000 -3.24551e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.34028e+01 180.000 1.07615e+02 0.000   0.9970 
1 1 1 7   0   14 o 8  1.45355e+01 1.83703e+00 1.85745e+02 0.000   1.38254e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.61359e+02 0.000   1.75614e+02 0.000   1.0000 
1 1 1 7   0   15 o 4  6.73666e+00 3.48198e+00 1.90442e+02 180.000 -3.80815e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.27182e+01 180.000 1.27724e+02 0.000   0.9990 
1 1 1 7   0   16 o 12 3.88867e+00 2.71857e+00 1.24914e+02 0.000   2.08780e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.68425e+01 0.000   1.08072e+02 180.000 0.9697 
1 1 1 7   1   0  o 6  2.42528e+01 5.77218e-01 1.56201e+02 142.904 -2.88622e+00 2.18254e+00  0.00000e+00 0.00000e+00 6.18623e+02 142.904 4.62422e+02 142.904 0.8471 
1 1 1 7   1   1  o 1  3.65508e+01 8.97565e-01 8.93562e+02 286.809 8.52245e+00  -2.82110e+01 0.00000e+00 0.00000e+00 4.61736e+02 286.809 4.31826e+02 106.809 0.9829 
1 1 1 7   1   2  o 18 1.81443e+01 6.17765e-01 5.64278e+02 350.957 1.06973e+01  -1.70246e+00 0.00000e+00 0.00000e+00 8.79450e+01 350.957 4.76333e+02 170.957 0.9527 
1 1 1 7   1   3  o 7  2.56493e+01 8.72810e-01 5.02845e+02 64.190  6.64480e+00  1.37396e+01  0.00000e+00 0.00000e+00 4.32828e+02 64.190  7.00176e+01 244.190 0.9667 
1 1 1 7   1   4  o 6  2.76278e+01 7.78389e-01 6.00280e+02 16.474  1.87159e+01  5.53470e+00  0.00000e+00 0.00000e+00 4.15325e+02 16.474  1.84954e+02 196.474 0.9740 
1 1 1 7   1   5  o 4  3.44687e+01 7.66573e-01 6.48069e+02 236.716 -1.61194e+01 -2.45543e+01 0.00000e+00 0.00000e+00 6.30454e+02 236.716 1.76150e+01 56.716  0.9828 
1 1 1 7   1   6  o 18 2.53577e+01 6.70416e-01 4.09315e+02 167.867 -1.78492e+01 3.83722e+00  0.00000e+00 0.00000e+00 5.21055e+02 167.867 1.11740e+02 167.867 0.9722 
1 1 1 7   1   7  o 1  1.53351e+01 6.90437e-01 2.56176e+02 10.308  8.38098e+00  1.52437e+00  0.00000e+00 0.00000e+00 2.87370e+02 10.308  3.11934e+01 10.308  0.9393 
1 1 1 7   1   8  o 13 1.91767e+01 7.01191e-01 2.26851e+02 82.047  1.64413e+00  1.17692e+01  0.00000e+00 0.00000e+00 4.65492e+02 82.047  2.38641e+02 82.047  0.9570 
1 1 1 7   1   9  o 9  2.09891e+01 7.95929e-01 3.13881e+02 256.120 -5.14100e+00 -2.08054e+01 0.00000e+00 0.00000e+00 4.59100e+02 256.120 1.45220e+02 256.120 0.9764 
1 1 1 7   1   10 o 14 7.71214e+00 1.38162e+00 2.00150e+02 342.855 5.98309e+00  -1.84583e+00 0.00000e+00 0.00000e+00 6.62943e+01 342.855 1.33856e+02 162.855 0.9162 
1 1 1 7   1   11 o 3  8.54689e+00 1.33394e+00 2.25245e+02 179.463 -1.01478e+01 9.51720e-02  0.00000e+00 0.00000e+00 8.06082e+01 179.463 1.44637e+02 359.463 0.9494 
1 1 1 7   1   12 o 14 5.70239e+00 1.43977e+00 1.17029e+02 325.048 3.44571e+00  -2.40836e+00 0.00000e+00 0.00000e+00 7.00935e+01 325.048 4.69355e+01 145.048 0.8709 
1 1 1 7   1   13 o 6  1.15069e+01 1.43390e+00 1.96675e+02 47.054  1.22293e+01  1.31393e+01  0.00000e+00 0.00000e+00 2.24423e+02 47.054  2.77488e+01 47.054  0.9717 
1 1 1 7   1   14 o 2  5.51221e+00 1.57150e+00 7.68795e+01 166.385 -3.66542e+00 8.87744e-01  0.00000e+00 0.00000e+00 1.00329e+02 166.385 2.34494e+01 166.385 0.8541 
1 1 1 7   1   15 o 3  1.32271e+01 2.23056e+00 2.13101e+02 208.214 -1.67814e+01 -9.00330e+00 0.00000e+00 0.00000e+00 2.71210e+02 208.214 5.81090e+01 208.214 0.9734 
1 1 1 7   1   16 o 5  5.96301e+00 1.90295e+00 1.51675e+02 290.327 2.73340e+00  -7.37878e+00 0.00000e+00 0.00000e+00 5.77139e+01 290.327 9.39606e+01 110.327 0.9341 
1 1 1 7   2   0  o 16 2.63538e+01 6.04977e-01 3.34840e+02 253.001 -2.46096e+00 -8.04993e+00 0.00000e+00 0.00000e+00 5.98061e+02 253.001 2.63222e+02 253.001 0.9386 
1 1 1 7   2   1  o 10 1.38732e+01 5.49861e-01 1.84316e+02 40.139  1.77791e+00  1.49922e+00  0.00000e+00 0.00000e+00 2.05401e+02 40.139  2.10851e+01 40.139  0.7446 
1 1 1 7   2   2  o 11 3.03473e+01 6.78865e-01 7.31953e+02 322.986 1.87247e+01  -1.41170e+01 0.00000e+00 0.00000e+00 3.88442e+02 322.986 3.43511e+02 142.986 0.9784 
1 1 1 7   2   3  o 7  3.53664e+01 8.99604e-01 7.11157e+02 47.710  1.86749e+01  2.05304e+01  0.00000e+00 0.00000e+00 5.99208e+02 47.710  1.11949e+02 227.709 0.9818 
1 1 1 7   2   4  o 14 4.32507e+01 9.00720e-01 1.12038e+03 240.934 -2.88149e+01 -5.18438e+01 0.00000e+00 0.00000e+00 4.98084e+02 240.934 6.22294e+02 60.935  0.9915 
1 1 1 7   2   5  o 3  2.83978e+01 8.02628e-01 3.68915e+02 32.225  1.16339e+01  7.33324e+00  0.00000e+00 0.00000e+00 6.63094e+02 32.225  2.94179e+02 32.225  0.9629 
1 1 1 7   2   6  o 3  4.23720e+01 1.07272e+00 8.14428e+02 292.061 2.22746e+01  -5.49633e+01 0.00000e+00 0.00000e+00 7.71077e+02 292.061 4.33516e+01 112.061 0.9915 
1 1 1 7   2   7  o 11 3.26337e+01 7.81000e-01 5.84737e+02 134.397 -2.87867e+01 2.93988e+01  0.00000e+00 0.00000e+00 6.31603e+02 134.397 4.68659e+01 134.397 0.9878 
1 1 1 7   2   8  o 2  1.05981e+01 8.81269e-01 7.73880e+01 312.800 1.50001e+00  -1.61987e+00 0.00000e+00 0.00000e+00 2.14132e+02 312.800 1.36744e+02 312.800 0.7291 
1 1 1 7   2   9  o 14 1.78520e+01 7.97045e-01 3.36297e+02 333.615 1.74906e+01  -8.67686e+00 0.00000e+00 0.00000e+00 3.19574e+02 333.615 1.67231e+01 153.615 0.9740 
1 1 1 7   2   10 o 4  2.48101e+01 8.15941e-01 3.19556e+02 66.661  1.40771e+01  3.26252e+01  0.00000e+00 0.00000e+00 6.02701e+02 66.661  2.83145e+02 66.661  0.9858 
1 1 1 7   2   11 o 18 2.52159e+01 8.89591e-01 4.84885e+02 210.001 -6.18836e+01 -3.57301e+01 0.00000e+00 0.00000e+00 4.58916e+02 210.001 2.59698e+01 30.001  0.9930 
1 1 1 7   2   12 o 15 1.23502e+01 1.15814e+00 2.19337e+02 299.277 9.13762e+00  -1.62980e+01 0.00000e+00 0.00000e+00 2.33362e+02 299.277 1.40259e+01 299.277 0.9729 
1 1 1 7   2   13 o 6  1.35024e+01 1.31030e+00 1.50953e+02 62.842  7.77202e+00  1.51502e+01  0.00000e+00 0.00000e+00 3.42376e+02 62.842  1.91422e+02 62.842  0.9702 
1 1 1 7   2   14 o 7  9.96003e+00 1.69213e+00 2.09544e+02 275.104 1.55011e+00  -1.73550e+01 0.00000e+00 0.00000e+00 1.54420e+02 275.104 5.51241e+01 95.104  0.9709 
1 1 1 7   2   15 o 17 5.30428e+00 1.67067e+00 1.21790e+02 45.279  4.25102e+00  4.29260e+00  0.00000e+00 0.00000e+00 6.03781e+01 45.279  6.14117e+01 225.279 0.9130 
1 1 1 7   2   16 o 19 4.71720e+00 1.61135e+00 1.10030e+02 131.622 -3.60304e+00 4.05506e+00  0.00000e+00 0.00000e+00 4.99846e+01 131.622 6.00457e+01 311.622 0.9024 
1 1 1 7   3   0  o 7  1.74636e+01 4.94813e-01 2.74825e+02 155.711 -4.17712e+00 1.88504e+00  0.00000e+00 0.00000e+00 3.06575e+02 155.711 3.17501e+01 155.711 0.8827 
1 1 1 7   3   1  o 8  2.11257e+01 6.22118e-01 4.82546e+02 91.577  -2.54535e-01 9.24428e+00  0.00000e+00 0.00000e+00 2.70013e+02 91.577  2.12532e+02 271.577 0.9443 
1 1 1 7   3   2  o 4  2.08610e+01 5.48267e-01 3.51039e+02 247.909 -2.91397e+00 -7.17960e+00 0.00000e+00 0.00000e+00 3.83388e+02 247.909 3.23493e+01 247.909 0.9330 
1 1 1 7   3   3  o 12 3.51279e+01 8.83388e-01 6.43882e+02 94.373  -1.90286e+00 2.48819e+01  0.00000e+00 0.00000e+00 6.54907e+02 94.373  1.10244e+01 94.373  0.9798 
1 1 1 7   3   4  o 14 3.85970e+01 8.23598e-01 6.86983e+02 296.535 1.45354e+01  -2.91094e+01 0.00000e+00 0.00000e+00 7.47096e+02 296.535 6.01136e+01 296.535 0.9845 
1 1 1 7   3   5  o 12 2.38424e+01 9.06006e-01 4.44231e+02 73.920  3.83236e+00  1.32949e+01  0.00000e+00 0.00000e+00 4.22430e+02 73.920  2.18009e+01 253.920 0.9632 
1 1 1 7   3   6  o 19 3.19481e+01 7.46934e-01 3.93759e+02 91.607  -6.17783e-01 2.20249e+01  0.00000e+00 0.00000e+00 7.84213e+02 91.607  3.90454e+02 91.607  0.9770 
1 1 1 7   3   7  o 9  2.48910e+01 8.34279e-01 4.73048e+02 30.015  2.19007e+01  1.26522e+01  0.00000e+00 0.00000e+00 4.47421e+02 30.015  2.56267e+01 210.015 0.9800 
1 1 1 7   3   8  o 14 8.18846e+00 1.05737e+00 1.97176e+02 25.921  3.84150e+00  1.86708e+00  0.00000e+00 0.00000e+00 7.25766e+01 25.921  1.24600e+02 205.921 0.8732 
1 1 1 7   3   9  o 9  2.89539e+01 8.20557e-01 3.16334e+02 170.242 -2.92801e+01 5.03567e+00  0.00000e+00 0.00000e+00 7.57210e+02 170.242 4.40875e+02 170.242 0.9830 
1 1 1 7   3   10 o 11 6.99630e+00 1.30114e+00 2.27312e+02 347.217 6.39417e+00  -1.45076e+00 0.00000e+00 0.00000e+00 1.54506e+01 347.217 2.11861e+02 167.217 0.9202 
1 1 1 7   3   11 o 17 1.48401e+01 1.03885e+00 2.21832e+02 327.287 1.56871e+01  -1.00759e+01 0.00000e+00 0.00000e+00 3.22326e+02 327.287 1.00494e+02 327.287 0.9728 
1 1 1 7   3   12 o 5  7.87169e+00 1.49827e+00 7.76089e+01 49.458  2.45085e+00  2.86527e+00  0.00000e+00 0.00000e+00 1.75697e+02 49.458  9.80884e+01 49.458  0.8541 
1 1 1 7   3   13 o 6  1.52269e+01 1.13979e+00 2.33668e+02 288.355 1.00169e+01  -3.01916e+01 0.00000e+00 0.00000e+00 3.30678e+02 288.355 9.70101e+01 288.355 0.9842 
1 1 1 7   3   14 o 1  9.36112e+00 1.57287e+00 1.65855e+02 31.379  1.17863e+01  7.18848e+00  0.00000e+00 0.00000e+00 1.73475e+02 31.379  7.61949e+00 31.379  0.9631 
1 1 1 7   3   15 o 2  4.79370e+00 1.56169e+00 4.58011e+01 34.447  1.80494e+00  1.23804e+00  0.00000e+00 0.00000e+00 8.51936e+01 34.447  3.93924e+01 34.447  0.7265 
1 1 1 7   3   16 o 4  5.68860e+00 1.83139e+00 1.20975e+02 151.843 -5.51938e+00 2.95407e+00  0.00000e+00 0.00000e+00 7.49503e+01 151.843 4.60246e+01 331.844 0.9162 
1 1 1 7   4   0  o 18 2.12708e+01 5.30607e-01 3.08116e+02 137.855 -4.62912e+00 4.18937e+00  0.00000e+00 0.00000e+00 4.26716e+02 137.855 1.18600e+02 137.855 0.9160 
1 1 1 7   4   1  o 9  1.49327e+01 7.02783e-01 4.46241e+02 199.662 -5.67334e+00 -2.02715e+00 0.00000e+00 0.00000e+00 6.79347e+01 199.662 3.78306e+02 19.662  0.9127 
1 1 1 7   4   2  o 4  1.86423e+01 5.28321e-01 2.27566e+02 81.946  6.28399e-01  4.44068e+00  0.00000e+00 0.00000e+00 3.91355e+02 81.946  1.63788e+02 81.946  0.8799 
1 1 1 7   4   3  o 5  1.51214e+01 5.14351e-01 5.76479e+02 56.467  5.36490e+00  8.09535e+00  0.00000e+00 0.00000e+00 3.60744e+01 236.467 6.12554e+02 236.467 0.9470 
1 1 1 7   4   4  o 6  3.73283e+01 8.02511e-01 7.43745e+02 156.011 -3.11238e+01 1.38498e+01  0.00000e+00 0.00000e+00 6.44169e+02 156.011 9.95762e+01 336.011 0.9852 
1 1 1 7   4   5  f 0  4.10652e+01 8.69674e-01 9.41084e+02 10.706  4.96523e+01  9.38735e+00  0.00000e+00 0.00000e+00 5.93289e+02 10.706  3.47795e+02 190.706 0.9901 
1 1 1 7   4   6  o 19 3.72909e+01 8.25714e-01 6.03089e+02 326.722 3.27780e+01  -2.15132e+01 0.00000e+00 0.00000e+00 7.86118e+02 326.722 1.83029e+02 326.722 0.9872 
1 1 1 7   4   7  o 15 3.27071e+01 7.58382e-01 4.22227e+02 149.018 -2.55466e+01 1.53387e+01  0.00000e+00 0.00000e+00 7.91029e+02 149.018 3.68802e+02 149.018 0.9831 
1 1 1 7   4   8  o 6  2.39734e+01 7.11441e-01 3.81557e+02 246.030 -1.01374e+01 -2.28009e+01 0.00000e+00 0.00000e+00 5.04565e+02 246.030 1.23008e+02 246.030 0.9798 
1 1 1 7   4   9  o 19 1.71603e+01 8.40935e-01 3.26291e+02 100.098 -3.17664e+00 1.78379e+01  0.00000e+00 0.00000e+00 3.02833e+02 100.098 2.34580e+01 280.098 0.9720 
1 1 1 7   4   10 o 3  2.05485e+01 8.22513e-01 2.66494e+02 61.919  1.15347e+01  2.16197e+01  0.00000e+00 0.00000e+00 4.92339e+02 61.919  2.25845e+02 61.919  0.9794 
1 1 1 7   4   11 o 17 1.10205e+01 1.20692e+00 2.75215e+02 186.524 -1.67354e+01 -1.91385e+00 0.00000e+00 0.00000e+00 1.27653e+02 186.524 1.47562e+02 6.524   0.9698 
1 1 1 7   4   12 o 11 1.47013e+01 1.12358e+00 2.11245e+02 149.890 -2.02422e+01 1.17388e+01  0.00000e+00 0.00000e+00 3.30688e+02 149.890 1.19443e+02 149.890 0.9784 
1 1 1 7   4   13 o 18 9.83263e+00 1.51420e+00 2.73562e+02 286.265 5.76934e+00  -1.97738e+01 0.00000e+00 0.00000e+00 8.76208e+01 286.265 1.85941e+02 106.266 0.9754 
1 1 1 7   4   14 o 14 8.66545e+00 1.68806e+00 1.28253e+02 127.304 -5.63425e+00 7.39482e+00  0.00000e+00 0.00000e+00 1.79826e+02 127.304 5.15734e+01 127.304 0.9446 
1 1 1 7   4   15 o 13 7.06715e+00 1.82593e+00 1.17070e+02 254.870 -1.84327e+00 -6.81710e+00 0.00000e+00 0.00000e+00 1.29152e+02 254.870 1.20823e+01 254.870 0.9262 
1 1 1 7   4   16 o 14 5.90409e+00 1.85817e+00 1.01528e+02 312.269 3.60641e+00  -3.96772e+00 0.00000e+00 0.00000e+00 9.84720e+01 312.269 3.05595e+00 132.269 0.9011 
1 1 1 7   5   0  o 10 1.64120e+01 5.93317e-01 2.81308e+02 250.935 -1.43172e+00 -4.14276e+00 0.00000e+00 0.00000e+00 2.61404e+02 250.935 1.99038e+01 70.935  0.8768 
1 1 1 7   5   1  o 1  1.26776e+01 4.88683e-01 1.80316e+02 98.401  -3.02669e-01 2.04949e+00  0.00000e+00 0.00000e+00 1.58865e+02 98.401  2.14507e+01 278.401 0.7092 
1 1 1 7   5   2  o 7  3.01054e+01 6.76181e-01 6.56251e+02 46.646  1.42364e+01  1.50788e+01  0.00000e+00 0.00000e+00 4.51932e+02 46.646  2.04319e+02 226.646 0.9756 
1 1 1 7   5   3  o 10 2.11872e+01 5.68653e-01 4.65802e+02 354.787 1.09212e+01  -9.96458e-01 0.00000e+00 0.00000e+00 2.96352e+02 354.787 1.69450e+02 174.787 0.9533 
1 1 1 7   5   4  o 10 1.33775e+01 6.26862e-01 3.71290e+02 318.805 4.60798e+00  -4.03333e+00 0.00000e+00 0.00000e+00 9.02663e+01 318.805 2.81023e+02 138.805 0.9142 
1 1 1 7   5   5  o 16 1.57280e+01 7.08385e-01 2.05636e+02 210.911 -3.77934e+00 -2.26285e+00 0.00000e+00 0.00000e+00 3.15197e+02 210.911 1.09561e+02 210.911 0.8775 
1 1 1 7   5   6  o 8  4.32263e+01 9.16430e-01 7.91410e+02 76.722  1.36167e+01  5.77021e+01  0.00000e+00 0.00000e+00 8.26010e+02 76.722  3.45999e+01 76.722  0.9915 
1 1 1 7   5   7  o 14 1.14036e+01 7.43454e-01 2.12982e+02 125.518 -3.04565e+00 4.26707e+00  0.00000e+00 0.00000e+00 1.73727e+02 125.518 3.92551e+01 305.518 0.8987 
1 1 1 7   5   8  o 11 1.55141e+01 7.26696e-01 2.10457e+02 297.633 4.12487e+00  -7.87904e+00 0.00000e+00 0.00000e+00 3.40870e+02 297.633 1.30413e+02 297.633 0.9420 
1 1 1 7   5   9  o 5  2.08403e+01 8.14156e-01 2.10660e+02 284.176 3.48686e+00  -1.38047e+01 0.00000e+00 0.00000e+00 5.47252e+02 284.176 3.36592e+02 284.176 0.9642 
1 1 1 7   5   10 o 6  1.16181e+01 1.07005e+00 1.31081e+02 292.685 2.52712e+00  -6.04565e+00 0.00000e+00 0.00000e+00 2.72018e+02 292.685 1.40937e+02 292.685 0.9202 
1 1 1 7   5   11 o 6  3.00654e+01 9.08197e-01 4.68838e+02 118.417 -3.98773e+01 7.36988e+01  0.00000e+00 0.00000e+00 6.57616e+02 118.417 1.88778e+02 118.417 0.9940 
1 1 1 7   5   12 o 9  6.38706e+00 1.50820e+00 1.50200e+02 24.353  5.75626e+00  2.60549e+00  0.00000e+00 0.00000e+00 7.04789e+01 24.353  7.97209e+01 204.353 0.9170 
1 1 1 7   5   13 o 3  1.20770e+01 1.44131e+00 2.32010e+02 326.628 1.84895e+01  -1.21788e+01 0.00000e+00 0.00000e+00 2.12398e+02 326.628 1.96116e+01 146.628 0.9771 
1 1 1 7   5   14 o 11 5.40452e+00 1.56107e+00 1.26006e+02 106.926 -1.77348e+00 5.82755e+00  0.00000e+00 0.00000e+00 5.98661e+01 106.926 6.61398e+01 286.926 0.9138 
1 1 1 7   5   15 f 0  1.13453e+01 1.90389e+00 1.04608e+02 5.155   9.63839e+00  8.69568e-01  0.00000e+00 0.00000e+00 2.99459e+02 5.155   1.94851e+02 5.155   0.9468 
1 1 1 7   5   16 o 2  6.29867e+00 1.96528e+00 1.60197e+02 44.135  6.05977e+00  5.87951e+00  0.00000e+00 0.00000e+00 6.20734e+01 44.135  9.81238e+01 224.135 0.9388 
1 1 1 7   6   0  o 12 2.49945e+01 5.85885e-01 5.03786e+02 272.654 5.52286e-01  -1.19131e+01 0.00000e+00 0.00000e+00 3.98430e+02 272.654 1.05356e+02 92.654  0.9571 
1 1 1 7   6   1  o 6  3.64799e+01 7.68601e-01 7.63138e+02 185.713 -2.48956e+01 -2.49075e+00 0.00000e+00 0.00000e+00 5.85230e+02 185.713 1.77907e+02 5.713   0.9798 
1 1 1 7   6   2  o 2  2.46717e+01 6.01057e-01 3.48842e+02 146.518 -7.53323e+00 4.98279e+00  0.00000e+00 0.00000e+00 5.28888e+02 146.518 1.80046e+02 146.518 0.9429 
1 1 1 7   6   3  o 6  4.29256e+01 8.90892e-01 1.05730e+03 126.776 -2.98506e+01 3.99366e+01  0.00000e+00 0.00000e+00 5.46203e+02 126.776 5.11099e+02 306.776 0.9899 
1 1 1 7   6   4  o 9  2.13098e+01 5.80483e-01 4.17471e+02 39.317  8.48590e+00  6.94992e+00  0.00000e+00 0.00000e+00 3.49140e+02 39.317  6.83314e+01 219.317 0.9533 
1 1 1 7   6   5  o 2  4.70695e+01 1.15465e+00 1.00998e+03 39.326  4.89904e+01  4.01358e+01  0.00000e+00 0.00000e+00 7.52280e+02 39.326  2.57697e+02 219.326 0.9921 
1 1 1 7   6   6  o 5  2.07595e+01 6.01950e-01 1.66612e+02 218.737 -4.74550e+00 -3.80690e+00 0.00000e+00 0.00000e+00 5.49126e+02 218.737 3.82514e+02 218.737 0.9136 
1 1 1 7   6   7  o 11 2.16279e+01 6.69037e-01 4.89624e+02 299.010 1.11254e+01  -2.00624e+01 0.00000e+00 0.00000e+00 3.08456e+02 299.010 1.81168e+02 119.010 0.9780 
1 1 1 7   6   8  o 16 2.01830e+01 7.03622e-01 4.52974e+02 239.344 -1.27129e+01 -2.14488e+01 0.00000e+00 0.00000e+00 2.93012e+02 239.344 1.59961e+02 59.344  0.9797 
1 1 1 7   6   9  o 19 2.90057e+01 7.99484e-01 5.07282e+02 149.731 -4.12508e+01 2.40751e+01  0.00000e+00 0.00000e+00 5.75202e+02 149.731 6.79197e+01 149.731 0.9895 
1 1 1 7   6   10 o 7  2.74351e+01 8.33194e-01 5.12674e+02 71.816  2.07061e+01  6.30361e+01  0.00000e+00 0.00000e+00 5.13952e+02 71.816  1.27807e+00 71.816  0.9924 
1 1 1 7   6   11 o 8  1.70559e+01 9.20618e-01 3.47534e+02 248.154 -1.30730e+01 -3.26086e+01 0.00000e+00 0.00000e+00 2.86118e+02 248.154 6.14163e+01 68.154  0.9857 
1 1 1 7   6   12 o 3  4.72235e+00 1.37602e+00 1.51547e+02 347.338 4.82553e+00  -1.08408e+00 0.00000e+00 0.00000e+00 7.17625e+00 347.338 1.44371e+02 167.338 0.8921 
1 1 1 7   6   13 o 18 1.04108e+01 1.56954e+00 2.47029e+02 52.916  1.19790e+01  1.58484e+01  0.00000e+00 0.00000e+00 1.35020e+02 52.916  1.12010e+02 232.916 0.9745 
1 1 1 7   6   14 o 8  1.11770e+01 1.90281e+00 2.29081e+02 192.025 -1.86752e+01 -3.97814e+00 0.00000e+00 0.00000e+00 1.80423e+02 192.025 4.86575e+01 12.025  0.9735 
1 1 1 7   6   15 f 0  5.25526e+00 1.63990e+00 8.50294e+01 37.651  3.36771e+00  2.59823e+00  0.00000e+00 0.00000e+00 8.74633e+01 37.651  2.43393e+00 37.651  0.8726 
1 1 1 7   6   16 o 18 5.66185e+00 1.81267e+00 1.01986e+02 358.426 5.31080e+00  -1.45958e-01 0.00000e+00 0.00000e+00 8.95932e+01 358.426 1.23931e+01 178.426 0.9002 
1 1 1 7   7   0  o 16 2.99619e+01 6.56858e-01 7.63923e+02 70.807  6.85361e+00  1.96882e+01  0.00000e+00 0.00000e+00 3.38602e+02 70.807  4.25321e+02 250.807 0.9757 
1 1 1 7   7   1  o 9  3.35429e+01 7.25463e-01 6.88104e+02 90.212  -7.64811e-02 2.07092e+01  0.00000e+00 0.00000e+00 5.46299e+02 90.212  1.41805e+02 270.212 0.9755 
1 1 1 7   7   2  o 4  8.17032e+00 5.99106e-01 5.20148e+01 296.243 1.96740e-01  -3.99062e-01 0.00000e+00 0.00000e+00 1.49203e+01 296.243 3.70945e+01 116.244 0.2171 
1 1 1 7   7   3  o 10 2.47281e+01 6.11487e-01 5.92685e+02 78.998  3.09398e+00  1.59136e+01  0.00000e+00 0.00000e+00 3.11177e+02 78.998  2.81508e+02 258.997 0.9686 
1 1 1 7   7   4  o 7  1.84898e+01 5.58295e-01 2.90004e+02 63.226  2.97555e+00  5.89720e+00  0.00000e+00 0.00000e+00 3.52524e+02 63.226  6.25209e+01 63.226  0.9208 
1 1 1 7   7   5  o 7  2.85841e+01 8.16852e-01 5.59151e+02 38.671  1.68879e+01  1.35155e+01  0.00000e+00 0.00000e+00 4.94314e+02 38.671  6.48374e+01 218.671 0.9766 
1 1 1 7   7   6  o 9  2.33872e+01 6.21904e-01 3.02739e+02 319.487 9.45031e+00  -8.07492e+00 0.00000e+00 0.00000e+00 5.43519e+02 319.487 2.40780e+02 319.487 0.9589 
1 1 1 7   7   7  o 15 3.33948e+01 7.56690e-01 6.88274e+02 248.465 -1.86420e+01 -4.72422e+01 0.00000e+00 0.00000e+00 5.59295e+02 248.465 1.28979e+02 68.466  0.9901 
1 1 1 7   7   8  o 7  3.72633e+01 8.42325e-01 6.91710e+02 189.332 -7.03029e+01 -1.15533e+01 0.00000e+00 0.00000e+00 7.04145e+02 189.332 1.24351e+01 189.332 0.9930 
1 1 1 7   7   9  o 10 4.53063e+01 9.85014e-01 6.77458e+02 111.832 -3.62909e+01 9.05887e+01  0.00000e+00 0.00000e+00 1.02253e+03 111.832 3.45076e+02 111.832 0.9949 
1 1 1 7   7   10 o 18 7.81942e+00 1.41496e+00 1.53947e+02 24.063  4.64273e+00  2.07322e+00  0.00000e+00 0.00000e+00 1.10016e+02 24.063  4.39317e+01 204.063 0.8953 
1 1 1 7   7   11 o 19 2.30482e+01 9.14336e-01 4.04022e+02 347.591 5.39411e+01  -1.18690e+01 0.00000e+00 0.00000e+00 4.56790e+02 347.591 5.27679e+01 347.591 0.9909 
1 1 1 7   7   12 o 15 8.55130e+00 1.53122e+00 2.00561e+02 162.882 -1.06946e+01 3.29369e+00  0.00000e+00 0.00000e+00 1.06861e+02 162.882 9.36998e+01 342.882 0.9542 
1 1 1 7   7   13 f 0  2.30022e+01 1.07816e+00 4.09886e+02 246.852 -3.53016e+01 -8.25723e+01 0.00000e+00 0.00000e+00 4.51476e+02 246.852 4.15901e+01 246.852 0.9944 
1 1 1 7   7   14 o 10 4.66636e+00 1.49307e+00 8.92999e+01 66.732  1.52513e+00  3.54673e+00  0.00000e+00 0.00000e+00 6.13783e+01 66.732  2.79217e+01 246.732 0.8579 
1 1 1 7   7   15 o 10 6.23207e+00 1.77820e+00 4.47673e+01 40.029  1.87459e+00  1.57457e+00  0.00000e+00 0.00000e+00 1.33207e+02 40.029  8.84400e+01 40.029  0.7592 
1 1 1 7   7   16 o 7  7.85015e+00 2.26671e+00 2.55006e+02 309.852 8.93818e+00  -1.07083e+01 0.00000e+00 0.00000e+00 2.92907e+01 309.852 2.25715e+02 129.851 0.9635 
1 1 1 7   8   0  o 10 3.70961e+01 7.77975e-01 8.70150e+02 355.470 2.91217e+01  -2.30726e+00 0.00000e+00 0.00000e+00 5.04689e+02 355.470 3.65461e+02 175.470 0.9827 
1 1 1 7   8   1  o 11 2.82816e+01 6.40748e-01 5.39791e+02 263.473 -1.85720e+00 -1.62314e+01 0.00000e+00 0.00000e+00 4.93871e+02 263.473 4.59203e+01 83.473  0.9689 
1 1 1 7   8   2  o 3  4.24504e+01 8.76849e-01 8.50044e+02 101.929 -7.72467e+00 3.65656e+01  0.00000e+00 0.00000e+00 7.30012e+02 101.929 1.20032e+02 281.929 0.9865 
1 1 1 7   8   3  o 5  3.54424e+00 7.93697e-01 1.96962e+02 316.505 5.56005e-01  -5.27529e-01 0.00000e+00 0.00000e+00 1.49139e+02 136.505 3.46100e+02 136.505 0.3576 
1 1 1 7   8   4  o 5  3.12881e+01 7.10544e-01 7.95463e+02 83.214  3.60036e+00  3.02579e+01  0.00000e+00 0.00000e+00 3.65714e+02 83.214  4.29749e+02 263.214 0.9835 
1 1 1 7   8   5  o 5  1.94441e+01 5.62794e-01 3.87540e+02 236.469 -5.67660e+00 -8.56645e+00 0.00000e+00 0.00000e+00 3.09553e+02 236.469 7.79866e+01 56.469  0.9500 
1 1 1 7   8   6  o 7  1.67957e+01 5.98264e-01 3.05880e+02 305.692 5.26084e+00  -7.32352e+00 0.00000e+00 0.00000e+00 2.91659e+02 305.692 1.42212e+01 125.692 0.9428 
1 1 1 7   8   7  o 11 1.26992e+01 8.56533e-01 2.41631e+02 182.709 -6.72199e+00 -3.18041e-01 0.00000e+00 0.00000e+00 2.00329e+02 182.709 4.13020e+01 2.709   0.9224 
1 1 1 7   8   8  o 18 2.86583e+01 7.44591e-01 7.05404e+02 50.907  3.54970e+01  4.36900e+01  0.00000e+00 0.00000e+00 3.66059e+02 50.907  3.39345e+02 230.907 0.9911 
1 1 1 7   8   9  f 0  2.57141e+01 9.09152e-01 2.47227e+02 119.517 -1.00371e+01 1.77286e+01  0.00000e+00 0.00000e+00 6.98475e+02 119.517 4.51247e+02 119.517 0.9751 
1 1 1 7   8   10 o 2  1.47359e+01 9.41574e-01 1.28822e+02 154.989 -7.97023e+00 3.71836e+00  0.00000e+00 0.00000e+00 3.94170e+02 154.989 2.65348e+02 154.989 0.9413 
1 1 1 7   8   11 o 4  8.57341e+00 1.42500e+00 1.61697e+02 328.970 6.21233e+00  -3.73711e+00 0.00000e+00 0.00000e+00 1.38243e+02 328.970 2.34540e+01 148.970 0.9282 
1 1 1 7   8   12 o 16 6.07279e+00 1.53394e+00 8.74023e+01 227.899 -2.31841e+00 -2.56573e+00 0.00000e+00 0.00000e+00 1.04525e+02 227.899 1.71226e+01 227.899 0.8389 
1 1 1 7   8   13 o 4  1.28119e+01 1.33067e+00 1.60606e+02 290.549 6.20088e+00  -1.65414e+01 0.00000e+00 0.00000e+00 3.07985e+02 290.549 1.47380e+02 290.549 0.9713 
1 1 1 7   8   14 o 3  5.66919e+00 1.76650e+00 1.14544e+02 261.073 -8.07837e-01 -5.14297e+00 0.00000e+00 0.00000e+00 7.70478e+01 261.073 3.74962e+01 81.073  0.8980 
1 1 1 7   8   15 o 8  5.79521e+00 1.75429e+00 7.84668e+01 302.860 2.20488e+00  -3.41342e+00 0.00000e+00 0.00000e+00 1.10284e+02 302.860 3.18175e+01 302.860 0.8659 
1 1 1 7   8   16 o 12 8.19934e+00 2.28130e+00 1.40748e+02 253.881 -2.23424e+00 -7.73133e+00 0.00000e+00 0.00000e+00 1.47613e+02 253.881 6.86479e+00 253.881 0.9356 
1 1 1 7   9   0  o 16 2.50399e+01 5.90825e-01 5.96401e+02 3.373   1.34999e+01  7.95747e-01  0.00000e+00 0.00000e+00 3.12287e+02 3.373   2.84114e+02 183.373 0.9623 
1 1 1 7   9   1  o 3  2.77968e+01 6.32713e-01 5.35163e+02 260.143 -2.71649e+00 -1.56335e+01 0.00000e+00 0.00000e+00 4.79775e+02 260.143 5.53882e+01 80.143  0.9680 
1 1 1 7   9   2  o 5  1.84822e+01 5.43833e-01 2.18476e+02 189.447 -4.15110e+00 -6.90690e-01 0.00000e+00 0.00000e+00 3.88931e+02 189.447 1.70455e+02 189.447 0.8711 
1 1 1 7   9   3  o 13 1.93184e+01 5.52101e-01 4.84544e+02 53.139  6.19222e+00  8.25901e+00  0.00000e+00 0.00000e+00 2.08145e+02 53.139  2.76399e+02 233.139 0.9503 
1 1 1 7   9   4  o 7  4.26240e+01 8.92637e-01 1.03473e+03 172.643 -5.30964e+01 6.85548e+00  0.00000e+00 0.00000e+00 5.58640e+02 172.643 4.76087e+02 352.643 0.9906 
1 1 1 7   9   5  o 9  1.63728e+01 5.67433e-01 2.77414e+02 336.560 5.67418e+00  -2.46009e+00 0.00000e+00 0.00000e+00 2.88002e+02 336.560 1.05885e+01 336.560 0.9151 
1 1 1 7   9   6  o 3  2.61521e+01 6.57155e-01 4.51496e+02 71.118  6.54626e+00  1.91398e+01  0.00000e+00 0.00000e+00 5.10626e+02 71.118  5.91303e+01 71.118  0.9750 
1 1 1 7   9   7  o 12 4.08049e+01 8.60167e-01 6.16303e+02 184.911 -5.48845e+01 -4.71546e+00 0.00000e+00 0.00000e+00 9.09223e+02 184.911 2.92920e+02 184.911 0.9909 
1 1 1 7   9   8  o 19 1.64819e+01 7.46297e-01 2.43064e+02 22.683  1.02829e+01  4.29776e+00  0.00000e+00 0.00000e+00 3.50100e+02 22.683  1.07036e+02 22.683  0.9540 
1 1 1 7   9   9  o 4  1.69578e+01 8.27017e-01 2.45146e+02 133.445 -9.98964e+00 1.05471e+01  0.00000e+00 0.00000e+00 3.71985e+02 133.445 1.26839e+02 133.445 0.9649 
1 1 1 7   9   10 o 4  1.46565e+01 9.37792e-01 2.24138e+02 106.107 -4.22248e+00 1.46220e+01  0.00000e+00 0.00000e+00 3.09981e+02 106.107 8.58427e+01 106.107 0.9666 
1 1 1 7   9   11 o 16 1.01241e+01 1.45447e+00 1.25036e+02 70.907  2.14615e+00  6.20007e+00  0.00000e+00 0.00000e+00 2.26117e+02 70.907  1.01080e+02 70.907  0.9203 
1 1 1 7   9   12 o 2  1.68655e+01 1.05748e+00 3.59573e+02 196.986 -4.45065e+01 -1.35956e+01 0.00000e+00 0.00000e+00 2.68949e+02 196.986 9.06240e+01 16.987  0.9892 
1 1 1 7   9   13 o 14 8.91905e+00 1.58001e+00 2.73527e+02 90.004  -1.28326e-03 1.87393e+01  0.00000e+00 0.00000e+00 5.32367e+01 90.004  2.20290e+02 270.004 0.9729 
1 1 1 7   9   14 o 4  6.30150e+00 1.71660e+00 1.33920e+02 114.588 -2.81656e+00 6.15527e+00  0.00000e+00 0.00000e+00 8.49432e+01 114.588 4.89766e+01 294.588 0.9229 
1 1 1 7   9   15 o 8  8.82756e+00 1.92632e+00 1.49617e+02 333.904 9.57810e+00  -4.69140e+00 0.00000e+00 0.00000e+00 1.66437e+02 333.904 1.68194e+01 333.904 0.9519 
1 1 1 7   9   16 o 16 6.33963e+00 2.11733e+00 7.51124e+01 183.192 -3.66109e+00 -2.04147e-01 0.00000e+00 0.00000e+00 1.27282e+02 183.192 5.21697e+01 183.192 0.8494 
1 1 1 7   10  0  o 4  1.92351e+01 5.22688e-01 5.29310e+02 103.678 -2.17403e+00 8.93300e+00  0.00000e+00 0.00000e+00 1.55397e+02 103.678 3.73912e+02 283.678 0.9439 
1 1 1 7   10  1  o 18 2.18489e+01 6.27520e-01 8.74058e+01 116.528 -9.06517e-01 1.81598e+00  0.00000e+00 0.00000e+00 4.91632e+02 116.528 4.04226e+02 116.528 0.7026 
1 1 1 7   10  2  f 0  3.10240e+01 6.90766e-01 6.45584e+02 74.607  5.50248e+00  1.99864e+01  0.00000e+00 0.00000e+00 4.96287e+02 74.607  1.49297e+02 254.607 0.9756 
1 1 1 7   10  3  o 17 2.16004e+01 5.66324e-01 3.97194e+02 199.602 -1.06661e+01 -3.79854e+00 0.00000e+00 0.00000e+00 3.80974e+02 199.602 1.62200e+01 19.602  0.9548 
1 1 1 7   10  4  o 7  1.71578e+01 5.37859e-01 2.32913e+02 155.953 -4.78563e+00 2.13543e+00  0.00000e+00 0.00000e+00 3.48935e+02 155.953 1.16022e+02 155.953 0.8987 
1 1 1 7   10  5  o 5  8.72897e+00 9.12311e-01 1.44699e+02 263.142 -2.02395e-01 -1.68277e+00 0.00000e+00 0.00000e+00 6.63588e+01 263.142 7.83400e+01 83.142  0.6408 
1 1 1 7   10  6  o 2  2.77087e+01 6.65921e-01 3.38332e+02 97.050  -1.96729e+00 1.59070e+01  0.00000e+00 0.00000e+00 6.74047e+02 97.050  3.35714e+02 97.050  0.9683 
1 1 1 7   10  7  o 2  2.86197e+01 7.15755e-01 6.02809e+02 69.597  1.32858e+01  3.57195e+01  0.00000e+00 0.00000e+00 4.62720e+02 69.597  1.40088e+02 249.597 0.9868 
1 1 1 7   10  8  o 4  1.53034e+01 7.52144e-01 3.88741e+02 236.547 -9.11066e+00 -1.37893e+01 0.00000e+00 0.00000e+00 1.70791e+02 236.547 2.17950e+02 56.547  0.9693 
1 1 1 7   10  9  o 8  3.35229e+01 8.37763e-01 3.96745e+02 75.661  1.14843e+01  4.49275e+01  0.00000e+00 0.00000e+00 8.53808e+02 75.661  4.57063e+02 75.661  0.9892 
1 1 1 7   10  10 o 13 2.47977e+01 8.37622e-01 5.74150e+02 242.745 -3.06612e+01 -5.95201e+01 0.00000e+00 0.00000e+00 3.53767e+02 242.745 2.20383e+02 62.745  0.9925 
1 1 1 7   10  11 o 15 8.10080e+00 1.37414e+00 1.41634e+02 226.048 -4.57252e+00 -4.74299e+00 0.00000e+00 0.00000e+00 1.39440e+02 226.048 2.19429e+00 46.048  0.9206 
1 1 1 7   10  12 o 13 1.21141e+01 1.34077e+00 1.95920e+02 197.898 -1.59677e+01 -5.15676e+00 0.00000e+00 0.00000e+00 2.46635e+02 197.898 5.07149e+01 197.898 0.9697 
1 1 1 7   10  13 o 9  8.52938e+00 1.59060e+00 1.10912e+02 238.207 -3.80851e+00 -6.14428e+00 0.00000e+00 0.00000e+00 1.87134e+02 238.207 7.62219e+01 238.207 0.9280 
1 1 1 7   10  14 o 10 1.03904e+01 1.75007e+00 1.86556e+02 226.360 -1.05422e+01 -1.10551e+01 0.00000e+00 0.00000e+00 1.91453e+02 226.360 4.89728e+00 226.360 0.9667 
1 1 1 7   10  15 o 14 5.80885e+00 1.76258e+00 1.58806e+02 109.995 -2.80369e+00 7.70519e+00  0.00000e+00 0.00000e+00 4.58809e+01 109.995 1.12925e+02 289.995 0.9369 
1 1 1 7   11  0  o 10 2.58944e+01 5.97156e-01 5.98107e+02 345.559 1.34648e+01  -3.46747e+00 0.00000e+00 0.00000e+00 3.42568e+02 345.559 2.55539e+02 165.559 0.9633 
1 1 1 7   11  1  o 16 2.21231e+01 6.52125e-01 3.76116e+02 349.725 8.66111e+00  -1.57000e+00 0.00000e+00 0.00000e+00 4.09416e+02 349.725 3.33004e+01 349.725 0.9414 
1 1 1 7   11  2  o 3  1.67116e+01 5.26823e-01 3.46413e+02 23.976  6.39790e+00  2.84532e+00  0.00000e+00 0.00000e+00 2.37121e+02 23.976  1.09292e+02 203.976 0.9256 
1 1 1 7   11  3  o 13 3.64690e+01 7.43916e-01 9.14332e+02 122.804 -2.36328e+01 3.66652e+01  0.00000e+00 0.00000e+00 4.45830e+02 122.804 4.68502e+02 302.804 0.9885 
1 1 1 7   11  4  o 19 5.02576e+01 1.30573e+00 6.75265e+02 86.264  2.79585e+00  4.28175e+01  0.00000e+00 0.00000e+00 1.19892e+03 86.264  5.23656e+02 86.264  0.9883 
1 1 1 7   11  5  o 4  9.77770e+00 6.04732e-01 3.39720e+01 79.336  9.81780e-02  5.21374e-01  0.00000e+00 0.00000e+00 6.06105e+01 79.336  2.66385e+01 79.336  0.2564 
1 1 1 7   11  6  o 1  3.60703e+01 9.34164e-01 5.00795e+02 51.322  1.90039e+01  2.37393e+01  0.00000e+00 0.00000e+00 8.37648e+02 51.322  3.36853e+02 51.322  0.9834 
1 1 1 7   11  7  o 19 2.41728e+01 6.82650e-01 4.21907e+02 242.577 -1.03842e+01 -2.00135e+01 0.00000e+00 0.00000e+00 4.69621e+02 242.577 4.77136e+01 242.577 0.9776 
1 1 1 7   11  8  o 4  2.98373e+01 7.52212e-01 3.79642e+02 115.495 -1.35319e+01 2.83761e+01  0.00000e+00 0.00000e+00 7.27809e+02 115.495 3.48167e+02 115.495 0.9840 
1 1 1 7   11  9  o 8  2.25846e+01 7.80637e-01 4.32762e+02 216.076 -2.76778e+01 -2.01655e+01 0.00000e+00 0.00000e+00 4.06424e+02 216.076 2.63382e+01 36.076  0.9853 
1 1 1 7   11  10 o 11 2.23156e+01 8.73899e-01 3.78653e+02 20.967  3.61392e+01  1.38488e+01  0.00000e+00 0.00000e+00 4.51725e+02 20.967  7.30720e+01 20.967  0.9870 
1 1 1 7   11  11 o 8  6.89112e+00 1.37432e+00 1.34519e+02 177.570 -5.31353e+00 2.25467e-01  0.00000e+00 0.00000e+00 9.92901e+01 177.570 3.52292e+01 357.570 0.9003 
1 1 1 7   11  12 o 14 5.95973e+00 1.55255e+00 1.22362e+02 223.609 -3.44933e+00 -3.28577e+00 0.00000e+00 0.00000e+00 7.69159e+01 223.609 4.54460e+01 43.609  0.8876 
1 1 1 7   11  13 o 17 4.34074e+00 1.37035e+00 1.42496e+02 114.064 -2.07026e+00 4.63603e+00  0.00000e+00 0.00000e+00 3.80934e+00 114.064 1.38687e+02 294.064 0.8951 
1 1 1 7   11  14 o 7  6.70323e+00 1.82007e+00 1.13894e+02 113.723 -2.33331e+00 5.30964e+00  0.00000e+00 0.00000e+00 1.15446e+02 113.723 1.55242e+00 113.723 0.9091 
1 1 1 7   11  15 o 8  4.68203e+00 1.53177e+00 2.69509e+01 185.356 -1.27886e+00 -1.19890e-01 0.00000e+00 0.00000e+00 6.78164e+01 185.356 4.08655e+01 185.356 0.5382 
1 1 1 7   12  0  o 2  1.28204e+01 5.41203e-01 3.24573e+02 61.524  2.11993e+00  3.90841e+00  0.00000e+00 0.00000e+00 1.00241e+02 61.524  2.24332e+02 241.524 0.8787 
1 1 1 7   12  1  o 18 2.06288e+01 5.49739e-01 4.17063e+02 126.671 -5.42552e+00 7.28652e+00  0.00000e+00 0.00000e+00 3.16854e+02 126.671 1.00208e+02 306.671 0.9432 
1 1 1 7   12  2  o 6  2.95073e+01 9.32400e-01 4.86210e+02 225.615 -1.19300e+01 -1.21891e+01 0.00000e+00 0.00000e+00 5.93820e+02 225.615 1.07609e+02 225.615 0.9702 
1 1 1 7   12  3  o 18 1.91241e+01 5.34651e-01 3.44536e+02 12.132  8.45627e+00  1.81788e+00  0.00000e+00 0.00000e+00 3.33927e+02 12.132  1.06087e+01 192.132 0.9403 
1 1 1 7   12  4  o 6  2.59785e+01 7.07605e-01 4.70505e+02 209.331 -1.38404e+01 -7.77684e+00 0.00000e+00 0.00000e+00 4.78345e+02 209.331 7.83993e+00 209.331 0.9680 
1 1 1 7   12  5  o 7  2.39149e+01 6.01788e-01 3.71846e+02 259.013 -2.70056e+00 -1.39101e+01 0.00000e+00 0.00000e+00 4.98086e+02 259.013 1.26240e+02 259.013 0.9640 
1 1 1 7   12  6  o 18 2.80588e+01 6.87742e-01 3.44782e+02 130.176 -1.06211e+01 1.25792e+01  0.00000e+00 0.00000e+00 6.81229e+02 130.176 3.36447e+02 130.176 0.9691 
1 1 1 7   12  7  o 14 4.05583e+01 8.59126e-01 6.92097e+02 114.960 -2.85824e+01 6.14081e+01  0.00000e+00 0.00000e+00 8.26694e+02 114.960 1.34597e+02 114.960 0.9926 
1 1 1 7   12  8  o 6  1.49263e+01 8.07967e-01 4.78068e+02 136.341 -1.53963e+01 1.46918e+01  0.00000e+00 0.00000e+00 7.15607e+01 136.341 4.06507e+02 316.341 0.9762 
1 1 1 7   12  9  o 7  2.92652e+01 8.12975e-01 4.31814e+02 295.567 1.90191e+01  -3.97546e+01 0.00000e+00 0.00000e+00 6.59213e+02 295.567 2.27399e+02 295.567 0.9886 
1 1 1 7   12  10 f 0  2.58945e+01 8.32139e-01 5.15712e+02 113.686 -2.46917e+01 5.62864e+01  0.00000e+00 0.00000e+00 4.52531e+02 113.686 6.31816e+01 293.686 0.9918 
1 1 1 7   12  11 o 6  1.41913e+01 1.05338e+00 1.65889e+02 225.827 -1.02675e+01 -1.05682e+01 0.00000e+00 0.00000e+00 3.50449e+02 225.827 1.84560e+02 225.827 0.9654 
1 1 1 7   12  12 o 13 1.35973e+01 1.20424e+00 2.55901e+02 63.691  1.14156e+01  2.30884e+01  0.00000e+00 0.00000e+00 2.46271e+02 63.691  9.63018e+00 243.691 0.9804 
1 1 1 7   12  13 o 10 4.74573e+00 1.46269e+00 1.28960e+02 178.164 -4.82350e+00 1.54635e-01  0.00000e+00 0.00000e+00 2.99264e+01 178.164 9.90333e+01 358.164 0.8892 
1 1 1 7   12  14 o 10 1.50523e+01 1.56939e+00 2.91980e+02 118.498 -1.81249e+01 3.33840e+01  0.00000e+00 0.00000e+00 2.66958e+02 118.498 2.50223e+01 298.498 0.9867 
1 1 1 7   12  15 o 1  6.31842e+00 1.76221e+00 1.34973e+02 114.876 -3.17549e+00 6.84847e+00  0.00000e+00 0.00000e+00 8.63070e+01 114.876 4.86657e+01 294.876 0.9312 
1 1 1 7   13  0  o 1  2.17626e+01 6.32214e-01 4.07876e+02 161.674 -8.94014e+00 2.96114e+00  0.00000e+00 0.00000e+00 3.67859e+02 161.674 4.00172e+01 341.674 0.9453 
1 1 1 7   13  1  o 14 2.49842e+01 6.87992e-01 6.99978e+02 80.419  3.04297e+00  1.80267e+01  0.00000e+00 0.00000e+00 2.16202e+02 80.419  4.83776e+02 260.419 0.9723 
1 1 1 7   13  2  o 9  2.59056e+01 7.95787e-01 4.51051e+02 264.248 -1.39393e+00 -1.38383e+01 0.00000e+00 0.00000e+00 4.90397e+02 264.248 3.93463e+01 264.248 0.9634 
1 1 1 7   13  3  o 12 2.61511e+01 6.02318e-01 4.03039e+02 88.184  4.36217e-01  1.37569e+01  0.00000e+00 0.00000e+00 5.47067e+02 88.184  1.44028e+02 88.184  0.9630 
1 1 1 7   13  4  o 1  1.91393e+01 7.28670e-01 1.71082e+02 24.488  3.85833e+00  1.75741e+00  0.00000e+00 0.00000e+00 4.58741e+02 24.488  2.87659e+02 24.488  0.8721 
1 1 1 7   13  5  o 7  3.58551e+01 7.53590e-01 7.44369e+02 208.555 -3.70288e+01 -2.01507e+01 0.00000e+00 0.00000e+00 5.92363e+02 208.555 1.52006e+02 28.555  0.9881 
1 1 1 7   13  6  o 5  2.63607e+01 6.70977e-01 4.25170e+02 18.390  1.82764e+01  6.07608e+00  0.00000e+00 0.00000e+00 5.43237e+02 18.390  1.18067e+02 18.390  0.9737 
1 1 1 7   13  7  o 2  3.07549e+01 7.34163e-01 5.82788e+02 224.674 -3.09891e+01 -3.06386e+01 0.00000e+00 0.00000e+00 5.64059e+02 224.674 1.87289e+01 44.674  0.9885 
1 1 1 7   13  8  o 19 3.36722e+01 8.14876e-01 6.05702e+02 61.644  2.88281e+01  5.34134e+01  0.00000e+00 0.00000e+00 6.53866e+02 61.644  4.81641e+01 61.644  0.9917 
1 1 1 7   13  9  o 4  1.82670e+01 8.24826e-01 3.04882e+02 124.142 -1.06089e+01 1.56448e+01  0.00000e+00 0.00000e+00 3.65487e+02 124.142 6.06045e+01 124.142 0.9732 
1 1 1 7   13  10 o 4  1.13658e+01 1.05568e+00 1.14396e+02 280.995 1.09953e+00  -5.65941e+00 0.00000e+00 0.00000e+00 2.74892e+02 280.995 1.60496e+02 280.995 0.9085 
1 1 1 7   13  11 o 3  9.92224e+00 1.33818e+00 9.37516e+01 217.887 -4.24923e+00 -3.30642e+00 0.00000e+00 0.00000e+00 2.43370e+02 217.887 1.49618e+02 217.887 0.9016 
1 1 1 7   13  12 o 8  7.11995e+00 1.56405e+00 1.08487e+02 358.706 5.01550e+00  -1.13316e-01 0.00000e+00 0.00000e+00 1.31224e+02 358.706 2.27375e+01 358.706 0.8938 
1 1 1 7   13  13 o 13 8.68388e+00 1.75732e+00 2.23262e+02 198.897 -1.26725e+01 -4.33794e+00 0.00000e+00 0.00000e+00 9.12420e+01 198.897 1.32021e+02 18.897  0.9619 
1 1 1 7   13  14 f 0  5.79182e+00 1.67968e+00 9.45254e+01 329.647 4.02776e+00  -2.35865e+00 0.00000e+00 0.00000e+00 9.83721e+01 329.647 3.84670e+00 329.647 0.8851 
1 1 1 7   13  15 o 12 5.30774e+00 1.70281e+00 1.08443e+02 332.111 4.66153e+00  -2.46705e+00 0.00000e+00 0.00000e+00 7.10831e+01 332.111 3.73602e+01 152.111 0.8994 
1 1 1 7   14  0  o 13 2.70047e+01 6.17495e-01 6.27417e+02 302.360 9.57608e+00  -1.51127e+01 0.00000e+00 0.00000e+00 3.61941e+02 302.360 2.65477e+02 122.360 0.9716 
1 1 1 7   14  1  o 10 9.54204e+00 5.02829e-01 2.91032e+02 65.711  1.19337e+00  2.64442e+00  0.00000e+00 0.00000e+00 2.25918e+00 245.711 2.93291e+02 245.711 0.8024 
1 1 1 7   14  2  o 9  1.62177e+01 6.73158e-01 3.57371e+02 18.774  6.09565e+00  2.07202e+00  0.00000e+00 0.00000e+00 2.04647e+02 18.774  1.52724e+02 198.774 0.9187 
1 1 1 7   14  3  o 11 4.02161e+01 7.99348e-01 7.70278e+02 353.244 3.64376e+01  -4.31662e+00 0.00000e+00 0.00000e+00 7.26153e+02 353.244 4.41254e+01 173.244 0.9863 
1 1 1 7   14  4  o 1  2.70672e+01 6.26136e-01 2.29982e+02 80.266  1.35001e+00  7.86998e+00  0.00000e+00 0.00000e+00 7.24994e+02 80.266  4.95012e+02 80.266  0.9351 
1 1 1 7   14  5  o 12 3.35468e+01 7.23015e-01 3.95839e+02 256.400 -4.83328e+00 -1.99780e+01 0.00000e+00 0.00000e+00 8.38709e+02 256.400 4.42870e+02 256.400 0.9754 
1 1 1 7   14  6  o 9  3.26421e+01 7.31471e-01 7.99839e+02 106.082 -1.23808e+01 4.29452e+01  0.00000e+00 0.00000e+00 4.17835e+02 106.082 3.82005e+02 286.082 0.9887 
1 1 1 7   14  7  o 11 1.61680e+01 6.56037e-01 2.60374e+02 358.048 1.02635e+01  -3.49705e-01 0.00000e+00 0.00000e+00 3.19044e+02 358.048 5.86697e+01 358.048 0.9500 
1 1 1 7   14  8  o 14 4.89894e+01 1.00454e+00 7.42054e+02 170.923 -1.04636e+02 1.67168e+01  0.00000e+00 0.00000e+00 1.09696e+03 170.923 3.54902e+02 170.923 0.9953 
1 1 1 7   14  9  o 17 1.63580e+01 8.34960e-01 2.44233e+02 336.874 1.24421e+01  -5.31375e+00 0.00000e+00 0.00000e+00 3.49349e+02 336.874 1.05117e+02 336.874 0.9623 
1 1 1 7   14  10 f 0  1.43681e+01 9.28595e-01 2.07372e+02 83.743  1.46870e+00  1.33959e+01  0.00000e+00 0.00000e+00 3.13763e+02 83.743  1.06391e+02 83.743  0.9622 
1 1 1 7   14  11 f 0  1.42542e+01 1.05055e+00 9.28092e+01 211.813 -7.25795e+00 -4.50243e+00 0.00000e+00 0.00000e+00 4.11839e+02 211.813 3.19030e+02 211.813 0.9395 
1 1 1 7   14  12 o 8  1.52835e+01 1.14458e+00 2.34993e+02 53.003  1.70560e+01  2.26368e+01  0.00000e+00 0.00000e+00 3.30452e+02 53.003  9.54585e+01 53.003  0.9822 
1 1 1 7   14  13 o 17 1.35800e+01 1.49325e+00 3.27319e+02 227.239 -2.34558e+01 -2.53644e+01 0.00000e+00 0.00000e+00 1.76507e+02 227.239 1.50812e+02 47.239  0.9854 
1 1 1 7   14  14 o 7  7.66798e+00 1.84894e+00 1.36047e+02 98.267  -1.16655e+00 8.02880e+00  0.00000e+00 0.00000e+00 1.34076e+02 98.267  1.97108e+00 278.267 0.9362 
1 1 1 7   14  15 o 4  1.17668e+01 2.17437e+00 1.78225e+02 38.358  1.14557e+01  9.06604e+00  0.00000e+00 0.00000e+00 2.48858e+02 38.358  7.06339e+01 38.358  0.9651 
1 1 1 7   15  0  o 7  1.89777e+01 5.63127e-01 3.39611e+02 34.149  5.59794e+00  3.79711e+00  0.00000e+00 0.00000e+00 3.20692e+02 34.149  1.89197e+01 214.149 0.9228 
1 1 1 7   15  1  o 9  1.13084e+01 4.68500e-01 1.59432e+02 258.146 -3.85189e-01 -1.83514e+00 0.00000e+00 0.00000e+00 1.28940e+02 258.146 3.04918e+01 78.146  0.6762 
1 1 1 7   15  2  o 2  1.85783e+01 6.99324e-01 4.26867e+02 292.404 3.34061e+00  -8.10331e+00 0.00000e+00 0.00000e+00 2.32649e+02 292.404 1.94218e+02 112.404 0.9411 
1 1 1 7   15  3  o 11 1.62202e+01 5.18573e-01 4.51484e+02 302.664 4.70207e+00  -7.33448e+00 0.00000e+00 0.00000e+00 1.24168e+02 302.664 3.27316e+02 122.664 0.9407 
1 1 1 7   15  4  o 12 2.82298e+01 7.34783e-01 5.94386e+02 78.697  4.19079e+00  2.09679e+01  0.00000e+00 0.00000e+00 4.45473e+02 78.697  1.48913e+02 258.697 0.9763 
1 1 1 7   15  5  o 2  1.52855e+01 6.22859e-01 3.06279e+01 84.904  6.44539e-02  7.22761e-01  0.00000e+00 0.00000e+00 1.65946e+02 84.904  1.35318e+02 84.904  0.3409 
1 1 1 7   15  6  o 1  1.05104e+01 7.03429e-01 2.37442e+02 35.384  3.48368e+00  2.47423e+00  0.00000e+00 0.00000e+00 1.08822e+02 35.384  1.28620e+02 215.384 0.8733 
1 1 1 7   15  7  o 3  1.85810e+01 6.82051e-01 2.25044e+02 145.678 -8.29617e+00 5.66396e+00  0.00000e+00 0.00000e+00 4.40016e+02 145.678 2.14972e+02 145.678 0.9488 
1 1 1 7   15  8  o 4  2.99952e+01 7.74754e-01 4.61465e+02 309.753 2.51862e+01  -3.02797e+01 0.00000e+00 0.00000e+00 6.55371e+02 309.753 1.93906e+02 309.753 0.9872 
1 1 1 7   15  9  o 19 1.44268e+01 8.63204e-01 1.88626e+02 30.757  7.88507e+00  4.69238e+00  0.00000e+00 0.00000e+00 3.24806e+02 30.757  1.36180e+02 30.757  0.9438 
1 1 1 7   15  10 o 1  8.92419e+00 1.35425e+00 1.66376e+02 326.214 5.49597e+00  -3.67725e+00 0.00000e+00 0.00000e+00 1.43429e+02 326.214 2.29471e+01 146.214 0.9209 
1 1 1 7   15  11 o 14 1.92007e+01 9.65776e-01 2.71401e+02 343.585 3.29237e+01  -9.69958e+00 0.00000e+00 0.00000e+00 4.41501e+02 343.585 1.70100e+02 343.585 0.9853 
1 1 1 7   15  12 o 15 5.37022e+00 1.43579e+00 8.70594e+01 96.911  -3.98984e-01 3.29157e+00  0.00000e+00 0.00000e+00 8.10039e+01 96.911  6.05560e+00 276.911 0.8309 
1 1 1 7   15  13 f 0  9.45195e+00 1.68263e+00 1.24004e+02 57.801  4.63172e+00  7.35542e+00  0.00000e+00 0.00000e+00 2.10702e+02 57.801  8.66976e+01 57.801  0.9406 
1 1 1 7   15  14 o 3  6.07814e+00 1.65921e+00 1.32773e+02 309.922 4.46015e+00  -5.33009e+00 0.00000e+00 0.00000e+00 7.87732e+01 309.922 5.39997e+01 129.922 0.9250 
1 1 1 7   15  15 o 11 1.08805e+01 2.34064e+00 1.66077e+02 45.205  8.07315e+00  8.13122e+00  0.00000e+00 0.00000e+00 2.24800e+02 45.205  5.87228e+01 45.205  0.9553 
1 1 1 7   16  0  o 6  2.65702e+01 7.70865e-01 1.74893e+02 294.408 1.99298e+00  -4.39186e+00 0.00000e+00 0.00000e+00 7.15788e+02 294.408 5.40895e+02 294.408 0.8891 
1 1 1 7   16  1  o 10 2.65279e+01 5.87680e-01 4.21443e+02 261.247 -2.05062e+00 -1.33190e+01 0.00000e+00 0.00000e+00 5.41121e+02 261.247 1.19679e+02 261.247 0.9622 
1 1 1 7   16  2  o 2  2.79771e+01 8.27879e-01 5.16346e+02 313.964 1.09897e+01  -1.13946e+01 0.00000e+00 0.00000e+00 5.05044e+02 313.964 1.13019e+01 133.964 0.9679 
1 1 1 7   16  3  o 9  1.45366e+01 5.37819e-01 1.18457e+02 70.515  7.11415e-01  2.01069e+00  0.00000e+00 0.00000e+00 2.75517e+02 70.515  1.57060e+02 70.515  0.7184 
1 1 1 7   16  4  o 17 1.74444e+01 6.98304e-01 2.68915e+02 41.137  4.49403e+00  3.92553e+00  0.00000e+00 0.00000e+00 3.31193e+02 41.137  6.22782e+01 41.137  0.9118 
1 1 1 7   16  5  o 18 3.60799e+01 7.57003e-01 5.93400e+02 213.401 -2.74802e+01 -1.81208e+01 0.00000e+00 0.00000e+00 7.46954e+02 213.401 1.53554e+02 213.401 0.9847 
1 1 1 7   16  6  f 0  2.28730e+01 6.34454e-01 3.35592e+02 46.922  1.10136e+01  1.17783e+01  0.00000e+00 0.00000e+00 5.00097e+02 46.922  1.64505e+02 46.922  0.9685 
1 1 1 7   16  7  o 5  3.49763e+01 1.05814e+00 7.67498e+02 192.706 -6.10135e+01 -1.37566e+01 0.00000e+00 0.00000e+00 5.41249e+02 192.706 2.26249e+02 12.706  0.9920 
1 1 1 7   16  8  o 15 2.18695e+01 7.16092e-01 4.26444e+02 266.083 -1.81784e+00 -2.65502e+01 0.00000e+00 0.00000e+00 3.82700e+02 266.083 4.37436e+01 86.083  0.9810 
1 1 1 7   16  9  o 4  2.09349e+01 8.13725e-01 3.43388e+02 169.119 -2.71163e+01 5.21221e+00  0.00000e+00 0.00000e+00 4.31541e+02 169.119 8.81532e+01 169.119 0.9817 
1 1 1 7   16  10 f 0  1.75340e+01 8.72417e-01 1.75461e+02 51.825  9.29014e+00  1.18162e+01  0.00000e+00 0.00000e+00 4.63088e+02 51.825  2.87627e+02 51.825  0.9661 
1 1 1 7   16  11 o 2  1.35155e+01 1.02828e+00 2.74153e+02 67.460  9.20272e+00  2.21731e+01  0.00000e+00 0.00000e+00 2.24395e+02 67.460  4.97588e+01 247.460 0.9789 
1 1 1 7   16  12 o 8  1.79443e+01 1.00628e+00 2.77062e+02 279.856 7.00987e+00  -4.03479e+01 0.00000e+00 0.00000e+00 3.90500e+02 279.856 1.13438e+02 279.856 0.9877 
1 1 1 7   16  13 o 6  8.53551e+00 1.69273e+00 1.50813e+02 203.995 -8.67484e+00 -3.86146e+00 0.00000e+00 0.00000e+00 1.53096e+02 203.995 2.28328e+00 203.995 0.9458 
1 1 1 7   16  14 o 15 7.27212e+00 1.67123e+00 1.43461e+02 3.567   8.94523e+00  5.57622e-01  0.00000e+00 0.00000e+00 1.14411e+02 3.567   2.90509e+01 183.567 0.9424 
1 1 1 7   16  15 o 18 7.44181e+00 1.99833e+00 1.43864e+02 142.498 -6.56485e+00 5.03774e+00  0.00000e+00 0.00000e+00 1.18475e+02 142.498 2.53888e+01 322.498 0.9375 
1 1 1 7   17  0  o 17 1.05354e+01 5.18887e-01 1.89158e+02 141.143 -1.61150e+00 1.29831e+00  0.00000e+00 0.00000e+00 9.23961e+01 141.143 9.67619e+01 321.143 0.7089 
1 1 1 7   17  1  o 4  2.49086e+01 5.64986e-01 6.71827e+02 188.717 -1.98405e+01 -3.04189e+00 0.00000e+00 0.00000e+00 2.43785e+02 188.717 4.28042e+02 8.717   0.9748 
1 1 1 7   17  2  o 5  2.80340e+01 6.27934e-01 4.81244e+02 325.703 1.46769e+01  -1.00107e+01 0.00000e+00 0.00000e+00 5.45932e+02 325.703 6.46882e+01 325.703 0.9714 
1 1 1 7   17  3  o 16 1.53196e+01 5.13619e-01 3.16826e+02 262.499 -7.82255e-01 -5.94075e+00 0.00000e+00 0.00000e+00 2.10350e+02 262.499 1.06477e+02 82.499  0.9122 
1 1 1 7   17  4  o 19 3.30499e+01 8.62041e-01 6.79990e+02 104.474 -7.37454e+00 2.85697e+01  0.00000e+00 0.00000e+00 5.45512e+02 104.474 1.34478e+02 284.473 0.9829 
1 1 1 7   17  5  f 0  3.54173e+01 7.44884e-01 6.01496e+02 317.221 2.94833e+01  -2.72812e+01 0.00000e+00 0.00000e+00 7.17902e+02 317.221 1.16406e+02 317.221 0.9875 
1 1 1 7   17  6  o 3  2.40165e+01 8.37212e-01 2.94067e+02 241.220 -7.04378e+00 -1.28232e+01 0.00000e+00 0.00000e+00 5.80385e+02 241.220 2.86318e+02 241.220 0.9652 
1 1 1 7   17  7  o 6  1.00947e+01 8.27187e-01 2.41668e+02 22.809  5.33401e+00  2.24320e+00  0.00000e+00 0.00000e+00 1.04411e+02 22.809  1.37257e+02 202.809 0.9089 
1 1 1 7   17  8  o 4  1.59459e+01 8.00256e-01 1.39700e+02 202.149 -5.83603e+00 -2.37561e+00 0.00000e+00 0.00000e+00 4.11625e+02 202.149 2.71924e+02 202.149 0.9168 
1 1 1 7   17  9  o 1  3.15096e+01 9.71676e-01 3.08783e+02 265.856 -2.64239e+00 -3.64729e+01 0.00000e+00 0.00000e+00 8.62884e+02 265.856 5.54101e+02 265.856 0.9862 
1 1 1 7   17  10 o 3  2.02560e+01 8.40563e-01 3.05504e+02 314.829 2.29774e+01  -2.31149e+01 0.00000e+00 0.00000e+00 4.46188e+02 314.829 1.40684e+02 314.829 0.9845 
1 1 1 7   17  11 o 8  6.60847e+00 1.46262e+00 9.92289e+01 43.834  2.82898e+00  2.71610e+00  0.00000e+00 0.00000e+00 1.15021e+02 43.834  1.57925e+01 43.834  0.8604 
1 1 1 7   17  12 o 14 9.53685e+00 1.47995e+00 1.67756e+02 198.118 -1.05898e+01 -3.46492e+00 0.00000e+00 0.00000e+00 1.74911e+02 198.118 7.15515e+00 198.118 0.9540 
1 1 1 7   17  13 o 7  1.51115e+01 1.48033e+00 2.37053e+02 81.888  3.92630e+00  2.75446e+01  0.00000e+00 0.00000e+00 3.21499e+02 81.888  8.44455e+01 81.888  0.9819 
1 1 1 7   17  14 o 18 5.62127e+00 1.66480e+00 1.57542e+02 339.820 7.16311e+00  -2.63259e+00 0.00000e+00 0.00000e+00 3.95671e+01 339.820 1.17975e+02 159.821 0.9320 
1 1 1 7   17  15 o 13 7.93211e+00 2.22892e+00 1.36286e+02 256.876 -1.66125e+00 -7.12534e+00 0.00000e+00 0.00000e+00 1.40769e+02 256.876 4.48324e+00 256.876 0.9289 
1 1 1 7   18  0  o 13 3.23392e+01 7.46328e-01 7.96191e+02 320.689 2.38681e+01  -1.95434e+01 0.00000e+00 0.00000e+00 4.03047e+02 320.689 3.93144e+02 140.689 0.9837 
1 1 1 7   18  1  f 0  1.26597e+01 4.62618e-01 5.64890e+02 6.469   7.92789e+00  8.98952e-01  0.00000e+00 0.00000e+00 1.18513e+02 186.469 6.83403e+02 186.469 0.9351 
1 1 1 7   18  2  o 15 2.23289e+01 5.81517e-01 3.02097e+02 319.970 6.77771e+00  -5.69319e+00 0.00000e+00 0.00000e+00 4.90957e+02 319.970 1.88860e+02 319.970 0.9417 
1 1 1 7   18  3  o 9  3.25654e+01 9.07521e-01 7.21338e+02 340.304 2.68479e+01  -9.61088e+00 0.00000e+00 0.00000e+00 4.85324e+02 340.304 2.36014e+02 160.304 0.9823 
1 1 1 7   18  4  o 10 2.95954e+01 8.15582e-01 5.31443e+02 130.650 -1.34326e+01 1.56441e+01  0.00000e+00 0.00000e+00 5.57580e+02 130.650 2.61368e+01 130.650 0.9754 
1 1 1 7   18  5  o 19 2.62855e+01 6.44806e-01 4.37477e+02 326.246 1.80603e+01  -1.20694e+01 0.00000e+00 0.00000e+00 5.31008e+02 326.246 9.35312e+01 326.246 0.9767 
1 1 1 7   18  6  o 10 1.63298e+01 6.28060e-01 2.92152e+02 153.267 -8.92715e+00 4.49631e+00  0.00000e+00 0.00000e+00 2.92158e+02 153.267 6.26361e-03 153.267 0.9486 
1 1 1 7   18  7  o 15 1.56409e+01 6.65988e-01 2.83519e+02 172.743 -1.17550e+01 1.49697e+00  0.00000e+00 0.00000e+00 2.80946e+02 172.743 2.57254e+00 352.743 0.9568 
1 1 1 7   18  8  o 11 2.60449e+01 7.49540e-01 4.05731e+02 181.300 -3.37121e+01 -7.65344e-01 0.00000e+00 0.00000e+00 5.61767e+02 181.300 1.56035e+02 181.300 0.9851 
1 1 1 7   18  9  f 0  1.08320e+01 1.17040e+00 9.40052e+01 311.906 2.47746e+00  -2.76059e+00 0.00000e+00 0.00000e+00 2.53667e+02 311.906 1.59661e+02 311.906 0.8513 
1 1 1 7   18  10 o 2  6.29801e+00 1.31299e+00 1.05814e+02 291.089 1.14535e+00  -2.96993e+00 0.00000e+00 0.00000e+00 8.94651e+01 291.089 1.63494e+01 111.089 0.8227 
1 1 1 7   18  11 o 9  1.10445e+01 1.31992e+00 1.63196e+02 218.688 -8.79651e+00 -7.04444e+00 0.00000e+00 0.00000e+00 2.34013e+02 218.688 7.08167e+01 218.688 0.9545 
1 1 1 7   18  12 o 4  7.14651e+00 1.52305e+00 1.77137e+02 268.222 -2.68812e-01 -8.65790e+00 0.00000e+00 0.00000e+00 7.59597e+01 268.222 1.01177e+02 88.222  0.9404 
1 1 1 7   18  13 o 10 5.48308e+00 1.58999e+00 6.75055e+01 55.279  1.55924e+00  2.25010e+00  0.00000e+00 0.00000e+00 9.52492e+01 55.279  2.77436e+01 55.279  0.7885 
1 1 1 7   18  14 o 14 5.37164e+00 1.63482e+00 7.56778e+01 231.462 -2.21724e+00 -2.78363e+00 0.00000e+00 0.00000e+00 9.49135e+01 231.462 1.92356e+01 231.462 0.8441 
1 1 1 7   18  15 o 3  9.98920e+00 2.22559e+00 1.60288e+02 308.781 6.80466e+00  -8.46890e+00 0.00000e+00 0.00000e+00 1.97577e+02 308.781 3.72885e+01 308.781 0.9528 
1 1 1 7   19  0  o 14 1.37770e+01 5.05082e-01 3.16131e+02 257.477 -1.13228e+00 -5.09771e+00 0.00000e+00 0.00000e+00 1.50402e+02 257.477 1.65729e+02 77.477  0.8983 
1 1 1 7   19  1  o 1  9.78152e+00 5.01965e-01 2.06804e+02 128.576 -1.39844e+00 1.75331e+00  0.00000e+00 0.00000e+00 6.38674e+01 128.576 1.42937e+02 308.576 0.7339 
1 1 1 7   19  2  o 16 2.94997e+01 8.39017e-01 6.54229e+02 303.366 1.25920e+01  -1.91218e+01 0.00000e+00 0.00000e+00 4.33752e+02 303.366 2.20476e+02 123.366 0.9779 
1 1 1 7   19  3  o 8  3.73742e+01 1.00623e+00 2.96516e+02 35.987  1.15381e+01  8.37901e+00  0.00000e+00 0.00000e+00 1.06283e+03 35.987  7.66316e+02 35.987  0.9643 
1 1 1 7   19  4  o 4  1.65392e+01 6.75607e-01 3.47613e+02 353.507 7.77227e+00  -8.84560e-01 0.00000e+00 0.00000e+00 2.34908e+02 353.507 1.12705e+02 173.507 0.9337 
1 1 1 7   19  5  o 2  2.03269e+01 5.93404e-01 3.77897e+02 162.309 -1.38107e+01 4.40528e+00  0.00000e+00 0.00000e+00 3.61930e+02 162.309 1.59672e+01 342.309 0.9649 
1 1 1 7   19  6  o 18 3.68661e+01 9.90934e-01 6.50001e+02 359.787 4.89572e+01  -1.82124e-01 0.00000e+00 0.00000e+00 7.26302e+02 359.787 7.63010e+01 359.787 0.9897 
1 1 1 7   19  7  o 14 3.50824e+01 7.83352e-01 7.71207e+02 63.406  3.20331e+01  6.39866e+01  0.00000e+00 0.00000e+00 5.42664e+02 63.406  2.28544e+02 243.406 0.9930 
1 1 1 7   19  8  o 10 3.02025e+01 7.85257e-01 5.39028e+02 321.111 4.02209e+01  -3.24418e+01 0.00000e+00 0.00000e+00 5.88796e+02 321.111 4.97680e+01 321.111 0.9903 
1 1 1 7   19  9  o 5  9.43453e+00 1.06357e+00 1.73712e+02 208.430 -5.84001e+00 -3.16169e+00 0.00000e+00 0.00000e+00 1.53973e+02 208.430 1.97393e+01 28.430  0.9213 
1 1 1 7   19  10 o 3  2.17518e+01 8.30870e-01 3.80180e+02 232.322 -2.65724e+01 -3.44083e+01 0.00000e+00 0.00000e+00 4.30131e+02 232.322 4.99511e+01 232.322 0.9884 
1 1 1 7   19  11 o 4  7.09648e+00 1.34019e+00 1.04343e+02 319.186 3.50046e+00  -3.02302e+00 0.00000e+00 0.00000e+00 1.31975e+02 319.186 2.76325e+01 319.186 0.8839 
1 1 1 7   19  12 o 13 1.62820e+01 1.32394e+00 2.44792e+02 127.109 -1.77519e+01 2.34644e+01  0.00000e+00 0.00000e+00 3.57863e+02 127.109 1.13070e+02 127.109 0.9829 
1 1 1 7   19  13 o 17 7.24997e+00 1.68995e+00 1.28100e+02 48.914  4.31323e+00  4.94677e+00  0.00000e+00 0.00000e+00 1.23048e+02 48.914  5.05170e+00 228.914 0.9203 
1 1 1 7   19  14 o 13 1.14310e+01 2.13243e+00 1.55208e+02 320.205 9.28615e+00  -7.73546e+00 0.00000e+00 0.00000e+00 2.56638e+02 320.205 1.01430e+02 320.205 0.9577 
1 1 1 7   19  15 o 14 5.72215e+00 1.84224e+00 8.08805e+01 320.986 3.04388e+00  -2.46615e+00 0.00000e+00 0.00000e+00 1.04200e+02 320.986 2.33194e+01 320.986 0.8603 
1 1 1 7   20  0  o 4  3.52340e+01 7.96364e-01 7.73828e+02 136.639 -2.18709e+01 2.06542e+01  0.00000e+00 0.00000e+00 5.32065e+02 136.639 2.41764e+02 316.639 0.9832 
1 1 1 7   20  1  o 2  4.07555e+01 9.06593e-01 6.84479e+02 317.440 2.23908e+01  -2.05602e+01 0.00000e+00 0.00000e+00 8.26711e+02 317.440 1.42232e+02 317.440 0.9834 
1 1 1 7   20  2  o 1  2.22590e+01 5.52038e-01 3.14672e+02 138.412 -6.23711e+00 5.53527e+00  0.00000e+00 0.00000e+00 4.72693e+02 138.412 1.58021e+02 138.412 0.9380 
1 1 1 7   20  3  o 14 1.39762e+01 8.77262e-01 1.18635e+02 81.492  3.16312e-01  2.11445e+00  0.00000e+00 0.00000e+00 2.60474e+02 81.492  1.41839e+02 81.492  0.7192 
1 1 1 7   20  4  o 19 1.12155e+01 7.35178e-01 1.77476e+02 185.090 -2.68276e+00 -2.38981e-01 0.00000e+00 0.00000e+00 1.54396e+02 185.090 2.30801e+01 5.090   0.7845 
1 1 1 7   20  5  o 12 3.62117e+01 7.69165e-01 7.01353e+02 117.045 -2.01756e+01 3.95204e+01  0.00000e+00 0.00000e+00 6.49063e+02 117.045 5.22896e+01 297.045 0.9887 
1 1 1 7   20  6  o 3  2.22847e+01 6.35184e-01 4.95585e+02 227.097 -1.56736e+01 -1.68649e+01 0.00000e+00 0.00000e+00 3.26483e+02 227.097 1.69102e+02 47.097  0.9780 
1 1 1 7   20  7  o 2  4.85583e+00 1.11465e+00 1.18320e+02 272.647 6.66066e-02  -1.44052e+00 0.00000e+00 0.00000e+00 1.18331e+01 92.647  1.30153e+02 92.647  0.5815 
1 1 1 7   20  8  o 1  3.63348e+01 8.46568e-01 6.88507e+02 259.168 -1.43548e+01 -7.50211e+01 0.00000e+00 0.00000e+00 6.72564e+02 259.168 1.59432e+01 79.168  0.9934 
1 1 1 7   20  9  o 5  6.03116e+00 1.35825e+00 1.27687e+02 103.237 -6.76346e-01 2.87517e+00  0.00000e+00 0.00000e+00 5.56795e+01 103.237 7.20077e+01 283.237 0.8065 
1 1 1 7   20  10 o 3  1.92325e+01 8.77834e-01 3.06965e+02 2.369   3.37381e+01  1.39581e+00  0.00000e+00 0.00000e+00 4.07027e+02 2.369   1.00062e+02 2.369   0.9851 
1 1 1 7   20  11 o 8  9.59618e+00 1.34656e+00 2.46732e+02 183.516 -1.47152e+01 -9.04140e-01 0.00000e+00 0.00000e+00 1.02301e+02 183.516 1.44431e+02 3.516   0.9655 
1 1 1 7   20  12 o 7  1.00511e+01 1.65560e+00 1.20377e+02 28.782  6.87755e+00  3.77817e+00  0.00000e+00 0.00000e+00 2.33107e+02 28.782  1.12729e+02 28.782  0.9339 
1 1 1 7   20  13 o 4  4.98675e+00 1.54006e+00 9.58218e+01 334.975 3.46894e+00  -1.61943e+00 0.00000e+00 0.00000e+00 6.49557e+01 334.975 3.08661e+01 154.975 0.8566 
1 1 1 7   20  14 o 16 7.86691e+00 2.08594e+00 1.06479e+02 357.494 5.84568e+00  -2.55809e-01 0.00000e+00 0.00000e+00 1.62824e+02 357.494 5.63450e+01 357.494 0.9100 
1 1 1 7   20  15 o 11 9.35713e+00 2.17729e+00 1.76128e+02 172.845 -1.16186e+01 1.45853e+00  0.00000e+00 0.00000e+00 1.60288e+02 172.845 1.58398e+01 352.845 0.9563 
1 1 1 7   21  0  o 7  1.30442e+01 4.68934e-01 1.04476e+02 256.002 -3.64668e-01 -1.46287e+00 0.00000e+00 0.00000e+00 1.89555e+02 256.002 8.50787e+01 256.002 0.5980 
1 1 1 7   21  1  o 10 2.22176e+01 6.12593e-01 1.90184e+02 10.765  5.44689e+00  1.03564e+00  0.00000e+00 0.00000e+00 5.67607e+02 10.765  3.77423e+02 10.765  0.9046 
1 1 1 7   21  2  o 7  1.93734e+01 5.53576e-01 4.56339e+02 29.170  9.14101e+00  5.10246e+00  0.00000e+00 0.00000e+00 2.38409e+02 29.170  2.17930e+02 209.170 0.9510 
1 1 1 7   21  3  o 14 2.01352e+01 7.01303e-01 2.13322e+02 324.254 4.46286e+00  -3.21236e+00 0.00000e+00 0.00000e+00 4.73016e+02 324.254 2.59693e+02 324.254 0.9038 
1 1 1 7   21  4  o 17 1.74935e+01 5.52235e-01 3.78994e+02 254.071 -2.90917e+00 -1.01929e+01 0.00000e+00 0.00000e+00 2.48875e+02 254.071 1.30119e+02 74.071  0.9516 
1 1 1 7   21  5  f 0  2.75981e+01 7.34486e-01 4.97509e+02 160.372 -2.25583e+01 8.04483e+00  0.00000e+00 0.00000e+00 5.21456e+02 160.372 2.39467e+01 160.372 0.9789 
1 1 1 7   21  6  o 19 3.61753e+01 1.35633e+00 4.33137e+02 327.621 2.71721e+01  -1.72298e+01 0.00000e+00 0.00000e+00 9.09864e+02 327.621 4.76727e+02 327.621 0.9843 
1 1 1 7   21  7  f 0  2.22230e+01 6.90919e-01 3.26128e+02 56.949  1.02793e+01  1.57980e+01  0.00000e+00 0.00000e+00 4.89386e+02 56.949  1.63258e+02 56.949  0.9731 
1 1 1 7   21  8  o 15 2.09880e+01 7.47839e-01 4.92968e+02 251.546 -1.00698e+01 -3.01766e+01 0.00000e+00 0.00000e+00 2.85840e+02 251.546 2.07128e+02 71.546  0.9842 
1 1 1 7   21  9  o 12 1.74460e+01 8.48688e-01 3.78069e+02 33.137  2.29887e+01  1.50072e+01  0.00000e+00 0.00000e+00 2.67480e+02 33.137  1.10589e+02 213.137 0.9816 
1 1 1 7   21  10 o 17 2.46843e+01 8.53925e-01 4.67757e+02 226.029 -4.59719e+01 -4.76532e+01 0.00000e+00 0.00000e+00 4.55406e+02 226.029 1.23507e+01 46.029  0.9924 
1 1 1 7   21  11 o 12 1.45103e+01 1.06003e+00 3.30996e+02 101.532 -6.39453e+00 3.13419e+01  0.00000e+00 0.00000e+00 2.07005e+02 101.532 1.23991e+02 281.531 0.9842 
1 1 1 7   21  12 o 13 7.05229e+00 1.58512e+00 1.20402e+02 329.259 5.06923e+00  -3.01483e+00 0.00000e+00 0.00000e+00 1.21450e+02 329.259 1.04764e+00 329.259 0.9107 
1 1 1 7   21  13 o 14 1.17707e+01 1.61515e+00 2.03307e+02 22.476  1.70908e+01  7.07077e+00  0.00000e+00 0.00000e+00 2.27560e+02 22.476  2.42537e+01 22.476  0.9726 
1 1 1 7   21  14 o 6  5.88112e+00 1.79159e+00 1.06701e+02 191.046 -4.90889e+00 -9.58326e-01 0.00000e+00 0.00000e+00 9.09474e+01 191.046 1.57538e+01 11.046  0.8934 
1 1 1 7   21  15 o 3  6.39817e+00 2.00022e+00 1.75293e+02 104.939 -2.27852e+00 8.53997e+00  0.00000e+00 0.00000e+00 5.11932e+01 104.939 1.24100e+02 284.939 0.9416 
1 1 1 7   22  0  o 1  1.91451e+01 4.99585e-01 3.87323e+02 194.264 -9.48253e+00 -2.41065e+00 0.00000e+00 0.00000e+00 2.96341e+02 194.264 9.09825e+01 14.264  0.9474 
1 1 1 7   22  1  o 14 1.62956e+01 5.58964e-01 6.80436e+01 62.289  6.73707e-01  1.28260e+00  0.00000e+00 0.00000e+00 2.90255e+02 62.289  2.22211e+02 62.289  0.5832 
1 1 1 7   22  2  o 2  2.85005e+01 8.19115e-01 6.44872e+02 211.630 -1.91187e+01 -1.17757e+01 0.00000e+00 0.00000e+00 4.05607e+02 211.630 2.39265e+02 31.630  0.9775 
1 1 1 7   22  3  o 8  3.56243e+01 7.90630e-01 6.33561e+02 261.744 -4.11736e+00 -2.83769e+01 0.00000e+00 0.00000e+00 6.86285e+02 261.744 5.27235e+01 261.744 0.9824 
1 1 1 7   22  4  o 10 1.91576e+01 5.58970e-01 4.46138e+02 356.078 1.35679e+01  -9.30144e-01 0.00000e+00 0.00000e+00 2.49301e+02 356.078 1.96837e+02 176.078 0.9625 
1 1 1 7   22  5  o 14 4.23770e+01 1.05103e+00 4.89843e+02 223.209 -2.53075e+01 -2.37731e+01 0.00000e+00 0.00000e+00 1.08524e+03 223.209 5.95395e+02 223.209 0.9855 
1 1 1 7   22  6  o 13 3.43382e+01 7.36013e-01 6.21767e+02 32.250  3.89375e+01  2.45682e+01  0.00000e+00 0.00000e+00 6.59100e+02 32.250  3.73332e+01 32.250  0.9891 
1 1 1 7   22  7  o 17 1.43825e+01 7.23169e-01 8.85170e+01 282.997 7.81296e-01  -3.38482e+00 0.00000e+00 0.00000e+00 3.66907e+02 282.997 2.78390e+02 282.997 0.8397 
1 1 1 7   22  8  o 17 3.28952e+01 7.90912e-01 3.90020e+02 126.486 -2.41078e+01 3.25964e+01  0.00000e+00 0.00000e+00 8.34816e+02 126.486 4.44796e+02 126.486 0.9876 
1 1 1 7   22  9  o 5  1.11621e+01 9.89955e-01 1.87479e+02 144.946 -6.97281e+00 4.89224e+00  0.00000e+00 0.00000e+00 2.07730e+02 144.946 2.02512e+01 144.946 0.9393 
1 1 1 7   22  10 o 3  7.26408e+00 1.27216e+00 1.17647e+02 180.562 -4.31590e+00 -4.23454e-02 0.00000e+00 0.00000e+00 1.21772e+02 180.562 4.12460e+00 180.562 0.8747 
1 1 1 7   22  11 o 19 1.63078e+01 1.00077e+00 2.91686e+02 276.315 3.53213e+00  -3.19187e+01 0.00000e+00 0.00000e+00 3.12967e+02 276.315 2.12816e+01 276.315 0.9843 
1 1 1 7   22  12 o 8  1.53259e+01 1.28812e+00 2.59532e+02 1.445   3.10506e+01  7.83013e-01  0.00000e+00 0.00000e+00 3.08165e+02 1.445   4.86332e+01 1.445   0.9838 
1 1 1 7   22  13 o 12 6.94673e+00 1.67172e+00 1.25019e+02 215.755 -5.47821e+00 -3.94451e+00 0.00000e+00 0.00000e+00 1.16194e+02 215.755 8.82472e+00 35.755  0.9226 
1 1 1 7   22  14 o 9  1.15023e+01 2.04839e+00 2.57740e+02 26.665  1.83854e+01  9.23289e+00  0.00000e+00 0.00000e+00 1.64260e+02 26.665  9.34791e+01 206.665 0.9754 
1 1 1 7   22  15 o 8  4.66556e+00 1.61458e+00 3.62645e+01 229.490 -1.04464e+00 -1.22269e+00 0.00000e+00 0.00000e+00 7.27834e+01 229.490 3.65190e+01 229.490 0.6218 
1 1 1 7   23  0  o 6  2.73864e+01 6.33103e-01 3.93172e+02 251.496 -4.46423e+00 -1.33390e+01 0.00000e+00 0.00000e+00 6.01594e+02 251.496 2.08423e+02 251.496 0.9638 
1 1 1 7   23  1  o 17 1.97569e+01 6.53346e-01 2.07896e+02 201.218 -4.54271e+00 -1.76363e+00 0.00000e+00 0.00000e+00 4.55240e+02 201.218 2.47344e+02 201.218 0.8904 
1 1 1 7   23  2  o 6  2.75260e+01 5.92048e-01 5.05944e+02 92.088  -6.21373e-01 1.70446e+01  0.00000e+00 0.00000e+00 5.01033e+02 92.088  4.91070e+00 272.088 0.9702 
1 1 1 7   23  3  o 5  1.83134e+01 5.23906e-01 3.42715e+02 64.770  3.55691e+00  7.54841e+00  0.00000e+00 0.00000e+00 3.05081e+02 64.770  3.76344e+01 244.770 0.9380 
1 1 1 7   23  4  o 11 2.69989e+01 6.19148e-01 3.47591e+02 190.413 -1.43175e+01 -2.63113e+00 0.00000e+00 0.00000e+00 6.34994e+02 190.413 2.87403e+02 190.413 0.9650 
1 1 1 7   23  5  o 9  2.84968e+01 8.24703e-01 3.53038e+02 171.834 -1.68206e+01 2.41383e+00  0.00000e+00 0.00000e+00 6.89547e+02 171.834 3.36510e+02 171.834 0.9701 
1 1 1 7   23  6  o 3  2.15278e+01 6.39173e-01 2.85253e+02 3.800   1.35983e+01  9.03236e-01  0.00000e+00 0.00000e+00 4.96208e+02 3.800   2.10955e+02 3.800   0.9626 
1 1 1 7   23  7  o 12 2.00668e+01 6.80240e-01 3.47032e+02 308.527 1.18504e+01  -1.48835e+01 0.00000e+00 0.00000e+00 3.89459e+02 308.527 4.24264e+01 308.527 0.9734 
1 1 1 7   23  8  o 18 1.58762e+01 1.02514e+00 1.40632e+02 254.485 -1.83582e+00 -6.61299e+00 0.00000e+00 0.00000e+00 4.12396e+02 254.485 2.71764e+02 254.485 0.9240 
1 1 1 7   23  9  f 0  6.33379e+00 1.31910e+00 1.30866e+02 171.650 -3.24199e+00 4.75850e-01  0.00000e+00 0.00000e+00 6.69268e+01 171.650 6.39396e+01 351.650 0.8285 
1 1 1 7   23  10 o 19 2.03005e+01 8.47968e-01 2.73623e+02 22.343  2.83091e+01  1.16352e+01  0.00000e+00 0.00000e+00 4.78695e+02 22.343  2.05071e+02 22.343  0.9835 
1 1 1 7   23  11 o 14 5.56278e+00 1.35730e+00 1.47637e+02 182.943 -5.23506e+00 -2.69177e-01 0.00000e+00 0.00000e+00 4.06683e+01 182.943 1.06969e+02 2.943   0.8987 
1 1 1 7   23  12 o 16 8.83354e+00 1.52394e+00 1.15104e+02 235.913 -4.09156e+00 -6.04609e+00 0.00000e+00 0.00000e+00 1.93784e+02 235.913 7.86802e+01 235.913 0.9287 
1 1 1 7   23  13 o 12 7.46797e+00 1.66035e+00 1.16109e+02 43.499  4.91176e+00  4.66089e+00  0.00000e+00 0.00000e+00 1.43256e+02 43.499  2.71466e+01 43.499  0.9229 
1 1 1 7   23  14 o 5  9.73514e+00 2.10516e+00 1.14525e+02 174.293 -7.60288e+00 7.59798e-01  0.00000e+00 0.00000e+00 2.26755e+02 174.293 1.12230e+02 174.293 0.9321 
1 1 1 7   23  15 o 1  6.22684e+00 1.69729e+00 1.91465e+01 332.576 9.58301e-01  -4.97243e-01 0.00000e+00 0.00000e+00 9.17741e+01 332.576 7.26275e+01 332.576 0.4739 
1 1 1 7   24  0  o 19 1.25142e+01 4.80635e-01 2.89858e+02 245.510 -1.79502e+00 -3.94056e+00 0.00000e+00 0.00000e+00 1.22860e+02 245.510 1.66998e+02 65.510  0.8751 
1 1 1 7   24  1  o 1  3.57825e+01 6.84514e-01 7.49063e+02 27.977  2.91594e+01  1.54891e+01  0.00000e+00 0.00000e+00 5.79202e+02 27.977  1.69860e+02 207.977 0.9847 
1 1 1 7   24  2  o 15 2.50216e+01 5.67325e-01 5.65874e+02 51.569  1.14837e+01  1.44726e+01  0.00000e+00 0.00000e+00 3.51618e+02 51.569  2.14256e+02 231.569 0.9725 
1 1 1 7   24  3  o 15 3.28423e+01 8.45139e-01 4.70589e+02 240.582 -9.93678e+00 -1.76223e+01 0.00000e+00 0.00000e+00 7.36817e+02 240.582 2.66228e+02 240.582 0.9750 
1 1 1 7   24  4  o 3  2.31890e+01 1.00626e+00 6.86599e+02 335.469 2.19732e+01  -1.00282e+01 0.00000e+00 0.00000e+00 1.69568e+02 335.469 5.17031e+02 155.469 0.9791 
1 1 1 7   24  5  o 15 1.49728e+01 6.48524e-01 2.94992e+02 335.585 6.90733e+00  -3.13546e+00 0.00000e+00 0.00000e+00 2.30990e+02 335.585 6.40019e+01 155.585 0.9315 
1 1 1 7   24  6  o 15 1.60414e+01 7.44017e-01 2.90740e+02 308.836 7.11883e+00  -8.84255e+00 0.00000e+00 0.00000e+00 2.86868e+02 308.836 3.87243e+00 128.836 0.9549 
1 1 1 7   24  7  o 6  2.60161e+01 6.89835e-01 3.86836e+02 324.468 2.28830e+01  -1.63418e+01 0.00000e+00 0.00000e+00 5.76479e+02 324.468 1.89643e+02 324.468 0.9821 
1 1 1 7   24  8  o 1  1.17831e+01 8.63402e-01 1.47712e+02 91.548  -1.51777e-01 5.61706e+00  0.00000e+00 0.00000e+00 2.54730e+02 91.548  1.07019e+02 91.548  0.9060 
1 1 1 7   24  9  o 19 1.27025e+01 9.48404e-01 2.21960e+02 358.022 1.18589e+01  -4.09501e-01 0.00000e+00 0.00000e+00 2.36140e+02 358.022 1.41801e+01 358.022 0.9569 
1 1 1 7   24  10 o 1  1.75296e+01 9.00538e-01 2.77328e+02 264.743 -2.45071e+00 -2.66369e+01 0.00000e+00 0.00000e+00 3.70678e+02 264.743 9.33501e+01 264.743 0.9811 
1 1 1 7   24  11 o 6  1.18847e+01 1.44921e+00 1.95109e+02 215.274 -1.17033e+01 -8.27841e+00 0.00000e+00 0.00000e+00 2.36610e+02 215.274 4.15013e+01 215.274 0.9645 
1 1 1 7   24  12 o 8  8.17428e+00 1.64873e+00 1.55043e+02 223.773 -6.23211e+00 -5.97066e+00 0.00000e+00 0.00000e+00 1.34284e+02 223.773 2.07592e+01 43.773  0.9401 
1 1 1 7   24  13 o 19 6.61832e+00 1.81677e+00 4.52431e+01 286.732 6.44341e-01  -2.14329e+00 0.00000e+00 0.00000e+00 1.37368e+02 286.732 9.21245e+01 286.732 0.7332 
1 1 1 7   24  14 o 18 5.22893e+00 1.69398e+00 6.04559e+01 16.013  2.60538e+00  7.47724e-01  0.00000e+00 0.00000e+00 9.41332e+01 16.013  3.36773e+01 16.013  0.7861 
1 1 1 7   24  15 o 3  8.37713e+00 1.95691e+00 8.18145e+01 94.080  -4.04043e-01 5.66413e+00  0.00000e+00 0.00000e+00 2.03790e+02 94.080  1.21975e+02 94.080  0.9071 
1 1 1 7   25  0  o 19 4.18813e+01 7.68747e-01 1.03969e+03 195.234 -4.94297e+01 -1.34613e+01 0.00000e+00 0.00000e+00 5.23072e+02 195.234 5.16619e+02 15.234  0.9902 
1 1 1 7   25  1  o 7  9.11466e+00 4.97087e-01 1.82445e+02 169.111 -2.01057e+00 3.86779e-01  0.00000e+00 0.00000e+00 5.99073e+01 169.111 1.22538e+02 349.111 0.7054 
1 1 1 7   25  2  o 8  2.13893e+01 8.31981e-01 3.53390e+02 319.113 7.28182e+00  -6.30473e+00 0.00000e+00 0.00000e+00 4.09914e+02 319.113 5.65236e+01 319.113 0.9466 
1 1 1 7   25  3  o 3  2.78871e+01 6.06218e-01 5.25482e+02 63.682  8.84792e+00  1.78880e+01  0.00000e+00 0.00000e+00 4.99317e+02 63.682  2.61651e+01 243.682 0.9746 
1 1 1 7   25  4  o 4  3.32953e+01 6.86372e-01 6.05418e+02 163.385 -3.64501e+01 1.08764e+01  0.00000e+00 0.00000e+00 6.33461e+02 163.385 2.80427e+01 163.385 0.9868 
1 1 1 7   25  5  o 5  1.98136e+01 5.98826e-01 4.80565e+02 143.671 -1.61479e+01 1.18742e+01  0.00000e+00 0.00000e+00 2.47686e+02 143.671 2.32879e+02 323.671 0.9747 
1 1 1 7   25  6  o 18 3.34266e+01 8.01575e-01 6.66741e+02 180.537 -5.38616e+01 -5.04987e-01 0.00000e+00 0.00000e+00 5.81890e+02 180.537 8.48516e+01 0.537   0.9907 
1 1 1 7   25  7  o 8  6.48148e+00 1.10862e+00 1.00427e+02 257.105 -3.89497e-01 -1.70131e+00 0.00000e+00 0.00000e+00 5.87010e+01 257.105 4.17264e+01 77.105  0.6512 
1 1 1 7   25  8  o 1  1.03745e+01 9.86040e-01 2.39571e+02 200.860 -7.37777e+00 -2.81145e+00 0.00000e+00 0.00000e+00 1.25819e+02 200.860 1.13752e+02 20.860  0.9343 
1 1 1 7   25  9  o 4  1.15241e+01 9.98040e-01 1.55400e+02 266.295 -5.04632e-01 -7.79341e+00 0.00000e+00 0.00000e+00 2.50058e+02 266.295 9.46584e+01 266.295 0.9336 
1 1 1 7   25  10 o 1  1.37577e+01 9.72091e-01 3.10341e+02 177.188 -2.45805e+01 1.20742e+00  0.00000e+00 0.00000e+00 1.97337e+02 177.188 1.13004e+02 357.188 0.9795 
1 1 1 7   25  11 o 11 9.54987e+00 1.39469e+00 1.53574e+02 239.600 -4.98377e+00 -8.49460e+00 0.00000e+00 0.00000e+00 1.87308e+02 239.600 3.37341e+01 239.600 0.9478 
1 1 1 7   25  12 o 8  6.64426e+00 1.68155e+00 2.62313e+02 53.490  6.97039e+00  9.41659e+00  0.00000e+00 0.00000e+00 2.31117e+01 233.490 2.85425e+02 233.490 0.9563 
1 1 1 7   25  13 o 8  8.05239e+00 2.02789e+00 1.81890e+02 181.476 -9.81674e+00 -2.52946e-01 0.00000e+00 0.00000e+00 1.05232e+02 181.476 7.66581e+01 1.476   0.9476 
1 1 1 7   25  14 o 1  8.37037e+00 1.98241e+00 2.08538e+02 335.719 1.20061e+01  -5.41612e+00 0.00000e+00 0.00000e+00 9.40505e+01 335.719 1.14487e+02 155.719 0.9613 
1 1 1 7   25  15 o 8  5.31135e+00 1.63753e+00 8.40685e+01 260.198 -7.66457e-01 -4.43627e+00 0.00000e+00 0.00000e+00 9.16779e+01 260.198 7.60937e+00 260.198 0.8804 
1 1 1 7   26  0  o 7  2.22090e+01 5.16062e-01 2.41383e+02 192.653 -6.44349e+00 -1.44659e+00 0.00000e+00 0.00000e+00 5.29218e+02 192.653 2.87835e+02 192.653 0.9208 
1 1 1 7   26  1  o 1  2.07945e+01 5.00985e-01 3.74876e+02 195.180 -9.85584e+00 -2.67404e+00 0.00000e+00 0.00000e+00 3.69457e+02 195.180 5.41920e+00 15.180  0.9497 
1 1 1 7   26  2  o 14 3.29953e+01 7.41949e-01 4.94368e+02 0.916   2.07445e+01  3.31785e-01  0.00000e+00 0.00000e+00 7.19126e+02 0.916   2.24758e+02 0.916   0.9756 
1 1 1 7   26  3  o 14 3.48840e+01 6.88998e-01 5.34908e+02 124.844 -1.44167e+01 2.07089e+01  0.00000e+00 0.00000e+00 7.53980e+02 124.844 2.19072e+02 124.844 0.9800 
1 1 1 7   26  4  o 12 2.90642e+01 7.23322e-01 5.44949e+02 10.569  2.91962e+01  5.44748e+00  0.00000e+00 0.00000e+00 5.32313e+02 10.569  1.26361e+01 190.569 0.9830 
1 1 1 7   26  5  o 4  1.95027e+01 7.52032e-01 4.36587e+02 230.043 -1.13775e+01 -1.35799e+01 0.00000e+00 0.00000e+00 2.77706e+02 230.043 1.58881e+02 50.043  0.9714 
1 1 1 7   26  6  o 3  2.76085e+01 6.72976e-01 4.95054e+02 48.781  2.16298e+01  2.46907e+01  0.00000e+00 0.00000e+00 5.29902e+02 48.781  3.48471e+01 48.781  0.9846 
1 1 1 7   26  7  o 15 2.41130e+01 6.87228e-01 2.90940e+02 103.785 -5.02620e+00 2.04869e+01  0.00000e+00 0.00000e+00 5.96285e+02 103.785 3.05345e+02 103.785 0.9760 
1 1 1 7   26  8  o 4  1.57679e+01 8.33603e-01 2.80861e+02 197.278 -1.47386e+01 -4.58439e+00 0.00000e+00 0.00000e+00 2.93883e+02 197.278 1.30223e+01 197.278 0.9670 
1 1 1 7   26  9  o 9  1.71648e+01 8.19714e-01 2.73163e+02 330.041 1.91867e+01  -1.10592e+01 0.00000e+00 0.00000e+00 3.58892e+02 330.041 8.57284e+01 330.041 0.9772 
1 1 1 7   26  10 o 6  1.10278e+01 1.13730e+00 2.16798e+02 246.775 -5.22479e+00 -1.21754e+01 0.00000e+00 0.00000e+00 1.82644e+02 246.775 3.41535e+01 66.775  0.9615 
1 1 1 7   26  11 o 13 9.60115e+00 1.53852e+00 1.82153e+02 76.402  2.61636e+00  1.08164e+01  0.00000e+00 0.00000e+00 1.62765e+02 76.402  1.93881e+01 256.402 0.9540 
1 1 1 7   26  12 o 3  6.35457e+00 1.65112e+00 8.05898e+01 206.087 -3.12805e+00 -1.53155e+00 0.00000e+00 0.00000e+00 1.20391e+02 206.087 3.98009e+01 206.087 0.8402 
1 1 1 7   26  13 o 2  4.70022e+00 1.54837e+00 7.02627e+01 56.209  1.61938e+00  2.41983e+00  0.00000e+00 0.00000e+00 7.17860e+01 56.209  1.52326e+00 56.209  0.8032 
1 1 1 7   26  14 o 11 5.50352e+00 1.74868e+00 6.79637e+01 0.730   3.17532e+00  4.04574e-02  0.00000e+00 0.00000e+00 1.02190e+02 0.730   3.42262e+01 0.730   0.8222 
1 1 1 7   26  15 o 14 4.73813e+00 1.55635e+00 2.88320e+01 156.785 -1.26523e+00 5.42665e-01  0.00000e+00 0.00000e+00 7.16229e+01 156.785 4.27909e+01 156.785 0.5641 
1 1 1 7   27  0  o 18 2.62790e+01 7.04883e-01 2.35310e+02 251.385 -2.57183e+00 -7.63563e+00 0.00000e+00 0.00000e+00 6.91185e+02 251.385 4.55875e+02 251.385 0.9357 
1 1 1 7   27  1  o 19 2.34810e+01 5.32962e-01 6.12637e+02 324.368 1.52252e+01  -1.09131e+01 0.00000e+00 0.00000e+00 2.48356e+02 324.368 3.64282e+02 144.368 0.9729 
1 1 1 7   27  2  o 18 3.70572e+01 7.09827e-01 6.89383e+02 95.765  -3.38737e+00 3.35515e+01  0.00000e+00 0.00000e+00 6.86621e+02 95.765  2.76168e+00 275.765 0.9851 
1 1 1 7   27  3  o 14 1.05976e+01 6.32811e-01 1.50426e+02 139.967 -1.93789e+00 1.62800e+00  0.00000e+00 0.00000e+00 1.56541e+02 139.967 6.11508e+00 139.967 0.7683 
1 1 1 7   27  4  o 10 1.11769e+01 5.93873e-01 2.23088e+02 253.832 -1.22090e+00 -4.21103e+00 0.00000e+00 0.00000e+00 1.46405e+02 253.832 7.66833e+01 73.832  0.8768 
1 1 1 7   27  5  o 5  4.77707e+01 8.98706e-01 8.74603e+02 190.411 -8.45451e+01 -1.55336e+01 0.00000e+00 0.00000e+00 9.15979e+02 190.411 4.13758e+01 190.411 0.9942 
1 1 1 7   27  6  o 11 2.95704e+01 6.88515e-01 5.86356e+02 252.598 -1.24128e+01 -3.96036e+01 0.00000e+00 0.00000e+00 5.14954e+02 252.598 7.14023e+01 72.598  0.9879 
1 1 1 7   27  7  o 9  2.16404e+01 6.78356e-01 3.84852e+02 1.164   2.38643e+01  4.84938e-01  0.00000e+00 0.00000e+00 4.13636e+02 1.164   2.87835e+01 1.164   0.9788 
1 1 1 7   27  8  o 19 7.92869e+00 1.22161e+00 1.73979e+02 262.354 -5.92182e-01 -4.41096e+00 0.00000e+00 0.00000e+00 8.86507e+01 262.354 8.53283e+01 82.354  0.8789 
1 1 1 7   27  9  o 12 1.22409e+01 9.89024e-01 2.48951e+02 255.325 -3.54237e+00 -1.35272e+01 0.00000e+00 0.00000e+00 1.95483e+02 255.325 5.34673e+01 75.325  0.9636 
1 1 1 7   27  10 o 5  9.90359e+00 1.17643e+00 1.84701e+02 79.691  1.82998e+00  1.00608e+01  0.00000e+00 0.00000e+00 1.69624e+02 79.691  1.50762e+01 259.691 0.9498 
1 1 1 7   27  11 o 6  1.30297e+01 1.28714e+00 2.62721e+02 107.542 -6.84321e+00 2.16481e+01  0.00000e+00 0.00000e+00 2.16995e+02 107.542 4.57260e+01 287.542 0.9777 
1 1 1 7   27  12 o 18 1.15919e+01 1.59088e+00 2.13386e+02 159.505 -1.73864e+01 6.49869e+00  0.00000e+00 0.00000e+00 2.11014e+02 159.505 2.37181e+00 339.505 0.9727 
1 1 1 7   27  13 o 7  8.83114e+00 2.04042e+00 9.48106e+01 96.012  -5.97324e-01 5.67191e+00  0.00000e+00 0.00000e+00 2.06698e+02 96.012  1.11888e+02 96.012  0.9075 
1 1 1 7   27  14 o 12 9.71938e+00 2.19088e+00 9.13939e+01 275.789 5.94894e-01  -5.86783e+00 0.00000e+00 0.00000e+00 2.41451e+02 275.789 1.50057e+02 275.789 0.9107 
1 1 1 7   27  15 o 10 6.56914e+00 1.82685e+00 1.45681e+02 305.307 4.74690e+00  -6.70253e+00 0.00000e+00 0.00000e+00 8.56242e+01 305.307 6.00569e+01 125.307 0.9370 
1 1 1 7   28  0  o 15 2.60337e+01 6.21252e-01 6.64399e+02 240.619 -1.10270e+01 -1.95851e+01 0.00000e+00 0.00000e+00 2.94362e+02 240.619 3.70037e+02 60.619  0.9775 
1 1 1 7   28  1  o 12 2.88190e+01 8.34678e-01 4.05671e+02 241.755 -7.02272e+00 -1.30727e+01 0.00000e+00 0.00000e+00 6.43118e+02 241.755 2.37448e+02 241.755 0.9657 
1 1 1 7   28  2  o 15 3.01303e+01 6.92935e-01 5.09024e+02 27.982  1.84342e+01  9.79436e+00  0.00000e+00 0.00000e+00 5.99110e+02 27.982  9.00855e+01 27.982  0.9757 
1 1 1 7   28  3  o 5  3.15499e+01 9.45172e-01 4.02351e+02 12.288  1.89462e+01  4.12688e+00  0.00000e+00 0.00000e+00 7.55902e+02 12.288  3.53552e+02 12.288  0.9739 
1 1 1 7   28  4  o 3  3.77833e+01 9.49585e-01 5.75695e+02 199.069 -3.46427e+01 -1.19752e+01 0.00000e+00 0.00000e+00 8.29156e+02 199.069 2.53460e+02 199.069 0.9863 
1 1 1 7   28  5  o 7  1.94157e+01 1.02056e+00 3.04998e+02 13.680  1.16936e+01  2.84621e+00  0.00000e+00 0.00000e+00 3.95871e+02 13.680  9.08739e+01 13.680  0.9575 
1 1 1 7   28  6  o 10 1.33100e+01 6.91882e-01 1.25764e+02 94.067  -3.16285e-01 4.44822e+00  0.00000e+00 0.00000e+00 3.15345e+02 94.067  1.89581e+02 94.067  0.8791 
1 1 1 7   28  7  o 8  3.95422e+01 8.31898e-01 7.10117e+02 343.150 7.58220e+01  -2.29635e+01 0.00000e+00 0.00000e+00 7.70934e+02 343.150 6.08169e+01 343.150 0.9937 
1 1 1 7   28  8  o 13 5.20088e+00 1.18791e+00 2.40371e+02 200.064 -3.79868e+00 -1.38741e+00 0.00000e+00 0.00000e+00 7.07885e+01 20.064  3.11160e+02 20.064  0.8652 
1 1 1 7   28  9  o 14 1.55074e+01 8.85575e-01 1.69815e+02 15.868  1.15569e+01  3.28500e+00  0.00000e+00 0.00000e+00 3.89603e+02 15.868  2.19788e+02 15.868  0.9574 
1 1 1 7   28  10 o 9  1.33664e+01 1.03243e+00 2.88379e+02 267.092 -1.12841e+00 -2.22158e+01 0.00000e+00 0.00000e+00 2.03638e+02 267.092 8.47407e+01 87.092  0.9773 
1 1 1 7   28  11 o 12 1.44165e+01 1.24870e+00 3.02426e+02 96.078  -3.33570e+00 3.13264e+01  0.00000e+00 0.00000e+00 2.31715e+02 96.078  7.07103e+01 276.078 0.9840 
1 1 1 7   28  12 o 19 1.13249e+01 1.53280e+00 2.52818e+02 236.224 -1.21041e+01 -1.80973e+01 0.00000e+00 0.00000e+00 1.63516e+02 236.224 8.93016e+01 56.224  0.9768 
1 1 1 7   28  13 o 18 6.95044e+00 1.97464e+00 1.23166e+02 173.343 -5.99135e+00 6.99278e-01  0.00000e+00 0.00000e+00 1.15518e+02 173.343 7.64753e+00 353.343 0.9129 
1 1 1 7   28  14 o 7  3.81037e+00 1.30144e+00 7.94744e+01 194.789 -3.13410e+00 -8.27414e-01 0.00000e+00 0.00000e+00 3.89152e+01 194.789 4.05592e+01 14.789  0.8264 
1 1 1 7   28  15 o 1  5.11909e+00 1.63058e+00 8.28304e+01 5.486   4.32717e+00  4.15594e-01  0.00000e+00 0.00000e+00 8.56069e+01 5.486   2.77651e+00 5.486   0.8757 
1 1 1 7   29  0  o 13 3.17961e+01 7.98711e-01 3.17037e+02 148.143 -1.08859e+01 6.76457e+00  0.00000e+00 0.00000e+00 8.33079e+02 148.143 5.16042e+02 148.143 0.9602 
1 1 1 7   29  1  o 7  3.47616e+01 7.49708e-01 5.72567e+02 317.936 1.94973e+01  -1.75946e+01 0.00000e+00 0.00000e+00 7.12138e+02 317.936 1.39572e+02 317.936 0.9808 
1 1 1 7   29  2  o 14 2.56626e+01 6.77435e-01 2.64470e+02 35.704  7.46812e+00  5.36712e+00  0.00000e+00 0.00000e+00 6.48529e+02 35.704  3.84060e+02 35.704  0.9440 
1 1 1 7   29  3  o 3  3.02931e+01 7.65324e-01 5.40446e+02 204.018 -2.29337e+01 -1.02196e+01 0.00000e+00 0.00000e+00 5.78450e+02 204.018 3.80032e+01 204.018 0.9799 
1 1 1 7   29  4  o 15 6.45142e+00 9.26596e-01 2.44706e+02 25.262  2.39777e+00  1.13146e+00  0.00000e+00 0.00000e+00 5.48905e+01 205.262 2.99597e+02 205.262 0.7805 
1 1 1 7   29  5  o 18 3.55204e+01 1.21415e+00 2.75419e+02 157.277 -1.87651e+01 7.85849e+00  0.00000e+00 0.00000e+00 1.03026e+03 157.277 7.54837e+02 157.277 0.9751 
1 1 1 7   29  6  o 2  2.55737e+01 6.60068e-01 5.33272e+02 291.752 1.31840e+01  -3.30417e+01 0.00000e+00 0.00000e+00 4.17081e+02 291.752 1.16191e+02 111.752 0.9858 
1 1 1 7   29  7  o 6  7.52112e+00 1.15749e+00 1.44723e+02 179.304 -3.31458e+00 4.02797e-02  0.00000e+00 0.00000e+00 9.07922e+01 179.304 5.39305e+01 359.304 0.8308 
1 1 1 7   29  8  o 5  2.29806e+01 7.48397e-01 4.30958e+02 164.822 -3.69426e+01 1.00215e+01  0.00000e+00 0.00000e+00 4.23654e+02 164.822 7.30324e+00 344.822 0.9868 
1 1 1 7   29  9  o 16 1.15711e+01 1.04451e+00 9.62797e+01 178.044 -5.29149e+00 1.80673e-01  0.00000e+00 0.00000e+00 2.95978e+02 178.044 1.99698e+02 178.044 0.8998 
1 1 1 7   29  10 o 17 1.23594e+01 1.23655e+00 1.47258e+02 321.773 8.52354e+00  -6.71393e+00 0.00000e+00 0.00000e+00 2.96246e+02 321.773 1.48988e+02 321.773 0.9527 
1 1 1 7   29  11 o 14 1.09249e+01 1.40394e+00 1.90751e+02 208.639 -1.24913e+01 -6.82154e+00 0.00000e+00 0.00000e+00 2.05849e+02 208.639 1.50975e+01 208.639 0.9642 
1 1 1 7   29  12 o 17 5.27945e+00 1.60568e+00 8.36030e+01 123.126 -1.77375e+00 2.71820e+00  0.00000e+00 0.00000e+00 8.06392e+01 123.126 2.96381e+00 303.126 0.8266 
1 1 1 7   29  13 f 0  1.31772e+01 1.86432e+00 2.12449e+02 268.515 -5.23268e-01 -2.01923e+01 0.00000e+00 0.00000e+00 2.70799e+02 268.515 5.83499e+01 268.515 0.9749 
1 1 1 7   29  14 o 10 1.18843e+01 1.58978e+00 1.87432e+02 78.004  4.61483e+00  2.17177e+01  0.00000e+00 0.00000e+00 2.49188e+02 78.004  6.17561e+01 78.004  0.9772 
1 1 1 7   29  15 o 11 6.01147e+00 1.80608e+00 1.12179e+02 255.410 -1.50688e+00 -5.78897e+00 0.00000e+00 0.00000e+00 9.38318e+01 255.410 1.83470e+01 75.410  0.9121 
1 1 1 7   30  0  o 5  2.28609e+01 5.94896e-01 3.99082e+02 160.211 -1.13865e+01 4.09696e+00  0.00000e+00 0.00000e+00 4.25688e+02 160.211 2.66061e+01 160.211 0.9577 
1 1 1 7   30  1  f 0  2.58281e+01 7.06845e-01 6.88908e+02 181.456 -2.33714e+01 -5.94002e-01 0.00000e+00 0.00000e+00 2.63225e+02 181.456 4.25684e+02 1.456   0.9784 
1 1 1 7   30  2  o 2  1.43795e+01 4.94270e-01 4.20664e+02 260.324 -1.62429e+00 -9.52632e+00 0.00000e+00 0.00000e+00 9.23898e+01 260.324 3.28274e+02 80.324  0.9468 
1 1 1 7   30  3  o 7  3.09909e+01 8.35454e-01 5.02552e+02 30.049  2.51772e+01  1.45647e+01  0.00000e+00 0.00000e+00 6.45268e+02 30.049  1.42716e+02 30.049  0.9827 
1 1 1 7   30  4  o 17 1.93054e+01 6.15066e-01 3.58509e+02 93.334  -6.91760e-01 1.18741e+01  0.00000e+00 0.00000e+00 3.37886e+02 93.334  2.06230e+01 273.334 0.9570 
1 1 1 7   30  5  o 3  2.22909e+01 7.94921e-01 4.51494e+02 246.023 -8.99276e+00 -2.02196e+01 0.00000e+00 0.00000e+00 3.69529e+02 246.023 8.19652e+01 66.023  0.9771 
1 1 1 7   30  6  o 17 1.05211e+01 8.08098e-01 2.05673e+02 164.954 -5.38277e+00 1.44693e+00  0.00000e+00 0.00000e+00 1.53286e+02 164.954 5.23864e+01 344.954 0.9052 
1 1 1 7   30  7  o 2  2.16656e+01 6.87320e-01 3.90691e+02 191.515 -2.56816e+01 -5.23200e+00 0.00000e+00 0.00000e+00 4.10101e+02 191.515 1.94104e+01 191.515 0.9807 
1 1 1 7   30  8  o 15 8.02363e+00 1.19211e+00 1.79384e+02 332.796 5.08046e+00  -2.61143e+00 0.00000e+00 0.00000e+00 9.50310e+01 332.796 8.43530e+01 152.796 0.9076 
1 1 1 7   30  9  o 7  1.86444e+01 8.16260e-01 2.93380e+02 12.340  2.63074e+01  5.75529e+00  0.00000e+00 0.00000e+00 3.95825e+02 12.340  1.02445e+02 12.340  0.9813 
1 1 1 7   30  10 o 14 8.96665e+00 1.46010e+00 1.62970e+02 186.768 -8.32269e+00 -9.87783e-01 0.00000e+00 0.00000e+00 1.53883e+02 186.768 9.08681e+00 6.769   0.9383 
1 1 1 7   30  11 o 12 3.99062e+00 1.28937e+00 8.83219e+01 118.812 -1.22099e+00 2.21984e+00  0.00000e+00 0.00000e+00 2.71475e+01 118.812 6.11744e+01 298.812 0.7686 
1 1 1 7   30  12 o 19 8.37769e+00 1.62329e+00 1.21065e+02 189.906 -7.52316e+00 -1.31387e+00 0.00000e+00 0.00000e+00 1.72768e+02 189.906 5.17036e+01 189.906 0.9320 
1 1 1 7   30  13 o 14 5.78884e+00 1.76325e+00 4.98822e+01 95.320  -2.15170e-01 2.31073e+00  0.00000e+00 0.00000e+00 1.12116e+02 95.320  6.22334e+01 95.320  0.7440 
1 1 1 7   30  14 o 9  4.13064e+00 1.35059e+00 1.08140e+02 168.899 -5.02924e+00 9.86743e-01  0.00000e+00 0.00000e+00 3.10245e+01 168.899 7.71159e+01 348.899 0.8962 
1 1 1 7   30  15 o 19 5.01837e+00 1.59527e+00 3.29522e+01 254.465 -4.45780e-01 -1.60364e+00 0.00000e+00 0.00000e+00 8.66269e+01 254.465 5.36747e+01 254.465 0.6342 
1 1 1 7   31  0  o 7  4.11954e+01 8.55376e-01 9.22516e+02 355.410 4.94800e+01  -3.97250e+00 0.00000e+00 0.00000e+00 6.13458e+02 355.410 3.09057e+02 175.410 0.9899 
1 1 1 7   31  1  o 1  3.24689e+01 8.17418e-01 3.57539e+02 288.616 4.99577e+00  -1.48305e+01 0.00000e+00 0.00000e+00 8.26001e+02 288.616 4.68462e+02 288.616 0.9675 
1 1 1 7   31  2  o 16 2.07533e+01 6.49894e-01 1.98437e+02 69.520  2.23289e+00  5.97846e+00  0.00000e+00 0.00000e+00 5.19414e+02 69.520  3.20977e+02 69.520  0.9179 
1 1 1 7   31  3  o 10 1.61967e+01 7.62501e-01 3.41787e+02 232.374 -5.90583e+00 -7.66181e+00 0.00000e+00 0.00000e+00 2.36165e+02 232.374 1.05622e+02 52.374  0.9468 
1 1 1 7   31  4  o 11 2.16152e+01 5.78524e-01 4.00226e+02 274.438 1.40805e+00  -1.81408e+01 0.00000e+00 0.00000e+00 3.91749e+02 274.438 8.47643e+00 94.438  0.9721 
1 1 1 7   31  5  o 16 3.53735e+01 9.37030e-01 4.97370e+02 72.203  1.28870e+01  4.01462e+01  0.00000e+00 0.00000e+00 8.19978e+02 72.203  3.22608e+02 72.203  0.9881 
1 1 1 7   31  6  o 18 2.23476e+01 6.49432e-01 2.03564e+02 218.899 -9.69275e+00 -7.82075e+00 0.00000e+00 0.00000e+00 6.04133e+02 218.899 4.00570e+02 218.899 0.9590 
1 1 1 7   31  7  o 14 1.49941e+01 7.27939e-01 3.82513e+02 171.548 -1.74528e+01 2.59330e+00  0.00000e+00 0.00000e+00 1.66278e+02 171.548 2.16234e+02 351.548 0.9712 
1 1 1 7   31  8  o 17 1.12853e+01 1.18687e+00 1.54178e+02 1.962   6.88682e+00  2.35885e-01  0.00000e+00 0.00000e+00 2.38834e+02 1.962   8.46563e+01 1.962   0.9243 
1 1 1 7   31  9  o 5  9.83935e+00 1.15038e+00 1.27375e+02 255.715 -1.53141e+00 -6.01471e+00 0.00000e+00 0.00000e+00 2.11926e+02 255.715 8.45508e+01 255.715 0.9155 
1 1 1 7   31  10 o 14 1.45192e+01 1.12583e+00 2.85557e+02 183.660 -2.74568e+01 -1.75611e+00 0.00000e+00 0.00000e+00 2.51172e+02 183.660 3.43846e+01 3.660   0.9817 
1 1 1 7   31  11 f 0  5.76630e+00 1.51192e+00 1.27085e+02 264.321 -4.99606e-01 -5.02380e+00 0.00000e+00 0.00000e+00 6.70808e+01 264.321 6.00042e+01 84.321  0.8945 
1 1 1 7   31  12 o 3  4.64078e+00 1.49815e+00 1.47105e+02 258.966 -1.01444e+00 -5.20234e+00 0.00000e+00 0.00000e+00 1.00409e+01 258.966 1.37064e+02 78.966  0.8999 
1 1 1 7   31  13 o 1  1.21346e+01 1.88675e+00 1.78728e+02 269.451 -1.56297e-01 -1.63037e+01 0.00000e+00 0.00000e+00 2.63431e+02 269.451 8.47023e+01 269.451 0.9688 
1 1 1 7   31  14 o 6  1.01510e+01 1.75351e+00 2.16591e+02 102.312 -4.17594e+00 1.91326e+01  0.00000e+00 0.00000e+00 1.55109e+02 102.312 6.14821e+01 282.312 0.9741 
1 1 1 7   31  15 o 18 5.12227e+00 1.62519e+00 1.00631e+02 172.316 -5.30404e+00 7.15615e-01  0.00000e+00 0.00000e+00 7.27382e+01 172.316 2.78925e+01 352.316 0.9010 
1 1 1 7   32  0  o 19 3.67515e+01 6.99046e-01 4.73593e+02 157.269 -2.17317e+01 9.10458e+00  0.00000e+00 0.00000e+00 8.80886e+02 157.269 4.07293e+02 157.269 0.9785 
1 1 1 7   32  1  o 5  3.36824e+01 7.54260e-01 5.07144e+02 309.408 1.71545e+01  -2.08785e+01 0.00000e+00 0.00000e+00 7.38054e+02 309.408 2.30910e+02 309.408 0.9813 
1 1 1 7   32  2  o 10 2.42020e+01 5.56154e-01 3.95809e+02 77.755  3.14133e+00  1.44746e+01  0.00000e+00 0.00000e+00 4.84776e+02 77.755  8.89671e+01 77.755  0.9656 
1 1 1 7   32  3  o 5  2.39131e+01 9.20040e-01 3.02965e+02 7.164   1.21429e+01  1.52621e+00  0.00000e+00 0.00000e+00 5.60552e+02 7.164   2.57588e+02 7.164   0.9582 
1 1 1 7   32  4  o 1  2.90689e+01 7.32406e-01 4.80841e+02 150.400 -2.52933e+01 1.43687e+01  0.00000e+00 0.00000e+00 5.95688e+02 150.400 1.14847e+02 150.400 0.9827 
1 1 1 7   32  5  o 19 3.40449e+01 9.27943e-01 6.41494e+02 26.414  4.67328e+01  2.32124e+01  0.00000e+00 0.00000e+00 6.29218e+02 26.414  1.22756e+01 206.414 0.9904 
1 1 1 7   32  6  o 18 1.94358e+01 6.46812e-01 3.96937e+02 233.125 -1.29650e+01 -1.72836e+01 0.00000e+00 0.00000e+00 3.18354e+02 233.125 7.85828e+01 53.125  0.9766 
1 1 1 7   32  7  o 10 3.32898e+00 1.02225e+00 2.83538e+02 266.791 -1.62511e-01 -2.89851e+00 0.00000e+00 0.00000e+00 1.82865e+02 86.791  4.66403e+02 86.791  0.8026 
1 1 1 7   32  8  o 2  2.13867e+01 7.56851e-01 3.87189e+02 143.750 -2.80880e+01 2.05953e+01  0.00000e+00 0.00000e+00 4.06892e+02 143.750 1.97028e+01 143.750 0.9855 
1 1 1 7   32  9  o 13 1.95671e+01 7.80790e-01 4.54514e+02 337.486 4.78181e+01  -1.98202e+01 0.00000e+00 0.00000e+00 2.75339e+02 337.486 1.79176e+02 157.486 0.9903 
1 1 1 7   32  10 o 11 1.17818e+01 1.36990e+00 2.17536e+02 56.531  8.69600e+00  1.31535e+01  0.00000e+00 0.00000e+00 2.11795e+02 56.531  5.74068e+00 236.531 0.9678 
1 1 1 7   32  11 o 15 9.31845e+00 1.48925e+00 1.11724e+02 295.108 3.06412e+00  -6.53882e+00 0.00000e+00 0.00000e+00 2.13748e+02 295.108 1.02025e+02 295.108 0.9279 
1 1 1 7   32  12 o 11 1.56253e+01 1.57073e+00 3.81430e+02 1.879   4.47308e+01  1.46725e+00  0.00000e+00 0.00000e+00 1.99868e+02 1.879   1.81562e+02 181.879 0.9888 
1 1 1 7   32  13 o 2  4.22005e+00 1.43190e+00 8.67501e+01 171.166 -3.35145e+00 5.20877e-01  0.00000e+00 0.00000e+00 4.58046e+01 171.166 4.09455e+01 351.166 0.8352 
1 1 1 7   32  14 o 17 8.91151e+00 1.82948e+00 1.26053e+02 142.737 -7.64261e+00 5.81422e+00  0.00000e+00 0.00000e+00 1.90947e+02 142.737 6.48943e+01 142.737 0.9464 
1 1 1 7   32  15 o 11 1.77510e+01 1.52274e+00 2.26607e+02 62.654  2.04237e+01  3.94917e+01  0.00000e+00 0.00000e+00 4.32647e+02 62.654  2.06040e+02 62.654  0.9887 
1 1 1 7   33  0  o 18 3.65794e+01 8.82841e-01 4.76644e+02 81.468  4.06424e+00  2.70902e+01  0.00000e+00 0.00000e+00 8.75545e+02 81.468  3.98901e+02 81.468  0.9816 
1 1 1 7   33  1  o 11 3.46817e+01 7.58376e-01 6.42662e+02 72.715  1.02118e+01  3.28157e+01  0.00000e+00 0.00000e+00 6.44624e+02 72.715  1.96231e+00 72.715  0.9853 
1 1 1 7   33  2  o 14 1.88357e+01 5.17978e-01 2.77251e+02 126.565 -5.89723e+00 7.95088e+00  0.00000e+00 0.00000e+00 3.95552e+02 126.565 1.18301e+02 126.565 0.9481 
1 1 1 7   33  3  o 18 8.60656e+00 6.20342e-01 1.56800e+02 228.196 -1.53376e+00 -1.71518e+00 0.00000e+00 0.00000e+00 8.36707e+01 228.196 7.31298e+01 48.196  0.7415 
1 1 1 7   33  4  o 7  2.99689e+01 6.56369e-01 5.91752e+02 356.121 3.68300e+01  -2.49694e+00 0.00000e+00 0.00000e+00 5.22189e+02 356.121 6.95636e+01 176.121 0.9864 
1 1 1 7   33  5  o 11 1.64671e+01 9.39479e-01 1.04826e+02 87.278  1.92772e-01  4.05429e+00  0.00000e+00 0.00000e+00 4.32412e+02 87.278  3.27586e+02 87.278  0.8657 
1 1 1 7   33  6  o 16 1.35121e+01 7.16117e-01 2.32935e+02 123.007 -5.15062e+00 7.92906e+00  0.00000e+00 0.00000e+00 2.48499e+02 123.007 1.55641e+01 123.007 0.9455 
1 1 1 7   33  7  o 16 1.30316e+01 8.18453e-01 2.59225e+02 147.093 -9.19118e+00 5.94766e+00  0.00000e+00 0.00000e+00 2.08786e+02 147.093 5.04386e+01 327.093 0.9532 
1 1 1 7   33  8  o 2  1.21308e+01 9.33980e-01 1.89637e+02 115.318 -4.15781e+00 8.78859e+00  0.00000e+00 0.00000e+00 2.43165e+02 115.318 5.35275e+01 115.318 0.9471 
1 1 1 7   33  9  o 9  1.01209e+01 1.36280e+00 2.86058e+02 224.610 -1.01879e+01 -1.00500e+01 0.00000e+00 0.00000e+00 8.15477e+01 224.610 2.04510e+02 44.610  0.9644 
1 1 1 7   33  10 o 5  1.09468e+01 1.32621e+00 2.25561e+02 96.187  -1.66760e+00 1.53818e+01  0.00000e+00 0.00000e+00 1.73047e+02 96.187  5.25144e+01 276.187 0.9671 
1 1 1 7   33  11 o 6  1.38278e+01 1.11826e+00 1.93648e+02 139.343 -1.61125e+01 1.38378e+01  0.00000e+00 0.00000e+00 3.14390e+02 139.343 1.20742e+02 139.343 0.9762 
1 1 1 7   33  12 o 1  6.89892e+00 1.79486e+00 1.59138e+02 261.862 -1.09202e+00 -7.63710e+00 0.00000e+00 0.00000e+00 8.29528e+01 261.862 7.61848e+01 81.863  0.9327 
1 1 1 7   33  13 o 12 5.90022e+00 1.65566e+00 1.47191e+02 195.793 -7.21291e+00 -2.04014e+00 0.00000e+00 0.00000e+00 5.92994e+01 195.793 8.78912e+01 15.793  0.9307 
1 1 1 7   33  14 f 0  4.14930e+00 1.37164e+00 1.21823e+02 131.982 -3.77629e+00 4.19671e+00  0.00000e+00 0.00000e+00 1.95355e+01 131.982 1.02288e+02 311.982 0.9065 
1 1 1 7   33  15 o 11 4.62688e+00 1.51621e+00 3.20720e+01 167.833 -1.63338e+00 3.52164e-01  0.00000e+00 0.00000e+00 7.83929e+01 167.833 4.63208e+01 167.833 0.6356 
1 1 1 7   34  0  o 14 2.62963e+01 5.70082e-01 5.80214e+02 345.739 2.29513e+01  -5.83342e+00 0.00000e+00 0.00000e+00 3.88871e+02 345.739 1.91343e+02 165.739 0.9787 
1 1 1 7   34  1  o 12 3.24779e+01 6.78185e-01 6.36895e+02 148.545 -2.71406e+01 1.66023e+01  0.00000e+00 0.00000e+00 5.67029e+02 148.545 6.98663e+01 328.545 0.9842 
1 1 1 7   34  2  o 18 4.01566e+01 7.59412e-01 6.83750e+02 328.139 4.07241e+01  -2.53097e+01 0.00000e+00 0.00000e+00 8.13208e+02 328.139 1.29458e+02 328.139 0.9895 
1 1 1 7   34  3  o 15 1.98997e+01 5.46335e-01 2.61379e+02 207.056 -7.97690e+00 -4.07431e+00 0.00000e+00 0.00000e+00 4.45218e+02 207.056 1.83839e+02 207.056 0.9424 
1 1 1 7   34  4  f 0  2.67444e+01 7.06244e-01 5.75196e+02 194.337 -3.22150e+01 -8.23344e+00 0.00000e+00 0.00000e+00 4.17271e+02 194.337 1.57925e+02 14.337  0.9848 
1 1 1 7   34  5  o 11 2.50051e+01 7.95974e-01 4.71497e+02 238.276 -1.63875e+01 -2.65084e+01 0.00000e+00 0.00000e+00 4.55471e+02 238.276 1.60264e+01 58.276  0.9838 
1 1 1 7   34  6  o 15 1.92736e+01 6.62852e-01 3.69629e+02 274.022 1.50132e+00  -2.13510e+01 0.00000e+00 0.00000e+00 3.39402e+02 274.022 3.02272e+01 94.022  0.9764 
1 1 1 7   34  7  o 13 1.61798e+01 7.43792e-01 2.50366e+02 146.977 -1.19616e+01 7.77468e+00  0.00000e+00 0.00000e+00 3.37429e+02 146.977 8.70639e+01 146.977 0.9643 
1 1 1 7   34  8  o 2  2.51315e+01 7.40858e-01 2.70833e+02 356.938 3.08216e+01  -1.64897e+00 0.00000e+00 0.00000e+00 6.60347e+02 356.938 3.89514e+02 356.938 0.9837 
1 1 1 7   34  9  o 16 7.25128e+00 1.51779e+00 1.60830e+02 282.772 1.21993e+00  -5.38153e+00 0.00000e+00 0.00000e+00 8.60710e+01 282.772 7.47594e+01 102.772 0.9042 
1 1 1 7   34  10 o 7  1.63786e+01 1.08366e+00 2.80487e+02 105.049 -7.88504e+00 2.93260e+01  0.00000e+00 0.00000e+00 3.25889e+02 105.049 4.54015e+01 105.049 0.9834 
1 1 1 7   34  11 o 11 1.52266e+01 1.32447e+00 3.29534e+02 292.898 1.43935e+01  -3.40782e+01 0.00000e+00 0.00000e+00 2.35705e+02 292.898 9.38295e+01 112.898 0.9864 
1 1 1 7   34  12 o 5  8.74353e+00 1.87674e+00 1.82085e+02 339.226 9.66853e+00  -3.66772e+00 0.00000e+00 0.00000e+00 1.30498e+02 339.226 5.15865e+01 159.226 0.9503 
1 1 1 7   34  13 o 12 3.49583e+00 1.16995e+00 8.01198e+01 72.665  9.30873e-01  2.98227e+00  0.00000e+00 0.00000e+00 2.75011e+01 72.665  5.26187e+01 252.665 0.8188 
1 1 1 7   34  14 o 13 1.44114e+01 1.42759e+00 2.37689e+02 61.364  1.76529e+01  3.23290e+01  0.00000e+00 0.00000e+00 2.96482e+02 61.364  5.87924e+01 61.364  0.9863 
1 1 1 7   34  15 o 9  1.35413e+01 1.76785e+00 1.43102e+02 314.091 1.29140e+01  -1.33305e+01 0.00000e+00 0.00000e+00 3.51570e+02 314.091 2.08467e+02 314.091 0.9727 
1 1 1 7   35  0  o 15 3.38431e+01 6.65894e-01 5.75701e+02 109.288 -9.89489e+00 2.82745e+01  0.00000e+00 0.00000e+00 6.77131e+02 109.288 1.01430e+02 109.288 0.9832 
1 1 1 7   35  1  o 4  3.20841e+01 7.20963e-01 5.26697e+02 205.080 -2.87193e+01 -1.34407e+01 0.00000e+00 0.00000e+00 6.62452e+02 205.080 1.35755e+02 205.080 0.9841 
1 1 1 7   35  2  o 11 1.86997e+01 5.30323e-01 3.71984e+02 312.881 8.13125e+00  -8.75596e+00 0.00000e+00 0.00000e+00 3.02271e+02 312.881 6.97129e+01 132.881 0.9572 
1 1 1 7   35  3  o 17 2.14905e+01 5.72468e-01 4.33288e+02 39.227  1.51578e+01  1.23744e+01  0.00000e+00 0.00000e+00 3.55384e+02 39.227  7.79040e+01 219.227 0.9741 
1 1 1 7   35  4  o 14 1.62991e+01 5.79935e-01 2.33953e+02 103.524 -1.98324e+00 8.24567e+00  0.00000e+00 0.00000e+00 3.42716e+02 103.524 1.08763e+02 103.524 0.9390 
1 1 1 7   35  5  o 5  3.06409e+01 8.76385e-01 4.72764e+02 216.165 -2.99986e+01 -2.19280e+01 0.00000e+00 0.00000e+00 6.66056e+02 216.165 1.93292e+02 216.165 0.9865 
1 1 1 7   35  6  o 13 2.62651e+01 6.89092e-01 5.37497e+02 250.294 -1.35831e+01 -3.79234e+01 0.00000e+00 0.00000e+00 4.39682e+02 250.294 9.78149e+01 70.294  0.9875 
1 1 1 7   35  7  o 8  8.60272e+00 1.06640e+00 2.10018e+02 7.572   6.04924e+00  8.04099e-01  0.00000e+00 0.00000e+00 8.61573e+01 7.572   1.23861e+02 187.572 0.9139 
1 1 1 7   35  8  o 9  2.20298e+01 7.41039e-01 3.62109e+02 131.158 -2.37177e+01 2.71327e+01  0.00000e+00 0.00000e+00 4.56029e+02 131.158 9.39205e+01 131.158 0.9860 
1 1 1 7   35  9  o 9  1.85674e+01 1.01417e+00 3.60650e+02 153.690 -3.22680e+01 1.59550e+01  0.00000e+00 0.00000e+00 3.28729e+02 153.690 3.19216e+01 333.690 0.9860 
1 1 1 7   35  10 f 0  1.20927e+01 1.24245e+00 2.80378e+02 37.857  1.77166e+01  1.37707e+01  0.00000e+00 0.00000e+00 1.64575e+02 37.857  1.15803e+02 217.857 0.9775 
1 1 1 7   35  11 o 14 8.92829e+00 1.78923e+00 1.74783e+02 104.376 -2.46714e+00 9.62582e+00  0.00000e+00 0.00000e+00 1.43810e+02 104.376 3.09735e+01 284.376 0.9483 
1 1 1 7   35  12 o 17 5.92959e+00 1.73678e+00 9.75668e+01 354.923 4.20733e+00  -3.73756e-01 0.00000e+00 0.00000e+00 9.68365e+01 354.923 7.30270e-01 174.923 0.8716 
1 1 1 7   35  13 o 14 3.74723e+00 1.25487e+00 6.80927e+01 75.090  7.22472e-01  2.71337e+00  0.00000e+00 0.00000e+00 4.38692e+01 75.090  2.42235e+01 255.090 0.7947 
1 1 1 7   35  14 o 3  8.31786e+00 1.78513e+00 2.11658e+02 278.291 2.22223e+00  -1.52503e+01 0.00000e+00 0.00000e+00 9.05781e+01 278.291 1.21080e+02 98.291  0.9670 
1 1 1 7   35  15 o 9  4.70119e+00 1.53693e+00 5.62434e+01 104.362 -7.01683e-01 2.74033e+00  0.00000e+00 0.00000e+00 8.43719e+01 104.362 2.81285e+01 104.362 0.7965 
1 1 1 7   36  0  o 3  4.85099e+01 8.73477e-01 8.23128e+02 355.593 7.39895e+01  -5.70260e+00 0.00000e+00 0.00000e+00 9.90879e+02 355.593 1.67751e+02 355.593 0.9932 
1 1 1 7   36  1  o 11 2.49868e+01 5.60341e-01 3.41826e+02 341.208 1.42217e+01  -4.83928e+00 0.00000e+00 0.00000e+00 5.67261e+02 341.208 2.25435e+02 341.208 0.9661 
1 1 1 7   36  2  o 16 2.12281e+01 6.03337e-01 6.21425e+02 172.458 -2.25090e+01 2.98034e+00  0.00000e+00 0.00000e+00 1.60335e+02 172.458 4.61089e+02 352.457 0.9777 
1 1 1 7   36  3  o 11 3.68111e+01 1.34491e+00 4.88723e+02 229.664 -2.30483e+01 -2.71435e+01 0.00000e+00 0.00000e+00 8.78362e+02 229.664 3.89639e+02 229.664 0.9859 
1 1 1 7   36  4  o 15 1.48317e+01 5.78865e-01 3.26548e+02 243.438 -5.31233e+00 -1.06259e+01 0.00000e+00 0.00000e+00 2.08148e+02 243.438 1.18400e+02 63.438  0.9569 
1 1 1 7   36  5  o 2  3.05428e+01 7.04019e-01 5.29711e+02 199.020 -4.17766e+01 -1.44014e+01 0.00000e+00 0.00000e+00 6.07848e+02 199.020 7.81366e+01 199.020 0.9886 
1 1 1 7   36  6  o 11 1.24202e+01 7.38185e-01 2.87609e+02 265.482 -8.96909e-01 -1.13505e+01 0.00000e+00 0.00000e+00 1.59232e+02 265.482 1.28376e+02 85.482  0.9550 
1 1 1 7   36  7  o 14 2.03359e+01 7.44915e-01 3.77239e+02 99.628  -4.37606e+00 2.57960e+01  0.00000e+00 0.00000e+00 3.73970e+02 99.628  3.26838e+00 279.628 0.9807 
1 1 1 7   36  8  o 19 1.89053e+01 9.17441e-01 3.35010e+02 322.518 2.33296e+01  -1.78895e+01 0.00000e+00 0.00000e+00 3.64756e+02 322.518 2.97466e+01 322.518 0.9828 
1 1 1 7   36  9  o 4  1.24722e+01 1.13094e+00 2.68415e+02 144.042 -1.50423e+01 1.09119e+01  0.00000e+00 0.00000e+00 1.88369e+02 144.042 8.00454e+01 324.042 0.9727 
1 1 1 7   36  10 o 14 1.19638e+01 1.30953e+00 1.74401e+02 54.754  7.78535e+00  1.10175e+01  0.00000e+00 0.00000e+00 2.58894e+02 54.754  8.44925e+01 54.754  0.9622 
1 1 1 7   36  11 f 0  6.55693e+00 1.69877e+00 1.40230e+01 76.176  1.46540e-01  5.95533e-01  0.00000e+00 0.00000e+00 5.82845e+01 76.176  4.42615e+01 76.176  0.2931 
1 1 1 7   36  12 o 13 5.72723e+00 1.66471e+00 1.33629e+02 85.128  5.06996e-01  5.94841e+00  0.00000e+00 0.00000e+00 6.27979e+01 85.128  7.08314e+01 265.128 0.9119 
1 1 1 7   36  13 o 18 1.60791e+01 1.23816e+00 2.53421e+02 13.071  4.40118e+01  1.02187e+01  0.00000e+00 0.00000e+00 3.44312e+02 13.071  9.08904e+01 13.071  0.9889 
1 1 1 7   36  14 o 9  6.15222e+00 1.68432e+00 8.22131e+01 283.353 1.08527e+00  -4.57199e+00 0.00000e+00 0.00000e+00 1.22566e+02 283.353 4.03532e+01 283.353 0.8859 
1 1 1 7   36  15 o 12 5.64717e+00 1.68365e+00 8.37531e+01 172.820 -4.81620e+00 6.06748e-01  0.00000e+00 0.00000e+00 1.04948e+02 172.820 2.11947e+01 172.820 0.8899 
1 1 1 7   37  0  o 7  6.29194e+01 1.24308e+00 9.88723e+02 201.508 -9.76987e+01 -3.85008e+01 0.00000e+00 0.00000e+00 1.36859e+03 201.508 3.79869e+02 201.508 0.9952 
1 1 1 7   37  1  o 2  3.18156e+01 6.43844e-01 5.19071e+02 84.845  2.53323e+00  2.80799e+01  0.00000e+00 0.00000e+00 6.57498e+02 84.845  1.38427e+02 84.845  0.9821 
1 1 1 7   37  2  o 15 3.63068e+01 1.14794e+00 3.03246e+02 37.662  1.45109e+01  1.11999e+01  0.00000e+00 0.00000e+00 1.02630e+03 37.662  7.23056e+02 37.662  0.9723 
1 1 1 7   37  3  o 17 3.49837e+01 7.10107e-01 4.98888e+02 9.318   3.72949e+01  6.11945e+00  0.00000e+00 0.00000e+00 8.01285e+02 9.318   3.02397e+02 9.318   0.9867 
1 1 1 7   37  4  o 4  1.95766e+01 5.87234e-01 4.19681e+02 185.748 -1.97146e+01 -1.98437e+00 0.00000e+00 0.00000e+00 2.98902e+02 185.748 1.20779e+02 5.748   0.9744 
1 1 1 7   37  5  o 8  2.46243e+01 7.38818e-01 4.27950e+02 91.141  -5.69773e-01 2.86152e+01  0.00000e+00 0.00000e+00 4.83287e+02 91.141  5.53371e+01 91.141  0.9824 
1 1 1 7   37  6  o 7  1.10695e+01 7.83699e-01 1.64790e+02 43.973  4.02436e+00  3.88258e+00  0.00000e+00 0.00000e+00 2.12774e+02 43.973  4.79838e+01 43.973  0.9055 
1 1 1 7   37  7  o 4  9.28344e+00 1.04488e+00 8.32801e+01 45.604  2.00979e+00  2.05259e+00  0.00000e+00 0.00000e+00 1.96476e+02 45.604  1.13196e+02 45.604  0.8001 
1 1 1 7   37  8  o 6  1.61442e+01 7.68003e-01 3.80780e+02 53.728  1.68530e+01  2.29661e+01  0.00000e+00 0.00000e+00 2.16391e+02 53.728  1.64389e+02 233.728 0.9823 
1 1 1 7   37  9  o 7  2.26095e+01 9.50227e-01 3.09064e+02 254.419 -1.10446e+01 -3.96079e+01 0.00000e+00 0.00000e+00 5.31717e+02 254.419 2.22653e+02 254.419 0.9878 
1 1 1 7   37  10 o 3  1.53184e+01 1.16438e+00 2.62475e+02 44.603  2.07230e+01  2.04376e+01  0.00000e+00 0.00000e+00 3.04062e+02 44.603  4.15867e+01 44.603  0.9827 
1 1 1 7   37  11 o 7  8.29053e+00 1.74819e+00 5.65515e+01 117.338 -1.40695e+00 2.72154e+00  0.00000e+00 0.00000e+00 1.97530e+02 117.338 1.40979e+02 117.338 0.8146 
1 1 1 7   37  12 o 8  6.45836e+00 1.57340e+00 1.31527e+02 352.336 7.12057e+00  -9.58150e-01 0.00000e+00 0.00000e+00 9.37546e+01 352.336 3.77723e+01 172.336 0.9275 
1 1 1 7   37  13 o 18 4.64075e+00 1.43734e+00 1.81145e+01 255.227 -2.06006e-01 -7.81217e-01 0.00000e+00 0.00000e+00 4.71658e+01 255.227 2.90512e+01 255.227 0.3742 
1 1 1 7   37  14 o 17 5.32019e+00 1.56998e+00 9.95484e+01 284.799 1.38054e+00  -5.22549e+00 0.00000e+00 0.00000e+00 8.07353e+01 284.799 1.88131e+01 104.799 0.9020 
1 1 1 7   37  15 o 9  4.85574e+00 1.56496e+00 7.36855e+01 116.210 -1.80249e+00 3.66148e+00  0.00000e+00 0.00000e+00 8.43018e+01 116.210 1.06162e+01 116.210 0.8666 
1 1 1 7   38  0  o 19 2.05164e+01 5.27181e-01 4.93441e+02 326.478 1.44520e+01  -9.57343e+00 0.00000e+00 0.00000e+00 2.56211e+02 326.478 2.37230e+02 146.478 0.9707 
1 1 1 7   38  1  o 17 2.96030e+01 7.88603e-01 5.54669e+02 77.479  6.06868e+00  2.73269e+01  0.00000e+00 0.00000e+00 5.39818e+02 77.479  1.48511e+01 257.479 0.9820 
1 1 1 7   38  2  o 12 2.65482e+01 5.99692e-01 4.83923e+02 25.507  2.42775e+01  1.15834e+01  0.00000e+00 0.00000e+00 4.97070e+02 25.507  1.31472e+01 25.507  0.9812 
1 1 1 7   38  3  o 10 1.58410e+01 5.95392e-01 2.54291e+02 153.609 -8.03104e+00 3.98505e+00  0.00000e+00 0.00000e+00 3.08000e+02 153.609 5.37086e+01 153.609 0.9425 
1 1 1 7   38  4  o 4  2.00433e+01 6.12830e-01 3.07136e+02 174.449 -1.64232e+01 1.59598e+00  0.00000e+00 0.00000e+00 4.24561e+02 174.449 1.17425e+02 174.449 0.9692 
1 1 1 7   38  5  f 0  1.18949e+01 7.21941e-01 4.45250e+02 211.662 -1.25268e+01 -7.72519e+00 0.00000e+00 0.00000e+00 1.27202e+01 31.662  4.57971e+02 31.662  0.9654 
1 1 1 7   38  6  o 5  1.82078e+01 6.73137e-01 2.92229e+02 89.370  1.86453e-01  1.69611e+01  0.00000e+00 0.00000e+00 3.73011e+02 89.370  8.07820e+01 89.370  0.9701 
1 1 1 7   38  7  o 7  7.62798e+00 1.01444e+00 1.94288e+02 114.300 -2.48767e+00 5.50963e+00  0.00000e+00 0.00000e+00 6.80020e+01 114.300 1.26286e+02 294.300 0.9131 
1 1 1 7   38  8  o 5  1.34370e+01 9.88533e-01 2.63282e+02 267.028 -8.78754e-01 -1.69239e+01 0.00000e+00 0.00000e+00 2.27497e+02 267.028 3.57844e+01 87.028  0.9700 
1 1 1 7   38  9  o 18 7.08680e+00 1.50095e+00 2.07716e+02 305.149 4.67642e+00  -6.64168e+00 0.00000e+00 0.00000e+00 4.20524e+01 305.149 1.65664e+02 125.149 0.9363 
1 1 1 7   38  10 o 15 6.19830e+00 1.47177e+00 1.14568e+02 278.297 6.38423e-01  -4.37783e+00 0.00000e+00 0.00000e+00 9.02469e+01 278.297 2.43207e+01 98.297  0.8781 
1 1 1 7   38  11 o 11 9.37655e+00 1.76399e+00 1.20385e+02 65.269  3.05970e+00  6.64274e+00  0.00000e+00 0.00000e+00 2.07265e+02 65.269  8.68800e+01 65.269  0.9289 
1 1 1 7   38  12 o 4  6.22499e+00 1.39810e+00 1.22713e+02 81.849  9.97623e-01  6.96481e+00  0.00000e+00 0.00000e+00 9.40289e+01 81.849  2.86842e+01 261.849 0.9259 
1 1 1 7   38  13 o 2  7.48610e+00 1.63801e+00 7.75944e+01 168.707 -5.03695e+00 1.00585e+00  0.00000e+00 0.00000e+00 1.74637e+02 168.707 9.70430e+01 168.707 0.8965 
1 1 1 7   38  14 o 2  6.10974e+00 1.55794e+00 4.31656e+01 78.627  5.10584e-01  2.53848e+00  0.00000e+00 0.00000e+00 1.34562e+02 78.627  9.13960e+01 78.627  0.7744 
1 1 1 7   38  15 o 18 8.17098e+00 2.03489e+00 1.05921e+02 120.456 -3.57107e+00 6.07307e+00  0.00000e+00 0.00000e+00 1.78145e+02 120.456 7.22238e+01 120.456 0.9260 
1 1 1 7   39  0  o 12 3.50704e+01 6.82924e-01 7.33361e+02 134.252 -3.07222e+01 3.15350e+01  0.00000e+00 0.00000e+00 5.71520e+02 134.252 1.61841e+02 314.252 0.9886 
1 1 1 7   39  1  o 8  4.72598e+01 1.03084e+00 7.54909e+02 329.644 6.29026e+01  -3.68398e+01 0.00000e+00 0.00000e+00 1.01203e+03 329.644 2.57124e+02 329.644 0.9931 
1 1 1 7   39  2  o 1  1.82817e+01 7.12185e-01 1.26110e+02 105.257 -1.25889e+00 4.61535e+00  0.00000e+00 0.00000e+00 4.85254e+02 105.257 3.59144e+02 105.257 0.8881 
1 1 1 7   39  3  f 0  9.97106e+00 8.50450e-01 9.85847e+01 219.319 -1.65990e+00 -1.35955e+00 0.00000e+00 0.00000e+00 1.71886e+02 219.319 7.33008e+01 219.319 0.7203 
1 1 1 7   39  4  o 7  2.03577e+01 6.01624e-01 4.28504e+02 103.359 -5.38583e+00 2.26795e+01  0.00000e+00 0.00000e+00 3.21567e+02 103.359 1.06937e+02 283.359 0.9783 
1 1 1 7   39  5  o 8  1.31853e+01 7.05529e-01 2.08845e+02 73.668  2.31989e+00  7.91675e+00  0.00000e+00 0.00000e+00 2.56589e+02 73.668  4.77443e+01 73.668  0.9373 
1 1 1 7   39  6  o 13 8.91467e+00 9.71691e-01 1.09556e+02 318.931 2.34726e+00  -2.04541e+00 0.00000e+00 0.00000e+00 1.65077e+02 318.931 5.55214e+01 318.931 0.8180 
1 1 1 7   39  7  o 12 2.91188e+01 7.41821e-01 2.79493e+02 332.908 3.05309e+01  -1.56181e+01 0.00000e+00 0.00000e+00 8.00881e+02 332.908 5.21388e+02 332.908 0.9853 
1 1 1 7   39  8  o 16 1.47357e+01 1.05189e+00 2.55808e+02 152.647 -1.69235e+01 8.75455e+00  0.00000e+00 0.00000e+00 2.84214e+02 152.647 2.84060e+01 152.647 0.9734 
1 1 1 7   39  9  o 18 2.53329e+01 9.43085e-01 4.46791e+02 157.627 -6.93339e+01 2.85398e+01  0.00000e+00 0.00000e+00 5.00356e+02 157.627 5.35645e+01 157.627 0.9933 
1 1 1 7   39  10 o 1  4.88577e+00 1.41392e+00 4.27366e+01 64.756  6.06156e-01  1.28556e+00  0.00000e+00 0.00000e+00 6.31704e+01 64.756  2.04337e+01 64.756  0.5761 
1 1 1 7   39  11 o 11 1.58584e+01 1.34519e+00 2.49632e+02 70.512  1.10222e+01  3.11462e+01  0.00000e+00 0.00000e+00 3.37788e+02 70.512  8.81557e+01 70.512  0.9847 
1 1 1 7   39  12 o 16 1.13300e+01 1.34788e+00 1.82212e+02 26.482  1.80170e+01  8.97593e+00  0.00000e+00 0.00000e+00 2.33067e+02 26.482  5.08549e+01 26.482  0.9748 
1 1 1 7   39  13 o 5  8.03325e+00 1.51449e+00 9.47540e+01 152.369 -6.62569e+00 3.46839e+00  0.00000e+00 0.00000e+00 1.86169e+02 152.369 9.14145e+01 152.369 0.9305 
1 1 1 7   39  14 o 10 3.74207e+00 1.26522e+00 2.47632e+01 147.577 -9.92455e-01 6.30383e-01  0.00000e+00 0.00000e+00 4.62456e+01 147.577 2.14824e+01 147.577 0.5052 
1 1 1 7   39  15 o 6  4.65527e+00 1.53592e+00 6.78811e+01 18.715  3.39468e+00  1.15003e+00  0.00000e+00 0.00000e+00 7.98497e+01 18.715  1.19686e+01 18.715  0.8454 
1 1 1 7   40  0  o 9  2.30822e+01 5.46023e-01 4.22066e+02 193.122 -1.99440e+01 -4.64907e+00 0.00000e+00 0.00000e+00 4.25115e+02 193.122 3.04828e+00 193.122 0.9753 
1 1 1 7   40  1  o 5  1.14539e+01 5.20318e-01 3.80933e+02 85.995  6.39909e-01  9.13883e+00  0.00000e+00 0.00000e+00 2.59641e+01 85.995  3.54969e+02 265.995 0.9437 
1 1 1 7   40  2  f 0  1.68650e+01 5.33821e-01 1.67229e+02 86.026  4.25828e-01  6.12937e+00  0.00000e+00 0.00000e+00 4.13475e+02 86.026  2.46246e+02 86.026  0.9145 
1 1 1 7   40  3  o 3  3.65659e+01 7.27655e-01 6.77524e+02 108.174 -1.87188e+01 5.70218e+01  0.00000e+00 0.00000e+00 6.87840e+02 108.174 1.03160e+01 108.174 0.9916 
1 1 1 7   40  4  o 12 1.90153e+01 5.88436e-01 2.51288e+02 23.460  1.14499e+01  4.96899e+00  0.00000e+00 0.00000e+00 4.35467e+02 23.460  1.84179e+02 23.460  0.9591 
1 1 1 7   40  5  o 17 1.21584e+01 6.97986e-01 1.47259e+02 97.422  -6.59410e-01 5.06184e+00  0.00000e+00 0.00000e+00 2.62867e+02 97.422  1.15609e+02 97.422  0.8958 
1 1 1 7   40  6  o 1  1.54724e+01 7.07689e-01 2.29968e+02 316.635 9.13729e+00  -8.62999e+00 0.00000e+00 0.00000e+00 3.28975e+02 316.635 9.90073e+01 316.635 0.9594 
1 1 1 7   40  7  o 13 1.23700e+01 8.28482e-01 2.70262e+02 159.673 -1.34397e+01 4.97865e+00  0.00000e+00 0.00000e+00 1.78933e+02 159.673 9.13283e+01 339.673 0.9645 
1 1 1 7   40  8  o 1  2.58509e+01 8.94855e-01 5.66822e+02 351.789 8.26191e+01  -1.19216e+01 0.00000e+00 0.00000e+00 4.00484e+02 351.789 1.66338e+02 171.789 0.9940 
1 1 1 7   40  9  o 19 1.20566e+01 1.13168e+00 1.93810e+02 262.272 -2.08033e+00 -1.53307e+01 0.00000e+00 0.00000e+00 2.45030e+02 262.272 5.12203e+01 262.272 0.9671 
1 1 1 7   40  10 o 7  4.51957e+00 1.37321e+00 1.15552e+02 27.966  3.21710e+00  1.70812e+00  0.00000e+00 0.00000e+00 2.86837e+01 27.966  8.68686e+01 207.966 0.8482 
1 1 1 7   40  11 o 12 1.01306e+01 1.53705e+00 2.15299e+02 40.144  1.26358e+01  1.06570e+01  0.00000e+00 0.00000e+00 1.54013e+02 40.144  6.12867e+01 220.144 0.9693 
1 1 1 7   40  12 o 17 8.63844e+00 1.49785e+00 1.06751e+02 154.125 -7.48958e+00 3.63279e+00  0.00000e+00 0.00000e+00 1.97832e+02 154.125 9.10811e+01 154.125 0.9379 
1 1 1 7   40  13 o 6  4.97465e+00 1.48005e+00 1.01219e+02 128.494 -3.08652e+00 3.88113e+00  0.00000e+00 0.00000e+00 6.56036e+01 128.494 3.56154e+01 308.494 0.8924 
1 1 1 7   40  14 o 2  6.93578e+00 1.68655e+00 1.30465e+02 349.512 8.70002e+00  -1.61054e+00 0.00000e+00 0.00000e+00 1.14825e+02 349.512 1.56399e+01 169.512 0.9417 
1 1 1 7   40  15 o 6  1.20241e+01 1.92245e+00 1.88349e+02 11.708  1.88590e+01  3.90826e+00  0.00000e+00 0.00000e+00 2.51088e+02 11.708  6.27384e+01 11.708  0.9737 
1 1 1 7   41  0  o 5  2.30346e+01 5.52952e-01 4.38720e+02 329.982 1.83201e+01  -1.05849e+01 0.00000e+00 0.00000e+00 4.07317e+02 329.982 3.14026e+01 149.982 0.9761 
1 1 1 7   41  1  o 14 3.48067e+01 7.69585e-01 6.51503e+02 187.343 -4.85040e+01 -6.25091e+00 0.00000e+00 0.00000e+00 6.45112e+02 187.343 6.39078e+00 7.343   0.9897 
1 1 1 7   41  2  f 0  2.25022e+01 5.63618e-01 2.14571e+02 280.740 1.99967e+00  -1.05425e+01 0.00000e+00 0.00000e+00 5.92051e+02 280.740 3.77480e+02 280.740 0.9522 
1 1 1 7   41  3  o 5  2.56655e+01 6.09223e-01 5.08805e+02 313.574 2.16161e+01  -2.27199e+01 0.00000e+00 0.00000e+00 4.41986e+02 313.574 6.68194e+01 133.574 0.9839 
1 1 1 7   41  4  o 14 8.37563e+00 8.06021e-01 3.09949e+02 320.285 5.39373e+00  -4.48040e+00 0.00000e+00 0.00000e+00 1.80224e+01 140.285 3.27972e+02 140.285 0.9257 
1 1 1 7   41  5  o 11 1.52851e+01 6.52823e-01 2.57209e+02 160.949 -1.19211e+01 4.11669e+00  0.00000e+00 0.00000e+00 2.95017e+02 160.949 3.78080e+01 160.949 0.9595 
1 1 1 7   41  6  o 7  9.44088e+00 9.02715e-01 8.80302e+01 75.690  6.90540e-01  2.70711e+00  0.00000e+00 0.00000e+00 1.94032e+02 75.690  1.06002e+02 75.690  0.7935 
1 1 1 7   41  7  o 9  2.86770e+01 7.49729e-01 4.70392e+02 241.955 -2.86858e+01 -5.38488e+01 0.00000e+00 0.00000e+00 6.00332e+02 241.955 1.29940e+02 241.955 0.9918 
1 1 1 7   41  8  o 18 2.26444e+01 9.53854e-01 4.62030e+02 106.926 -1.64870e+01 5.41753e+01  0.00000e+00 0.00000e+00 3.82760e+02 106.926 7.92701e+01 286.926 0.9911 
1 1 1 7   41  9  o 9  1.00710e+01 1.24533e+00 2.03558e+02 179.094 -1.31784e+01 2.08488e-01  0.00000e+00 0.00000e+00 1.60755e+02 179.094 4.28028e+01 359.094 0.9613 
1 1 1 7   41  10 o 9  2.87850e+01 1.12116e+00 4.68614e+02 68.115  3.99232e+01  9.93866e+01  0.00000e+00 0.00000e+00 6.09223e+02 68.115  1.40609e+02 68.115  0.9953 
1 1 1 7   41  11 o 19 1.21953e+01 1.25610e+00 2.61003e+02 249.822 -9.71641e+00 -2.64402e+01 0.00000e+00 0.00000e+00 1.89411e+02 249.822 7.15922e+01 69.822  0.9821 
1 1 1 7   41  12 o 14 4.48506e+00 1.33664e+00 6.99906e+01 41.018  2.21590e+00  1.92750e+00  0.00000e+00 0.00000e+00 6.57667e+01 41.018  4.22381e+00 221.018 0.8052 
1 1 1 7   41  13 o 11 5.24836e+00 1.57157e+00 1.56555e+02 200.523 -7.12269e+00 -2.66626e+00 0.00000e+00 0.00000e+00 2.71777e+01 200.523 1.29378e+02 20.523  0.9317 
1 1 1 7   41  14 o 15 6.26273e+00 1.73179e+00 1.34349e+02 65.090  3.21692e+00  6.92718e+00  0.00000e+00 0.00000e+00 8.48471e+01 65.090  4.95018e+01 245.090 0.9320 
1 1 1 7   41  15 o 13 1.00437e+01 2.09434e+00 1.72948e+02 342.629 1.32361e+01  -4.14049e+00 0.00000e+00 0.00000e+00 1.90138e+02 342.629 1.71894e+01 342.629 0.9632 
1 1 1 7   42  0  o 6  2.55192e+01 6.94498e-01 4.21658e+02 202.129 -2.15585e+01 -8.76673e+00 0.00000e+00 0.00000e+00 5.17641e+02 202.129 9.59832e+01 202.129 0.9783 
1 1 1 7   42  1  o 8  1.74594e+01 6.21856e-01 3.88872e+02 9.003   1.48899e+01  2.35914e+00  0.00000e+00 0.00000e+00 2.46021e+02 9.003   1.42851e+02 189.003 0.9662 
1 1 1 7   42  2  o 8  3.10835e+01 6.53119e-01 5.63279e+02 11.579  4.17966e+01  8.56379e+00  0.00000e+00 0.00000e+00 5.92960e+02 11.579  2.96806e+01 11.579  0.9882 
1 1 1 7   42  3  o 8  3.40188e+01 7.00860e-01 6.79889e+02 33.715  5.10810e+01  3.40867e+01  0.00000e+00 0.00000e+00 5.90326e+02 33.715  8.95631e+01 213.715 0.9918 
1 1 1 7   42  4  o 18 1.57971e+01 6.05271e-01 2.34564e+02 64.725  4.42958e+00  9.38160e+00  0.00000e+00 0.00000e+00 3.30749e+02 64.725  9.61848e+01 64.725  0.9505 
1 1 1 7   42  5  o 16 9.50492e+00 8.22475e-01 1.80389e+02 245.607 -2.16038e+00 -4.76402e+00 0.00000e+00 0.00000e+00 1.41134e+02 245.607 3.92552e+01 65.607  0.8985 
1 1 1 7   42  6  o 12 2.15978e+01 6.84906e-01 3.44709e+02 148.977 -2.48322e+01 1.49342e+01  0.00000e+00 0.00000e+00 4.54234e+02 148.977 1.09525e+02 148.977 0.9826 
1 1 1 7   42  7  o 15 9.39489e+00 1.19026e+00 1.57460e+02 278.112 9.23530e-01  -6.47928e+00 0.00000e+00 0.00000e+00 1.67924e+02 278.112 1.04638e+01 278.112 0.9201 
1 1 1 7   42  8  o 2  4.44148e+00 1.28957e+00 1.74256e+02 205.714 -3.52468e+00 -1.69739e+00 0.00000e+00 0.00000e+00 3.04885e+01 25.714  2.04745e+02 25.714  0.8601 
1 1 1 7   42  9  o 18 1.02655e+01 1.34402e+00 1.75183e+02 122.401 -5.90934e+00 9.31136e+00  0.00000e+00 0.00000e+00 1.93131e+02 122.401 1.79482e+01 122.401 0.9535 
1 1 1 7   42  10 o 4  7.37886e+00 1.60197e+00 1.58390e+02 14.781  7.49415e+00  1.97737e+00  0.00000e+00 0.00000e+00 1.00595e+02 14.781  5.77945e+01 194.781 0.9331 
1 1 1 7   42  11 o 12 7.67807e+00 1.50964e+00 8.53569e+01 39.209  3.91840e+00  3.19680e+00  0.00000e+00 0.00000e+00 1.72954e+02 39.209  8.75967e+01 39.209  0.8947 
1 1 1 7   42  12 f 0  6.62457e+00 1.52159e+00 4.15375e+01 333.372 2.24461e+00  -1.12537e+00 0.00000e+00 0.00000e+00 1.49239e+02 333.372 1.07701e+02 333.372 0.7662 
1 1 1 7   42  13 o 10 1.07180e+01 1.55190e+00 1.75816e+02 67.232  7.43205e+00  1.77078e+01  0.00000e+00 0.00000e+00 2.16217e+02 67.232  4.04006e+01 67.232  0.9736 
1 1 1 7   42  14 o 9  1.52542e+01 1.44701e+00 3.12892e+02 326.918 4.59831e+01  -2.99553e+01 0.00000e+00 0.00000e+00 2.54636e+02 326.918 5.82557e+01 146.918 0.9908 
1 1 1 7   42  15 o 10 4.84804e+00 1.55899e+00 6.46696e+01 223.087 -2.56042e+00 -2.39493e+00 0.00000e+00 0.00000e+00 8.84050e+01 223.087 2.37354e+01 223.087 0.8414 
1 1 1 7   43  0  o 12 2.41336e+01 6.61095e-01 4.06440e+02 115.940 -9.49228e+00 1.95142e+01  0.00000e+00 0.00000e+00 4.80307e+02 115.940 7.38663e+01 115.940 0.9767 
1 1 1 7   43  1  o 5  1.42458e+01 5.74221e-01 1.95037e+02 264.017 -7.10424e-01 -6.77855e+00 0.00000e+00 0.00000e+00 2.99977e+02 264.017 1.04941e+02 264.017 0.9234 
1 1 1 7   43  2  o 18 2.97514e+01 6.71778e-01 4.57468e+02 271.797 1.02184e+00  -3.25693e+01 0.00000e+00 0.00000e+00 6.44973e+02 271.797 1.87505e+02 271.797 0.9845 
1 1 1 7   43  3  o 13 2.48295e+01 6.04397e-01 4.87870e+02 73.845  8.79349e+00  3.03564e+01  0.00000e+00 0.00000e+00 4.31857e+02 73.845  5.60126e+01 253.845 0.9841 
1 1 1 7   43  4  o 16 1.79996e+01 7.45486e-01 3.03066e+02 226.032 -1.12965e+01 -1.17108e+01 0.00000e+00 0.00000e+00 3.53358e+02 226.032 5.02920e+01 226.032 0.9688 
1 1 1 7   43  5  o 3  2.58997e+01 6.74997e-01 5.27724e+02 145.915 -3.60100e+01 2.43669e+01  0.00000e+00 0.00000e+00 4.35991e+02 145.915 9.17331e+01 325.915 0.9884 
1 1 1 7   43  6  o 6  1.42945e+01 9.38767e-01 1.62806e+02 64.569  4.12975e+00  8.68510e+00  0.00000e+00 0.00000e+00 3.46486e+02 64.569  1.83680e+02 64.569  0.9465 
1 1 1 7   43  7  o 11 1.25402e+01 1.04727e+00 2.31050e+02 128.339 -7.98370e+00 1.00951e+01  0.00000e+00 0.00000e+00 2.22219e+02 128.339 8.83081e+00 308.339 0.9603 
1 1 1 7   43  8  o 19 1.65910e+01 8.84497e-01 3.52642e+02 354.406 3.41037e+01  -3.34032e+00 0.00000e+00 0.00000e+00 2.62530e+02 354.406 9.01124e+01 174.406 0.9853 
1 1 1 7   43  9  o 5  5.73511e+00 1.51018e+00 1.50296e+02 111.653 -1.92794e+00 4.85632e+00  0.00000e+00 0.00000e+00 4.35428e+01 111.653 1.06754e+02 291.653 0.8984 
1 1 1 7   43  10 o 12 6.21118e+00 1.60680e+00 1.19767e+02 239.240 -2.51577e+00 -4.22691e+00 0.00000e+00 0.00000e+00 8.84920e+01 239.240 3.12748e+01 59.240  0.8915 
1 1 1 7   43  11 o 8  3.82801e+00 1.21538e+00 3.90747e+01 121.738 -7.18391e-01 1.16145e+00  0.00000e+00 0.00000e+00 4.16867e+01 121.738 2.61205e+00 121.738 0.5611 
1 1 1 7   43  12 o 13 4.51248e+00 1.35835e+00 7.31793e+01 2.900   3.16798e+00  1.60456e-01  0.00000e+00 0.00000e+00 6.62134e+01 2.900   6.96581e+00 182.899 0.8219 
1 1 1 7   43  13 o 10 5.35555e+00 1.53951e+00 9.94736e+01 337.857 4.98257e+00  -2.02758e+00 0.00000e+00 0.00000e+00 8.18868e+01 337.857 1.75868e+01 157.857 0.9015 
1 1 1 7   43  14 o 9  4.80715e+00 1.49422e+00 8.58339e+01 25.255  3.99161e+00  1.88298e+00  0.00000e+00 0.00000e+00 7.25784e+01 25.255  1.32555e+01 205.255 0.8777 
1 1 1 7   43  15 o 8  7.74890e+00 1.92930e+00 8.13997e+01 163.553 -5.46681e+00 1.61385e+00  0.00000e+00 0.00000e+00 1.82435e+02 163.553 1.01035e+02 163.553 0.9074 
1 1 1 7   44  0  o 13 3.35276e+01 7.41489e-01 7.41620e+02 279.948 1.04116e+01  -5.93640e+01 0.00000e+00 0.00000e+00 5.09050e+02 279.948 2.32570e+02 99.948  0.9917 
1 1 1 7   44  1  o 11 3.95201e+01 7.55862e-01 8.69887e+02 105.884 -2.24368e+01 7.88486e+01  0.00000e+00 0.00000e+00 6.07980e+02 105.884 2.61907e+02 285.884 0.9939 
1 1 1 7   44  2  o 3  1.50242e+01 7.40007e-01 1.54613e+02 59.777  3.09726e+00  5.31678e+00  0.00000e+00 0.00000e+00 3.62545e+02 59.777  2.07933e+02 59.777  0.9147 
1 1 1 7   44  3  o 13 2.67913e+01 6.34149e-01 5.03409e+02 88.424  1.01426e+00  3.68609e+01  0.00000e+00 0.00000e+00 4.91181e+02 88.424  1.22275e+01 268.424 0.9863 
1 1 1 7   44  4  o 6  9.42450e+00 1.21790e+00 1.29956e+02 152.156 -2.92657e+00 1.54585e+00  0.00000e+00 0.00000e+00 1.64660e+02 152.156 3.47037e+01 152.156 0.8305 
1 1 1 7   44  5  o 7  3.10677e+01 7.17720e-01 5.30320e+02 21.704  4.99753e+01  1.98918e+01  0.00000e+00 0.00000e+00 6.28159e+02 21.704  9.78382e+01 21.704  0.9907 
1 1 1 7   44  6  o 10 2.76162e+01 8.18184e-01 5.01357e+02 60.646  2.83603e+01  5.04267e+01  0.00000e+00 0.00000e+00 5.29049e+02 60.646  2.76918e+01 60.646  0.9913 
1 1 1 7   44  7  f 0  3.25661e+01 9.28927e-01 5.56233e+02 346.196 8.51798e+01  -2.09276e+01 0.00000e+00 0.00000e+00 6.62355e+02 346.196 1.06122e+02 346.196 0.9943 
1 1 1 7   44  8  o 19 5.53481e+00 1.30539e+00 1.06372e+02 98.181  -4.52712e-01 3.14895e+00  0.00000e+00 0.00000e+00 6.49320e+01 98.181  4.14396e+01 278.181 0.8225 
1 1 1 7   44  9  o 7  6.89221e+00 1.45013e+00 8.92198e+01 145.958 -3.35546e+00 2.26688e+00  0.00000e+00 0.00000e+00 1.35155e+02 145.958 4.59357e+01 145.958 0.8654 
1 1 1 7   44  10 o 19 5.68416e+00 1.51713e+00 7.15026e+01 33.195  2.42592e+00  1.58716e+00  0.00000e+00 0.00000e+00 9.99869e+01 33.195  2.84844e+01 33.195  0.8022 
1 1 1 7   44  11 o 15 1.34115e+01 1.11798e+00 3.08833e+02 257.671 -7.94413e+00 -3.63469e+01 0.00000e+00 0.00000e+00 1.88532e+02 257.671 1.20302e+02 77.671  0.9865 
1 1 1 7   44  12 o 4  1.26055e+01 1.21002e+00 2.25924e+02 353.796 3.08019e+01  -3.34855e+00 0.00000e+00 0.00000e+00 2.40056e+02 353.796 1.41328e+01 353.796 0.9837 
1 1 1 7   44  13 o 15 8.50566e+00 1.45915e+00 1.75400e+02 288.077 4.91754e+00  -1.50659e+01 0.00000e+00 0.00000e+00 1.33822e+02 288.077 4.15786e+01 108.077 0.9679 
1 1 1 7   44  14 o 3  9.49904e+00 1.85494e+00 1.89175e+02 146.655 -1.34821e+01 8.87125e+00  0.00000e+00 0.00000e+00 1.56183e+02 146.655 3.29915e+01 326.655 0.9685 
1 1 1 7   44  15 o 17 7.40270e+00 1.93883e+00 1.85984e+02 26.051  1.06244e+01  5.19365e+00  0.00000e+00 0.00000e+00 7.97267e+01 26.051  1.06257e+02 206.051 0.9567 
1 1 1 7   45  0  o 11 9.84116e+00 9.51572e-01 1.25460e+02 322.235 2.28973e+00  -1.77384e+00 0.00000e+00 0.00000e+00 1.71403e+02 322.235 4.59426e+01 322.235 0.8020 
1 1 1 7   45  1  o 11 1.55134e+01 5.53477e-01 1.94368e+02 11.105  7.94469e+00  1.55939e+00  0.00000e+00 0.00000e+00 3.51930e+02 11.105  1.57562e+02 11.105  0.9360 
1 1 1 7   45  2  o 5  1.61074e+01 5.48283e-01 3.29214e+02 251.432 -4.41993e+00 -1.31577e+01 0.00000e+00 0.00000e+00 2.54620e+02 251.432 7.45937e+01 71.432  0.9633 
1 1 1 7   45  3  o 14 5.43891e+00 9.15284e-01 1.55086e+02 214.259 -1.90318e+00 -1.29627e+00 0.00000e+00 0.00000e+00 3.26927e+00 34.259  1.58356e+02 34.259  0.7417 
1 1 1 7   45  4  o 15 2.05269e+01 8.02012e-01 2.33743e+02 225.792 -1.05729e+01 -1.08693e+01 0.00000e+00 0.00000e+00 5.12872e+02 225.792 2.79129e+02 225.792 0.9664 
1 1 1 7   45  5  o 7  2.82422e+01 7.07619e-01 2.92826e+02 340.024 2.73719e+01  -9.94974e+00 0.00000e+00 0.00000e+00 7.51679e+02 340.024 4.58853e+02 340.024 0.9827 
1 1 1 7   45  6  o 9  1.64191e+01 7.34624e-01 1.57305e+02 113.779 -4.51971e+00 1.02579e+01  0.00000e+00 0.00000e+00 4.32367e+02 113.779 2.75062e+02 113.779 0.9543 
1 1 1 7   45  7  o 1  9.04913e+00 1.14897e+00 1.34464e+02 60.047  3.00887e+00  5.22143e+00  0.00000e+00 0.00000e+00 1.76346e+02 60.047  4.18818e+01 60.047  0.9128 
1 1 1 7   45  8  f 0  1.29299e+01 1.04565e+00 2.33079e+02 156.469 -1.73196e+01 7.54183e+00  0.00000e+00 0.00000e+00 2.40323e+02 156.469 7.24328e+00 156.469 0.9732 
1 1 1 7   45  9  o 2  7.45524e+00 1.40483e+00 9.45262e+01 196.138 -4.32164e+00 -1.25051e+00 0.00000e+00 0.00000e+00 1.52328e+02 196.138 5.78019e+01 196.138 0.8803 
1 1 1 7   45  10 o 2  9.05683e+00 1.50834e+00 1.54800e+02 133.117 -6.91652e+00 7.38687e+00  0.00000e+00 0.00000e+00 1.68470e+02 133.117 1.36700e+01 133.117 0.9492 
1 1 1 7   45  11 o 19 6.50967e+00 1.43698e+00 1.76273e+02 48.719  6.35098e+00  7.23401e+00  0.00000e+00 0.00000e+00 5.53381e+01 48.719  1.20935e+02 228.719 0.9465 
1 1 1 7   45  12 o 12 4.30579e+00 1.30741e+00 6.15705e+01 162.343 -2.62774e+00 8.36465e-01  0.00000e+00 0.00000e+00 6.62933e+01 162.343 4.72278e+00 162.343 0.7903 
1 1 1 7   45  13 o 12 4.98012e+00 1.44662e+00 7.68415e+01 104.957 -1.05061e+00 3.93282e+00  0.00000e+00 0.00000e+00 8.51612e+01 104.957 8.31970e+00 104.957 0.8662 
1 1 1 7   45  14 o 4  7.70927e+00 1.78132e+00 1.53355e+02 283.811 2.68271e+00  -1.09132e+01 0.00000e+00 0.00000e+00 1.22821e+02 283.811 3.05336e+01 103.811 0.9544 
1 1 1 7   45  15 o 12 1.21589e+01 2.09200e+00 2.17702e+02 28.352  1.86765e+01  1.00783e+01  0.00000e+00 0.00000e+00 2.27526e+02 28.352  9.82461e+00 28.352  0.9761 
1 1 1 7   46  0  o 11 1.59720e+01 6.91862e-01 2.09161e+02 156.310 -8.12929e+00 3.56687e+00  0.00000e+00 0.00000e+00 3.56580e+02 156.310 1.47420e+02 156.310 0.9419 
1 1 1 7   46  1  o 18 1.27078e+01 6.40641e-01 2.02924e+02 37.261  5.34777e+00  4.06815e+00  0.00000e+00 0.00000e+00 2.37933e+02 37.261  3.50090e+01 37.261  0.9223 
1 1 1 7   46  2  o 12 2.12137e+01 5.65394e-01 2.91089e+02 52.160  1.04014e+01  1.33903e+01  0.00000e+00 0.00000e+00 4.83135e+02 52.160  1.92046e+02 52.160  0.9700 
1 1 1 7   46  3  o 16 2.92104e+01 7.79858e-01 5.15446e+02 174.651 -4.45286e+01 4.16933e+00  0.00000e+00 0.00000e+00 5.71331e+02 174.651 5.58845e+01 174.651 0.9888 
1 1 1 7   46  4  f 0  3.01696e+01 8.88357e-01 4.00474e+02 328.999 3.13242e+01  -1.88222e+01 0.00000e+00 0.00000e+00 7.19192e+02 328.999 3.18719e+02 328.999 0.9862 
1 1 1 7   46  5  o 2  1.26216e+01 7.45381e-01 1.14869e+02 70.774  1.62699e+00  4.66530e+00  0.00000e+00 0.00000e+00 3.08796e+02 70.774  1.93928e+02 70.774  0.8920 
1 1 1 7   46  6  o 11 4.10011e+01 1.01181e+00 6.29607e+02 29.833  9.74586e+01  5.58898e+01  0.00000e+00 0.00000e+00 9.06345e+02 29.833  2.76738e+02 29.833  0.9955 
1 1 1 7   46  7  o 19 1.24893e+01 1.00781e+00 1.61939e+02 60.431  5.55315e+00  9.78761e+00  0.00000e+00 0.00000e+00 2.86578e+02 60.431  1.24639e+02 60.431  0.9545 
1 1 1 7   46  8  o 12 1.94832e+01 8.88004e-01 3.46293e+02 355.695 4.50748e+01  -3.39350e+00 0.00000e+00 0.00000e+00 3.78474e+02 355.695 3.21811e+01 355.695 0.9889 
1 1 1 7   46  9  o 4  1.38927e+01 1.13583e+00 2.90170e+02 339.829 2.83591e+01  -1.04179e+01 0.00000e+00 0.00000e+00 2.23604e+02 339.829 6.65657e+01 159.829 0.9833 
1 1 1 7   46  10 o 17 1.52427e+01 1.09801e+00 2.62930e+02 93.903  -2.30300e+00 3.37587e+01  0.00000e+00 0.00000e+00 3.01633e+02 93.903  3.87020e+01 93.903  0.9851 
1 1 1 7   46  11 o 2  5.27278e+00 1.35777e+00 9.95523e+01 40.105  3.61922e+00  3.04823e+00  0.00000e+00 0.00000e+00 7.61829e+01 40.105  2.33694e+01 220.105 0.8868 
1 1 1 7   46  12 f 0  3.61326e+00 1.16732e+00 6.94688e+01 273.691 1.85756e-01  -2.87919e+00 0.00000e+00 0.00000e+00 3.92802e+01 273.691 3.01886e+01 93.691  0.8011 
1 1 1 7   46  13 o 12 6.53684e+00 1.50956e+00 1.19833e+02 291.155 2.90864e+00  -7.51652e+00 0.00000e+00 0.00000e+00 1.09854e+02 291.155 9.97913e+00 111.155 0.9357 
1 1 1 7   46  14 o 7  5.46954e+00 1.59720e+00 5.91351e+01 18.366  3.16718e+00  1.05148e+00  0.00000e+00 0.00000e+00 1.11677e+02 18.366  5.25420e+01 18.366  0.8321 
1 1 1 7   46  15 o 19 4.31534e+00 1.45915e+00 1.24538e+02 22.951  6.06607e+00  2.56876e+00  0.00000e+00 0.00000e+00 2.44714e+01 22.951  1.00066e+02 202.951 0.9206 
1 1 1 7   47  0  o 3  1.93716e+01 5.96050e-01 2.85161e+02 81.186  2.20845e+00  1.42427e+01  0.00000e+00 0.00000e+00 4.17509e+02 81.186  1.32348e+02 81.186  0.9647 
1 1 1 7   47  1  o 13 8.49837e+00 6.31297e-01 1.31087e+02 17.369  2.91057e+00  9.10378e-01  0.00000e+00 0.00000e+00 1.28965e+02 17.369  2.12210e+00 197.369 0.8136 
1 1 1 7   47  2  o 18 3.22668e+01 6.79137e-01 5.83438e+02 345.821 5.08040e+01  -1.28358e+01 0.00000e+00 0.00000e+00 6.18753e+02 345.821 3.53144e+01 345.821 0.9904 
1 1 1 7   47  3  o 1  2.64360e+01 6.29149e-01 4.10570e+02 76.168  8.35230e+00  3.39218e+01  0.00000e+00 0.00000e+00 5.69703e+02 76.168  1.59132e+02 76.168  0.9856 
1 1 1 7   47  4  o 1  1.66839e+01 6.60927e-01 2.38643e+02 248.108 -4.87897e+00 -1.21418e+01 0.00000e+00 0.00000e+00 3.64620e+02 248.108 1.25976e+02 248.108 0.9610 
1 1 1 7   47  5  o 6  1.05657e+01 7.92286e-01 1.56885e+02 146.599 -5.30562e+00 3.49849e+00  0.00000e+00 0.00000e+00 2.07882e+02 146.599 5.09970e+01 146.599 0.9175 
1 1 1 7   47  6  o 1  2.36242e+01 8.94588e-01 3.11432e+02 342.955 3.27882e+01  -1.00523e+01 0.00000e+00 0.00000e+00 5.64354e+02 342.955 2.52922e+02 342.955 0.9853 
1 1 1 7   47  7  o 17 9.60878e+00 1.19126e+00 2.28704e+02 124.165 -6.34137e+00 9.34320e+00  0.00000e+00 0.00000e+00 1.16380e+02 124.165 1.12324e+02 304.165 0.9546 
1 1 1 7   47  8  o 18 5.59946e+00 1.47483e+00 4.84880e+01 178.322 -1.61403e+00 4.72950e-02  0.00000e+00 0.00000e+00 8.27754e+01 178.322 3.42874e+01 178.322 0.6232 
1 1 1 7   47  9  o 13 1.06512e+01 1.30060e+00 1.77372e+02 236.553 -7.45590e+00 -1.12872e+01 0.00000e+00 0.00000e+00 2.08060e+02 236.553 3.06877e+01 236.553 0.9623 
1 1 1 7   47  10 o 15 7.30409e+00 1.29294e+00 1.91843e+02 28.173  1.05366e+01  5.64338e+00  0.00000e+00 0.00000e+00 7.09909e+01 28.173  1.20852e+02 208.173 0.9572 
1 1 1 7   47  11 o 9  1.33517e+01 1.02748e+00 2.39986e+02 285.047 9.07070e+00  -3.37413e+01 0.00000e+00 0.00000e+00 2.54534e+02 285.047 1.45485e+01 285.047 0.9856 
1 1 1 7   47  12 o 6  6.10619e+00 1.48906e+00 1.55506e+02 312.915 6.04585e+00  -6.50261e+00 0.00000e+00 0.00000e+00 6.05358e+01 312.915 9.49697e+01 132.915 0.9419 
1 1 1 7   47  13 o 15 8.96788e+00 1.62156e+00 1.49408e+02 352.538 1.27997e+01  -1.67643e+00 0.00000e+00 0.00000e+00 1.73981e+02 352.538 2.45727e+01 352.538 0.9605 
1 1 1 7   47  14 o 11 8.07975e+00 1.78068e+00 2.17823e+02 151.739 -1.49515e+01 8.03740e+00  0.00000e+00 0.00000e+00 7.63023e+01 151.739 1.41520e+02 331.739 0.9701 
1 1 1 7   48  0  o 18 2.05510e+01 5.74076e-01 4.03898e+02 100.638 -4.20269e+00 2.23737e+01  0.00000e+00 0.00000e+00 3.51596e+02 100.638 5.23015e+01 280.638 0.9778 
1 1 1 7   48  1  o 1  2.97832e+01 6.37176e-01 5.77397e+02 257.165 -1.06762e+01 -4.68594e+01 0.00000e+00 0.00000e+00 5.30930e+02 257.165 4.64674e+01 77.165  0.9895 
1 1 1 7   48  2  o 3  2.84284e+01 6.32428e-01 5.68270e+02 316.304 3.50935e+01  -3.35317e+01 0.00000e+00 0.00000e+00 4.89955e+02 316.304 7.83155e+01 136.304 0.9896 
1 1 1 7   48  3  o 8  1.18955e+01 7.95474e-01 1.43046e+02 255.704 -1.28606e+00 -5.04675e+00 0.00000e+00 0.00000e+00 2.58799e+02 255.704 1.15754e+02 255.704 0.8980 
1 1 1 7   48  4  o 10 2.31391e+01 6.73518e-01 4.52569e+02 196.322 -3.55650e+01 -1.04150e+01 0.00000e+00 0.00000e+00 4.06124e+02 196.322 4.64452e+01 16.322  0.9864 
1 1 1 7   48  5  o 19 8.12332e+00 9.56384e-01 1.99879e+02 330.074 5.77506e+00  -3.32434e+00 0.00000e+00 0.00000e+00 8.17625e+01 330.074 1.18117e+02 150.074 0.9216 
1 1 1 7   48  6  o 5  8.56899e+00 1.39852e+00 1.38405e+02 335.494 4.46837e+00  -2.03690e+00 0.00000e+00 0.00000e+00 1.48905e+02 335.494 1.04993e+01 335.494 0.8913 
1 1 1 7   48  7  o 10 6.33348e+00 1.36113e+00 2.44643e+02 284.489 1.92196e+00  -7.43779e+00 0.00000e+00 0.00000e+00 2.25048e+01 104.489 2.67148e+02 104.489 0.9324 
1 1 1 7   48  8  o 12 1.13982e+01 1.21517e+00 1.50226e+02 204.993 -1.00489e+01 -4.68445e+00 0.00000e+00 0.00000e+00 2.58628e+02 204.993 1.08403e+02 204.993 0.9538 
1 1 1 7   48  9  o 7  1.21607e+01 1.52182e+00 1.86867e+02 299.379 7.64386e+00  -1.35775e+01 0.00000e+00 0.00000e+00 2.55445e+02 299.379 6.85779e+01 299.379 0.9674 
1 1 1 7   48  10 o 15 1.51526e+01 9.09188e-01 2.41360e+02 342.150 3.37547e+01  -1.08700e+01 0.00000e+00 0.00000e+00 3.20110e+02 342.150 7.87503e+01 342.150 0.9858 
1 1 1 7   48  11 o 18 6.10543e+00 1.37262e+00 1.96464e+02 105.867 -3.15453e+00 1.10984e+01  0.00000e+00 0.00000e+00 2.27677e+01 105.867 1.73696e+02 285.867 0.9556 
1 1 1 7   48  12 o 1  1.10328e+01 1.26800e+00 2.00585e+02 266.233 -1.63614e+00 -2.48514e+01 0.00000e+00 0.00000e+00 2.05389e+02 266.233 4.80363e+00 266.233 0.9797 
1 1 1 7   48  13 o 2  6.71234e+00 1.64062e+00 1.13824e+02 201.203 -6.96181e+00 -2.70071e+00 0.00000e+00 0.00000e+00 1.20627e+02 201.203 6.80234e+00 201.203 0.9304 
1 1 1 7   48  14 o 10 9.36975e+00 1.64776e+00 1.32237e+02 129.143 -8.44267e+00 1.03727e+01  0.00000e+00 0.00000e+00 2.05911e+02 129.143 7.36736e+01 129.143 0.9619 
1 1 1 7   49  0  o 14 1.09048e+01 5.50678e-01 2.74790e+02 282.424 1.80791e+00  -8.20634e+00 0.00000e+00 0.00000e+00 1.09916e+02 282.424 1.64874e+02 102.424 0.9385 
1 1 1 7   49  1  o 9  2.36125e+01 8.65241e-01 3.09682e+02 251.666 -6.78659e+00 -2.04801e+01 0.00000e+00 0.00000e+00 5.57360e+02 251.666 2.47678e+02 251.666 0.9765 
1 1 1 7   49  2  o 15 1.94984e+01 5.83359e-01 5.09261e+02 153.624 -2.87150e+01 1.42396e+01  0.00000e+00 0.00000e+00 2.12515e+02 153.624 2.96747e+02 333.624 0.9843 
1 1 1 7   49  3  o 4  4.56807e+00 9.85949e-01 1.06913e+02 347.978 1.47433e+00  -3.13966e-01 0.00000e+00 0.00000e+00 4.17125e+00 167.978 1.11084e+02 167.978 0.5980 
1 1 1 7   49  4  f 0  2.79250e+01 6.71880e-01 5.68863e+02 160.912 -5.15541e+01 1.78405e+01  0.00000e+00 0.00000e+00 4.71895e+02 160.912 9.69678e+01 340.912 0.9908 
1 1 1 7   49  5  o 16 1.90733e+01 6.83357e-01 2.67014e+02 46.377  1.53364e+01  1.60916e+01  0.00000e+00 0.00000e+00 4.34125e+02 46.377  1.67112e+02 46.377  0.9772 
1 1 1 7   49  6  o 15 2.40438e+01 9.10176e-01 4.04978e+02 302.869 2.56267e+01  -3.96596e+01 0.00000e+00 0.00000e+00 4.89784e+02 302.869 8.48066e+01 302.869 0.9894 
1 1 1 7   49  7  o 9  1.50440e+01 9.03901e-01 3.39641e+02 162.927 -2.84277e+01 8.73079e+00  0.00000e+00 0.00000e+00 2.16570e+02 162.927 1.23070e+02 342.927 0.9830 
1 1 1 7   49  8  o 19 1.72532e+01 9.90633e-01 3.49047e+02 334.322 3.66631e+01  -1.76276e+01 0.00000e+00 0.00000e+00 2.91709e+02 334.322 5.73380e+01 154.322 0.9876 
1 1 1 7   49  9  o 4  2.01787e+01 1.06132e+00 3.23542e+02 114.622 -2.19766e+01 4.79529e+01  0.00000e+00 0.00000e+00 4.27839e+02 114.622 1.04297e+02 114.622 0.9905 
1 1 1 7   49  10 o 8  6.09453e+00 1.32772e+00 1.30078e+02 25.846  5.95776e+00  2.88594e+00  0.00000e+00 0.00000e+00 8.08854e+01 25.846  4.91927e+01 205.846 0.9210 
1 1 1 7   49  11 o 12 1.83688e+01 9.27067e-01 3.41043e+02 76.603  1.62340e+01  6.81587e+01  0.00000e+00 0.00000e+00 3.44125e+02 76.603  3.08206e+00 76.603  0.9928 
1 1 1 7   49  12 f 0  5.67881e+00 1.51138e+00 1.10656e+02 257.047 -1.36376e+00 -5.92939e+00 0.00000e+00 0.00000e+00 8.41907e+01 257.047 2.64649e+01 77.047  0.9136 
1 1 1 7   49  13 o 6  4.18033e+00 1.32775e+00 1.45250e+02 159.463 -6.35262e+00 2.37987e+00  0.00000e+00 0.00000e+00 4.14444e-01 339.463 1.45664e+02 339.463 0.9230 
1 1 1 7   49  14 o 3  6.88370e+00 1.87597e+00 1.14186e+02 18.790  6.69337e+00  2.27733e+00  0.00000e+00 0.00000e+00 1.25029e+02 18.790  1.08436e+01 18.790  0.9263 
1 1 1 7   50  0  o 14 3.12099e+01 6.44844e-01 5.80822e+02 225.263 -3.65526e+01 -3.68892e+01 0.00000e+00 0.00000e+00 5.80914e+02 225.263 9.18929e-02 225.263 0.9903 
1 1 1 7   50  1  o 11 2.62976e+01 6.49275e-01 3.29764e+02 45.664  1.72977e+01  1.77032e+01  0.00000e+00 0.00000e+00 6.38747e+02 45.664  3.08984e+02 45.664  0.9796 
1 1 1 7   50  2  o 3  4.02898e+01 7.85787e-01 6.56815e+02 245.946 -3.30193e+01 -7.39746e+01 0.00000e+00 0.00000e+00 8.48846e+02 245.946 1.92031e+02 245.946 0.9938 
1 1 1 7   50  3  o 7  1.22521e+01 8.38018e-01 2.00989e+02 193.624 -7.72045e+00 -1.87117e+00 0.00000e+00 0.00000e+00 2.29732e+02 193.624 2.87434e+01 193.624 0.9348 
1 1 1 7   50  4  o 9  3.03503e+01 6.98279e-01 4.40255e+02 43.472  3.75876e+01  3.56338e+01  0.00000e+00 0.00000e+00 6.90175e+02 43.472  2.49920e+02 43.472  0.9903 
1 1 1 7   50  5  o 11 1.00045e+01 1.04723e+00 2.02057e+02 184.785 -8.70970e+00 -7.29136e-01 0.00000e+00 0.00000e+00 1.51997e+02 184.785 5.00598e+01 4.785   0.9409 
1 1 1 7   50  6  o 4  1.61767e+01 1.02529e+00 2.17434e+02 84.159  1.81508e+00  1.77424e+01  0.00000e+00 0.00000e+00 3.73651e+02 84.159  1.56218e+02 84.159  0.9715 
1 1 1 7   50  7  o 17 2.24428e+01 9.08106e-01 3.97531e+02 213.785 -4.38758e+01 -2.93554e+01 0.00000e+00 0.00000e+00 4.38396e+02 213.785 4.08655e+01 213.785 0.9905 
1 1 1 7   50  8  o 12 1.84826e+01 9.72338e-01 3.42558e+02 40.477  3.43271e+01  2.92941e+01  0.00000e+00 0.00000e+00 3.44615e+02 40.477  2.05765e+00 40.477  0.9889 
1 1 1 7   50  9  o 13 5.92317e+00 1.32034e+00 1.61502e+02 217.015 -5.63481e+00 -4.24841e+00 0.00000e+00 0.00000e+00 4.47063e+01 217.015 1.16796e+02 37.015  0.9262 
1 1 1 7   50  10 o 7  1.01959e+01 1.13283e+00 1.36047e+02 31.413  1.11899e+01  6.83388e+00  0.00000e+00 0.00000e+00 2.32182e+02 31.413  9.61346e+01 31.413  0.9611 
1 1 1 7   50  11 o 6  5.10039e+00 1.33273e+00 7.07439e+01 358.183 3.62707e+00  -1.15035e-01 0.00000e+00 0.00000e+00 9.16444e+01 358.183 2.09005e+01 358.183 0.8476 
1 1 1 7   50  12 o 15 6.47963e+00 1.53377e+00 5.72593e+01 283.917 8.43186e-01  -3.40272e+00 0.00000e+00 0.00000e+00 1.47455e+02 283.917 9.01958e+01 283.917 0.8414 
1 1 1 7   50  13 o 17 9.07695e+00 1.49730e+00 1.92232e+02 137.922 -1.35144e+01 1.22017e+01  0.00000e+00 0.00000e+00 1.38942e+02 137.922 5.32895e+01 317.922 0.9721 
1 1 1 7   50  14 o 5  4.64562e+00 1.46003e+00 5.78013e+01 98.689  -4.83265e-01 3.16229e+00  0.00000e+00 0.00000e+00 8.57334e+01 98.689  2.79321e+01 98.689  0.8237 
1 1 1 7   51  0  f 0  1.34992e+01 5.43796e-01 1.24583e+02 23.317  4.99208e+00  2.15168e+00  0.00000e+00 0.00000e+00 3.33329e+02 23.317  2.08746e+02 23.317  0.9026 
1 1 1 7   51  1  o 7  2.37174e+01 6.19903e-01 4.62043e+02 240.712 -1.71807e+01 -3.06306e+01 0.00000e+00 0.00000e+00 4.16737e+02 240.712 4.53060e+01 60.712  0.9857 
1 1 1 7   51  2  o 6  3.56292e+01 7.28624e-01 6.18605e+02 111.028 -2.50260e+01 6.51011e+01  0.00000e+00 0.00000e+00 7.11356e+02 111.028 9.27507e+01 111.028 0.9928 
1 1 1 7   51  3  o 18 1.73346e+01 5.97319e-01 3.27345e+02 71.825  6.28548e+00  1.91461e+01  0.00000e+00 0.00000e+00 3.08107e+02 71.825  1.92380e+01 251.825 0.9749 
1 1 1 7   51  4  o 13 2.67947e+01 6.68942e-01 4.39868e+02 59.066  2.58112e+01  4.30691e+01  0.00000e+00 0.00000e+00 5.57683e+02 59.066  1.17816e+02 59.066  0.9900 
1 1 1 7   51  5  o 13 2.89763e+01 8.45205e-01 4.98578e+02 309.481 4.31040e+01  -5.23253e+01 0.00000e+00 0.00000e+00 5.83042e+02 309.481 8.44645e+01 309.481 0.9926 
1 1 1 7   51  6  o 9  1.06287e+01 1.05448e+00 1.65032e+02 160.019 -9.06087e+00 3.29446e+00  0.00000e+00 0.00000e+00 2.13316e+02 160.019 4.82838e+01 160.019 0.9466 
1 1 1 7   51  7  o 5  2.66569e+01 9.33856e-01 5.61083e+02 258.797 -1.92736e+01 -9.73097e+01 0.00000e+00 0.00000e+00 4.36145e+02 258.797 1.24939e+02 78.797  0.9949 
1 1 1 7   51  8  o 9  6.27297e+00 1.40594e+00 1.19639e+02 285.100 1.24703e+00  -4.62173e+00 0.00000e+00 0.00000e+00 8.98163e+01 285.100 2.98226e+01 105.100 0.8882 
1 1 1 7   51  9  f 0  1.38134e+01 8.67872e-01 1.29493e+02 125.610 -9.36250e+00 1.30724e+01  0.00000e+00 0.00000e+00 3.73262e+02 125.610 2.43769e+02 125.610 0.9684 
1 1 1 7   51  10 o 5  8.50952e+00 1.19395e+00 1.80823e+02 29.999  1.16328e+01  6.71606e+00  0.00000e+00 0.00000e+00 1.26763e+02 29.999  5.40598e+01 209.999 0.9620 
1 1 1 7   51  11 o 16 9.36128e+00 1.33789e+00 1.51897e+02 340.919 1.30379e+01  -4.50991e+00 0.00000e+00 0.00000e+00 1.86715e+02 340.919 3.48176e+01 340.919 0.9630 
1 1 1 7   51  12 o 6  1.45852e+01 1.12737e+00 2.24829e+02 95.374  -3.99929e+00 4.25163e+01  0.00000e+00 0.00000e+00 3.16302e+02 95.374  9.14722e+01 95.374  0.9882 
1 1 1 7   51  13 o 9  4.45289e+00 1.39458e+00 1.17920e+02 245.704 -2.56857e+00 -5.68969e+00 0.00000e+00 0.00000e+00 3.51363e+01 245.704 8.27837e+01 65.704  0.9160 
1 1 1 7   51  14 o 1  5.37976e+00 1.68161e+00 1.08854e+02 9.065   5.70386e+00  9.10079e-01  0.00000e+00 0.00000e+00 7.44999e+01 9.065   3.43542e+01 189.065 0.9087 
1 1 1 7   52  0  o 15 3.44920e+01 6.53813e-01 6.89701e+02 260.603 -1.20045e+01 -7.25351e+01 0.00000e+00 0.00000e+00 5.97541e+02 260.603 9.21601e+01 80.603  0.9932 
1 1 1 7   52  1  o 10 3.23503e+01 6.35312e-01 6.05201e+02 229.672 -4.04433e+01 -4.76416e+01 0.00000e+00 0.00000e+00 6.00946e+02 229.672 4.25511e+00 49.672  0.9920 
1 1 1 7   52  2  o 16 4.16282e+01 8.05401e-01 6.53504e+02 34.361  7.26007e+01  4.96377e+01  0.00000e+00 0.00000e+00 9.02506e+02 34.361  2.49002e+02 34.361  0.9943 
1 1 1 7   52  3  f 0  2.52873e+01 6.38346e-01 3.88498e+02 163.522 -3.23591e+01 9.57194e+00  0.00000e+00 0.00000e+00 5.48058e+02 163.522 1.59560e+02 163.522 0.9851 
1 1 1 7   52  4  o 17 4.06001e+01 8.21298e-01 6.65919e+02 348.977 1.10347e+02  -2.14952e+01 0.00000e+00 0.00000e+00 8.53861e+02 348.977 1.87942e+02 348.977 0.9955 
1 1 1 7   52  5  o 3  4.44041e+01 1.06896e+00 7.63173e+02 232.802 -9.04358e+01 -1.19153e+02 0.00000e+00 0.00000e+00 9.00866e+02 232.802 1.37693e+02 232.802 0.9967 
1 1 1 7   52  6  f 0  2.26783e+01 8.48588e-01 3.23822e+02 335.469 3.70786e+01  -1.69220e+01 0.00000e+00 0.00000e+00 5.18327e+02 335.469 1.94506e+02 335.469 0.9877 
1 1 1 7   52  7  o 10 5.65917e+00 1.39623e+00 1.18067e+02 147.091 -3.42300e+00 2.21518e+00  0.00000e+00 0.00000e+00 6.62680e+01 147.091 5.17995e+01 327.091 0.8664 
1 1 1 7   52  8  o 14 1.04782e+01 1.21748e+00 1.14241e+02 327.313 7.34438e+00  -4.71273e+00 0.00000e+00 0.00000e+00 2.56307e+02 327.313 1.42067e+02 327.313 0.9408 
1 1 1 7   52  9  o 19 1.96278e+01 8.88121e-01 3.28427e+02 192.979 -5.68541e+01 -1.31036e+01 0.00000e+00 0.00000e+00 4.02815e+02 192.979 7.43878e+01 192.979 0.9914 
1 1 1 7   52  10 o 13 4.50551e+00 1.26256e+00 1.19465e+02 53.194  2.92268e+00  3.90595e+00  0.00000e+00 0.00000e+00 3.12600e+01 53.194  8.82047e+01 233.194 0.8905 
1 1 1 7   52  11 o 13 7.35475e+00 1.37540e+00 1.22339e+02 85.557  6.97212e-01  8.97227e+00  0.00000e+00 0.00000e+00 1.38032e+02 85.557  1.56924e+01 85.557  0.9427 
1 1 1 7   52  12 o 11 7.66543e+00 1.59110e+00 1.70227e+02 176.610 -1.27566e+01 7.55639e-01  0.00000e+00 0.00000e+00 1.06022e+02 176.610 6.42051e+01 356.610 0.9600 
1 1 1 7   52  13 o 17 6.67775e+00 1.77141e+00 1.30728e+02 316.869 5.76912e+00  -5.40458e+00 0.00000e+00 0.00000e+00 1.03394e+02 316.869 2.73342e+01 136.869 0.9344 
1 1 1 7   52  14 o 15 7.65464e+00 1.87326e+00 1.27500e+02 169.451 -8.75145e+00 1.62972e+00  0.00000e+00 0.00000e+00 1.42910e+02 169.451 1.54101e+01 169.451 0.9420 
1 1 1 7   53  0  o 18 3.30856e+01 6.37739e-01 5.93168e+02 117.468 -2.88055e+01 5.54099e+01  0.00000e+00 0.00000e+00 6.39900e+02 117.468 4.67322e+01 117.468 0.9920 
1 1 1 7   53  1  o 12 3.32995e+01 6.45073e-01 6.00159e+02 132.463 -4.42764e+01 4.83825e+01  0.00000e+00 0.00000e+00 6.41673e+02 132.463 4.15141e+01 132.463 0.9923 
1 1 1 7   53  2  o 3  1.95624e+01 1.18048e+00 3.16060e+02 19.248  1.93621e+01  6.76090e+00  0.00000e+00 0.00000e+00 4.01086e+02 19.248  8.50266e+01 19.248  0.9753 
1 1 1 7   53  3  o 5  1.46677e+01 6.21695e-01 3.55728e+02 245.936 -9.12687e+00 -2.04380e+01 0.00000e+00 0.00000e+00 1.83206e+02 245.936 1.72522e+02 65.936  0.9774 
1 1 1 7   53  4  o 5  3.32612e+01 8.75415e-01 5.09095e+02 258.371 -1.51646e+01 -7.36900e+01 0.00000e+00 0.00000e+00 7.33025e+02 258.371 2.23930e+02 258.371 0.9933 
1 1 1 7   53  5  o 3  1.75787e+01 8.17806e-01 3.16527e+02 12.315  2.66959e+01  5.82773e+00  0.00000e+00 0.00000e+00 3.32144e+02 12.315  1.56160e+01 12.315  0.9815 
1 1 1 7   53  6  o 9  9.05936e+00 9.37670e-01 1.55931e+02 234.622 -4.73354e+00 -6.66622e+00 0.00000e+00 0.00000e+00 1.63077e+02 234.622 7.14676e+00 234.622 0.9367 
1 1 1 7   53  7  o 15 1.86990e+01 9.17873e-01 3.25379e+02 140.922 -3.31298e+01 2.69027e+01  0.00000e+00 0.00000e+00 3.69213e+02 140.922 4.38340e+01 140.922 0.9882 
1 1 1 7   53  8  o 7  8.97388e+00 1.14241e+00 2.02722e+02 237.559 -7.36108e+00 -1.15810e+01 0.00000e+00 0.00000e+00 1.22007e+02 237.559 8.07154e+01 57.559  0.9628 
1 1 1 7   53  9  o 11 8.96685e+00 1.14910e+00 2.03109e+02 152.439 -1.46042e+01 7.62222e+00  0.00000e+00 0.00000e+00 1.23415e+02 152.439 7.96937e+01 332.439 0.9692 
1 1 1 7   53  10 o 6  3.47657e+00 1.08782e+00 7.56864e+01 312.972 1.82002e+00  -1.95367e+00 0.00000e+00 0.00000e+00 2.64721e+01 312.972 4.92143e+01 132.972 0.7823 
1 1 1 7   53  11 o 9  4.27386e+00 1.23547e+00 1.16433e+02 40.422  4.20905e+00  3.58496e+00  0.00000e+00 0.00000e+00 2.86969e+01 40.422  8.77357e+01 220.422 0.9044 
1 1 1 7   53  12 o 7  4.35160e+00 1.33426e+00 7.30884e+01 91.525  -9.60730e-02 3.60882e+00  0.00000e+00 0.00000e+00 6.51942e+01 91.525  7.89423e+00 271.525 0.8467 
1 1 1 7   53  13 o 11 1.42098e+01 1.61977e+00 2.50056e+02 328.629 3.16067e+01  -1.92705e+01 0.00000e+00 0.00000e+00 2.75773e+02 328.629 2.57162e+01 328.629 0.9864 
1 1 1 7   53  14 o 10 7.00429e+00 1.80784e+00 1.10583e+02 340.036 7.12760e+00  -2.58917e+00 0.00000e+00 0.00000e+00 1.34055e+02 340.036 2.34729e+01 340.036 0.9315 
1 1 1 7   54  0  o 9  1.74217e+01 5.41098e-01 2.97272e+02 306.740 1.02173e+01  -1.36876e+01 0.00000e+00 0.00000e+00 3.37727e+02 306.740 4.04548e+01 306.740 0.9703 
1 1 1 7   54  1  o 8  2.61017e+01 6.39414e-01 4.18196e+02 318.011 2.86931e+01  -2.58253e+01 0.00000e+00 0.00000e+00 5.49786e+02 318.011 1.31590e+02 318.011 0.9870 
1 1 1 7   54  2  o 14 2.60574e+01 5.98050e-01 4.45822e+02 213.211 -3.80544e+01 -2.49125e+01 0.00000e+00 0.00000e+00 5.22644e+02 213.211 7.68222e+01 213.211 0.9889 
1 1 1 7   54  3  o 11 2.06472e+01 6.91494e-01 3.88587e+02 336.427 3.11088e+01  -1.35734e+01 0.00000e+00 0.00000e+00 3.75960e+02 336.427 1.26265e+01 156.427 0.9852 
1 1 1 7   54  4  o 14 2.95419e+01 8.42770e-01 4.11010e+02 178.477 -5.69586e+01 1.51391e+00  0.00000e+00 0.00000e+00 6.89671e+02 178.477 2.78661e+02 178.477 0.9912 
1 1 1 7   54  5  o 15 1.49548e+01 8.09004e-01 2.43238e+02 193.766 -2.04351e+01 -5.00656e+00 0.00000e+00 0.00000e+00 3.05385e+02 193.766 6.21464e+01 193.766 0.9759 
1 1 1 7   54  6  o 1  4.87650e+00 1.16490e+00 6.75300e+01 198.541 -1.74542e+00 -5.85398e-01 0.00000e+00 0.00000e+00 5.52517e+01 198.541 1.22783e+01 18.541  0.6699 
1 1 1 7   54  7  o 10 6.57609e+00 1.15092e+00 1.59290e+02 333.995 6.08970e+00  -2.97082e+00 0.00000e+00 0.00000e+00 6.88169e+01 333.995 9.04727e+01 153.995 0.9229 
1 1 1 7   54  8  o 17 1.17859e+01 8.74569e-01 1.68969e+02 336.339 1.55990e+01  -6.83481e+00 0.00000e+00 0.00000e+00 2.60703e+02 336.339 9.17340e+01 336.339 0.9702 
1 1 1 7   54  9  o 8  6.04112e+00 1.25340e+00 1.05204e+02 185.903 -5.39923e+00 -5.58205e-01 0.00000e+00 0.00000e+00 9.96086e+01 185.903 5.59499e+00 5.903   0.9024 
1 1 1 7   54  10 o 19 9.08652e+00 1.13326e+00 1.55677e+02 336.004 1.39737e+01  -6.22028e+00 0.00000e+00 0.00000e+00 1.74232e+02 336.004 1.85549e+01 336.004 0.9667 
1 1 1 7   54  11 o 1  7.08300e+00 1.42180e+00 1.57292e+02 82.307  1.44551e+00  1.07010e+01  0.00000e+00 0.00000e+00 9.59974e+01 82.307  6.12948e+01 262.307 0.9525 
1 1 1 7   54  12 o 3  8.90419e+00 1.61298e+00 1.70758e+02 28.010  1.30048e+01  6.91772e+00  0.00000e+00 0.00000e+00 1.51844e+02 28.010  1.89143e+01 208.010 0.9654 
1 1 1 7   54  13 o 15 4.18690e+00 1.35881e+00 3.68171e+01 357.916 1.91809e+00  -6.97916e-02 0.00000e+00 0.00000e+00 7.06157e+01 357.916 3.37986e+01 357.916 0.6841 
1 1 1 7   54  14 o 11 5.13497e+00 1.57631e+00 2.07520e+02 219.079 -8.93650e+00 -7.25718e+00 0.00000e+00 0.00000e+00 2.35758e+01 39.079  2.31096e+02 39.079  0.9555 
1 1 1 7   55  0  o 5  1.87409e+01 5.28182e-01 1.78197e+02 50.171  7.42001e+00  8.89649e+00  0.00000e+00 0.00000e+00 4.94608e+02 50.171  3.16411e+02 50.171  0.9558 
1 1 1 7   55  1  o 15 6.38765e+00 7.95358e-01 8.83568e+01 158.873 -1.78077e+00 6.88099e-01  0.00000e+00 0.00000e+00 7.53731e+01 158.873 1.29837e+01 338.873 0.6823 
1 1 1 7   55  2  o 15 2.14577e+01 5.69337e-01 3.52369e+02 122.656 -1.75587e+01 2.73968e+01  0.00000e+00 0.00000e+00 4.41450e+02 122.656 8.90813e+01 122.656 0.9845 
1 1 1 7   55  3  o 10 1.54051e+01 6.21275e-01 3.25118e+02 280.553 4.01748e+00  -2.15639e+01 0.00000e+00 0.00000e+00 2.40474e+02 280.553 8.46438e+01 100.554 0.9769 
1 1 1 7   55  4  o 13 1.71025e+01 7.60024e-01 1.75350e+02 223.829 -1.00130e+01 -9.61195e+00 0.00000e+00 0.00000e+00 4.43825e+02 223.829 2.68475e+02 223.829 0.9633 
1 1 1 7   55  5  o 9  2.01569e+01 7.99460e-01 3.85930e+02 90.051  -3.82652e-02 4.32116e+01  0.00000e+00 0.00000e+00 3.62833e+02 90.051  2.30962e+01 270.051 0.9884 
1 1 1 7   55  6  o 5  1.17326e+01 9.58954e-01 2.41062e+02 243.561 -8.03487e+00 -1.61589e+01 0.00000e+00 0.00000e+00 1.87477e+02 243.561 5.35842e+01 63.562  0.9719 
1 1 1 7   55  7  o 8  6.77285e+00 1.36210e+00 1.54713e+02 247.769 -2.69050e+00 -6.58267e+00 0.00000e+00 0.00000e+00 8.11545e+01 247.769 7.35585e+01 67.769  0.9268 
1 1 1 7   55  8  o 13 9.80635e+00 1.04515e+00 1.98649e+02 335.546 1.43906e+01  -6.54410e+00 0.00000e+00 0.00000e+00 1.57937e+02 335.546 4.07122e+01 155.546 0.9678 
1 1 1 7   55  9  o 19 3.85432e+00 1.12691e+00 9.25115e+01 302.659 1.79311e+00  -2.79742e+00 0.00000e+00 0.00000e+00 2.78391e+01 302.659 6.46724e+01 122.659 0.8313 
1 1 1 7   55  10 o 5  1.59637e+01 9.30213e-01 3.48150e+02 170.531 -6.45799e+01 1.07714e+01  0.00000e+00 0.00000e+00 2.46709e+02 170.531 1.01442e+02 350.531 0.9923 
1 1 1 7   55  11 o 9  8.68198e+00 1.41760e+00 2.43748e+02 19.699  1.98327e+01  7.10072e+00  0.00000e+00 0.00000e+00 7.43210e+01 19.699  1.69427e+02 199.699 0.9760 
1 1 1 7   55  12 o 1  5.94323e+00 1.53756e+00 1.01058e+02 150.028 -5.26596e+00 3.03691e+00  0.00000e+00 0.00000e+00 1.02668e+02 150.028 1.60965e+00 150.028 0.9136 
1 1 1 7   55  13 o 6  1.18027e+01 1.69208e+00 2.16433e+02 297.778 1.15796e+01  -2.19834e+01 0.00000e+00 0.00000e+00 2.17210e+02 297.778 7.77099e-01 297.778 0.9797 
1 1 1 7   55  14 o 11 4.81912e+00 1.52508e+00 4.59358e+01 323.974 2.07361e+00  -1.50800e+00 0.00000e+00 0.00000e+00 9.34762e+01 323.974 4.75404e+01 323.974 0.7718 
1 1 1 7   56  0  o 8  1.12973e+01 6.75618e-01 1.15817e+02 87.770  1.97476e-01  5.07103e+00  0.00000e+00 0.00000e+00 2.63935e+02 87.770  1.48119e+02 87.770  0.8951 
1 1 1 7   56  1  o 12 1.37116e+01 5.52006e-01 1.11610e+02 95.169  -5.94590e-01 6.57284e+00  0.00000e+00 0.00000e+00 3.62639e+02 95.169  2.51029e+02 95.169  0.9208 
1 1 1 7   56  2  o 4  1.83601e+01 5.58621e-01 3.93196e+02 223.385 -2.24468e+01 -2.12161e+01 0.00000e+00 0.00000e+00 2.85345e+02 223.385 1.07851e+02 43.385  0.9837 
1 1 1 7   56  3  o 5  2.14901e+01 6.15190e-01 3.71306e+02 292.820 1.49741e+01  -3.55871e+01 0.00000e+00 0.00000e+00 4.25671e+02 292.820 5.43655e+01 292.820 0.9870 
1 1 1 7   56  4  f 0  1.74511e+01 7.50506e-01 1.99919e+02 108.259 -5.82542e+00 1.76564e+01  0.00000e+00 0.00000e+00 4.37974e+02 108.259 2.38055e+02 108.259 0.9727 
1 1 1 7   56  5  o 4  9.29062e+00 9.64518e-01 1.63972e+02 147.533 -6.96443e+00 4.43126e+00  0.00000e+00 0.00000e+00 1.63270e+02 147.533 7.01736e-01 327.533 0.9373 
1 1 1 7   56  6  f 0  3.28015e+00 1.00823e+00 1.13056e+02 239.019 -1.30458e+00 -2.17279e+00 0.00000e+00 0.00000e+00 1.83106e+01 59.019  1.31366e+02 59.019  0.7687 
1 1 1 7   56  7  o 13 1.22844e+01 1.02701e+00 1.51076e+02 89.405  1.37973e-01  1.32881e+01  0.00000e+00 0.00000e+00 2.92754e+02 89.405  1.41678e+02 89.405  0.9616 
1 1 1 7   56  8  o 1  2.31430e+01 7.52223e-01 3.67850e+02 338.284 7.34770e+01  -2.92637e+01 0.00000e+00 0.00000e+00 4.96015e+02 338.284 1.28165e+02 338.284 0.9937 
1 1 1 7   56  9  o 12 1.37010e+01 8.54942e-01 1.97904e+02 208.784 -2.48950e+01 -1.36771e+01 0.00000e+00 0.00000e+00 3.07517e+02 208.784 1.09613e+02 208.784 0.9822 
1 1 1 7   56  10 o 4  9.68766e+00 1.10797e+00 2.81382e+02 149.098 -2.42550e+01 1.45172e+01  0.00000e+00 0.00000e+00 7.58528e+01 149.098 2.05529e+02 329.098 0.9821 
1 1 1 7   56  11 o 5  6.57493e+00 1.50583e+00 7.06364e+01 43.509  3.32347e+00  3.15484e+00  0.00000e+00 0.00000e+00 1.47188e+02 43.509  7.65516e+01 43.509  0.8827 
1 1 1 7   56  12 o 3  3.72308e+00 1.20665e+00 5.65822e+01 291.474 9.74342e-01  -2.47675e+00 0.00000e+00 0.00000e+00 5.25716e+01 291.474 4.01056e+00 111.474 0.7815 
1 1 1 7   56  13 o 11 7.06278e+00 1.72857e+00 1.28959e+02 181.098 -9.07945e+00 -1.74072e-01 0.00000e+00 0.00000e+00 1.20844e+02 181.098 8.11456e+00 1.098   0.9432 
1 1 1 7   56  14 o 10 4.59354e+00 1.47434e+00 4.63202e+01 208.807 -2.28549e+00 -1.25683e+00 0.00000e+00 0.00000e+00 8.73202e+01 208.807 4.10000e+01 208.807 0.7763 
1 1 1 7   57  0  o 4  2.44438e+01 5.64798e-01 4.39891e+02 320.409 3.55835e+01  -2.94277e+01 0.00000e+00 0.00000e+00 4.67942e+02 320.409 2.80505e+01 320.409 0.9891 
1 1 1 7   57  1  o 15 3.04005e+01 6.16822e-01 6.22533e+02 145.074 -6.60473e+01 4.61193e+01  0.00000e+00 0.00000e+00 5.12135e+02 145.074 1.10397e+02 325.074 0.9938 
1 1 1 7   57  2  o 11 4.50285e+01 7.97148e-01 6.20959e+02 310.320 8.12250e+01  -9.57090e+01 0.00000e+00 0.00000e+00 1.06379e+03 310.320 4.42827e+02 310.320 0.9960 
1 1 1 7   57  3  o 2  2.27530e+01 6.95678e-01 3.30272e+02 100.265 -6.25667e+00 3.45479e+01  0.00000e+00 0.00000e+00 5.12293e+02 100.265 1.82020e+02 100.265 0.9857 
1 1 1 7   57  4  o 1  7.02507e+00 1.13345e+00 1.91298e+02 247.967 -2.72611e+00 -6.73630e+00 0.00000e+00 0.00000e+00 5.37521e+01 247.967 1.37546e+02 67.967  0.9284 
1 1 1 7   57  5  o 1  5.49530e+00 1.16805e+00 1.46340e+02 79.254  8.38887e-01  4.42029e+00  0.00000e+00 0.00000e+00 3.54195e+01 79.254  1.10921e+02 259.254 0.8803 
1 1 1 7   57  6  o 1  1.04972e+01 1.00445e+00 1.95020e+02 170.719 -1.38637e+01 2.26551e+00  0.00000e+00 0.00000e+00 1.85060e+02 170.719 9.96060e+00 350.719 0.9637 
1 1 1 7   57  7  o 1  1.30575e+01 7.68701e-01 2.92849e+02 343.512 3.03886e+01  -8.99477e+00 0.00000e+00 0.00000e+00 1.89872e+02 343.512 1.02977e+02 163.512 0.9841 
1 1 1 7   57  8  o 1  9.89354e+00 9.43237e-01 1.38529e+02 216.847 -9.73729e+00 -7.29680e+00 0.00000e+00 0.00000e+00 2.17456e+02 216.847 7.89266e+01 216.847 0.9580 
1 1 1 7   57  9  o 8  9.50955e+00 1.02987e+00 1.33186e+02 144.148 -9.52411e+00 6.88215e+00  0.00000e+00 0.00000e+00 2.08355e+02 144.148 7.51687e+01 144.148 0.9565 
1 1 1 7   57  10 o 10 7.29875e+00 1.37301e+00 1.66725e+02 195.167 -1.12096e+01 -3.03867e+00 0.00000e+00 0.00000e+00 9.51917e+01 195.167 7.15337e+01 15.167  0.9559 
1 1 1 7   57  11 f 0  4.29706e+00 1.25847e+00 1.55552e+02 315.679 5.23171e+00  -5.10918e+00 0.00000e+00 0.00000e+00 5.77097e+00 135.679 1.61323e+02 135.679 0.9289 
1 1 1 7   57  12 o 3  5.02591e+00 1.44802e+00 1.06140e+02 98.463  -8.90498e-01 5.98482e+00  0.00000e+00 0.00000e+00 6.60086e+01 98.463  4.01311e+01 278.463 0.9131 
1 1 1 7   57  13 o 11 6.56060e+00 1.71355e+00 1.12887e+02 359.214 7.64692e+00  -1.04881e-01 0.00000e+00 0.00000e+00 1.16388e+02 359.214 3.50082e+00 359.214 0.9321 
1 1 1 7   57  14 o 7  5.55339e+00 1.60624e+00 2.75704e+01 353.285 1.71908e+00  -2.02414e-01 0.00000e+00 0.00000e+00 1.07331e+02 353.285 7.97605e+01 353.285 0.6483 
1 1 1 7   58  0  o 14 2.61554e+01 5.86214e-01 3.42736e+02 245.615 -1.62781e+01 -3.59101e+01 0.00000e+00 0.00000e+00 6.26670e+02 245.615 2.83934e+02 245.615 0.9872 
1 1 1 7   58  1  o 11 1.91938e+01 5.51064e-01 3.61080e+02 37.156  2.55184e+01  1.93388e+01  0.00000e+00 0.00000e+00 3.48336e+02 37.156  1.27443e+01 217.156 0.9843 
1 1 1 7   58  2  o 3  7.20989e+00 9.97849e-01 1.04762e+02 191.032 -3.39058e+00 -6.61045e-01 0.00000e+00 0.00000e+00 1.22351e+02 191.032 1.75892e+01 191.032 0.8387 
1 1 1 7   58  3  o 16 1.12808e+01 7.40854e-01 1.50019e+02 47.461  5.68212e+00  6.19254e+00  0.00000e+00 0.00000e+00 2.47659e+02 47.461  9.76401e+01 47.461  0.9385 
1 1 1 7   58  4  o 3  8.78572e+00 9.40997e-01 1.67178e+02 222.588 -5.84729e+00 -5.37464e+00 0.00000e+00 0.00000e+00 1.41333e+02 222.588 2.58452e+01 42.588  0.9347 
1 1 1 7   58  5  o 17 4.98756e+00 1.21318e+00 1.09819e+02 94.522  -2.58750e-01 3.27196e+00  0.00000e+00 0.00000e+00 4.54820e+01 94.522  6.43365e+01 274.522 0.8289 
1 1 1 7   58  6  o 16 1.71952e+01 8.42215e-01 3.63729e+02 119.439 -2.14783e+01 3.80569e+01  0.00000e+00 0.00000e+00 2.74769e+02 119.439 8.89592e+01 299.439 0.9885 
1 1 1 7   58  7  o 13 8.98907e+00 9.33500e-01 1.63256e+02 340.503 1.16547e+01  -4.12634e+00 0.00000e+00 0.00000e+00 1.60421e+02 340.503 2.83553e+00 160.504 0.9587 
1 1 1 7   58  8  o 1  3.74234e+00 1.09419e+00 9.96594e+00 277.540 4.52205e-02  -3.41630e-01 0.00000e+00 0.00000e+00 1.38972e+01 277.540 3.93123e+00 277.540 0.1698 
1 1 1 7   58  9  o 10 1.54452e+01 9.67341e-01 2.55615e+02 202.024 -3.73174e+01 -1.50952e+01 0.00000e+00 0.00000e+00 3.17024e+02 202.024 6.14090e+01 202.024 0.9875 
1 1 1 7   58  10 f 0  7.75687e+00 1.38436e+00 1.73565e+02 124.477 -7.59158e+00 1.10553e+01  0.00000e+00 0.00000e+00 1.06504e+02 124.477 6.70613e+01 304.477 0.9620 
1 1 1 7   58  11 o 12 4.59352e+00 1.33984e+00 1.26772e+02 290.941 2.40219e+00  -6.27708e+00 0.00000e+00 0.00000e+00 3.21825e+01 290.941 9.45892e+01 110.941 0.9223 
1 1 1 7   58  12 o 16 3.75267e+00 1.23655e+00 7.38730e+01 129.178 -2.12171e+00 2.60347e+00  0.00000e+00 0.00000e+00 4.34153e+01 129.178 3.04577e+01 309.178 0.8334 
1 1 1 7   58  13 o 16 5.12942e+00 1.57114e+00 8.78499e+01 139.756 -3.81230e+00 3.22667e+00  0.00000e+00 0.00000e+00 8.39083e+01 139.756 3.94160e+00 319.756 0.8933 
1 1 1 7   58  14 o 3  5.48780e+00 1.61909e+00 1.47556e+02 33.510  7.63510e+00  5.05539e+00  0.00000e+00 0.00000e+00 4.64757e+01 33.510  1.01080e+02 213.510 0.9437 
1 1 1 7   59  0  o 7  1.72808e+01 7.00721e-01 2.54755e+02 308.842 1.25106e+01  -1.55366e+01 0.00000e+00 0.00000e+00 3.77431e+02 308.842 1.22676e+02 308.842 0.9746 
1 1 1 7   59  1  o 19 1.41120e+01 5.69680e-01 1.55096e+02 340.899 1.00376e+01  -3.47597e+00 0.00000e+00 0.00000e+00 3.49158e+02 340.899 1.94061e+02 340.899 0.9517 
1 1 1 7   59  2  o 17 1.06368e+01 6.81855e-01 2.07208e+02 176.101 -1.02624e+01 6.99380e-01  0.00000e+00 0.00000e+00 1.72293e+02 176.101 3.49141e+01 356.101 0.9501 
1 1 1 7   59  3  o 3  9.84610e+00 8.10709e-01 2.20433e+02 27.810  1.10942e+01  5.85174e+00  0.00000e+00 0.00000e+00 1.34303e+02 27.810  8.61296e+01 207.810 0.9593 
1 1 1 7   59  4  o 5  1.69869e+01 7.13968e-01 3.39358e+02 237.986 -1.84343e+01 -2.94846e+01 0.00000e+00 0.00000e+00 2.89436e+02 237.986 4.99225e+01 57.986  0.9855 
1 1 1 7   59  5  o 7  8.13894e+00 1.09232e+00 1.11933e+02 204.536 -5.27106e+00 -2.40618e+00 0.00000e+00 0.00000e+00 1.65964e+02 204.536 5.40304e+01 204.536 0.9090 
1 1 1 7   59  6  o 10 1.33251e+01 9.06799e-01 2.11358e+02 256.494 -5.13613e+00 -2.13841e+01 0.00000e+00 0.00000e+00 2.77603e+02 256.494 6.62445e+01 256.494 0.9770 
1 1 1 7   59  7  f 0  9.11804e+00 1.01376e+00 2.38860e+02 79.962  3.11137e+00  1.75769e+01  0.00000e+00 0.00000e+00 9.38279e+01 79.962  1.45032e+02 259.962 0.9716 
1 1 1 7   59  8  o 15 1.35367e+01 9.44384e-01 2.82292e+02 217.420 -2.90833e+01 -2.22520e+01 0.00000e+00 0.00000e+00 2.18991e+02 217.420 6.33014e+01 37.420  0.9863 
1 1 1 7   59  9  o 8  1.43023e+01 9.91199e-01 3.05651e+02 60.638  2.37411e+01  4.21983e+01  0.00000e+00 0.00000e+00 2.25666e+02 60.638  7.99857e+01 240.638 0.9896 
1 1 1 7   59  10 o 12 8.65056e+00 1.34601e+00 1.21535e+02 197.929 -1.01973e+01 -3.29936e+00 0.00000e+00 0.00000e+00 1.87563e+02 197.929 6.60275e+01 197.929 0.9521 
1 1 1 7   59  11 o 2  4.13123e+00 1.25973e+00 3.30906e+01 24.908  1.47740e+00  6.86025e-01  0.00000e+00 0.00000e+00 6.39920e+01 24.908  3.09014e+01 24.908  0.6264 
1 1 1 7   59  12 o 9  4.51573e+00 1.39202e+00 2.30059e+01 182.168 -1.18168e+00 -4.47319e-02 0.00000e+00 0.00000e+00 6.29028e+01 182.168 3.98969e+01 182.168 0.5073 
1 1 1 7   59  13 o 16 1.06117e+01 1.77725e+00 1.61109e+02 318.536 1.19101e+01  -1.05239e+01 0.00000e+00 0.00000e+00 2.23899e+02 318.536 6.27904e+01 318.536 0.9680 
1 1 1 7   59  14 o 1  4.86364e+00 1.53295e+00 5.80679e+01 167.912 -3.39523e+00 7.27103e-01  0.00000e+00 0.00000e+00 9.49076e+01 167.912 3.68397e+01 167.912 0.8396 
1 1 1 7   60  0  o 9  1.75285e+01 6.23878e-01 3.25158e+02 311.471 1.77922e+01  -2.01307e+01 0.00000e+00 0.00000e+00 3.20331e+02 311.471 4.82709e+00 131.471 0.9812 
1 1 1 7   60  1  o 8  9.13477e+00 8.03445e-01 1.60007e+02 165.080 -6.48923e+00 1.72905e+00  0.00000e+00 0.00000e+00 1.56235e+02 165.080 3.77272e+00 345.080 0.9222 
1 1 1 7   60  2  o 2  2.90202e+01 9.46596e-01 4.91751e+02 147.872 -6.22235e+01 3.90757e+01  0.00000e+00 0.00000e+00 5.90425e+02 147.872 9.86743e+01 147.872 0.9932 
1 1 1 7   60  3  o 7  4.27449e+01 1.22501e+00 6.41866e+02 339.512 1.30869e+02  -4.88978e+01 0.00000e+00 0.00000e+00 9.57524e+02 339.512 3.15658e+02 339.512 0.9964 
1 1 1 7   60  4  o 11 1.16114e+01 8.89369e-01 1.84775e+02 128.778 -7.98522e+00 9.93939e+00  0.00000e+00 0.00000e+00 2.33818e+02 128.778 4.90425e+01 128.778 0.9599 
1 1 1 7   60  6  f 0  4.61503e+00 1.18337e+00 1.34261e+02 84.716  3.89979e-01  4.21689e+00  0.00000e+00 0.00000e+00 1.68588e+01 84.716  1.17402e+02 264.716 0.8720 
1 1 1 7   60  7  o 12 8.20059e+00 1.11884e+00 1.53462e+02 282.417 2.13964e+00  -9.71767e+00 0.00000e+00 0.00000e+00 1.38547e+02 282.417 1.49146e+01 102.417 0.9483 
1 1 1 7   60  8  f 0  4.11335e+00 1.19469e+00 1.30151e+02 124.935 -2.77916e+00 3.97870e+00  0.00000e+00 0.00000e+00 7.26360e+00 124.935 1.22887e+02 304.935 0.8899 
1 1 1 7   60  9  o 8  9.70652e+00 1.20339e+00 2.12641e+02 57.924  1.14556e+01  1.82789e+01  0.00000e+00 0.00000e+00 1.43124e+02 57.924  6.95176e+01 237.924 0.9765 
1 1 1 7   60  10 o 15 8.16618e+00 1.33074e+00 1.31236e+02 286.673 3.12292e+00  -1.04268e+01 0.00000e+00 0.00000e+00 1.60737e+02 286.673 2.95010e+01 286.673 0.9529 
1 1 1 7   60  11 o 19 1.33265e+01 1.22007e+00 2.49924e+02 2.198   4.02513e+01  1.54504e+00  0.00000e+00 0.00000e+00 2.43682e+02 2.198   6.24189e+00 182.198 0.9875 
1 1 1 7   60  12 o 16 8.19571e+00 1.58349e+00 1.06735e+02 105.323 -2.46534e+00 8.99760e+00  0.00000e+00 0.00000e+00 1.83574e+02 105.323 7.68391e+01 105.323 0.9448 
1 1 1 7   60  13 o 14 8.13691e+00 1.84438e+00 1.50742e+02 127.581 -6.95105e+00 9.03226e+00  0.00000e+00 0.00000e+00 1.40482e+02 127.581 1.02599e+01 307.581 0.9551 
1 1 1 7   60  14 o 11 3.82492e+00 1.29248e+00 5.69316e+01 307.034 1.94137e+00  -2.57307e+00 0.00000e+00 0.00000e+00 6.12889e+01 307.034 4.35722e+00 307.034 0.8252 
1 1 1 7   61  0  o 18 2.44393e+01 6.76379e-01 3.23908e+02 82.142  5.42269e+00  3.92885e+01  0.00000e+00 0.00000e+00 5.81518e+02 82.142  2.57611e+02 82.142  0.9873 
1 1 1 7   61  1  o 12 3.75853e+01 8.46094e-01 5.88431e+02 213.533 -9.65935e+01 -6.40147e+01 0.00000e+00 0.00000e+00 8.16176e+02 213.533 2.27745e+02 213.533 0.9957 
1 1 1 7   61  2  o 17 5.58037e+00 1.14019e+00 9.67950e+01 97.858  -3.97962e-01 2.88359e+00  0.00000e+00 0.00000e+00 7.14633e+01 97.858  2.53316e+01 277.858 0.8032 
1 1 1 7   61  3  o 16 1.45536e+01 9.28328e-01 2.17251e+02 47.763  1.15824e+01  1.27572e+01  0.00000e+00 0.00000e+00 3.13072e+02 47.763  9.58207e+01 47.763  0.9705 
1 1 1 7   61  4  o 19 1.68170e+01 1.18068e+00 2.79795e+02 86.262  1.85063e+00  2.83296e+01  0.00000e+00 0.00000e+00 3.40430e+02 86.262  6.06344e+01 86.262  0.9822 
1 1 1 7   61  5  o 12 1.06887e+01 1.22361e+00 2.65198e+02 250.129 -6.10502e+00 -1.68917e+01 0.00000e+00 0.00000e+00 1.24808e+02 250.129 1.40390e+02 70.129  0.9718 
1 1 1 7   61  6  o 4  5.32532e+00 1.13471e+00 1.06348e+02 64.949  1.81455e+00  3.88223e+00  0.00000e+00 0.00000e+00 6.83374e+01 64.949  3.80108e+01 244.949 0.8737 
1 1 1 7   61  7  o 18 1.29458e+01 9.07291e-01 1.82085e+02 222.264 -1.56680e+01 -1.42387e+01 0.00000e+00 0.00000e+00 2.92306e+02 222.264 1.10221e+02 222.264 0.9761 
1 1 1 7   61  8  o 9  2.76057e+01 8.95539e-01 3.99602e+02 83.486  1.29193e+01  1.13142e+02  0.00000e+00 0.00000e+00 6.32031e+02 83.486  2.32429e+02 83.486  0.9956 
1 1 1 7   61  9  o 13 1.71561e+01 9.54077e-01 2.58627e+02 311.433 3.24773e+01  -3.67951e+01 0.00000e+00 0.00000e+00 3.78588e+02 311.433 1.19962e+02 311.433 0.9898 
1 1 1 7   61  10 o 7  3.65071e+00 1.14135e+00 8.49489e+01 12.338  3.47385e+00  7.59838e-01  0.00000e+00 0.00000e+00 3.06398e+01 12.338  5.43091e+01 192.338 0.8440 
1 1 1 7   61  11 o 2  5.26496e+00 1.38767e+00 7.30060e+01 16.336  4.07055e+00  1.19306e+00  0.00000e+00 0.00000e+00 9.92091e+01 16.336  2.62032e+01 16.336  0.8722 
1 1 1 7   61  12 o 4  6.11288e+00 1.56012e+00 1.72395e+02 238.680 -5.90989e+00 -9.71237e+00 0.00000e+00 0.00000e+00 4.64312e+01 238.680 1.25963e+02 58.680  0.9550 
1 1 1 7   61  13 o 16 7.22908e+00 1.81873e+00 1.94668e+02 184.500 -1.36348e+01 -1.07309e+00 0.00000e+00 0.00000e+00 6.60931e+01 184.500 1.28575e+02 4.500   0.9627 
1 1 1 7   62  0  f 0  1.37788e+01 9.75711e-01 1.22684e+02 243.398 -3.86413e+00 -7.71594e+00 0.00000e+00 0.00000e+00 3.63319e+02 243.398 2.40635e+02 243.398 0.9401 
1 1 1 7   62  1  o 2  6.91019e+00 9.66962e-01 2.08795e+02 322.994 6.44633e+00  -4.85865e+00 0.00000e+00 0.00000e+00 3.38864e+01 322.994 1.74909e+02 142.994 0.9358 
1 1 1 7   62  2  o 15 1.80441e+01 8.77208e-01 2.07373e+02 100.678 -3.82260e+00 2.02728e+01  0.00000e+00 0.00000e+00 4.53277e+02 100.678 2.45903e+02 100.678 0.9755 
1 1 1 7   62  3  o 3  3.18536e+01 1.01701e+00 4.98740e+02 341.544 8.71886e+01  -2.90977e+01 0.00000e+00 0.00000e+00 6.90495e+02 341.544 1.91756e+02 341.544 0.9945 
1 1 1 7   62  4  o 16 6.86296e+00 1.59195e+00 1.62983e+02 71.753  2.00148e+00  6.07082e+00  0.00000e+00 0.00000e+00 7.35514e+01 71.753  8.94314e+01 251.753 0.9181 
1 1 1 7   62  5  o 19 1.76181e+01 1.10228e+00 3.32216e+02 140.889 -3.35459e+01 2.72731e+01  0.00000e+00 0.00000e+00 3.21510e+02 140.889 1.07057e+01 320.888 0.9884 
1 1 1 7   62  6  o 9  6.66391e+00 1.09848e+00 1.69562e+02 62.996  4.09757e+00  8.04068e+00  0.00000e+00 0.00000e+00 6.63044e+01 62.996  1.03258e+02 242.996 0.9429 
1 1 1 7   62  7  o 16 4.33147e+00 1.22368e+00 1.10517e+02 216.052 -3.11859e+00 -2.27012e+00 0.00000e+00 0.00000e+00 2.89486e+01 216.052 8.15686e+01 36.052  0.8578 
1 1 1 7   62  8  o 9  9.85187e+00 1.05174e+00 1.53771e+02 27.456  1.23596e+01  6.42205e+00  0.00000e+00 0.00000e+00 2.02430e+02 27.456  4.86593e+01 27.456  0.9634 
1 1 1 7   62  9  o 14 8.73462e+00 1.29779e+00 1.27536e+02 295.767 4.95317e+00  -1.02610e+01 0.00000e+00 0.00000e+00 1.85458e+02 295.767 5.79220e+01 295.767 0.9551 
1 1 1 7   62  10 o 8  3.97943e+00 1.19379e+00 3.11771e+01 334.861 1.28846e+00  -6.04628e-01 0.00000e+00 0.00000e+00 5.48865e+01 334.861 2.37094e+01 334.861 0.5766 
1 1 1 7   62  11 o 7  8.99622e+00 1.45302e+00 1.44964e+02 218.746 -1.11312e+01 -8.93254e+00 0.00000e+00 0.00000e+00 1.80312e+02 218.746 3.53480e+01 218.746 0.9643 
1 1 1 7   62  12 o 15 4.13974e+00 1.30261e+00 7.47744e+01 350.141 3.76785e+00  -6.54839e-01 0.00000e+00 0.00000e+00 5.81032e+01 350.141 1.66711e+01 170.141 0.8564 
1 1 1 7   62  13 o 18 7.77278e+00 1.75157e+00 1.35593e+02 59.790  5.29584e+00  9.09535e+00  0.00000e+00 0.00000e+00 1.41390e+02 59.790  5.79696e+00 59.790  0.9512 
1 1 1 7   63  0  o 14 9.48295e+00 7.61460e-01 1.94441e+02 105.901 -2.81933e+00 9.89654e+00  0.00000e+00 0.00000e+00 1.43525e+02 105.901 5.09160e+01 285.901 0.9501 
1 1 1 7   63  1  o 14 2.08963e+01 8.32984e-01 3.16765e+02 44.531  2.62130e+01  2.57877e+01  0.00000e+00 0.00000e+00 4.56543e+02 44.531  1.39778e+02 44.531  0.9863 
1 1 1 7   63  2  o 10 1.02405e+01 1.01353e+00 2.52221e+02 230.976 -9.24202e+00 -1.14034e+01 0.00000e+00 0.00000e+00 1.18752e+02 230.976 1.33469e+02 50.976  0.9653 
1 1 1 7   63  3  f 0  1.14818e+01 7.75238e-01 2.30651e+02 122.256 -9.36833e+00 1.48442e+01  0.00000e+00 0.00000e+00 1.87830e+02 122.256 4.28211e+01 302.256 0.9711 
1 1 1 7   63  4  o 6  1.45294e+01 1.36701e+00 3.17731e+02 51.157  1.78643e+01  2.21849e+01  0.00000e+00 0.00000e+00 2.17974e+02 51.157  9.97570e+01 231.157 0.9823 
1 1 1 7   63  5  o 4  1.47669e+01 1.13234e+00 2.58057e+02 321.936 2.08239e+01  -1.63066e+01 0.00000e+00 0.00000e+00 2.85645e+02 321.936 2.75876e+01 321.936 0.9809 
1 1 1 7   63  6  o 11 9.55498e+00 9.74250e-01 1.55885e+02 234.411 -7.18741e+00 -1.00435e+01 0.00000e+00 0.00000e+00 1.87907e+02 234.411 3.20219e+01 234.411 0.9586 
1 1 1 7   63  7  o 7  1.90162e+01 1.08702e+00 3.03088e+02 80.565  8.60717e+00  5.17977e+01  0.00000e+00 0.00000e+00 4.03747e+02 80.565  1.00659e+02 80.565  0.9904 
1 1 1 7   63  8  o 12 9.23201e+00 1.09335e+00 1.48653e+02 280.338 2.49488e+00  -1.36764e+01 0.00000e+00 0.00000e+00 1.85055e+02 280.338 3.64027e+01 280.338 0.9633 
1 1 1 7   63  9  o 12 8.43310e+00 1.24259e+00 1.43006e+02 248.033 -4.83180e+00 -1.19791e+01 0.00000e+00 0.00000e+00 1.60847e+02 248.033 1.78419e+01 248.033 0.9605 
1 1 1 7   63  10 o 3  1.41126e+01 1.12158e+00 3.19219e+02 177.014 -5.27116e+01 2.74940e+00  0.00000e+00 0.00000e+00 2.05003e+02 177.014 1.14216e+02 357.014 0.9905 
1 1 1 7   63  11 o 18 8.26977e+00 1.52356e+00 2.22476e+02 287.740 5.60734e+00  -1.75280e+01 0.00000e+00 0.00000e+00 7.90059e+01 287.740 1.43470e+02 107.740 0.9724 
1 1 1 7   63  12 o 16 7.57692e+00 1.57991e+00 2.06827e+02 91.154  -3.46551e-01 1.72012e+01  0.00000e+00 0.00000e+00 6.87261e+01 91.154  1.38101e+02 271.154 0.9705 
1 1 1 7   63  13 o 11 4.20608e+00 1.34313e+00 5.46630e+01 137.451 -2.24295e+00 2.05884e+00  0.00000e+00 0.00000e+00 7.34530e+01 137.451 1.87900e+01 137.451 0.8132 
1 1 1 7   64  0  o 12 8.72996e+00 7.31353e-01 1.97243e+02 110.362 -3.37523e+00 9.09415e+00  0.00000e+00 0.00000e+00 1.12806e+02 110.362 8.44367e+01 290.362 0.9470 
1 1 1 7   64  1  o 8  1.54725e+01 8.59430e-01 3.03514e+02 244.397 -1.18946e+01 -2.48228e+01 0.00000e+00 0.00000e+00 2.66280e+02 244.397 3.72343e+01 64.397  0.9817 
1 1 1 7   64  2  o 7  1.47761e+01 8.38654e-01 2.05594e+02 52.386  1.21645e+01  1.57877e+01  0.00000e+00 0.00000e+00 3.34731e+02 52.386  1.29137e+02 52.386  0.9746 
1 1 1 7   64  3  o 13 1.22845e+01 1.02295e+00 1.45927e+02 182.207 -1.21780e+01 -4.69401e-01 0.00000e+00 0.00000e+00 2.95727e+02 182.207 1.49799e+02 182.207 0.9581 
1 1 1 7   64  4  o 5  1.07895e+01 1.05655e+00 2.29920e+02 90.544  -1.64114e-01 1.72910e+01  0.00000e+00 0.00000e+00 1.63108e+02 90.544  6.68124e+01 270.544 0.9706 
1 1 1 7   64  5  o 4  1.22982e+01 7.90498e-01 2.23629e+02 49.144  1.50253e+01  1.73723e+01  0.00000e+00 0.00000e+00 2.27751e+02 49.144  4.12179e+00 49.144  0.9780 
1 1 1 7   64  6  o 9  1.55220e+01 7.96135e-01 3.33257e+02 284.879 1.21817e+01  -4.58492e+01 0.00000e+00 0.00000e+00 2.43063e+02 284.879 9.01940e+01 104.879 0.9894 
1 1 1 7   64  7  o 14 9.50608e+00 1.26414e+00 9.36903e+01 104.384 -1.94913e+00 7.59991e+00  0.00000e+00 0.00000e+00 2.39429e+02 104.384 1.45739e+02 104.384 0.9339 
1 1 1 7   64  8  o 2  3.89948e+00 1.12459e+00 8.11323e+01 271.969 1.13626e-01  -3.30423e+00 0.00000e+00 0.00000e+00 4.03349e+01 271.969 4.07974e+01 91.970  0.8303 
1 1 1 7   64  9  f 0  6.68143e+00 1.36156e+00 8.20846e+01 298.606 2.65573e+00  -4.86977e+00 0.00000e+00 0.00000e+00 1.44632e+02 298.606 6.25473e+01 298.606 0.9047 
1 1 1 7   64  10 o 15 4.41206e+00 1.26621e+00 8.88852e+01 73.930  1.28269e+00  4.45261e+00  0.00000e+00 0.00000e+00 5.73807e+01 73.930  3.15045e+01 253.930 0.8841 
1 1 1 7   64  11 o 15 5.39821e+00 1.42043e+00 7.91242e+01 16.226  4.47415e+00  1.30206e+00  0.00000e+00 0.00000e+00 9.99141e+01 16.226  2.07899e+01 16.226  0.8848 
1 1 1 7   64  12 o 3  1.29818e+01 1.34830e+00 2.43141e+02 97.804  -5.40780e+00 3.94581e+01  0.00000e+00 0.00000e+00 2.37100e+02 97.804  6.04092e+00 277.804 0.9874 
1 1 1 7   64  13 o 9  3.63875e+00 1.22553e+00 1.20136e+02 7.499   6.35453e+00  8.36467e-01  0.00000e+00 0.00000e+00 4.99536e+00 7.499   1.15141e+02 187.499 0.9183 
1 1 1 7   65  0  o 1  1.89329e+01 5.50326e-01 3.03530e+02 311.299 2.38100e+01  -2.71031e+01 0.00000e+00 0.00000e+00 3.96509e+02 311.299 9.29797e+01 311.299 0.9860 
1 1 1 7   65  1  o 18 1.62085e+01 8.17486e-01 3.26522e+02 7.139   3.45869e+01  4.33165e+00  0.00000e+00 0.00000e+00 2.72633e+02 7.139   5.38881e+01 187.139 0.9855 
1 1 1 7   65  2  o 15 8.55533e+00 1.00848e+00 1.65786e+02 63.839  4.06107e+00  8.26754e+00  0.00000e+00 0.00000e+00 1.37207e+02 63.839  2.85789e+01 243.839 0.9440 
1 1 1 7   65  3  o 2  1.80500e+01 1.06452e+00 3.46787e+02 7.803   4.18091e+01  5.72964e+00  0.00000e+00 0.00000e+00 3.22371e+02 7.803   2.44159e+01 187.803 0.9881 
1 1 1 7   65  4  o 15 1.74895e+01 9.95015e-01 3.28414e+02 235.206 -2.49093e+01 -3.58482e+01 0.00000e+00 0.00000e+00 3.20268e+02 235.206 8.14557e+00 55.206  0.9885 
1 1 1 7   65  5  o 6  7.41963e+00 1.01000e+00 1.71597e+02 92.307  -4.20861e-01 1.04488e+01  0.00000e+00 0.00000e+00 9.31393e+01 92.307  7.84580e+01 272.307 0.9509 
1 1 1 7   65  6  o 5  4.78043e+00 1.04924e+00 1.32735e+02 329.699 4.70372e+00  -2.74868e+00 0.00000e+00 0.00000e+00 2.91999e+01 329.699 1.03535e+02 149.700 0.9028 
1 1 1 7   65  7  o 3  9.04696e+00 1.33927e+00 1.94295e+02 106.754 -4.38706e+00 1.45730e+01  0.00000e+00 0.00000e+00 1.33764e+02 106.754 6.05306e+01 286.754 0.9666 
1 1 1 7   65  8  o 4  4.22308e+00 1.14847e+00 9.89962e+01 93.168  -2.47259e-01 4.46695e+00  0.00000e+00 0.00000e+00 4.03303e+01 93.168  5.86659e+01 273.168 0.8796 
1 1 1 7   65  9  o 2  1.35275e+01 1.00493e+00 2.83620e+02 173.089 -4.52382e+01 5.48316e+00  0.00000e+00 0.00000e+00 2.18072e+02 173.089 6.55480e+01 353.089 0.9890 
1 1 1 7   65  10 o 1  4.32445e+00 1.23987e+00 7.42434e+01 74.972  1.00202e+00  3.73228e+00  0.00000e+00 0.00000e+00 6.48726e+01 74.972  9.37072e+00 254.972 0.8581 
1 1 1 7   65  11 o 14 3.53347e+00 1.13241e+00 9.14489e+01 37.812  3.55714e+00  2.76040e+00  0.00000e+00 0.00000e+00 2.51345e+01 37.812  6.63143e+01 217.812 0.8804 
1 1 1 7   65  12 o 19 4.52473e+00 1.38315e+00 4.01743e+01 119.895 -1.13438e+00 1.97312e+00  0.00000e+00 0.00000e+00 8.49598e+01 119.895 4.47855e+01 119.895 0.7383 
1 1 1 7   65  13 o 5  3.89749e+00 1.30459e+00 3.64368e+01 319.670 1.52102e+00  -1.29128e+00 0.00000e+00 0.00000e+00 6.52748e+01 319.670 2.88380e+01 319.670 0.6970 
1 1 1 7   66  0  o 15 1.69542e+01 7.09092e-01 2.68417e+02 352.945 3.02638e+01  -3.74516e+00 0.00000e+00 0.00000e+00 3.56708e+02 352.945 8.82903e+01 352.945 0.9835 
1 1 1 7   66  1  o 4  5.72842e+00 1.08453e+00 9.83721e+01 343.713 3.44442e+00  -1.00637e+00 0.00000e+00 0.00000e+00 8.32783e+01 343.713 1.50938e+01 163.713 0.8456 
1 1 1 7   66  2  o 3  1.66606e+01 5.82270e-01 3.85259e+02 259.670 -8.64062e+00 -4.74048e+01 0.00000e+00 0.00000e+00 2.33129e+02 259.670 1.52130e+02 79.670  0.9896 
1 1 1 7   66  3  o 11 1.61465e+01 9.71184e-01 2.47650e+02 171.116 -2.81605e+01 4.40188e+00  0.00000e+00 0.00000e+00 3.47327e+02 171.116 9.96767e+01 171.116 0.9823 
1 1 1 7   66  4  o 18 8.29389e+00 1.53348e+00 1.04697e+02 347.768 5.52264e+00  -1.19722e+00 0.00000e+00 0.00000e+00 1.77380e+02 347.768 7.26830e+01 347.768 0.9066 
1 1 1 7   66  5  o 6  5.75788e+00 9.96418e-01 2.03309e+02 151.304 -8.45259e+00 4.62692e+00  0.00000e+00 0.00000e+00 1.16660e+00 151.304 2.02142e+02 331.304 0.9466 
1 1 1 7   66  6  o 10 6.54461e+00 1.08123e+00 1.05038e+02 0.025   6.37122e+00  2.78554e-03  0.00000e+00 0.00000e+00 1.20285e+02 0.025   1.52466e+01 0.025   0.9178 
1 1 1 7   66  7  o 16 4.16012e+00 1.27117e+00 9.66244e+01 161.959 -3.22871e+00 1.05162e+00  0.00000e+00 0.00000e+00 3.37440e+01 161.959 6.28804e+01 341.959 0.8355 
1 1 1 7   66  8  o 15 3.28146e+00 1.00761e+00 2.33329e+01 146.724 -6.91709e-01 4.53956e-01  0.00000e+00 0.00000e+00 2.36651e+01 146.724 3.32167e-01 146.724 0.3819 
1 1 1 7   66  9  o 2  4.90226e+00 1.13557e+00 8.43918e+01 299.205 2.32059e+00  -4.15129e+00 0.00000e+00 0.00000e+00 7.87155e+01 299.205 5.67633e+00 119.205 0.8874 
1 1 1 7   66  10 o 13 1.48343e+01 1.00981e+00 2.73196e+02 65.227  2.30882e+01  5.00293e+01  0.00000e+00 0.00000e+00 2.77764e+02 65.227  4.56832e+00 65.227  0.9909 
1 1 1 7   66  11 o 17 1.48623e+01 1.08274e+00 2.34187e+02 280.260 9.01798e+00  -4.98187e+01 0.00000e+00 0.00000e+00 3.17165e+02 280.260 8.29788e+01 280.260 0.9901 
1 1 1 7   66  12 o 12 4.14090e+00 1.34017e+00 9.76199e+01 102.791 -1.16708e+00 5.14077e+00  0.00000e+00 0.00000e+00 4.18567e+01 102.791 5.57631e+01 282.791 0.8993 
1 1 1 7   66  13 o 19 5.89706e+00 1.56767e+00 1.11162e+02 15.646  7.57492e+00  2.12151e+00  0.00000e+00 0.00000e+00 9.50468e+01 15.646  1.61148e+01 195.646 0.9341 
1 1 1 7   67  0  o 12 4.71932e+00 9.66531e-01 2.67885e+01 161.333 -8.24885e-01 2.78678e-01  0.00000e+00 0.00000e+00 4.37425e+01 161.333 1.69539e+01 161.333 0.3987 
1 1 1 7   67  1  o 5  1.14335e+01 7.95567e-01 2.07273e+02 205.350 -1.54306e+01 -7.31059e+00 0.00000e+00 0.00000e+00 2.08664e+02 205.350 1.39131e+00 205.350 0.9703 
1 1 1 7   67  2  o 8  1.67548e+01 7.51551e-01 2.27425e+02 337.562 2.50631e+01  -1.03497e+01 0.00000e+00 0.00000e+00 3.89204e+02 337.562 1.61779e+02 337.562 0.9814 
1 1 1 7   67  3  o 17 1.29808e+01 1.17420e+00 2.37896e+02 284.107 5.16605e+00  -2.05565e+01 0.00000e+00 0.00000e+00 2.37336e+02 284.107 5.60637e-01 104.107 0.9761 
1 1 1 7   67  4  o 12 1.87598e+01 6.53924e-01 2.64159e+02 69.716  1.55575e+01  4.20946e+01  0.00000e+00 0.00000e+00 4.31608e+02 69.716  1.67449e+02 69.716  0.9888 
1 1 1 7   67  5  o 14 5.09870e+00 1.03350e+00 1.86963e+02 326.418 6.77185e+00  -4.49620e+00 0.00000e+00 0.00000e+00 7.89876e+00 146.418 1.94862e+02 146.418 0.9363 
1 1 1 7   67  6  o 10 7.88370e+00 9.48616e-01 1.79921e+02 3.969   1.41051e+01  9.78754e-01  0.00000e+00 0.00000e+00 1.05115e+02 3.969   7.48067e+01 183.969 0.9640 
1 1 1 7   67  7  o 6  8.71838e+00 9.98154e-01 1.08883e+02 249.036 -3.57334e+00 -9.32650e+00 0.00000e+00 0.00000e+00 2.01250e+02 249.036 9.23668e+01 249.036 0.9485 
1 1 1 7   67  8  o 2  5.04755e+00 1.14269e+00 8.79222e+01 54.345  2.75122e+00  3.83508e+00  0.00000e+00 0.00000e+00 7.98500e+01 54.345  8.07217e+00 234.345 0.8865 
1 1 1 7   67  9  o 8  4.42309e+00 1.20188e+00 1.04924e+02 194.670 -5.12692e+00 -1.34218e+00 0.00000e+00 0.00000e+00 4.42864e+01 194.670 6.06376e+01 14.670  0.8999 
1 1 1 7   67  10 o 12 4.47448e+00 1.23851e+00 6.17282e+01 245.298 -1.38611e+00 -3.01336e+00 0.00000e+00 0.00000e+00 7.76068e+01 245.298 1.58786e+01 245.298 0.8309 
1 1 1 7   67  11 o 2  3.34266e+00 1.09402e+00 2.62569e+01 150.302 -1.09646e+00 6.25354e-01  0.00000e+00 0.00000e+00 4.03175e+01 150.302 1.40606e+01 150.302 0.5316 
1 1 1 7   67  12 o 11 6.38149e+00 1.48978e+00 1.50887e+02 234.201 -6.58370e+00 -9.12895e+00 0.00000e+00 0.00000e+00 7.72017e+01 234.201 7.36855e+01 54.201  0.9545 
1 1 1 7   67  13 o 2  5.97628e+00 1.58013e+00 6.08407e+01 60.456  2.15939e+00  3.80993e+00  0.00000e+00 0.00000e+00 1.35257e+02 60.456  7.44162e+01 60.456  0.8767 
1 1 1 7   68  0  o 5  1.45640e+01 6.27032e-01 2.63011e+02 212.606 -2.35455e+01 -1.50612e+01 0.00000e+00 0.00000e+00 2.72959e+02 212.606 9.94817e+00 212.606 0.9819 
1 1 1 7   68  1  o 7  1.23741e+01 7.34102e-01 2.36582e+02 358.867 2.08855e+01  -4.12861e-01 0.00000e+00 0.00000e+00 2.16043e+02 358.867 2.05396e+01 178.867 0.9758 
1 1 1 7   68  2  o 11 5.00961e+00 1.13149e+00 1.51451e+02 118.596 -2.65377e+00 4.86811e+00  0.00000e+00 0.00000e+00 1.84701e+01 118.596 1.32981e+02 298.596 0.9046 
1 1 1 7   68  3  o 5  9.00521e+00 9.69529e-01 1.73098e+02 255.222 -3.12348e+00 -1.18401e+01 0.00000e+00 0.00000e+00 1.50493e+02 255.222 2.26051e+01 75.222  0.9583 
1 1 1 7   68  4  o 18 6.10401e+00 9.41950e-01 1.88174e+02 267.481 -4.22474e-01 -9.60187e+00 0.00000e+00 0.00000e+00 2.84790e+01 267.481 1.59695e+02 87.481  0.9465 
1 1 1 7   68  5  o 12 8.66514e+00 7.98993e-01 2.30682e+02 33.788  1.53961e+01  1.03021e+01  0.00000e+00 0.00000e+00 8.53808e+01 33.788  1.45301e+02 213.788 0.9726 
1 1 1 7   68  6  o 15 7.78210e+00 9.25748e-01 1.02597e+02 13.450  7.53319e+00  1.80160e+00  0.00000e+00 0.00000e+00 1.69683e+02 13.450  6.70853e+01 13.450  0.9330 
1 1 1 7   68  7  o 12 8.21800e+00 9.56784e-01 1.33931e+02 77.969  2.67895e+00  1.25706e+01  0.00000e+00 0.00000e+00 1.61967e+02 77.969  2.80360e+01 77.969  0.9603 
1 1 1 7   68  8  o 9  6.49144e+00 1.09957e+00 1.04724e+02 54.181  4.58627e+00  6.35457e+00  0.00000e+00 0.00000e+00 1.22530e+02 54.181  1.78053e+01 54.181  0.9338 
1 1 1 7   68  9  o 16 3.14019e+00 9.95422e-01 6.12148e+01 359.752 2.39090e+00  -1.03531e-02 0.00000e+00 0.00000e+00 2.73611e+01 359.752 3.38537e+01 179.752 0.7526 
1 1 1 7   68  10 o 9  5.17674e+00 1.35376e+00 4.74892e+01 146.019 -2.24610e+00 1.51393e+00  0.00000e+00 0.00000e+00 1.04951e+02 146.019 5.74620e+01 146.019 0.7859 
1 1 1 7   68  11 o 1  3.79622e+00 1.15839e+00 7.60463e+01 161.930 -3.69195e+00 1.20458e+00  0.00000e+00 0.00000e+00 4.60782e+01 161.930 2.99682e+01 341.930 0.8589 
1 1 1 7   68  12 o 1  6.27901e+00 1.59569e+00 1.27100e+02 301.210 4.41300e+00  -7.28392e+00 0.00000e+00 0.00000e+00 9.37178e+01 301.210 3.33820e+01 121.210 0.9393 
1 1 1 7   68  13 f 0  6.72094e+00 1.77060e+00 1.88603e+02 132.792 -9.06239e+00 9.78922e+00  0.00000e+00 0.00000e+00 5.32866e+01 132.792 1.35317e+02 312.792 0.9618 
1 1 1 7   69  0  o 1  1.20691e+01 6.24052e-01 2.94949e+02 141.146 -2.12974e+01 1.71569e+01  0.00000e+00 0.00000e+00 1.48942e+02 141.146 1.46007e+02 321.146 0.9815 
1 1 1 7   69  1  f 0  9.43930e+00 6.62143e-01 1.93435e+02 329.357 1.29655e+01  -7.68096e+00 0.00000e+00 0.00000e+00 1.48402e+02 329.357 4.50331e+01 149.357 0.9662 
1 1 1 7   69  2  o 2  7.98640e+00 9.22791e-01 2.07015e+02 293.978 4.92900e+00  -1.10820e+01 0.00000e+00 0.00000e+00 7.97514e+01 293.978 1.27264e+02 113.978 0.9578 
1 1 1 7   69  3  f 0  5.88717e+00 1.14464e+00 2.74289e+01 352.444 1.25945e+00  -1.67071e-01 0.00000e+00 0.00000e+00 9.04523e+01 352.444 6.30234e+01 352.444 0.5341 
1 1 1 7   69  4  o 11 8.70751e+00 7.54772e-01 1.74492e+02 302.486 7.57028e+00  -1.18894e+01 0.00000e+00 0.00000e+00 1.40189e+02 302.486 3.43028e+01 122.486 0.9638 
1 1 1 7   69  5  o 10 7.74213e+00 8.62455e-01 1.30200e+02 54.012  5.92111e+00  8.15343e+00  0.00000e+00 0.00000e+00 1.45285e+02 54.012  1.50849e+01 54.012  0.9490 
1 1 1 7   69  6  o 10 8.77042e+00 8.77456e-01 1.31405e+02 93.388  -6.65071e-01 1.12334e+01  0.00000e+00 0.00000e+00 1.82454e+02 93.388  5.10494e+01 93.388  0.9545 
1 1 1 7   69  7  o 3  8.84379e+00 9.53749e-01 1.97999e+02 305.840 1.19437e+01  -1.65362e+01 0.00000e+00 0.00000e+00 1.25309e+02 305.840 7.26901e+01 125.840 0.9752 
1 1 1 7   69  8  o 10 7.49038e+00 1.03724e+00 1.28124e+02 178.475 -1.17444e+01 3.12627e-01  0.00000e+00 0.00000e+00 1.40402e+02 178.475 1.22785e+01 178.475 0.9564 
1 1 1 7   69  9  o 8  9.46211e+00 1.07127e+00 2.35029e+02 278.914 4.52543e+00  -2.88513e+01 0.00000e+00 0.00000e+00 1.13421e+02 278.914 1.21608e+02 98.914  0.9827 
1 1 1 7   69  10 o 6  9.66958e+00 1.23126e+00 9.65664e+01 194.341 -1.16932e+01 -2.98944e+00 0.00000e+00 0.00000e+00 2.50326e+02 194.341 1.53760e+02 194.341 0.9576 
1 1 1 7   69  11 o 4  3.94909e+00 1.22796e+00 7.58726e+01 217.440 -3.39834e+00 -2.60201e+00 0.00000e+00 0.00000e+00 5.33051e+01 217.440 2.25675e+01 37.440  0.8735 
1 1 1 7   69  12 o 7  6.71901e+00 1.61595e+00 1.26205e+02 132.244 -6.29350e+00 6.92997e+00  0.00000e+00 0.00000e+00 1.11466e+02 132.244 1.47392e+01 312.244 0.9450 
1 1 1 7   69  13 o 9  5.83054e+00 1.66589e+00 5.23220e+01 52.332  2.09971e+00  2.71982e+00  0.00000e+00 0.00000e+00 1.30418e+02 52.332  7.80961e+01 52.332  0.8377 
1 1 1 7   70  0  o 3  8.53822e+00 7.12973e-01 1.87712e+02 21.196  1.15232e+01  4.46853e+00  0.00000e+00 0.00000e+00 1.18932e+02 21.196  6.87795e+01 201.196 0.9586 
1 1 1 7   70  1  o 13 8.46105e+00 9.36496e-01 1.66325e+02 292.674 4.30560e+00  -1.03059e+01 0.00000e+00 0.00000e+00 1.36190e+02 292.674 3.01344e+01 112.674 0.9541 
1 1 1 7   70  2  o 2  1.30157e+01 8.00911e-01 2.57930e+02 249.761 -9.64778e+00 -2.61674e+01 0.00000e+00 0.00000e+00 2.21073e+02 249.761 3.68567e+01 69.761  0.9819 
1 1 1 7   70  3  o 3  3.72829e+00 9.63322e-01 6.73962e+01 73.934  5.77616e-01  2.00564e+00  0.00000e+00 0.00000e+00 3.20504e+01 73.934  3.53458e+01 253.934 0.7116 
1 1 1 7   70  4  o 12 7.94865e+00 8.98943e-01 1.61796e+02 10.664  1.13583e+01  2.13881e+00  0.00000e+00 0.00000e+00 1.22981e+02 10.664  3.88143e+01 190.664 0.9557 
1 1 1 7   70  5  o 10 3.45168e+00 9.28578e-01 7.38049e+01 275.763 2.56523e-01  -2.54158e+00 0.00000e+00 0.00000e+00 2.59327e+01 275.763 4.78722e+01 95.763  0.7708 
1 1 1 7   70  6  o 19 1.30748e+01 7.30652e-01 2.84701e+02 314.479 3.02138e+01  -3.07688e+01 0.00000e+00 0.00000e+00 1.99700e+02 314.479 8.50007e+01 134.479 0.9883 
1 1 1 7   70  7  o 12 4.01729e+00 1.09332e+00 4.32907e+01 217.611 -1.55488e+00 -1.19790e+00 0.00000e+00 0.00000e+00 6.08416e+01 217.611 1.75509e+01 217.611 0.6916 
1 1 1 7   70  8  o 9  7.71223e+00 1.05152e+00 1.38747e+02 83.374  1.47837e+00  1.27268e+01  0.00000e+00 0.00000e+00 1.38748e+02 83.374  7.13836e-04 83.374  0.9601 
1 1 1 7   70  9  o 15 7.20247e+00 1.21781e+00 1.63119e+02 242.018 -6.67589e+00 -1.25652e+01 0.00000e+00 0.00000e+00 9.70649e+01 242.018 6.60546e+01 62.018  0.9642 
1 1 1 7   70  10 o 18 8.43972e+00 1.28829e+00 1.38909e+02 279.267 2.39534e+00  -1.46802e+01 0.00000e+00 0.00000e+00 1.66380e+02 279.267 2.74716e+01 279.267 0.9658 
1 1 1 7   70  11 o 1  5.70011e+00 1.45372e+00 7.25056e+01 80.938  7.67236e-01  4.81022e+00  0.00000e+00 0.00000e+00 1.17502e+02 80.938  4.49966e+01 80.938  0.8903 
1 1 1 7   70  12 o 6  4.92237e+00 1.46500e+00 9.02107e+01 303.412 3.01339e+00  -4.56795e+00 0.00000e+00 0.00000e+00 7.61961e+01 303.412 1.40145e+01 123.412 0.9033 
1 1 1 7   70  13 o 1  8.41986e+00 1.86099e+00 1.76290e+02 131.353 -9.95919e+00 1.13153e+01  0.00000e+00 0.00000e+00 1.28042e+02 131.353 4.82482e+01 311.353 0.9662 
1 1 1 7   71  0  o 2  2.16058e+01 6.57924e-01 3.76045e+02 132.775 -4.74348e+01 5.12703e+01  0.00000e+00 0.00000e+00 4.27412e+02 132.775 5.13667e+01 132.775 0.9928 
1 1 1 7   71  1  o 16 6.70141e+00 9.58288e-01 1.22544e+02 27.296  5.80739e+00  2.99688e+00  0.00000e+00 0.00000e+00 1.08429e+02 27.296  1.41151e+01 207.296 0.9199 
1 1 1 7   71  2  o 2  1.32784e+01 7.91451e-01 2.72482e+02 13.471  3.07029e+01  7.35468e+00  0.00000e+00 0.00000e+00 2.17150e+02 13.471  5.53320e+01 193.471 0.9840 
1 1 1 7   71  3  f 0  9.10384e+00 1.10703e+00 4.00571e+01 253.903 -8.41022e-01 -2.91435e+00 0.00000e+00 0.00000e+00 2.37131e+02 253.903 1.97074e+02 253.903 0.8124 
1 1 1 7   71  4  o 6  1.18278e+01 6.99040e-01 1.88574e+02 245.224 -9.82175e+00 -2.12793e+01 0.00000e+00 0.00000e+00 2.45171e+02 245.224 5.65966e+01 245.224 0.9784 
1 1 1 7   71  5  o 3  7.84329e+00 1.01427e+00 2.26467e+02 53.114  1.05360e+01  1.40398e+01  0.00000e+00 0.00000e+00 5.90020e+01 53.114  1.67465e+02 233.114 0.9711 
1 1 1 7   71  6  o 19 4.99895e+00 1.08065e+00 1.40697e+02 172.214 -7.41999e+00 1.01454e+00  0.00000e+00 0.00000e+00 3.36575e+01 172.214 1.07039e+02 352.214 0.9306 
1 1 1 7   71  7  o 18 4.32451e+00 1.04396e+00 1.40550e+02 241.986 -3.16847e+00 -5.95547e+00 0.00000e+00 0.00000e+00 8.96120e+00 241.986 1.31588e+02 61.986  0.9226 
1 1 1 7   71  8  o 18 3.73659e+00 1.06117e+00 3.77361e+01 168.827 -1.72915e+00 3.41529e-01  0.00000e+00 0.00000e+00 5.39175e+01 168.827 1.61813e+01 168.827 0.6547 
1 1 1 7   71  9  o 2  6.58508e+00 1.24889e+00 1.26779e+02 41.647  7.44732e+00  6.62300e+00  0.00000e+00 0.00000e+00 1.07166e+02 41.647  1.96133e+01 221.647 0.9484 
1 1 1 7   71  10 o 3  8.90623e+00 1.26067e+00 1.27357e+02 274.478 1.15682e+00  -1.47713e+01 0.00000e+00 0.00000e+00 1.94699e+02 274.478 6.73422e+01 274.478 0.9656 
1 1 1 7   71  11 o 8  1.69637e+01 1.04571e+00 2.37163e+02 93.489  -3.55569e+00 5.83184e+01  0.00000e+00 0.00000e+00 3.92396e+02 93.489  1.55233e+02 93.489  0.9914 
1 1 1 7   71  12 f 0  6.35424e+00 1.56903e+00 9.66022e+01 300.296 3.62653e+00  -6.20702e+00 0.00000e+00 0.00000e+00 1.23944e+02 300.296 2.73418e+01 300.296 0.9276 
1 1 1 7   71  13 o 8  3.55691e+00 1.15714e+00 9.19201e+01 98.867  -8.47219e-01 5.43100e+00  0.00000e+00 0.00000e+00 2.83058e+01 98.867  6.36143e+01 278.866 0.9038 
1 1 1 7   72  0  o 5  8.05065e+00 6.66164e-01 1.95620e+02 358.354 1.41593e+01  -4.06938e-01 0.00000e+00 0.00000e+00 9.50228e+01 358.354 1.00597e+02 178.354 0.9640 
1 1 1 7   72  1  o 14 5.75646e+00 8.80412e-01 1.10740e+02 76.620  1.25568e+00  5.27892e+00  0.00000e+00 0.00000e+00 8.38444e+01 76.620  2.68954e+01 256.620 0.9024 
1 1 1 7   72  2  o 11 2.26608e+01 7.96398e-01 3.63026e+02 200.248 -6.70619e+01 -2.47382e+01 0.00000e+00 0.00000e+00 4.80011e+02 200.248 1.16985e+02 200.248 0.9930 
1 1 1 7   72  3  o 15 5.79624e+00 8.23587e-01 1.05175e+02 345.357 5.42671e+00  -1.41788e+00 0.00000e+00 0.00000e+00 9.15566e+01 345.357 1.36188e+01 165.357 0.9058 
1 1 1 7   72  4  o 18 4.69120e+00 9.87965e-01 8.77090e+01 25.842  3.63742e+00  1.76170e+00  0.00000e+00 0.00000e+00 6.43695e+01 25.842  2.33395e+01 205.842 0.8651 
1 1 1 7   72  5  o 7  8.16180e+00 8.50301e-01 1.89915e+02 254.972 -3.95120e+00 -1.47171e+01 0.00000e+00 0.00000e+00 1.05720e+02 254.972 8.41952e+01 74.972  0.9666 
1 1 1 7   72  6  o 11 1.16341e+01 9.04113e-01 2.52792e+02 318.447 2.61671e+01  -2.31934e+01 0.00000e+00 0.00000e+00 1.76872e+02 318.447 7.59199e+01 138.447 0.9856 
1 1 1 7   72  7  f 0  7.33723e+00 1.00530e+00 2.65594e+02 143.379 -1.88156e+01 1.39845e+01  0.00000e+00 0.00000e+00 3.37924e+00 143.379 2.62215e+02 323.379 0.9784 
1 1 1 7   72  8  o 4  1.44125e+01 8.55361e-01 2.69157e+02 306.500 3.05413e+01  -4.12747e+01 0.00000e+00 0.00000e+00 2.65455e+02 306.500 3.70138e+00 126.500 0.9902 
1 1 1 7   72  9  o 5  4.97299e+00 1.23569e+00 1.13448e+02 153.535 -6.27700e+00 3.12477e+00  0.00000e+00 0.00000e+00 5.89523e+01 153.535 5.44952e+01 333.535 0.9257 
1 1 1 7   72  10 o 8  4.20772e+00 1.22217e+00 6.50588e+01 205.701 -3.28452e+00 -1.58078e+00 0.00000e+00 0.00000e+00 6.85863e+01 205.701 3.52747e+00 205.701 0.8483 
1 1 1 7   72  11 o 3  4.08458e+00 1.21679e+00 7.96426e+01 85.344  3.68547e-01  4.52573e+00  0.00000e+00 0.00000e+00 5.51166e+01 85.344  2.45259e+01 265.344 0.8815 
1 1 1 7   72  12 o 14 4.98127e+00 1.30879e+00 8.08470e+01 184.878 -5.78167e+00 -4.93396e-01 0.00000e+00 0.00000e+00 8.85821e+01 184.878 7.73511e+00 184.878 0.9092 
1 1 1 7   72  13 o 8  4.19160e+00 1.31100e+00 1.24590e+02 333.263 7.04618e+00  -3.54954e+00 0.00000e+00 0.00000e+00 2.18472e+01 333.263 1.02743e+02 153.263 0.9343 
1 1 1 7   73  0  o 5  1.48716e+01 6.55345e-01 2.33286e+02 56.069  1.74181e+01  2.58905e+01  0.00000e+00 0.00000e+00 3.14531e+02 56.069  8.12448e+01 56.069  0.9838 
1 1 1 7   73  1  o 13 9.27644e+00 7.92843e-01 1.30369e+02 251.130 -3.58843e+00 -1.04987e+01 0.00000e+00 0.00000e+00 2.00995e+02 251.130 7.06258e+01 251.130 0.9538 
1 1 1 7   73  2  o 10 5.56694e+00 7.97133e-01 6.42391e+01 78.314  6.70238e-01  3.24058e+00  0.00000e+00 0.00000e+00 1.08937e+02 78.314  4.46982e+01 78.314  0.8305 
1 1 1 7   73  3  o 2  5.75926e+00 8.26663e-01 1.30723e+02 82.489  9.94443e-01  7.54239e+00  0.00000e+00 0.00000e+00 7.03094e+01 82.489  6.04135e+01 262.489 0.9317 
1 1 1 7   73  4  o 2  9.63506e+00 6.33983e-01 1.58563e+02 305.822 9.44730e+00  -1.30886e+01 0.00000e+00 0.00000e+00 1.91051e+02 305.822 3.24877e+01 305.822 0.9685 
1 1 1 7   73  5  f 0  1.60259e+01 6.38976e-01 2.21290e+02 57.834  2.24407e+01  3.56824e+01  0.00000e+00 0.00000e+00 3.71964e+02 57.834  1.50674e+02 57.834  0.9881 
1 1 1 7   73  6  o 6  3.12493e+00 9.26405e-01 1.03674e+02 19.810  3.70433e+00  1.33440e+00  0.00000e+00 0.00000e+00 2.86787e+00 199.810 1.06542e+02 199.810 0.8611 
1 1 1 7   73  7  o 19 4.32553e+00 1.06700e+00 1.26860e+02 191.649 -6.19828e+00 -1.27789e+00 0.00000e+00 0.00000e+00 2.17521e+01 191.649 1.05108e+02 11.649  0.9172 
1 1 1 7   73  8  o 12 3.44462e+00 1.04209e+00 9.63136e+01 42.477  3.26213e+00  2.98679e+00  0.00000e+00 0.00000e+00 1.69601e+01 42.477  7.93535e+01 222.477 0.8780 
1 1 1 7   73  9  o 6  5.47626e+00 1.26643e+00 1.03637e+02 14.813  6.95088e+00  1.83820e+00  0.00000e+00 0.00000e+00 8.65674e+01 14.813  1.70700e+01 194.813 0.9276 
1 1 1 7   73  10 o 17 3.36473e+00 1.09825e+00 1.45968e+02 289.203 2.24915e+00  -6.45755e+00 0.00000e+00 0.00000e+00 2.96297e+01 109.203 1.75597e+02 109.203 0.9237 
1 1 1 7   73  11 o 2  4.96958e+00 1.29896e+00 1.50560e+02 351.749 1.02028e+01  -1.47950e+00 0.00000e+00 0.00000e+00 2.61344e+01 351.749 1.24426e+02 171.749 0.9502 
1 1 1 7   73  12 o 18 4.13368e+00 1.25855e+00 6.41224e+01 97.590  -5.30728e-01 3.98290e+00  0.00000e+00 0.00000e+00 6.94973e+01 97.590  5.37485e+00 97.590  0.8642 
1 1 1 7   73  13 o 14 6.74209e+00 1.56386e+00 1.05191e+02 237.240 -4.97857e+00 -7.73723e+00 0.00000e+00 0.00000e+00 1.32745e+02 237.240 2.75540e+01 237.240 0.9440 
1 1 1 7   74  0  o 13 8.92360e+00 8.28299e-01 1.61362e+02 189.414 -1.30361e+01 -2.16135e+00 0.00000e+00 0.00000e+00 1.59783e+02 189.414 1.57957e+00 9.414   0.9614 
1 1 1 7   74  1  o 6  8.04417e+00 9.64231e-01 1.34637e+02 288.057 2.95355e+00  -9.05927e+00 0.00000e+00 0.00000e+00 1.50290e+02 288.057 1.56536e+01 288.057 0.9460 
1 1 1 7   74  2  o 3  9.27738e+00 5.89526e-01 1.40902e+02 304.250 7.94811e+00  -1.16732e+01 0.00000e+00 0.00000e+00 1.94003e+02 304.250 5.31014e+01 304.250 0.9639 
1 1 1 7   74  3  o 12 1.04101e+01 5.77003e-01 1.88789e+02 232.182 -1.34058e+01 -1.72718e+01 0.00000e+00 0.00000e+00 1.92101e+02 232.182 3.31215e+00 232.182 0.9769 
1 1 1 7   74  4  o 15 1.22108e+01 5.95762e-01 2.53483e+02 117.193 -1.49248e+01 2.90492e+01  0.00000e+00 0.00000e+00 1.96848e+02 117.193 5.66350e+01 297.193 0.9846 
1 1 1 7   74  5  o 19 2.35739e+01 6.25297e-01 4.28817e+02 317.317 9.78856e+01  -9.02720e+01 0.00000e+00 0.00000e+00 4.50893e+02 317.317 2.20760e+01 317.317 0.9962 
1 1 1 7   74  6  o 15 1.26408e+01 7.18767e-01 1.92269e+02 135.334 -2.17782e+01 2.15255e+01  0.00000e+00 0.00000e+00 2.73411e+02 135.334 8.11421e+01 135.334 0.9835 
1 1 1 7   74  7  o 15 8.38086e+00 8.67628e-01 1.72384e+02 243.601 -8.80757e+00 -1.77434e+01 0.00000e+00 0.00000e+00 1.33466e+02 243.601 3.89178e+01 63.601  0.9744 
1 1 1 7   74  8  o 12 7.42516e+00 9.20100e-01 1.17457e+02 326.244 1.02595e+01  -6.85665e+00 0.00000e+00 0.00000e+00 1.49064e+02 326.244 3.16074e+01 326.244 0.9586 
1 1 1 7   74  9  o 2  8.32617e+00 9.71855e-01 1.66841e+02 169.486 -1.90537e+01 3.53604e+00  0.00000e+00 0.00000e+00 1.36708e+02 169.486 3.01331e+01 349.486 0.9738 
1 1 1 7   74  10 o 12 6.33632e+00 1.27565e+00 9.77359e+01 277.977 1.18917e+00  -8.48656e+00 0.00000e+00 0.00000e+00 1.25103e+02 277.977 2.73668e+01 277.977 0.9397 
1 1 1 7   74  11 o 7  3.18185e+00 1.04590e+00 4.37317e+01 240.142 -1.09507e+00 -1.90762e+00 0.00000e+00 0.00000e+00 4.29250e+01 240.142 8.06697e-01 60.142  0.7280 
1 1 1 7   74  12 o 2  4.85116e+00 1.34473e+00 1.50465e+02 280.929 1.97041e+00  -1.02042e+01 0.00000e+00 0.00000e+00 2.19865e+01 280.929 1.28479e+02 100.929 0.9506 
1 1 1 7   74  13 o 4  5.93946e+00 1.42926e+00 9.76524e+01 170.683 -8.72361e+00 1.43119e+00  0.00000e+00 0.00000e+00 1.11391e+02 170.683 1.37385e+01 170.683 0.9416 
1 1 1 7   75  0  o 3  1.74911e+01 6.67136e-01 2.07463e+02 83.334  4.02518e+00  3.44420e+01  0.00000e+00 0.00000e+00 4.37652e+02 83.334  2.30189e+02 83.334  0.9855 
1 1 1 7   75  1  o 10 1.08445e+01 7.22181e-01 2.04985e+02 334.906 2.09868e+01  -9.82840e+00 0.00000e+00 0.00000e+00 1.92129e+02 334.906 1.28561e+01 154.906 0.9782 
1 1 1 7   75  2  o 7  7.88475e+00 6.56339e-01 2.13255e+02 93.242  -1.03755e+00 1.83178e+01  0.00000e+00 0.00000e+00 7.38100e+01 93.242  1.39445e+02 273.242 0.9724 
1 1 1 7   75  3  o 13 6.60035e+00 6.85662e-01 7.58285e+01 155.183 -5.00163e+00 2.31288e+00  0.00000e+00 0.00000e+00 1.47614e+02 155.183 7.17858e+01 155.183 0.9040 
1 1 1 7   75  4  o 11 1.32855e+01 6.01097e-01 2.63508e+02 316.322 3.04215e+01  -2.90492e+01 0.00000e+00 0.00000e+00 2.28085e+02 316.322 3.54231e+01 136.322 0.9880 
1 1 1 7   75  5  o 4  1.66755e+01 5.99563e-01 3.01160e+02 140.505 -4.83114e+01 3.98182e+01  0.00000e+00 0.00000e+00 3.18336e+02 140.505 1.71760e+01 140.505 0.9920 
1 1 1 7   75  6  o 7  6.77967e+00 9.68264e-01 1.93780e+02 228.390 -1.06684e+01 -1.20120e+01 0.00000e+00 0.00000e+00 5.20746e+01 228.390 1.41706e+02 48.390  0.9684 
1 1 1 7   75  7  o 8  1.63641e+01 6.72850e-01 3.34600e+02 328.035 6.72043e+01  -4.19364e+01 0.00000e+00 0.00000e+00 2.74259e+02 328.035 6.03413e+01 148.035 0.9937 
1 1 1 7   75  8  o 4  6.24159e+00 1.05637e+00 9.47697e+01 95.903  -8.05779e-01 7.79353e+00  0.00000e+00 0.00000e+00 1.23434e+02 95.903  2.86646e+01 95.903  0.9338 
1 1 1 7   75  9  o 11 3.53362e+00 1.05395e+00 5.73331e+01 337.944 2.59045e+00  -1.04953e+00 0.00000e+00 0.00000e+00 4.76280e+01 337.944 9.70507e+00 157.944 0.7936 
1 1 1 7   75  10 o 4  1.07323e+01 1.00166e+00 1.80043e+02 207.897 -2.72018e+01 -1.44009e+01 0.00000e+00 0.00000e+00 2.14955e+02 207.897 3.49118e+01 207.897 0.9836 
1 1 1 7   75  11 o 17 8.60167e+00 1.24346e+00 1.45818e+02 16.440  1.72183e+01  5.08070e+00  0.00000e+00 0.00000e+00 1.66825e+02 16.440  2.10068e+01 16.440  0.9717 
1 1 1 7   75  12 o 14 4.61298e+00 1.29119e+00 1.13910e+02 353.723 8.11211e+00  -8.92235e-01 0.00000e+00 0.00000e+00 4.76210e+01 353.723 6.62888e+01 173.723 0.9366 
1 1 1 7   75  13 o 6  4.29562e+00 1.28046e+00 8.34224e+01 112.144 -2.39625e+00 5.88833e+00  0.00000e+00 0.00000e+00 6.38745e+01 112.144 1.95478e+01 292.144 0.9176 
1 1 1 7   76  0  o 14 5.74414e+00 9.86926e-01 9.70593e+01 259.679 -9.40650e-01 -5.16534e+00 0.00000e+00 0.00000e+00 9.61433e+01 259.679 9.15930e-01 79.679  0.8989 
1 1 1 7   76  1  o 19 1.01356e+01 5.53639e-01 1.74011e+02 146.082 -1.63689e+01 1.10069e+01  0.00000e+00 0.00000e+00 1.95598e+02 146.082 2.15877e+01 146.082 0.9743 
1 1 1 7   76  2  o 14 1.47544e+01 5.32441e-01 3.13286e+02 180.784 -4.99629e+01 -6.83851e-01 0.00000e+00 0.00000e+00 2.33489e+02 180.784 7.97966e+01 0.784   0.9899 
1 1 1 7   76  3  o 12 6.27690e+00 7.70243e-01 1.10202e+02 358.365 7.54109e+00  -2.15200e-01 0.00000e+00 0.00000e+00 1.08624e+02 358.365 1.57753e+00 178.365 0.9311 
1 1 1 7   76  4  o 19 1.35076e+01 6.80744e-01 2.31071e+02 208.984 -3.53355e+01 -1.95740e+01 0.00000e+00 0.00000e+00 2.68388e+02 208.984 3.73172e+01 208.984 0.9875 
1 1 1 7   76  5  o 15 6.79060e+00 8.40626e-01 9.03274e+01 233.659 -4.56636e+00 -6.20703e+00 0.00000e+00 0.00000e+00 1.46808e+02 233.659 5.64807e+01 233.659 0.9327 
1 1 1 7   76  6  o 1  7.82898e+00 9.07424e-01 1.14279e+02 294.670 4.61952e+00  -1.00575e+01 0.00000e+00 0.00000e+00 1.65270e+02 294.670 5.09905e+01 294.670 0.9537 
1 1 1 7   76  7  o 16 6.70419e+00 8.81435e-01 9.68215e+01 12.369  9.37515e+00  2.05592e+00  0.00000e+00 0.00000e+00 1.40700e+02 12.369  4.38790e+01 12.369  0.9464 
1 1 1 7   76  8  o 12 1.12932e+01 7.91022e-01 2.01552e+02 216.818 -2.86333e+01 -2.14342e+01 0.00000e+00 0.00000e+00 2.15198e+02 216.818 1.36462e+01 216.818 0.9859 
1 1 1 7   76  9  o 16 1.10849e+01 8.35540e-01 1.51920e+02 238.148 -1.47717e+01 -2.37766e+01 0.00000e+00 0.00000e+00 2.55410e+02 238.148 1.03490e+02 238.148 0.9820 
1 1 1 7   76  10 o 2  4.63827e+00 1.24852e+00 1.20477e+02 120.963 -3.70255e+00 6.17113e+00  0.00000e+00 0.00000e+00 4.04878e+01 120.963 7.99896e+01 300.963 0.9277 
1 1 1 7   76  11 o 2  5.89560e+00 1.34349e+00 9.10491e+01 248.133 -2.73620e+00 -6.81784e+00 0.00000e+00 0.00000e+00 1.13817e+02 248.133 2.27675e+01 248.133 0.9292 
1 1 1 7   76  12 f 0  4.08303e+00 1.23521e+00 9.90734e+01 91.798  -2.04967e-01 6.52757e+00  0.00000e+00 0.00000e+00 4.13253e+01 91.798  5.77480e+01 271.798 0.9199 
1 1 1 7   76  13 o 14 4.36854e+00 1.33286e+00 7.29685e+01 45.131  3.58261e+00  3.59906e+00  0.00000e+00 0.00000e+00 7.31401e+01 45.131  1.71564e-01 45.131  0.8952 
1 1 1 7   77  0  o 5  1.01235e+01 7.54671e-01 1.96949e+02 221.203 -1.53370e+01 -1.34277e+01 0.00000e+00 0.00000e+00 1.72369e+02 221.203 2.45806e+01 41.203  0.9752 
1 1 1 7   77  1  o 18 1.44520e+01 5.29288e-01 2.84674e+02 348.298 4.61493e+01  -9.55900e+00 0.00000e+00 0.00000e+00 2.50352e+02 348.298 3.43218e+01 168.298 0.9893 
1 1 1 7   77  2  o 5  9.43938e+00 6.17878e-01 1.29732e+02 196.890 -1.22853e+01 -3.73022e+00 0.00000e+00 0.00000e+00 2.09507e+02 196.890 7.97741e+01 196.890 0.9602 
1 1 1 7   77  3  o 18 6.87151e+00 7.24908e-01 9.65755e+01 165.935 -7.86486e+00 1.97036e+00  0.00000e+00 0.00000e+00 1.44211e+02 165.935 4.76357e+01 165.935 0.9361 
1 1 1 7   77  4  o 4  5.95035e+00 8.24600e-01 1.13001e+02 98.939  -1.21186e+00 7.70401e+00  0.00000e+00 0.00000e+00 9.49329e+01 98.939  1.80683e+01 278.940 0.9335 
1 1 1 7   77  5  o 3  1.37488e+01 6.12005e-01 2.95280e+02 24.847  5.14043e+01  2.38036e+01  0.00000e+00 0.00000e+00 2.14839e+02 24.847  8.04416e+01 204.847 0.9911 
1 1 1 7   77  6  o 18 1.25883e+01 7.41280e-01 2.45546e+02 292.443 1.70618e+01  -4.13072e+01 0.00000e+00 0.00000e+00 2.20368e+02 292.443 2.51782e+01 112.443 0.9887 
1 1 1 7   77  7  o 2  1.18857e+01 7.32644e-01 2.10576e+02 161.538 -3.68705e+01 1.23093e+01  0.00000e+00 0.00000e+00 2.28528e+02 161.538 1.79528e+01 161.538 0.9871 
1 1 1 7   77  8  o 8  4.75787e+00 1.12560e+00 9.58055e+01 226.027 -4.35445e+00 -4.51338e+00 0.00000e+00 0.00000e+00 6.73550e+01 226.027 2.84505e+01 46.027  0.9164 
1 1 1 7   77  9  o 18 5.41108e+00 1.13289e+00 1.03280e+02 2.293   7.62549e+00  3.05401e-01  0.00000e+00 0.00000e+00 8.53930e+01 2.293   1.78869e+01 182.293 0.9320 
1 1 1 7   77  10 o 3  3.99541e+00 1.15990e+00 9.64299e+01 100.939 -1.05677e+00 5.46772e+00  0.00000e+00 0.00000e+00 3.88233e+01 100.939 5.76066e+01 280.939 0.9051 
1 1 1 7   77  11 o 8  5.00513e+00 1.21885e+00 7.26422e+01 325.125 4.60183e+00  -3.20725e+00 0.00000e+00 0.00000e+00 9.68683e+01 325.125 2.42261e+01 325.125 0.9058 
1 1 1 7   77  12 o 9  4.96034e+00 1.32801e+00 8.14799e+01 33.426  4.99697e+00  3.29811e+00  0.00000e+00 0.00000e+00 8.76176e+01 33.426  6.13765e+00 33.426  0.9122 
1 1 1 7   77  13 o 14 4.66351e+00 1.40153e+00 1.21560e+02 290.275 3.09511e+00  -8.37862e+00 0.00000e+00 0.00000e+00 4.25818e+01 290.275 7.89779e+01 110.275 0.9422 
1 1 1 7   78  0  o 13 1.84548e+01 5.98669e-01 2.40213e+02 179.911 -4.67221e+01 7.23774e-02  0.00000e+00 0.00000e+00 4.42617e+02 179.911 2.02404e+02 179.911 0.9892 
1 1 1 7   78  1  o 3  6.40214e+00 6.99647e-01 1.29208e+02 25.786  8.29619e+00  4.00803e+00  0.00000e+00 0.00000e+00 9.69111e+01 25.786  3.22974e+01 205.786 0.9441 
1 1 1 7   78  2  o 15 1.10321e+01 5.61736e-01 1.27938e+02 47.079  1.16544e+01  1.25324e+01  0.00000e+00 0.00000e+00 2.72625e+02 47.079  1.44687e+02 47.079  0.9703 
1 1 1 7   78  3  o 19 9.83230e+00 6.07291e-01 2.36077e+02 23.769  2.80874e+01  1.23699e+01  0.00000e+00 0.00000e+00 1.25842e+02 23.769  1.10234e+02 203.769 0.9836 
1 1 1 7   78  4  o 17 1.63081e+01 5.81798e-01 3.05055e+02 190.180 -6.73372e+01 -1.20916e+01 0.00000e+00 0.00000e+00 3.00824e+02 190.180 4.23078e+00 10.180  0.9927 
1 1 1 7   78  5  o 9  6.46188e+00 8.18790e-01 1.11706e+02 120.415 -4.92829e+00 8.39500e+00  0.00000e+00 0.00000e+00 1.17361e+02 120.415 5.65481e+00 120.415 0.9472 
1 1 1 7   78  6  o 2  4.30041e+00 1.00489e+00 5.56820e+01 45.120  2.09300e+00  2.10176e+00  0.00000e+00 0.00000e+00 7.42710e+01 45.120  1.85890e+01 45.120  0.8075 
1 1 1 7   78  7  o 4  1.16005e+01 7.31230e-01 1.68912e+02 230.977 -1.91094e+01 -2.35790e+01 0.00000e+00 0.00000e+00 2.57972e+02 230.977 8.90599e+01 230.977 0.9834 
1 1 1 7   78  8  o 10 5.35751e+00 1.19940e+00 9.63643e+01 170.978 -6.82838e+00 1.08416e+00  0.00000e+00 0.00000e+00 8.89592e+01 170.978 7.40518e+00 350.978 0.9246 
1 1 1 7   78  9  o 18 1.02881e+01 9.28653e-01 1.83663e+02 97.521  -4.26834e+00 3.23313e+01  0.00000e+00 0.00000e+00 1.95218e+02 97.521  1.15552e+01 97.521  0.9845 
1 1 1 7   78  10 o 9  3.49666e+00 1.10496e+00 5.19183e+01 246.048 -1.06918e+00 -2.40687e+00 0.00000e+00 0.00000e+00 4.99110e+01 246.048 2.00723e+00 66.048  0.7788 
1 1 1 7   78  11 o 8  1.15166e+01 1.06901e+00 1.59412e+02 89.815  1.02493e-01  3.18075e+01  0.00000e+00 0.00000e+00 2.64263e+02 89.815  1.04851e+02 89.815  0.9842 
1 1 1 7   78  12 o 9  4.29303e+00 1.24922e+00 4.92180e+01 357.276 3.48550e+00  -1.65847e-01 0.00000e+00 0.00000e+00 8.56128e+01 357.276 3.63948e+01 357.276 0.8406 
1 1 1 7   78  13 o 10 5.43830e+00 1.49071e+00 8.24929e+01 242.303 -3.03349e+00 -5.77863e+00 0.00000e+00 0.00000e+00 1.04328e+02 242.303 2.18349e+01 242.303 0.9198 
1 1 1 7   79  0  o 18 1.08779e+01 5.64376e-01 2.30228e+02 81.937  4.25832e+00  3.00590e+01  0.00000e+00 0.00000e+00 1.69792e+02 81.937  6.04366e+01 261.937 0.9834 
1 1 1 7   79  1  o 16 1.13929e+01 5.58150e-01 2.90881e+02 282.775 8.88172e+00  -3.91717e+01 0.00000e+00 0.00000e+00 1.29921e+02 282.775 1.60961e+02 102.775 0.9875 
1 1 1 7   79  2  o 17 9.83907e+00 5.95187e-01 1.47237e+02 170.372 -1.89630e+01 3.21682e+00  0.00000e+00 0.00000e+00 2.11154e+02 170.372 6.39167e+01 170.372 0.9736 
1 1 1 7   79  3  o 6  6.05066e+00 7.69833e-01 1.33556e+02 219.469 -7.36234e+00 -6.06227e+00 0.00000e+00 0.00000e+00 8.06156e+01 219.469 5.29403e+01 39.469  0.9460 
1 1 1 7   79  4  o 4  4.74031e+00 8.88346e-01 5.01998e+01 34.548  2.46727e+00  1.69875e+00  0.00000e+00 0.00000e+00 9.34130e+01 34.548  4.32132e+01 34.548  0.8097 
1 1 1 7   79  5  o 9  3.16963e+00 8.45905e-01 8.12326e+01 76.174  8.06429e-01  3.27673e+00  0.00000e+00 0.00000e+00 1.77148e+01 76.174  6.35178e+01 256.174 0.8343 
1 1 1 7   79  6  o 14 9.92113e+00 7.42663e-01 1.48700e+02 261.036 -3.62257e+00 -2.29661e+01 0.00000e+00 0.00000e+00 2.14443e+02 261.036 6.57432e+01 261.036 0.9783 
1 1 1 7   79  7  o 8  7.99875e+00 8.97769e-01 1.16947e+02 39.706  1.07457e+01  8.92307e+00  0.00000e+00 0.00000e+00 1.71387e+02 39.706  5.44400e+01 39.706  0.9635 
1 1 1 7   79  8  o 17 3.91142e+00 1.17601e+00 5.89921e+01 80.399  5.29289e-01  3.12901e+00  0.00000e+00 0.00000e+00 6.12796e+01 80.399  2.28743e+00 80.399  0.8220 
1 1 1 7   79  9  o 9  1.23094e+01 9.09759e-01 2.32923e+02 318.039 3.50505e+01  -3.15168e+01 0.00000e+00 0.00000e+00 2.22504e+02 318.039 1.04195e+01 138.039 0.9893 
1 1 1 7   79  10 o 10 1.78989e+01 8.33388e-01 2.90586e+02 160.805 -8.96722e+01 3.12187e+01  0.00000e+00 0.00000e+00 3.75047e+02 160.805 8.44614e+01 160.805 0.9947 
1 1 1 7   79  11 o 16 8.55604e+00 1.23200e+00 1.54571e+02 252.700 -6.06790e+00 -1.94814e+01 0.00000e+00 0.00000e+00 1.57253e+02 252.700 2.68205e+00 252.700 0.9752 
1 1 1 7   79  12 o 13 3.08387e+00 9.91829e-01 5.50662e+01 205.325 -3.27011e+00 -1.54750e+00 0.00000e+00 0.00000e+00 4.25140e+01 205.325 1.25522e+01 25.325  0.8470 
1 1 1 7   79  13 o 18 4.31001e+00 1.25717e+00 7.51719e+01 318.851 4.46362e+00  -3.90064e+00 0.00000e+00 0.00000e+00 7.14712e+01 318.851 3.70070e+00 138.851 0.9112 
1 1 1 7   80  0  f 0  4.09247e+00 7.88918e-01 3.29752e+01 354.592 1.67275e+00  -1.58358e-01 0.00000e+00 0.00000e+00 6.45843e+01 354.592 3.16090e+01 354.592 0.6376 
1 1 1 7   80  1  o 17 6.32241e+00 6.80452e-01 1.04072e+02 272.583 3.82865e-01  -8.48798e+00 0.00000e+00 0.00000e+00 1.17977e+02 272.583 1.39055e+01 272.583 0.9392 
1 1 1 7   80  2  o 2  8.42172e+00 6.44329e-01 1.46376e+02 238.254 -7.97071e+00 -1.28825e+01 0.00000e+00 0.00000e+00 1.58041e+02 238.254 1.16646e+01 238.254 0.9664 
1 1 1 7   80  3  o 6  4.44649e+00 8.43169e-01 9.90981e+01 281.626 1.06949e+00  -5.19797e+00 0.00000e+00 0.00000e+00 5.06093e+01 281.626 4.84887e+01 101.626 0.9000 
1 1 1 7   80  4  o 11 8.08436e+00 7.21363e-01 1.68643e+02 124.012 -1.06863e+01 1.58358e+01  0.00000e+00 0.00000e+00 1.25771e+02 124.012 4.28715e+01 304.012 0.9735 
1 1 1 7   80  5  o 14 5.14501e+00 9.06486e-01 1.41669e+02 290.771 3.40101e+00  -8.96703e+00 0.00000e+00 0.00000e+00 4.04791e+01 290.771 1.01190e+02 110.771 0.9463 
1 1 1 7   80  6  o 8  5.32539e+00 9.49553e-01 1.18601e+02 54.604  5.13240e+00  7.22307e+00  0.00000e+00 0.00000e+00 6.90119e+01 54.604  4.95888e+01 234.604 0.9418 
1 1 1 7   80  7  o 7  4.07019e+00 1.02062e+00 4.87129e+01 242.448 -1.34011e+00 -2.56862e+00 0.00000e+00 0.00000e+00 7.33992e+01 242.448 2.46863e+01 242.448 0.8021 
1 1 1 7   80  8  o 15 7.41181e+00 1.26640e+00 1.09107e+02 151.182 -9.34641e+00 5.14202e+00  0.00000e+00 0.00000e+00 1.54747e+02 151.182 4.56406e+01 151.182 0.9519 
1 1 1 7   80  9  o 15 2.68375e+00 8.45635e-01 4.29665e+01 213.927 -1.54650e+00 -1.04025e+00 0.00000e+00 0.00000e+00 2.46735e+01 213.927 1.82930e+01 33.927  0.6741 
1 1 1 7   80  10 o 1  4.66712e+00 1.23482e+00 8.20098e+01 171.224 -5.50725e+00 8.50217e-01  0.00000e+00 0.00000e+00 7.58918e+01 171.224 6.11801e+00 351.224 0.9052 
1 1 1 7   80  11 o 5  3.60099e+00 1.15005e+00 1.42748e+02 131.101 -5.82956e+00 6.68240e+00  0.00000e+00 0.00000e+00 1.60300e+01 311.101 1.58778e+02 311.101 0.9418 
1 1 1 7   80  12 o 4  6.27754e+00 1.48984e+00 1.28482e+02 354.260 1.19137e+01  -1.19751e+00 0.00000e+00 0.00000e+00 9.59605e+01 354.260 3.25214e+01 174.260 0.9573 
1 1 1 7   80  13 o 18 3.22340e+00 1.08612e+00 4.21317e+01 170.224 -3.05562e+00 5.26484e-01  0.00000e+00 0.00000e+00 5.61982e+01 170.224 1.40665e+01 170.224 0.8172 
1 1 1 7   81  0  f 0  5.51843e+00 7.22034e-01 1.58036e+02 308.793 6.55542e+00  -8.15547e+00 0.00000e+00 0.00000e+00 3.81136e+01 308.793 1.19923e+02 128.793 0.9509 
1 1 1 7   81  1  o 19 7.67991e+00 6.48166e-01 8.16413e+01 243.952 -3.37557e+00 -6.90634e+00 0.00000e+00 0.00000e+00 1.86106e+02 243.952 1.04465e+02 243.952 0.9325 
1 1 1 7   81  2  o 4  1.00555e+01 6.02931e-01 1.51575e+02 118.772 -9.59003e+00 1.74644e+01  0.00000e+00 0.00000e+00 2.14885e+02 118.772 6.33105e+01 118.772 0.9746 
1 1 1 7   81  3  o 18 1.07032e+01 6.04501e-01 2.22695e+02 173.770 -3.33166e+01 3.63671e+00  0.00000e+00 0.00000e+00 1.71583e+02 173.770 5.11118e+01 353.770 0.9850 
1 1 1 7   81  4  o 19 2.77289e+00 8.13254e-01 3.79931e+01 277.231 1.76054e-01  -1.38765e+00 0.00000e+00 0.00000e+00 2.11327e+01 277.231 1.68604e+01 97.231  0.5701 
1 1 1 7   81  5  o 19 6.42846e+00 8.57303e-01 1.21301e+02 8.591   1.15341e+01  1.74253e+00  0.00000e+00 0.00000e+00 1.08589e+02 8.591   1.27121e+01 188.591 0.9561 
1 1 1 7   81  6  f 0  6.37225e+00 8.75411e-01 8.67479e+01 213.205 -6.70612e+00 -4.38913e+00 0.00000e+00 0.00000e+00 1.36171e+02 213.205 4.94232e+01 213.205 0.9354 
1 1 1 7   81  7  o 9  4.24964e+00 1.02542e+00 9.39151e+01 268.494 -1.42236e-01 -5.41071e+00 0.00000e+00 0.00000e+00 4.94539e+01 268.494 4.44612e+01 88.494  0.9021 
1 1 1 7   81  8  o 16 7.69957e+00 1.21066e+00 1.57199e+02 106.854 -4.57207e+00 1.50919e+01  0.00000e+00 0.00000e+00 1.21401e+02 106.854 3.57973e+01 286.854 0.9678 
1 1 1 7   81  9  o 11 3.59347e+00 1.03045e+00 8.16552e+01 17.789  4.37288e+00  1.40308e+00  0.00000e+00 0.00000e+00 3.69528e+01 17.789  4.47024e+01 197.789 0.8830 
1 1 1 7   81  10 o 3  8.91578e+00 1.14780e+00 1.59207e+02 185.436 -2.29388e+01 -2.18300e+00 0.00000e+00 0.00000e+00 1.66659e+02 185.436 7.45252e+00 185.436 0.9781 
1 1 1 7   81  11 o 5  3.77811e+00 1.13562e+00 3.17201e+01 103.114 -4.72371e-01 2.02759e+00  0.00000e+00 0.00000e+00 6.85949e+01 103.114 3.68748e+01 103.114 0.7108 
1 1 1 7   81  12 o 2  7.06084e+00 1.32396e+00 9.07866e+01 339.427 9.63571e+00  -3.61659e+00 0.00000e+00 0.00000e+00 1.59712e+02 339.427 6.89251e+01 339.427 0.9501 
1 1 1 7   81  13 o 18 3.26481e+00 1.07407e+00 3.13134e+01 116.272 -1.02340e+00 2.07326e+00  0.00000e+00 0.00000e+00 5.92109e+01 116.272 2.78975e+01 116.272 0.7429 
1 1 1 7   82  0  o 13 9.99705e+00 5.47084e-01 1.46423e+02 233.973 -1.19421e+01 -1.64208e+01 0.00000e+00 0.00000e+00 2.17846e+02 233.973 7.14238e+01 233.973 0.9751 
1 1 1 7   82  1  f 0  6.71114e+00 6.91921e-01 1.14283e+02 94.715  -8.00579e-01 9.70595e+00  0.00000e+00 0.00000e+00 1.23323e+02 94.715  9.03969e+00 94.715  0.9472 
1 1 1 7   82  2  o 3  1.07440e+01 6.05443e-01 1.60901e+02 262.156 -3.31720e+00 -2.40773e+01 0.00000e+00 0.00000e+00 2.32427e+02 262.156 7.15265e+01 262.156 0.9792 
1 1 1 7   82  3  o 5  3.42627e+00 8.29332e-01 7.85289e+01 47.431  2.32261e+00  2.52856e+00  0.00000e+00 0.00000e+00 2.87713e+01 47.431  4.97577e+01 227.431 0.8375 
1 1 1 7   82  4  f 0  1.02721e+01 6.46585e-01 2.23362e+02 91.386  -8.10237e-01 3.34916e+01  0.00000e+00 0.00000e+00 1.54975e+02 91.386  6.83866e+01 271.386 0.9850 
1 1 1 7   82  5  o 10 8.89012e+00 7.02639e-01 1.67648e+02 240.786 -1.14407e+01 -2.04595e+01 0.00000e+00 0.00000e+00 1.57620e+02 240.786 1.00279e+01 60.787  0.9784 
1 1 1 7   82  6  o 2  4.14619e+00 9.75384e-01 1.00707e+02 105.260 -1.57532e+00 5.77410e+00  0.00000e+00 0.00000e+00 4.07039e+01 105.260 6.00033e+01 285.260 0.9121 
1 1 1 7   82  7  o 13 7.75451e+00 8.75053e-01 1.26732e+02 215.379 -1.21220e+01 -8.60788e+00 0.00000e+00 0.00000e+00 1.53265e+02 215.379 2.65330e+01 215.379 0.9658 
1 1 1 7   82  8  o 12 6.95954e+00 1.37783e+00 9.04173e+01 53.093  4.88264e+00  6.50137e+00  0.00000e+00 0.00000e+00 1.53171e+02 53.093  6.27535e+01 53.093  0.9363 
1 1 1 7   82  9  o 3  4.50616e+00 1.20786e+00 6.19245e+01 125.533 -2.20934e+00 3.09364e+00  0.00000e+00 0.00000e+00 8.21350e+01 125.533 2.02105e+01 125.533 0.8554 
1 1 1 7   82  10 o 15 6.06464e+00 1.28666e+00 1.09983e+02 348.850 9.73307e+00  -1.91837e+00 0.00000e+00 0.00000e+00 1.04856e+02 348.850 5.12716e+00 168.850 0.9482 
1 1 1 7   82  11 o 9  3.47208e+00 1.05062e+00 7.76004e+01 158.374 -4.58329e+00 1.81704e+00  0.00000e+00 0.00000e+00 3.80354e+01 158.374 3.95650e+01 338.374 0.8917 
1 1 1 7   82  12 o 5  4.76239e+00 1.28724e+00 8.08957e+01 153.232 -5.96187e+00 3.00736e+00  0.00000e+00 0.00000e+00 8.29806e+01 153.232 2.08492e+00 153.232 0.9217 
1 1 1 7   82  13 o 2  4.05949e+00 1.26927e+00 5.70535e+01 153.027 -4.06558e+00 2.06912e+00  0.00000e+00 0.00000e+00 7.65663e+01 153.027 1.95129e+01 153.027 0.8821 
1 1 1 7   83  0  o 5  5.08754e+00 7.60542e-01 9.40223e+01 268.969 -1.13883e-01 -6.32517e+00 0.00000e+00 0.00000e+00 8.03067e+01 268.969 1.37156e+01 88.969  0.9171 
1 1 1 7   83  1  o 3  5.60955e+00 7.47856e-01 8.42805e+01 260.605 -1.03167e+00 -6.23544e+00 0.00000e+00 0.00000e+00 1.07967e+02 260.605 2.36861e+01 260.605 0.9171 
1 1 1 7   83  2  f 0  7.03769e+00 6.93693e-01 8.59725e+01 43.152  5.92687e+00  5.55634e+00  0.00000e+00 0.00000e+00 1.60316e+02 43.152  7.43432e+01 43.152  0.9363 
1 1 1 7   83  3  o 4  1.72685e+01 5.68710e-01 2.65929e+02 120.752 -3.61152e+01 6.06999e+01  0.00000e+00 0.00000e+00 3.75027e+02 120.752 1.09098e+02 120.752 0.9929 
1 1 1 7   83  4  o 12 2.58514e+00 7.70474e-01 5.34216e+01 280.143 3.78612e-01  -2.11639e+00 0.00000e+00 0.00000e+00 1.62535e+01 280.143 3.71681e+01 100.143 0.7209 
1 1 1 7   83  5  o 3  4.65045e+00 8.99200e-01 9.65872e+01 52.299  3.94131e+00  5.09923e+00  0.00000e+00 0.00000e+00 6.31479e+01 52.299  3.34393e+01 232.299 0.9188 
1 1 1 7   83  6  o 17 2.88511e+00 8.72402e-01 6.33016e+01 114.925 -1.21656e+00 2.61790e+00  0.00000e+00 0.00000e+00 2.31180e+01 114.925 4.01836e+01 294.925 0.8013 
1 1 1 7   83  7  o 17 4.74671e+00 8.63118e-01 2.61899e+01 340.426 1.91613e+00  -6.81329e-01 0.00000e+00 0.00000e+00 9.85823e+01 340.426 7.23924e+01 340.426 0.7032 
1 1 1 7   83  8  o 18 4.39036e+00 1.19426e+00 8.64046e+01 323.374 4.30044e+00  -3.19685e+00 0.00000e+00 0.00000e+00 6.14446e+01 323.374 2.49600e+01 143.374 0.9011 
1 1 1 7   83  9  o 6  2.67808e+00 8.80491e-01 4.53739e+01 150.955 -1.88612e+00 1.04744e+00  0.00000e+00 0.00000e+00 2.68725e+01 150.955 1.85014e+01 330.955 0.7220 
1 1 1 7   83  10 f 0  6.59743e+00 1.25270e+00 1.03340e+02 123.489 -5.72443e+00 8.65233e+00  0.00000e+00 0.00000e+00 1.30895e+02 123.489 2.75550e+01 123.489 0.9505 
1 1 1 7   83  11 o 15 6.64783e+00 1.35996e+00 4.20440e+01 274.274 3.16067e-01  -4.22902e+00 0.00000e+00 0.00000e+00 1.74453e+02 274.274 1.32409e+02 274.274 0.8722 
1 1 1 7   83  12 o 12 3.41563e+00 1.13169e+00 8.41106e+01 96.091  -5.96078e-01 5.58599e+00  0.00000e+00 0.00000e+00 3.13866e+01 96.091  5.27240e+01 276.091 0.9060 
1 1 1 7   83  13 o 15 5.14849e+00 1.45102e+00 1.31573e+02 353.270 1.10479e+01  -1.30369e+00 0.00000e+00 0.00000e+00 5.16467e+01 353.270 7.99268e+01 173.270 0.9539 
1 1 1 7   84  0  o 8  1.83751e+01 5.31260e-01 3.46469e+02 138.346 -7.09640e+01 6.31248e+01  0.00000e+00 0.00000e+00 3.36270e+02 138.346 1.01995e+01 318.346 0.9947 
1 1 1 7   84  1  o 13 1.36079e+01 5.43580e-01 2.72583e+02 14.581  5.04812e+01  1.31319e+01  0.00000e+00 0.00000e+00 2.30940e+02 14.581  4.16423e+01 194.581 0.9904 
1 1 1 7   84  2  o 18 6.47104e+00 7.55714e-01 1.14743e+02 71.663  3.35468e+00  1.01215e+01  0.00000e+00 0.00000e+00 1.15441e+02 71.663  6.98102e-01 71.663  0.9519 
1 1 1 7   84  3  o 3  1.60640e+01 5.79771e-01 2.56638e+02 272.728 2.87535e+00  -6.03527e+01 0.00000e+00 0.00000e+00 3.38751e+02 272.728 8.21130e+01 272.728 0.9917 
1 1 1 7   84  4  o 18 4.31471e+00 8.60792e-01 7.19607e+01 217.864 -3.59169e+00 -2.79245e+00 0.00000e+00 0.00000e+00 7.02418e+01 217.864 1.71893e+00 37.864  0.8818 
1 1 1 7   84  5  o 5  1.31703e+01 6.43054e-01 2.24173e+02 111.702 -1.82996e+01 4.59794e+01  0.00000e+00 0.00000e+00 2.63095e+02 111.702 3.89218e+01 111.702 0.9898 
1 1 1 7   84  6  o 10 3.96575e+00 1.02600e+00 1.00374e+02 236.529 -3.25185e+00 -4.91834e+00 0.00000e+00 0.00000e+00 3.46119e+01 236.529 6.57622e+01 56.529  0.9107 
1 1 1 7   84  7  o 7  3.87676e+00 1.00639e+00 6.46299e+01 114.581 -1.52635e+00 3.33677e+00  0.00000e+00 0.00000e+00 5.84406e+01 114.581 6.18926e+00 294.581 0.8495 
1 1 1 7   84  8  o 6  9.09397e+00 9.19634e-01 1.83991e+02 148.646 -2.42164e+01 1.47551e+01  0.00000e+00 0.00000e+00 1.49751e+02 148.646 3.42393e+01 328.646 0.9822 
1 1 1 7   84  9  o 3  5.68378e+00 1.22774e+00 8.65938e+01 70.247  2.43193e+00  6.77234e+00  0.00000e+00 0.00000e+00 1.10365e+02 70.247  2.37714e+01 70.247  0.9277 
1 1 1 7   84  10 o 18 3.86543e+00 1.06143e+00 5.11944e+01 291.095 1.31241e+00  -3.40208e+00 0.00000e+00 0.00000e+00 7.12732e+01 291.095 2.00788e+01 291.095 0.8484 
1 1 1 7   84  11 o 8  4.19307e+00 1.23118e+00 6.55169e+01 227.508 -3.32828e+00 -3.63316e+00 0.00000e+00 0.00000e+00 7.40557e+01 227.508 8.53882e+00 227.508 0.8917 
1 1 1 7   84  12 o 18 4.60659e+00 1.33104e+00 7.82388e+01 156.423 -5.67454e+00 2.47646e+00  0.00000e+00 0.00000e+00 7.90852e+01 156.423 8.46442e-01 156.423 0.9152 
1 1 1 7   85  0  o 12 6.99476e+00 6.88429e-01 9.74740e+01 252.343 -2.87399e+00 -9.02899e+00 0.00000e+00 0.00000e+00 1.49545e+02 252.343 5.20713e+01 252.343 0.9457 
1 1 1 7   85  1  o 11 4.78277e+00 8.26889e-01 8.82515e+01 217.391 -4.66973e+00 -3.56912e+00 0.00000e+00 0.00000e+00 7.43970e+01 217.391 1.38545e+01 37.391  0.9104 
1 1 1 7   85  2  o 18 3.72418e+00 8.72586e-01 1.41262e+02 36.119  5.57942e+00  4.07149e+00  0.00000e+00 0.00000e+00 1.26317e+01 216.119 1.53893e+02 216.119 0.9245 
1 1 1 7   85  3  o 13 5.72323e+00 8.19364e-01 8.10267e+01 232.214 -4.21945e+00 -5.44236e+00 0.00000e+00 0.00000e+00 1.16624e+02 232.214 3.55968e+01 232.214 0.9242 
1 1 1 7   85  4  o 11 9.42185e+00 6.63199e-01 1.29356e+02 89.308  2.34018e-01  1.93890e+01  0.00000e+00 0.00000e+00 2.13518e+02 89.308  8.41617e+01 89.308  0.9739 
1 1 1 7   85  5  f 0  5.63592e+00 8.85695e-01 1.71859e+02 272.686 7.13014e-01  -1.51980e+01 0.00000e+00 0.00000e+00 3.17033e+01 272.686 1.40155e+02 92.686  0.9666 
1 1 1 7   85  6  o 14 2.43365e+00 7.89925e-01 6.47331e+01 11.188  2.63758e+00  5.21672e-01  0.00000e+00 0.00000e+00 6.56595e+00 11.188  5.81671e+01 191.188 0.7841 
1 1 1 7   85  7  o 8  4.03558e+00 1.00061e+00 5.38580e+01 223.310 -2.60852e+00 -2.45897e+00 0.00000e+00 0.00000e+00 7.36115e+01 223.310 1.97535e+01 223.310 0.8454 
1 1 1 7   85  8  o 11 1.07973e+01 8.65665e-01 2.02344e+02 121.070 -2.04754e+01 3.39824e+01  0.00000e+00 0.00000e+00 1.95879e+02 121.070 6.46588e+00 301.070 0.9873 
1 1 1 7   85  9  o 16 8.51296e+00 1.05135e+00 1.37067e+02 163.058 -1.93499e+01 5.89438e+00  0.00000e+00 0.00000e+00 1.72901e+02 163.058 3.58340e+01 163.058 0.9750 
1 1 1 7   85  10 o 16 5.52335e+00 1.29063e+00 7.83471e+01 80.848  1.06627e+00  6.61879e+00  0.00000e+00 0.00000e+00 1.11800e+02 80.848  3.34524e+01 80.848  0.9221 
1 1 1 7   85  11 o 11 6.50905e+00 1.32812e+00 1.27327e+02 295.601 6.10119e+00  -1.27336e+01 0.00000e+00 0.00000e+00 1.06837e+02 295.601 2.04903e+01 115.601 0.9639 
1 1 1 7   85  12 o 10 4.20105e+00 1.24299e+00 7.49587e+01 58.069  3.29058e+00  5.28009e+00  0.00000e+00 0.00000e+00 6.85502e+01 58.069  6.40850e+00 238.069 0.9157 
1 1 1 7   86  0  o 5  2.25130e+00 6.84781e-01 6.52848e+00 49.301  1.37748e-01  1.60156e-01  0.00000e+00 0.00000e+00 2.30028e+00 49.301  4.22820e+00 229.301 0.1050 
1 1 1 7   86  1  o 18 2.31559e+00 7.23615e-01 3.46292e+01 61.613  5.30879e-01  9.82354e-01  0.00000e+00 0.00000e+00 7.41435e+00 61.613  2.72148e+01 241.612 0.4862 
1 1 1 7   86  2  o 3  4.96044e+00 8.18395e-01 6.04124e+01 329.062 3.81908e+00  -2.28908e+00 0.00000e+00 0.00000e+00 1.02436e+02 329.062 4.20232e+01 329.062 0.8789 
1 1 1 7   86  3  o 19 7.43809e+00 7.34014e-01 1.31468e+02 188.499 -1.48682e+01 -2.22188e+00 0.00000e+00 0.00000e+00 1.36988e+02 188.499 5.52026e+00 188.499 0.9661 
1 1 1 7   86  4  o 10 5.79237e+00 8.51707e-01 8.08033e+01 150.896 -6.23966e+00 3.47352e+00  0.00000e+00 0.00000e+00 1.19815e+02 150.896 3.90120e+01 150.896 0.9271 
1 1 1 7   86  5  o 7  4.49343e+00 9.78839e-01 7.89075e+01 175.916 -5.38270e+00 3.84312e-01  0.00000e+00 0.00000e+00 7.24853e+01 175.916 6.42227e+00 355.916 0.9018 
1 1 1 7   86  6  o 5  6.43595e+00 9.53477e-01 1.33725e+02 123.625 -7.57649e+00 1.13929e+01  0.00000e+00 0.00000e+00 9.77459e+01 123.625 3.59793e+01 303.625 0.9627 
1 1 1 7   86  7  o 12 3.26168e+00 9.35219e-01 5.53208e+01 310.979 1.95582e+00  -2.25160e+00 0.00000e+00 0.00000e+00 4.32041e+01 310.979 1.21167e+01 130.979 0.8087 
1 1 1 7   86  8  o 11 4.57485e+00 1.10539e+00 8.11586e+01 69.907  1.94094e+00  5.30589e+00  0.00000e+00 0.00000e+00 7.37302e+01 69.907  7.42843e+00 249.907 0.9065 
1 1 1 7   86  9  o 18 5.37610e+00 1.12452e+00 8.53039e+01 10.341  7.52090e+00  1.37233e+00  0.00000e+00 0.00000e+00 1.01798e+02 10.341  1.64940e+01 10.341  0.9321 
1 1 1 7   86  10 o 8  5.41899e+00 1.27948e+00 7.91703e+01 349.846 6.53989e+00  -1.17128e+00 0.00000e+00 0.00000e+00 1.07189e+02 349.846 2.80190e+01 349.846 0.9213 
1 1 1 7   86  11 o 17 3.91294e+00 1.19349e+00 7.52012e+01 214.310 -4.59527e+00 -3.13587e+00 0.00000e+00 0.00000e+00 5.69318e+01 214.310 1.82694e+01 34.310  0.9050 
1 1 1 7   86  12 o 12 5.82271e+00 1.47131e+00 9.37702e+01 181.363 -8.65307e+00 -2.05933e-01 0.00000e+00 0.00000e+00 1.10443e+02 181.363 1.66727e+01 181.363 0.9403 
1 1 1 7   87  0  o 3  4.15157e+00 9.19479e-01 7.66812e+01 38.845  3.59119e+00  2.89206e+00  0.00000e+00 0.00000e+00 6.02297e+01 38.845  1.64516e+01 218.845 0.8835 
1 1 1 7   87  1  o 9  5.58088e+00 8.21055e-01 8.70328e+01 148.890 -6.16449e+00 3.72016e+00  0.00000e+00 0.00000e+00 1.06270e+02 148.890 1.92372e+01 148.890 0.9277 
1 1 1 7   87  2  o 12 4.37268e+00 8.35161e-01 3.53047e+01 310.012 1.45953e+00  -1.73866e+00 0.00000e+00 0.00000e+00 8.51202e+01 310.012 4.98155e+01 310.012 0.7375 
1 1 1 7   87  3  o 6  1.71223e+01 5.82198e-01 3.14552e+02 78.491  1.76159e+01  8.65187e+01  0.00000e+00 0.00000e+00 3.21298e+02 78.491  6.74540e+00 78.491  0.9943 
1 1 1 7   87  4  o 6  6.02679e+00 8.68657e-01 1.24785e+02 242.768 -5.44907e+00 -1.05884e+01 0.00000e+00 0.00000e+00 9.06492e+01 242.768 3.41355e+01 62.768  0.9570 
1 1 1 7   87  5  o 5  1.26509e+01 6.58297e-01 2.29793e+02 317.843 3.91798e+01  -3.54728e+01 0.00000e+00 0.00000e+00 2.38236e+02 317.843 8.44260e+00 317.843 0.9905 
1 1 1 7   87  6  o 10 7.19059e+00 9.02423e-01 9.63440e+01 197.705 -1.10627e+01 -3.53157e+00 0.00000e+00 0.00000e+00 1.60378e+02 197.705 6.40340e+01 197.705 0.9559 
1 1 1 7   87  7  o 10 4.68617e+00 1.08967e+00 1.23744e+02 254.184 -2.41638e+00 -8.53024e+00 0.00000e+00 0.00000e+00 4.10713e+01 254.184 8.26731e+01 74.184  0.9418 
1 1 1 7   87  8  o 9  3.98836e+00 1.10961e+00 8.77833e+01 81.797  7.79603e-01  5.40813e+00  0.00000e+00 0.00000e+00 4.67088e+01 81.797  4.10745e+01 261.797 0.9031 
1 1 1 7   87  9  o 15 8.12179e+00 1.13250e+00 1.36697e+02 78.148  3.77351e+00  1.79806e+01  0.00000e+00 0.00000e+00 1.58111e+02 78.148  2.14149e+01 78.148  0.9724 
1 1 1 7   87  10 f 0  3.49424e+00 1.07386e+00 2.64284e+01 218.246 -1.37117e+00 -1.08077e+00 0.00000e+00 0.00000e+00 5.85011e+01 218.246 3.20728e+01 218.246 0.6513 
1 1 1 7   87  11 o 19 3.11897e+00 1.03027e+00 5.50381e+01 30.128  3.26259e+00  1.89340e+00  0.00000e+00 0.00000e+00 4.43440e+01 30.128  1.06941e+01 210.128 0.8542 
1 1 1 7   87  12 o 9  4.25925e+00 1.28231e+00 7.96341e+01 184.427 -6.57921e+00 -5.09382e-01 0.00000e+00 0.00000e+00 6.66030e+01 184.427 1.30311e+01 4.427   0.9208 
1 1 1 7   88  0  o 7  3.51588e+00 8.56262e-01 7.16567e+01 149.128 -3.14844e+00 1.88219e+00  0.00000e+00 0.00000e+00 3.97919e+01 149.128 3.18648e+01 329.128 0.8494 
1 1 1 7   88  1  o 19 4.71094e+00 8.38183e-01 6.38217e+01 156.116 -4.03200e+00 1.78537e+00  0.00000e+00 0.00000e+00 9.05023e+01 156.116 2.66806e+01 156.116 0.8776 
1 1 1 7   88  2  o 11 5.12988e+00 8.31263e-01 1.13596e+02 40.934  6.51624e+00  5.65132e+00  0.00000e+00 0.00000e+00 6.64527e+01 40.934  4.71436e+01 220.934 0.9401 
1 1 1 7   88  3  o 8  5.84305e+00 8.54931e-01 1.62765e+02 31.151  1.15785e+01  6.99873e+00  0.00000e+00 0.00000e+00 4.71833e+01 31.151  1.15582e+02 211.151 0.9623 
1 1 1 7   88  4  o 2  6.76956e+00 8.42373e-01 8.31848e+01 265.646 -6.99470e-01 -9.18680e+00 0.00000e+00 0.00000e+00 1.55460e+02 265.646 7.22756e+01 265.646 0.9441 
1 1 1 7   88  5  o 16 7.46686e+00 8.58508e-01 9.48414e+01 113.256 -4.68639e+00 1.09046e+01  0.00000e+00 0.00000e+00 1.71967e+02 113.256 7.71254e+01 113.256 0.9569 
1 1 1 7   88  6  o 4  8.57181e+00 7.95327e-01 1.48090e+02 84.358  2.18147e+00  2.20820e+01  0.00000e+00 0.00000e+00 1.64682e+02 84.358  1.65916e+01 84.358  0.9772 
1 1 1 7   88  7  o 10 3.46626e+00 1.02617e+00 7.85041e+01 233.301 -2.67618e+00 -3.59048e+00 0.00000e+00 0.00000e+00 3.53396e+01 233.301 4.31645e+01 53.301  0.8797 
1 1 1 7   88  8  o 19 6.59347e+00 1.00554e+00 8.73840e+01 111.552 -3.62749e+00 9.18427e+00  0.00000e+00 0.00000e+00 1.45926e+02 111.552 5.85423e+01 111.552 0.9479 
1 1 1 7   88  9  o 3  9.45389e+00 1.00770e+00 1.59717e+02 287.049 8.47136e+00  -2.76241e+01 0.00000e+00 0.00000e+00 1.86942e+02 287.049 2.72252e+01 287.049 0.9825 
1 1 1 7   88  10 o 3  4.79292e+00 1.26194e+00 9.05791e+01 122.492 -4.07883e+00 6.40441e+00  0.00000e+00 0.00000e+00 7.60101e+01 122.492 1.45690e+01 302.492 0.9316 
1 1 1 7   88  11 o 10 6.02877e+00 1.39897e+00 1.44346e+02 199.765 -1.30352e+01 -4.68403e+00 0.00000e+00 0.00000e+00 7.22249e+01 199.765 7.21212e+01 19.765  0.9632 
1 1 1 7   88  12 o 19 3.08985e+00 1.03441e+00 4.98374e+01 79.130  6.97995e-01  3.63496e+00  0.00000e+00 0.00000e+00 4.81849e+01 79.130  1.65256e+00 259.130 0.8510 
1 1 1 7   89  0  o 13 3.59830e+00 8.48060e-01 7.09223e+01 302.282 2.00172e+00  -3.16856e+00 0.00000e+00 0.00000e+00 4.36007e+01 302.282 2.73216e+01 122.282 0.8531 
1 1 1 7   89  1  o 2  5.38380e+00 8.58677e-01 1.24284e+02 181.396 -9.75889e+00 -2.37775e-01 0.00000e+00 0.00000e+00 6.60411e+01 181.396 5.82433e+01 1.396   0.9473 
1 1 1 7   89  2  o 12 9.24018e+00 6.41029e-01 1.44647e+02 21.220  1.93712e+01  7.52146e+00  0.00000e+00 0.00000e+00 1.91840e+02 21.220  4.71932e+01 21.220  0.9756 
1 1 1 7   89  3  o 19 6.25720e+00 8.22934e-01 1.04177e+02 40.581  7.41637e+00  6.35238e+00  0.00000e+00 0.00000e+00 1.17099e+02 40.581  1.29215e+01 40.581  0.9473 
1 1 1 7   89  4  o 9  4.97514e+00 8.85613e-01 1.24392e+02 204.455 -9.14260e+00 -4.15785e+00 0.00000e+00 0.00000e+00 5.18382e+01 204.455 7.25534e+01 24.455  0.9488 
1 1 1 7   89  5  o 11 4.94167e+00 9.59491e-01 8.82360e+01 2.328   7.07127e+00  2.87489e-01  0.00000e+00 0.00000e+00 8.26684e+01 2.328   5.56760e+00 182.328 0.9264 
1 1 1 7   89  6  o 5  6.44988e+00 9.65996e-01 9.03040e+01 327.378 7.43346e+00  -4.75782e+00 0.00000e+00 0.00000e+00 1.36393e+02 327.378 4.60891e+01 327.378 0.9415 
1 1 1 7   89  7  o 18 1.06557e+01 9.03052e-01 2.10034e+02 107.509 -1.18053e+01 3.74213e+01  0.00000e+00 0.00000e+00 1.82603e+02 107.509 2.74304e+01 287.509 0.9872 
1 1 1 7   89  8  o 16 6.44496e+00 1.12506e+00 1.06568e+02 248.036 -4.28419e+00 -1.06230e+01 0.00000e+00 0.00000e+00 1.23205e+02 248.036 1.66366e+01 248.036 0.9553 
1 1 1 7   89  9  o 4  6.21995e+00 1.26731e+00 1.13081e+02 139.191 -8.38158e+00 7.23707e+00  0.00000e+00 0.00000e+00 1.08251e+02 139.191 4.83004e+00 319.191 0.9537 
1 1 1 7   89  10 o 4  4.05565e+00 1.19778e+00 9.80077e+01 29.418  6.58855e+00  3.71520e+00  0.00000e+00 0.00000e+00 4.28800e+01 29.418  5.51276e+01 209.418 0.9313 
1 1 1 7   89  11 o 7  7.65967e+00 1.32163e+00 8.93211e+01 278.626 1.92349e+00  -1.26788e+01 0.00000e+00 0.00000e+00 1.84908e+02 278.626 9.55872e+01 278.626 0.9602 
1 1 1 7   89  12 o 8  3.74201e+00 1.19649e+00 1.19099e+02 74.906  2.49199e+00  9.23987e+00  0.00000e+00 0.00000e+00 1.28674e+01 74.906  1.06231e+02 254.906 0.9462 
1 1 1 7   90  0  o 2  6.37526e+00 7.77690e-01 1.37616e+02 68.088  4.81814e+00  1.19781e+01  0.00000e+00 0.00000e+00 9.07739e+01 68.088  4.68421e+01 248.088 0.9605 
1 1 1 7   90  1  o 9  7.17770e+00 7.09106e-01 1.06720e+02 66.377  4.64089e+00  1.06108e+01  0.00000e+00 0.00000e+00 1.49235e+02 66.377  4.25157e+01 66.377  0.9558 
1 1 1 7   90  2  o 8  9.61157e+00 6.34771e-01 1.98245e+02 250.986 -1.00723e+01 -2.92287e+01 0.00000e+00 0.00000e+00 1.54570e+02 250.986 4.36758e+01 70.986  0.9837 
1 1 1 7   90  3  o 7  4.83762e+00 8.68577e-01 9.11566e+01 156.831 -6.14894e+00 2.63154e+00  0.00000e+00 0.00000e+00 7.52823e+01 156.831 1.58743e+01 336.831 0.9219 
1 1 1 7   90  4  o 16 3.39243e+00 8.97581e-01 4.83033e+01 176.903 -2.68204e+00 1.45113e-01  0.00000e+00 0.00000e+00 5.09384e+01 176.903 2.63514e+00 176.903 0.7838 
1 1 1 7   90  5  o 6  5.13367e+00 9.99605e-01 1.38648e+02 114.410 -4.59369e+00 1.01220e+01  0.00000e+00 0.00000e+00 4.41254e+01 114.410 9.45227e+01 294.410 0.9539 
1 1 1 7   90  6  o 18 1.10980e+01 7.34843e-01 1.48305e+02 280.131 5.33975e+00  -2.98843e+01 0.00000e+00 0.00000e+00 2.59010e+02 280.131 1.10705e+02 280.131 0.9834 
1 1 1 7   90  7  o 19 7.21092e+00 1.16077e+00 8.87030e+01 2.626   9.77308e+00  4.48289e-01  0.00000e+00 0.00000e+00 1.66241e+02 2.626   7.75382e+01 2.626   0.9474 
1 1 1 7   90  8  o 1  5.26153e+00 1.15453e+00 1.10172e+02 160.217 -8.89460e+00 3.19923e+00  0.00000e+00 0.00000e+00 7.54447e+01 160.217 3.47276e+01 340.217 0.9455 
1 1 1 7   90  9  o 1  5.30232e+00 1.15127e+00 1.09489e+02 315.503 7.03510e+00  -6.91268e+00 0.00000e+00 0.00000e+00 7.79853e+01 315.503 3.15036e+01 135.503 0.9479 
1 1 1 7   90  10 o 18 4.12781e+00 1.21087e+00 1.44747e+02 143.391 -8.93509e+00 6.63807e+00  0.00000e+00 0.00000e+00 2.09581e+00 143.391 1.42651e+02 323.390 0.9540 
1 1 1 7   90  11 o 3  3.40896e+00 1.10106e+00 5.76876e+01 179.180 -4.26031e+00 6.09378e-02  0.00000e+00 0.00000e+00 5.32311e+01 179.180 4.45643e+00 359.180 0.8728 
1 1 1 7   90  12 o 6  4.73679e+00 1.38251e+00 6.32621e+01 210.336 -4.91634e+00 -2.87708e+00 0.00000e+00 0.00000e+00 9.68882e+01 210.336 3.36261e+01 210.336 0.9074 
1 1 1 7   91  0  o 9  5.91872e+00 7.67450e-01 1.48793e+02 338.330 1.25676e+01  -4.99363e+00 0.00000e+00 0.00000e+00 6.35923e+01 338.330 8.52011e+01 158.330 0.9623 
1 1 1 7   91  1  o 18 6.27438e+00 7.64208e-01 8.18111e+01 178.735 -8.73133e+00 1.92725e-01  0.00000e+00 0.00000e+00 1.38383e+02 178.735 5.65724e+01 178.735 0.9409 
1 1 1 7   91  2  o 9  7.58979e+00 7.00643e-01 1.28704e+02 236.773 -8.77230e+00 -1.33915e+01 0.00000e+00 0.00000e+00 1.45454e+02 236.773 1.67502e+01 236.773 0.9682 
1 1 1 7   91  3  f 0  3.32944e+00 9.12154e-01 9.03698e+01 0.216   4.79005e+00  1.80427e-02  0.00000e+00 0.00000e+00 1.99773e+01 0.216   7.03925e+01 180.216 0.8883 
1 1 1 7   91  4  o 18 1.71104e+01 6.25497e-01 2.33922e+02 90.472  -6.37031e-01 7.72477e+01  0.00000e+00 0.00000e+00 4.00388e+02 90.472  1.66465e+02 90.472  0.9935 
1 1 1 7   91  5  o 14 8.28564e+00 8.33262e-01 1.80785e+02 324.731 1.98804e+01  -1.40601e+01 0.00000e+00 0.00000e+00 1.21970e+02 324.731 5.88148e+01 144.731 0.9792 
1 1 1 7   91  6  o 12 4.63065e+00 1.06949e+00 8.70955e+01 329.160 5.39518e+00  -3.22132e+00 0.00000e+00 0.00000e+00 7.12666e+01 329.160 1.58290e+01 149.160 0.9166 
1 1 1 7   91  7  o 1  3.77132e+00 1.09689e+00 5.45580e+01 136.638 -2.51406e+00 2.37427e+00  0.00000e+00 0.00000e+00 6.34724e+01 136.638 8.91432e+00 136.638 0.8389 
1 1 1 7   91  8  o 12 8.39790e+00 1.03934e+00 1.21451e+02 32.898  1.60253e+01  1.03665e+01  0.00000e+00 0.00000e+00 1.83482e+02 32.898  6.20305e+01 32.898  0.9734 
1 1 1 7   91  9  f 0  8.14727e+00 1.13286e+00 1.08124e+02 175.364 -1.67252e+01 1.35613e+00  0.00000e+00 0.00000e+00 1.86511e+02 175.364 7.83864e+01 175.364 0.9697 
1 1 1 7   91  10 o 14 3.95360e+00 1.17978e+00 2.47497e+01 18.873  1.79142e+00  6.12387e-01  0.00000e+00 0.00000e+00 7.53956e+01 18.873  5.06459e+01 18.873  0.6794 
1 1 1 7   91  11 o 16 4.29718e+00 1.25777e+00 9.20756e+01 337.393 7.40587e+00  -3.08375e+00 0.00000e+00 0.00000e+00 5.77299e+01 337.393 3.43457e+01 157.394 0.9354 
1 1 1 7   91  12 o 15 5.79693e+00 1.51474e+00 8.71537e+01 190.729 -8.41529e+00 -1.59448e+00 0.00000e+00 0.00000e+00 1.15767e+02 190.729 2.86137e+01 190.729 0.9397 
1 1 1 7   92  0  o 5  7.87857e+00 6.79815e-01 1.63922e+02 15.694  2.05495e+01  5.77396e+00  0.00000e+00 0.00000e+00 1.22832e+02 15.694  4.10896e+01 195.694 0.9763 
1 1 1 7   92  1  o 13 1.00245e+01 6.25144e-01 1.80053e+02 235.529 -1.88183e+01 -2.74106e+01 0.00000e+00 0.00000e+00 1.88096e+02 235.529 8.04285e+00 235.529 0.9848 
1 1 1 7   92  2  o 16 6.28909e+00 8.23135e-01 1.22840e+02 23.312  1.18376e+01  5.10102e+00  0.00000e+00 0.00000e+00 1.02435e+02 23.312  2.04049e+01 203.312 0.9604 
1 1 1 7   92  3  o 12 8.31618e+00 7.08982e-01 1.16068e+02 280.691 3.04263e+00  -1.61168e+01 0.00000e+00 0.00000e+00 1.84532e+02 280.691 6.84632e+01 280.691 0.9690 
1 1 1 7   92  4  o 5  3.06332e+00 9.05714e-01 3.78750e+01 93.083  -1.02673e-01 1.90639e+00  0.00000e+00 0.00000e+00 4.00929e+01 93.083  2.21797e+00 93.083  0.6823 
1 1 1 7   92  5  o 18 5.65749e+00 9.48400e-01 3.70219e+01 328.961 2.94597e+00  -1.77288e+00 0.00000e+00 0.00000e+00 1.39800e+02 328.961 1.02779e+02 328.961 0.8378 
1 1 1 7   92  6  o 8  3.19688e+00 9.48420e-01 5.77744e+01 341.655 3.03205e+00  -1.00537e+00 0.00000e+00 0.00000e+00 4.04169e+01 341.655 1.73576e+01 161.656 0.8234 
1 1 1 7   92  7  o 4  4.33349e+00 1.04706e+00 3.90283e+01 267.106 -1.50222e-01 -2.97109e+00 0.00000e+00 0.00000e+00 9.15892e+01 267.106 5.25609e+01 267.106 0.8081 
1 1 1 7   92  8  o 9  6.82593e+00 1.12351e+00 1.10312e+02 37.387  1.04829e+01  8.01090e+00  0.00000e+00 0.00000e+00 1.34395e+02 37.387  2.40823e+01 37.387  0.9613 
1 1 1 7   92  9  o 1  7.24505e+00 1.17247e+00 1.41737e+02 210.206 -1.72131e+01 -1.00206e+01 0.00000e+00 0.00000e+00 1.21511e+02 210.206 2.02258e+01 30.206  0.9746 
1 1 1 7   92  10 o 8  1.77671e+01 9.21598e-01 2.66459e+02 61.191  5.40636e+01  9.83051e+01  0.00000e+00 0.00000e+00 3.92800e+02 61.191  1.26341e+02 61.191  0.9955 
1 1 1 7   92  11 o 5  4.70452e+00 1.30884e+00 8.67264e+01 205.869 -7.24352e+00 -3.51246e+00 0.00000e+00 0.00000e+00 7.72790e+01 205.869 9.44740e+00 25.869  0.9357 
1 1 1 7   93  0  o 18 1.17407e+01 5.91946e-01 1.95410e+02 340.917 4.02579e+01  -1.39274e+01 0.00000e+00 0.00000e+00 2.37016e+02 340.917 4.16066e+01 340.917 0.9882 
1 1 1 7   93  1  o 7  1.06152e+01 6.08561e-01 1.81130e+02 193.517 -3.53353e+01 -8.49415e+00 0.00000e+00 0.00000e+00 2.09128e+02 193.517 2.79979e+01 193.517 0.9861 
1 1 1 7   93  2  o 14 4.48221e+00 9.13829e-01 7.42519e+01 2.218   5.11189e+00  1.97956e-01  0.00000e+00 0.00000e+00 7.54979e+01 2.218   1.24602e+00 2.218   0.8960 
1 1 1 7   93  3  f 0  2.78256e+00 8.40204e-01 8.84141e+01 315.686 3.00590e+00  -2.93477e+00 0.00000e+00 0.00000e+00 1.95076e+00 315.686 8.64633e+01 135.686 0.8708 
1 1 1 7   93  4  o 14 3.62687e+00 9.59916e-01 2.87934e+01 298.047 8.13067e-01  -1.52614e+00 0.00000e+00 0.00000e+00 5.88453e+01 298.047 3.00519e+01 298.047 0.6479 
1 1 1 7   93  5  o 17 6.12068e+00 9.92510e-01 1.43353e+02 322.737 1.08020e+01  -8.21779e+00 0.00000e+00 0.00000e+00 7.63428e+01 322.737 6.70103e+01 142.737 0.9624 
1 1 1 7   93  6  o 13 5.64753e+00 9.63437e-01 1.05756e+02 116.465 -4.68912e+00 9.41932e+00  0.00000e+00 0.00000e+00 9.45868e+01 116.465 1.11690e+01 296.465 0.9512 
1 1 1 7   93  7  o 5  8.16465e+00 1.03050e+00 1.49376e+02 38.062  1.70459e+01  1.33474e+01  0.00000e+00 0.00000e+00 1.47960e+02 38.062  1.41641e+00 218.062 0.9766 
1 1 1 7   93  8  o 9  1.01823e+01 9.29035e-01 1.41953e+02 290.264 9.96890e+00  -2.70010e+01 0.00000e+00 0.00000e+00 2.31015e+02 290.264 8.90616e+01 290.264 0.9825 
1 1 1 7   93  9  o 5  7.53391e+00 1.20499e+00 9.96344e+01 86.392  8.33711e-01  1.32202e+01  0.00000e+00 0.00000e+00 1.70365e+02 86.392  7.07311e+01 86.392  0.9615 
1 1 1 7   93  10 o 9  5.91837e+00 1.28160e+00 8.91383e+01 21.059  9.57438e+00  3.68657e+00  0.00000e+00 0.00000e+00 1.20356e+02 21.059  3.12173e+01 21.059  0.9499 
1 1 1 7   93  11 f 0  7.17382e+00 1.39918e+00 1.19004e+02 265.709 -1.13370e+00 -1.51100e+01 0.00000e+00 0.00000e+00 1.39241e+02 265.709 2.02375e+01 265.709 0.9664 
1 1 1 7   94  0  o 5  5.69173e+00 8.27341e-01 1.20970e+02 21.922  1.02572e+01  4.12801e+00  0.00000e+00 0.00000e+00 8.12836e+01 21.922  3.96860e+01 201.922 0.9536 
1 1 1 7   94  1  o 12 4.84641e+00 8.74300e-01 7.32567e+01 211.878 -5.12818e+00 -3.18933e+00 0.00000e+00 0.00000e+00 9.16527e+01 211.878 1.83960e+01 211.878 0.9130 
1 1 1 7   94  2  o 6  7.74394e+00 7.46793e-01 1.10336e+02 240.464 -7.54740e+00 -1.33207e+01 0.00000e+00 0.00000e+00 1.68751e+02 240.464 5.84153e+01 240.464 0.9668 
1 1 1 7   94  3  o 7  2.79631e+00 8.33892e-01 3.97771e+01 340.773 1.70662e+00  -5.95192e-01 0.00000e+00 0.00000e+00 2.93936e+01 340.773 1.03835e+01 160.773 0.6635 
1 1 1 7   94  4  o 14 5.25348e+00 9.43706e-01 1.18415e+02 267.110 -5.43464e-01 -1.07662e+01 0.00000e+00 0.00000e+00 6.81448e+01 267.110 5.02702e+01 87.110  0.9524 
1 1 1 7   94  5  o 16 9.13429e+00 7.60982e-01 9.25590e+01 106.862 -4.73039e+00 1.56063e+01  0.00000e+00 0.00000e+00 2.37407e+02 106.862 1.44848e+02 106.862 0.9688 
1 1 1 7   94  6  o 10 2.81921e+00 9.04942e-01 5.29836e+01 222.208 -2.09523e+00 -1.90039e+00 0.00000e+00 0.00000e+00 3.07347e+01 222.208 2.22489e+01 42.208  0.7965 
1 1 1 7   94  7  o 19 6.45025e+00 1.06468e+00 1.50580e+02 77.426  3.88049e+00  1.73971e+01  0.00000e+00 0.00000e+00 8.30367e+01 77.426  6.75434e+01 257.426 0.9715 
1 1 1 7   94  8  f 0  7.60725e+00 1.07461e+00 1.34566e+02 214.288 -1.59560e+01 -1.08795e+01 0.00000e+00 0.00000e+00 1.41537e+02 214.288 6.97068e+00 214.288 0.9738 
1 1 1 7   94  9  o 17 4.52599e+00 1.23867e+00 4.73869e+01 354.349 3.85092e+00  -3.81052e-01 0.00000e+00 0.00000e+00 9.73750e+01 354.349 4.99881e+01 354.349 0.8583 
1 1 1 7   94  10 o 10 9.93161e+00 1.13278e+00 1.75302e+02 1.503   3.73264e+01  9.79326e-01  0.00000e+00 0.00000e+00 1.89693e+02 1.503   1.43908e+01 1.503   0.9865 
1 1 1 7   94  11 o 16 3.28624e+00 1.07635e+00 5.50364e+01 251.057 -1.52257e+00 -4.43610e+00 0.00000e+00 0.00000e+00 5.33497e+01 251.057 1.68662e+00 71.057  0.8857 
1 1 1 7   95  0  o 15 5.28133e+00 8.68341e-01 7.94213e+01 220.322 -5.37563e+00 -4.56249e+00 0.00000e+00 0.00000e+00 1.02779e+02 220.322 2.33577e+01 220.322 0.9261 
1 1 1 7   95  1  o 15 5.93733e+00 8.50669e-01 1.01403e+02 70.311  3.43827e+00  9.60844e+00  0.00000e+00 0.00000e+00 1.08694e+02 70.311  7.29141e+00 70.311  0.9497 
1 1 1 7   95  2  o 17 4.69190e+00 9.54172e-01 6.82360e+01 103.604 -1.14858e+00 4.74636e+00  0.00000e+00 0.00000e+00 8.74957e+01 103.604 1.92596e+01 103.604 0.8906 
1 1 1 7   95  3  o 4  5.03977e+00 9.53335e-01 1.28909e+02 289.897 3.61847e+00  -9.99735e+00 0.00000e+00 0.00000e+00 4.98758e+01 289.897 7.90328e+01 109.897 0.9517 
1 1 1 7   95  4  o 9  7.43711e+00 8.31191e-01 1.17783e+02 228.058 -1.04860e+01 -1.16698e+01 0.00000e+00 0.00000e+00 1.50457e+02 228.058 3.26740e+01 228.058 0.9676 
1 1 1 7   95  5  o 11 7.16087e+00 8.93171e-01 1.12140e+02 164.392 -1.42335e+01 3.97622e+00  0.00000e+00 0.00000e+00 1.45595e+02 164.392 3.34553e+01 164.392 0.9656 
1 1 1 7   95  6  o 11 3.68113e+00 1.01220e+00 1.01540e+02 16.720  6.74054e+00  2.02485e+00  0.00000e+00 0.00000e+00 2.55115e+01 16.720  7.60285e+01 196.720 0.9260 
1 1 1 7   95  7  o 6  3.37468e+00 9.77695e-01 7.50640e+01 212.416 -4.08372e+00 -2.59317e+00 0.00000e+00 0.00000e+00 3.68085e+01 212.416 3.82556e+01 32.416  0.8895 
1 1 1 7   95  8  o 6  3.57214e+00 1.01006e+00 2.84910e+01 286.891 6.57908e-01  -2.16671e+00 0.00000e+00 0.00000e+00 6.95776e+01 286.891 4.10866e+01 286.891 0.7367 
1 1 1 7   95  9  o 14 5.21664e+00 1.36084e+00 9.72228e+01 317.665 6.06337e+00  -5.52412e+00 0.00000e+00 0.00000e+00 8.48570e+01 317.665 1.23657e+01 137.664 0.9369 
1 1 1 7   95  10 o 5  3.25036e+00 1.04008e+00 5.74533e+01 68.995  1.63620e+00  4.26132e+00  0.00000e+00 0.00000e+00 4.93409e+01 68.995  8.11238e+00 248.995 0.8822 
1 1 1 7   95  11 o 14 3.79723e+00 1.14548e+00 5.64669e+01 264.607 -4.95467e-01 -5.24802e+00 0.00000e+00 0.00000e+00 7.06704e+01 264.607 1.42035e+01 264.607 0.8993 
1 1 1 7   96  0  o 19 1.01836e+01 6.20751e-01 1.50859e+02 303.824 1.53231e+01  -2.28684e+01 0.00000e+00 0.00000e+00 2.21448e+02 303.824 7.05892e+01 303.824 0.9817 
1 1 1 7   96  1  o 7  3.89947e+00 8.17770e-01 4.37555e+01 342.410 2.91933e+00  -9.25477e-01 0.00000e+00 0.00000e+00 7.45607e+01 342.410 3.08052e+01 342.410 0.8145 
1 1 1 7   96  2  o 1  4.65732e+00 9.57808e-01 3.28985e+01 303.574 1.38278e+00  -2.08329e+00 0.00000e+00 0.00000e+00 9.98566e+01 303.574 6.69581e+01 303.574 0.7650 
1 1 1 7   96  3  f 0  6.04911e+00 9.26968e-01 1.55063e+02 214.432 -1.24138e+01 -8.50998e+00 0.00000e+00 0.00000e+00 6.27269e+01 214.432 9.23359e+01 34.432  0.9662 
1 1 1 7   96  4  o 10 1.00389e+01 7.24460e-01 1.60319e+02 354.201 3.14269e+01  -3.19171e+00 0.00000e+00 0.00000e+00 2.07820e+02 354.201 4.75009e+01 354.201 0.9840 
1 1 1 7   96  5  o 16 5.00275e+00 9.16156e-01 7.07807e+01 210.810 -5.71694e+00 -3.40931e+00 0.00000e+00 0.00000e+00 1.01016e+02 210.810 3.02349e+01 210.810 0.9215 
1 1 1 7   96  6  o 9  4.05655e+00 1.01696e+00 8.30518e+01 23.710  5.86672e+00  2.57652e+00  0.00000e+00 0.00000e+00 5.57569e+01 23.710  2.72949e+01 203.710 0.9183 
1 1 1 7   96  7  o 8  4.27384e+00 1.09950e+00 6.33442e+01 205.075 -4.54356e+00 -2.12591e+00 0.00000e+00 0.00000e+00 7.89816e+01 205.075 1.56374e+01 205.075 0.8938 
1 1 1 7   96  8  o 14 5.45554e+00 1.15757e+00 1.08230e+02 47.517  7.30656e+00  7.97838e+00  0.00000e+00 0.00000e+00 8.53741e+01 47.517  2.28562e+01 227.517 0.9526 
1 1 1 7   96  9  o 10 5.07986e+00 1.25663e+00 9.97615e+01 271.397 2.46191e-01  -1.00928e+01 0.00000e+00 0.00000e+00 7.98068e+01 271.397 1.99547e+01 91.397  0.9491 
1 1 1 7   96  10 o 15 2.83216e+00 9.42417e-01 8.82210e+01 342.255 6.22441e+00  -1.99184e+00 0.00000e+00 0.00000e+00 8.78912e+00 342.255 7.94318e+01 162.255 0.9199 
1 1 1 7   96  11 o 11 2.99700e+00 9.89543e-01 3.53438e+01 156.813 -2.74092e+00 1.17405e+00  0.00000e+00 0.00000e+00 5.48580e+01 156.813 1.95141e+01 156.813 0.8086 
1 1 1 7   97  0  o 16 2.62173e+00 7.91559e-01 5.01977e+01 40.876  1.78053e+00  1.54107e+00  0.00000e+00 0.00000e+00 2.28405e+01 40.876  2.73572e+01 220.876 0.7482 
1 1 1 7   97  1  o 11 5.53595e+00 9.10181e-01 8.56883e+01 67.137  3.25706e+00  7.72458e+00  0.00000e+00 0.00000e+00 1.07762e+02 67.137  2.20739e+01 67.137  0.9383 
1 1 1 7   97  2  o 6  6.88161e+00 8.21711e-01 9.89226e+01 239.755 -5.82028e+00 -9.98241e+00 0.00000e+00 0.00000e+00 1.46054e+02 239.755 4.71317e+01 239.755 0.9557 
1 1 1 7   97  3  o 11 7.31601e+00 8.47884e-01 7.57328e+01 18.615  9.63777e+00  3.24619e+00  0.00000e+00 0.00000e+00 1.83048e+02 18.615  1.07315e+02 18.615  0.9495 
1 1 1 7   97  4  o 1  4.42790e+00 9.58579e-01 5.49830e+01 282.964 1.00747e+00  -4.37640e+00 0.00000e+00 0.00000e+00 9.01986e+01 282.964 3.52156e+01 282.964 0.8801 
1 1 1 7   97  5  o 16 8.28951e+00 8.37214e-01 1.34953e+02 249.666 -8.25483e+00 -2.22752e+01 0.00000e+00 0.00000e+00 1.67313e+02 249.666 3.23601e+01 249.666 0.9787 
1 1 1 7   97  6  o 7  3.93328e+00 9.89687e-01 1.06039e+02 230.101 -5.16379e+00 -6.17608e+00 0.00000e+00 0.00000e+00 3.10658e+01 230.101 7.49729e+01 50.101  0.9357 
1 1 1 7   97  7  o 7  5.70105e+00 1.06013e+00 1.08894e+02 137.672 -9.25742e+00 8.43177e+00  0.00000e+00 0.00000e+00 9.48069e+01 137.672 1.40870e+01 317.672 0.9592 
1 1 1 7   97  8  o 3  6.90521e+00 1.15258e+00 7.22789e+01 10.635  9.50791e+00  1.78540e+00  0.00000e+00 0.00000e+00 1.71218e+02 10.635  9.89394e+01 10.635  0.9468 
1 1 1 7   97  9  o 2  3.22073e+00 1.05164e+00 6.02570e+01 156.022 -4.01566e+00 1.78608e+00  0.00000e+00 0.00000e+00 4.49352e+01 156.022 1.53219e+01 336.021 0.8772 
1 1 1 7   97  10 o 16 2.96761e+00 9.72805e-01 2.66333e+01 212.221 -1.78071e+00 -1.12228e+00 0.00000e+00 0.00000e+00 5.22684e+01 212.221 2.56350e+01 212.221 0.7143 
1 1 1 7   98  0  o 6  3.65249e+00 9.00882e-01 6.72456e+01 159.261 -3.73584e+00 1.41453e+00  0.00000e+00 0.00000e+00 5.01265e+01 159.261 1.71191e+01 339.261 0.8633 
1 1 1 7   98  1  o 4  7.35245e+00 7.39782e-01 1.21750e+02 248.703 -6.11014e+00 -1.56739e+01 0.00000e+00 0.00000e+00 1.43731e+02 248.703 2.19804e+01 248.703 0.9698 
1 1 1 7   98  2  o 1  4.86762e+00 9.48601e-01 9.51659e+01 96.150  -8.57514e-01 7.95865e+00  0.00000e+00 0.00000e+00 7.43667e+01 96.150  2.07992e+01 276.150 0.9353 
1 1 1 7   98  3  f 0  5.59434e+00 9.85326e-01 1.10848e+02 303.233 5.90088e+00  -9.00603e+00 0.00000e+00 0.00000e+00 8.75812e+01 303.233 2.32671e+01 123.233 0.9524 
1 1 1 7   98  4  o 9  8.74061e+00 8.09611e-01 8.61022e+01 129.322 -9.79959e+00 1.19634e+01  0.00000e+00 0.00000e+00 2.28745e+02 129.322 1.42643e+02 129.322 0.9671 
1 1 1 7   98  5  o 8  4.17649e+00 9.79529e-01 7.05062e+01 9.297   5.67552e+00  9.29131e-01  0.00000e+00 0.00000e+00 7.07904e+01 9.297   2.84181e-01 9.297   0.9083 
1 1 1 7   98  6  o 3  4.47154e+00 1.07936e+00 4.29772e+01 291.908 1.28348e+00  -3.19150e+00 0.00000e+00 0.00000e+00 9.65677e+01 291.908 5.35906e+01 291.908 0.8379 
1 1 1 7   98  7  o 10 7.08551e+00 1.07374e+00 9.59816e+01 96.945  -1.73171e+00 1.42171e+01  0.00000e+00 0.00000e+00 1.58500e+02 96.945  6.25182e+01 96.945  0.9644 
1 1 1 7   98  8  o 17 2.38022e+00 8.10109e-01 6.83506e+01 12.929  4.00632e+00  9.19674e-01  0.00000e+00 0.00000e+00 8.54358e+00 12.929  5.98071e+01 192.929 0.8676 
1 1 1 7   98  9  o 2  4.53392e+00 1.26936e+00 1.18637e+02 257.606 -2.31592e+00 -1.05386e+01 0.00000e+00 0.00000e+00 4.21157e+01 257.606 7.65215e+01 77.606  0.9525 
1 1 1 7   98  10 o 8  3.53935e+00 1.09204e+00 3.39296e+01 343.950 2.83723e+00  -8.16236e-01 0.00000e+00 0.00000e+00 7.22831e+01 343.950 3.83535e+01 343.950 0.8064 
1 1 1 7   99  0  o 11 4.69942e+00 8.75051e-01 7.79331e+01 160.899 -6.24632e+00 2.16312e+00  0.00000e+00 0.00000e+00 8.31121e+01 160.899 5.17901e+00 160.899 0.9209 
1 1 1 7   99  1  o 19 5.29376e+00 9.10399e-01 1.19569e+02 283.398 2.63040e+00  -1.10432e+01 0.00000e+00 0.00000e+00 6.85846e+01 283.398 5.09845e+01 103.398 0.9549 
1 1 1 7   99  2  o 3  3.56201e+00 9.26221e-01 8.92634e+01 46.113  3.97084e+00  4.12816e+00  0.00000e+00 0.00000e+00 3.11347e+01 46.113  5.81287e+01 226.113 0.9079 
1 1 1 7   99  3  o 16 3.55503e+00 9.43298e-01 5.17727e+01 29.025  2.97063e+00  1.64835e+00  0.00000e+00 0.00000e+00 5.88271e+01 29.025  7.05441e+00 29.025  0.8356 
1 1 1 7   99  4  o 5  4.32909e+00 1.00519e+00 6.04794e+01 198.937 -4.46912e+00 -1.53334e+00 0.00000e+00 0.00000e+00 8.24373e+01 198.937 2.19579e+01 198.937 0.8866 
1 1 1 7   99  5  o 6  3.54226e+00 9.97248e-01 3.94108e+01 226.924 -1.82962e+00 -1.95684e+00 0.00000e+00 0.00000e+00 6.38862e+01 226.924 2.44754e+01 226.924 0.7831 
1 1 1 7   99  6  o 3  3.55622e+00 1.00695e+00 4.67189e+01 180.625 -3.29548e+00 -3.59421e-02 0.00000e+00 0.00000e+00 6.31417e+01 180.625 1.64228e+01 180.625 0.8297 
1 1 1 7   99  7  o 10 1.00478e+01 8.94013e-01 1.35950e+02 107.570 -9.99597e+00 3.15684e+01  0.00000e+00 0.00000e+00 2.32439e+02 107.570 9.64889e+01 107.570 0.9848 
1 1 1 7   99  8  o 14 5.04280e+00 1.20154e+00 6.94259e+01 254.096 -2.01216e+00 -7.06172e+00 0.00000e+00 0.00000e+00 1.04991e+02 254.096 3.55646e+01 254.096 0.9292 
1 1 1 7   99  9  o 13 6.16962e+00 1.36686e+00 1.07048e+02 138.092 -9.17687e+00 8.23625e+00  0.00000e+00 0.00000e+00 1.13038e+02 138.092 5.99001e+00 138.092 0.9586 
1 1 1 7   99  10 o 9  2.45197e+00 8.44050e-01 2.39644e+01 76.014  4.35522e-01  1.74865e+00  0.00000e+00 0.00000e+00 3.64650e+01 76.014  1.25005e+01 76.014  0.6624 
1 1 1 7   100 0  o 13 4.93994e+00 9.10082e-01 5.11272e+01 307.112 2.77133e+00  -3.66272e+00 0.00000e+00 0.00000e+00 1.11148e+02 307.112 6.00213e+01 307.112 0.8830 
1 1 1 7   100 1  o 18 3.58263e+00 9.16486e-01 9.29147e+01 348.103 6.16965e+00  -1.29979e+00 0.00000e+00 0.00000e+00 2.93163e+01 348.103 6.35984e+01 168.103 0.9169 
1 1 1 7   100 2  o 6  1.23810e+01 6.42751e-01 1.58104e+02 126.418 -2.56388e+01 3.47523e+01  0.00000e+00 0.00000e+00 2.97334e+02 126.418 1.39231e+02 126.418 0.9884 
1 1 1 7   100 3  o 8  4.81368e+00 9.68078e-01 3.51081e+01 19.170  2.95677e+00  1.02789e+00  0.00000e+00 0.00000e+00 1.11674e+02 19.170  7.65659e+01 19.170  0.8192 
1 1 1 7   100 4  o 17 6.89559e+00 9.47757e-01 8.94059e+01 75.380  3.07872e+00  1.18027e+01  0.00000e+00 0.00000e+00 1.56532e+02 75.380  6.71258e+01 75.380  0.9581 
1 1 1 7   100 5  f 0  4.51027e+00 9.52968e-01 8.47136e+01 340.185 7.03254e+00  -2.53399e+00 0.00000e+00 0.00000e+00 7.15157e+01 340.185 1.31979e+01 160.185 0.9305 
1 1 1 7   100 6  o 5  1.18397e+01 7.60682e-01 1.71731e+02 163.699 -5.30941e+01 1.55269e+01  0.00000e+00 0.00000e+00 2.64991e+02 163.699 9.32597e+01 163.699 0.9909 
1 1 1 7   100 7  o 15 3.82913e+00 1.07472e+00 1.01942e+02 341.282 7.81846e+00  -2.64911e+00 0.00000e+00 0.00000e+00 3.16452e+01 341.282 7.02966e+01 161.282 0.9373 
1 1 1 7   100 8  o 3  4.51498e+00 1.05358e+00 8.26260e+01 269.299 -1.03148e-01 -8.42956e+00 0.00000e+00 0.00000e+00 7.50874e+01 269.299 7.53863e+00 89.299  0.9387 
1 1 1 7   100 9  o 16 3.27570e+00 1.02405e+00 5.96018e+01 152.577 -4.39557e+00 2.28070e+00  0.00000e+00 0.00000e+00 4.91390e+01 152.577 1.04628e+01 332.577 0.8923 
1 1 1 7   101 0  o 11 7.58285e+00 7.50576e-01 9.17309e+01 251.705 -4.65092e+00 -1.40672e+01 0.00000e+00 0.00000e+00 1.80601e+02 251.705 8.88700e+01 251.705 0.9656 
1 1 1 7   101 1  o 1  3.80771e+00 9.29271e-01 6.12141e+01 124.202 -2.49092e+00 3.66503e+00  0.00000e+00 0.00000e+00 6.31962e+01 124.202 1.98210e+00 124.202 0.8783 
1 1 1 7   101 2  o 19 3.33137e+00 9.07736e-01 4.28548e+01 9.256   2.71474e+00  4.42398e-01  0.00000e+00 0.00000e+00 5.50336e+01 9.256   1.21787e+01 9.256   0.7897 
1 1 1 7   101 3  o 6  2.53709e+00 7.92630e-01 4.03098e+01 188.646 -2.24272e+00 -3.41017e-01 0.00000e+00 0.00000e+00 2.93003e+01 188.646 1.10095e+01 8.646   0.7373 
1 1 1 7   101 4  o 13 6.16538e+00 9.81319e-01 6.98669e+01 353.016 8.13347e+00  -9.96362e-01 0.00000e+00 0.00000e+00 1.45089e+02 353.016 7.52224e+01 353.016 0.9368 
1 1 1 7   101 5  o 6  6.56532e+00 9.75322e-01 1.08797e+02 111.801 -5.72392e+00 1.43100e+01  0.00000e+00 0.00000e+00 1.27474e+02 111.801 1.86774e+01 111.801 0.9670 
1 1 1 7   101 6  o 10 5.96622e+00 1.07968e+00 1.00375e+02 306.817 6.98479e+00  -9.33091e+00 0.00000e+00 0.00000e+00 1.11903e+02 306.817 1.15278e+01 306.817 0.9561 
1 1 1 7   101 7  o 19 3.54282e+00 1.04071e+00 7.34514e+01 280.472 1.01515e+00  -5.49245e+00 0.00000e+00 0.00000e+00 4.59048e+01 280.472 2.75466e+01 100.472 0.9054 
1 1 1 7   101 8  o 1  3.94318e+00 1.11242e+00 6.06919e+01 92.282  -2.22068e-01 5.57316e+00  0.00000e+00 0.00000e+00 7.21077e+01 92.282  1.14158e+01 92.282  0.9053 
1 1 1 7   101 9  o 15 6.73971e+00 1.27130e+00 1.05618e+02 116.557 -6.75844e+00 1.35216e+01  0.00000e+00 0.00000e+00 1.36623e+02 116.557 3.10045e+01 116.557 0.9663 
1 1 1 7   102 0  o 18 5.37918e+00 9.03098e-01 1.20315e+02 337.740 1.15670e+01  -4.73446e+00 0.00000e+00 0.00000e+00 7.15161e+01 337.740 4.87987e+01 157.740 0.9591 
1 1 1 7   102 1  o 4  3.31715e+00 8.65630e-01 6.70831e+01 304.055 2.44582e+00  -3.61862e+00 0.00000e+00 0.00000e+00 4.10254e+01 304.055 2.60577e+01 124.055 0.8763 
1 1 1 7   102 2  o 17 5.93624e+00 9.71494e-01 1.14735e+02 33.212  1.11790e+01  7.31859e+00  0.00000e+00 0.00000e+00 9.76508e+01 33.212  1.70844e+01 213.212 0.9618 
1 1 1 7   102 3  o 4  1.00698e+01 7.85956e-01 1.72355e+02 306.956 2.31055e+01  -3.07109e+01 0.00000e+00 0.00000e+00 1.97365e+02 306.956 2.50100e+01 306.956 0.9869 
1 1 1 7   102 4  o 9  4.87081e+00 8.78460e-01 3.27909e+01 322.899 2.77528e+00  -2.09898e+00 0.00000e+00 0.00000e+00 1.19441e+02 322.899 8.66497e+01 322.899 0.8400 
1 1 1 7   102 5  o 15 5.42763e+00 1.06378e+00 7.51738e+01 0.736   8.66725e+00  1.11358e-01  0.00000e+00 0.00000e+00 1.14732e+02 0.736   3.95585e+01 0.736   0.9404 
1 1 1 7   102 6  o 6  3.79723e+00 1.02241e+00 4.92635e+01 259.776 -7.34471e-01 -4.07233e+00 0.00000e+00 0.00000e+00 7.34484e+01 259.776 2.41850e+01 259.776 0.8686 
1 1 1 7   102 7  o 7  3.84134e+00 1.08285e+00 6.29738e+01 64.699  2.36705e+00  5.00735e+00  0.00000e+00 0.00000e+00 6.62808e+01 64.699  3.30702e+00 64.699  0.9045 
1 1 1 7   102 8  o 13 4.98108e+00 1.23219e+00 7.88047e+01 122.179 -4.18574e+00 6.65223e+00  0.00000e+00 0.00000e+00 9.42345e+01 122.179 1.54298e+01 122.179 0.9340 
1 1 1 7   102 9  o 7  2.84238e+00 9.47995e-01 4.75750e+01 282.005 7.80203e-01  -3.66908e+00 0.00000e+00 0.00000e+00 4.26029e+01 282.005 4.97206e+00 102.005 0.8532 
1 1 1 7   103 0  o 12 3.20606e+00 8.29582e-01 6.50563e+01 127.508 -2.74569e+00 3.57720e+00  0.00000e+00 0.00000e+00 3.98886e+01 127.508 2.51677e+01 307.508 0.8806 
1 1 1 7   103 1  o 3  9.52751e+00 7.08557e-01 1.90528e+02 266.559 -2.51978e+00 -4.19026e+01 0.00000e+00 0.00000e+00 1.59465e+02 266.559 3.10634e+01 86.559  0.9880 
1 1 1 7   103 2  o 6  3.27568e+00 9.33651e-01 6.91120e+01 1.822   4.45072e+00  1.41606e-01  0.00000e+00 0.00000e+00 3.79550e+01 1.822   3.11569e+01 181.822 0.8789 
1 1 1 7   103 3  o 15 3.03820e+00 9.07472e-01 7.06782e+01 171.808 -4.53974e+00 6.53559e-01  0.00000e+00 0.00000e+00 2.90790e+01 171.808 4.15992e+01 351.808 0.8828 
1 1 1 7   103 4  o 6  3.55935e+00 9.66455e-01 5.23515e+01 153.956 -3.72547e+00 1.82058e+00  0.00000e+00 0.00000e+00 6.26860e+01 153.956 1.03345e+01 153.956 0.8689 
1 1 1 7   103 5  o 11 4.82199e+00 9.36339e-01 1.05676e+02 310.363 7.73031e+00  -9.09479e+00 0.00000e+00 0.00000e+00 6.59934e+01 310.363 3.96827e+01 130.364 0.9571 
1 1 1 7   103 6  o 11 8.12709e+00 9.50233e-01 1.48918e+02 165.675 -2.71393e+01 6.93046e+00  0.00000e+00 0.00000e+00 1.47909e+02 165.675 1.00949e+00 345.675 0.9820 
1 1 1 7   103 7  o 8  3.12853e+00 9.60294e-01 7.36414e+01 69.012  2.06529e+00  5.38369e+00  0.00000e+00 0.00000e+00 3.20674e+01 69.012  4.15740e+01 249.012 0.9086 
1 1 1 7   103 8  o 4  4.82026e+00 1.20120e+00 1.29132e+02 332.904 1.18452e+01  -6.06039e+00 0.00000e+00 0.00000e+00 4.32249e+01 332.904 8.59069e+01 152.904 0.9617 
1 1 1 7   103 9  o 5  4.10418e+00 1.13878e+00 1.99479e+01 103.824 -4.94114e-01 2.00803e+00  0.00000e+00 0.00000e+00 8.81646e+01 103.824 6.82168e+01 103.824 0.7086 
1 1 1 7   104 0  o 8  2.88245e+00 8.58774e-01 6.40512e+01 293.902 1.54613e+00  -3.48863e+00 0.00000e+00 0.00000e+00 2.76437e+01 293.902 3.64076e+01 113.902 0.8561 
1 1 1 7   104 1  o 6  6.82348e+00 8.48386e-01 1.34468e+02 315.120 1.36753e+01  -1.36183e+01 0.00000e+00 0.00000e+00 1.12500e+02 315.120 2.19681e+01 135.120 0.9737 
1 1 1 7   104 2  o 13 8.84122e+00 7.75173e-01 1.45100e+02 163.765 -2.88415e+01 8.39812e+00  0.00000e+00 0.00000e+00 1.78073e+02 163.765 3.29731e+01 163.765 0.9832 
1 1 1 7   104 3  f 0  2.74423e+00 8.73332e-01 8.00944e+01 2.334   5.12022e+00  2.08713e-01  0.00000e+00 0.00000e+00 1.13493e+01 2.334   6.87451e+01 182.334 0.8962 
1 1 1 7   104 4  o 18 7.66224e+00 8.62392e-01 1.22293e+02 168.760 -2.31264e+01 4.59580e+00  0.00000e+00 0.00000e+00 1.56515e+02 168.760 3.42217e+01 168.760 0.9786 
1 1 1 7   104 5  o 15 3.92348e+00 1.02206e+00 2.69582e+01 104.454 -5.83704e-01 2.26449e+00  0.00000e+00 0.00000e+00 8.19117e+01 104.454 5.49535e+01 104.454 0.7462 
1 1 1 7   104 6  o 14 3.43867e+00 9.41269e-01 5.74924e+01 173.932 -5.26444e+00 5.59626e-01  0.00000e+00 0.00000e+00 5.75531e+01 173.932 6.06276e-02 173.932 0.8998 
1 1 1 7   104 7  o 8  2.29613e+00 7.86727e-01 4.75047e+01 257.508 -7.79164e-01 -3.51689e+00 0.00000e+00 0.00000e+00 2.47381e+01 257.508 2.27666e+01 77.508  0.8463 
1 1 1 7   104 8  o 12 5.33178e+00 1.27773e+00 9.44524e+01 19.966  9.68822e+00  3.51974e+00  0.00000e+00 0.00000e+00 9.38661e+01 19.966  5.86274e-01 199.966 0.9502 
1 1 1 7   105 0  o 1  5.87139e+00 8.62562e-01 9.94194e+01 324.412 1.04556e+01  -7.48222e+00 0.00000e+00 0.00000e+00 1.10041e+02 324.412 1.06214e+01 324.412 0.9603 
1 1 1 7   105 1  o 19 7.02701e+00 8.81954e-01 8.42800e+01 124.438 -7.28008e+00 1.06170e+01  0.00000e+00 0.00000e+00 1.66483e+02 124.438 8.22029e+01 124.438 0.9603 
1 1 1 7   105 2  o 14 4.07390e+00 9.82874e-01 7.20864e+01 186.610 -6.40923e+00 -7.42694e-01 0.00000e+00 0.00000e+00 6.70398e+01 186.610 5.04660e+00 6.610   0.9189 
1 1 1 7   105 3  o 11 4.70328e+00 1.00503e+00 9.59148e+01 144.945 -8.26923e+00 5.80204e+00  0.00000e+00 0.00000e+00 7.00191e+01 144.945 2.58957e+01 324.945 0.9491 
1 1 1 7   105 4  o 14 4.17927e+00 1.01929e+00 6.04275e+01 22.154  5.06457e+00  2.06207e+00  0.00000e+00 0.00000e+00 7.98959e+01 22.154  1.94683e+01 22.154  0.9032 
1 1 1 7   105 5  o 2  2.43738e+00 8.18359e-01 3.15108e+01 141.989 -1.55506e+00 1.21545e+00  0.00000e+00 0.00000e+00 3.13173e+01 141.989 1.93516e-01 321.989 0.6934 
1 1 1 7   105 6  o 6  2.90282e+00 9.13562e-01 4.87708e+01 128.505 -2.30064e+00 2.89182e+00  0.00000e+00 0.00000e+00 4.30222e+01 128.505 5.74862e+00 308.505 0.8507 
1 1 1 7   105 7  f 0  2.88351e+00 8.83945e-01 7.32405e+01 24.970  5.78811e+00  2.69536e+00  0.00000e+00 0.00000e+00 2.51399e+01 24.970  4.81007e+01 204.970 0.9180 
1 1 1 7   105 8  o 15 3.84109e+00 1.08931e+00 9.02442e+01 323.852 6.75455e+00  -4.93412e+00 0.00000e+00 0.00000e+00 4.36699e+01 323.852 4.65743e+01 143.852 0.9382 
1 1 1 7   106 0  o 5  2.48313e+00 7.83707e-01 3.14962e+01 279.309 3.24281e-01  -1.97841e+00 0.00000e+00 0.00000e+00 3.29265e+01 279.309 1.43029e+00 279.309 0.6986 
1 1 1 7   106 1  o 12 3.63721e+00 9.62734e-01 5.48708e+01 139.380 -3.50428e+00 3.00563e+00  0.00000e+00 0.00000e+00 6.45274e+01 139.380 9.65656e+00 139.380 0.8837 
1 1 1 7   106 2  o 8  3.46151e+00 9.47259e-01 4.97561e+01 275.705 4.02046e-01  -4.02449e+00 0.00000e+00 0.00000e+00 6.15232e+01 275.705 1.17670e+01 275.705 0.8652 
1 1 1 7   106 3  o 5  4.37745e+00 1.01826e+00 7.14346e+01 90.643  -7.67412e-02 6.83827e+00  0.00000e+00 0.00000e+00 7.88197e+01 90.643  7.38508e+00 90.643  0.9237 
1 1 1 7   106 4  o 5  6.04801e+00 1.02286e+00 9.17753e+01 290.545 4.15876e+00  -1.10967e+01 0.00000e+00 0.00000e+00 1.23284e+02 290.545 3.15090e+01 290.545 0.9568 
1 1 1 7   106 5  o 19 7.78543e+00 9.64140e-01 1.31084e+02 86.833  1.43945e+00  2.60164e+01  0.00000e+00 0.00000e+00 1.52641e+02 86.833  2.15577e+01 86.833  0.9806 
1 1 1 7   106 6  o 7  3.07711e+00 9.46624e-01 3.26349e+01 224.444 -1.91169e+00 -1.87494e+00 0.00000e+00 0.00000e+00 5.69026e+01 224.444 2.42676e+01 224.444 0.7830 
1 1 1 7   106 7  f 0  3.18845e+00 9.86465e-01 6.74827e+01 152.355 -5.42982e+00 2.84406e+00  0.00000e+00 0.00000e+00 4.08406e+01 152.355 2.66422e+01 332.355 0.9143 
1 1 1 7   106 8  o 13 2.45914e+00 8.40030e-01 4.82381e+01 290.064 1.44872e+00  -3.96651e+00 0.00000e+00 0.00000e+00 3.13874e+01 290.064 1.68507e+01 110.064 0.8716 
1 1 1 7   107 0  o 1  3.56792e+00 8.99359e-01 6.11907e+01 204.101 -4.86430e+00 -2.17603e+00 0.00000e+00 0.00000e+00 5.80982e+01 204.101 3.09247e+00 24.101  0.9005 
1 1 1 7   107 1  o 11 5.15059e+00 9.87499e-01 6.53391e+01 344.210 6.76925e+00  -1.91424e+00 0.00000e+00 0.00000e+00 1.11772e+02 344.210 4.64326e+01 344.210 0.9259 
1 1 1 7   107 2  o 12 3.96499e+00 9.69605e-01 3.88616e+01 319.135 2.62833e+00  -2.27395e+00 0.00000e+00 0.00000e+00 8.48252e+01 319.135 4.59636e+01 319.135 0.8398 
1 1 1 7   107 3  o 6  7.50423e+00 8.84214e-01 1.14684e+02 101.921 -4.24395e+00 2.01022e+01  0.00000e+00 0.00000e+00 1.57224e+02 101.921 4.25393e+01 101.921 0.9754 
1 1 1 7   107 4  o 18 6.67695e+00 9.73583e-01 1.11395e+02 262.673 -2.46647e+00 -1.91819e+01 0.00000e+00 0.00000e+00 1.30167e+02 262.673 1.87724e+01 262.673 0.9738 
1 1 1 7   107 5  o 11 3.64189e+00 1.01178e+00 9.88545e+01 340.509 8.10806e+00  -2.86969e+00 0.00000e+00 0.00000e+00 2.83231e+01 340.509 7.05314e+01 160.510 0.9399 
1 1 1 7   107 6  o 7  3.35690e+00 9.96362e-01 3.91970e+01 171.974 -3.52209e+00 4.96632e-01  0.00000e+00 0.00000e+00 6.60614e+01 171.974 2.68644e+01 171.974 0.8440 
1 1 1 7   107 7  o 15 2.54361e+00 8.39760e-01 5.62589e+01 161.195 -4.60846e+00 1.56931e+00  0.00000e+00 0.00000e+00 2.78555e+01 161.195 2.84033e+01 341.195 0.8902 
1 1 1 7   108 0  o 15 5.19543e+00 9.90121e-01 7.83579e+01 244.601 -3.87041e+00 -8.15132e+00 0.00000e+00 0.00000e+00 1.03462e+02 244.601 2.51037e+01 244.601 0.9428 
1 1 1 7   108 1  o 12 5.76605e+00 9.48209e-01 8.24598e+01 216.270 -9.01970e+00 -6.61830e+00 0.00000e+00 0.00000e+00 1.21812e+02 216.270 3.93517e+01 216.270 0.9542 
1 1 1 7   108 2  o 13 4.45911e+00 9.05767e-01 5.31978e+01 65.340  2.32132e+00  5.05617e+00  0.00000e+00 0.00000e+00 9.66554e+01 65.340  4.34576e+01 65.340  0.9050 
1 1 1 7   108 3  o 16 2.46946e+00 7.99112e-01 4.69857e+01 304.049 1.74737e+00  -2.58576e+00 0.00000e+00 0.00000e+00 2.80842e+01 304.049 1.89014e+01 124.049 0.8185 
1 1 1 7   108 4  o 4  4.74803e+00 1.02349e+00 4.37996e+01 122.344 -2.58079e+00 4.07539e+00  0.00000e+00 0.00000e+00 1.12997e+02 122.344 6.91971e+01 122.344 0.8891 
1 1 1 7   108 5  o 12 4.44920e+00 1.09654e+00 4.76004e+01 41.345  3.86484e+00  3.40075e+00  0.00000e+00 0.00000e+00 1.00580e+02 41.345  5.29798e+01 41.345  0.8967 
1 1 1 7   108 6  o 12 3.12889e+00 9.46540e-01 5.36880e+01 206.060 -4.48328e+00 -2.19245e+00 0.00000e+00 0.00000e+00 5.01026e+01 206.060 3.58541e+00 26.060  0.8932 
1 1 1 7   108 7  o 9  2.73456e+00 8.35718e-01 5.94330e+01 167.651 -5.57849e+00 1.22135e+00  0.00000e+00 0.00000e+00 3.27338e+01 167.651 2.66992e+01 347.650 0.9076 
1 1 1 7   109 0  o 2  3.74267e+00 9.65531e-01 7.68596e+01 338.556 5.98303e+00  -2.35006e+00 0.00000e+00 0.00000e+00 5.07040e+01 338.556 2.61556e+01 158.556 0.9185 
1 1 1 7   109 1  o 10 8.85799e+00 7.48339e-01 1.08787e+02 9.481   2.57779e+01  4.30498e+00  0.00000e+00 0.00000e+00 2.13631e+02 9.481   1.04844e+02 9.481   0.9807 
1 1 1 7   109 2  o 9  6.75792e+00 9.23311e-01 9.29310e+01 252.909 -5.03131e+00 -1.63633e+01 0.00000e+00 0.00000e+00 1.50501e+02 252.909 5.75701e+01 252.909 0.9703 
1 1 1 7   109 3  o 4  2.21684e+00 7.38237e-01 2.16172e+01 15.360  1.36897e+00  3.76055e-01  0.00000e+00 0.00000e+00 2.57617e+01 15.360  4.14453e+00 15.360  0.5756 
1 1 1 7   109 4  o 11 6.11161e+00 1.00080e+00 7.65032e+01 135.481 -8.45514e+00 8.31440e+00  0.00000e+00 0.00000e+00 1.40632e+02 135.481 6.41292e+01 135.481 0.9569 
1 1 1 7   109 5  o 6  2.00329e+00 6.96460e-01 2.58801e+01 12.880  1.74581e+00  3.99214e-01  0.00000e+00 0.00000e+00 2.32323e+01 12.880  2.64780e+00 192.880 0.6603 
1 1 1 7   109 6  o 11 3.41570e+00 9.93035e-01 5.30138e+01 131.792 -3.48732e+00 3.90141e+00  0.00000e+00 0.00000e+00 6.09359e+01 131.792 7.92206e+00 131.792 0.8985 
1 1 1 7   110 0  o 6  3.17652e+00 9.00834e-01 5.01871e+01 30.961  3.80308e+00  2.28156e+00  0.00000e+00 0.00000e+00 5.33170e+01 30.961  3.12990e+00 30.961  0.8784 
1 1 1 7   110 1  o 18 5.29783e+00 8.13895e-01 8.46528e+01 202.243 -1.21365e+01 -4.96350e+00 0.00000e+00 0.00000e+00 1.04270e+02 202.243 1.96174e+01 202.243 0.9611 
1 1 1 7   110 2  o 6  2.66016e+00 8.05708e-01 2.55712e+01 110.045 -6.52787e-01 1.78911e+00  0.00000e+00 0.00000e+00 4.17035e+01 110.045 1.61323e+01 110.045 0.6814 
1 1 1 7   110 3  o 1  3.09445e+00 8.68740e-01 4.24679e+01 213.585 -3.22556e+00 -2.14184e+00 0.00000e+00 0.00000e+00 5.61249e+01 213.585 1.36570e+01 213.585 0.8584 
1 1 1 7   110 4  o 5  6.07441e+00 9.65084e-01 7.57032e+01 23.883  1.07603e+01  4.76452e+00  0.00000e+00 0.00000e+00 1.39969e+02 23.883  6.42661e+01 23.883  0.9565 
1 1 1 7   110 5  o 14 3.88392e+00 1.03238e+00 6.30479e+01 99.811  -1.13238e+00 6.54836e+00  0.00000e+00 0.00000e+00 6.97815e+01 99.811  6.73354e+00 99.811  0.9213 
1 1 1 7   110 6  o 3  2.95489e+00 8.62039e-01 4.98102e+01 299.222 2.45350e+00  -4.38603e+00 0.00000e+00 0.00000e+00 4.82387e+01 299.222 1.57152e+00 119.222 0.8940 
1 1 1 7   111 0  f 0  3.01696e+00 8.90653e-01 1.94729e+01 298.983 7.58288e-01  -1.36894e+00 0.00000e+00 0.00000e+00 4.89737e+01 298.983 2.95008e+01 298.983 0.6118 
1 1 1 7   111 1  f 0  3.49516e+00 9.36943e-01 9.17763e+01 291.625 3.01947e+00  -7.61660e+00 0.00000e+00 0.00000e+00 2.96806e+01 291.625 6.20957e+01 111.625 0.9368 
1 1 1 7   111 2  o 3  4.10580e+00 9.69585e-01 9.00797e+01 269.877 -2.07861e-02 -9.65963e+00 0.00000e+00 0.00000e+00 5.41329e+01 269.877 3.59468e+01 89.877  0.9467 
1 1 1 7   111 3  o 12 5.55745e+00 1.01199e+00 1.06447e+02 105.626 -3.90812e+00 1.39724e+01  0.00000e+00 0.00000e+00 9.25257e+01 105.626 1.39209e+01 285.626 0.9649 
1 1 1 7   111 4  o 8  2.16945e+00 7.29516e-01 3.73532e+01 80.156  4.69861e-01  2.70784e+00  0.00000e+00 0.00000e+00 2.62049e+01 80.156  1.11483e+01 260.156 0.7895 
1 1 1 7   111 5  o 9  3.25260e+00 9.41302e-01 1.19069e+01 95.586  -1.05199e-01 1.07566e+00  0.00000e+00 0.00000e+00 4.53381e+01 95.586  3.34312e+01 95.586  0.4743 
1 1 1 7   111 6  o 15 2.54137e+00 8.36885e-01 3.76070e+01 313.384 2.44649e+00  -2.58852e+00 0.00000e+00 0.00000e+00 4.20072e+01 313.384 4.40015e+00 313.384 0.8443 
1 1 1 7   112 0  f 0  5.89767e+00 9.53532e-01 7.88646e+01 204.639 -1.12013e+01 -5.13753e+00 0.00000e+00 0.00000e+00 1.30710e+02 204.639 5.18455e+01 204.639 0.9585 
1 1 1 7   112 1  o 13 3.24996e+00 8.94046e-01 1.62665e+01 228.810 -1.03441e+00 -1.18202e+00 0.00000e+00 0.00000e+00 5.76257e+01 228.810 4.13592e+01 228.810 0.6131 
1 1 1 7   112 2  o 7  3.18090e+00 9.27771e-01 8.41848e+01 49.023  4.64893e+00  5.35240e+00  0.00000e+00 0.00000e+00 2.51230e+01 49.023  5.90618e+01 229.023 0.9265 
1 1 1 7   112 3  o 14 3.26194e+00 9.37235e-01 4.58587e+01 167.974 -4.07655e+00 8.68416e-01  0.00000e+00 0.00000e+00 5.93717e+01 167.974 1.35130e+01 167.974 0.8697 
1 1 1 7   112 4  o 5  2.84877e+00 8.98013e-01 3.95186e+01 100.526 -6.58105e-01 3.54171e+00  0.00000e+00 0.00000e+00 4.99152e+01 100.526 1.03966e+01 100.526 0.8463 
1 1 1 7   112 5  o 11 3.12475e+00 9.43153e-01 3.72487e+01 243.700 -1.60980e+00 -3.25715e+00 0.00000e+00 0.00000e+00 6.10233e+01 243.700 2.37746e+01 243.700 0.8478 
1 1 1 7   113 0  o 9  3.00880e+00 8.91548e-01 5.68971e+01 10.001  5.05947e+00  8.92205e-01  0.00000e+00 0.00000e+00 4.30692e+01 10.001  1.38279e+01 190.001 0.8965 
1 1 1 7   113 1  o 6  4.05220e+00 1.00919e+00 8.58162e+01 269.750 -3.90840e-02 -8.94934e+00 0.00000e+00 0.00000e+00 5.57420e+01 269.750 3.00742e+01 89.750  0.9424 
1 1 1 7   113 2  o 15 3.02659e+00 9.16069e-01 6.64387e+01 168.632 -5.60225e+00 1.12635e+00  0.00000e+00 0.00000e+00 3.54199e+01 168.632 3.10188e+01 348.632 0.9077 
1 1 1 7   113 3  o 4  5.44217e+00 1.04882e+00 8.12079e+01 4.885   1.12935e+01  9.65287e-01  0.00000e+00 0.00000e+00 1.11482e+02 4.885   3.02745e+01 4.885   0.9548 
1 1 1 7   113 4  o 14 3.86164e+00 1.05444e+00 6.91569e+01 160.031 -6.60807e+00 2.40111e+00  0.00000e+00 0.00000e+00 6.34366e+01 160.031 5.72023e+00 340.031 0.9259 
1 1 1 7   113 5  o 10 2.93113e+00 9.18515e-01 7.79368e+01 103.041 -1.70236e+00 7.34961e+00  0.00000e+00 0.00000e+00 2.32807e+01 103.041 5.46561e+01 283.041 0.9311 
1 1 1 7   114 0  o 10 2.62293e+00 8.25784e-01 4.49942e+01 151.309 -3.48586e+00 1.90772e+00  0.00000e+00 0.00000e+00 3.88230e+01 151.309 6.17120e+00 331.309 0.8625 
1 1 1 7   114 1  o 6  2.47976e+00 7.89420e-01 4.43726e+00 145.994 -3.18389e-01 2.14808e-01  0.00000e+00 0.00000e+00 1.28930e+01 145.994 8.45570e+00 145.994 0.1886 
1 1 1 7   114 2  o 5  3.16883e+00 9.06628e-01 4.54278e+01 65.966  1.85848e+00  4.16764e+00  0.00000e+00 0.00000e+00 5.81875e+01 65.966  1.27597e+01 65.966  0.8822 
1 1 1 7   114 3  o 17 6.56288e+00 9.49687e-01 6.48985e+01 280.943 2.37276e+00  -1.22721e+01 0.00000e+00 0.00000e+00 1.68449e+02 280.943 1.03550e+02 280.943 0.9591 
1 1 1 7   114 4  o 18 3.69453e+00 1.02351e+00 7.47659e+01 73.685  2.33291e+00  7.97038e+00  0.00000e+00 0.00000e+00 5.36709e+01 73.685  2.10950e+01 253.685 0.9377 
1 1 1 7   114 5  o 19 5.58409e+00 1.10613e+00 8.92472e+01 342.340 1.32222e+01  -4.20956e+00 0.00000e+00 0.00000e+00 1.10171e+02 342.340 2.09233e+01 342.340 0.9633 
1 1 1 7   115 0  o 2  2.44529e+00 7.84901e-01 4.73858e+01 155.462 -3.79761e+00 1.73375e+00  0.00000e+00 0.00000e+00 3.14018e+01 155.462 1.59840e+01 335.461 0.8699 
1 1 1 7   115 1  o 15 3.25938e+00 9.42672e-01 3.69598e+01 70.727  1.10753e+00  3.16744e+00  0.00000e+00 0.00000e+00 6.36483e+01 70.727  2.66885e+01 70.727  0.8332 
1 1 1 7   115 2  o 10 3.27085e+00 9.16401e-01 5.28826e+01 208.233 -4.90418e+00 -2.63322e+00 0.00000e+00 0.00000e+00 5.68089e+01 208.233 3.92633e+00 208.233 0.9050 
1 1 1 7   115 3  o 9  3.05569e+00 9.25987e-01 7.34298e+01 234.243 -4.41086e+00 -6.12559e+00 0.00000e+00 0.00000e+00 3.20198e+01 234.243 4.14100e+01 54.243  0.9312 
1 1 1 7   115 4  o 19 3.97616e+00 1.01203e+00 6.63632e+01 68.584  2.89636e+00  7.38457e+00  0.00000e+00 0.00000e+00 7.13716e+01 68.584  5.00839e+00 68.584  0.9347 
1 1 1 7   115 5  o 4  2.53682e+00 8.30744e-01 2.93585e+01 349.197 2.85221e+00  -5.44227e-01 0.00000e+00 0.00000e+00 4.61021e+01 349.197 1.67437e+01 349.197 0.8026 
1 1 1 7   116 0  o 7  2.88800e+00 8.62859e-01 2.52093e+01 28.850  2.17407e+00  1.19766e+00  0.00000e+00 0.00000e+00 5.63841e+01 28.850  3.11748e+01 28.850  0.7630 
1 1 1 7   116 1  o 1  5.24803e+00 1.00566e+00 1.05927e+02 98.081  -2.31465e+00 1.63022e+01  0.00000e+00 0.00000e+00 8.24399e+01 98.081  2.34869e+01 278.081 0.9691 
1 1 1 7   116 2  f 0  4.95834e+00 1.02928e+00 6.85461e+01 286.822 2.93761e+00  -9.71617e+00 0.00000e+00 0.00000e+00 1.05828e+02 286.822 3.72819e+01 286.822 0.9494 
1 1 1 7   116 3  o 18 2.49158e+00 8.13470e-01 1.92100e+01 178.015 -1.71532e+00 5.94553e-02  0.00000e+00 0.00000e+00 4.03509e+01 178.015 2.11409e+01 178.015 0.6452 
1 1 1 7   116 4  f 0  2.26116e+00 7.50002e-01 5.59955e+00 88.383  1.52161e-02  5.38869e-01  0.00000e+00 0.00000e+00 1.61992e+01 88.383  1.05997e+01 88.383  0.2602 
1 1 1 7   117 0  o 16 3.91882e+00 1.00787e+00 8.57408e+01 111.406 -3.66615e+00 9.35193e+00  0.00000e+00 0.00000e+00 5.18912e+01 111.406 3.38496e+01 291.406 0.9488 
1 1 1 7   117 1  o 12 7.48490e+00 9.41265e-01 1.06679e+02 286.088 7.11914e+00  -2.46846e+01 0.00000e+00 0.00000e+00 1.64993e+02 286.088 5.83138e+01 286.088 0.9803 
1 1 1 7   117 2  o 4  4.17128e+00 1.00830e+00 5.50924e+01 237.199 -3.75731e+00 -5.83006e+00 0.00000e+00 0.00000e+00 8.77596e+01 237.199 3.26672e+01 237.199 0.9248 
1 1 1 7   117 3  o 10 3.96673e+00 1.04131e+00 9.60803e+01 120.879 -5.90180e+00 9.86955e+00  0.00000e+00 0.00000e+00 4.42898e+01 120.879 5.17905e+01 300.879 0.9555 
1 1 1 7   117 4  o 10 2.69205e+00 8.65040e-01 7.32512e+01 9.769   7.28225e+00  1.25380e+00  0.00000e+00 0.00000e+00 1.94420e+01 9.769   5.38091e+01 189.769 0.9296 
1 1 1 7   118 0  o 3  4.16784e+00 9.43034e-01 7.87432e+01 105.746 -2.99819e+00 1.06336e+01  0.00000e+00 0.00000e+00 6.83235e+01 105.746 1.04197e+01 285.746 0.9536 
1 1 1 7   118 1  o 8  2.09324e+00 7.01813e-01 5.02831e+01 21.546  4.37212e+00  1.72625e+00  0.00000e+00 0.00000e+00 1.83553e+01 21.546  3.19279e+01 201.546 0.8859 
1 1 1 7   118 2  o 11 2.53853e+00 8.16685e-01 5.78777e+01 134.179 -4.06422e+00 4.18233e+00  0.00000e+00 0.00000e+00 2.76067e+01 134.179 3.02710e+01 314.179 0.9097 
1 1 1 7   118 3  o 14 2.95408e+00 8.86959e-01 2.57473e+01 85.887  1.99146e-01  2.76973e+00  0.00000e+00 0.00000e+00 6.08787e+01 85.887  3.51313e+01 85.887  0.7920 
1 1 1 7   118 4  f 0  2.13742e+00 7.26091e-01 2.00295e+01 246.127 -8.59575e-01 -1.94222e+00 0.00000e+00 0.00000e+00 3.67233e+01 246.127 1.66938e+01 246.127 0.7171 
1 1 1 7   119 0  o 18 2.84651e+00 8.74439e-01 4.58622e+01 19.784  4.54590e+00  1.63517e+00  0.00000e+00 0.00000e+00 4.77770e+01 19.784  1.91483e+00 19.784  0.8893 
1 1 1 7   119 1  o 11 5.41577e+00 1.07196e+00 1.45596e+02 177.424 -2.21903e+01 9.98484e-01  0.00000e+00 0.00000e+00 5.02230e+01 177.424 9.53731e+01 357.424 0.9772 
1 1 1 7   119 2  o 15 4.21764e+00 1.02681e+00 4.45427e+01 237.608 -3.28227e+00 -5.17360e+00 0.00000e+00 0.00000e+00 9.81613e+01 237.608 5.36186e+01 237.608 0.9143 
1 1 1 7   119 3  o 18 2.58436e+00 8.17840e-01 4.58506e+01 80.975  8.16197e-01  5.13890e+00  0.00000e+00 0.00000e+00 4.00344e+01 80.975  5.81614e+00 260.975 0.8979 
1 1 1 7   119 4  f 0  3.52633e+00 9.97292e-01 6.79428e+01 293.088 3.01369e+00  -7.06964e+00 0.00000e+00 0.00000e+00 5.37672e+01 293.088 1.41756e+01 113.088 0.9325 
1 1 1 7   120 0  o 19 2.64505e+00 8.37531e-01 7.22369e+01 115.980 -3.46629e+00 7.11316e+00  0.00000e+00 0.00000e+00 1.91657e+01 115.980 5.30713e+01 295.980 0.9345 
1 1 1 7   120 1  o 19 2.04427e+00 6.98588e-01 2.95721e+01 178.115 -2.79970e+00 9.21459e-02  0.00000e+00 0.00000e+00 3.04754e+01 178.115 9.03218e-01 178.115 0.7941 
1 1 1 7   120 2  o 2  2.80548e+00 8.70432e-01 4.61737e+01 47.156  3.60552e+00  3.88757e+00  0.00000e+00 0.00000e+00 4.72305e+01 47.156  1.05678e+00 47.156  0.8999 
1 1 1 7   120 3  o 18 2.52651e+00 8.26764e-01 3.70308e+01 90.127  -8.19399e-03 3.68180e+00  0.00000e+00 0.00000e+00 4.24333e+01 90.127  5.40249e+00 90.127  0.8501 
1 1 1 7   121 2  o 4  2.37988e+00 7.77602e-01 3.86448e+01 48.236  2.55444e+00  2.86056e+00  0.00000e+00 0.00000e+00 3.67719e+01 48.236  1.87292e+00 228.236 0.8569 
1 1 1 8   0   0  o 13 1.45999e+00 9.89347e-01 1.68554e+02 180.000 -1.61772e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.59713e+02 0.000   3.28267e+02 0.000   0.1604 
1 1 1 8   0   1  o 19 9.33413e+00 8.02611e-01 1.75582e+02 180.000 -1.07239e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.03065e+02 180.000 7.25179e+01 0.000   0.7904 
1 1 1 8   0   2  o 7  1.73604e+01 7.70126e-01 1.86957e+02 180.000 -2.00261e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.45437e+02 180.000 2.58480e+02 180.000 0.9642 
1 1 1 8   0   3  o 6  4.72795e+01 1.37806e+00 8.57183e+02 180.000 -2.55703e+01 0.00000e+00  0.00000e+00 0.00000e+00 9.29318e+02 180.000 7.21354e+01 180.000 1.0000 
1 1 1 8   0   4  o 10 3.75809e+01 1.16825e+00 6.62391e+02 180.000 -1.95983e+01 0.00000e+00  0.00000e+00 0.00000e+00 7.57794e+02 180.000 9.54026e+01 180.000 1.0000 
1 1 1 8   0   6  o 9  3.26127e+01 1.11413e+00 6.53708e+02 180.000 -2.35242e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.78768e+02 180.000 7.49403e+01 0.000   1.0000 
1 1 1 8   0   7  o 10 1.27765e+01 1.16213e+00 2.69298e+02 0.000   4.66188e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.13421e+02 0.000   5.58771e+01 180.000 0.9998 
1 1 1 8   0   8  o 16 4.76872e+00 2.31086e+00 1.04683e+02 0.000   7.03066e-01  0.00000e+00  0.00000e+00 0.00000e+00 4.56043e+00 0.000   1.00123e+02 180.000 0.6063 
1 1 1 8   0   9  o 14 3.12390e+01 1.25785e+00 5.89730e+02 180.000 -3.92775e+01 0.00000e+00  0.00000e+00 0.00000e+00 5.90352e+02 180.000 6.22409e-01 180.000 1.0000 
1 1 1 8   0   10 o 7  3.81038e+00 2.21197e+00 8.37854e+00 0.000   7.46966e-02  0.00000e+00  0.00000e+00 0.00000e+00 2.35062e+00 0.000   6.02791e+00 180.000 0.0746 
1 1 1 8   0   11 o 13 1.25842e+01 2.00990e+00 1.13137e+02 0.000   4.45424e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.61839e+02 0.000   2.48702e+02 0.000   0.9997 
1 1 1 8   0   12 o 19 1.91797e+01 1.60757e+00 3.04013e+02 180.000 -2.43519e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.19827e+02 180.000 1.15814e+02 180.000 1.0000 
1 1 1 8   0   13 o 16 5.41974e+00 3.09808e+00 2.28240e+01 180.000 -3.71382e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.97964e+01 180.000 2.69724e+01 180.000 0.3552 
1 1 1 8   0   14 o 6  2.87026e+00 2.04040e+00 8.67806e+01 180.000 -1.22476e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.23869e+00 180.000 8.25419e+01 0.000   0.8411 
1 1 1 8   0   15 o 4  4.49264e+00 3.08940e+00 7.50057e+01 180.000 -1.15332e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.36224e+01 180.000 1.13833e+01 0.000   0.8189 
1 1 1 8   1   0  o 6  2.08053e+01 5.58101e-01 5.05532e+02 5.161   1.38313e+01  1.24917e+00  0.00000e+00 0.00000e+00 2.51235e+02 5.161   2.54297e+02 185.161 0.9633 
1 1 1 8   1   1  o 11 1.40977e+01 5.26514e-01 1.14768e+02 312.448 1.43046e+00  -1.56391e+00 0.00000e+00 0.00000e+00 2.66725e+02 312.448 1.51957e+02 312.448 0.7164 
1 1 1 8   1   2  o 14 1.64854e+01 5.39875e-01 3.08826e+02 296.386 2.79214e+00  -5.62810e+00 0.00000e+00 0.00000e+00 2.62003e+02 296.386 4.68229e+01 116.386 0.9165 
1 1 1 8   1   3  o 14 3.79228e+01 8.29795e-01 6.43112e+02 89.521  2.58929e-01  3.09641e+01  0.00000e+00 0.00000e+00 7.66505e+02 89.521  1.23393e+02 89.521  0.9837 
1 1 1 8   1   4  o 3  3.34367e+01 7.59482e-01 6.03355e+02 283.942 7.67710e+00  -3.09242e+01 0.00000e+00 0.00000e+00 6.40229e+02 283.942 3.68741e+01 283.942 0.9842 
1 1 1 8   1   5  o 19 2.38045e+01 6.76550e-01 4.54360e+02 344.288 1.77858e+01  -5.00331e+00 0.00000e+00 0.00000e+00 4.20561e+02 344.288 3.37992e+01 164.288 0.9726 
1 1 1 8   1   6  o 4  5.40360e+01 1.12551e+00 9.76092e+02 220.010 -8.68102e+01 -7.28677e+01 0.00000e+00 0.00000e+00 1.05697e+03 220.010 8.08768e+01 220.010 0.9956 
1 1 1 8   1   7  o 13 3.10108e+01 7.87539e-01 5.27295e+02 29.068  3.88376e+01  2.15881e+01  0.00000e+00 0.00000e+00 6.31292e+02 29.068  1.03997e+02 29.068  0.9887 
1 1 1 8   1   8  o 6  1.70240e+01 8.44722e-01 4.35872e+02 187.116 -2.31489e+01 -2.88980e+00 0.00000e+00 0.00000e+00 1.93412e+02 187.116 2.42460e+02 7.116   0.9783 
1 1 1 8   1   9  o 10 8.18736e+00 1.32297e+00 1.83604e+02 359.386 5.94965e+00  -6.37138e-02 0.00000e+00 0.00000e+00 9.83316e+01 359.386 8.52729e+01 179.386 0.9116 
1 1 1 8   1   10 o 14 5.74902e+00 1.47484e+00 1.55860e+02 247.697 -1.63023e+00 -3.97441e+00 0.00000e+00 0.00000e+00 3.39019e+01 247.697 1.21958e+02 67.697  0.8740 
1 1 1 8   1   11 o 3  1.60412e+01 1.08031e+00 3.48487e+02 167.739 -3.80076e+01 8.26016e+00  0.00000e+00 0.00000e+00 2.49297e+02 167.739 9.91896e+01 347.739 0.9871 
1 1 1 8   1   12 o 6  4.47929e+00 1.34382e+00 8.35197e+01 302.444 1.55079e+00  -2.43953e+00 0.00000e+00 0.00000e+00 5.19834e+01 302.444 3.15363e+01 122.444 0.8016 
1 1 1 8   1   13 o 7  5.83774e+00 1.71752e+00 1.19401e+02 112.195 -1.99982e+00 4.90173e+00  0.00000e+00 0.00000e+00 7.87467e+01 112.195 4.06540e+01 292.194 0.8998 
1 1 1 8   1   14 o 12 5.79618e+00 1.76926e+00 1.16594e+02 329.223 4.78047e+00  -2.84712e+00 0.00000e+00 0.00000e+00 8.11856e+01 329.223 3.54086e+01 149.223 0.9050 
1 1 1 8   1   15 o 19 5.72190e+00 1.92938e+00 2.01887e+01 228.816 -6.02201e-01 -6.88289e-01 0.00000e+00 0.00000e+00 6.93554e+01 228.816 4.91668e+01 228.816 0.4153 
1 1 1 8   2   0  o 9  2.46001e+01 6.03941e-01 4.49356e+02 297.640 6.75934e+00  -1.29076e+01 0.00000e+00 0.00000e+00 4.47070e+02 297.640 2.28595e+00 117.640 0.9650 
1 1 1 8   2   1  o 18 1.30124e+01 5.33212e-01 4.91919e+01 224.131 -5.50928e-01 -5.34465e-01 0.00000e+00 0.00000e+00 1.26782e+02 224.131 7.75905e+01 224.131 0.3580 
1 1 1 8   2   2  o 12 2.17979e+01 5.84565e-01 2.92240e+02 80.595  1.28267e+00  7.74373e+00  0.00000e+00 0.00000e+00 4.76869e+02 80.595  1.84629e+02 80.595  0.9339 
1 1 1 8   2   3  o 9  2.87298e+01 7.86153e-01 5.92005e+02 148.714 -1.84801e+01 1.12301e+01  0.00000e+00 0.00000e+00 4.68165e+02 148.714 1.23840e+02 328.714 0.9766 
1 1 1 8   2   4  o 17 5.49044e+01 1.11754e+00 1.04868e+03 251.890 -2.77024e+01 -8.47068e+01 0.00000e+00 0.00000e+00 1.01448e+03 251.890 3.41992e+01 71.890  0.9944 
1 1 1 8   2   5  o 2  2.10825e+01 6.53017e-01 3.59833e+02 26.987  1.15567e+01  5.88517e+00  0.00000e+00 0.00000e+00 4.05546e+02 26.987  4.57124e+01 26.987  0.9606 
1 1 1 8   2   6  o 14 7.50985e+00 1.00748e+00 2.14892e+02 340.096 3.29382e+00  -1.19262e+00 0.00000e+00 0.00000e+00 2.38631e+01 340.096 1.91029e+02 160.096 0.8413 
1 1 1 8   2   7  o 2  1.01478e+01 9.19955e-01 1.43619e+02 334.019 3.51886e+00  -1.71480e+00 0.00000e+00 0.00000e+00 1.86221e+02 334.019 4.26015e+01 334.019 0.8602 
1 1 1 8   2   8  o 7  8.16121e+00 1.20736e+00 1.84886e+02 46.054  3.15219e+00  3.27041e+00  0.00000e+00 0.00000e+00 8.69480e+01 46.054  9.79384e+01 226.054 0.8816 
1 1 1 8   2   9  o 7  2.39152e+01 8.55366e-01 3.56591e+02 38.622  2.85417e+01  2.28026e+01  0.00000e+00 0.00000e+00 5.34371e+02 38.622  1.77780e+02 38.622  0.9862 
1 1 1 8   2   10 o 1  1.55013e+01 1.01837e+00 3.18086e+02 214.068 -2.18275e+01 -1.47605e+01 0.00000e+00 0.00000e+00 2.56116e+02 214.068 6.19695e+01 34.068  0.9808 
1 1 1 8   2   11 o 11 1.17027e+01 1.31399e+00 2.39272e+02 78.542  3.60488e+00  1.77856e+01  0.00000e+00 0.00000e+00 1.90201e+02 78.542  4.90715e+01 258.542 0.9720 
1 1 1 8   2   12 o 2  1.93399e+01 1.10767e+00 3.46846e+02 121.225 -2.93448e+01 4.84072e+01  0.00000e+00 0.00000e+00 3.76559e+02 121.225 2.97126e+01 121.225 0.9911 
1 1 1 8   2   13 o 4  4.34412e+00 1.43633e+00 7.30631e+01 189.222 -2.72556e+00 -4.42540e-01 0.00000e+00 0.00000e+00 5.65046e+01 189.222 1.65584e+01 9.222   0.7907 
1 1 1 8   2   14 o 18 6.96547e+00 1.96860e+00 1.39855e+02 34.894  5.89632e+00  4.11248e+00  0.00000e+00 0.00000e+00 1.03752e+02 34.894  3.61030e+01 214.894 0.9276 
1 1 1 8   2   15 o 19 5.83186e+00 1.95126e+00 1.03281e+02 242.982 -2.13902e+00 -4.19483e+00 0.00000e+00 0.00000e+00 9.14614e+01 242.982 1.18197e+01 62.982  0.8862 
1 1 1 8   3   0  o 1  2.64289e+01 6.26727e-01 6.22596e+02 180.590 -2.16567e+01 -2.22869e-01 0.00000e+00 0.00000e+00 3.52024e+02 180.590 2.70572e+02 0.590   0.9766 
1 1 1 8   3   1  o 13 1.57803e+01 6.28927e-01 3.02422e+02 101.625 -1.14940e+00 5.58726e+00  0.00000e+00 0.00000e+00 2.38474e+02 101.625 6.39485e+01 281.625 0.9075 
1 1 1 8   3   2  o 14 2.79409e+01 6.61847e-01 6.45931e+02 354.108 2.20588e+01  -2.27642e+00 0.00000e+00 0.00000e+00 3.85567e+02 354.108 2.60364e+02 174.108 0.9772 
1 1 1 8   3   3  o 19 2.42738e+01 7.18552e-01 4.88577e+02 228.691 -9.97311e+00 -1.13487e+01 0.00000e+00 0.00000e+00 3.97727e+02 228.691 9.08498e+01 48.691  0.9663 
1 1 1 8   3   4  o 12 3.47880e+01 7.84404e-01 6.40177e+02 137.678 -2.59557e+01 2.36357e+01  0.00000e+00 0.00000e+00 6.55586e+02 137.678 1.54089e+01 137.678 0.9857 
1 1 1 8   3   5  o 17 4.18355e+01 9.06074e-01 7.46798e+02 249.998 -1.80319e+01 -4.95369e+01 0.00000e+00 0.00000e+00 8.19156e+02 249.998 7.23582e+01 249.998 0.9905 
1 1 1 8   3   6  o 3  4.53845e+01 9.82077e-01 9.04324e+02 44.735  6.34015e+01  6.28174e+01  0.00000e+00 0.00000e+00 8.01160e+02 44.735  1.03164e+02 224.735 0.9944 
1 1 1 8   3   7  o 14 1.64515e+01 7.54703e-01 3.92319e+02 217.858 -1.38788e+01 -1.07882e+01 0.00000e+00 0.00000e+00 2.11400e+02 217.858 1.80918e+02 37.858  0.9711 
1 1 1 8   3   8  o 5  2.17506e+01 8.13731e-01 3.51666e+02 45.912  1.67746e+01  1.73171e+01  0.00000e+00 0.00000e+00 4.52907e+02 45.912  1.01240e+02 45.912  0.9790 
1 1 1 8   3   9  o 18 2.52480e+01 8.39019e-01 4.52031e+02 226.295 -3.38491e+01 -3.54149e+01 0.00000e+00 0.00000e+00 4.91940e+02 226.295 3.99090e+01 226.295 0.9897 
1 1 1 8   3   10 o 19 1.77362e+01 9.80446e-01 2.88019e+02 99.233  -4.41257e+00 2.71461e+01  0.00000e+00 0.00000e+00 3.69507e+02 99.233  8.14886e+01 99.233  0.9816 
1 1 1 8   3   11 o 4  9.23672e+00 1.42790e+00 1.55732e+02 155.003 -8.13693e+00 3.79388e+00  0.00000e+00 0.00000e+00 1.72952e+02 155.003 1.72208e+01 155.003 0.9425 
1 1 1 8   3   12 o 6  1.03385e+01 1.48630e+00 3.02773e+02 322.791 1.81910e+01  -1.38124e+01 0.00000e+00 0.00000e+00 7.87551e+01 322.791 2.24018e+02 142.791 0.9779 
1 1 1 8   3   13 o 1  7.95994e+00 1.95881e+00 2.01706e+02 142.233 -8.82433e+00 6.83668e+00  0.00000e+00 0.00000e+00 8.47815e+01 142.233 1.16924e+02 322.233 0.9541 
1 1 1 8   3   14 o 4  3.99674e+00 1.37655e+00 5.58710e+01 6.281   2.26070e+00  2.48818e-01  0.00000e+00 0.00000e+00 5.53483e+01 6.281   5.22719e-01 186.281 0.7381 
1 1 1 8   3   15 o 16 5.08440e+00 1.72918e+00 7.08002e+01 313.537 2.20360e+00  -2.31913e+00 0.00000e+00 0.00000e+00 8.70130e+01 313.537 1.62128e+01 313.537 0.8237 
1 1 1 8   4   0  o 4  1.08606e+01 5.41939e-01 1.15400e+01 115.755 -7.17862e-02 1.48796e-01  0.00000e+00 0.00000e+00 2.22193e+01 115.755 1.06793e+01 115.755 0.0823 
1 1 1 8   4   1  o 3  2.26278e+01 5.94323e-01 5.64956e+02 250.435 -5.11686e+00 -1.43976e+01 0.00000e+00 0.00000e+00 2.61239e+02 250.435 3.03717e+02 70.435  0.9667 
1 1 1 8   4   2  o 13 3.31878e+01 7.35182e-01 8.36131e+02 100.040 -5.92538e+00 3.34688e+01  0.00000e+00 0.00000e+00 3.99079e+02 100.040 4.37052e+02 280.040 0.9852 
1 1 1 8   4   3  o 17 9.81993e+00 6.95333e-01 1.87513e+01 270.890 3.64228e-03  -2.34570e-01 0.00000e+00 0.00000e+00 2.44755e+01 270.890 5.72419e+00 270.890 0.1165 
1 1 1 8   4   4  f 0  1.37672e+01 6.04470e-01 2.87248e+02 38.317  4.83181e+00  3.81819e+00  0.00000e+00 0.00000e+00 1.88654e+02 38.317  9.85944e+01 218.317 0.9148 
1 1 1 8   4   5  o 19 3.60564e+01 8.22560e-01 6.37812e+02 180.977 -3.89551e+01 -6.64064e-01 0.00000e+00 0.00000e+00 7.07194e+02 180.977 6.93819e+01 180.977 0.9871 
1 1 1 8   4   6  o 11 2.48104e+01 7.06747e-01 3.36102e+02 266.494 -1.12999e+00 -1.84452e+01 0.00000e+00 0.00000e+00 5.75762e+02 266.494 2.39661e+02 266.494 0.9726 
1 1 1 8   4   7  o 6  2.64734e+01 7.43593e-01 4.96864e+02 178.873 -3.58384e+01 7.04897e-01  0.00000e+00 0.00000e+00 4.89450e+02 178.873 7.41478e+00 358.873 0.9860 
1 1 1 8   4   8  f 0  1.91960e+01 8.05130e-01 3.64213e+02 91.904  -7.32585e-01 2.20339e+01  0.00000e+00 0.00000e+00 3.44415e+02 91.904  1.97981e+01 271.904 0.9771 
1 1 1 8   4   9  f 0  1.05017e+01 1.22722e+00 3.16294e+02 346.655 1.30221e+01  -3.08915e+00 0.00000e+00 0.00000e+00 6.52882e+01 346.655 2.51006e+02 166.655 0.9619 
1 1 1 8   4   10 o 6  2.75546e+01 8.97353e-01 4.46078e+02 275.510 6.51911e+00  -6.75773e+01 0.00000e+00 0.00000e+00 5.86837e+02 275.510 1.40759e+02 275.510 0.9926 
1 1 1 8   4   11 o 2  1.04948e+01 1.47010e+00 1.73641e+02 324.430 9.11826e+00  -6.52082e+00 0.00000e+00 0.00000e+00 2.04465e+02 324.430 3.08242e+01 324.430 0.9543 
1 1 1 8   4   12 o 8  1.07695e+01 1.45013e+00 1.11975e+02 8.566   8.82926e+00  1.32998e+00  0.00000e+00 0.00000e+00 2.70971e+02 8.566   1.58995e+02 8.566   0.9422 
1 1 1 8   4   13 o 3  7.14189e+00 1.94502e+00 1.35870e+02 310.047 4.37138e+00  -5.20090e+00 0.00000e+00 0.00000e+00 1.12836e+02 310.047 2.30341e+01 130.047 0.9232 
1 1 1 8   4   14 o 11 6.13597e+00 1.82127e+00 1.86783e+02 27.012  8.16819e+00  4.16405e+00  0.00000e+00 0.00000e+00 3.15573e+01 27.012  1.55225e+02 207.012 0.9438 
1 1 1 8   4   15 o 15 8.06295e+00 2.27164e+00 1.82871e+02 203.734 -8.79751e+00 -3.86816e+00 0.00000e+00 0.00000e+00 1.04687e+02 203.734 7.81840e+01 23.734  0.9464 
1 1 1 8   5   0  o 11 3.11420e+01 6.96159e-01 6.55129e+02 226.897 -1.82668e+01 -1.95182e+01 0.00000e+00 0.00000e+00 4.98540e+02 226.897 1.56589e+02 46.897  0.9811 
1 1 1 8   5   1  o 8  3.97948e+01 9.76215e-01 8.80693e+02 18.102  3.92368e+01  1.28259e+01  0.00000e+00 0.00000e+00 6.04018e+02 18.102  2.76676e+02 198.102 0.9878 
1 1 1 8   5   2  o 3  1.61919e+01 7.65484e-01 4.14902e+02 208.006 -7.25032e+00 -3.85610e+00 0.00000e+00 0.00000e+00 1.58247e+02 208.006 2.56655e+02 28.006  0.9370 
1 1 1 8   5   3  o 10 1.07781e+01 7.30952e-01 2.46210e+02 88.977  6.27674e-02  3.51536e+00  0.00000e+00 0.00000e+00 9.66627e+01 88.977  1.49548e+02 268.977 0.8419 
1 1 1 8   5   4  o 12 3.35576e+01 7.65503e-01 6.66763e+02 80.021  5.99385e+00  3.40676e+01  0.00000e+00 0.00000e+00 5.82872e+02 80.021  8.38906e+01 260.021 0.9854 
1 1 1 8   5   5  o 5  4.47287e+01 9.54167e-01 5.95789e+02 179.411 -4.47765e+01 4.60642e-01  0.00000e+00 0.00000e+00 1.07555e+03 179.411 4.79760e+02 179.411 0.9888 
1 1 1 8   5   6  o 15 4.06767e+01 9.03444e-01 6.76462e+02 265.966 -4.23186e+00 -6.00031e+01 0.00000e+00 0.00000e+00 8.47878e+02 265.966 1.71416e+02 265.966 0.9917 
1 1 1 8   5   7  o 11 1.46496e+01 7.65421e-01 2.75411e+02 102.211 -2.32082e+00 1.07240e+01  0.00000e+00 0.00000e+00 2.52295e+02 102.211 2.31160e+01 282.211 0.9533 
1 1 1 8   5   8  o 3  2.29340e+01 7.96951e-01 5.78554e+02 32.473  3.53066e+01  2.24694e+01  0.00000e+00 0.00000e+00 2.77524e+02 32.473  3.01030e+02 212.473 0.9880 
1 1 1 8   5   9  o 1  3.48546e+01 8.93957e-01 6.32379e+02 124.842 -5.36011e+01 7.70018e+01  0.00000e+00 0.00000e+00 6.77206e+02 124.842 4.48278e+01 124.842 0.9947 
1 1 1 8   5   10 o 1  2.62373e+01 9.30171e-01 4.14163e+02 87.951  2.13212e+00  5.95895e+01  0.00000e+00 0.00000e+00 5.68340e+02 87.951  1.54177e+02 87.951  0.9916 
1 1 1 8   5   11 o 6  8.45373e+00 1.43807e+00 1.16857e+02 247.661 -2.33434e+00 -5.68080e+00 0.00000e+00 0.00000e+00 1.75010e+02 247.661 5.81526e+01 247.661 0.9145 
1 1 1 8   5   12 o 14 1.27269e+01 1.30988e+00 1.81124e+02 349.111 1.77155e+01  -3.40799e+00 0.00000e+00 0.00000e+00 2.85663e+02 349.111 1.04540e+02 349.111 0.9719 
1 1 1 8   5   13 o 15 8.22148e+00 1.85674e+00 1.85112e+02 139.144 -8.43204e+00 7.29276e+00  0.00000e+00 0.00000e+00 1.10763e+02 139.144 7.43487e+01 319.144 0.9540 
1 1 1 8   5   14 o 4  6.73901e+00 1.93125e+00 1.88992e+02 38.367  7.51931e+00  5.95276e+00  0.00000e+00 0.00000e+00 5.14523e+01 38.367  1.37540e+02 218.367 0.9463 
1 1 1 8   5   15 o 2  5.80528e+00 1.92632e+00 1.25770e+02 251.229 -1.98246e+00 -5.83328e+00 0.00000e+00 0.00000e+00 7.43424e+01 251.229 5.14275e+01 71.229  0.9148 
1 1 1 8   6   0  o 3  1.46031e+01 5.29325e-01 1.11069e+02 80.878  3.38121e-01  2.10582e+00  0.00000e+00 0.00000e+00 2.85054e+02 80.878  1.73985e+02 80.878  0.7184 
1 1 1 8   6   1  o 7  1.75040e+01 6.49821e-01 3.46668e+02 321.753 5.67163e+00  -4.47061e+00 0.00000e+00 0.00000e+00 2.66791e+02 321.753 7.98771e+01 141.753 0.9279 
1 1 1 8   6   2  o 3  3.25399e+01 7.30581e-01 5.85111e+02 231.180 -1.45898e+01 -1.81329e+01 0.00000e+00 0.00000e+00 6.17465e+02 231.180 3.23543e+01 231.180 0.9783 
1 1 1 8   6   3  o 2  4.41081e+01 9.25510e-01 9.75724e+02 76.003  1.36663e+01  5.48246e+01  0.00000e+00 0.00000e+00 6.76047e+02 76.003  2.99677e+02 256.003 0.9911 
1 1 1 8   6   4  o 3  2.92832e+01 8.24176e-01 4.62006e+02 216.591 -1.67312e+01 -1.24216e+01 0.00000e+00 0.00000e+00 6.17666e+02 216.591 1.55659e+02 216.591 0.9757 
1 1 1 8   6   5  o 15 1.27209e+01 6.68519e-01 2.04055e+02 200.354 -4.19095e+00 -1.55478e+00 0.00000e+00 0.00000e+00 2.18713e+02 200.354 1.46581e+01 200.354 0.8794 
1 1 1 8   6   6  o 4  2.62867e+01 7.21001e-01 2.07635e+02 95.270  -1.10878e+00 1.20213e+01  0.00000e+00 0.00000e+00 7.43648e+02 95.270  5.36013e+02 95.270  0.9576 
1 1 1 8   6   7  o 16 1.72961e+01 7.32910e-01 3.41016e+02 216.852 -1.28616e+01 -9.64000e+00 0.00000e+00 0.00000e+00 2.91876e+02 216.852 4.91402e+01 36.852  0.9684 
1 1 1 8   6   8  o 17 1.02574e+01 1.05702e+00 7.86124e+01 205.922 -2.22216e+00 -1.08006e+00 0.00000e+00 0.00000e+00 2.16607e+02 205.922 1.37995e+02 205.922 0.7618 
1 1 1 8   6   9  o 17 1.29507e+01 1.04413e+00 2.85112e+02 105.735 -4.16287e+00 1.47751e+01  0.00000e+00 0.00000e+00 1.87875e+02 105.735 9.72370e+01 285.735 0.9669 
1 1 1 8   6   10 o 1  8.90797e+00 1.34549e+00 2.31982e+02 267.449 -4.59542e-01 -1.03140e+01 0.00000e+00 0.00000e+00 8.76890e+01 267.449 1.44293e+02 87.449  0.9503 
1 1 1 8   6   11 o 12 5.35957e+00 1.52027e+00 6.00204e+01 75.842  4.75464e-01  1.88478e+00  0.00000e+00 0.00000e+00 7.92535e+01 75.842  1.92331e+01 75.842  0.6883 
1 1 1 8   6   12 o 5  9.23505e+00 1.75293e+00 1.19784e+02 56.042  4.02788e+00  5.98106e+00  0.00000e+00 0.00000e+00 2.03570e+02 56.042  8.37857e+01 56.042  0.9278 
1 1 1 8   6   13 o 3  1.32943e+01 1.71403e+00 2.65790e+02 277.742 3.75016e+00  -2.75861e+01 0.00000e+00 0.00000e+00 2.26598e+02 277.742 3.91923e+01 97.742  0.9819 
1 1 1 8   6   14 o 10 5.76269e+00 1.73844e+00 8.28678e+01 252.523 -1.20034e+00 -3.81221e+00 0.00000e+00 0.00000e+00 1.04720e+02 252.523 2.18519e+01 252.523 0.8634 
1 1 1 8   6   15 o 11 7.00664e+00 2.19280e+00 6.42484e+01 40.583  2.45600e+00  2.10381e+00  0.00000e+00 0.00000e+00 1.53802e+02 40.583  8.95532e+01 40.583  0.8259 
1 1 1 8   7   0  o 11 3.01814e+01 6.80164e-01 5.77076e+02 343.306 2.18001e+01  -6.53765e+00 0.00000e+00 0.00000e+00 5.37169e+02 343.306 3.99078e+01 163.306 0.9778 
1 1 1 8   7   1  o 19 3.35288e+01 8.58412e-01 8.14318e+02 58.547  1.68074e+01  2.74773e+01  0.00000e+00 0.00000e+00 4.32193e+02 58.547  3.82125e+02 238.547 0.9844 
1 1 1 8   7   2  o 19 2.52170e+01 7.35313e-01 4.62090e+02 118.168 -7.17979e+00 1.34084e+01  0.00000e+00 0.00000e+00 4.58664e+02 118.168 3.42623e+00 298.168 0.9665 
1 1 1 8   7   3  o 3  2.60490e+01 7.61147e-01 5.05542e+02 329.242 1.49404e+01  -8.89142e+00 0.00000e+00 0.00000e+00 4.49939e+02 329.242 5.56033e+01 149.242 0.9708 
1 1 1 8   7   4  o 8  3.53000e+01 7.93773e-01 5.69729e+02 162.874 -2.96118e+01 9.12450e+00  0.00000e+00 0.00000e+00 7.42466e+02 162.874 1.72737e+02 162.874 0.9837 
1 1 1 8   7   5  f 0  2.29199e+01 6.63568e-01 4.16106e+02 211.701 -1.39686e+01 -8.62747e+00 0.00000e+00 0.00000e+00 4.23216e+02 211.701 7.11034e+00 211.701 0.9691 
1 1 1 8   7   6  o 10 1.91320e+01 7.80303e-01 3.19896e+02 293.659 5.40833e+00  -1.23448e+01 0.00000e+00 0.00000e+00 3.75719e+02 293.659 5.58234e+01 293.659 0.9622 
1 1 1 8   7   7  o 7  2.76180e+01 8.76841e-01 4.45111e+02 128.538 -2.11325e+01 2.65314e+01  0.00000e+00 0.00000e+00 5.82960e+02 128.538 1.37848e+02 128.538 0.9851 
1 1 1 8   7   8  f 0  4.35615e+01 9.68137e-01 7.06483e+02 356.268 9.82528e+01  -6.40846e+00 0.00000e+00 0.00000e+00 9.30926e+02 356.268 2.24442e+02 356.268 0.9949 
1 1 1 8   7   9  o 6  1.14045e+01 1.09622e+00 1.19351e+02 193.334 -5.45528e+00 -1.29300e+00 0.00000e+00 0.00000e+00 2.70845e+02 193.334 1.51494e+02 193.334 0.9058 
1 1 1 8   7   10 o 13 1.60770e+01 9.67686e-01 2.04502e+02 318.515 1.34045e+01  -1.18530e+01 0.00000e+00 0.00000e+00 3.85408e+02 318.515 1.80906e+02 318.515 0.9716 
1 1 1 8   7   11 f 0  1.22727e+01 1.21609e+00 3.90334e+02 132.690 -2.16767e+01 2.34992e+01  0.00000e+00 0.00000e+00 6.56762e+01 132.690 3.24658e+02 312.690 0.9842 
1 1 1 8   7   12 o 3  4.26109e+00 1.38525e+00 1.14985e+02 13.255  3.62200e+00  8.53230e-01  0.00000e+00 0.00000e+00 2.19979e+01 13.255  9.29869e+01 193.255 0.8519 
1 1 1 8   7   13 o 14 8.62742e+00 1.81811e+00 4.63832e+01 170.076 -2.94431e+00 5.15144e-01  0.00000e+00 0.00000e+00 2.16946e+02 170.076 1.70563e+02 170.076 0.8092 
1 1 1 8   7   14 o 11 1.45675e+01 2.02421e+00 2.95939e+02 342.815 3.03557e+01  -9.38799e+00 0.00000e+00 0.00000e+00 2.44567e+02 342.815 5.13722e+01 162.815 0.9841 
1 1 1 8   7   15 o 5  6.96385e+00 2.20443e+00 1.73017e+02 34.501  7.08325e+00  4.86843e+00  0.00000e+00 0.00000e+00 7.36103e+01 34.501  9.94069e+01 214.501 0.9399 
1 1 1 8   8   0  o 16 2.77879e+01 6.48569e-01 5.91304e+02 324.012 1.73565e+01  -1.26046e+01 0.00000e+00 0.00000e+00 4.33115e+02 324.012 1.58189e+02 144.012 0.9764 
1 1 1 8   8   1  o 16 3.24162e+01 8.38828e-01 7.88698e+02 291.556 1.10679e+01  -2.80176e+01 0.00000e+00 0.00000e+00 4.15088e+02 291.556 3.73610e+02 111.556 0.9833 
1 1 1 8   8   2  o 12 1.08641e+01 7.09529e-01 3.62970e+02 122.901 -2.79419e+00 4.31893e+00  0.00000e+00 0.00000e+00 5.00668e+00 122.901 3.57963e+02 302.901 0.8966 
1 1 1 8   8   3  o 7  5.35504e+01 1.09026e+00 9.35720e+02 61.980  3.05686e+01  5.74423e+01  0.00000e+00 0.00000e+00 1.07195e+03 61.980  1.36228e+02 61.980  0.9923 
1 1 1 8   8   4  o 11 2.24708e+01 6.37106e-01 3.94162e+02 272.096 5.01819e-01  -1.37087e+01 0.00000e+00 0.00000e+00 4.23376e+02 272.096 2.92141e+01 272.096 0.9628 
1 1 1 8   8   5  o 4  1.42634e+01 6.53665e-01 3.58056e+02 63.231  3.95903e+00  7.84825e+00  0.00000e+00 0.00000e+00 1.49283e+02 63.231  2.08773e+02 243.231 0.9413 
1 1 1 8   8   6  o 10 2.47992e+01 6.97230e-01 5.61080e+02 320.244 2.36581e+01  -1.96802e+01 0.00000e+00 0.00000e+00 3.60677e+02 320.244 2.00403e+02 140.244 0.9836 
1 1 1 8   8   7  o 18 1.94897e+01 7.28287e-01 2.69799e+02 119.620 -7.25589e+00 1.27621e+01  0.00000e+00 0.00000e+00 4.41082e+02 119.620 1.71283e+02 119.620 0.9653 
1 1 1 8   8   8  o 17 1.99162e+01 8.47289e-01 3.21502e+02 202.777 -1.91273e+01 -8.03125e+00 0.00000e+00 0.00000e+00 4.12566e+02 202.777 9.10634e+01 202.777 0.9756 
1 1 1 8   8   9  o 7  1.31920e+01 1.04346e+00 2.60848e+02 4.108   1.49143e+01  1.07108e+00  0.00000e+00 0.00000e+00 2.20486e+02 4.108   4.03616e+01 184.108 0.9660 
1 1 1 8   8   10 o 14 1.43886e+01 1.03994e+00 3.28944e+02 227.593 -1.71075e+01 -1.87304e+01 0.00000e+00 0.00000e+00 2.03591e+02 227.593 1.25352e+02 47.593  0.9801 
1 1 1 8   8   11 o 18 1.23143e+01 1.38738e+00 1.92254e+02 296.195 6.60047e+00  -1.34170e+01 0.00000e+00 0.00000e+00 2.56795e+02 296.195 6.45410e+01 296.195 0.9660 
1 1 1 8   8   12 o 19 8.90853e+00 1.81479e+00 1.69162e+02 253.887 -2.65302e+00 -9.18402e+00 0.00000e+00 0.00000e+00 1.48912e+02 253.887 2.02498e+01 73.887  0.9462 
1 1 1 8   8   13 o 18 8.19829e+00 1.53669e+00 1.03765e+02 326.839 6.13395e+00  -4.00804e+00 0.00000e+00 0.00000e+00 1.83522e+02 326.839 7.97564e+01 326.839 0.9290 
1 1 1 8   8   14 o 1  4.94369e+00 1.71308e+00 8.48806e+01 140.587 -2.84938e+00 2.34156e+00  0.00000e+00 0.00000e+00 7.36100e+01 140.587 1.12706e+01 320.587 0.8504 
1 1 1 8   8   15 o 14 8.81088e+00 2.17890e+00 1.27964e+02 281.920 1.68639e+00  -7.98862e+00 0.00000e+00 0.00000e+00 1.82977e+02 281.920 5.50130e+01 281.920 0.9366 
1 1 1 8   9   0  o 10 3.33152e+01 7.32605e-01 7.41002e+02 212.984 -2.46461e+01 -1.59959e+01 0.00000e+00 0.00000e+00 4.95239e+02 212.984 2.45763e+02 32.984  0.9828 
1 1 1 8   9   1  o 9  2.89977e+01 6.81493e-01 6.22139e+02 106.600 -6.09195e+00 2.04348e+01  0.00000e+00 0.00000e+00 4.47012e+02 106.600 1.75127e+02 286.600 0.9763 
1 1 1 8   9   2  o 11 1.92904e+01 6.68786e-01 3.10546e+02 31.780  6.64089e+00  4.11430e+00  0.00000e+00 0.00000e+00 3.69777e+02 31.780  5.92312e+01 31.780  0.9336 
1 1 1 8   9   3  o 7  1.55523e+01 6.08117e-01 5.42857e+02 218.695 -8.71784e+00 -6.98302e+00 0.00000e+00 0.00000e+00 1.77814e+01 218.695 5.25075e+02 38.695  0.9541 
1 1 1 8   9   4  o 6  4.87228e+01 1.01236e+00 8.68355e+02 83.139  7.67722e+00  6.38091e+01  0.00000e+00 0.00000e+00 9.58299e+02 83.139  8.99435e+01 83.139  0.9922 
1 1 1 8   9   5  o 6  3.93292e+01 8.30731e-01 7.15239e+02 289.145 1.57339e+01  -4.53209e+01 0.00000e+00 0.00000e+00 7.55348e+02 289.145 4.01090e+01 289.145 0.9895 
1 1 1 8   9   6  o 6  2.42228e+01 6.85290e-01 4.83185e+02 175.699 -2.85552e+01 2.14760e+00  0.00000e+00 0.00000e+00 4.15999e+02 175.699 6.71863e+01 355.699 0.9824 
1 1 1 8   9   7  o 19 1.73169e+01 7.25055e-01 2.44984e+02 264.672 -1.09908e+00 -1.17862e+01 0.00000e+00 0.00000e+00 3.81045e+02 264.672 1.36061e+02 264.672 0.9568 
1 1 1 8   9   8  o 18 6.82721e+00 1.31278e+00 2.76974e+02 75.087  1.48405e+00  5.57229e+00  0.00000e+00 0.00000e+00 4.26292e+01 255.087 3.19603e+02 255.087 0.9086 
1 1 1 8   9   9  o 4  1.58452e+01 8.96380e-01 3.30916e+02 138.042 -1.73337e+01 1.55845e+01  0.00000e+00 0.00000e+00 2.54602e+02 138.042 7.63140e+01 318.042 0.9783 
1 1 1 8   9   10 o 15 6.88641e+00 1.44947e+00 1.18882e+02 72.348  1.20545e+00  3.78802e+00  0.00000e+00 0.00000e+00 1.05423e+02 72.348  1.34585e+01 252.348 0.8626 
1 1 1 8   9   11 o 7  1.31300e+01 1.23419e+00 2.71879e+02 10.278  2.49673e+01  4.52735e+00  0.00000e+00 0.00000e+00 2.13910e+02 10.278  5.79685e+01 190.278 0.9801 
1 1 1 8   9   12 o 11 9.06204e+00 1.82024e+00 2.78263e+02 124.844 -9.13079e+00 1.31161e+01  0.00000e+00 0.00000e+00 5.28198e+01 124.844 2.25444e+02 304.844 0.9682 
1 1 1 8   9   13 o 4  7.00189e+00 1.76631e+00 9.82825e+01 45.268  3.71319e+00  3.74807e+00  0.00000e+00 0.00000e+00 1.39256e+02 45.268  4.09730e+01 45.268  0.8994 
1 1 1 8   9   14 o 1  1.12651e+01 2.08125e+00 1.89941e+02 250.156 -5.18333e+00 -1.43624e+01 0.00000e+00 0.00000e+00 2.20601e+02 250.156 3.06590e+01 250.156 0.9667 
1 1 1 8   9   15 o 2  6.41885e+00 2.12879e+00 1.01523e+02 254.774 -1.27675e+00 -4.69084e+00 0.00000e+00 0.00000e+00 1.13743e+02 254.774 1.22201e+01 254.774 0.8901 
1 1 1 8   10  0  o 12 3.39161e+01 7.41031e-01 8.39652e+02 110.305 -1.17282e+01 3.16961e+01  0.00000e+00 0.00000e+00 4.21748e+02 110.305 4.17904e+02 290.305 0.9851 
1 1 1 8   10  1  o 15 2.24687e+01 5.92198e-01 5.82045e+02 315.232 1.14788e+01  -1.13863e+01 0.00000e+00 0.00000e+00 2.39826e+02 315.232 3.42218e+02 135.232 0.9686 
1 1 1 8   10  2  o 15 3.70961e+01 9.35107e-01 6.71564e+02 42.133  2.37980e+01  2.15283e+01  0.00000e+00 0.00000e+00 7.07707e+02 42.133  3.61428e+01 42.133  0.9843 
1 1 1 8   10  3  f 0  2.61855e+01 7.48773e-01 4.58590e+02 255.329 -3.99756e+00 -1.52688e+01 0.00000e+00 0.00000e+00 4.98848e+02 255.329 4.02580e+01 255.329 0.9678 
1 1 1 8   10  4  f 0  2.19817e+01 7.44023e-01 4.40383e+02 181.909 -1.82843e+01 -6.09324e-01 0.00000e+00 0.00000e+00 3.67164e+02 181.909 7.32187e+01 1.909   0.9723 
1 1 1 8   10  5  o 19 1.87643e+01 6.31142e-01 2.82618e+02 269.418 -9.26020e-02 -9.12298e+00 0.00000e+00 0.00000e+00 3.86355e+02 269.418 1.03737e+02 269.418 0.9435 
1 1 1 8   10  6  o 17 6.96214e+00 1.00723e+00 1.55950e+02 110.217 -8.94407e-01 2.42873e+00  0.00000e+00 0.00000e+00 4.77362e+01 110.217 1.08213e+02 290.217 0.7743 
1 1 1 8   10  7  o 4  7.10926e+00 1.21939e+00 3.07048e+02 59.927  2.90246e+00  5.01238e+00  0.00000e+00 0.00000e+00 6.28795e+01 239.927 3.69927e+02 239.927 0.9090 
1 1 1 8   10  8  o 9  4.00148e+00 1.19263e+00 1.34701e+02 280.814 3.13553e-01  -1.64147e+00 0.00000e+00 0.00000e+00 3.86056e+01 100.814 1.73307e+02 100.814 0.6357 
1 1 1 8   10  9  o 13 3.49479e+01 8.94215e-01 7.27115e+02 239.539 -5.72286e+01 -9.73048e+01 0.00000e+00 0.00000e+00 5.87032e+02 239.539 1.40082e+02 59.539  0.9956 
1 1 1 8   10  10 o 19 1.25470e+01 1.10150e+00 1.58896e+02 292.026 4.19498e+00  -1.03694e+01 0.00000e+00 0.00000e+00 2.93189e+02 292.026 1.34293e+02 292.026 0.9542 
1 1 1 8   10  11 o 16 6.30374e+00 1.57267e+00 1.19088e+02 136.063 -3.40577e+00 3.28171e+00  0.00000e+00 0.00000e+00 9.19123e+01 136.063 2.71761e+01 316.063 0.8867 
1 1 1 8   10  12 o 14 6.35561e+00 1.60832e+00 5.88332e+01 122.903 -1.40916e+00 2.17793e+00  0.00000e+00 0.00000e+00 1.26997e+02 122.903 6.81637e+01 122.903 0.7749 
1 1 1 8   10  13 o 19 7.44869e+00 1.83519e+00 1.85800e+02 4.011   1.04913e+01  7.35562e-01  0.00000e+00 0.00000e+00 8.14388e+01 4.011   1.04362e+02 184.011 0.9512 
1 1 1 8   10  14 o 6  4.81825e+00 1.67656e+00 7.63166e+01 160.519 -3.10932e+00 1.09989e+00  0.00000e+00 0.00000e+00 7.44146e+01 160.519 1.90204e+00 340.519 0.8298 
1 1 1 8   10  15 o 11 6.21616e+00 2.07153e+00 7.83689e+01 152.919 -3.34837e+00 1.71207e+00  0.00000e+00 0.00000e+00 1.21564e+02 152.919 4.31953e+01 152.919 0.8536 
1 1 1 8   11  0  o 19 2.57045e+01 6.26575e-01 3.39949e+02 109.701 -3.49841e+00 9.76991e+00  0.00000e+00 0.00000e+00 5.82472e+02 109.701 2.42523e+02 109.701 0.9505 
1 1 1 8   11  1  o 13 2.31985e+01 5.93463e-01 3.52433e+02 88.415  2.78954e-01  1.00791e+01  0.00000e+00 0.00000e+00 4.78998e+02 88.415  1.26565e+02 88.415  0.9490 
1 1 1 8   11  2  o 3  3.26314e+01 8.78303e-01 6.58926e+02 304.136 1.55511e+01  -2.29375e+01 0.00000e+00 0.00000e+00 5.51221e+02 304.136 1.07705e+02 124.136 0.9818 
1 1 1 8   11  3  o 6  3.27192e+01 7.47638e-01 5.12513e+02 46.516  1.56831e+01  1.65358e+01  0.00000e+00 0.00000e+00 6.96178e+02 46.516  1.83665e+02 46.516  0.9778 
1 1 1 8   11  4  o 3  1.17615e+01 7.16201e-01 2.13240e+02 255.422 -1.19242e+00 -4.58513e+00 0.00000e+00 0.00000e+00 1.80901e+02 255.422 3.23389e+01 75.422  0.8869 
1 1 1 8   11  5  o 17 3.98754e+01 8.38249e-01 7.70072e+02 9.754   6.29787e+01  1.08263e+01  0.00000e+00 0.00000e+00 7.24807e+02 9.754   4.52646e+01 189.754 0.9921 
1 1 1 8   11  6  o 7  1.43604e+01 6.96651e-01 3.39736e+02 79.032  2.26387e+00  1.16811e+01  0.00000e+00 0.00000e+00 1.79544e+02 79.032  1.60192e+02 259.032 0.9570 
1 1 1 8   11  7  o 4  2.41654e+01 8.24927e-01 1.82785e+02 234.115 -7.15232e+00 -9.88584e+00 0.00000e+00 0.00000e+00 6.91987e+02 234.115 5.09202e+02 234.115 0.9581 
1 1 1 8   11  8  o 10 4.21738e+01 9.50924e-01 6.11296e+02 181.494 -8.23176e+01 -2.14668e+00 0.00000e+00 0.00000e+00 9.72204e+02 181.494 3.60907e+02 181.494 0.9939 
1 1 1 8   11  9  o 7  1.46030e+01 9.40890e-01 3.71160e+02 266.382 -1.50681e+00 -2.38320e+01 0.00000e+00 0.00000e+00 1.68715e+02 266.382 2.02445e+02 86.382  0.9788 
1 1 1 8   11  10 o 6  9.71293e+00 1.28416e+00 1.06397e+02 183.900 -5.52476e+00 -3.76631e-01 0.00000e+00 0.00000e+00 2.25343e+02 183.900 1.18946e+02 183.900 0.9045 
1 1 1 8   11  11 o 10 4.24150e+00 1.34093e+00 2.33611e+01 187.477 -6.72428e-01 -8.82563e-02 0.00000e+00 0.00000e+00 2.80313e+01 187.477 4.67017e+00 187.477 0.3210 
1 1 1 8   11  12 o 3  1.10363e+01 1.68338e+00 1.83440e+02 9.349   1.34175e+01  2.20901e+00  0.00000e+00 0.00000e+00 2.17382e+02 9.349   3.39412e+01 9.349   0.9625 
1 1 1 8   11  13 o 11 5.16651e+00 1.55273e+00 1.58665e+02 119.371 -3.53965e+00 6.28931e+00  0.00000e+00 0.00000e+00 2.21454e+01 119.371 1.36520e+02 299.371 0.9279 
1 1 1 8   11  14 o 14 5.28430e+00 1.79842e+00 4.41894e+01 138.137 -1.45525e+00 1.30404e+00  0.00000e+00 0.00000e+00 9.32795e+01 138.137 4.90901e+01 138.137 0.6901 
1 1 1 8   11  15 o 1  4.64984e+00 1.64106e+00 9.05936e+01 307.763 2.47342e+00  -3.19302e+00 0.00000e+00 0.00000e+00 6.09469e+01 307.763 2.96467e+01 127.763 0.8650 
1 1 1 8   12  0  o 7  3.29396e+01 7.30719e-01 8.05677e+02 20.877  2.92669e+01  1.11625e+01  0.00000e+00 0.00000e+00 4.17855e+02 20.877  3.87821e+02 200.877 0.9839 
1 1 1 8   12  1  o 18 4.64541e+01 9.54250e-01 9.82623e+02 72.290  1.68616e+01  5.28024e+01  0.00000e+00 0.00000e+00 7.55743e+02 72.290  2.26880e+02 252.290 0.9909 
1 1 1 8   12  2  o 5  2.13950e+01 7.08853e-01 5.58789e+02 16.647  1.46782e+01  4.38887e+00  0.00000e+00 0.00000e+00 2.22507e+02 16.647  3.36282e+02 196.647 0.9668 
1 1 1 8   12  3  o 7  2.35624e+01 7.06082e-01 3.94571e+02 228.837 -8.31287e+00 -9.50813e+00 0.00000e+00 0.00000e+00 4.59578e+02 228.837 6.50066e+01 228.837 0.9596 
1 1 1 8   12  4  o 19 1.31633e+01 7.73337e-01 2.89899e+02 77.646  1.53445e+00  7.00592e+00  0.00000e+00 0.00000e+00 1.71339e+02 77.646  1.18560e+02 257.646 0.9274 
1 1 1 8   12  5  o 10 3.52532e+01 8.11617e-01 6.04240e+02 350.751 4.37595e+01  -7.12571e+00 0.00000e+00 0.00000e+00 7.12670e+02 350.751 1.08429e+02 350.751 0.9887 
1 1 1 8   12  6  o 1  1.64068e+01 6.80326e-01 1.98035e+02 193.478 -7.70308e+00 -1.84628e+00 0.00000e+00 0.00000e+00 3.81313e+02 193.478 1.83278e+02 193.478 0.9346 
1 1 1 8   12  7  o 6  2.14957e+01 7.24575e-01 3.61859e+02 216.763 -1.87431e+01 -1.40027e+01 0.00000e+00 0.00000e+00 4.32719e+02 216.763 7.08601e+01 216.763 0.9784 
1 1 1 8   12  8  o 13 2.09702e+01 8.18084e-01 3.86482e+02 162.273 -2.70316e+01 8.64083e+00  0.00000e+00 0.00000e+00 3.91603e+02 162.273 5.12104e+00 162.273 0.9822 
1 1 1 8   12  9  o 1  2.21673e+01 8.45421e-01 4.40048e+02 2.582   4.34976e+01  1.96124e+00  0.00000e+00 0.00000e+00 3.87507e+02 2.582   5.25408e+01 182.582 0.9884 
1 1 1 8   12  10 o 1  5.05328e+00 1.39226e+00 1.89607e+02 200.857 -4.65694e+00 -1.77429e+00 0.00000e+00 0.00000e+00 1.92177e+01 20.857  2.08824e+02 20.857  0.8930 
1 1 1 8   12  11 f 0  1.80537e+01 1.05463e+00 2.62996e+02 133.473 -2.45077e+01 2.58505e+01  0.00000e+00 0.00000e+00 4.08836e+02 133.473 1.45841e+02 133.473 0.9859 
1 1 1 8   12  12 o 11 9.06169e+00 1.73137e+00 1.55662e+02 76.966  2.09212e+00  9.03758e+00  0.00000e+00 0.00000e+00 1.67266e+02 76.966  1.16043e+01 76.966  0.9445 
1 1 1 8   12  13 o 4  7.22400e+00 1.86479e+00 1.50041e+02 167.395 -7.90907e+00 1.76864e+00  0.00000e+00 0.00000e+00 1.05008e+02 167.395 4.50333e+01 347.395 0.9361 
1 1 1 8   12  14 o 10 6.85648e+00 2.05989e+00 8.54283e+01 269.198 -5.84852e-02 -4.17947e+00 0.00000e+00 0.00000e+00 1.39464e+02 269.198 5.40353e+01 269.198 0.8701 
1 1 1 8   13  0  o 6  1.77056e+01 5.50509e-01 6.90505e+02 205.323 -1.36691e+01 -6.46822e+00 0.00000e+00 0.00000e+00 4.45925e+01 25.324  7.35098e+02 25.324  0.9663 
1 1 1 8   13  1  o 10 1.04055e+01 5.61212e-01 3.80470e+02 271.587 1.34582e-01  -4.85880e+00 0.00000e+00 0.00000e+00 3.07410e+01 91.587  4.11211e+02 91.587  0.8900 
1 1 1 8   13  2  o 15 1.76655e+01 6.45907e-01 1.60692e+02 134.052 -2.52799e+00 2.61302e+00  0.00000e+00 0.00000e+00 4.05055e+02 134.052 2.44363e+02 134.052 0.8479 
1 1 1 8   13  3  o 5  1.68249e+01 5.63724e-01 2.72812e+02 85.913  4.45530e-01  6.23527e+00  0.00000e+00 0.00000e+00 3.09454e+02 85.913  3.66418e+01 85.913  0.9161 
1 1 1 8   13  4  o 11 3.90921e+01 1.01229e+00 4.29743e+02 79.637  5.58278e+00  3.05301e+01  0.00000e+00 0.00000e+00 1.02322e+03 79.637  5.93472e+02 79.637  0.9838 
1 1 1 8   13  5  o 8  2.83374e+01 6.93896e-01 3.43697e+02 290.574 7.16157e+00  -1.90793e+01 0.00000e+00 0.00000e+00 7.00370e+02 290.574 3.56673e+02 290.574 0.9751 
1 1 1 8   13  6  o 1  6.51864e+00 1.08035e+00 1.63797e+02 172.773 -2.46898e+00 3.13103e-01  0.00000e+00 0.00000e+00 2.43123e+01 172.773 1.39484e+02 352.773 0.7638 
1 1 1 8   13  7  o 19 2.72726e+01 7.59856e-01 5.03934e+02 345.935 3.99201e+01  -1.00010e+01 0.00000e+00 0.00000e+00 5.13820e+02 345.935 9.88526e+00 345.935 0.9878 
1 1 1 8   13  8  o 6  2.80790e+01 8.14058e-01 4.00123e+02 77.468  8.52777e+00  3.83655e+01  0.00000e+00 0.00000e+00 6.46970e+02 77.468  2.46848e+02 77.468  0.9872 
1 1 1 8   13  9  o 5  1.59743e+01 8.80316e-01 2.20149e+02 31.545  1.40474e+01  8.62331e+00  0.00000e+00 0.00000e+00 3.64557e+02 31.545  1.44408e+02 31.545  0.9692 
1 1 1 8   13  10 f 0  1.10460e+01 1.20303e+00 2.08528e+02 234.629 -7.27888e+00 -1.02533e+01 0.00000e+00 0.00000e+00 1.91596e+02 234.629 1.69318e+01 54.629  0.9594 
1 1 1 8   13  11 o 19 1.49565e+01 1.21819e+00 3.06188e+02 166.686 -3.02889e+01 7.16772e+00  0.00000e+00 0.00000e+00 2.49208e+02 166.686 5.69792e+01 346.686 0.9838 
1 1 1 8   13  12 f 0  5.29545e+00 1.59554e+00 1.90237e+02 95.684  -7.48110e-01 7.51635e+00  0.00000e+00 0.00000e+00 4.17374e+00 275.684 1.94411e+02 275.684 0.9312 
1 1 1 8   13  13 f 0  1.80029e+01 1.29176e+00 1.44768e+02 337.975 2.42380e+01  -9.80484e+00 0.00000e+00 0.00000e+00 5.21085e+02 337.975 3.76317e+02 337.975 0.9807 
1 1 1 8   13  14 f 0  6.11635e+00 1.93980e+00 9.13570e+01 201.727 -3.95896e+00 -1.57766e+00 0.00000e+00 0.00000e+00 1.09893e+02 201.727 1.85364e+01 201.727 0.8729 
1 1 1 8   14  0  f 0  5.04332e+01 1.18895e+00 1.26076e+03 336.646 7.01660e+01  -3.02970e+01 0.00000e+00 0.00000e+00 6.30576e+02 336.646 6.30187e+02 156.646 0.9934 
1 1 1 8   14  1  o 14 1.78529e+01 5.52586e-01 4.30417e+02 171.361 -9.95308e+00 1.51217e+00  0.00000e+00 0.00000e+00 2.09310e+02 171.361 2.21107e+02 351.361 0.9490 
1 1 1 8   14  2  o 16 2.73727e+01 6.33020e-01 5.20358e+02 56.155  1.01365e+01  1.51163e+01  0.00000e+00 0.00000e+00 4.84675e+02 56.155  3.56834e+01 236.155 0.9721 
1 1 1 8   14  3  f 0  2.13787e+01 6.82646e-01 1.34219e+02 96.802  -5.41810e-01 4.54255e+00  0.00000e+00 0.00000e+00 5.78474e+02 96.802  4.44255e+02 96.802  0.8825 
1 1 1 8   14  5  o 7  4.12125e+01 8.63139e-01 5.41312e+02 186.969 -4.57752e+01 -5.59532e+00 0.00000e+00 0.00000e+00 9.98790e+02 186.969 4.57478e+02 186.969 0.9891 
1 1 1 8   14  6  o 5  2.30601e+01 6.86904e-01 3.29296e+02 220.372 -1.38936e+01 -1.18127e+01 0.00000e+00 0.00000e+00 5.17707e+02 220.372 1.88411e+02 220.372 0.9722 
1 1 1 8   14  7  o 14 5.38245e+01 1.08218e+00 8.59099e+02 181.003 -1.33735e+02 -2.34231e+00 0.00000e+00 0.00000e+00 1.16668e+03 181.003 3.07586e+02 181.003 0.9963 
1 1 1 8   14  8  o 14 2.95746e+01 8.33560e-01 4.67726e+02 298.803 2.32294e+01  -4.22482e+01 0.00000e+00 0.00000e+00 6.37753e+02 298.803 1.70027e+02 298.803 0.9896 
1 1 1 8   14  9  o 2  9.84459e+00 1.19282e+00 2.21101e+02 135.790 -6.90942e+00 6.72141e+00  0.00000e+00 0.00000e+00 1.30839e+02 135.790 9.02622e+01 315.790 0.9466 
1 1 1 8   14  10 o 11 9.80476e+00 1.28832e+00 2.52785e+02 175.560 -1.34494e+01 1.04430e+00  0.00000e+00 0.00000e+00 1.03407e+02 175.560 1.49378e+02 355.560 0.9622 
1 1 1 8   14  11 o 8  1.37060e+01 1.31092e+00 2.90946e+02 106.526 -7.47690e+00 2.51997e+01  0.00000e+00 0.00000e+00 2.16435e+02 106.526 7.45113e+01 286.526 0.9808 
1 1 1 8   14  12 o 18 1.31625e+01 1.48819e+00 2.07615e+02 7.792   2.12841e+01  2.91244e+00  0.00000e+00 0.00000e+00 2.77301e+02 7.792   6.96861e+01 7.792   0.9764 
1 1 1 8   14  13 o 9  5.87623e+00 1.70441e+00 1.30259e+02 206.379 -5.57008e+00 -2.76243e+00 0.00000e+00 0.00000e+00 7.26497e+01 206.379 5.76095e+01 26.379  0.9156 
1 1 1 8   14  14 o 7  1.20622e+01 2.23274e+00 1.78568e+02 129.895 -8.95970e+00 1.07178e+01  0.00000e+00 0.00000e+00 2.59515e+02 129.895 8.09471e+01 129.895 0.9635 
1 1 1 8   15  0  o 5  1.84141e+01 5.47989e-01 4.97343e+02 117.731 -5.23807e+00 9.96387e+00  0.00000e+00 0.00000e+00 1.66123e+02 117.731 3.31221e+02 297.731 0.9545 
1 1 1 8   15  1  o 19 1.35057e+01 5.32407e-01 2.14214e+02 162.785 -3.61211e+00 1.11916e+00  0.00000e+00 0.00000e+00 2.21580e+02 162.785 7.36626e+00 162.785 0.8546 
1 1 1 8   15  2  o 19 1.67161e+01 5.44718e-01 1.44195e+02 354.305 3.19343e+00  -3.18442e-01 0.00000e+00 0.00000e+00 3.76237e+02 354.305 2.32042e+02 354.305 0.8243 
1 1 1 8   15  3  o 15 1.96143e+01 5.75700e-01 2.98734e+02 64.883  3.96908e+00  8.46661e+00  0.00000e+00 0.00000e+00 4.01366e+02 64.883  1.02632e+02 64.883  0.9449 
1 1 1 8   15  4  o 17 1.25997e+01 1.11564e+00 2.13319e+02 248.613 -1.67795e+00 -4.28451e+00 0.00000e+00 0.00000e+00 2.07099e+02 248.613 6.21950e+00 68.613  0.8832 
1 1 1 8   15  5  o 16 3.91105e+01 8.37081e-01 6.68433e+02 129.889 -3.47092e+01 4.15282e+01  0.00000e+00 0.00000e+00 7.95456e+02 129.889 1.27023e+02 129.889 0.9907 
1 1 1 8   15  6  o 8  3.28560e+01 7.70262e-01 6.58760e+02 356.057 5.15072e+01  -3.54975e+00 0.00000e+00 0.00000e+00 5.70448e+02 356.057 8.83125e+01 176.057 0.9903 
1 1 1 8   15  7  o 4  3.75786e+01 8.55804e-01 5.72429e+02 80.124  1.04373e+01  5.99525e+01  0.00000e+00 0.00000e+00 8.35459e+02 80.124  2.63031e+02 80.124  0.9917 
1 1 1 8   15  8  o 18 1.21795e+01 9.82586e-01 2.16328e+02 280.589 1.61620e+00  -8.64505e+00 0.00000e+00 0.00000e+00 2.16711e+02 280.589 3.82973e-01 280.589 0.9413 
1 1 1 8   15  9  o 14 2.07828e+01 8.68669e-01 5.20118e+02 43.222  3.69072e+01  3.46843e+01  0.00000e+00 0.00000e+00 2.56943e+02 43.222  2.63175e+02 223.221 0.9901 
1 1 1 8   15  10 o 9  1.98890e+01 9.16092e-01 3.11178e+02 252.489 -1.10550e+01 -3.50390e+01 0.00000e+00 0.00000e+00 4.29432e+02 252.489 1.18254e+02 252.489 0.9863 
1 1 1 8   15  11 o 17 2.21312e+01 1.15964e+00 3.96097e+02 211.124 -5.18189e+01 -3.12890e+01 0.00000e+00 0.00000e+00 4.32261e+02 211.124 3.61643e+01 211.124 0.9917 
1 1 1 8   15  12 o 13 7.26208e+00 1.76937e+00 1.14686e+02 54.713  3.32774e+00  4.70215e+00  0.00000e+00 0.00000e+00 1.34221e+02 54.713  1.95347e+01 54.713  0.9085 
1 1 1 8   15  13 o 4  1.22037e+01 2.02654e+00 2.72653e+02 271.149 4.57714e-01  -2.28146e+01 0.00000e+00 0.00000e+00 1.77366e+02 271.149 9.52866e+01 91.149  0.9778 
1 1 1 8   15  14 o 6  7.64433e+00 2.14553e+00 2.55234e+02 132.729 -8.93567e+00 9.67352e+00  0.00000e+00 0.00000e+00 2.17350e+01 132.729 2.33498e+02 312.729 0.9612 
1 1 1 8   16  0  o 15 2.35742e+01 5.73734e-01 6.61315e+02 313.487 1.40525e+01  -1.48148e+01 0.00000e+00 0.00000e+00 2.06459e+02 313.487 4.54856e+02 133.487 0.9752 
1 1 1 8   16  1  o 7  2.32022e+01 5.82273e-01 5.11460e+02 246.550 -6.08518e+00 -1.40286e+01 0.00000e+00 0.00000e+00 3.35449e+02 246.550 1.76011e+02 66.550  0.9667 
1 1 1 8   16  2  o 7  3.63167e+01 7.61646e-01 7.96691e+02 332.528 3.38325e+01  -1.75906e+01 0.00000e+00 0.00000e+00 5.56749e+02 332.528 2.39942e+02 152.529 0.9868 
1 1 1 8   16  3  o 1  3.84120e+01 7.93105e-01 8.03381e+02 23.391  4.46545e+01  1.93157e+01  0.00000e+00 0.00000e+00 6.32554e+02 23.391  1.70828e+02 203.391 0.9897 
1 1 1 8   16  4  o 18 2.19215e+01 6.19547e-01 3.94405e+02 169.267 -1.49212e+01 2.82816e+00  0.00000e+00 0.00000e+00 4.05973e+02 169.267 1.15688e+01 169.267 0.9665 
1 1 1 8   16  5  o 9  3.78757e+01 8.16798e-01 6.88474e+02 49.093  3.53323e+01  4.07781e+01  0.00000e+00 0.00000e+00 7.29094e+02 49.093  4.06201e+01 49.093  0.9907 
1 1 1 8   16  6  o 17 3.65180e+01 8.57976e-01 6.25137e+02 211.075 -5.15796e+01 -3.10836e+01 0.00000e+00 0.00000e+00 7.42938e+02 211.075 1.17801e+02 211.075 0.9917 
1 1 1 8   16  7  o 15 1.33876e+01 8.42118e-01 2.38313e+02 267.132 -4.51336e-01 -9.00902e+00 0.00000e+00 0.00000e+00 2.38491e+02 267.132 1.77857e-01 267.132 0.9428 
1 1 1 8   16  8  o 1  2.64966e+01 8.17555e-01 4.29663e+02 200.686 -3.61808e+01 -1.36615e+01 0.00000e+00 0.00000e+00 5.58091e+02 200.686 1.28428e+02 200.686 0.9870 
1 1 1 8   16  9  o 13 2.12291e+01 8.59948e-01 2.90950e+02 149.907 -2.45358e+01 1.42187e+01  0.00000e+00 0.00000e+00 4.96455e+02 149.907 2.05505e+02 149.907 0.9822 
1 1 1 8   16  10 o 7  7.38999e+00 1.49036e+00 1.63134e+02 324.797 5.05803e+00  -3.56848e+00 0.00000e+00 0.00000e+00 9.22051e+01 324.797 7.09293e+01 144.797 0.9152 
1 1 1 8   16  11 o 15 1.33756e+01 1.39938e+00 2.56648e+02 66.984  9.20949e+00  2.16795e+01  0.00000e+00 0.00000e+00 2.37324e+02 66.984  1.93237e+01 246.984 0.9785 
1 1 1 8   16  12 o 10 4.33014e+00 1.39673e+00 4.32423e+01 247.051 -5.89268e-01 -1.39166e+00 0.00000e+00 0.00000e+00 5.45961e+01 247.051 1.13538e+01 247.051 0.5989 
1 1 1 8   16  13 f 0  5.40230e+00 1.73745e+00 1.37973e+02 239.186 -3.04618e+00 -5.10724e+00 0.00000e+00 0.00000e+00 4.77222e+01 239.186 9.02510e+01 59.186  0.9115 
1 1 1 8   16  14 o 5  1.17740e+01 2.53309e+00 1.41070e+02 85.458  7.21214e-01  9.07890e+00  0.00000e+00 0.00000e+00 2.77582e+02 85.458  1.36513e+02 85.458  0.9434 
1 1 1 8   17  0  o 12 1.43963e+01 7.82836e-01 3.59119e+02 68.694  2.43538e+00  6.24439e+00  0.00000e+00 0.00000e+00 1.41912e+02 68.694  2.17207e+02 248.694 0.9221 
1 1 1 8   17  1  o 9  4.06422e+01 9.20652e-01 6.32521e+02 324.050 2.63966e+01  -1.91433e+01 0.00000e+00 0.00000e+00 8.78242e+02 324.050 2.45721e+02 324.050 0.9845 
1 1 1 8   17  2  o 3  3.48665e+01 8.27196e-01 6.75393e+02 117.499 -1.42480e+01 2.73714e+01  0.00000e+00 0.00000e+00 6.19810e+02 117.499 5.55833e+01 297.499 0.9837 
1 1 1 8   17  3  o 7  1.58747e+01 5.65255e-01 3.88805e+02 238.954 -4.95439e+00 -8.23050e+00 0.00000e+00 0.00000e+00 1.78674e+02 238.954 2.10131e+02 58.954  0.9464 
1 1 1 8   17  4  o 12 2.59681e+01 6.61091e-01 4.81977e+02 188.303 -2.12195e+01 -3.09674e+00 0.00000e+00 0.00000e+00 4.75819e+02 188.303 6.15769e+00 8.303   0.9764 
1 1 1 8   17  5  o 11 3.77402e+01 8.13989e-01 7.88180e+02 241.270 -3.08662e+01 -5.63076e+01 0.00000e+00 0.00000e+00 6.26381e+02 241.270 1.61799e+02 61.270  0.9922 
1 1 1 8   17  6  o 3  2.25177e+01 6.90009e-01 5.00723e+02 63.179  1.35746e+01  2.68489e+01  0.00000e+00 0.00000e+00 3.35654e+02 63.179  1.65069e+02 243.179 0.9832 
1 1 1 8   17  7  o 4  2.24856e+01 7.26872e-01 4.67692e+02 306.916 1.79979e+01  -2.39566e+01 0.00000e+00 0.00000e+00 3.67372e+02 306.916 1.00320e+02 126.916 0.9832 
1 1 1 8   17  8  o 12 5.90807e+00 1.31779e+00 9.32198e+01 263.019 -2.12506e-01 -1.73562e+00 0.00000e+00 0.00000e+00 5.22342e+01 263.019 4.09857e+01 83.020  0.6519 
1 1 1 8   17  9  o 7  2.05117e+01 8.87655e-01 2.82135e+02 333.152 2.35635e+01  -1.19277e+01 0.00000e+00 0.00000e+00 4.77599e+02 333.152 1.95464e+02 333.152 0.9809 
1 1 1 8   17  10 o 11 1.14836e+01 1.16767e+00 2.06498e+02 23.485  1.32475e+01  5.75595e+00  0.00000e+00 0.00000e+00 2.11736e+02 23.485  5.23880e+00 23.485  0.9647 
1 1 1 8   17  11 o 8  1.96597e+01 1.15800e+00 3.76403e+02 163.238 -5.27795e+01 1.58968e+01  0.00000e+00 0.00000e+00 3.58777e+02 163.238 1.76256e+01 343.238 0.9909 
1 1 1 8   17  12 o 12 1.15510e+01 1.64509e+00 2.84937e+02 33.358  1.98846e+01  1.30907e+01  0.00000e+00 0.00000e+00 1.41571e+02 33.358  1.43366e+02 213.358 0.9788 
1 1 1 8   17  13 o 7  1.66315e+01 1.76264e+00 2.60603e+02 202.517 -3.04256e+01 -1.26133e+01 0.00000e+00 0.00000e+00 3.56946e+02 202.517 9.63435e+01 202.517 0.9847 
1 1 1 8   17  14 o 5  7.25103e+00 2.75925e+00 1.75135e+02 346.944 6.03535e+00  -1.39960e+00 0.00000e+00 0.00000e+00 7.50019e+01 346.944 1.00133e+02 166.944 0.9153 
1 1 1 8   18  0  o 2  2.73733e+01 6.16795e-01 3.58367e+02 298.956 6.11054e+00  -1.10438e+01 0.00000e+00 0.00000e+00 6.32971e+02 298.956 2.74604e+02 298.956 0.9595 
1 1 1 8   18  1  o 5  2.62646e+01 6.14528e-01 4.96918e+02 261.845 -2.36645e+00 -1.65147e+01 0.00000e+00 0.00000e+00 4.64486e+02 261.845 3.24320e+01 81.845  0.9696 
1 1 1 8   18  2  o 13 2.52515e+01 7.29702e-01 2.05250e+02 21.249  6.56142e+00  2.55144e+00  0.00000e+00 0.00000e+00 6.77731e+02 21.249  4.72481e+02 21.249  0.9260 
1 1 1 8   18  3  o 14 2.55049e+01 9.36843e-01 4.30991e+02 56.713  9.21046e+00  1.40285e+01  0.00000e+00 0.00000e+00 5.03152e+02 56.713  7.21608e+01 56.713  0.9697 
1 1 1 8   18  4  o 17 3.80704e+01 8.06356e-01 7.33868e+02 347.702 4.63127e+01  -1.00964e+01 0.00000e+00 0.00000e+00 6.88925e+02 347.702 4.49425e+01 167.702 0.9894 
1 1 1 8   18  5  o 2  1.94482e+01 7.79986e-01 3.24170e+02 149.577 -1.17363e+01 6.89183e+00  0.00000e+00 0.00000e+00 3.82961e+02 149.577 5.87917e+01 149.577 0.9625 
1 1 1 8   18  6  o 8  1.26714e+01 7.34329e-01 2.92416e+02 121.334 -5.01278e+00 8.23345e+00  0.00000e+00 0.00000e+00 1.60688e+02 121.334 1.31729e+02 301.334 0.9466 
1 1 1 8   18  7  o 11 2.78699e+01 7.66893e-01 4.68473e+02 265.595 -3.19899e+00 -4.15286e+01 0.00000e+00 0.00000e+00 5.71505e+02 265.595 1.03032e+02 265.595 0.9879 
1 1 1 8   18  8  o 10 1.51000e+01 9.10352e-01 2.76587e+02 153.534 -1.42018e+01 7.07029e+00  0.00000e+00 0.00000e+00 2.75410e+02 153.534 1.17700e+00 333.534 0.9680 
1 1 1 8   18  9  o 14 2.46977e+01 9.39085e-01 4.66539e+02 91.452  -1.41655e+00 5.58842e+01  0.00000e+00 0.00000e+00 4.57645e+02 91.452  8.89380e+00 271.452 0.9910 
1 1 1 8   18  10 o 18 1.96423e+01 9.69443e-01 3.26413e+02 26.119  3.68051e+01  1.80454e+01  0.00000e+00 0.00000e+00 4.05969e+02 26.119  7.95562e+01 26.119  0.9877 
1 1 1 8   18  11 o 15 6.11500e+00 1.69347e+00 1.74436e+02 171.766 -6.46756e+00 9.35940e-01  0.00000e+00 0.00000e+00 3.78541e+01 171.766 1.36581e+02 351.766 0.9199 
1 1 1 8   18  12 o 15 7.12476e+00 1.53398e+00 2.12906e+02 246.184 -4.65109e+00 -1.05373e+01 0.00000e+00 0.00000e+00 4.39152e+01 246.184 1.68991e+02 66.184  0.9556 
1 1 1 8   18  13 o 5  6.15991e+00 1.82529e+00 1.01353e+02 248.015 -1.71983e+00 -4.25988e+00 0.00000e+00 0.00000e+00 1.03746e+02 248.015 2.39343e+00 248.015 0.8830 
1 1 1 8   18  14 o 5  4.19356e+00 2.01469e+00 6.92790e+01 52.448  1.37057e+00  1.78281e+00  0.00000e+00 0.00000e+00 4.68321e+01 52.448  2.24470e+01 232.448 0.7347 
1 1 1 8   19  0  o 14 3.36436e+01 7.00603e-01 8.15220e+02 231.677 -2.17387e+01 -2.75033e+01 0.00000e+00 0.00000e+00 4.36285e+02 231.677 3.78935e+02 51.677  0.9856 
1 1 1 8   19  1  o 3  4.34491e+01 9.65413e-01 9.23429e+02 322.909 4.19022e+01  -3.16799e+01 0.00000e+00 0.00000e+00 7.01179e+02 322.909 2.22250e+02 142.909 0.9904 
1 1 1 8   19  2  o 4  1.22459e+01 6.10877e-01 2.64487e+02 113.069 -1.72549e+00 4.05141e+00  0.00000e+00 0.00000e+00 1.41248e+02 113.069 1.23239e+02 293.069 0.8774 
1 1 1 8   19  3  o 16 2.32440e+01 6.17271e-01 3.56507e+02 176.215 -1.57109e+01 1.03945e+00  0.00000e+00 0.00000e+00 4.93004e+02 176.215 1.36497e+02 176.215 0.9677 
1 1 1 8   19  4  o 5  3.32977e+01 7.41275e-01 6.06083e+02 294.187 1.41823e+01  -3.15765e+01 0.00000e+00 0.00000e+00 6.33315e+02 294.187 2.72313e+01 294.187 0.9854 
1 1 1 8   19  5  o 9  2.77198e+01 7.04880e-01 5.77484e+02 61.450  1.65543e+01  3.04255e+01  0.00000e+00 0.00000e+00 4.54354e+02 61.450  1.23129e+02 241.450 0.9855 
1 1 1 8   19  6  o 8  2.59200e+01 7.13028e-01 3.45282e+02 135.312 -1.65566e+01 1.63772e+01  0.00000e+00 0.00000e+00 6.12529e+02 135.312 2.67247e+02 135.312 0.9783 
1 1 1 8   19  7  o 10 3.26503e+01 8.00330e-01 7.55240e+02 261.061 -1.21600e+01 -7.73076e+01 0.00000e+00 0.00000e+00 4.70051e+02 261.061 2.85188e+02 81.061  0.9936 
1 1 1 8   19  8  o 2  6.99001e+00 1.30305e+00 9.80247e+01 271.279 5.45835e-02  -2.44542e+00 0.00000e+00 0.00000e+00 1.02331e+02 271.279 4.30672e+00 271.279 0.7590 
1 1 1 8   19  9  o 16 2.37973e+01 8.62457e-01 3.89742e+02 260.084 -7.83098e+00 -4.47963e+01 0.00000e+00 0.00000e+00 4.98841e+02 260.084 1.09099e+02 260.084 0.9889 
1 1 1 8   19  10 o 6  8.30542e+00 1.52169e+00 1.16929e+02 306.640 3.26470e+00  -4.38944e+00 0.00000e+00 0.00000e+00 1.66250e+02 306.640 4.93215e+01 306.640 0.9033 
1 1 1 8   19  11 o 3  5.23734e+00 1.47351e+00 1.99140e+02 292.728 2.71363e+00  -6.47823e+00 0.00000e+00 0.00000e+00 1.61720e+01 112.728 2.15312e+02 112.728 0.9258 
1 1 1 8   19  12 o 11 1.22688e+01 1.53186e+00 3.60088e+02 69.439  1.21914e+01  3.25012e+01  0.00000e+00 0.00000e+00 9.59870e+01 69.439  2.64101e+02 249.439 0.9855 
1 1 1 8   19  13 o 12 5.82861e+00 1.82770e+00 1.14230e+02 23.537  4.74037e+00  2.06481e+00  0.00000e+00 0.00000e+00 8.29412e+01 23.537  3.12887e+01 203.537 0.8972 
1 1 1 8   19  14 o 4  7.51861e+00 1.97466e+00 1.16939e+02 178.319 -6.96302e+00 2.04294e-01  0.00000e+00 0.00000e+00 1.45195e+02 178.319 2.82565e+01 178.319 0.9252 
1 1 1 8   20  0  o 16 2.28787e+01 7.44220e-01 2.86251e+02 110.426 -2.90556e+00 7.80203e+00  0.00000e+00 0.00000e+00 5.23523e+02 110.426 2.37272e+02 110.426 0.9379 
1 1 1 8   20  1  o 18 2.71595e+01 6.23057e-01 4.93349e+02 264.593 -1.66904e+00 -1.76345e+01 0.00000e+00 0.00000e+00 5.02549e+02 264.593 9.20040e+00 264.593 0.9713 
1 1 1 8   20  2  o 9  2.56212e+01 7.23989e-01 6.91443e+02 186.072 -2.79943e+01 -2.97809e+00 0.00000e+00 0.00000e+00 2.58641e+02 186.072 4.32802e+02 6.072   0.9821 
1 1 1 8   20  3  o 2  2.62262e+01 8.41806e-01 2.80683e+02 287.034 4.03562e+00  -1.31722e+01 0.00000e+00 0.00000e+00 6.73103e+02 287.034 3.92420e+02 287.034 0.9630 
1 1 1 8   20  4  o 17 1.82626e+01 6.22227e-01 2.80223e+02 52.698  5.33919e+00  7.00816e+00  0.00000e+00 0.00000e+00 3.69129e+02 52.698  8.89068e+01 52.698  0.9414 
1 1 1 8   20  5  o 3  3.06971e+01 7.30594e-01 4.57530e+02 262.651 -3.97376e+00 -3.08104e+01 0.00000e+00 0.00000e+00 6.83115e+02 262.651 2.25585e+02 262.651 0.9838 
1 1 1 8   20  6  o 5  1.01793e+01 8.84603e-01 1.49763e+02 29.468  3.40336e+00  1.92299e+00  0.00000e+00 0.00000e+00 1.80861e+02 29.468  3.10975e+01 29.468  0.8599 
1 1 1 8   20  7  o 1  3.16580e+01 7.98615e-01 5.63529e+02 218.584 -4.28297e+01 -3.41706e+01 0.00000e+00 0.00000e+00 6.21160e+02 218.584 5.76302e+01 218.584 0.9908 
1 1 1 8   20  8  o 17 1.37805e+01 9.17318e-01 1.60987e+02 228.059 -6.15830e+00 -6.85361e+00 0.00000e+00 0.00000e+00 3.30294e+02 228.059 1.69307e+02 228.059 0.9441 
1 1 1 8   20  9  o 16 1.64420e+01 9.98319e-01 2.00092e+02 295.970 7.38642e+00  -1.51643e+01 0.00000e+00 0.00000e+00 4.01988e+02 295.970 2.01896e+02 295.970 0.9699 
1 1 1 8   20  10 o 17 1.45494e+01 1.29155e+00 2.55040e+02 11.666  2.19557e+01  4.53332e+00  0.00000e+00 0.00000e+00 2.81743e+02 11.666  2.67034e+01 11.666  0.9774 
1 1 1 8   20  11 f 0  4.90068e+00 1.46252e+00 3.93186e+01 5.275   1.29592e+00  1.19646e-01  0.00000e+00 0.00000e+00 6.11075e+01 5.275   2.17889e+01 5.275   0.5431 
1 1 1 8   20  12 o 13 4.38015e+00 1.47252e+00 7.78667e+01 336.758 2.52723e+00  -1.08538e+00 0.00000e+00 0.00000e+00 5.26037e+01 336.758 2.52629e+01 156.758 0.7897 
1 1 1 8   20  13 o 8  5.18270e+00 1.68637e+00 4.48746e+01 96.972  -2.36282e-01 1.93216e+00  0.00000e+00 0.00000e+00 8.97170e+01 96.972  4.48424e+01 96.972  0.6888 
1 1 1 8   20  14 o 16 6.83717e+00 1.76532e+00 1.18191e+02 144.270 -5.80324e+00 4.17470e+00  0.00000e+00 0.00000e+00 1.20690e+02 144.270 2.49811e+00 144.270 0.9272 
1 1 1 8   21  0  o 5  2.60042e+01 7.45050e-01 2.91006e+02 308.783 6.25373e+00  -7.78268e+00 0.00000e+00 0.00000e+00 6.39791e+02 308.783 3.48785e+02 308.783 0.9485 
1 1 1 8   21  1  o 12 4.49307e+01 8.75007e-01 8.68769e+02 130.616 -3.43376e+01 4.00394e+01  0.00000e+00 0.00000e+00 8.11120e+02 130.616 5.76491e+01 310.616 0.9905 
1 1 1 8   21  2  o 9  3.27048e+01 7.92431e-01 4.84860e+02 280.360 4.49832e+00  -2.46056e+01 0.00000e+00 0.00000e+00 7.25023e+02 280.360 2.40163e+02 280.360 0.9798 
1 1 1 8   21  3  o 11 1.16083e+01 6.27617e-01 2.04706e+02 326.766 3.50966e+00  -2.29963e+00 0.00000e+00 0.00000e+00 1.76961e+02 326.766 2.77447e+01 146.766 0.8707 
1 1 1 8   21  4  o 16 2.67045e+01 6.70106e-01 5.19678e+02 346.755 2.83833e+01  -6.68065e+00 0.00000e+00 0.00000e+00 4.71428e+02 346.755 4.82497e+01 166.755 0.9827 
1 1 1 8   21  5  o 2  2.90998e+01 7.19307e-01 4.90250e+02 198.172 -2.99358e+01 -9.82648e+00 0.00000e+00 0.00000e+00 5.91237e+02 198.172 1.00987e+02 198.172 0.9840 
1 1 1 8   21  6  o 13 4.47117e+01 9.28399e-01 7.50792e+02 339.508 8.43863e+01  -3.15364e+01 0.00000e+00 0.00000e+00 9.28502e+02 339.508 1.77709e+02 339.508 0.9944 
1 1 1 8   21  7  o 15 2.09737e+01 7.66367e-01 3.21529e+02 159.195 -1.93770e+01 7.36242e+00  0.00000e+00 0.00000e+00 4.51209e+02 159.195 1.29680e+02 159.195 0.9756 
1 1 1 8   21  8  o 17 1.50566e+01 8.95429e-01 3.53936e+02 243.810 -9.77795e+00 -1.98798e+01 0.00000e+00 0.00000e+00 2.01624e+02 243.810 1.52313e+02 63.810  0.9772 
1 1 1 8   21  9  o 17 8.15423e+00 1.35211e+00 8.24033e+01 50.820  2.01077e+00  2.46723e+00  0.00000e+00 0.00000e+00 1.70845e+02 50.820  8.84420e+01 50.820  0.8226 
1 1 1 8   21  10 o 15 9.79993e+00 1.64023e+00 2.21479e+02 160.679 -1.15501e+01 4.04952e+00  0.00000e+00 0.00000e+00 1.32955e+02 160.679 8.85245e+01 340.679 0.9582 
1 1 1 8   21  11 o 6  7.70707e+00 1.70717e+00 6.02332e+01 166.480 -2.87652e+00 6.91673e-01  0.00000e+00 0.00000e+00 1.74403e+02 166.480 1.14170e+02 166.480 0.8069 
1 1 1 8   21  12 o 7  9.00064e+00 2.14420e+00 2.21838e+02 28.603  1.01268e+01  5.52190e+00  0.00000e+00 0.00000e+00 1.02571e+02 28.603  1.19267e+02 208.603 0.9556 
1 1 1 8   21  13 o 18 9.72152e+00 2.22306e+00 3.13498e+02 242.038 -8.80606e+00 -1.65883e+01 0.00000e+00 0.00000e+00 4.31110e+01 242.038 2.70387e+02 62.038  0.9730 
1 1 1 8   21  14 o 4  5.39542e+00 1.63228e+00 1.11861e+02 54.673  3.33733e+00  4.70873e+00  0.00000e+00 0.00000e+00 7.28746e+01 54.673  3.89867e+01 234.673 0.9087 
1 1 1 8   22  0  o 13 1.93841e+01 6.90489e-01 2.27494e+02 320.183 4.45882e+00  -3.71723e+00 0.00000e+00 0.00000e+00 4.37558e+02 320.183 2.10064e+02 320.183 0.9092 
1 1 1 8   22  1  o 4  1.63703e+01 5.52125e-01 2.46885e+02 1.792   5.50305e+00  1.72155e-01  0.00000e+00 0.00000e+00 3.11660e+02 1.792   6.47748e+01 1.792   0.9039 
1 1 1 8   22  2  o 1  2.24101e+01 6.75822e-01 1.60875e+02 208.142 -4.92549e+00 -2.63464e+00 0.00000e+00 0.00000e+00 6.05169e+02 208.142 4.44294e+02 208.142 0.9054 
1 1 1 8   22  3  f 0  2.93212e+01 7.95458e-01 3.95575e+02 120.864 -1.03863e+01 1.73786e+01  0.00000e+00 0.00000e+00 6.83918e+02 120.864 2.88343e+02 120.864 0.9750 
1 1 1 8   22  4  o 16 2.02576e+01 6.43472e-01 3.16925e+02 284.543 3.38196e+00  -1.30369e+01 0.00000e+00 0.00000e+00 4.19129e+02 284.543 1.02204e+02 284.543 0.9621 
1 1 1 8   22  5  o 15 2.18110e+01 6.71957e-01 3.63115e+02 248.517 -7.09064e+00 -1.80162e+01 0.00000e+00 0.00000e+00 4.39054e+02 248.517 7.59388e+01 248.517 0.9738 
1 1 1 8   22  6  o 15 1.86326e+01 7.26160e-01 2.40920e+02 277.477 1.59188e+00  -1.21287e+01 0.00000e+00 0.00000e+00 4.33356e+02 277.477 1.92436e+02 277.477 0.9582 
1 1 1 8   22  7  o 17 3.51119e+01 9.57724e-01 6.91827e+02 154.052 -6.79281e+01 3.30538e+01  0.00000e+00 0.00000e+00 6.25312e+02 154.052 6.65144e+01 334.052 0.9934 
1 1 1 8   22  8  o 11 1.21017e+01 1.03754e+00 1.87075e+02 212.432 -7.75248e+00 -4.92605e+00 0.00000e+00 0.00000e+00 2.44225e+02 212.432 5.71506e+01 212.432 0.9439 
1 1 1 8   22  9  o 4  9.13249e+00 1.29753e+00 1.99854e+02 356.892 9.51240e+00  -5.16563e-01 0.00000e+00 0.00000e+00 1.26275e+02 356.892 7.35793e+01 176.892 0.9460 
1 1 1 8   22  10 o 2  1.81451e+01 1.07914e+00 2.51075e+02 291.614 1.12779e+01  -2.84647e+01 0.00000e+00 0.00000e+00 4.22464e+02 291.614 1.71389e+02 291.614 0.9835 
1 1 1 8   22  11 o 13 1.36750e+01 1.45916e+00 2.24646e+02 9.632   2.12839e+01  3.61233e+00  0.00000e+00 0.00000e+00 2.79206e+02 9.632   5.45600e+01 9.632   0.9766 
1 1 1 8   22  12 o 3  5.52513e+00 1.68338e+00 1.33637e+02 92.381  -2.19201e-01 5.27074e+00  0.00000e+00 0.00000e+00 5.37791e+01 92.381  7.98575e+01 272.381 0.8994 
1 1 1 8   22  13 o 1  6.15906e+00 1.82773e+00 8.04676e+01 346.500 3.64596e+00  -8.75336e-01 0.00000e+00 0.00000e+00 1.17621e+02 346.500 3.71534e+01 346.500 0.8532 
1 1 1 8   22  14 o 6  7.05295e+00 1.83330e+00 1.01587e+02 342.985 5.84247e+00  -1.78792e+00 0.00000e+00 0.00000e+00 1.41317e+02 342.985 3.97307e+01 342.985 0.9140 
1 1 1 8   23  0  o 9  2.39908e+01 7.64350e-01 4.29558e+02 270.429 1.04501e-01  -1.39591e+01 0.00000e+00 0.00000e+00 4.42620e+02 270.429 1.30621e+01 270.429 0.9635 
1 1 1 8   23  1  o 18 2.84585e+01 7.23518e-01 5.94753e+02 99.094  -4.25007e+00 2.65529e+01  0.00000e+00 0.00000e+00 4.59202e+02 99.094  1.35551e+02 279.094 0.9812 
1 1 1 8   23  2  o 15 2.56582e+01 6.51622e-01 4.04603e+02 338.688 1.49399e+01  -5.82854e+00 0.00000e+00 0.00000e+00 5.33344e+02 338.688 1.28740e+02 338.688 0.9683 
1 1 1 8   23  3  o 13 2.37706e+01 7.63439e-01 5.66036e+02 251.665 -7.22534e+00 -2.18029e+01 0.00000e+00 0.00000e+00 3.11748e+02 251.665 2.54288e+02 71.665  0.9780 
1 1 1 8   23  4  o 1  2.63478e+01 6.66171e-01 3.28086e+02 47.776  1.21558e+01  1.33948e+01  0.00000e+00 0.00000e+00 6.38969e+02 47.776  3.10884e+02 47.776  0.9720 
1 1 1 8   23  5  o 15 3.14659e+01 7.44531e-01 5.72767e+02 92.729  -2.08194e+00 4.36813e+01  0.00000e+00 0.00000e+00 6.01858e+02 92.729  2.90908e+01 92.729  0.9885 
1 1 1 8   23  6  o 11 2.54216e+01 7.31328e-01 2.91034e+02 107.583 -6.22998e+00 1.96597e+01  0.00000e+00 0.00000e+00 6.45412e+02 107.583 3.54378e+02 107.583 0.9754 
1 1 1 8   23  7  o 18 1.57156e+01 8.18601e-01 3.94309e+02 65.733  8.01530e+00  1.77795e+01  0.00000e+00 0.00000e+00 1.83708e+02 65.733  2.10601e+02 245.733 0.9740 
1 1 1 8   23  8  o 9  1.58767e+01 8.74152e-01 2.62835e+02 218.922 -1.34637e+01 -1.08724e+01 0.00000e+00 0.00000e+00 3.19019e+02 218.922 5.61842e+01 218.922 0.9707 
1 1 1 8   23  9  o 16 1.46587e+01 9.75626e-01 2.55478e+02 170.622 -2.07429e+01 3.42574e+00  0.00000e+00 0.00000e+00 2.84543e+02 170.622 2.90643e+01 170.622 0.9759 
1 1 1 8   23  10 o 19 5.64944e+00 1.50584e+00 1.71810e+02 3.376   5.73978e+00  3.38556e-01  0.00000e+00 0.00000e+00 2.18395e+01 3.376   1.49970e+02 183.376 0.9083 
1 1 1 8   23  11 o 1  1.80687e+01 1.27371e+00 4.09740e+02 61.177  2.68779e+01  4.88447e+01  0.00000e+00 0.00000e+00 2.65792e+02 61.177  1.43948e+02 241.177 0.9910 
1 1 1 8   23  12 o 19 6.69413e+00 1.72860e+00 8.94866e+01 260.874 -6.89561e-01 -4.29263e+00 0.00000e+00 0.00000e+00 1.31579e+02 260.874 4.20925e+01 260.874 0.8757 
1 1 1 8   23  13 o 4  5.06021e+00 1.62892e+00 9.51303e+01 330.887 3.68505e+00  -2.05214e+00 0.00000e+00 0.00000e+00 7.10894e+01 330.887 2.40409e+01 150.887 0.8714 
1 1 1 8   23  14 o 7  5.35800e+00 1.69795e+00 1.00041e+02 52.152  3.03597e+00  3.90720e+00  0.00000e+00 0.00000e+00 8.00622e+01 52.152  1.99790e+01 232.152 0.8922 
1 1 1 8   24  0  o 7  2.31534e+01 6.40999e-01 5.12315e+02 176.505 -1.60457e+01 9.79908e-01  0.00000e+00 0.00000e+00 3.33638e+02 176.505 1.78677e+02 356.505 0.9684 
1 1 1 8   24  1  o 17 7.94270e+00 6.51658e-01 1.41782e+02 94.120  -1.28284e-01 1.78101e+00  0.00000e+00 0.00000e+00 5.58340e+01 94.120  8.59479e+01 274.120 0.6592 
1 1 1 8   24  2  o 18 1.88308e+01 5.75834e-01 2.57914e+02 208.738 -8.08684e+00 -4.43439e+00 0.00000e+00 0.00000e+00 4.13221e+02 208.738 1.55306e+02 208.738 0.9441 
1 1 1 8   24  3  o 3  3.53818e+01 9.36283e-01 5.89409e+02 63.870  1.54703e+01  3.15364e+01  0.00000e+00 0.00000e+00 7.27314e+02 63.870  1.37904e+02 63.870  0.9857 
1 1 1 8   24  4  o 15 2.16119e+01 6.38262e-01 2.16886e+02 153.920 -8.79675e+00 4.30573e+00  0.00000e+00 0.00000e+00 5.56326e+02 153.920 3.39440e+02 153.920 0.9475 
1 1 1 8   24  5  o 14 1.55801e+01 6.79928e-01 9.33617e+01 279.367 5.68665e-01  -3.44715e+00 0.00000e+00 0.00000e+00 4.01297e+02 279.367 3.07935e+02 279.367 0.8408 
1 1 1 8   24  6  o 18 2.27652e+01 7.11320e-01 4.20877e+02 119.257 -1.30433e+01 2.32837e+01  0.00000e+00 0.00000e+00 4.22508e+02 119.257 1.63180e+00 119.257 0.9811 
1 1 1 8   24  7  o 1  7.72745e+00 1.22511e+00 1.87690e+02 344.563 4.32013e+00  -1.19294e+00 0.00000e+00 0.00000e+00 6.90143e+01 344.563 1.18676e+02 164.563 0.8798 
1 1 1 8   24  8  o 16 8.28752e+00 1.30018e+00 1.08889e+02 128.806 -2.24749e+00 2.79469e+00  0.00000e+00 0.00000e+00 1.55649e+02 128.806 4.67599e+01 128.806 0.8455 
1 1 1 8   24  9  o 13 1.36644e+01 1.04403e+00 1.95785e+02 253.896 -3.95585e+00 -1.37015e+01 0.00000e+00 0.00000e+00 3.01567e+02 253.896 1.05782e+02 253.896 0.9643 
1 1 1 8   24  10 o 1  1.51773e+01 1.17651e+00 2.22152e+02 193.355 -2.15314e+01 -5.11148e+00 0.00000e+00 0.00000e+00 3.37491e+02 193.355 1.15339e+02 193.355 0.9771 
1 1 1 8   24  11 f 0  6.35819e+00 1.67264e+00 8.21636e+01 24.212  3.07137e+00  1.38110e+00  0.00000e+00 0.00000e+00 1.17849e+02 24.212  3.56852e+01 24.212  0.8339 
1 1 1 8   24  12 o 11 4.68877e+00 1.55130e+00 7.56212e+01 90.188  -9.16463e-03 2.79311e+00  0.00000e+00 0.00000e+00 6.46708e+01 90.188  1.09505e+01 270.188 0.7934 
1 1 1 8   24  13 o 10 5.47173e+00 1.72301e+00 1.56855e+02 150.877 -6.23958e+00 3.47617e+00  0.00000e+00 0.00000e+00 3.43560e+01 150.877 1.22499e+02 330.877 0.9271 
1 1 1 8   24  14 o 10 9.37456e+00 2.00916e+00 1.44688e+02 317.493 7.65916e+00  -7.01999e+00 0.00000e+00 0.00000e+00 1.91040e+02 317.493 4.63527e+01 317.493 0.9506 
1 1 1 8   25  0  o 1  2.73833e+01 7.48530e-01 5.27726e+02 147.672 -1.93125e+01 1.22218e+01  0.00000e+00 0.00000e+00 4.82515e+02 147.672 4.52110e+01 327.672 0.9779 
1 1 1 8   25  1  o 7  1.18023e+01 5.47710e-01 3.51636e+02 84.693  5.96645e-01  6.42335e+00  0.00000e+00 0.00000e+00 5.76182e+01 84.693  2.94018e+02 264.693 0.9188 
1 1 1 8   25  2  o 19 3.53916e+01 7.49104e-01 6.09867e+02 343.728 3.88579e+01  -1.13423e+01 0.00000e+00 0.00000e+00 7.09458e+02 343.728 9.95913e+01 343.728 0.9876 
1 1 1 8   25  3  o 16 1.07931e+01 7.80192e-01 1.19044e+02 182.871 -2.19525e+00 -1.10099e-01 0.00000e+00 0.00000e+00 1.77499e+02 182.871 5.84545e+01 182.871 0.7278 
1 1 1 8   25  4  o 11 2.98603e+01 7.08693e-01 3.66389e+02 249.963 -8.13335e+00 -2.23020e+01 0.00000e+00 0.00000e+00 7.37058e+02 249.963 3.70670e+02 249.963 0.9787 
1 1 1 8   25  5  o 14 1.61322e+01 6.81788e-01 3.08897e+02 2.755   1.33138e+01  6.40721e-01  0.00000e+00 0.00000e+00 2.76932e+02 2.755   3.19648e+01 182.755 0.9617 
1 1 1 8   25  6  o 7  1.86831e+01 7.21902e-01 3.83810e+02 295.469 9.25379e+00  -1.94277e+01 0.00000e+00 0.00000e+00 3.05051e+02 295.469 7.87596e+01 115.469 0.9765 
1 1 1 8   25  7  o 1  4.65413e+00 1.27292e+00 1.94622e+02 347.887 2.71132e+00  -5.81911e-01 0.00000e+00 0.00000e+00 5.55031e+01 167.887 2.50125e+02 167.887 0.7917 
1 1 1 8   25  8  o 4  2.23155e+01 8.10409e-01 4.00916e+02 152.104 -3.39903e+01 1.79937e+01  0.00000e+00 0.00000e+00 4.30490e+02 152.104 2.95744e+01 152.104 0.9869 
1 1 1 8   25  9  o 6  1.45102e+01 9.71122e-01 2.52250e+02 289.143 6.47803e+00  -1.86624e+01 0.00000e+00 0.00000e+00 2.81368e+02 289.143 2.91180e+01 289.143 0.9744 
1 1 1 8   25  10 f 0  1.40732e+01 1.31197e+00 2.25822e+02 26.978  1.75577e+01  8.93761e+00  0.00000e+00 0.00000e+00 2.91556e+02 26.978  6.57344e+01 26.978  0.9743 
1 1 1 8   25  11 o 14 8.80830e+00 1.52994e+00 2.65160e+02 128.323 -9.88403e+00 1.25050e+01  0.00000e+00 0.00000e+00 5.65068e+01 128.323 2.08654e+02 308.323 0.9681 
1 1 1 8   25  12 o 9  9.48900e+00 2.03923e+00 2.84162e+02 258.583 -3.21716e+00 -1.59306e+01 0.00000e+00 0.00000e+00 6.24548e+01 258.583 2.21707e+02 78.583  0.9687 
1 1 1 8   25  13 o 19 5.23916e+00 1.59284e+00 2.23525e+02 353.968 1.04369e+01  -1.10282e+00 0.00000e+00 0.00000e+00 3.57142e+01 173.968 2.59239e+02 173.968 0.9511 
1 1 1 8   25  14 o 8  4.21971e+00 1.41905e+00 6.58852e+01 243.375 -1.34680e+00 -2.68657e+00 0.00000e+00 0.00000e+00 6.29351e+01 243.375 2.95012e+00 63.375  0.8104 
1 1 1 8   26  0  o 1  4.57461e+01 8.90524e-01 8.08232e+02 298.508 2.70673e+01  -4.98349e+01 0.00000e+00 0.00000e+00 9.02245e+02 298.508 9.40134e+01 298.508 0.9911 
1 1 1 8   26  1  o 15 2.72306e+01 7.12389e-01 5.52372e+02 97.841  -3.15638e+00 2.29210e+01  0.00000e+00 0.00000e+00 4.52739e+02 97.841  9.96337e+01 277.841 0.9781 
1 1 1 8   26  2  o 11 1.66921e+01 5.60717e-01 2.57636e+02 88.454  2.04572e-01  7.58130e+00  0.00000e+00 0.00000e+00 3.29259e+02 88.454  7.16237e+01 88.454  0.9315 
1 1 1 8   26  3  o 12 6.26049e+00 1.00507e+00 5.57040e+01 41.139  4.42668e-01  3.86695e-01  0.00000e+00 0.00000e+00 1.09174e+01 41.139  4.47866e+01 221.139 0.2819 
1 1 1 8   26  4  o 4  2.32519e+01 8.26074e-01 2.27910e+02 342.136 1.08305e+01  -3.49065e+00 0.00000e+00 0.00000e+00 6.10458e+02 342.136 3.82548e+02 342.136 0.9550 
1 1 1 8   26  5  o 7  2.39681e+01 7.71859e-01 5.00388e+02 72.516  9.55103e+00  3.03218e+01  0.00000e+00 0.00000e+00 3.90221e+02 72.516  1.10167e+02 252.516 0.9841 
1 1 1 8   26  6  o 3  3.94662e+01 8.37932e-01 6.91702e+02 254.177 -2.10768e+01 -7.43701e+01 0.00000e+00 0.00000e+00 7.88724e+02 254.177 9.70221e+01 254.177 0.9935 
1 1 1 8   26  7  o 4  2.22885e+01 7.48272e-01 3.99326e+02 148.795 -2.68046e+01 1.62368e+01  0.00000e+00 0.00000e+00 4.28607e+02 148.795 2.92817e+01 148.795 0.9839 
1 1 1 8   26  8  o 3  5.75781e+00 1.24495e+00 1.05310e+02 123.017 -1.38013e+00 2.12383e+00  0.00000e+00 0.00000e+00 6.17270e+01 123.017 4.35834e+01 303.017 0.7685 
1 1 1 8   26  9  o 1  1.72714e+01 1.08297e+00 2.94722e+02 269.105 -4.22550e-01 -2.70406e+01 0.00000e+00 0.00000e+00 3.44948e+02 269.105 5.02266e+01 269.105 0.9813 
1 1 1 8   26  10 o 19 1.88627e+01 1.10594e+00 4.26372e+02 129.039 -3.32745e+01 4.10332e+01  0.00000e+00 0.00000e+00 2.78571e+02 129.039 1.47801e+02 309.039 0.9905 
1 1 1 8   26  11 o 7  1.13783e+01 1.86895e+00 1.75892e+02 320.691 9.53642e+00  -7.80789e+00 0.00000e+00 0.00000e+00 2.35489e+02 320.691 5.95967e+01 320.691 0.9585 
1 1 1 8   26  12 o 19 8.83786e+00 1.82767e+00 1.69174e+02 111.424 -3.81977e+00 9.73474e+00  0.00000e+00 0.00000e+00 1.47699e+02 111.424 2.14752e+01 291.424 0.9509 
1 1 1 8   26  13 o 13 8.09467e+00 1.61154e+00 1.12529e+02 1.514   8.07363e+00  2.13351e-01  0.00000e+00 0.00000e+00 1.72981e+02 1.514   6.04523e+01 1.514   0.9359 
1 1 1 8   26  14 o 14 4.40973e+00 1.46954e+00 1.41709e+02 154.722 -5.95477e+00 2.81202e+00  0.00000e+00 0.00000e+00 1.12109e+01 154.722 1.30498e+02 334.722 0.9206 
1 1 1 8   27  0  o 10 2.15195e+01 7.26138e-01 1.42498e+02 53.441  2.81027e+00  3.78976e+00  0.00000e+00 0.00000e+00 5.77049e+02 53.441  4.34552e+02 53.441  0.8864 
1 1 1 8   27  1  o 14 3.93071e+01 1.05462e+00 4.83283e+02 356.634 3.49496e+01  -2.05545e+00 0.00000e+00 0.00000e+00 9.78557e+02 356.634 4.95274e+02 356.634 0.9856 
1 1 1 8   27  2  f 0  1.45449e+01 6.83580e-01 2.61000e+02 43.401  4.72152e+00  4.46511e+00  0.00000e+00 0.00000e+00 2.43742e+02 43.401  1.72573e+01 223.401 0.9195 
1 1 1 8   27  3  o 1  2.06876e+01 7.89202e-01 3.43184e+02 151.120 -1.29397e+01 7.13715e+00  0.00000e+00 0.00000e+00 4.10834e+02 151.120 6.76496e+01 151.120 0.9655 
1 1 1 8   27  4  o 18 3.13169e+01 7.30851e-01 5.94500e+02 35.155  3.36381e+01  2.36893e+01  0.00000e+00 0.00000e+00 5.73326e+02 35.155  2.11740e+01 215.155 0.9878 
1 1 1 8   27  5  o 14 3.53224e+01 9.29270e-01 6.92741e+02 258.380 -1.26053e+01 -6.13015e+01 0.00000e+00 0.00000e+00 6.30126e+02 258.380 6.26148e+01 78.380  0.9920 
1 1 1 8   27  6  o 4  1.09042e+01 8.81550e-01 2.35868e+02 121.799 -3.81031e+00 6.14572e+00  0.00000e+00 0.00000e+00 1.46173e+02 121.799 8.96951e+01 301.799 0.9280 
1 1 1 8   27  7  o 19 1.54885e+01 8.09564e-01 1.88923e+02 199.155 -9.40861e+00 -3.26823e+00 0.00000e+00 0.00000e+00 3.65603e+02 199.155 1.76680e+02 199.155 0.9484 
1 1 1 8   27  8  o 15 1.96967e+01 8.10838e-01 2.64870e+02 310.142 1.59304e+01  -1.88902e+01 0.00000e+00 0.00000e+00 4.63391e+02 310.142 1.98521e+02 310.142 0.9796 
1 1 1 8   27  9  o 12 9.02418e+00 1.49540e+00 2.26856e+02 50.684  6.21690e+00  7.59124e+00  0.00000e+00 0.00000e+00 9.58499e+01 50.684  1.31006e+02 230.684 0.9476 
1 1 1 8   27  10 o 15 5.16743e+00 1.41754e+00 3.39189e+01 270.105 2.00981e-03  -1.09679e+00 0.00000e+00 0.00000e+00 5.95903e+01 270.105 2.56714e+01 270.105 0.4796 
1 1 1 8   27  11 o 12 7.80864e+00 1.94553e+00 1.28860e+02 276.200 6.46550e-01  -5.95145e+00 0.00000e+00 0.00000e+00 1.39780e+02 276.200 1.09194e+01 276.200 0.9121 
1 1 1 8   27  12 o 8  4.31956e+00 1.46182e+00 9.58659e+01 255.753 -8.46223e-01 -3.33279e+00 0.00000e+00 0.00000e+00 4.05797e+01 255.753 5.52862e+01 75.753  0.8378 
1 1 1 8   27  13 o 9  4.38572e+00 1.39025e+00 4.88731e+01 2.859   2.19346e+00  1.09538e-01  0.00000e+00 0.00000e+00 7.13665e+01 2.859   2.24933e+01 2.859   0.7275 
1 1 1 8   27  14 o 13 9.75036e+00 1.99847e+00 2.70099e+02 321.737 1.59833e+01  -1.26061e+01 0.00000e+00 0.00000e+00 8.80249e+01 321.737 1.82074e+02 141.737 0.9751 
1 1 1 8   28  0  o 7  3.14536e+01 8.87500e-01 4.17156e+02 142.881 -1.95155e+01 1.47696e+01  0.00000e+00 0.00000e+00 7.44754e+02 142.881 3.27598e+02 142.881 0.9794 
1 1 1 8   28  1  o 10 3.14285e+01 6.57486e-01 5.18364e+02 349.595 2.81891e+01  -5.17628e+00 0.00000e+00 0.00000e+00 6.46566e+02 349.595 1.28202e+02 349.595 0.9824 
1 1 1 8   28  2  o 19 4.80439e+01 1.00627e+00 9.50370e+02 49.932  4.92149e+01  5.85104e+01  0.00000e+00 0.00000e+00 8.50859e+02 49.932  9.95111e+01 229.932 0.9934 
1 1 1 8   28  3  f 0  8.51414e+00 7.64141e-01 7.15128e+01 115.666 -5.48622e-01 1.14169e+00  0.00000e+00 0.00000e+00 9.97596e+01 115.666 2.82468e+01 115.666 0.5329 
1 1 1 8   28  4  o 2  1.99613e+01 6.16342e-01 3.88073e+02 302.593 1.02432e+01  -1.60211e+01 0.00000e+00 0.00000e+00 3.45368e+02 302.593 4.27046e+01 122.593 0.9733 
1 1 1 8   28  5  o 13 3.12388e+01 8.92206e-01 4.53525e+02 217.250 -2.88851e+01 -2.19648e+01 0.00000e+00 0.00000e+00 7.09411e+02 217.250 2.55886e+02 217.250 0.9861 
1 1 1 8   28  6  o 10 2.22427e+01 7.18097e-01 3.76083e+02 71.961  8.29022e+00  2.54551e+01  0.00000e+00 0.00000e+00 4.47759e+02 71.961  7.16767e+01 71.961  0.9811 
1 1 1 8   28  7  o 13 1.07953e+01 9.89996e-01 2.49526e+02 230.155 -5.74108e+00 -6.87960e+00 0.00000e+00 0.00000e+00 1.34513e+02 230.155 1.15013e+02 50.155  0.9424 
1 1 1 8   28  8  o 3  2.66093e+01 9.01607e-01 4.50276e+02 73.123  1.62156e+01  5.34499e+01  0.00000e+00 0.00000e+00 5.44999e+02 73.123  9.47228e+01 73.123  0.9910 
1 1 1 8   28  9  o 9  8.27828e+00 1.56495e+00 1.86133e+02 259.140 -1.43731e+00 -7.49196e+00 0.00000e+00 0.00000e+00 1.04991e+02 259.140 8.11428e+01 79.140  0.9319 
1 1 1 8   28  10 o 16 4.33460e+00 1.36966e+00 1.52521e+02 133.159 -3.06802e+00 3.27180e+00  0.00000e+00 0.00000e+00 8.63608e+00 313.159 1.61157e+02 313.159 0.8799 
1 1 1 8   28  11 o 17 7.04086e+00 1.84646e+00 1.23772e+02 173.924 -5.42484e+00 5.77401e-01  0.00000e+00 0.00000e+00 1.16000e+02 173.924 7.77248e+00 353.924 0.9030 
1 1 1 8   28  12 o 11 6.80749e+00 1.90074e+00 1.09302e+02 124.859 -2.95221e+00 4.23835e+00  0.00000e+00 0.00000e+00 1.20921e+02 124.859 1.16188e+01 124.859 0.8971 
1 1 1 8   28  13 o 1  4.08822e+00 1.36224e+00 6.52541e+01 19.981  2.50892e+00  9.12222e-01  0.00000e+00 0.00000e+00 5.52555e+01 19.981  9.99861e+00 199.981 0.7823 
1 1 1 8   28  14 o 6  5.46508e+00 1.69675e+00 8.07960e+01 192.948 -3.96672e+00 -9.12008e-01 0.00000e+00 0.00000e+00 9.74919e+01 192.948 1.66959e+01 192.948 0.8662 
1 1 1 8   29  0  o 12 2.00361e+01 6.74758e-01 2.75602e+02 43.227  7.07630e+00  6.65138e+00  0.00000e+00 0.00000e+00 4.40053e+02 43.227  1.64452e+02 43.227  0.9470 
1 1 1 8   29  1  o 18 1.64867e+01 5.94454e-01 1.72359e+02 54.493  2.89743e+00  4.06098e+00  0.00000e+00 0.00000e+00 3.83159e+02 54.493  2.10800e+02 54.493  0.8931 
1 1 1 8   29  2  o 7  7.95974e+00 6.96801e-01 1.63595e+02 129.408 -1.41797e+00 1.72577e+00  0.00000e+00 0.00000e+00 5.64663e+01 129.408 1.07128e+02 309.408 0.7326 
1 1 1 8   29  3  o 10 1.72843e+01 5.94665e-01 2.50895e+02 151.352 -7.96146e+00 4.34939e+00  0.00000e+00 0.00000e+00 3.64375e+02 151.352 1.13480e+02 151.352 0.9432 
1 1 1 8   29  4  o 15 2.34928e+01 7.13717e-01 3.25602e+02 235.930 -1.04198e+01 -1.54074e+01 0.00000e+00 0.00000e+00 5.36990e+02 235.930 2.11388e+02 235.930 0.9727 
1 1 1 8   29  5  o 14 2.80190e+01 8.69169e-01 4.83031e+02 337.937 3.38049e+01  -1.37017e+01 0.00000e+00 0.00000e+00 5.60036e+02 337.937 7.70052e+01 337.937 0.9862 
1 1 1 8   29  6  o 3  1.66329e+01 7.83443e-01 4.28117e+02 149.147 -1.87978e+01 1.12292e+01  0.00000e+00 0.00000e+00 1.85228e+02 149.147 2.42889e+02 329.147 0.9769 
1 1 1 8   29  7  o 5  1.79207e+01 7.88429e-01 4.13262e+02 91.204  -5.99373e-01 2.85272e+01  0.00000e+00 0.00000e+00 2.51194e+02 91.204  1.62068e+02 271.204 0.9823 
1 1 1 8   29  8  o 13 2.17583e+01 8.26066e-01 4.07427e+02 350.138 4.02544e+01  -6.99797e+00 0.00000e+00 0.00000e+00 4.03614e+02 350.138 3.81281e+00 170.138 0.9877 
1 1 1 8   29  9  o 3  5.20288e+00 1.48784e+00 1.23096e+02 283.825 7.87616e-01  -3.20065e+00 0.00000e+00 0.00000e+00 3.97889e+01 283.825 8.33068e+01 103.825 0.8297 
1 1 1 8   29  10 o 6  1.83720e+01 1.16082e+00 2.82940e+02 79.951  6.58394e+00  3.71543e+01  0.00000e+00 0.00000e+00 4.00856e+02 79.951  1.17916e+02 79.951  0.9867 
1 1 1 8   29  11 o 19 1.17413e+01 1.74157e+00 2.75738e+02 245.536 -8.79118e+00 -1.93228e+01 0.00000e+00 0.00000e+00 1.56476e+02 245.536 1.19262e+02 65.536  0.9762 
1 1 1 8   29  12 o 16 6.38803e+00 1.80792e+00 1.21744e+02 340.790 5.51665e+00  -1.92218e+00 0.00000e+00 0.00000e+00 9.73479e+01 340.790 2.43960e+01 160.790 0.9098 
1 1 1 8   29  13 o 15 9.38681e+00 1.71783e+00 1.14915e+02 146.980 -7.49475e+00 4.87088e+00  0.00000e+00 0.00000e+00 2.18362e+02 146.980 1.03447e+02 146.980 0.9423 
1 1 1 8   29  14 o 2  7.22101e+00 1.86731e+00 2.07524e+02 350.513 1.26069e+01  -2.10682e+00 0.00000e+00 0.00000e+00 5.35596e+01 350.513 1.53964e+02 170.513 0.9600 
1 1 1 8   30  0  o 10 3.38871e+01 7.60434e-01 6.83651e+02 164.156 -3.88470e+01 1.10247e+01  0.00000e+00 0.00000e+00 5.78416e+02 164.156 1.05236e+02 344.156 0.9875 
1 1 1 8   30  1  o 5  1.95808e+01 5.48558e-01 3.74800e+02 18.952  1.18997e+01  4.08621e+00  0.00000e+00 0.00000e+00 3.33880e+02 18.952  4.09203e+01 198.952 0.9594 
1 1 1 8   30  2  o 9  1.86413e+01 5.61908e-01 2.92905e+02 149.395 -9.91261e+00 5.86357e+00  0.00000e+00 0.00000e+00 3.79218e+02 149.395 8.63130e+01 149.395 0.9555 
1 1 1 8   30  3  o 5  7.60535e+00 7.81460e-01 8.36433e+01 68.611  5.00402e-01  1.27759e+00  0.00000e+00 0.00000e+00 7.79172e+01 68.611  5.72609e+00 248.611 0.5629 
1 1 1 8   30  4  o 1  1.76030e+01 8.82576e-01 2.64659e+02 310.530 7.16444e+00  -8.37971e+00 0.00000e+00 0.00000e+00 3.68853e+02 310.530 1.04194e+02 310.530 0.9535 
1 1 1 8   30  5  o 2  2.52413e+01 8.42902e-01 4.54887e+02 101.577 -6.36529e+00 3.10721e+01  0.00000e+00 0.00000e+00 4.82709e+02 101.577 2.78226e+01 101.577 0.9841 
1 1 1 8   30  6  o 6  2.80549e+01 7.39396e-01 4.64986e+02 219.630 -3.09224e+01 -2.56083e+01 0.00000e+00 0.00000e+00 5.80668e+02 219.630 1.15682e+02 219.630 0.9875 
1 1 1 8   30  7  o 15 1.64965e+01 7.96454e-01 2.45784e+02 9.202   1.68989e+01  2.73759e+00  0.00000e+00 0.00000e+00 3.58358e+02 9.202   1.12575e+02 9.202   0.9703 
1 1 1 8   30  8  o 8  1.55919e+01 9.00959e-01 2.69059e+02 333.226 1.82779e+01  -9.22258e+00 0.00000e+00 0.00000e+00 3.04773e+02 333.226 3.57134e+01 333.226 0.9753 
1 1 1 8   30  9  o 7  1.03390e+01 1.39168e+00 2.72771e+02 244.256 -6.46397e+00 -1.34050e+01 0.00000e+00 0.00000e+00 1.03970e+02 244.256 1.68801e+02 64.256  0.9658 
1 1 1 8   30  10 o 2  2.10758e+01 9.71258e-01 4.00036e+02 53.528  3.65396e+01  4.94312e+01  0.00000e+00 0.00000e+00 3.88442e+02 53.528  1.15934e+01 233.528 0.9918 
1 1 1 8   30  11 o 8  7.06300e+00 1.82288e+00 1.61536e+02 213.122 -6.04077e+00 -3.94118e+00 0.00000e+00 0.00000e+00 8.55726e+01 213.122 7.59634e+01 33.122  0.9278 
1 1 1 8   30  12 o 11 5.52614e+00 1.57818e+00 1.80968e+02 241.898 -3.97295e+00 -7.44016e+00 0.00000e+00 0.00000e+00 1.45615e+01 241.898 1.66407e+02 61.898  0.9387 
1 1 1 8   30  13 o 9  6.13901e+00 1.71118e+00 1.81853e+02 72.630  2.83253e+00  9.05525e+00  0.00000e+00 0.00000e+00 3.68927e+01 72.630  1.44960e+02 252.630 0.9457 
1 1 1 8   30  14 o 7  6.49806e+00 1.85128e+00 1.92745e+02 188.310 -1.02718e+01 -1.50036e+00 0.00000e+00 0.00000e+00 3.98544e+01 188.310 1.52890e+02 8.310   0.9505 
1 1 1 8   31  0  o 15 1.56232e+01 5.19371e-01 1.87144e+02 230.289 -3.20620e+00 -3.86041e+00 0.00000e+00 0.00000e+00 3.39443e+02 230.289 1.52299e+02 230.289 0.8938 
1 1 1 8   31  1  o 1  2.82280e+01 6.97049e-01 5.47708e+02 247.448 -1.01709e+01 -2.44917e+01 0.00000e+00 0.00000e+00 4.96811e+02 247.448 5.08973e+01 67.448  0.9810 
1 1 1 8   31  2  o 17 2.02061e+01 5.68274e-01 3.88418e+02 186.290 -1.63819e+01 -1.80563e+00 0.00000e+00 0.00000e+00 3.50449e+02 186.290 3.79685e+01 6.290   0.9692 
1 1 1 8   31  3  o 7  1.34333e+01 6.14191e-01 3.60949e+02 77.643  2.31040e+00  1.05456e+01  0.00000e+00 0.00000e+00 1.21891e+02 77.643  2.39058e+02 257.642 0.9525 
1 1 1 8   31  4  o 12 1.40662e+01 6.66068e-01 2.51176e+02 162.010 -8.98701e+00 2.91831e+00  0.00000e+00 0.00000e+00 2.50755e+02 162.010 4.20310e-01 342.010 0.9455 
1 1 1 8   31  5  o 5  7.27821e+00 1.07209e+00 1.92285e+02 160.135 -3.54450e+00 1.28062e+00  0.00000e+00 0.00000e+00 4.23051e+01 160.135 1.49980e+02 340.135 0.8540 
1 1 1 8   31  6  o 8  1.11414e+01 9.01374e-01 1.64254e+02 50.791  3.61184e+00  4.42721e+00  0.00000e+00 0.00000e+00 2.17413e+02 50.791  5.31592e+01 50.791  0.9077 
1 1 1 8   31  7  o 17 2.60039e+01 7.56804e-01 3.93112e+02 57.272  2.33740e+01  3.63695e+01  0.00000e+00 0.00000e+00 5.76826e+02 57.272  1.83713e+02 57.272  0.9884 
1 1 1 8   31  8  o 12 1.57561e+01 1.07620e+00 2.14418e+02 227.217 -1.08150e+01 -1.16863e+01 0.00000e+00 0.00000e+00 3.61133e+02 227.217 1.46715e+02 227.217 0.9681 
1 1 1 8   31  9  o 8  1.89660e+01 1.04498e+00 3.20704e+02 73.450  1.08730e+01  3.65891e+01  0.00000e+00 0.00000e+00 3.85376e+02 73.450  6.46725e+01 73.450  0.9868 
1 1 1 8   31  10 o 7  1.05327e+01 1.64503e+00 1.79116e+02 218.742 -9.20214e+00 -7.38334e+00 0.00000e+00 0.00000e+00 2.00911e+02 218.742 2.17956e+01 218.742 0.9566 
1 1 1 8   31  11 o 15 7.57524e+00 1.82533e+00 1.66106e+02 254.804 -2.22407e+00 -8.18829e+00 0.00000e+00 0.00000e+00 1.02114e+02 254.804 6.39926e+01 74.804  0.9391 
1 1 1 8   31  12 o 7  5.90828e+00 1.60759e+00 1.05783e+02 239.022 -2.75204e+00 -4.58418e+00 0.00000e+00 0.00000e+00 9.48208e+01 239.022 1.09625e+01 59.022  0.9008 
1 1 1 8   31  13 o 12 5.91922e+00 1.65196e+00 1.70009e+02 22.074  8.48446e+00  3.44077e+00  0.00000e+00 0.00000e+00 4.04336e+01 22.074  1.29575e+02 202.074 0.9437 
1 1 1 8   31  14 o 12 7.46697e+00 1.98402e+00 2.32733e+02 125.705 -7.78159e+00 1.08272e+01  0.00000e+00 0.00000e+00 3.76735e+01 125.705 1.95060e+02 305.705 0.9617 
1 1 1 8   32  0  o 18 1.59445e+01 5.23926e-01 1.91356e+02 133.017 -3.59417e+00 3.85198e+00  0.00000e+00 0.00000e+00 3.49290e+02 133.017 1.57934e+02 133.017 0.8993 
1 1 1 8   32  1  o 11 1.74698e+01 6.61241e-01 3.09349e+02 101.432 -2.24854e+00 1.11198e+01  0.00000e+00 0.00000e+00 3.19828e+02 101.432 1.04795e+01 101.432 0.9549 
1 1 1 8   32  2  o 14 2.96906e+01 6.52948e-01 5.78711e+02 48.930  2.35533e+01  2.70281e+01  0.00000e+00 0.00000e+00 5.25679e+02 48.930  5.30318e+01 228.930 0.9860 
1 1 1 8   32  3  f 0  1.17614e+01 6.50403e-01 7.28364e+01 17.098  1.81335e+00  5.57777e-01  0.00000e+00 0.00000e+00 2.29007e+02 17.098  1.56171e+02 17.098  0.6801 
1 1 1 8   32  4  o 6  1.32855e+01 8.38847e-01 1.35556e+02 141.211 -3.69446e+00 2.96925e+00  0.00000e+00 0.00000e+00 3.09135e+02 141.211 1.73579e+02 141.211 0.8870 
1 1 1 8   32  5  o 3  4.43020e+01 8.80535e-01 7.47761e+02 271.815 3.09936e+00  -9.78212e+01 0.00000e+00 0.00000e+00 9.15581e+02 271.815 1.67821e+02 271.815 0.9949 
1 1 1 8   32  6  o 18 8.35333e+00 1.27937e+00 1.04982e+02 105.161 -7.02852e-01 2.59381e+00  0.00000e+00 0.00000e+00 1.42143e+02 105.161 3.71615e+01 105.161 0.7839 
1 1 1 8   32  7  o 2  1.31855e+01 8.79371e-01 3.97382e+02 45.701  1.51699e+01  1.55457e+01  0.00000e+00 0.00000e+00 8.85864e+01 45.701  3.08795e+02 225.701 0.9767 
1 1 1 8   32  8  o 5  1.01692e+01 1.27016e+00 1.60054e+02 66.068  3.18622e+00  7.17938e+00  0.00000e+00 0.00000e+00 1.98304e+02 66.068  3.82495e+01 66.068  0.9340 
1 1 1 8   32  9  o 14 6.13195e+00 1.54928e+00 6.11239e+01 115.501 -8.99914e-01 1.88660e+00  0.00000e+00 0.00000e+00 1.03584e+02 115.501 4.24600e+01 115.501 0.7121 
1 1 1 8   32  10 o 5  1.05998e+01 1.68907e+00 1.91826e+02 57.063  6.78366e+00  1.04711e+01  0.00000e+00 0.00000e+00 1.91556e+02 57.063  2.70510e-01 237.063 0.9590 
1 1 1 8   32  11 f 0  6.25944e+00 1.74052e+00 6.49308e+01 159.568 -2.63986e+00 9.83450e-01  0.00000e+00 0.00000e+00 1.22797e+02 159.568 5.78664e+01 159.568 0.7955 
1 1 1 8   32  12 o 15 6.21819e+00 1.68861e+00 3.66673e+01 12.209  1.82499e+00  3.94875e-01  0.00000e+00 0.00000e+00 1.21449e+02 12.209  8.47815e+01 12.209  0.6747 
1 1 1 8   32  13 o 13 5.77349e+00 1.55291e+00 6.01556e+01 143.910 -2.65765e+00 1.93726e+00  0.00000e+00 0.00000e+00 1.20199e+02 143.910 6.00433e+01 143.910 0.8293 
1 1 1 8   32  14 o 16 6.25185e+00 1.78380e+00 8.27095e+01 173.668 -4.73268e+00 5.25182e-01  0.00000e+00 0.00000e+00 1.26210e+02 173.668 4.35009e+01 173.668 0.8875 
1 1 1 8   33  0  o 6  1.27781e+01 5.35333e-01 2.25195e+02 268.985 -1.07655e-01 -6.07453e+00 0.00000e+00 0.00000e+00 2.14917e+02 268.985 1.02775e+01 88.985  0.9135 
1 1 1 8   33  1  f 0  1.28216e+01 6.04605e-01 3.42372e+02 216.083 -7.43548e+00 -5.41865e+00 0.00000e+00 0.00000e+00 1.14099e+02 216.083 2.28273e+02 36.083  0.9440 
1 1 1 8   33  2  o 17 1.90396e+01 5.67138e-01 3.28865e+02 5.142   1.36096e+01  1.22460e+00  0.00000e+00 0.00000e+00 3.62568e+02 5.142   3.37029e+01 5.142   0.9627 
1 1 1 8   33  3  o 2  2.42253e+01 6.29138e-01 4.70120e+02 58.070  1.47249e+01  2.36290e+01  0.00000e+00 0.00000e+00 4.27324e+02 58.070  4.27959e+01 238.070 0.9819 
1 1 1 8   33  4  o 15 2.19855e+01 6.44351e-01 4.51760e+02 234.521 -1.50430e+01 -2.11060e+01 0.00000e+00 0.00000e+00 3.61668e+02 234.521 9.00918e+01 54.521  0.9805 
1 1 1 8   33  5  o 9  2.83828e+01 7.20636e-01 5.57565e+02 296.294 2.00015e+01  -4.04814e+01 0.00000e+00 0.00000e+00 5.01544e+02 296.294 5.60212e+01 116.294 0.9889 
1 1 1 8   33  6  o 18 1.53421e+01 7.79265e-01 2.67719e+02 46.087  1.00139e+01  1.04012e+01  0.00000e+00 0.00000e+00 2.90790e+02 46.087  2.30712e+01 46.087  0.9647 
1 1 1 8   33  7  o 2  1.04049e+01 1.03831e+00 1.43117e+02 70.981  2.02026e+00  5.86099e+00  0.00000e+00 0.00000e+00 2.16247e+02 70.981  7.31296e+01 70.981  0.9154 
1 1 1 8   33  8  o 10 1.53696e+01 1.05370e+00 3.24276e+02 293.290 1.08819e+01  -2.52798e+01 0.00000e+00 0.00000e+00 2.44937e+02 293.290 7.93392e+01 113.290 0.9817 
1 1 1 8   33  9  o 1  6.80784e+00 1.50911e+00 1.42737e+02 247.467 -2.19493e+00 -5.29052e+00 0.00000e+00 0.00000e+00 9.04040e+01 247.467 5.23329e+01 67.467  0.9079 
1 1 1 8   33  10 o 1  5.63184e+00 1.65782e+00 1.38146e+02 119.700 -2.41626e+00 4.23607e+00  0.00000e+00 0.00000e+00 5.09631e+01 119.700 8.71825e+01 299.700 0.8904 
1 1 1 8   33  11 o 3  1.07863e+01 1.76353e+00 2.33671e+02 318.181 1.28663e+01  -1.15113e+01 0.00000e+00 0.00000e+00 1.60993e+02 318.181 7.26785e+01 138.181 0.9706 
1 1 1 8   33  12 o 17 5.49583e+00 1.46847e+00 1.09345e+02 110.057 -1.81366e+00 4.96751e+00  0.00000e+00 0.00000e+00 7.69769e+01 110.057 3.23681e+01 290.057 0.8997 
1 1 1 8   33  13 o 17 6.50389e+00 1.67039e+00 1.61101e+02 169.445 -9.12952e+00 1.70121e+00  0.00000e+00 0.00000e+00 7.02885e+01 169.445 9.08121e+01 349.444 0.9445 
1 1 1 8   33  14 o 19 1.12115e+01 2.07555e+00 2.16484e+02 69.403  6.33799e+00  1.68647e+01  0.00000e+00 0.00000e+00 1.93719e+02 69.403  2.27648e+01 249.403 0.9718 
1 1 1 8   34  0  o 18 3.13291e+01 8.58982e-01 6.61896e+02 91.965  -1.46842e+00 4.27904e+01  0.00000e+00 0.00000e+00 5.05333e+02 91.965  1.56563e+02 271.965 0.9883 
1 1 1 8   34  1  o 3  1.55751e+01 6.15576e-01 3.75103e+02 202.197 -1.13019e+01 -4.61164e+00 0.00000e+00 0.00000e+00 1.87651e+02 202.197 1.87452e+02 22.197  0.9581 
1 1 1 8   34  2  o 9  2.96026e+01 6.57936e-01 4.91087e+02 321.077 2.51109e+01  -2.02784e+01 0.00000e+00 0.00000e+00 6.08079e+02 321.077 1.16992e+02 321.077 0.9844 
1 1 1 8   34  3  o 17 2.62939e+01 7.52399e-01 4.94058e+02 280.833 5.83140e+00  -3.04724e+01 0.00000e+00 0.00000e+00 4.81790e+02 280.833 1.22675e+01 100.833 0.9837 
1 1 1 8   34  4  o 5  1.69060e+01 6.75865e-01 2.42227e+02 157.109 -1.03222e+01 4.35830e+00  0.00000e+00 0.00000e+00 3.66474e+02 157.109 1.24248e+02 157.109 0.9543 
1 1 1 8   34  5  o 17 2.36367e+01 6.87076e-01 3.84104e+02 242.836 -1.33027e+01 -2.59243e+01 0.00000e+00 0.00000e+00 4.92314e+02 242.836 1.08210e+02 242.836 0.9827 
1 1 1 8   34  6  o 9  2.32972e+01 7.31509e-01 3.06072e+02 272.008 8.79367e-01  -2.50746e+01 0.00000e+00 0.00000e+00 5.55265e+02 272.008 2.49192e+02 272.008 0.9799 
1 1 1 8   34  7  o 2  1.42864e+01 8.67667e-01 1.74183e+02 51.742  6.87611e+00  8.71983e+00  0.00000e+00 0.00000e+00 3.39948e+02 51.742  1.65765e+02 51.742  0.9539 
1 1 1 8   34  8  o 14 4.66999e+00 1.34402e+00 1.49058e+02 354.495 3.44308e+00  -3.31837e-01 0.00000e+00 0.00000e+00 1.26437e+00 174.495 1.50323e+02 174.495 0.8389 
1 1 1 8   34  9  o 12 5.64696e+00 1.44849e+00 1.18850e+02 5.711   4.00675e+00  4.00737e-01  0.00000e+00 0.00000e+00 6.52814e+01 5.711   5.35685e+01 185.711 0.8645 
1 1 1 8   34  10 o 8  1.88533e+01 1.22315e+00 4.32600e+02 318.373 4.68004e+01  -4.15906e+01 0.00000e+00 0.00000e+00 2.72588e+02 318.373 1.60013e+02 138.373 0.9920 
1 1 1 8   34  11 o 14 5.09536e+00 1.59193e+00 1.09562e+02 74.556  1.13562e+00  4.11059e+00  0.00000e+00 0.00000e+00 5.81068e+01 74.556  5.14556e+01 254.556 0.8730 
1 1 1 8   34  12 o 4  4.10071e+00 1.30170e+00 6.39709e+01 237.592 -1.33808e+00 -2.10784e+00 0.00000e+00 0.00000e+00 5.41765e+01 237.592 9.79445e+00 57.592  0.7646 
1 1 1 8   34  13 o 7  5.72098e+00 1.60845e+00 1.25291e+02 346.833 6.33197e+00  -1.48131e+00 0.00000e+00 0.00000e+00 7.28403e+01 346.833 5.24511e+01 166.833 0.9195 
1 1 1 8   34  14 o 8  5.17936e+00 1.62726e+00 1.03574e+02 334.871 4.99196e+00  -2.34152e+00 0.00000e+00 0.00000e+00 7.26971e+01 334.871 3.08771e+01 154.871 0.9041 
1 1 1 8   35  0  o 9  2.07022e+01 5.50371e-01 3.24095e+02 343.377 1.34662e+01  -4.02038e+00 0.00000e+00 0.00000e+00 4.28005e+02 343.377 1.03910e+02 343.377 0.9637 
1 1 1 8   35  1  o 16 3.99246e+01 8.64657e-01 6.86847e+02 319.382 4.46102e+01  -3.82600e+01 0.00000e+00 0.00000e+00 8.05742e+02 319.382 1.18895e+02 319.382 0.9915 
1 1 1 8   35  2  f 0  5.53365e+00 9.51447e-01 2.16624e+02 114.295 -1.06985e+00 2.37002e+00  0.00000e+00 0.00000e+00 5.47748e+01 294.295 2.71399e+02 294.295 0.7755 
1 1 1 8   35  3  f 0  2.66014e+01 6.46407e-01 4.05644e+02 254.753 -7.59317e+00 -2.78580e+01 0.00000e+00 0.00000e+00 5.80295e+02 254.753 1.74651e+02 254.753 0.9825 
1 1 1 8   35  4  o 15 5.14298e+00 1.05611e+00 1.93476e+02 272.015 9.46104e-02  -2.68850e+00 0.00000e+00 0.00000e+00 4.13215e+01 92.015  2.34797e+02 92.015  0.7842 
1 1 1 8   35  5  o 12 2.27308e+01 9.31397e-01 2.19190e+02 173.064 -1.49811e+01 1.82242e+00  0.00000e+00 0.00000e+00 6.09488e+02 173.064 3.90298e+02 173.064 0.9663 
1 1 1 8   35  6  o 12 1.88327e+01 7.34835e-01 3.73841e+02 101.371 -4.74778e+00 2.36072e+01  0.00000e+00 0.00000e+00 3.21763e+02 101.371 5.20776e+01 281.371 0.9790 
1 1 1 8   35  7  o 9  1.13775e+01 9.78473e-01 2.67212e+02 252.411 -4.01583e+00 -1.26676e+01 0.00000e+00 0.00000e+00 1.45525e+02 252.411 1.21687e+02 72.411  0.9616 
1 1 1 8   35  8  o 5  4.47641e+00 1.32313e+00 1.35401e+02 301.010 1.55475e+00  -2.58654e+00 0.00000e+00 0.00000e+00 1.58659e+00 301.010 1.33814e+02 121.010 0.8113 
1 1 1 8   35  9  o 4  4.06481e+00 1.25107e+00 7.86181e+01 335.304 1.86253e+00  -8.56514e-01 0.00000e+00 0.00000e+00 2.95803e+01 335.304 4.90378e+01 155.304 0.7058 
1 1 1 8   35  10 o 11 1.30068e+01 1.48328e+00 1.52619e+02 142.093 -1.08984e+01 8.48640e+00  0.00000e+00 0.00000e+00 3.19675e+02 142.093 1.67057e+02 142.093 0.9631 
1 1 1 8   35  11 o 2  5.92205e+00 1.28408e+00 3.01495e+01 229.987 -9.76265e-01 -1.16294e+00 0.00000e+00 0.00000e+00 1.03919e+02 229.987 7.37692e+01 229.987 0.6006 
1 1 1 8   35  12 o 3  1.17972e+01 1.49484e+00 1.26516e+02 126.359 -8.19285e+00 1.11290e+01  0.00000e+00 0.00000e+00 3.01564e+02 126.359 1.75048e+02 126.359 0.9631 
1 1 1 8   35  13 f 0  5.61295e+00 1.63128e+00 6.57056e+01 83.387  4.12921e-01  3.56154e+00  0.00000e+00 0.00000e+00 1.13006e+02 83.387  4.73005e+01 83.387  0.8454 
1 1 1 8   35  14 o 8  6.31205e+00 1.80946e+00 9.45396e+01 131.506 -3.62251e+00 4.09359e+00  0.00000e+00 0.00000e+00 1.20048e+02 131.506 2.55081e+01 131.506 0.9032 
1 1 1 8   36  0  f 0  3.15508e+01 6.63175e-01 5.61119e+02 330.256 3.33373e+01  -1.90491e+01 0.00000e+00 0.00000e+00 6.12527e+02 330.256 5.14084e+01 330.256 0.9869 
1 1 1 8   36  1  o 9  2.79710e+01 7.05085e-01 5.30725e+02 215.568 -2.67131e+01 -1.91024e+01 0.00000e+00 0.00000e+00 5.07704e+02 215.568 2.30201e+01 35.568  0.9847 
1 1 1 8   36  2  o 4  1.66541e+01 5.74028e-01 2.61922e+02 235.769 -6.00960e+00 -8.83271e+00 0.00000e+00 0.00000e+00 3.35984e+02 235.769 7.40629e+01 235.769 0.9520 
1 1 1 8   36  3  o 11 3.62344e+01 7.48198e-01 6.47629e+02 185.393 -6.06117e+01 -5.72189e+00 0.00000e+00 0.00000e+00 7.07818e+02 185.393 6.01888e+01 185.393 0.9918 
1 1 1 8   36  4  o 10 2.17239e+01 6.56464e-01 2.91666e+02 162.323 -1.82298e+01 5.80977e+00  0.00000e+00 0.00000e+00 5.06112e+02 162.323 2.14445e+02 162.323 0.9735 
1 1 1 8   36  5  o 11 1.57482e+01 7.17506e-01 3.59033e+02 84.996  1.51898e+00  1.73491e+01  0.00000e+00 0.00000e+00 2.17747e+02 84.996  1.41286e+02 264.996 0.9709 
1 1 1 8   36  6  f 0  1.37587e+01 8.28520e-01 2.80247e+01 289.062 4.82504e-01  -1.39635e+00 0.00000e+00 0.00000e+00 2.78459e+02 289.062 2.50435e+02 289.062 0.5905 
1 1 1 8   36  7  o 19 2.50838e+01 9.13302e-01 3.44008e+02 91.615  -1.13113e+00 4.01152e+01  0.00000e+00 0.00000e+00 5.90323e+02 91.615  2.46315e+02 91.615  0.9875 
1 1 1 8   36  8  o 8  7.21765e+00 1.42604e+00 1.66526e+02 28.711  5.14618e+00  2.81875e+00  0.00000e+00 0.00000e+00 8.12654e+01 28.711  8.52603e+01 208.711 0.9103 
1 1 1 8   36  9  f 0  7.64875e+00 1.70778e+00 2.15497e+02 133.607 -6.17461e+00 6.48239e+00  0.00000e+00 0.00000e+00 5.63086e+01 133.607 1.59188e+02 313.607 0.9424 
1 1 1 8   36  10 o 11 2.10532e+01 1.17595e+00 4.23679e+02 327.846 5.88053e+01  -3.69662e+01 0.00000e+00 0.00000e+00 3.64274e+02 327.846 5.94055e+01 147.846 0.9928 
1 1 1 8   36  11 o 6  4.32581e+00 1.37329e+00 9.93592e+01 260.122 -6.30021e-01 -3.61796e+00 0.00000e+00 0.00000e+00 3.91530e+01 260.122 6.02062e+01 80.122  0.8496 
1 1 1 8   36  12 o 11 3.80078e+00 1.24997e+00 8.47555e+01 66.888  1.28174e+00  3.00327e+00  0.00000e+00 0.00000e+00 3.37792e+01 66.888  5.09762e+01 246.888 0.8278 
1 1 1 8   36  13 o 7  4.75692e+00 1.48857e+00 3.51530e+01 232.758 -1.05320e+00 -1.38544e+00 0.00000e+00 0.00000e+00 8.13114e+01 232.758 4.61584e+01 232.758 0.6502 
1 1 1 8   36  14 o 4  4.64802e+00 1.51473e+00 7.72107e+01 330.210 3.29192e+00  -1.88457e+00 0.00000e+00 0.00000e+00 7.23742e+01 330.210 4.83650e+00 150.210 0.8551 
1 1 1 8   37  0  o 16 2.37239e+01 5.80133e-01 3.20674e+02 331.991 1.49481e+01  -7.95119e+00 0.00000e+00 0.00000e+00 5.46634e+02 331.991 2.25960e+02 331.991 0.9700 
1 1 1 8   37  1  o 15 2.87844e+01 7.23699e-01 5.04493e+02 163.751 -3.39469e+01 9.89372e+00  0.00000e+00 0.00000e+00 5.65222e+02 163.751 6.07299e+01 163.751 0.9858 
1 1 1 8   37  2  o 17 2.18262e+01 5.91944e-01 5.32732e+02 297.297 1.28440e+01  -2.48875e+01 0.00000e+00 0.00000e+00 2.75474e+02 297.297 2.57258e+02 117.297 0.9820 
1 1 1 8   37  3  o 9  5.62229e+01 1.02583e+00 9.91710e+02 66.982  5.50987e+01  1.29693e+02  0.00000e+00 0.00000e+00 1.12120e+03 66.982  1.29494e+02 66.982  0.9964 
1 1 1 8   37  4  o 10 2.34484e+01 6.50619e-01 4.40385e+02 167.060 -2.89219e+01 6.64517e+00  0.00000e+00 0.00000e+00 4.29038e+02 167.060 1.13469e+01 347.060 0.9830 
1 1 1 8   37  5  o 8  2.04978e+01 7.15078e-01 4.22093e+02 252.662 -8.17988e+00 -2.62015e+01 0.00000e+00 0.00000e+00 3.36887e+02 252.662 8.52068e+01 72.662  0.9816 
1 1 1 8   37  6  o 18 3.25550e+01 7.84339e-01 4.66340e+02 321.930 5.04583e+01  -3.95221e+01 0.00000e+00 0.00000e+00 7.52031e+02 321.930 2.85691e+02 321.930 0.9922 
1 1 1 8   37  7  o 6  6.63766e+00 1.45198e+00 1.23244e+02 189.918 -3.30028e+00 -5.77045e-01 0.00000e+00 0.00000e+00 8.52747e+01 189.918 3.79695e+01 9.918   0.8329 
1 1 1 8   37  8  f 0  9.68090e+00 1.34438e+00 1.01360e+02 38.295  4.05266e+00  3.19998e+00  0.00000e+00 0.00000e+00 2.26143e+02 38.295  1.24782e+02 38.295  0.8970 
1 1 1 8   37  9  o 15 1.69856e+01 1.18921e+00 3.36065e+02 70.583  1.27662e+01  3.62176e+01  0.00000e+00 0.00000e+00 2.95984e+02 70.583  4.00813e+01 250.583 0.9869 
1 1 1 8   37  10 f 0  1.51966e+01 1.35681e+00 3.35627e+02 318.238 2.89904e+01  -2.58859e+01 0.00000e+00 0.00000e+00 2.29797e+02 318.238 1.05830e+02 138.238 0.9871 
1 1 1 8   37  11 o 7  5.80956e+00 1.42875e+00 1.75526e+02 74.196  2.20488e+00  7.79000e+00  0.00000e+00 0.00000e+00 2.93936e+01 74.196  1.46133e+02 254.196 0.9360 
1 1 1 8   37  12 o 13 1.24161e+01 1.36438e+00 2.71714e+02 140.857 -2.63642e+01 2.14582e+01  0.00000e+00 0.00000e+00 1.89056e+02 140.857 8.26579e+01 320.857 0.9852 
1 1 1 8   37  13 o 15 5.22267e+00 1.57556e+00 1.29430e+02 11.124  6.58607e+00  1.29503e+00  0.00000e+00 0.00000e+00 5.19108e+01 11.124  7.75193e+01 191.124 0.9222 
1 1 1 8   37  14 o 18 3.98010e+00 1.36528e+00 5.36786e+01 35.842  2.12015e+00  1.53146e+00  0.00000e+00 0.00000e+00 6.27028e+01 35.842  9.02419e+00 35.842  0.7770 
1 1 1 8   38  0  o 12 1.99257e+01 6.14877e-01 4.31533e+02 57.042  1.14571e+01  1.76705e+01  0.00000e+00 0.00000e+00 3.01318e+02 57.042  1.30215e+02 237.042 0.9760 
1 1 1 8   38  1  o 12 1.41724e+01 7.03502e-01 3.17889e+02 143.308 -8.66277e+00 6.45516e+00  0.00000e+00 0.00000e+00 1.90993e+02 143.308 1.26896e+02 323.308 0.9525 
1 1 1 8   38  2  o 3  2.81346e+01 6.43344e-01 5.91629e+02 63.609  1.97694e+01  3.98404e+01  0.00000e+00 0.00000e+00 4.57184e+02 63.609  1.34444e+02 243.609 0.9887 
1 1 1 8   38  3  o 12 2.33880e+01 6.27852e-01 4.83956e+02 254.884 -8.08847e+00 -2.99431e+01 0.00000e+00 0.00000e+00 3.83694e+02 254.884 1.00262e+02 74.884  0.9837 
1 1 1 8   38  4  o 14 2.35166e+01 7.70380e-01 3.91336e+02 106.860 -7.56678e+00 2.49675e+01  0.00000e+00 0.00000e+00 4.78433e+02 106.860 8.70971e+01 106.860 0.9806 
1 1 1 8   38  5  o 3  3.06748e+01 7.37203e-01 4.90263e+02 297.296 2.25080e+01  -4.36153e+01 0.00000e+00 0.00000e+00 6.54854e+02 297.296 1.64591e+02 297.296 0.9898 
1 1 1 8   38  6  o 13 2.16237e+01 7.47675e-01 2.22251e+02 338.693 1.88951e+01  -7.36943e+00 0.00000e+00 0.00000e+00 5.72952e+02 338.693 3.50701e+02 338.693 0.9750 
1 1 1 8   38  7  o 5  1.08860e+01 1.24024e+00 2.43837e+02 46.443  8.34820e+00  8.77971e+00  0.00000e+00 0.00000e+00 1.49388e+02 46.443  9.44491e+01 226.443 0.9578 
1 1 1 8   38  8  o 4  5.51835e+00 1.42322e+00 1.74349e+02 61.286  2.41975e+00  4.41728e+00  0.00000e+00 0.00000e+00 1.17300e+01 61.286  1.62619e+02 241.286 0.8942 
1 1 1 8   38  9  o 13 1.68282e+01 1.16719e+00 1.96836e+02 282.166 5.06259e+00  -2.34824e+01 0.00000e+00 0.00000e+00 4.24258e+02 282.166 2.27422e+02 282.166 0.9790 
1 1 1 8   38  10 o 14 1.08229e+01 1.55127e+00 7.91068e+01 184.601 -6.00283e+00 -4.83035e-01 0.00000e+00 0.00000e+00 2.93213e+02 184.601 2.14106e+02 184.601 0.9127 
1 1 1 8   38  11 o 11 1.05251e+01 1.44650e+00 2.41828e+02 220.610 -1.61722e+01 -1.38659e+01 0.00000e+00 0.00000e+00 1.45330e+02 220.610 9.64975e+01 40.610  0.9762 
1 1 1 8   38  12 o 3  6.61731e+00 1.53325e+00 2.26509e+02 157.661 -1.28280e+01 5.27131e+00  0.00000e+00 0.00000e+00 1.35716e+01 157.661 2.12937e+02 337.661 0.9632 
1 1 1 8   38  13 o 19 1.14281e+01 1.84142e+00 2.12200e+02 325.686 1.69248e+01  -1.15511e+01 0.00000e+00 0.00000e+00 2.07418e+02 325.686 4.78150e+00 145.686 0.9753 
1 1 1 8   38  14 o 13 6.20771e+00 1.80586e+00 8.02950e+01 193.667 -4.47569e+00 -1.08836e+00 0.00000e+00 0.00000e+00 1.26054e+02 193.667 4.57592e+01 193.667 0.8834 
1 1 1 8   39  0  o 15 5.03067e+00 8.42998e-01 7.96620e+01 296.752 4.28040e-01  -8.49147e-01 0.00000e+00 0.00000e+00 1.60908e+00 296.752 7.80529e+01 116.752 0.4287 
1 1 1 8   39  1  o 2  2.64035e+01 6.13289e-01 2.19265e+02 327.596 1.17435e+01  -7.45388e+00 0.00000e+00 0.00000e+00 7.39469e+02 327.596 5.20204e+02 327.596 0.9634 
1 1 1 8   39  2  o 9  2.16614e+01 6.07196e-01 3.20159e+02 277.080 2.23527e+00  -1.79967e+01 0.00000e+00 0.00000e+00 4.73649e+02 277.080 1.53490e+02 277.080 0.9720 
1 1 1 8   39  3  o 10 3.56661e+01 7.43013e-01 7.04687e+02 296.591 3.12438e+01  -6.24162e+01 0.00000e+00 0.00000e+00 6.30512e+02 296.591 7.41757e+01 116.591 0.9928 
1 1 1 8   39  4  o 5  2.17504e+01 7.97503e-01 4.05763e+02 114.387 -1.15467e+01 2.54704e+01  0.00000e+00 0.00000e+00 3.99670e+02 114.387 6.09298e+00 294.387 0.9820 
1 1 1 8   39  5  o 16 3.60230e+01 7.94538e-01 5.83118e+02 137.237 -5.39519e+01 4.98959e+01  0.00000e+00 0.00000e+00 7.66147e+02 137.237 1.83029e+02 137.237 0.9932 
1 1 1 8   39  6  o 2  1.87113e+01 7.52746e-01 4.45369e+02 293.755 1.45637e+01  -3.30902e+01 0.00000e+00 0.00000e+00 2.50454e+02 293.755 1.94915e+02 113.755 0.9861 
1 1 1 8   39  7  o 16 3.00136e+01 9.30302e-01 5.90668e+02 201.500 -8.54323e+01 -3.36520e+01 0.00000e+00 0.00000e+00 5.34956e+02 201.500 5.57128e+01 21.500  0.9945 
1 1 1 8   39  8  o 1  1.73026e+01 1.02674e+00 2.73479e+02 85.733  2.21969e+00  2.97508e+01  0.00000e+00 0.00000e+00 3.67879e+02 85.733  9.43994e+01 85.733  0.9831 
1 1 1 8   39  9  o 2  7.06228e+00 1.66417e+00 1.20226e+02 216.033 -4.00261e+00 -2.91157e+00 0.00000e+00 0.00000e+00 1.17303e+02 216.033 2.92287e+00 36.033  0.8922 
1 1 1 8   39  10 o 1  5.73392e+00 1.55472e+00 1.25463e+02 229.802 -3.28958e+00 -3.89291e+00 0.00000e+00 0.00000e+00 6.80688e+01 229.802 5.73939e+01 49.802  0.8956 
1 1 1 8   39  11 o 19 1.21349e+01 1.25027e+00 2.40858e+02 212.672 -2.33476e+01 -1.49729e+01 0.00000e+00 0.00000e+00 2.08010e+02 212.672 3.28485e+01 32.672  0.9818 
1 1 1 8   39  12 o 4  7.90657e+00 1.93119e+00 1.89099e+02 52.392  6.94376e+00  9.01404e+00  0.00000e+00 0.00000e+00 9.52697e+01 52.392  9.38288e+01 232.392 0.9550 
1 1 1 8   39  13 o 3  4.60191e+00 1.49185e+00 2.95483e+01 278.798 2.15495e-01  -1.39228e+00 0.00000e+00 0.00000e+00 6.96784e+01 278.798 4.01301e+01 278.798 0.5728 
1 1 1 8   39  14 o 8  1.28179e+01 2.01774e+00 2.11237e+02 315.618 1.58389e+01  -1.55007e+01 0.00000e+00 0.00000e+00 2.60036e+02 315.618 4.87991e+01 315.618 0.9772 
1 1 1 8   40  0  o 2  1.58210e+01 5.38171e-01 2.54153e+02 237.981 -5.73963e+00 -9.17843e+00 0.00000e+00 0.00000e+00 3.13696e+02 237.981 5.95424e+01 237.981 0.9526 
1 1 1 8   40  1  o 19 1.12014e+01 6.12005e-01 2.57120e+02 325.431 6.33913e+00  -4.36794e+00 0.00000e+00 0.00000e+00 1.36580e+02 325.431 1.20539e+02 145.431 0.9326 
1 1 1 8   40  2  o 14 3.41681e+01 1.17581e+00 2.88966e+02 166.917 -2.51012e+01 5.83330e+00  0.00000e+00 0.00000e+00 9.73816e+02 166.917 6.84850e+02 166.917 0.9804 
1 1 1 8   40  3  o 5  1.06084e+01 9.31627e-01 2.14999e+02 100.799 -1.25515e+00 6.58014e+00  0.00000e+00 0.00000e+00 1.53775e+02 100.799 6.12243e+01 280.799 0.9220 
1 1 1 8   40  4  o 8  3.59557e+01 9.13726e-01 6.15680e+02 108.780 -2.15593e+01 6.34012e+01  0.00000e+00 0.00000e+00 7.29946e+02 108.780 1.14266e+02 108.780 0.9925 
1 1 1 8   40  5  o 5  1.15130e+01 8.43147e-01 1.52032e+02 50.776  3.74411e+00  4.58679e+00  0.00000e+00 0.00000e+00 2.43520e+02 50.776  9.14881e+01 50.776  0.9111 
1 1 1 8   40  6  o 6  7.21053e+00 1.46359e+00 9.83551e+01 235.004 -1.62471e+00 -2.32069e+00 0.00000e+00 0.00000e+00 1.18301e+02 235.004 1.99463e+01 235.004 0.7968 
1 1 1 8   40  7  o 1  1.10681e+01 1.20931e+00 2.65831e+02 22.747  1.44480e+01  6.05756e+00  0.00000e+00 0.00000e+00 1.37951e+02 22.747  1.27880e+02 202.747 0.9675 
1 1 1 8   40  8  o 19 7.63716e+00 1.57223e+00 2.11493e+02 53.924  5.26281e+00  7.22360e+00  0.00000e+00 0.00000e+00 5.98117e+01 53.924  1.51681e+02 233.924 0.9423 
1 1 1 8   40  9  o 5  1.20501e+01 1.49157e+00 1.68689e+02 280.035 2.34774e+00  -1.32669e+01 0.00000e+00 0.00000e+00 2.68321e+02 280.035 9.96314e+01 280.035 0.9621 
1 1 1 8   40  10 o 6  3.39467e+00 1.12985e+00 1.37017e+02 122.205 -2.07197e+00 3.28955e+00  0.00000e+00 0.00000e+00 2.71239e+01 302.205 1.64141e+02 302.205 0.8591 
1 1 1 8   40  11 o 6  1.05308e+01 1.35858e+00 2.47843e+02 91.123  -4.81009e-01 2.45437e+01  0.00000e+00 0.00000e+00 1.40701e+02 91.123  1.07142e+02 271.123 0.9794 
1 1 1 8   40  12 o 9  4.03765e+00 1.31378e+00 8.97588e+01 159.472 -3.48163e+00 1.30368e+00  0.00000e+00 0.00000e+00 3.97412e+01 159.472 5.00177e+01 339.472 0.8517 
1 1 1 8   40  13 o 2  7.85491e+00 1.97334e+00 1.38721e+02 300.021 4.27262e+00  -7.39407e+00 0.00000e+00 0.00000e+00 1.39049e+02 300.021 3.28362e-01 300.021 0.9395 
1 1 1 8   40  14 o 16 8.17047e+00 2.02163e+00 1.73994e+02 162.765 -1.07887e+01 3.34688e+00  0.00000e+00 0.00000e+00 1.19453e+02 162.765 5.45418e+01 342.765 0.9547 
1 1 1 8   41  0  o 7  3.69569e+01 8.21153e-01 4.93865e+02 280.209 8.33782e+00  -4.62995e+01 0.00000e+00 0.00000e+00 8.83528e+02 280.209 3.89662e+02 280.209 0.9893 
1 1 1 8   41  1  o 12 1.11981e+01 5.94972e-01 1.87472e+02 34.791  4.50523e+00  3.13022e+00  0.00000e+00 0.00000e+00 1.93814e+02 34.791  6.34241e+00 34.791  0.9036 
1 1 1 8   41  2  o 1  2.75177e+01 6.41626e-01 4.25595e+02 129.391 -2.08187e+01 2.53528e+01  0.00000e+00 0.00000e+00 5.95682e+02 129.391 1.70087e+02 129.391 0.9846 
1 1 1 8   41  3  o 2  2.47280e+01 6.40776e-01 4.28462e+02 80.831  4.83710e+00  2.99672e+01  0.00000e+00 0.00000e+00 4.88270e+02 80.831  5.98082e+01 80.831  0.9834 
1 1 1 8   41  4  o 2  1.55221e+01 9.17812e-01 4.22409e+02 10.461  2.00597e+01  3.70383e+00  0.00000e+00 0.00000e+00 1.48292e+02 10.461  2.74118e+02 190.461 0.9752 
1 1 1 8   41  5  o 3  5.03692e+01 9.75883e-01 8.96824e+02 144.059 -1.37420e+02 9.96260e+01  0.00000e+00 0.00000e+00 9.96734e+02 144.059 9.99095e+01 144.059 0.9970 
1 1 1 8   41  6  o 12 1.09669e+01 1.23025e+00 2.61141e+02 283.662 2.97453e+00  -1.22370e+01 0.00000e+00 0.00000e+00 1.35584e+02 283.662 1.25557e+02 103.662 0.9594 
1 1 1 8   41  7  o 18 8.40724e+00 1.29995e+00 2.11428e+02 10.182  8.78057e+00  1.57710e+00  0.00000e+00 0.00000e+00 8.72054e+01 10.182  1.24223e+02 190.182 0.9422 
1 1 1 8   41  8  o 15 6.50430e+00 1.56594e+00 1.96640e+02 135.510 -5.27103e+00 5.17803e+00  0.00000e+00 0.00000e+00 3.12956e+01 135.510 1.65345e+02 315.510 0.9296 
1 1 1 8   41  9  o 9  9.85005e+00 1.46336e+00 2.16903e+02 185.469 -1.43771e+01 -1.37654e+00 0.00000e+00 0.00000e+00 1.41243e+02 185.469 7.56606e+01 5.469   0.9647 
1 1 1 8   41  10 o 16 1.23690e+01 1.23685e+00 2.20862e+02 43.105  1.74314e+01  1.63150e+01  0.00000e+00 0.00000e+00 2.35326e+02 43.105  1.44641e+01 43.105  0.9788 
1 1 1 8   41  11 o 2  8.32680e+00 1.55542e+00 1.33495e+02 139.969 -7.25802e+00 6.09682e+00  0.00000e+00 0.00000e+00 1.63115e+02 139.969 2.96198e+01 139.969 0.9457 
1 1 1 8   41  12 o 17 1.20778e+01 1.56898e+00 2.48792e+02 343.977 2.65447e+01  -7.62286e+00 0.00000e+00 0.00000e+00 1.97660e+02 343.977 5.11328e+01 163.977 0.9817 
1 1 1 8   41  13 o 6  5.09916e+00 1.51928e+00 1.78523e+02 269.202 -1.29761e-01 -9.31135e+00 0.00000e+00 0.00000e+00 2.77287e+00 269.202 1.75750e+02 89.202  0.9447 
1 1 1 8   41  14 f 0  5.16599e+00 1.66180e+00 8.48617e+01 182.395 -4.56075e+00 -1.90793e-01 0.00000e+00 0.00000e+00 8.65775e+01 182.395 1.71586e+00 182.395 0.8822 
1 1 1 8   42  0  o 1  1.39584e+01 5.55654e-01 2.11100e+02 151.832 -7.16274e+00 3.83541e+00  0.00000e+00 0.00000e+00 2.81184e+02 151.832 7.00841e+01 151.832 0.9363 
1 1 1 8   42  1  o 5  3.09671e+01 6.65572e-01 5.07780e+02 151.038 -3.75819e+01 2.07994e+01  0.00000e+00 0.00000e+00 6.45384e+02 151.038 1.37605e+02 151.038 0.9883 
1 1 1 8   42  2  o 17 2.49024e+01 6.20922e-01 4.55061e+02 314.497 2.40003e+01  -2.44257e+01 0.00000e+00 0.00000e+00 4.69660e+02 314.497 1.45999e+01 314.497 0.9853 
1 1 1 8   42  3  o 5  3.78358e+01 7.75963e-01 6.61607e+02 354.994 7.92069e+01  -6.93853e+00 0.00000e+00 0.00000e+00 7.55603e+02 354.994 9.39958e+01 354.994 0.9937 
1 1 1 8   42  4  o 18 1.25523e+01 8.89781e-01 3.17297e+02 77.959  2.66973e+00  1.25160e+01  0.00000e+00 0.00000e+00 1.37026e+02 77.959  1.80271e+02 257.959 0.9601 
1 1 1 8   42  5  o 1  2.25560e+01 6.93517e-01 4.17268e+02 161.027 -3.79421e+01 1.30447e+01  0.00000e+00 0.00000e+00 4.22440e+02 161.027 5.17249e+00 161.027 0.9875 
1 1 1 8   42  6  o 17 1.81454e+01 8.94762e-01 3.44464e+02 324.862 2.33425e+01  -1.64285e+01 0.00000e+00 0.00000e+00 3.27527e+02 324.862 1.69372e+01 144.862 0.9823 
1 1 1 8   42  7  o 2  3.80222e+00 1.20563e+00 6.60589e+01 305.773 7.58048e-01  -1.05209e+00 0.00000e+00 0.00000e+00 1.15882e+01 305.773 5.44707e+01 125.773 0.5417 
1 1 1 8   42  8  o 17 1.27023e+01 1.31573e+00 1.81222e+02 223.422 -1.05216e+01 -9.95730e+00 0.00000e+00 0.00000e+00 2.80720e+02 223.422 9.94972e+01 223.422 0.9648 
1 1 1 8   42  9  o 1  8.50942e+00 1.65476e+00 1.60433e+02 216.225 -7.17132e+00 -5.25337e+00 0.00000e+00 0.00000e+00 1.41627e+02 216.225 1.88064e+01 36.225  0.9420 
1 1 1 8   42  10 o 2  1.32152e+01 1.10659e+00 2.23919e+02 303.678 1.48616e+01  -2.23029e+01 0.00000e+00 0.00000e+00 2.64582e+02 303.678 4.06625e+01 303.678 0.9812 
1 1 1 8   42  11 o 7  5.76201e+00 1.45532e+00 1.05128e+02 260.360 -9.37501e-01 -5.51966e+00 0.00000e+00 0.00000e+00 9.14074e+01 260.360 1.37206e+01 80.360  0.9056 
1 1 1 8   42  12 o 14 5.98093e+00 1.60064e+00 1.84066e+02 215.409 -8.40584e+00 -5.97569e+00 0.00000e+00 0.00000e+00 2.98961e+01 215.409 1.54169e+02 35.409  0.9502 
1 1 1 8   42  13 o 16 1.05017e+01 1.93855e+00 1.17409e+02 189.057 -9.94997e+00 -1.58609e+00 0.00000e+00 0.00000e+00 2.57634e+02 189.057 1.40225e+02 189.057 0.9490 
1 1 1 8   42  14 o 12 1.40286e+01 1.98959e+00 2.42869e+02 58.178  1.54803e+01  2.49460e+01  0.00000e+00 0.00000e+00 2.75723e+02 58.178  3.28534e+01 58.178  0.9828 
1 1 1 8   43  0  o 6  2.07053e+01 5.67712e-01 5.07093e+02 351.183 2.92205e+01  -4.53228e+00 0.00000e+00 0.00000e+00 2.59453e+02 351.183 2.47640e+02 171.183 0.9829 
1 1 1 8   43  1  o 4  1.17527e+01 7.60449e-01 3.10220e+02 93.817  -6.72462e-01 1.00791e+01  0.00000e+00 0.00000e+00 1.10040e+02 93.817  2.00180e+02 273.817 0.9491 
1 1 1 8   43  2  o 17 7.33740e+00 9.18369e-01 2.58667e+02 18.042  5.05786e+00  1.64754e+00  0.00000e+00 0.00000e+00 9.73322e+00 198.042 2.68400e+02 198.042 0.9003 
1 1 1 8   43  3  o 17 1.38306e+01 6.69550e-01 2.69279e+02 89.560  8.83662e-02  1.15198e+01  0.00000e+00 0.00000e+00 2.28836e+02 89.560  4.04434e+01 269.561 0.9556 
1 1 1 8   43  4  o 4  1.94994e+01 6.88295e-01 3.15958e+02 114.876 -9.15403e+00 1.97424e+01  0.00000e+00 0.00000e+00 4.01968e+02 114.876 8.60091e+01 114.876 0.9767 
1 1 1 8   43  5  o 13 3.47571e+01 7.82992e-01 5.96050e+02 137.214 -6.37900e+01 5.90415e+01  0.00000e+00 0.00000e+00 7.06601e+02 137.214 1.10551e+02 137.214 0.9942 
1 1 1 8   43  6  o 13 2.14508e+01 1.20312e+00 4.18853e+02 348.242 4.05411e+01  -8.43841e+00 0.00000e+00 0.00000e+00 3.79926e+02 348.242 3.89272e+01 168.242 0.9879 
1 1 1 8   43  7  o 19 4.77645e+00 1.36853e+00 1.43300e+02 79.285  6.65978e-01  3.51941e+00  0.00000e+00 0.00000e+00 8.88053e+00 79.285  1.34419e+02 259.285 0.8453 
1 1 1 8   43  8  o 1  5.58354e+00 1.50185e+00 2.17540e+02 313.889 4.90815e+00  -5.10230e+00 0.00000e+00 0.00000e+00 2.25942e+01 133.889 2.40134e+02 133.889 0.9264 
1 1 1 8   43  9  o 9  1.02693e+01 1.44124e+00 1.58360e+02 64.483  4.95489e+00  1.03803e+01  0.00000e+00 0.00000e+00 2.11364e+02 64.483  5.30038e+01 64.483  0.9555 
1 1 1 8   43  10 o 3  2.98531e+00 9.84450e-01 4.57982e+01 316.009 9.69796e-01  -9.36209e-01 0.00000e+00 0.00000e+00 1.67556e+01 316.009 2.90427e+01 136.009 0.5562 
1 1 1 8   43  11 o 11 4.15238e+00 1.26834e+00 1.16805e+02 106.682 -1.40906e+00 4.70213e+00  0.00000e+00 0.00000e+00 2.25577e+01 106.682 9.42470e+01 286.681 0.8912 
1 1 1 8   43  12 o 1  5.72193e+00 1.55311e+00 4.11956e+01 227.803 -1.49901e+00 -1.65336e+00 0.00000e+00 0.00000e+00 1.16558e+02 227.803 7.53623e+01 227.803 0.7324 
1 1 1 8   43  13 o 11 4.89352e+00 1.49534e+00 1.25736e+02 66.263  2.51892e+00  5.72827e+00  0.00000e+00 0.00000e+00 4.29624e+01 66.263  8.27734e+01 246.263 0.9162 
1 1 1 8   43  14 o 18 4.98648e+00 1.64166e+00 1.00714e+02 250.484 -1.75291e+00 -4.94558e+00 0.00000e+00 0.00000e+00 6.78447e+01 250.484 3.28696e+01 70.484  0.8988 
1 1 1 8   44  0  o 11 1.95659e+01 5.72748e-01 3.79438e+02 166.311 -2.18856e+01 5.33066e+00  0.00000e+00 0.00000e+00 3.40861e+02 166.311 3.85770e+01 346.311 0.9775 
1 1 1 8   44  1  o 3  2.83418e+01 6.77437e-01 4.28870e+02 68.672  1.32647e+01  3.39739e+01  0.00000e+00 0.00000e+00 6.24045e+02 68.672  1.95176e+02 68.672  0.9862 
1 1 1 8   44  2  o 11 2.43363e+01 9.90339e-01 3.16203e+02 4.895   2.38322e+01  2.04085e+00  0.00000e+00 0.00000e+00 5.81396e+02 4.895   2.65194e+02 4.895   0.9789 
1 1 1 8   44  3  o 13 1.90525e+01 6.40248e-01 3.81938e+02 167.346 -2.26576e+01 5.08703e+00  0.00000e+00 0.00000e+00 3.20436e+02 167.346 6.15024e+01 347.346 0.9782 
1 1 1 8   44  4  o 16 2.00828e+01 6.56077e-01 4.63567e+02 341.721 3.04131e+01  -1.00456e+01 0.00000e+00 0.00000e+00 2.81438e+02 341.721 1.82130e+02 161.721 0.9843 
1 1 1 8   44  5  o 5  1.41213e+01 9.19235e-01 2.17818e+02 126.785 -7.79870e+00 1.04304e+01  0.00000e+00 0.00000e+00 2.93574e+02 126.785 7.57560e+01 126.785 0.9608 
1 1 1 8   44  6  o 8  1.74680e+01 9.54448e-01 2.80810e+02 332.443 2.24484e+01  -1.17143e+01 0.00000e+00 0.00000e+00 3.64444e+02 332.443 8.36340e+01 332.443 0.9801 
1 1 1 8   44  7  o 19 4.55203e+00 1.21680e+00 9.25828e+01 43.821  1.68290e+00  1.61501e+00  0.00000e+00 0.00000e+00 3.53099e+01 43.821  5.72728e+01 223.821 0.7455 
1 1 1 8   44  8  f 0  1.00477e+01 1.45215e+00 2.51085e+02 269.563 -1.19085e-01 -1.55964e+01 0.00000e+00 0.00000e+00 1.15196e+02 269.563 1.35889e+02 89.563  0.9674 
1 1 1 8   44  9  o 6  3.52095e+00 1.10409e+00 7.82410e+01 136.178 -1.58521e+00 1.52131e+00  0.00000e+00 0.00000e+00 1.82820e+01 136.178 5.99589e+01 316.178 0.7276 
1 1 1 8   44  10 o 13 2.01492e+01 9.23530e-01 2.45825e+02 251.592 -1.52354e+01 -4.57790e+01 0.00000e+00 0.00000e+00 5.05210e+02 251.592 2.59385e+02 251.592 0.9896 
1 1 1 8   44  11 o 15 7.79348e+00 1.57022e+00 1.05340e+02 262.737 -8.67424e-01 -6.80651e+00 0.00000e+00 0.00000e+00 1.65799e+02 262.737 6.04590e+01 262.737 0.9240 
1 1 1 8   44  12 o 3  4.13186e+00 1.30944e+00 6.54862e+01 31.245  2.46771e+00  1.49716e+00  0.00000e+00 0.00000e+00 5.91210e+01 31.245  6.36526e+00 211.245 0.8012 
1 1 1 8   44  13 o 11 4.61294e+00 1.48678e+00 3.57943e+01 61.890  8.61205e-01  1.61222e+00  0.00000e+00 0.00000e+00 8.00302e+01 61.890  4.42358e+01 61.890  0.6674 
1 1 1 8   44  14 f 0  5.77889e+00 1.78720e+00 5.40545e+01 304.726 1.71309e+00  -2.47159e+00 0.00000e+00 0.00000e+00 1.22080e+02 304.726 6.80253e+01 304.726 0.8105 
1 1 1 8   45  0  o 16 4.01674e+01 7.80510e-01 5.23925e+02 32.041  5.06507e+01  3.17000e+01  0.00000e+00 0.00000e+00 9.75871e+02 32.041  4.51946e+02 32.041  0.9916 
1 1 1 8   45  1  f 0  3.23922e+01 6.94881e-01 6.99922e+02 323.719 5.20568e+01  -3.82123e+01 0.00000e+00 0.00000e+00 5.10680e+02 323.719 1.89242e+02 143.719 0.9922 
1 1 1 8   45  2  o 18 2.89488e+01 6.64521e-01 5.12438e+02 124.289 -2.58743e+01 3.79454e+01  0.00000e+00 0.00000e+00 5.66261e+02 124.289 5.38232e+01 124.289 0.9891 
1 1 1 8   45  3  o 5  2.19656e+01 6.40143e-01 3.55548e+02 22.350  2.37440e+01  9.76249e+00  0.00000e+00 0.00000e+00 4.55858e+02 22.350  1.00310e+02 22.350  0.9803 
1 1 1 8   45  4  o 14 1.13455e+01 7.64246e-01 1.12987e+02 205.493 -4.45726e+00 -2.12532e+00 0.00000e+00 0.00000e+00 2.68362e+02 205.493 1.55375e+02 205.493 0.8919 
1 1 1 8   45  5  o 7  1.47009e+01 9.23348e-01 3.42284e+02 111.532 -8.14929e+00 2.06545e+01  0.00000e+00 0.00000e+00 1.99124e+02 111.532 1.43160e+02 291.532 0.9772 
1 1 1 8   45  6  o 12 1.88409e+01 9.82498e-01 3.31901e+02 339.502 3.28455e+01  -1.22791e+01 0.00000e+00 0.00000e+00 3.67946e+02 339.502 3.60456e+01 339.502 0.9856 
1 1 1 8   45  7  f 0  1.71400e+01 9.81530e-01 4.06982e+02 229.419 -2.89184e+01 -3.37622e+01 0.00000e+00 0.00000e+00 2.31609e+02 229.419 1.75373e+02 49.419  0.9887 
1 1 1 8   45  8  o 18 1.02984e+01 1.43253e+00 2.22728e+02 318.706 1.14150e+01  -1.00263e+01 0.00000e+00 0.00000e+00 1.52306e+02 318.706 7.04224e+01 138.706 0.9665 
1 1 1 8   45  9  f 0  1.04337e+01 1.10389e+00 2.44764e+02 17.720  2.03373e+01  6.49845e+00  0.00000e+00 0.00000e+00 1.38968e+02 17.720  1.05795e+02 197.720 0.9763 
1 1 1 8   45  10 o 19 1.40265e+01 1.04624e+00 2.98450e+02 259.452 -7.49547e+00 -4.02529e+01 0.00000e+00 0.00000e+00 2.23316e+02 259.452 7.51340e+01 79.452  0.9877 
1 1 1 8   45  11 o 15 4.45695e+00 1.28180e+00 5.60547e+01 72.684  7.42697e-01  2.38220e+00  0.00000e+00 0.00000e+00 7.22268e+01 72.684  1.61721e+01 72.684  0.7645 
1 1 1 8   45  12 o 3  4.24409e+00 1.35149e+00 5.33460e+01 124.530 -1.47283e+00 2.14055e+00  0.00000e+00 0.00000e+00 7.04871e+01 124.530 1.71411e+01 124.530 0.7753 
1 1 1 8   45  13 o 13 6.25617e+00 1.72904e+00 1.33897e+02 115.698 -3.30297e+00 6.86353e+00  0.00000e+00 0.00000e+00 8.54080e+01 115.698 4.84895e+01 295.698 0.9318 
1 1 1 8   45  14 o 14 5.03909e+00 1.62454e+00 1.40442e+02 308.930 4.54757e+00  -5.62983e+00 0.00000e+00 0.00000e+00 3.54007e+01 308.930 1.05042e+02 128.930 0.9281 
1 1 1 8   46  0  o 8  2.30131e+01 6.55924e-01 4.61286e+02 250.303 -1.14944e+01 -3.21082e+01 0.00000e+00 0.00000e+00 3.92365e+02 250.303 6.89203e+01 70.303  0.9852 
1 1 1 8   46  1  o 15 2.65418e+01 6.40318e-01 3.57248e+02 150.658 -2.64968e+01 1.48951e+01  0.00000e+00 0.00000e+00 6.25771e+02 150.658 2.68523e+02 150.658 0.9834 
1 1 1 8   46  2  o 8  1.00874e+01 7.37367e-01 1.61807e+02 290.160 1.78151e+00  -4.85254e+00 0.00000e+00 0.00000e+00 1.79108e+02 290.160 1.73004e+01 290.160 0.8972 
1 1 1 8   46  3  o 15 2.78069e+00 8.83888e-01 3.59753e+01 174.104 -3.44090e-01 3.55350e-02  0.00000e+00 0.00000e+00 1.81206e+01 354.104 5.40959e+01 354.104 0.1704 
1 1 1 8   46  4  o 1  1.67879e+01 6.63794e-01 3.90249e+02 338.226 2.59646e+01  -1.03712e+01 0.00000e+00 0.00000e+00 2.30909e+02 338.226 1.59341e+02 158.226 0.9820 
1 1 1 8   46  5  o 17 1.05690e+01 1.07145e+00 1.23587e+02 197.408 -5.63890e+00 -1.76796e+00 0.00000e+00 0.00000e+00 2.39205e+02 197.408 1.15618e+02 197.408 0.9109 
1 1 1 8   46  6  o 12 1.09170e+01 1.19282e+00 1.16615e+02 1.151   6.55515e+00  1.31665e-01  0.00000e+00 0.00000e+00 2.61937e+02 1.151   1.45321e+02 1.151   0.9202 
1 1 1 8   46  7  o 12 7.63426e+00 1.44710e+00 1.13584e+02 125.991 -2.93400e+00 4.03956e+00  0.00000e+00 0.00000e+00 1.43349e+02 125.991 2.97653e+01 125.991 0.8932 
1 1 1 8   46  8  f 0  1.22635e+01 1.27454e+00 4.33306e+02 134.500 -2.48091e+01 2.52455e+01  0.00000e+00 0.00000e+00 2.21330e+01 134.500 4.11173e+02 314.500 0.9858 
1 1 1 8   46  9  o 19 5.56003e+00 1.31590e+00 8.64118e+01 292.832 1.45465e+00  -3.45505e+00 0.00000e+00 0.00000e+00 9.22534e+01 292.832 5.84157e+00 292.832 0.8531 
1 1 1 8   46  10 o 11 1.55318e+01 1.00220e+00 2.62485e+02 252.476 -1.15133e+01 -3.64628e+01 0.00000e+00 0.00000e+00 3.14694e+02 252.476 5.22092e+01 252.476 0.9868 
1 1 1 8   46  11 o 4  4.86073e+00 1.42319e+00 1.75504e+02 116.089 -3.66670e+00 7.48825e+00  0.00000e+00 0.00000e+00 3.87516e+00 296.089 1.79379e+02 296.089 0.9380 
1 1 1 8   46  12 o 10 3.81088e+00 1.24168e+00 5.42939e+01 233.176 -1.48692e+00 -1.98589e+00 0.00000e+00 0.00000e+00 5.51096e+01 233.176 8.15722e-01 233.176 0.7629 
1 1 1 8   46  13 o 14 5.33720e+00 1.61278e+00 6.84239e+01 107.733 -1.15268e+00 3.60465e+00  0.00000e+00 0.00000e+00 1.03157e+02 107.733 3.47334e+01 107.733 0.8547 
1 1 1 8   46  14 o 14 5.89324e+00 1.78507e+00 1.34268e+02 359.185 7.69633e+00  -1.09449e-01 0.00000e+00 0.00000e+00 7.23498e+01 359.185 6.19180e+01 179.185 0.9326 
1 1 1 8   47  0  o 2  2.65519e+01 6.21073e-01 6.12266e+02 204.842 -4.58198e+01 -2.12125e+01 0.00000e+00 0.00000e+00 3.77346e+02 204.842 2.34920e+02 24.842  0.9900 
1 1 1 8   47  1  o 1  1.07651e+01 9.69650e-01 1.48657e+02 281.118 9.56511e-01  -4.86707e+00 0.00000e+00 0.00000e+00 2.13122e+02 281.118 6.44648e+01 281.118 0.8925 
1 1 1 8   47  2  o 6  2.65961e+01 6.52712e-01 4.23694e+02 294.781 1.55123e+01  -3.36011e+01 0.00000e+00 0.00000e+00 5.64428e+02 294.781 1.40733e+02 294.781 0.9864 
1 1 1 8   47  3  o 1  1.91744e+01 6.29329e-01 2.60128e+02 174.712 -1.71057e+01 1.58337e+00  0.00000e+00 0.00000e+00 4.40855e+02 174.712 1.80727e+02 174.712 0.9704 
1 1 1 8   47  4  o 12 1.51396e+01 6.97641e-01 2.55995e+02 5.925   1.62964e+01  1.69122e+00  0.00000e+00 0.00000e+00 2.96709e+02 5.925   4.07139e+01 5.925   0.9690 
1 1 1 8   47  5  o 14 2.40973e+01 8.31241e-01 4.42576e+02 69.171  1.74160e+01  4.57787e+01  0.00000e+00 0.00000e+00 4.56032e+02 69.171  1.34560e+01 69.171  0.9897 
1 1 1 8   47  6  o 3  2.30026e+01 9.71407e-01 2.52895e+02 44.884  2.23830e+01  2.22927e+01  0.00000e+00 0.00000e+00 5.99946e+02 44.884  3.47051e+02 44.884  0.9840 
1 1 1 8   47  7  o 18 2.15743e+01 9.69710e-01 3.22690e+02 265.385 -3.86917e+00 -4.79339e+01 0.00000e+00 0.00000e+00 4.81606e+02 265.385 1.58916e+02 265.385 0.9895 
1 1 1 8   47  8  o 5  4.97663e+00 1.38062e+00 9.93137e+01 99.045  -5.35614e-01 3.36447e+00  0.00000e+00 0.00000e+00 5.74231e+01 99.045  4.18906e+01 279.045 0.8361 
1 1 1 8   47  9  o 11 1.05388e+01 1.13522e+00 2.77986e+02 330.251 2.12299e+01  -1.21336e+01 0.00000e+00 0.00000e+00 1.10721e+02 330.251 1.67265e+02 150.251 0.9793 
1 1 1 8   47  10 o 3  5.01725e+00 1.35842e+00 1.08886e+02 72.964  1.39142e+00  4.54099e+00  0.00000e+00 0.00000e+00 5.87198e+01 72.964  5.01659e+01 252.964 0.8872 
1 1 1 8   47  11 o 8  4.70102e+00 1.41352e+00 8.29203e+01 111.414 -1.40289e+00 3.57719e+00  0.00000e+00 0.00000e+00 6.87541e+01 111.414 1.41662e+01 291.414 0.8572 
1 1 1 8   47  12 o 11 5.11521e+00 1.49337e+00 1.09682e+02 288.200 1.82561e+00  -5.55272e+00 0.00000e+00 0.00000e+00 6.54370e+01 288.200 4.42449e+01 108.200 0.9099 
1 1 1 8   47  13 o 17 1.10988e+01 1.86529e+00 2.18702e+02 11.262  2.12541e+01  4.23238e+00  0.00000e+00 0.00000e+00 1.88967e+02 11.262  2.97348e+01 191.262 0.9766 
1 1 1 8   47  14 o 15 4.49837e+00 1.48306e+00 4.06000e+01 107.463 -6.43777e-01 2.04645e+00  0.00000e+00 0.00000e+00 8.11906e+01 107.463 4.05906e+01 107.463 0.7203 
1 1 1 8   48  0  o 8  1.88134e+01 6.63966e-01 3.26431e+02 332.052 1.72839e+01  -9.16995e+00 0.00000e+00 0.00000e+00 3.63376e+02 332.052 3.69448e+01 332.052 0.9741 
1 1 1 8   48  1  o 18 2.20365e+01 6.01528e-01 3.83159e+02 76.104  6.69625e+00  2.70657e+01  0.00000e+00 0.00000e+00 4.31533e+02 76.104  4.83738e+01 76.104  0.9819 
1 1 1 8   48  2  o 15 7.18294e+00 9.42265e-01 1.71333e+02 149.998 -3.65976e+00 2.11313e+00  0.00000e+00 0.00000e+00 6.44674e+01 149.998 1.06866e+02 329.998 0.8717 
1 1 1 8   48  3  o 15 2.41881e+01 6.53969e-01 5.06329e+02 84.159  5.34216e+00  5.22220e+01  0.00000e+00 0.00000e+00 3.96037e+02 84.159  1.10291e+02 264.159 0.9904 
1 1 1 8   48  4  f 0  2.75214e+01 8.86719e-01 4.10965e+02 68.370  1.85323e+01  4.67364e+01  0.00000e+00 0.00000e+00 6.15425e+02 68.370  2.04460e+02 68.370  0.9900 
1 1 1 8   48  5  o 17 8.26929e+00 1.13196e+00 1.55790e+02 31.319  5.12446e+00  3.11804e+00  0.00000e+00 0.00000e+00 1.28426e+02 31.319  2.73648e+01 211.319 0.9123 
1 1 1 8   48  6  o 14 1.85634e+01 8.10997e-01 2.45759e+02 59.836  1.36188e+01  2.34331e+01  0.00000e+00 0.00000e+00 4.40538e+02 59.836  1.94779e+02 59.836  0.9814 
1 1 1 8   48  7  o 12 1.22134e+01 1.48300e+00 2.97507e+02 279.436 3.54786e+00  -2.13475e+01 0.00000e+00 0.00000e+00 1.51804e+02 279.436 1.45704e+02 99.436  0.9766 
1 1 1 8   48  8  o 2  1.01525e+01 1.05007e+00 1.65609e+02 9.812   1.28809e+01  2.22765e+00  0.00000e+00 0.00000e+00 2.01847e+02 9.812   3.62384e+01 9.812   0.9610 
1 1 1 8   48  9  o 4  4.06630e+00 1.16141e+00 1.50708e+02 201.234 -5.14607e+00 -1.99955e+00 0.00000e+00 0.00000e+00 1.22520e+01 21.234  1.62960e+02 21.234  0.9042 
1 1 1 8   48  10 o 7  3.33461e+00 1.07585e+00 7.02067e+01 118.486 -1.19557e+00 2.20329e+00  0.00000e+00 0.00000e+00 2.59216e+01 118.486 4.42851e+01 298.485 0.7657 
1 1 1 8   48  11 o 12 8.75702e+00 1.51838e+00 1.55267e+02 154.572 -1.17373e+01 5.58036e+00  0.00000e+00 0.00000e+00 1.61359e+02 154.572 6.09245e+00 154.572 0.9607 
1 1 1 8   48  12 o 8  4.62541e+00 1.46477e+00 5.19991e+01 96.894  -3.04011e-01 2.51455e+00  0.00000e+00 0.00000e+00 8.17329e+01 96.894  2.97339e+01 96.894  0.7685 
1 1 1 8   48  13 o 1  1.22634e+01 2.03797e+00 1.68690e+02 222.248 -1.22574e+01 -1.11330e+01 0.00000e+00 0.00000e+00 2.78314e+02 222.248 1.09624e+02 222.248 0.9693 
1 1 1 8   48  14 o 1  3.79644e+00 1.31353e+00 7.68008e+01 354.706 3.96422e+00  -3.67301e-01 0.00000e+00 0.00000e+00 4.63114e+01 354.706 3.04893e+01 174.706 0.8628 
1 1 1 8   49  0  o 14 2.42219e+01 6.89119e-01 4.18913e+02 188.183 -3.28706e+01 -4.72704e+00 0.00000e+00 0.00000e+00 4.78863e+02 188.183 5.99494e+01 188.183 0.9848 
1 1 1 8   49  1  f 0  2.48438e+01 6.34557e-01 4.59096e+02 335.374 3.68135e+01  -1.68745e+01 0.00000e+00 0.00000e+00 4.64570e+02 335.374 5.47430e+00 335.374 0.9876 
1 1 1 8   49  2  o 3  2.85311e+01 6.70679e-01 4.70021e+02 101.260 -8.98426e+00 4.51258e+01  0.00000e+00 0.00000e+00 5.92587e+02 101.260 1.22566e+02 101.260 0.9891 
1 1 1 8   49  3  o 18 1.24863e+01 7.31968e-01 2.21671e+02 79.035  2.22344e+00  1.14765e+01  0.00000e+00 0.00000e+00 2.27999e+02 79.035  6.32802e+00 79.035  0.9562 
1 1 1 8   49  4  o 5  3.11492e+01 8.81562e-01 5.67974e+02 0.585   8.27302e+01  8.45169e-01  0.00000e+00 0.00000e+00 5.98173e+02 0.585   3.01988e+01 0.585   0.9939 
1 1 1 8   49  5  o 6  2.92642e+01 8.81142e-01 5.16003e+02 299.939 4.31179e+01  -7.48669e+01 0.00000e+00 0.00000e+00 5.79911e+02 299.939 6.39078e+01 299.939 0.9942 
1 1 1 8   49  6  o 12 2.72640e+01 9.34365e-01 4.44565e+02 299.098 3.47881e+01  -6.25083e+01 0.00000e+00 0.00000e+00 5.75188e+02 299.098 1.30623e+02 299.098 0.9930 
1 1 1 8   49  7  o 19 1.47755e+01 1.07073e+00 1.92024e+02 188.767 -1.85716e+01 -2.86416e+00 0.00000e+00 0.00000e+00 3.49469e+02 188.767 1.57445e+02 188.767 0.9730 
1 1 1 8   49  8  o 6  1.11449e+01 1.01535e+00 1.57964e+02 186.110 -1.43777e+01 -1.53918e+00 0.00000e+00 0.00000e+00 2.46960e+02 186.110 8.89954e+01 186.110 0.9648 
1 1 1 8   49  9  o 10 3.38923e+00 1.11224e+00 4.54371e+01 13.096  1.35513e+00  3.15253e-01  0.00000e+00 0.00000e+00 2.70579e+01 13.096  1.83792e+01 193.096 0.5681 
1 1 1 8   49  10 o 15 6.75737e+00 1.43796e+00 1.70937e+02 207.376 -9.57337e+00 -4.95732e+00 0.00000e+00 0.00000e+00 7.13235e+01 207.376 9.96134e+01 27.376  0.9524 
1 1 1 8   49  11 o 16 9.65041e+00 1.53610e+00 1.35362e+02 251.879 -3.71048e+00 -1.13381e+01 0.00000e+00 0.00000e+00 2.12213e+02 251.879 7.68517e+01 251.879 0.9571 
1 1 1 8   49  12 o 8  6.77598e+00 1.74520e+00 1.93870e+02 258.544 -2.33818e+00 -1.15382e+01 0.00000e+00 0.00000e+00 4.99350e+01 258.544 1.43935e+02 78.544  0.9565 
1 1 1 8   49  13 o 7  3.99630e+00 1.35463e+00 8.62844e+01 67.588  1.64133e+00  3.97975e+00  0.00000e+00 0.00000e+00 4.50858e+01 67.588  4.11986e+01 247.588 0.8743 
1 1 1 8   50  0  f 0  3.24692e+01 7.73935e-01 5.24552e+02 281.520 1.18945e+01  -5.83596e+01 0.00000e+00 0.00000e+00 6.86982e+02 281.520 1.62431e+02 281.520 0.9916 
1 1 1 8   50  1  o 15 1.52918e+01 6.02053e-01 3.19463e+02 85.772  1.24390e+00  1.68276e+01  0.00000e+00 0.00000e+00 2.38818e+02 85.772  8.06459e+01 265.772 0.9699 
1 1 1 8   50  2  o 13 2.07563e+01 7.24120e-01 2.98225e+02 350.431 2.59471e+01  -4.37417e+00 0.00000e+00 0.00000e+00 4.68259e+02 350.431 1.70034e+02 350.431 0.9808 
1 1 1 8   50  3  o 12 1.25134e+01 6.86559e-01 1.73002e+02 133.789 -6.53646e+00 6.81875e+00  0.00000e+00 0.00000e+00 2.72523e+02 133.789 9.95218e+01 133.789 0.9455 
1 1 1 8   50  4  o 9  1.85481e+01 8.07200e-01 2.65970e+02 295.743 9.88616e+00  -2.05028e+01 0.00000e+00 0.00000e+00 4.17041e+02 295.743 1.51071e+02 295.743 0.9778 
1 1 1 8   50  5  o 1  5.05183e+00 1.26888e+00 1.77435e+02 339.878 4.25579e+00  -1.55925e+00 0.00000e+00 0.00000e+00 9.75951e+00 159.878 1.87195e+02 159.878 0.8813 
1 1 1 8   50  6  o 2  8.58064e+00 1.29021e+00 1.80176e+02 176.314 -9.05570e+00 5.83328e-01  0.00000e+00 0.00000e+00 1.24624e+02 176.314 5.55518e+01 356.314 0.9432 
1 1 1 8   50  7  o 12 2.67573e+01 9.81112e-01 3.29641e+02 295.578 2.92276e+01  -6.10629e+01 0.00000e+00 0.00000e+00 6.70546e+02 295.578 3.40906e+02 295.578 0.9926 
1 1 1 8   50  8  o 15 1.23755e+01 9.79888e-01 2.48282e+02 119.684 -1.26246e+01 2.21480e+01  0.00000e+00 0.00000e+00 2.08474e+02 119.684 3.98080e+01 299.684 0.9802 
1 1 1 8   50  9  o 12 3.63310e+00 1.17223e+00 8.10945e+01 308.594 1.68417e+00  -2.11019e+00 0.00000e+00 0.00000e+00 2.62860e+01 308.594 5.48085e+01 128.594 0.7851 
1 1 1 8   50  10 o 2  6.32607e+00 1.40534e+00 1.42976e+02 121.540 -4.47834e+00 7.29641e+00  0.00000e+00 0.00000e+00 8.07472e+01 121.540 6.22284e+01 301.540 0.9396 
1 1 1 8   50  11 o 5  5.88821e+00 1.51261e+00 1.03331e+02 204.003 -5.26120e+00 -2.34281e+00 0.00000e+00 0.00000e+00 9.79301e+01 204.003 5.40039e+00 24.003  0.9084 
1 1 1 8   50  12 o 15 6.64797e+00 1.67560e+00 1.27956e+02 14.700  7.68008e+00  2.01477e+00  0.00000e+00 0.00000e+00 1.05757e+02 14.700  2.21989e+01 194.700 0.9347 
1 1 1 8   50  13 o 7  1.11109e+01 1.75746e+00 1.55446e+02 196.704 -1.54489e+01 -4.63600e+00 0.00000e+00 0.00000e+00 2.49094e+02 196.704 9.36476e+01 196.704 0.9685 
1 1 1 8   51  0  o 18 8.85045e+00 7.64793e-01 9.54824e+01 117.093 -1.30798e+00 2.55679e+00  0.00000e+00 0.00000e+00 1.70936e+02 117.093 7.54535e+01 117.093 0.8001 
1 1 1 8   51  1  o 17 2.60661e+01 6.36135e-01 5.05668e+02 305.660 2.99621e+01  -4.17575e+01 0.00000e+00 0.00000e+00 4.65772e+02 305.660 3.98958e+01 125.660 0.9902 
1 1 1 8   51  2  o 19 1.69182e+01 6.18423e-01 2.99293e+02 79.316  4.01077e+00  2.12585e+01  0.00000e+00 0.00000e+00 3.22695e+02 79.316  2.34030e+01 79.316  0.9766 
1 1 1 8   51  3  o 6  2.75996e+01 9.08560e-01 4.11818e+02 156.742 -4.61501e+01 1.98354e+01  0.00000e+00 0.00000e+00 6.16951e+02 156.742 2.05133e+02 156.742 0.9900 
1 1 1 8   51  4  o 8  1.32247e+01 8.36957e-01 2.15360e+02 121.409 -7.28898e+00 1.19372e+01  0.00000e+00 0.00000e+00 2.64477e+02 121.409 4.91175e+01 121.409 0.9636 
1 1 1 8   51  5  o 10 2.97387e+00 9.91867e-01 2.35488e+01 227.082 -2.57730e-01 -2.77178e-01 0.00000e+00 0.00000e+00 2.72650e+00 47.082  2.62753e+01 47.082  0.1859 
1 1 1 8   51  6  o 18 1.75076e+01 9.18599e-01 3.16300e+02 254.704 -9.71368e+00 -3.55165e+01 0.00000e+00 0.00000e+00 3.33966e+02 254.704 1.76658e+01 254.704 0.9863 
1 1 1 8   51  7  o 9  1.37363e+01 1.09264e+00 2.35702e+02 7.878   2.25971e+01  3.12677e+00  0.00000e+00 0.00000e+00 2.70056e+02 7.878   3.43542e+01 7.878   0.9778 
1 1 1 8   51  8  o 5  3.80561e+00 1.13683e+00 2.47306e+01 327.744 6.57491e-01  -4.14939e-01 0.00000e+00 0.00000e+00 2.71422e+01 327.744 2.41163e+00 327.744 0.3620 
1 1 1 8   51  9  o 9  4.55199e+00 1.27731e+00 1.27083e+02 109.519 -1.72243e+00 4.85885e+00  0.00000e+00 0.00000e+00 2.65882e+01 109.519 1.00494e+02 289.519 0.8969 
1 1 1 8   51  10 o 2  5.32463e+00 1.41306e+00 1.48630e+02 18.188  6.78773e+00  2.23013e+00  0.00000e+00 0.00000e+00 3.71401e+01 18.188  1.11490e+02 198.188 0.9271 
1 1 1 8   51  11 o 8  4.85947e+00 1.33446e+00 5.05415e+01 110.361 -9.27352e-01 2.49879e+00  0.00000e+00 0.00000e+00 9.23886e+01 110.361 4.18472e+01 110.361 0.7818 
1 1 1 8   51  12 o 14 6.66435e+00 1.68985e+00 1.43722e+02 220.922 -6.86615e+00 -5.95222e+00 0.00000e+00 0.00000e+00 9.26730e+01 220.922 5.10486e+01 40.922  0.9433 
1 1 1 8   51  13 o 6  5.23408e+00 1.49093e+00 1.29329e+02 69.535  2.75368e+00  7.37870e+00  0.00000e+00 0.00000e+00 5.44627e+01 69.535  7.48658e+01 249.535 0.9342 
1 1 1 8   52  0  o 12 2.20771e+01 6.45148e-01 3.54362e+02 16.359  3.21524e+01  9.43820e+00  0.00000e+00 0.00000e+00 4.63690e+02 16.359  1.09328e+02 16.359  0.9850 
1 1 1 8   52  1  o 11 2.90372e+01 6.66643e-01 5.37705e+02 116.015 -2.91707e+01 5.97698e+01  0.00000e+00 0.00000e+00 5.46748e+02 116.015 9.04317e+00 116.015 0.9925 
1 1 1 8   52  2  o 16 3.20249e+01 7.10803e-01 5.28663e+02 202.552 -6.79742e+01 -2.82276e+01 0.00000e+00 0.00000e+00 6.68525e+02 202.552 1.39862e+02 202.552 0.9932 
1 1 1 8   52  3  f 0  1.84860e+01 7.88043e-01 2.63285e+02 93.423  -1.37500e+00 2.29864e+01  0.00000e+00 0.00000e+00 4.17359e+02 93.423  1.54074e+02 93.423  0.9780 
1 1 1 8   52  4  o 16 1.18532e+01 8.94133e-01 2.33598e+02 253.866 -4.00017e+00 -1.38280e+01 0.00000e+00 0.00000e+00 1.96887e+02 253.866 3.67116e+01 73.866  0.9646 
1 1 1 8   52  5  o 19 2.08009e+01 8.25787e-01 3.42338e+02 281.886 8.67948e+00  -4.12378e+01 0.00000e+00 0.00000e+00 4.31506e+02 281.886 8.91686e+01 281.886 0.9881 
1 1 1 8   52  6  o 14 3.92559e+00 1.16250e+00 1.27881e+02 242.726 -1.51572e+00 -2.93989e+00 0.00000e+00 0.00000e+00 5.14698e+00 62.726  1.33028e+02 62.726  0.8304 
1 1 1 8   52  7  o 14 1.10446e+01 1.09949e+00 1.73030e+02 28.280  1.27579e+01  6.86365e+00  0.00000e+00 0.00000e+00 2.28167e+02 28.280  5.51375e+01 28.280  0.9648 
1 1 1 8   52  8  o 9  1.24298e+01 1.00418e+00 1.10183e+02 57.785  6.36978e+00  1.01090e+01  0.00000e+00 0.00000e+00 3.37688e+02 57.785  2.27505e+02 57.785  0.9572 
1 1 1 8   52  9  o 8  1.44414e+01 1.10518e+00 2.10674e+02 338.121 2.55335e+01  -1.02537e+01 0.00000e+00 0.00000e+00 3.22872e+02 338.121 1.12198e+02 338.121 0.9817 
1 1 1 8   52  10 f 0  7.88516e+00 1.48199e+00 1.39767e+02 60.691  5.02602e+00  8.95313e+00  0.00000e+00 0.00000e+00 1.42082e+02 60.691  2.31548e+00 60.691  0.9500 
1 1 1 8   52  11 o 15 5.09379e+00 1.42626e+00 2.92148e+01 105.571 -4.00358e-01 1.43670e+00  0.00000e+00 0.00000e+00 8.45971e+01 105.571 5.53823e+01 105.571 0.5940 
1 1 1 8   52  12 o 2  6.70177e+00 1.73102e+00 1.81931e+02 219.178 -8.99807e+00 -7.33301e+00 0.00000e+00 0.00000e+00 5.89446e+01 219.178 1.22986e+02 39.178  0.9559 
1 1 1 8   52  13 o 3  3.84225e+00 1.29298e+00 7.91218e+01 268.646 -9.82574e-02 -4.15738e+00 0.00000e+00 0.00000e+00 4.64173e+01 268.646 3.27045e+01 88.646  0.8694 
1 1 1 8   53  0  o 9  8.47871e+00 9.69214e-01 1.38809e+02 275.570 4.66566e-01  -4.78422e+00 0.00000e+00 0.00000e+00 1.44619e+02 275.570 5.81041e+00 275.570 0.8887 
1 1 1 8   53  1  o 12 2.51227e+01 6.29346e-01 4.91442e+02 222.582 -3.99077e+01 -3.66742e+01 0.00000e+00 0.00000e+00 4.45054e+02 222.582 4.63879e+01 42.582  0.9907 
1 1 1 8   53  2  o 15 5.90099e+00 9.94955e-01 1.14395e+02 315.136 2.08370e+00  -2.07384e+00 0.00000e+00 0.00000e+00 6.44758e+01 315.136 4.99194e+01 135.136 0.8054 
1 1 1 8   53  3  o 9  2.02440e+01 8.04797e-01 3.45485e+02 5.727   3.20143e+01  3.21095e+00  0.00000e+00 0.00000e+00 4.04577e+02 5.727   5.90920e+01 5.727   0.9843 
1 1 1 8   53  4  o 11 5.40753e+00 1.23349e+00 1.17198e+02 343.965 3.10672e+00  -8.92866e-01 0.00000e+00 0.00000e+00 5.09067e+01 343.965 6.62915e+01 163.965 0.8258 
1 1 1 8   53  5  o 12 1.35373e+01 1.01188e+00 2.63046e+02 3.747   2.05974e+01  1.34880e+00  0.00000e+00 0.00000e+00 2.34085e+02 3.747   2.89601e+01 183.747 0.9755 
1 1 1 8   53  6  o 15 1.01437e+01 1.30783e+00 1.98208e+02 174.845 -1.24061e+01 1.11922e+00  0.00000e+00 0.00000e+00 1.67996e+02 174.845 3.02123e+01 354.845 0.9590 
1 1 1 8   53  7  o 7  2.16273e+01 8.77999e-01 3.04053e+02 261.964 -7.51090e+00 -5.31974e+01 0.00000e+00 0.00000e+00 5.02456e+02 261.964 1.98403e+02 261.964 0.9906 
1 1 1 8   53  8  o 18 1.19221e+01 1.10011e+00 1.51346e+02 81.768  2.18091e+00  1.50741e+01  0.00000e+00 0.00000e+00 2.82388e+02 81.768  1.31043e+02 81.768  0.9666 
1 1 1 8   53  9  o 3  8.39713e+00 1.38875e+00 2.01494e+02 265.102 -1.23978e+00 -1.44679e+01 0.00000e+00 0.00000e+00 1.03413e+02 265.102 9.80813e+01 85.102  0.9649 
1 1 1 8   53  10 o 15 5.29719e+00 1.45517e+00 1.14095e+02 46.731  3.98148e+00  4.22964e+00  0.00000e+00 0.00000e+00 6.71115e+01 46.731  4.69837e+01 226.731 0.9093 
1 1 1 8   53  11 o 15 7.92968e+00 1.61708e+00 2.23128e+02 198.133 -1.64865e+01 -5.39917e+00 0.00000e+00 0.00000e+00 6.63712e+01 198.133 1.56757e+02 18.133  0.9707 
1 1 1 8   53  12 o 12 1.48949e+01 1.30642e+00 1.75581e+02 80.086  5.24872e+00  3.00319e+01  0.00000e+00 0.00000e+00 3.75125e+02 80.086  1.99544e+02 80.086  0.9835 
1 1 1 8   53  13 o 7  3.28515e+00 1.15040e+00 8.64111e+01 235.329 -2.35090e+00 -3.39883e+00 0.00000e+00 0.00000e+00 2.07969e+01 235.329 6.56142e+01 55.329  0.8684 
1 1 1 8   54  0  o 19 1.74007e+01 5.71346e-01 2.48628e+02 272.782 9.25130e-01  -1.90375e+01 0.00000e+00 0.00000e+00 3.88389e+02 272.782 1.39761e+02 272.782 0.9734 
1 1 1 8   54  1  o 19 2.09068e+01 6.23799e-01 2.83692e+02 268.637 -6.46641e-01 -2.71847e+01 0.00000e+00 0.00000e+00 4.88222e+02 268.637 2.04531e+02 268.637 0.9814 
1 1 1 8   54  2  o 8  9.18768e+00 1.15216e+00 1.66504e+02 343.076 6.50798e+00  -1.98021e+00 0.00000e+00 0.00000e+00 1.52686e+02 343.076 1.38176e+01 163.076 0.9233 
1 1 1 8   54  3  o 1  2.69543e+01 8.26162e-01 4.87475e+02 203.626 -6.34209e+01 -2.77421e+01 0.00000e+00 0.00000e+00 5.19601e+02 203.626 3.21259e+01 203.626 0.9928 
1 1 1 8   54  4  o 19 1.52182e+01 1.00610e+00 2.12833e+02 18.287  1.65700e+01  5.47576e+00  0.00000e+00 0.00000e+00 3.43307e+02 18.287  1.30474e+02 18.287  0.9709 
1 1 1 8   54  5  o 7  2.31161e+01 1.14018e+00 3.85208e+02 136.834 -4.09336e+01 3.83937e+01  0.00000e+00 0.00000e+00 4.77117e+02 136.834 9.19092e+01 136.834 0.9911 
1 1 1 8   54  6  o 16 8.69828e+00 1.35037e+00 1.19732e+02 326.790 5.56511e+00  -3.64308e+00 0.00000e+00 0.00000e+00 1.81948e+02 326.790 6.22152e+01 326.790 0.9214 
1 1 1 8   54  7  o 17 6.59378e+00 1.23382e+00 1.83003e+02 288.841 2.97333e+00  -8.71356e+00 0.00000e+00 0.00000e+00 5.12797e+01 288.841 1.31723e+02 108.841 0.9440 
1 1 1 8   54  8  o 13 7.87694e+00 1.29947e+00 6.09669e+01 323.408 3.28013e+00  -2.43535e+00 0.00000e+00 0.00000e+00 1.95956e+02 323.408 1.34989e+02 323.408 0.8667 
1 1 1 8   54  9  o 3  8.69148e+00 1.47992e+00 1.87688e+02 344.921 1.34192e+01  -3.61546e+00 0.00000e+00 0.00000e+00 1.27336e+02 344.921 6.03527e+01 164.921 0.9633 
1 1 1 8   54  10 o 16 6.11184e+00 1.41710e+00 1.44872e+02 351.002 8.60230e+00  -1.36221e+00 0.00000e+00 0.00000e+00 7.13960e+01 351.002 7.34762e+01 171.002 0.9407 
1 1 1 8   54  11 o 8  6.61673e+00 1.57834e+00 1.45104e+02 159.846 -8.89650e+00 3.26509e+00  0.00000e+00 0.00000e+00 9.01898e+01 159.846 5.49140e+01 339.846 0.9457 
1 1 1 8   54  12 o 15 3.95036e+00 1.30981e+00 1.17047e+02 279.815 9.87521e-01  -5.70819e+00 0.00000e+00 0.00000e+00 1.79333e+01 279.815 9.91138e+01 99.815  0.9090 
1 1 1 8   54  13 o 11 4.86992e+00 1.53957e+00 9.27780e+01 238.071 -2.57677e+00 -4.13502e+00 0.00000e+00 0.00000e+00 7.01307e+01 238.071 2.26473e+01 58.071  0.8903 
1 1 1 8   55  0  f 0  3.26824e+01 9.15713e-01 6.79102e+02 135.862 -7.01213e+01 6.80436e+01  0.00000e+00 0.00000e+00 5.43565e+02 135.862 1.35537e+02 315.862 0.9949 
1 1 1 8   55  1  o 11 7.51832e+00 9.42199e-01 1.39052e+02 8.440   4.77632e+00  7.08696e-01  0.00000e+00 0.00000e+00 1.12425e+02 8.440   2.66270e+01 188.440 0.8893 
1 1 1 8   55  2  o 10 5.66232e+00 1.13681e+00 4.93917e+01 128.142 -8.04897e-01 1.02498e+00  0.00000e+00 0.00000e+00 6.64139e+01 128.142 1.70222e+01 128.142 0.5436 
1 1 1 8   55  3  f 0  2.36275e+01 9.42206e-01 2.73082e+02 167.096 -3.54575e+01 8.12311e+00  0.00000e+00 0.00000e+00 6.03701e+02 167.096 3.30619e+02 167.096 0.9862 
1 1 1 8   55  4  o 18 1.31455e+01 1.04074e+00 2.59615e+02 19.104  1.82607e+01  6.32461e+00  0.00000e+00 0.00000e+00 2.22122e+02 19.104  3.74928e+01 199.104 0.9738 
1 1 1 8   55  5  o 16 6.62520e+00 1.81809e+00 1.05455e+02 129.016 -2.32356e+00 2.86772e+00  0.00000e+00 0.00000e+00 1.06607e+02 129.016 1.15241e+00 129.016 0.8505 
1 1 1 8   55  6  o 9  4.17831e+00 1.33144e+00 3.60347e+01 186.405 -1.02456e+00 -1.15014e-01 0.00000e+00 0.00000e+00 3.58704e+01 186.405 1.64348e-01 6.405   0.4573 
1 1 1 8   55  7  o 13 3.01456e+01 9.11266e-01 4.58400e+02 144.903 -9.56741e+01 6.72331e+01  0.00000e+00 0.00000e+00 6.71179e+02 144.903 2.12779e+02 144.903 0.9957 
1 1 1 8   55  8  o 8  4.51178e+00 1.20039e+00 5.74020e+01 13.954  2.27892e+00  5.66249e-01  0.00000e+00 0.00000e+00 6.94845e+01 13.954  1.20825e+01 13.954  0.7474 
1 1 1 8   55  9  o 13 7.67237e+00 1.39310e+00 1.69056e+02 59.213  6.33817e+00  1.06379e+01  0.00000e+00 0.00000e+00 1.07664e+02 59.213  6.13922e+01 239.213 0.9587 
1 1 1 8   55  10 o 6  1.25223e+01 1.26798e+00 2.86797e+02 192.745 -3.82671e+01 -8.65529e+00 0.00000e+00 0.00000e+00 1.78122e+02 192.745 1.08675e+02 12.745  0.9872 
1 1 1 8   55  11 o 10 7.11447e+00 1.50372e+00 9.59205e+01 164.119 -6.79093e+00 1.93201e+00  0.00000e+00 0.00000e+00 1.51827e+02 164.119 5.59069e+01 164.119 0.9262 
1 1 1 8   55  12 o 6  1.61820e+01 1.30092e+00 3.13197e+02 355.742 6.06574e+01  -4.51629e+00 0.00000e+00 0.00000e+00 2.89958e+02 355.742 2.32385e+01 175.742 0.9917 
1 1 1 8   55  13 o 10 5.41157e+00 1.52102e+00 1.41571e+02 65.511  3.67501e+00  8.06808e+00  0.00000e+00 0.00000e+00 4.98909e+01 65.511  9.16804e+01 245.511 0.9418 
1 1 1 8   56  0  f 0  1.62106e+01 6.65557e-01 3.25547e+02 142.333 -1.96134e+01 1.51411e+01  0.00000e+00 0.00000e+00 2.71506e+02 142.333 5.40418e+01 322.333 0.9796 
1 1 1 8   56  1  o 1  2.30881e+01 6.97094e-01 3.33227e+02 35.970  3.12471e+01  2.26773e+01  0.00000e+00 0.00000e+00 5.23768e+02 35.970  1.90541e+02 35.970  0.9870 
1 1 1 8   56  2  o 4  3.79752e+01 1.12639e+00 5.61298e+02 155.418 -9.63639e+01 4.40814e+01  0.00000e+00 0.00000e+00 8.60475e+02 155.418 2.99177e+02 155.418 0.9953 
1 1 1 8   56  3  o 6  1.87403e+01 9.25733e-01 3.79041e+02 338.624 3.58949e+01  -1.40495e+01 0.00000e+00 0.00000e+00 3.16834e+02 338.624 6.22071e+01 158.624 0.9869 
1 1 1 8   56  4  o 18 1.36942e+01 1.23160e+00 3.16237e+02 23.854  2.17742e+01  9.62830e+00  0.00000e+00 0.00000e+00 1.88107e+02 23.854  1.28130e+02 203.854 0.9788 
1 1 1 8   56  5  o 7  1.24801e+01 1.33843e+00 2.87151e+02 119.204 -1.09065e+01 1.95114e+01  0.00000e+00 0.00000e+00 1.71845e+02 119.204 1.15306e+02 299.204 0.9774 
1 1 1 8   56  6  o 15 6.32739e+00 1.23306e+00 1.58796e+02 195.901 -7.01516e+00 -1.99841e+00 0.00000e+00 0.00000e+00 6.23170e+01 195.901 9.64792e+01 15.901  0.9287 
1 1 1 8   56  7  o 1  5.85023e+00 1.27212e+00 1.16344e+02 358.724 5.34488e+00  -1.19002e-01 0.00000e+00 0.00000e+00 8.19506e+01 358.724 3.43935e+01 178.725 0.9008 
1 1 1 8   56  8  o 5  7.92577e+00 1.45392e+00 1.94109e+02 331.901 1.07343e+01  -5.73122e+00 0.00000e+00 0.00000e+00 9.15404e+01 331.901 1.02568e+02 151.901 0.9580 
1 1 1 8   56  9  o 10 7.43399e+00 1.34726e+00 6.81431e+01 292.001 1.84858e+00  -4.57521e+00 0.00000e+00 0.00000e+00 1.81234e+02 292.001 1.13091e+02 292.001 0.8918 
1 1 1 8   56  10 o 7  4.92772e+00 1.34124e+00 5.70815e+01 348.004 2.77813e+00  -5.90306e-01 0.00000e+00 0.00000e+00 9.06853e+01 348.004 3.36038e+01 348.004 0.7974 
1 1 1 8   56  11 f 0  5.75598e+00 1.47457e+00 1.11151e+02 26.450  6.01954e+00  2.99463e+00  0.00000e+00 0.00000e+00 8.84168e+01 26.450  2.27344e+01 206.450 0.9223 
1 1 1 8   56  12 o 9  6.28997e+00 1.63208e+00 1.14432e+02 185.942 -7.38602e+00 -7.68771e-01 0.00000e+00 0.00000e+00 1.05387e+02 185.942 9.04481e+00 5.942   0.9300 
1 1 1 8   56  13 o 5  5.88776e+00 1.68758e+00 4.74533e+01 197.734 -2.82345e+00 -9.02913e-01 0.00000e+00 0.00000e+00 1.31085e+02 197.734 8.36314e+01 197.734 0.8073 
1 1 1 8   57  0  o 18 1.26115e+01 8.63082e-01 2.00407e+02 99.751  -2.09056e+00 1.21652e+01  0.00000e+00 0.00000e+00 2.54052e+02 99.751  5.36454e+01 99.751  0.9586 
1 1 1 8   57  1  o 16 1.87643e+01 6.85026e-01 3.94691e+02 208.878 -3.48621e+01 -1.92271e+01 0.00000e+00 0.00000e+00 3.01982e+02 208.878 9.27098e+01 28.878  0.9874 
1 1 1 8   57  2  o 18 1.25506e+01 9.25335e-01 1.86926e+02 14.916  1.28018e+01  3.41004e+00  0.00000e+00 0.00000e+00 2.66941e+02 14.916  8.00145e+01 14.916  0.9615 
1 1 1 8   57  3  o 14 1.46042e+01 1.14048e+00 1.96071e+02 293.037 6.20814e+00  -1.45995e+01 0.00000e+00 0.00000e+00 3.35700e+02 293.037 1.39629e+02 293.037 0.9680 
1 1 1 8   57  4  o 6  7.27609e+00 1.48317e+00 1.81708e+02 163.885 -7.22880e+00 2.08858e+00  0.00000e+00 0.00000e+00 7.31345e+01 163.885 1.08573e+02 343.885 0.9310 
1 1 1 8   57  5  o 17 1.14363e+01 1.27415e+00 1.58759e+02 336.098 1.08766e+01  -4.82033e+00 0.00000e+00 0.00000e+00 2.53016e+02 336.098 9.42571e+01 336.098 0.9570 
1 1 1 8   57  6  o 6  9.81133e+00 9.52014e-01 1.01688e+02 332.539 7.08441e+00  -3.68179e+00 0.00000e+00 0.00000e+00 2.43490e+02 332.539 1.41801e+02 332.539 0.9351 
1 1 1 8   57  7  o 1  3.78474e+00 1.14004e+00 1.02643e+02 58.586  1.68414e+00  2.75753e+00  0.00000e+00 0.00000e+00 1.49261e+01 58.586  8.77170e+01 238.586 0.8257 
1 1 1 8   57  8  o 5  5.64064e+00 1.32634e+00 7.66720e+01 59.895  1.88885e+00  3.25784e+00  0.00000e+00 0.00000e+00 1.04498e+02 59.895  2.78261e+01 59.895  0.8539 
1 1 1 8   57  9  o 19 3.28875e+00 1.05821e+00 1.11335e+02 167.021 -3.78286e+00 8.71897e-01  0.00000e+00 0.00000e+00 5.11289e+00 347.021 1.16448e+02 347.021 0.8588 
1 1 1 8   57  10 o 16 5.46138e+00 1.30299e+00 1.42979e+02 316.332 6.23906e+00  -5.95555e+00 0.00000e+00 0.00000e+00 5.00607e+01 316.332 9.29186e+01 136.332 0.9401 
1 1 1 8   57  11 o 13 5.51209e+00 1.51636e+00 1.45577e+02 45.341  5.78172e+00  5.85096e+00  0.00000e+00 0.00000e+00 4.85671e+01 45.341  9.70097e+01 225.341 0.9371 
1 1 1 8   57  12 o 6  1.40098e+01 1.44339e+00 2.14631e+02 252.435 -1.07019e+01 -3.38078e+01 0.00000e+00 0.00000e+00 3.04268e+02 252.435 8.96368e+01 252.435 0.9858 
1 1 1 8   57  13 o 17 4.66984e+00 1.48070e+00 6.82482e+01 118.094 -1.72415e+00 3.22991e+00  0.00000e+00 0.00000e+00 8.06658e+01 118.094 1.24175e+01 118.094 0.8491 
1 1 1 8   58  0  o 15 1.64029e+01 6.58692e-01 3.01781e+02 357.046 2.65978e+01  -1.37260e+00 0.00000e+00 0.00000e+00 3.03048e+02 357.046 1.26711e+00 357.046 0.9810 
1 1 1 8   58  1  o 4  1.36556e+01 6.87508e-01 1.48634e+02 252.376 -3.61888e+00 -1.13916e+01 0.00000e+00 0.00000e+00 3.42805e+02 252.376 1.94171e+02 252.376 0.9572 
1 1 1 8   58  2  o 11 2.40625e+01 9.16774e-01 3.74784e+02 66.875  1.94096e+01  4.54493e+01  0.00000e+00 0.00000e+00 5.20899e+02 66.875  1.46115e+02 66.875  0.9898 
1 1 1 8   58  3  o 10 1.20761e+01 1.01805e+00 2.16739e+02 203.534 -1.38942e+01 -6.05104e+00 0.00000e+00 0.00000e+00 2.22216e+02 203.534 5.47712e+00 203.534 0.9664 
1 1 1 8   58  4  o 1  1.92870e+01 1.12318e+00 2.04971e+02 340.356 2.46586e+01  -8.80182e+00 0.00000e+00 0.00000e+00 5.06537e+02 340.356 3.01565e+02 340.356 0.9807 
1 1 1 8   58  5  o 11 2.23597e+01 1.14376e+00 4.17429e+02 230.338 -4.34592e+01 -5.24174e+01 0.00000e+00 0.00000e+00 4.17495e+02 230.338 6.56048e-02 230.338 0.9926 
1 1 1 8   58  6  o 9  2.53891e+01 8.26904e-01 4.38401e+02 359.333 9.65026e+01  -1.12259e+00 0.00000e+00 0.00000e+00 5.11709e+02 359.333 7.33081e+01 359.333 0.9948 
1 1 1 8   58  7  o 1  9.37856e+00 1.30782e+00 2.15667e+02 154.957 -1.55578e+01 7.26881e+00  0.00000e+00 0.00000e+00 1.26673e+02 154.957 8.89939e+01 334.957 0.9704 
1 1 1 8   58  8  o 2  6.33921e+00 1.34682e+00 9.07485e+01 237.463 -2.70609e+00 -4.24171e+00 0.00000e+00 0.00000e+00 1.22419e+02 237.463 3.16706e+01 237.463 0.8941 
1 1 1 8   58  9  o 9  3.65920e+00 1.11918e+00 8.89656e+01 299.910 1.74871e+00  -3.03985e+00 0.00000e+00 0.00000e+00 2.68145e+01 299.910 6.21510e+01 119.910 0.8415 
1 1 1 8   58  10 o 14 6.43359e+00 1.43654e+00 8.97751e+01 190.891 -5.71994e+00 -1.10054e+00 0.00000e+00 0.00000e+00 1.30203e+02 190.891 4.04274e+01 190.891 0.9095 
1 1 1 8   58  11 o 2  1.25679e+01 1.27784e+00 1.61944e+02 324.161 2.00173e+01  -1.44578e+01 0.00000e+00 0.00000e+00 3.00698e+02 324.161 1.38754e+02 324.161 0.9795 
1 1 1 8   58  12 o 4  7.44715e+00 1.64219e+00 1.39808e+02 163.925 -1.00276e+01 2.88959e+00  0.00000e+00 0.00000e+00 1.26190e+02 163.925 1.36189e+01 343.925 0.9508 
1 1 1 8   58  13 o 14 4.43691e+00 1.41950e+00 1.37251e+02 293.264 2.98835e+00  -6.95093e+00 0.00000e+00 0.00000e+00 1.79167e+01 293.264 1.19334e+02 113.264 0.9314 
1 1 1 8   59  0  o 15 6.86978e+00 9.76409e-01 1.14790e+02 349.068 4.16633e+00  -8.04729e-01 0.00000e+00 0.00000e+00 1.10400e+02 349.068 4.39055e+00 169.068 0.8723 
1 1 1 8   59  1  o 13 1.54669e+01 8.50477e-01 3.62440e+02 195.905 -2.99095e+01 -8.52284e+00 0.00000e+00 0.00000e+00 2.09552e+02 195.905 1.52888e+02 15.905  0.9838 
1 1 1 8   59  2  o 9  2.22611e+01 9.02184e-01 4.67415e+02 32.000  5.13929e+01  3.21142e+01  0.00000e+00 0.00000e+00 3.62657e+02 32.000  1.04757e+02 212.000 0.9917 
1 1 1 8   59  3  o 1  6.10881e+00 1.10214e+00 1.36829e+02 118.593 -2.46634e+00 4.52496e+00  0.00000e+00 0.00000e+00 6.91966e+01 118.593 6.76321e+01 298.593 0.8968 
1 1 1 8   59  4  o 15 9.07409e+00 1.34133e+00 1.85307e+02 284.710 2.65814e+00  -1.01252e+01 0.00000e+00 0.00000e+00 1.39236e+02 284.710 4.60709e+01 104.710 0.9510 
1 1 1 8   59  5  o 12 3.74796e+00 1.52656e+00 7.59007e+01 110.502 -6.08734e-01 1.62798e+00  0.00000e+00 0.00000e+00 1.56887e+01 110.502 6.02119e+01 290.502 0.6497 
1 1 1 8   59  6  o 18 9.95042e+00 9.49340e-01 2.01626e+02 123.661 -9.29954e+00 1.39646e+01  0.00000e+00 0.00000e+00 1.61292e+02 123.661 4.03343e+01 303.661 0.9697 
1 1 1 8   59  7  o 15 1.15539e+01 1.38914e+00 2.56039e+02 128.846 -1.49923e+01 1.86158e+01  0.00000e+00 0.00000e+00 1.69297e+02 128.846 8.67418e+01 308.846 0.9789 
1 1 1 8   59  8  o 11 6.71846e+00 1.19638e+00 1.32624e+02 59.845  4.34113e+00  7.47233e+00  0.00000e+00 0.00000e+00 1.04912e+02 59.845  2.77115e+01 239.845 0.9402 
1 1 1 8   59  9  o 10 6.13182e+00 1.31902e+00 1.32184e+02 181.358 -8.35125e+00 -1.97983e-01 0.00000e+00 0.00000e+00 8.40740e+01 181.358 4.81104e+01 1.358   0.9381 
1 1 1 8   59  10 o 8  4.34091e+00 1.25130e+00 6.52884e+01 331.781 2.74122e+00  -1.47097e+00 0.00000e+00 0.00000e+00 6.81534e+01 331.781 2.86494e+00 331.781 0.8179 
1 1 1 8   59  11 o 18 5.34245e+00 1.42389e+00 1.06493e+02 163.281 -6.27426e+00 1.88459e+00  0.00000e+00 0.00000e+00 7.82175e+01 163.281 2.82753e+01 343.281 0.9202 
1 1 1 8   59  12 o 9  3.51291e+00 1.18471e+00 4.01493e+01 157.149 -1.91082e+00 8.05219e-01  0.00000e+00 0.00000e+00 5.34644e+01 157.149 1.33150e+01 157.149 0.7095 
1 1 1 8   59  13 o 1  7.29212e+00 1.83764e+00 1.30037e+02 220.755 -6.89655e+00 -5.94340e+00 0.00000e+00 0.00000e+00 1.28231e+02 220.755 1.80594e+00 40.755  0.9434 
1 1 1 8   60  0  o 14 1.07549e+01 7.16449e-01 2.65145e+02 295.518 6.95179e+00  -1.45629e+01 0.00000e+00 0.00000e+00 1.26230e+02 295.518 1.38916e+02 115.518 0.9685 
1 1 1 8   60  1  o 10 2.97113e+01 9.67004e-01 5.41976e+02 140.192 -7.11155e+01 5.92684e+01  0.00000e+00 0.00000e+00 5.68671e+02 140.192 2.66949e+01 140.192 0.9946 
1 1 1 8   60  2  o 2  1.06250e+01 9.70451e-01 1.48633e+02 60.970  4.89316e+00  8.81665e+00  0.00000e+00 0.00000e+00 2.30442e+02 60.970  8.18091e+01 60.970  0.9490 
1 1 1 8   60  3  o 2  1.06561e+01 1.14941e+00 3.22170e+02 228.726 -1.48960e+01 -1.69714e+01 0.00000e+00 0.00000e+00 6.95211e+01 228.726 2.52649e+02 48.726  0.9776 
1 1 1 8   60  4  o 3  5.99565e+00 1.44733e+00 2.00177e+02 140.090 -5.69468e+00 4.76310e+00  0.00000e+00 0.00000e+00 9.49652e+00 140.090 1.90681e+02 320.090 0.9300 
1 1 1 8   60  5  o 6  7.41704e+00 1.09646e+00 1.84376e+02 31.761  8.91514e+00  5.51915e+00  0.00000e+00 0.00000e+00 8.08930e+01 31.761  1.03483e+02 211.761 0.9510 
1 1 1 8   60  6  o 7  1.36307e+01 8.41011e-01 1.84661e+02 268.392 -6.40653e-01 -2.28152e+01 0.00000e+00 0.00000e+00 3.16565e+02 268.392 1.31903e+02 268.392 0.9778 
1 1 1 8   60  7  f 0  1.28993e+01 1.34956e+00 3.08854e+02 23.383  3.02659e+01  1.30863e+01  0.00000e+00 0.00000e+00 1.68780e+02 23.383  1.40074e+02 203.383 0.9847 
1 1 1 8   60  8  o 11 1.39524e+01 9.60227e-01 3.23015e+02 198.403 -4.99486e+01 -1.66184e+01 0.00000e+00 0.00000e+00 1.96551e+02 198.403 1.26463e+02 18.403  0.9905 
1 1 1 8   60  9  o 10 5.51305e+00 1.30919e+00 1.33837e+02 140.677 -5.93265e+00 4.85971e+00  0.00000e+00 0.00000e+00 5.93718e+01 140.677 7.44653e+01 320.677 0.9323 
1 1 1 8   60  10 o 13 4.11843e+00 1.18271e+00 3.21312e+01 354.639 1.63119e+00  -1.53057e-01 0.00000e+00 0.00000e+00 6.51456e+01 354.639 3.30144e+01 354.639 0.6285 
1 1 1 8   60  11 o 1  3.92650e+00 1.24670e+00 1.06434e+02 243.761 -2.22667e+00 -4.51738e+00 0.00000e+00 0.00000e+00 2.54734e+01 243.761 8.09607e+01 63.761  0.8942 
1 1 1 8   60  12 o 1  5.18442e+00 1.50747e+00 6.52784e+01 220.268 -2.94081e+00 -2.49120e+00 0.00000e+00 0.00000e+00 1.01706e+02 220.268 3.64273e+01 220.268 0.8577 
1 1 1 8   60  13 f 0  4.24448e+00 1.40611e+00 2.68728e+01 300.075 7.40862e-01  -1.27933e+00 0.00000e+00 0.00000e+00 6.72474e+01 300.075 4.03745e+01 300.075 0.5907 
1 1 1 8   61  0  o 7  1.38522e+01 5.75085e-01 2.81107e+02 63.446  1.09225e+01  2.18555e+01  0.00000e+00 0.00000e+00 2.28522e+02 63.446  5.25852e+01 243.446 0.9793 
1 1 1 8   61  1  o 2  4.25895e+00 1.07415e+00 1.92863e+01 290.226 1.62029e-01  -4.39757e-01 0.00000e+00 0.00000e+00 1.72235e+01 290.226 2.06270e+00 110.226 0.2281 
1 1 1 8   61  2  o 11 7.30685e+00 1.19815e+00 9.97611e+01 285.656 1.21774e+00  -4.34492e+00 0.00000e+00 0.00000e+00 1.42116e+02 285.656 4.23548e+01 285.656 0.8807 
1 1 1 8   61  3  o 19 1.56037e+01 1.04473e+00 2.07024e+02 11.147  2.15184e+01  4.24011e+00  0.00000e+00 0.00000e+00 3.66041e+02 11.147  1.59017e+02 11.147  0.9769 
1 1 1 8   61  4  o 7  1.44696e+01 9.31372e-01 3.31562e+02 16.569  3.56333e+01  1.06020e+01  0.00000e+00 0.00000e+00 2.05094e+02 16.569  1.26468e+02 196.569 0.9865 
1 1 1 8   61  5  o 13 1.52712e+01 7.19999e-01 2.81886e+02 235.764 -2.15972e+01 -3.17365e+01 0.00000e+00 0.00000e+00 2.84774e+02 235.764 2.88784e+00 235.764 0.9869 
1 1 1 8   61  6  o 14 8.81703e+00 1.00931e+00 1.17670e+02 146.429 -7.53162e+00 4.99851e+00  0.00000e+00 0.00000e+00 1.94927e+02 146.429 7.72568e+01 146.429 0.9429 
1 1 1 8   61  7  o 9  9.37625e+00 1.31958e+00 2.21976e+02 61.698  8.62362e+00  1.60143e+01  0.00000e+00 0.00000e+00 1.20703e+02 61.698  1.01273e+02 241.698 0.9721 
1 1 1 8   61  8  o 18 5.66695e+00 1.22700e+00 6.71386e+01 250.639 -1.30202e+00 -3.70531e+00 0.00000e+00 0.00000e+00 1.16208e+02 250.639 4.90690e+01 250.639 0.8607 
1 1 1 8   61  9  o 17 8.68362e+00 1.21188e+00 1.78034e+02 46.403  1.14950e+01  1.20722e+01  0.00000e+00 0.00000e+00 1.38382e+02 46.403  3.96520e+01 226.403 0.9695 
1 1 1 8   61  10 o 12 9.50927e+00 1.31292e+00 2.01170e+02 342.467 2.10740e+01  -6.65790e+00 0.00000e+00 0.00000e+00 1.47951e+02 342.467 5.32192e+01 162.467 0.9771 
1 1 1 8   61  11 o 7  6.23038e+00 1.40602e+00 6.93982e+01 254.805 -1.27944e+00 -4.71089e+00 0.00000e+00 0.00000e+00 1.39016e+02 254.805 6.96174e+01 254.805 0.8906 
1 1 1 8   61  12 f 0  5.01921e+00 1.48391e+00 2.12387e+01 168.053 -1.16481e+00 2.46469e-01  0.00000e+00 0.00000e+00 7.48494e+01 168.053 5.36107e+01 168.053 0.5099 
1 1 1 8   61  13 o 9  7.21594e+00 1.81607e+00 8.98239e+01 223.447 -4.65210e+00 -4.40649e+00 0.00000e+00 0.00000e+00 1.58862e+02 223.447 6.90380e+01 223.447 0.9183 
1 1 1 8   62  0  o 7  7.31345e+00 8.36507e-01 1.37466e+02 81.586  9.64820e-01  6.52247e+00  0.00000e+00 0.00000e+00 1.15450e+02 81.586  2.20163e+01 261.586 0.9207 
1 1 1 8   62  1  o 13 1.57185e+01 7.49882e-01 2.47556e+02 50.930  1.68973e+01  2.08142e+01  0.00000e+00 0.00000e+00 3.31903e+02 50.930  8.43471e+01 50.930  0.9812 
1 1 1 8   62  2  o 9  4.18675e+00 1.11362e+00 9.99021e+01 290.462 9.69258e-01  -2.59770e+00 0.00000e+00 0.00000e+00 2.46595e+01 290.462 7.52426e+01 110.462 0.7917 
1 1 1 8   62  3  o 11 1.51389e+01 8.79564e-01 2.74913e+02 105.976 -8.37309e+00 2.92463e+01  0.00000e+00 0.00000e+00 2.84686e+02 105.976 9.77350e+00 105.976 0.9834 
1 1 1 8   62  4  o 4  1.07655e+01 1.06227e+00 2.04308e+02 201.357 -1.56998e+01 -6.13927e+00 0.00000e+00 0.00000e+00 1.88187e+02 201.357 1.61217e+01 21.357  0.9699 
1 1 1 8   62  5  o 4  9.81021e+00 8.39667e-01 2.01829e+02 269.149 -2.53791e-01 -1.70862e+01 0.00000e+00 0.00000e+00 1.56008e+02 269.149 4.58218e+01 89.149  0.9703 
1 1 1 8   62  6  o 19 3.63379e+00 1.03192e+00 8.02035e+01 222.681 -2.02532e+00 -1.86769e+00 0.00000e+00 0.00000e+00 2.77280e+01 222.681 5.24754e+01 42.681  0.7901 
1 1 1 8   62  7  o 9  6.25323e+00 1.37211e+00 7.92671e+01 279.798 6.84313e-01  -3.96260e+00 0.00000e+00 0.00000e+00 1.23901e+02 279.798 4.46341e+01 279.798 0.8643 
1 1 1 8   62  8  o 6  5.74903e+00 1.28234e+00 1.02795e+02 202.412 -5.24055e+00 -2.16126e+00 0.00000e+00 0.00000e+00 9.31598e+01 202.412 9.63568e+00 22.412  0.9069 
1 1 1 8   62  9  o 18 5.15488e+00 1.24036e+00 1.02376e+02 37.447  4.57426e+00  3.50320e+00  0.00000e+00 0.00000e+00 7.36043e+01 37.447  2.87713e+01 217.447 0.9085 
1 1 1 8   62  10 o 12 1.01719e+01 1.33960e+00 1.56249e+02 270.050 1.56780e-02  -1.80518e+01 0.00000e+00 0.00000e+00 2.15145e+02 270.050 5.88955e+01 270.050 0.9719 
1 1 1 8   62  11 o 9  4.31799e+00 1.33411e+00 1.28981e+02 24.750  6.31290e+00  2.91032e+00  0.00000e+00 0.00000e+00 2.10193e+01 24.750  1.07962e+02 204.750 0.9250 
1 1 1 8   62  12 o 8  4.26626e+00 1.37167e+00 6.18487e+01 196.101 -3.23805e+00 -9.34661e-01 0.00000e+00 0.00000e+00 7.17299e+01 196.101 9.88120e+00 196.101 0.8340 
1 1 1 8   62  13 o 17 7.34008e+00 1.74743e+00 1.10269e+02 318.148 6.37531e+00  -5.71057e+00 0.00000e+00 0.00000e+00 1.48537e+02 318.148 3.82682e+01 318.148 0.9396 
1 1 1 8   63  0  o 18 1.46937e+01 7.44676e-01 3.23825e+02 46.687  2.37163e+01  2.51554e+01  0.00000e+00 0.00000e+00 2.19953e+02 46.687  1.03872e+02 226.687 0.9854 
1 1 1 8   63  1  o 4  2.21074e+01 7.88437e-01 3.59896e+02 325.843 4.72820e+01  -3.20810e+01 0.00000e+00 0.00000e+00 4.63286e+02 325.843 1.03390e+02 325.843 0.9912 
1 1 1 8   63  2  o 10 8.31945e+00 1.00941e+00 1.06671e+02 302.097 3.17278e+00  -5.05834e+00 0.00000e+00 0.00000e+00 1.78390e+02 302.097 7.17190e+01 302.097 0.9119 
1 1 1 8   63  3  o 19 1.49781e+01 8.53016e-01 2.58561e+02 156.323 -2.80579e+01 1.23030e+01  0.00000e+00 0.00000e+00 2.95063e+02 156.323 3.65012e+01 156.323 0.9835 
1 1 1 8   63  4  o 1  3.05918e+00 9.45735e-01 1.22846e+02 118.256 -1.42448e+00 2.65039e+00  0.00000e+00 0.00000e+00 2.96385e+01 298.256 1.52484e+02 298.256 0.8106 
1 1 1 8   63  5  o 8  7.88877e+00 9.62750e-01 1.76079e+02 333.222 1.08406e+01  -5.47068e+00 0.00000e+00 0.00000e+00 1.07949e+02 333.222 6.81307e+01 153.222 0.9579 
1 1 1 8   63  6  o 1  6.76485e+00 1.13425e+00 1.11378e+02 147.940 -5.94478e+00 3.72332e+00  0.00000e+00 0.00000e+00 1.23993e+02 147.940 1.26154e+01 147.940 0.9257 
1 1 1 8   63  7  o 12 1.42072e+01 9.28261e-01 2.46163e+02 337.419 3.49600e+01  -1.45389e+01 0.00000e+00 0.00000e+00 2.80693e+02 337.419 3.45305e+01 337.419 0.9867 
1 1 1 8   63  8  f 0  9.82618e+00 1.15711e+00 2.59322e+02 330.851 2.35394e+01  -1.31283e+01 0.00000e+00 0.00000e+00 1.03013e+02 330.851 1.56309e+02 150.851 0.9813 
1 1 1 8   63  9  o 9  6.23145e+00 1.39165e+00 9.31009e+01 84.070  6.19597e-01  5.96497e+00  0.00000e+00 0.00000e+00 1.20491e+02 84.070  2.73898e+01 84.070  0.9123 
1 1 1 8   63  10 o 10 4.63006e+00 1.34053e+00 9.57112e+01 234.976 -2.88479e+00 -4.11630e+00 0.00000e+00 0.00000e+00 5.97636e+01 234.976 3.59476e+01 54.976  0.8940 
1 1 1 8   63  11 o 5  3.78679e+00 1.19312e+00 4.81013e+01 287.441 7.54487e-01  -2.40160e+00 0.00000e+00 0.00000e+00 6.09404e+01 287.441 1.28391e+01 287.441 0.7669 
1 1 1 8   63  12 o 13 5.16143e+00 1.48236e+00 1.02027e+02 120.726 -3.27963e+00 5.51779e+00  0.00000e+00 0.00000e+00 7.59003e+01 120.726 2.61268e+01 300.726 0.9184 
1 1 1 8   63  13 o 17 1.07180e+01 1.74376e+00 1.74916e+02 125.676 -1.17219e+01 1.63271e+01  0.00000e+00 0.00000e+00 2.17072e+02 125.676 4.21557e+01 125.676 0.9748 
1 1 1 8   64  0  o 17 2.44431e+01 7.91129e-01 3.65326e+02 291.837 2.39646e+01  -5.98038e+01 0.00000e+00 0.00000e+00 5.45321e+02 291.837 1.79995e+02 291.837 0.9922 
1 1 1 8   64  1  o 7  1.04907e+01 8.62884e-01 1.67067e+02 304.088 6.84554e+00  -1.01153e+01 0.00000e+00 0.00000e+00 2.10465e+02 304.088 4.33984e+01 304.088 0.9581 
1 1 1 8   64  2  o 13 1.14143e+01 8.59861e-01 1.83839e+02 123.338 -8.44901e+00 1.28436e+01  0.00000e+00 0.00000e+00 2.30782e+02 123.338 4.69430e+01 123.338 0.9669 
1 1 1 8   64  3  o 11 1.44636e+01 8.78012e-01 2.11515e+02 73.958  6.83015e+00  2.37543e+01  0.00000e+00 0.00000e+00 3.20836e+02 73.958  1.09321e+02 73.958  0.9796 
1 1 1 8   64  4  o 7  4.56712e+00 1.07414e+00 1.32965e+02 217.611 -3.87216e+00 -2.98315e+00 0.00000e+00 0.00000e+00 1.99047e+01 217.611 1.13060e+02 37.611  0.8907 
1 1 1 8   64  5  o 4  5.90324e+00 1.01373e+00 8.07887e+01 218.975 -3.22542e+00 -2.60959e+00 0.00000e+00 0.00000e+00 1.11997e+02 218.975 3.12081e+01 218.975 0.8690 
1 1 1 8   64  6  o 4  7.01442e+00 1.05597e+00 1.56003e+02 348.063 9.93898e+00  -2.10118e+00 0.00000e+00 0.00000e+00 9.42655e+01 348.063 6.17373e+01 168.063 0.9494 
1 1 1 8   64  7  o 2  7.87406e+00 1.08679e+00 8.37847e+01 0.412   7.01444e+00  5.04198e-02  0.00000e+00 0.00000e+00 1.90112e+02 0.412   1.06327e+02 0.412   0.9257 
1 1 1 8   64  8  o 17 9.65528e+00 1.08769e+00 1.89204e+02 120.467 -1.06876e+01 1.81680e+01  0.00000e+00 0.00000e+00 1.64849e+02 120.467 2.43550e+01 300.467 0.9760 
1 1 1 8   64  9  o 13 6.33255e+00 1.31072e+00 1.24370e+02 160.268 -7.89107e+00 2.83040e+00  0.00000e+00 0.00000e+00 9.88335e+01 160.268 2.55366e+01 340.268 0.9383 
1 1 1 8   64  10 o 4  1.37151e+01 1.16787e+00 2.20051e+02 358.838 3.68424e+01  -7.47156e-01 0.00000e+00 0.00000e+00 2.87978e+02 358.838 6.79266e+01 358.838 0.9863 
1 1 1 8   64  11 o 6  4.01824e+00 1.25732e+00 6.38570e+01 71.206  1.04946e+00  3.08390e+00  0.00000e+00 0.00000e+00 6.09546e+01 71.206  2.90240e+00 251.206 0.8274 
1 1 1 8   64  12 o 8  6.10991e+00 1.57970e+00 8.14631e+01 333.929 4.81947e+00  -2.35799e+00 0.00000e+00 0.00000e+00 1.25182e+02 333.929 4.37186e+01 333.929 0.9012 
1 1 1 8   64  13 o 7  4.97638e+00 1.54361e+00 9.80432e+01 237.377 -3.24819e+00 -5.07464e+00 0.00000e+00 0.00000e+00 7.23423e+01 237.377 2.57009e+01 57.377  0.9127 
1 1 1 8   65  0  o 13 1.12305e+01 7.80411e-01 2.01998e+02 359.948 1.69543e+01  -1.53511e-02 0.00000e+00 0.00000e+00 2.06986e+02 359.948 4.98830e+00 359.948 0.9700 
1 1 1 8   65  1  o 14 1.11732e+01 8.67646e-01 1.91660e+02 108.186 -4.88619e+00 1.48736e+01  0.00000e+00 0.00000e+00 2.14292e+02 108.186 2.26319e+01 108.186 0.9675 
1 1 1 8   65  2  o 19 6.33672e+00 1.11714e+00 7.19485e+01 92.782  -1.54441e-01 3.17798e+00  0.00000e+00 0.00000e+00 1.23836e+02 92.782  5.18874e+01 92.782  0.8226 
1 1 1 8   65  3  o 3  5.89526e+00 1.17758e+00 1.04919e+02 5.228   4.59049e+00  4.20065e-01  0.00000e+00 0.00000e+00 9.07435e+01 5.228   1.41755e+01 185.228 0.8835 
1 1 1 8   65  4  o 9  9.16146e+00 8.04072e-01 1.34245e+02 35.854  8.66790e+00  6.26398e+00  0.00000e+00 0.00000e+00 1.93456e+02 35.854  5.92105e+01 35.854  0.9520 
1 1 1 8   65  5  o 2  2.76038e+00 8.79378e-01 1.17059e+02 255.406 -8.11470e-01 -3.11669e+00 0.00000e+00 0.00000e+00 3.14864e+01 75.406  1.48545e+02 75.406  0.8251 
1 1 1 8   65  6  o 1  3.41524e+00 1.00082e+00 1.01565e+02 137.337 -2.39485e+00 2.20701e+00  0.00000e+00 0.00000e+00 4.59573e+00 137.337 9.69694e+01 317.337 0.8273 
1 1 1 8   65  7  o 4  4.92961e+00 1.14438e+00 1.09216e+02 312.162 3.87727e+00  -4.28167e+00 0.00000e+00 0.00000e+00 5.90875e+01 312.162 5.01287e+01 132.162 0.9087 
1 1 1 8   65  8  o 14 4.54079e+00 1.22304e+00 7.58917e+01 122.046 -2.04405e+00 3.26531e+00  0.00000e+00 0.00000e+00 7.03926e+01 122.046 5.49910e+00 302.046 0.8576 
1 1 1 8   65  9  o 5  3.57333e+00 1.06977e+00 7.71536e+01 253.600 -1.02429e+00 -3.48024e+00 0.00000e+00 0.00000e+00 3.65876e+01 253.600 4.05660e+01 73.600  0.8475 
1 1 1 8   65  10 o 2  3.19833e+00 1.04808e+00 4.49880e+01 166.175 -2.01134e+00 4.94975e-01  0.00000e+00 0.00000e+00 4.01744e+01 166.175 4.81363e+00 346.175 0.7092 
1 1 1 8   65  11 o 10 4.80902e+00 1.33526e+00 1.03901e+02 22.458  6.14646e+00  2.54062e+00  0.00000e+00 0.00000e+00 6.24244e+01 22.458  4.14766e+01 202.458 0.9214 
1 1 1 8   65  12 o 4  3.11611e+00 1.08190e+00 3.81573e+01 106.857 -5.42433e-01 1.79017e+00  0.00000e+00 0.00000e+00 4.08031e+01 106.857 2.64578e+00 106.857 0.6753 
1 1 1 8   65  13 o 4  4.76402e+00 1.48875e+00 9.15646e+01 201.073 -5.19564e+00 -2.00200e+00 0.00000e+00 0.00000e+00 7.01504e+01 201.073 2.14142e+01 21.073  0.9051 
1 1 1 8   66  0  o 9  3.81702e+00 9.94984e-01 8.75535e+01 171.667 -2.51590e+00 3.68509e-01  0.00000e+00 0.00000e+00 2.27036e+01 171.667 6.48499e+01 351.667 0.7696 
1 1 1 8   66  1  o 16 1.06582e+01 9.05939e-01 1.53167e+02 261.102 -1.86614e+00 -1.19192e+01 0.00000e+00 0.00000e+00 2.30044e+02 261.102 7.68773e+01 261.102 0.9576 
1 1 1 8   66  2  o 6  1.29541e+01 8.56091e-01 3.31623e+02 297.938 1.63079e+01  -3.07504e+01 0.00000e+00 0.00000e+00 1.47823e+02 297.938 1.83799e+02 117.938 0.9855 
1 1 1 8   66  3  o 8  1.36187e+01 6.96467e-01 1.66421e+02 226.171 -1.40483e+01 -1.46345e+01 0.00000e+00 0.00000e+00 3.32339e+02 226.171 1.65918e+02 226.171 0.9750 
1 1 1 8   66  4  f 0  1.00584e+01 7.55629e-01 3.28700e+02 127.139 -1.87366e+01 2.47387e+01  0.00000e+00 0.00000e+00 4.30039e+01 127.139 2.85696e+02 307.139 0.9838 
1 1 1 8   66  5  o 14 4.01283e+00 1.06029e+00 3.72321e+01 249.876 -4.92365e-01 -1.34370e+00 0.00000e+00 0.00000e+00 4.99947e+01 249.876 1.27627e+01 249.876 0.5786 
1 1 1 8   66  6  o 16 1.83625e+01 7.97214e-01 2.82194e+02 98.540  -8.33296e+00 5.54922e+01  0.00000e+00 0.00000e+00 4.01440e+02 98.540  1.19246e+02 98.540  0.9910 
1 1 1 8   66  7  o 15 4.63537e+00 1.15128e+00 1.08896e+02 93.744  -3.35334e-01 5.12474e+00  0.00000e+00 0.00000e+00 4.71923e+01 93.744  6.17034e+01 273.744 0.8964 
1 1 1 8   66  8  o 12 1.23242e+01 9.64520e-01 2.63068e+02 320.283 3.01272e+01  -2.50267e+01 0.00000e+00 0.00000e+00 1.93861e+02 320.283 6.92065e+01 140.283 0.9872 
1 1 1 8   66  9  o 17 5.24601e+00 1.30587e+00 1.29226e+02 156.175 -7.19270e+00 3.17616e+00  0.00000e+00 0.00000e+00 5.47759e+01 156.175 7.44503e+01 336.175 0.9341 
1 1 1 8   66  10 o 6  1.27014e+01 1.09481e+00 1.88551e+02 302.096 1.81530e+01  -2.89433e+01 0.00000e+00 0.00000e+00 2.81243e+02 302.096 9.26919e+01 302.096 0.9853 
1 1 1 8   66  11 o 5  1.08661e+01 1.37061e+00 1.43908e+02 22.911  1.79131e+01  7.57094e+00  0.00000e+00 0.00000e+00 2.53263e+02 22.911  1.09355e+02 22.911  0.9739 
1 1 1 8   66  12 o 10 8.26631e+00 1.67199e+00 1.74434e+02 186.257 -1.53620e+01 -1.68421e+00 0.00000e+00 0.00000e+00 1.25469e+02 186.257 4.89651e+01 6.257   0.9671 
1 1 1 8   66  13 o 8  4.78108e+00 1.44684e+00 5.42124e+01 245.139 -1.49572e+00 -3.22802e+00 0.00000e+00 0.00000e+00 9.71134e+01 245.139 4.29011e+01 245.139 0.8441 
1 1 1 8   67  0  f 0  7.12192e+00 9.71823e-01 7.11438e+00 295.236 1.69891e-01  -3.60442e-01 0.00000e+00 0.00000e+00 4.51064e+01 295.236 3.79920e+01 295.236 0.1954 
1 1 1 8   67  1  o 1  4.55078e+00 1.11433e+00 6.56918e+01 69.074  8.13464e-01  2.12732e+00  0.00000e+00 0.00000e+00 6.04629e+01 69.074  5.22889e+00 249.074 0.7385 
1 1 1 8   67  2  o 7  5.96261e+00 1.12457e+00 5.84507e+01 108.192 -8.61812e-01 2.62241e+00  0.00000e+00 0.00000e+00 1.18547e+02 108.192 6.00960e+01 108.192 0.7906 
1 1 1 8   67  3  o 11 9.79512e+00 7.45324e-01 1.73597e+02 354.927 1.49417e+01  -1.32654e+00 0.00000e+00 0.00000e+00 1.81769e+02 354.927 8.17190e+00 354.927 0.9661 
1 1 1 8   67  4  o 9  9.39280e+00 7.66846e-01 1.83080e+02 135.529 -1.14692e+01 1.12593e+01  0.00000e+00 0.00000e+00 1.58538e+02 135.529 2.45413e+01 315.529 0.9684 
1 1 1 8   67  5  o 18 1.33490e+01 8.81574e-01 1.44242e+02 128.237 -1.17491e+01 1.49104e+01  0.00000e+00 0.00000e+00 3.43755e+02 128.237 1.99513e+02 128.237 0.9733 
1 1 1 8   67  6  o 13 9.61713e+00 9.32521e-01 1.27381e+02 330.318 1.20770e+01  -6.88359e+00 0.00000e+00 0.00000e+00 2.20587e+02 330.318 9.32057e+01 330.318 0.9633 
1 1 1 8   67  7  o 2  3.22101e+00 1.00482e+00 1.10415e+02 167.416 -3.92643e+00 8.76526e-01  0.00000e+00 0.00000e+00 5.84776e+00 347.416 1.16262e+02 347.416 0.8644 
1 1 1 8   67  8  o 3  1.48705e+01 8.83558e-01 2.82354e+02 310.281 3.69932e+01  -4.36502e+01 0.00000e+00 0.00000e+00 2.71153e+02 310.281 1.12006e+01 130.281 0.9912 
1 1 1 8   67  9  o 5  5.02559e+00 1.16151e+00 1.75426e+02 171.842 -1.09490e+01 1.56964e+00  0.00000e+00 0.00000e+00 4.51308e+00 171.842 1.70912e+02 351.842 0.9537 
1 1 1 8   67  10 o 7  5.42408e+00 1.37098e+00 8.31225e+01 11.624  5.08435e+00  1.04589e+00  0.00000e+00 0.00000e+00 9.96252e+01 11.624  1.65027e+01 11.624  0.8976 
1 1 1 8   67  11 o 10 5.50013e+00 1.47273e+00 1.69030e+02 45.164  7.37138e+00  7.41370e+00  0.00000e+00 0.00000e+00 2.72147e+01 45.164  1.41816e+02 225.164 0.9509 
1 1 1 8   67  12 o 17 4.62892e+00 1.41594e+00 7.02279e+01 126.596 -2.52315e+00 3.39797e+00  0.00000e+00 0.00000e+00 8.11527e+01 126.596 1.09248e+01 126.596 0.8719 
1 1 1 8   67  13 o 3  5.31064e+00 1.62402e+00 1.35954e+02 45.695  6.08629e+00  6.23568e+00  0.00000e+00 0.00000e+00 5.13505e+01 45.695  8.46037e+01 225.695 0.9407 
1 1 1 8   68  0  o 6  1.54872e+01 6.53423e-01 2.95745e+02 87.550  1.68368e+00  3.93434e+01  0.00000e+00 0.00000e+00 2.77926e+02 87.550  1.78193e+01 267.549 0.9872 
1 1 1 8   68  1  o 15 3.72938e+00 1.01893e+00 8.12172e+01 161.878 -2.35835e+00 7.71824e-01  0.00000e+00 0.00000e+00 2.55754e+01 161.878 5.56417e+01 341.878 0.7630 
1 1 1 8   68  2  o 15 6.47666e+00 1.09418e+00 1.66370e+02 213.266 -7.19290e+00 -4.71867e+00 0.00000e+00 0.00000e+00 6.21658e+01 213.266 1.04205e+02 33.266  0.9399 
1 1 1 8   68  3  o 17 1.27970e+01 6.81523e-01 2.50419e+02 65.944  1.24878e+01  2.79750e+01  0.00000e+00 0.00000e+00 2.22163e+02 65.944  2.82558e+01 245.944 0.9835 
1 1 1 8   68  4  o 3  8.63904e+00 7.86215e-01 2.27755e+02 176.277 -1.97952e+01 1.28819e+00  0.00000e+00 0.00000e+00 8.83651e+01 176.277 1.39390e+02 356.277 0.9745 
1 1 1 8   68  5  o 2  3.86010e+00 9.73847e-01 5.51181e+01 296.024 8.84033e-01  -1.81057e+00 0.00000e+00 0.00000e+00 4.63816e+01 296.024 8.73648e+00 116.024 0.7002 
1 1 1 8   68  6  o 6  5.74645e+00 1.09278e+00 8.34103e+01 195.557 -5.07934e+00 -1.41405e+00 0.00000e+00 0.00000e+00 1.10661e+02 195.557 2.72508e+01 195.557 0.8993 
1 1 1 8   68  7  o 9  2.10439e+01 8.04311e-01 3.32280e+02 49.190  6.00273e+01  6.95178e+01  0.00000e+00 0.00000e+00 4.53595e+02 49.190  1.21315e+02 49.190  0.9945 
1 1 1 8   68  8  o 10 5.83232e+00 1.19964e+00 7.66840e+01 119.813 -2.50801e+00 4.37689e+00  0.00000e+00 0.00000e+00 1.19165e+02 119.813 4.24813e+01 119.813 0.8944 
1 1 1 8   68  9  o 14 3.97278e+00 1.14631e+00 9.58372e+01 205.637 -4.33712e+00 -2.08141e+00 0.00000e+00 0.00000e+00 3.67066e+01 205.637 5.91306e+01 25.637  0.8888 
1 1 1 8   68  10 o 16 3.33511e+00 1.10080e+00 6.21562e+01 346.015 2.88553e+00  -7.18644e-01 0.00000e+00 0.00000e+00 3.89742e+01 346.015 2.31820e+01 166.015 0.8080 
1 1 1 8   68  11 o 12 4.09610e+00 1.29029e+00 1.72203e+02 227.147 -6.46063e+00 -6.96386e+00 0.00000e+00 0.00000e+00 2.68642e+01 47.147  1.99067e+02 47.147  0.9458 
1 1 1 8   68  12 o 2  1.65837e+01 1.25518e+00 2.21536e+02 50.438  3.52078e+01  4.26158e+01  0.00000e+00 0.00000e+00 3.94721e+02 50.438  1.73185e+02 50.438  0.9909 
1 1 1 8   68  13 o 7  4.31153e+00 1.38070e+00 2.78612e+01 225.764 -1.20280e+00 -1.23533e+00 0.00000e+00 0.00000e+00 7.66830e+01 225.764 4.88218e+01 225.764 0.6469 
1 1 1 8   69  0  o 6  5.04095e+00 1.03085e+00 5.06631e+01 91.490  -5.40985e-02 2.08035e+00  0.00000e+00 0.00000e+00 8.37247e+01 91.490  3.30616e+01 91.490  0.7106 
1 1 1 8   69  1  o 19 1.15535e+01 7.71853e-01 1.58788e+02 253.944 -4.44978e+00 -1.54614e+01 0.00000e+00 0.00000e+00 2.61058e+02 253.944 1.02271e+02 253.944 0.9684 
1 1 1 8   69  2  o 16 1.50980e+01 7.08833e-01 2.45409e+02 57.311  1.87696e+01  2.92491e+01  0.00000e+00 0.00000e+00 3.13059e+02 57.311  6.76492e+01 57.311  0.9855 
1 1 1 8   69  3  o 8  6.23828e+00 9.39769e-01 7.77414e+01 147.386 -3.99217e+00 2.55450e+00  0.00000e+00 0.00000e+00 1.29974e+02 147.386 5.22323e+01 147.386 0.8870 
1 1 1 8   69  4  o 16 1.84381e+01 6.40113e-01 2.65627e+02 73.155  1.50300e+01  4.96403e+01  0.00000e+00 0.00000e+00 4.19907e+02 73.155  1.54280e+02 73.155  0.9903 
1 1 1 8   69  5  o 8  1.67569e+01 6.82599e-01 3.37384e+02 212.964 -5.31467e+01 -3.44659e+01 0.00000e+00 0.00000e+00 2.86782e+02 212.964 5.06021e+01 32.964  0.9921 
1 1 1 8   69  6  o 16 1.08196e+01 9.71447e-01 1.85350e+02 38.697  1.71884e+01  1.37691e+01  0.00000e+00 0.00000e+00 2.11545e+02 38.697  2.61958e+01 38.697  0.9770 
1 1 1 8   69  7  o 10 5.50376e+00 1.18996e+00 1.24002e+02 233.450 -4.61803e+00 -6.22962e+00 0.00000e+00 0.00000e+00 6.87993e+01 233.450 5.52030e+01 53.450  0.9331 
1 1 1 8   69  8  o 12 3.61360e+00 1.04502e+00 8.51920e+01 210.441 -3.61368e+00 -2.12358e+00 0.00000e+00 0.00000e+00 3.28871e+01 210.441 5.23049e+01 30.441  0.8705 
1 1 1 8   69  9  o 8  3.61932e+00 1.10932e+00 1.43396e+02 331.113 5.71869e+00  -3.15517e+00 0.00000e+00 0.00000e+00 1.84437e+01 151.113 1.61840e+02 151.113 0.9199 
1 1 1 8   69  10 o 7  8.15188e+00 1.33631e+00 1.51175e+02 163.654 -1.43230e+01 4.20076e+00  0.00000e+00 0.00000e+00 1.44257e+02 163.654 6.91820e+00 343.654 0.9659 
1 1 1 8   69  11 o 16 4.54516e+00 1.33893e+00 8.38329e+01 346.547 4.97535e+00  -1.19013e+00 0.00000e+00 0.00000e+00 6.89184e+01 346.547 1.49146e+01 166.547 0.8960 
1 1 1 8   69  12 o 9  5.76341e+00 1.53481e+00 1.61403e+02 339.232 1.08215e+01  -4.10382e+00 0.00000e+00 0.00000e+00 4.51339e+01 339.232 1.16269e+02 159.232 0.9558 
1 1 1 8   69  13 o 18 4.04555e+00 1.33734e+00 4.41166e+01 93.498  -1.68122e-01 2.75045e+00  0.00000e+00 0.00000e+00 7.56850e+01 93.498  3.15684e+01 93.498  0.7902 
1 1 1 8   70  0  o 11 9.26850e+00 8.01836e-01 1.59100e+02 224.562 -9.63031e+00 -9.48418e+00 0.00000e+00 0.00000e+00 1.75414e+02 224.562 1.63138e+01 224.562 0.9623 
1 1 1 8   70  1  o 2  1.42476e+01 7.35274e-01 1.59416e+02 180.331 -2.11481e+01 -1.22086e-01 0.00000e+00 0.00000e+00 3.62330e+02 180.331 2.02914e+02 180.331 0.9761 
1 1 1 8   70  2  o 17 7.27289e+00 7.58955e-01 1.29431e+02 157.965 -8.17800e+00 3.30999e+00  0.00000e+00 0.00000e+00 1.27527e+02 157.965 1.90393e+00 337.965 0.9415 
1 1 1 8   70  3  o 2  1.45729e+01 6.33641e-01 2.79793e+02 287.171 1.26424e+01  -4.09137e+01 0.00000e+00 0.00000e+00 2.60744e+02 287.171 1.90489e+01 107.171 0.9883 
1 1 1 8   70  4  o 1  1.02518e+01 7.35098e-01 2.14717e+02 11.900  2.34031e+01  4.93200e+00  0.00000e+00 0.00000e+00 1.61971e+02 11.900  5.27464e+01 191.900 0.9789 
1 1 1 8   70  5  o 14 4.30493e+00 9.94099e-01 1.55995e+02 57.293  4.01266e+00  6.24867e+00  0.00000e+00 0.00000e+00 5.70549e+00 237.293 1.61701e+02 237.293 0.9300 
1 1 1 8   70  6  o 18 4.14463e+00 1.12367e+00 5.64335e+01 53.342  1.49994e+00  2.01542e+00  0.00000e+00 0.00000e+00 6.27936e+01 53.342  6.36011e+00 53.342  0.7663 
1 1 1 8   70  7  o 9  3.58747e+00 9.10040e-01 1.15660e+02 63.506  2.36555e+00  4.74589e+00  0.00000e+00 0.00000e+00 5.52591e+00 63.506  1.10134e+02 243.506 0.9000 
1 1 1 8   70  8  o 14 1.03443e+01 1.02032e+00 2.07836e+02 345.832 2.82763e+01  -7.13804e+00 0.00000e+00 0.00000e+00 1.73675e+02 345.832 3.41605e+01 165.832 0.9827 
1 1 1 8   70  9  o 14 1.56485e+01 9.69145e-01 2.44872e+02 130.195 -3.46360e+01 4.09938e+01  0.00000e+00 0.00000e+00 3.36807e+02 130.195 9.19352e+01 130.195 0.9906 
1 1 1 8   70  10 o 19 3.28443e+00 1.06896e+00 8.04848e+01 180.900 -4.02313e+00 -6.31860e-02 0.00000e+00 0.00000e+00 2.60205e+01 180.900 5.44643e+01 0.900   0.8644 
1 1 1 8   70  11 o 15 6.51370e+00 1.55491e+00 1.66737e+02 319.954 9.45221e+00  -7.94432e+00 0.00000e+00 0.00000e+00 6.74243e+01 319.954 9.93126e+01 139.954 0.9586 
1 1 1 8   70  12 o 5  6.47564e+00 1.44925e+00 1.36219e+02 157.828 -1.07985e+01 4.40063e+00  0.00000e+00 0.00000e+00 9.58786e+01 157.828 4.03406e+01 337.828 0.9561 
1 1 1 8   70  13 o 19 3.36039e+00 1.15994e+00 4.11937e+01 211.098 -2.20715e+00 -1.33135e+00 0.00000e+00 0.00000e+00 5.61614e+01 211.098 1.49678e+01 211.098 0.7732 
1 1 1 8   71  0  f 0  1.30203e+01 7.28209e-01 3.02689e+02 224.350 -2.65841e+01 -2.59879e+01 0.00000e+00 0.00000e+00 1.78957e+02 224.350 1.23732e+02 44.350  0.9865 
1 1 1 8   71  1  o 6  1.73796e+01 7.23311e-01 3.14653e+02 108.149 -1.61028e+01 4.91249e+01  0.00000e+00 0.00000e+00 3.30928e+02 108.149 1.62758e+01 108.149 0.9903 
1 1 1 8   71  2  o 19 1.49765e+01 5.95912e-01 2.75567e+02 18.092  4.16393e+01  1.36030e+01  0.00000e+00 0.00000e+00 2.79887e+02 18.092  4.31982e+00 18.092  0.9885 
1 1 1 8   71  3  o 7  3.70834e+00 9.41914e-01 5.55641e+01 119.288 -9.74024e-01 1.73651e+00  0.00000e+00 0.00000e+00 4.13308e+01 119.288 1.42333e+01 299.288 0.6963 
1 1 1 8   71  4  f 0  1.45681e+01 6.77923e-01 2.28990e+02 60.610  1.83834e+01  3.26384e+01  0.00000e+00 0.00000e+00 3.10398e+02 60.610  8.14078e+01 60.610  0.9866 
1 1 1 8   71  5  o 18 9.39004e+00 8.05894e-01 1.48933e+02 163.604 -1.65956e+01 4.88300e+00  0.00000e+00 0.00000e+00 1.93146e+02 163.604 4.42131e+01 163.604 0.9707 
1 1 1 8   71  6  o 14 6.35970e+00 1.22040e+00 9.06960e+01 244.161 -2.71974e+00 -5.61621e+00 0.00000e+00 0.00000e+00 1.27925e+02 244.161 3.72285e+01 244.161 0.9159 
1 1 1 8   71  7  o 18 1.47640e+01 7.62893e-01 2.66915e+02 146.885 -4.62742e+01 3.01831e+01  0.00000e+00 0.00000e+00 2.82115e+02 146.885 1.51999e+01 146.885 0.9909 
1 1 1 8   71  8  o 2  7.74319e+00 1.18598e+00 1.53971e+02 316.665 1.07370e+01  -1.01305e+01 0.00000e+00 0.00000e+00 1.26556e+02 316.665 2.74157e+01 136.665 0.9655 
1 1 1 8   71  9  o 3  4.08697e+00 1.16368e+00 8.74959e+01 186.143 -4.86413e+00 -5.23486e-01 0.00000e+00 0.00000e+00 4.90897e+01 186.143 3.84062e+01 6.143   0.8908 
1 1 1 8   71  10 o 8  4.12411e+00 1.25423e+00 1.81927e+02 0.344   1.00486e+01  6.03897e-02  0.00000e+00 0.00000e+00 3.51586e+01 180.344 2.17085e+02 180.344 0.9489 
1 1 1 8   71  11 o 1  9.78274e+00 1.43814e+00 1.22242e+02 262.942 -1.82563e+00 -1.47458e+01 0.00000e+00 0.00000e+00 2.31986e+02 262.942 1.09744e+02 262.942 0.9657 
1 1 1 8   71  12 o 11 4.69444e+00 1.43562e+00 1.15988e+02 89.114  1.11664e-01  7.21943e+00  0.00000e+00 0.00000e+00 4.72751e+01 89.114  6.87127e+01 269.114 0.9279 
1 1 1 8   71  13 o 3  4.01628e+00 1.33088e+00 8.88569e+01 301.420 3.15270e+00  -5.16088e+00 0.00000e+00 0.00000e+00 4.85297e+01 301.420 4.03272e+01 121.420 0.9131 
1 1 1 8   72  0  o 18 9.26124e+00 7.83253e-01 1.51364e+02 297.300 6.59722e+00  -1.27817e+01 0.00000e+00 0.00000e+00 1.83565e+02 297.300 3.22010e+01 297.300 0.9646 
1 1 1 8   72  1  o 9  1.33557e+01 7.10722e-01 2.37424e+02 128.234 -2.02104e+01 2.56515e+01  0.00000e+00 0.00000e+00 2.55727e+02 128.234 1.83029e+01 128.234 0.9846 
1 1 1 8   72  2  o 14 5.19353e+00 9.37711e-01 5.83064e+01 161.917 -2.87753e+00 9.39582e-01  0.00000e+00 0.00000e+00 9.98799e+01 161.917 4.15735e+01 161.917 0.8120 
1 1 1 8   72  3  o 17 1.19883e+01 6.51640e-01 1.87090e+02 70.738  7.72560e+00  2.21074e+01  0.00000e+00 0.00000e+00 2.52978e+02 70.738  6.58886e+01 70.738  0.9784 
1 1 1 8   72  4  o 9  9.44105e+00 8.01858e-01 2.22571e+02 229.895 -1.61317e+01 -1.91536e+01 0.00000e+00 0.00000e+00 1.24532e+02 229.895 9.80391e+01 49.895  0.9798 
1 1 1 8   72  5  o 15 7.72170e+00 9.36129e-01 1.74978e+02 252.438 -4.53475e+00 -1.43281e+01 0.00000e+00 0.00000e+00 1.04959e+02 252.438 7.00190e+01 72.438  0.9661 
1 1 1 8   72  6  o 8  9.57543e+00 1.08365e+00 1.63766e+02 195.325 -1.81211e+01 -4.96578e+00 0.00000e+00 0.00000e+00 1.85842e+02 195.325 2.20760e+01 195.325 0.9730 
1 1 1 8   72  7  o 4  8.07321e+00 1.06056e+00 1.52043e+02 355.152 1.47618e+01  -1.25214e+00 0.00000e+00 0.00000e+00 1.40461e+02 355.152 1.15820e+01 175.152 0.9656 
1 1 1 8   72  8  o 9  1.13836e+01 9.78246e-01 2.05393e+02 153.370 -2.88552e+01 1.44682e+01  0.00000e+00 0.00000e+00 2.15004e+02 153.370 9.61067e+00 153.370 0.9844 
1 1 1 8   72  9  o 4  5.53029e+00 1.23621e+00 6.61279e+01 57.457  2.60852e+00  4.08782e+00  0.00000e+00 0.00000e+00 1.18438e+02 57.457  5.23096e+01 57.457  0.8898 
1 1 1 8   72  10 o 18 4.09577e+00 1.26860e+00 8.18175e+01 334.216 3.84745e+00  -1.85863e+00 0.00000e+00 0.00000e+00 5.23015e+01 334.216 2.95160e+01 154.216 0.8733 
1 1 1 8   72  11 o 8  5.40113e+00 1.46927e+00 1.07043e+02 173.304 -7.12879e+00 8.36933e-01  0.00000e+00 0.00000e+00 8.07412e+01 173.304 2.63018e+01 353.304 0.9275 
1 1 1 8   72  12 o 4  8.83307e+00 1.64809e+00 1.47390e+02 89.048  2.56057e-01  1.54015e+01  0.00000e+00 0.00000e+00 1.72675e+02 89.048  2.52843e+01 89.048  0.9670 
1 1 1 8   72  13 o 10 4.42995e+00 1.39493e+00 6.52537e+01 330.099 3.80320e+00  -2.18700e+00 0.00000e+00 0.00000e+00 8.02513e+01 330.099 1.49976e+01 330.099 0.8769 
1 1 1 8   73  0  o 6  6.60163e+00 1.03281e+00 1.05738e+02 46.576  4.63740e+00  4.89977e+00  0.00000e+00 0.00000e+00 1.22566e+02 46.576  1.68287e+01 46.576  0.9226 
1 1 1 8   73  1  o 4  8.90980e+00 7.02922e-01 1.55369e+02 38.652  1.16396e+01  9.30897e+00  0.00000e+00 0.00000e+00 1.67301e+02 38.652  1.19318e+01 38.652  0.9658 
1 1 1 8   73  2  o 13 8.48508e+00 7.26810e-01 1.82747e+02 21.791  1.56822e+01  6.26959e+00  0.00000e+00 0.00000e+00 1.25911e+02 21.791  5.68365e+01 201.791 0.9699 
1 1 1 8   73  3  o 1  1.04036e+01 6.64804e-01 1.83292e+02 167.029 -2.09163e+01 4.81780e+00  0.00000e+00 0.00000e+00 1.97754e+02 167.029 1.44620e+01 167.029 0.9764 
1 1 1 8   73  4  o 6  1.16719e+01 7.10973e-01 2.13585e+02 50.055  2.05108e+01  2.44916e+01  0.00000e+00 0.00000e+00 2.17375e+02 50.055  3.79094e+00 50.055  0.9842 
1 1 1 8   73  5  o 7  1.21817e+01 7.33973e-01 2.15501e+02 246.471 -1.31596e+01 -3.02230e+01 0.00000e+00 0.00000e+00 2.34527e+02 246.471 1.90265e+01 246.471 0.9847 
1 1 1 8   73  6  o 5  3.80359e+00 1.05312e+00 1.02666e+02 262.686 -5.95310e-01 -4.63822e+00 0.00000e+00 0.00000e+00 2.36615e+01 262.686 7.90045e+01 82.686  0.8853 
1 1 1 8   73  7  o 12 6.69623e+00 1.10005e+00 1.12053e+02 344.144 9.33896e+00  -2.65252e+00 0.00000e+00 0.00000e+00 1.25832e+02 344.144 1.37790e+01 344.144 0.9470 
1 1 1 8   73  8  o 18 7.59854e+00 1.43847e+00 2.24849e+02 115.156 -7.62889e+00 1.62449e+01  0.00000e+00 0.00000e+00 5.21009e+01 115.156 1.72748e+02 295.155 0.9717 
1 1 1 8   73  9  o 14 3.21989e+00 1.04263e+00 1.16815e+02 64.783  2.42443e+00  5.14823e+00  0.00000e+00 0.00000e+00 7.26365e+00 244.783 1.24078e+02 244.783 0.9073 
1 1 1 8   73  10 o 9  4.37653e+00 1.29857e+00 1.09969e+02 351.354 6.37232e+00  -9.68907e-01 0.00000e+00 0.00000e+00 4.07831e+01 351.354 6.91863e+01 171.354 0.9188 
1 1 1 8   73  11 o 2  3.70206e+00 1.18383e+00 3.25968e+01 270.678 2.26188e-02  -1.91135e+00 0.00000e+00 0.00000e+00 6.21265e+01 270.678 2.95297e+01 270.678 0.6827 
1 1 1 8   73  12 o 10 6.03167e+00 1.64123e+00 1.66860e+02 273.027 6.26435e-01  -1.18467e+01 0.00000e+00 0.00000e+00 4.93719e+01 273.027 1.17488e+02 93.027  0.9569 
1 1 1 8   73  13 o 7  6.34776e+00 1.71892e+00 1.18316e+02 59.561  4.66333e+00  7.93599e+00  0.00000e+00 0.00000e+00 1.06087e+02 59.561  1.22293e+01 239.561 0.9440 
1 1 1 8   74  0  o 1  5.68256e+00 1.01703e+00 4.05052e+01 196.547 -2.07252e+00 -6.15777e-01 0.00000e+00 0.00000e+00 1.13400e+02 196.547 7.28945e+01 196.547 0.7227 
1 1 1 8   74  1  o 13 1.09833e+01 6.19592e-01 2.89777e+02 159.269 -3.33773e+01 1.26326e+01  0.00000e+00 0.00000e+00 1.16158e+02 159.269 1.73619e+02 339.269 0.9859 
1 1 1 8   74  2  o 3  4.69768e+00 9.46482e-01 1.48937e+02 299.270 3.51735e+00  -6.27561e+00 0.00000e+00 0.00000e+00 1.44647e+01 299.270 1.34472e+02 119.270 0.9276 
1 1 1 8   74  3  o 13 5.93745e+00 9.23889e-01 9.92467e+01 336.748 6.15574e+00  -2.64493e+00 0.00000e+00 0.00000e+00 1.06063e+02 336.748 6.81619e+00 336.748 0.9220 
1 1 1 8   74  4  o 18 6.21354e+00 9.93927e-01 1.32089e+02 224.275 -6.38997e+00 -6.23036e+00 0.00000e+00 0.00000e+00 8.74910e+01 224.275 4.45979e+01 44.275  0.9422 
1 1 1 8   74  5  o 13 4.36102e+00 1.02524e+00 1.06541e+02 209.604 -4.82108e+00 -2.73920e+00 0.00000e+00 0.00000e+00 4.14401e+01 209.604 6.51011e+01 29.604  0.9047 
1 1 1 8   74  6  o 6  6.80554e+00 1.02335e+00 1.66800e+02 174.555 -1.44012e+01 1.37268e+00  0.00000e+00 0.00000e+00 7.94791e+01 174.555 8.73207e+01 354.555 0.9648 
1 1 1 8   74  7  o 12 6.58683e+00 1.14919e+00 7.06268e+01 272.083 2.12637e-01  -5.84716e+00 0.00000e+00 0.00000e+00 1.54178e+02 272.083 8.35514e+01 272.083 0.9100 
1 1 1 8   74  8  o 10 3.82786e+00 1.16109e+00 1.02885e+02 269.961 -3.37391e-03 -4.97944e+00 0.00000e+00 0.00000e+00 2.52886e+01 269.961 7.75968e+01 89.961  0.8929 
1 1 1 8   74  9  o 6  7.97610e+00 1.27403e+00 1.04938e+02 75.962  2.54891e+00  1.01942e+01  0.00000e+00 0.00000e+00 1.79505e+02 75.962  7.45665e+01 75.962  0.9512 
1 1 1 8   74  10 o 13 6.30302e+00 1.42281e+00 1.01702e+02 76.465  1.90275e+00  7.90440e+00  0.00000e+00 0.00000e+00 1.19511e+02 76.465  1.78090e+01 76.465  0.9363 
1 1 1 8   74  11 o 3  4.55586e+00 1.36978e+00 9.40495e+01 198.230 -5.61103e+00 -1.84806e+00 0.00000e+00 0.00000e+00 6.14548e+01 198.230 3.25948e+01 18.230  0.9109 
1 1 1 8   74  12 o 9  6.22082e+00 1.60197e+00 1.19854e+02 29.945  7.87267e+00  4.53530e+00  0.00000e+00 0.00000e+00 9.99378e+01 29.945  1.99160e+01 209.945 0.9432 
1 1 1 8   74  13 o 14 5.56981e+00 1.60415e+00 1.23024e+02 109.321 -3.07124e+00 8.75982e+00  0.00000e+00 0.00000e+00 7.39390e+01 109.321 4.90852e+01 289.321 0.9445 
1 1 1 8   75  0  f 0  1.55700e+01 6.83784e-01 2.24029e+02 306.610 2.14780e+01  -2.89101e+01 0.00000e+00 0.00000e+00 3.51214e+02 306.610 1.27184e+02 306.610 0.9860 
1 1 1 8   75  1  o 6  6.42498e+00 8.81895e-01 1.34296e+02 228.932 -5.95947e+00 -6.83916e+00 0.00000e+00 0.00000e+00 9.28270e+01 228.932 4.14690e+01 48.932  0.9432 
1 1 1 8   75  2  o 2  1.64947e+01 6.09139e-01 2.96893e+02 113.726 -2.36099e+01 5.37188e+01  0.00000e+00 0.00000e+00 3.16189e+02 113.726 1.92952e+01 113.726 0.9914 
1 1 1 8   75  3  o 16 1.46797e+01 6.88421e-01 2.37508e+02 304.500 2.54444e+01  -3.70214e+01 0.00000e+00 0.00000e+00 3.06754e+02 304.500 6.92464e+01 304.500 0.9888 
1 1 1 8   75  4  o 9  5.32162e+00 9.38155e-01 8.42320e+01 104.925 -1.34222e+00 5.03544e+00  0.00000e+00 0.00000e+00 9.49840e+01 104.925 1.07520e+01 104.925 0.8981 
1 1 1 8   75  5  o 7  4.13928e+00 1.02835e+00 8.75249e+01 342.229 4.05463e+00  -1.29950e+00 0.00000e+00 0.00000e+00 4.79511e+01 342.229 3.95738e+01 162.229 0.8728 
1 1 1 8   75  6  o 13 1.12212e+01 8.16983e-01 1.96035e+02 134.372 -2.07064e+01 2.11655e+01  0.00000e+00 0.00000e+00 2.17601e+02 134.372 2.15658e+01 134.372 0.9830 
1 1 1 8   75  7  o 4  4.09418e+00 1.10656e+00 4.47535e+01 13.783  2.29668e+00  5.63410e-01  0.00000e+00 0.00000e+00 7.03052e+01 13.783  2.55518e+01 13.783  0.7495 
1 1 1 8   75  8  o 14 3.31131e+00 1.08886e+00 1.08179e+02 118.311 -2.42829e+00 4.50774e+00  0.00000e+00 0.00000e+00 3.07272e+00 118.311 1.05106e+02 298.311 0.8961 
1 1 1 8   75  9  o 18 3.70678e+00 1.13509e+00 1.05493e+02 302.013 3.14402e+00  -5.02893e+00 0.00000e+00 0.00000e+00 2.11294e+01 302.013 8.43631e+01 122.013 0.9113 
1 1 1 8   75  10 o 16 4.04833e+00 1.20385e+00 5.47635e+01 8.893   3.13602e+00  4.90715e-01  0.00000e+00 0.00000e+00 6.99583e+01 8.893   1.51948e+01 8.893   0.8221 
1 1 1 8   75  11 o 4  1.00512e+01 1.39824e+00 1.78191e+02 187.972 -2.51809e+01 -3.52630e+00 0.00000e+00 0.00000e+00 1.90884e+02 187.972 1.26930e+01 187.972 0.9801 
1 1 1 8   75  12 o 4  4.57447e+00 1.33728e+00 2.22757e+01 258.760 -3.06494e-01 -1.54225e+00 0.00000e+00 0.00000e+00 8.28298e+01 258.760 6.05542e+01 258.760 0.6135 
1 1 1 8   76  0  o 13 1.01784e+01 5.96853e-01 1.43487e+02 208.323 -1.54689e+01 -8.33704e+00 0.00000e+00 0.00000e+00 2.26802e+02 208.323 8.33155e+01 208.323 0.9711 
1 1 1 8   76  1  o 7  3.28494e+00 8.37322e-01 1.05667e+02 22.636  3.76472e+00  1.56985e+00  0.00000e+00 0.00000e+00 9.94594e-01 22.636  1.04672e+02 202.636 0.8665 
1 1 1 8   76  2  o 13 1.46976e+01 6.17963e-01 2.42686e+02 342.372 4.48680e+01  -1.42570e+01 0.00000e+00 0.00000e+00 3.02320e+02 342.372 5.96341e+01 342.372 0.9893 
1 1 1 8   76  3  o 11 1.72351e+01 6.14637e-01 3.22892e+02 183.880 -7.58228e+01 -5.14221e+00 0.00000e+00 0.00000e+00 3.18948e+02 183.880 3.94382e+00 3.880   0.9934 
1 1 1 8   76  4  o 5  6.72998e+00 9.30509e-01 1.40908e+02 176.015 -1.17790e+01 8.20580e-01  0.00000e+00 0.00000e+00 1.00478e+02 176.015 4.04294e+01 356.015 0.9567 
1 1 1 8   76  5  o 4  7.85025e+00 8.81939e-01 1.57883e+02 64.637  6.85615e+00  1.44629e+01  0.00000e+00 0.00000e+00 1.27103e+02 64.637  3.07794e+01 244.637 0.9682 
1 1 1 8   76  6  o 11 8.30846e+00 9.69310e-01 1.97143e+02 197.450 -2.16328e+01 -6.79991e+00 0.00000e+00 0.00000e+00 1.07419e+02 197.450 8.97246e+01 17.450  0.9777 
1 1 1 8   76  7  o 12 7.79750e+00 1.04378e+00 1.91886e+02 253.744 -5.79521e+00 -1.98751e+01 0.00000e+00 0.00000e+00 9.32954e+01 253.744 9.85901e+01 73.744  0.9755 
1 1 1 8   76  8  o 6  5.38796e+00 1.42655e+00 1.35098e+02 320.664 6.62750e+00  -5.43152e+00 0.00000e+00 0.00000e+00 5.46915e+01 320.664 8.04069e+01 140.664 0.9397 
1 1 1 8   76  9  o 9  2.98831e+00 9.90228e-01 4.72858e+01 72.562  6.79033e-01  2.16177e+00  0.00000e+00 0.00000e+00 3.52492e+01 72.562  1.20365e+01 252.562 0.7369 
1 1 1 8   76  10 o 15 3.31871e+00 1.07967e+00 6.25101e+01 84.283  3.29705e-01  3.29305e+00  0.00000e+00 0.00000e+00 4.07590e+01 84.283  2.17511e+01 264.283 0.8305 
1 1 1 8   76  11 o 12 4.45606e+00 1.35527e+00 8.77750e+01 49.504  3.56885e+00  4.17910e+00  0.00000e+00 0.00000e+00 6.30647e+01 49.504  2.47103e+01 229.503 0.9037 
1 1 1 8   76  12 o 4  8.20442e+00 1.65852e+00 4.32994e+01 283.284 1.03476e+00  -4.38266e+00 0.00000e+00 0.00000e+00 2.27158e+02 283.284 1.83858e+02 283.284 0.8804 
1 1 1 8   77  0  o 13 5.47797e+00 8.00015e-01 7.53050e+01 143.868 -4.13569e+00 3.01938e+00  0.00000e+00 0.00000e+00 1.08551e+02 143.868 3.32460e+01 143.868 0.8961 
1 1 1 8   77  1  o 4  2.67919e+00 7.31226e-01 3.12577e+01 348.413 1.04147e+00  -2.13545e-01 0.00000e+00 0.00000e+00 1.57498e+01 348.413 1.55079e+01 168.413 0.4683 
1 1 1 8   77  2  o 18 1.31436e+01 5.75587e-01 1.96006e+02 226.085 -2.24157e+01 -2.32810e+01 0.00000e+00 0.00000e+00 2.88850e+02 226.085 9.28444e+01 226.085 0.9844 
1 1 1 8   77  3  o 6  7.41296e+00 8.48136e-01 8.98717e+01 146.139 -6.65523e+00 4.46549e+00  0.00000e+00 0.00000e+00 1.70005e+02 146.139 8.01336e+01 146.139 0.9354 
1 1 1 8   77  4  f 0  3.76494e+00 1.00015e+00 8.70540e+01 337.909 3.78230e+00  -1.53513e+00 0.00000e+00 0.00000e+00 3.52451e+01 337.909 5.18088e+01 157.909 0.8666 
1 1 1 8   77  5  o 13 1.07721e+01 7.84948e-01 1.70594e+02 271.687 7.50477e-01  -2.54762e+01 0.00000e+00 0.00000e+00 2.25204e+02 271.687 5.46097e+01 271.687 0.9802 
1 1 1 8   77  6  o 8  6.19120e+00 1.12515e+00 1.07493e+02 322.385 6.71495e+00  -5.17398e+00 0.00000e+00 0.00000e+00 1.10434e+02 322.385 2.94131e+00 322.385 0.9390 
1 1 1 8   77  7  o 8  1.33048e+01 8.30676e-01 2.93582e+02 90.031  -3.46319e-02 6.31701e+01  0.00000e+00 0.00000e+00 2.01151e+02 90.031  9.24312e+01 270.031 0.9921 
1 1 1 8   77  8  f 0  4.83913e+00 1.34222e+00 4.16110e+01 334.049 2.27656e+00  -1.10792e+00 0.00000e+00 0.00000e+00 9.77475e+01 334.049 5.61364e+01 334.049 0.7684 
1 1 1 8   77  9  o 5  1.87695e+01 9.33455e-01 3.02377e+02 183.371 -9.54549e+01 -5.62207e+00 0.00000e+00 0.00000e+00 3.97227e+02 183.371 9.48503e+01 183.371 0.9948 
1 1 1 8   77  10 o 8  3.47051e+00 1.10839e+00 6.43163e+01 324.651 2.88132e+00  -2.04376e+00 0.00000e+00 0.00000e+00 4.52512e+01 324.651 1.90651e+01 144.651 0.8428 
1 1 1 8   77  11 o 15 3.21842e+00 1.10662e+00 6.49890e+01 245.140 -1.55471e+00 -3.35551e+00 0.00000e+00 0.00000e+00 3.75561e+01 245.140 2.74330e+01 65.140  0.8508 
1 1 1 8   77  12 o 8  4.54113e+00 1.38487e+00 7.27139e+01 145.842 -4.43597e+00 3.00992e+00  0.00000e+00 0.00000e+00 8.04716e+01 145.842 7.75773e+00 145.842 0.9011 
1 1 1 8   78  0  o 19 9.19637e+00 6.59017e-01 1.03755e+02 344.769 1.12814e+01  -3.07155e+00 0.00000e+00 0.00000e+00 2.25540e+02 344.769 1.21785e+02 344.769 0.9562 
1 1 1 8   78  1  o 14 6.39979e+00 7.18238e-01 9.91211e+01 88.345  2.20007e-01  7.61667e+00  0.00000e+00 0.00000e+00 1.24262e+02 88.345  2.51408e+01 88.345  0.9319 
1 1 1 8   78  2  o 13 1.16520e+01 6.04082e-01 1.41226e+02 70.650  7.13413e+00  2.03146e+01  0.00000e+00 0.00000e+00 2.85063e+02 70.650  1.43837e+02 70.650  0.9765 
1 1 1 8   78  3  o 12 5.37708e+00 8.50031e-01 1.27099e+02 25.828  7.91482e+00  3.83091e+00  0.00000e+00 0.00000e+00 6.25619e+01 25.828  6.45371e+01 205.828 0.9413 
1 1 1 8   78  4  o 14 5.59927e+00 1.00886e+00 7.93894e+01 305.359 3.13970e+00  -4.42471e+00 0.00000e+00 0.00000e+00 1.09968e+02 305.359 3.05786e+01 305.359 0.9024 
1 1 1 8   78  5  o 18 9.70748e+00 8.57326e-01 1.71007e+02 71.606  7.84279e+00  2.35847e+01  0.00000e+00 0.00000e+00 1.85412e+02 71.606  1.44049e+01 71.606  0.9797 
1 1 1 8   78  6  o 18 9.81164e+00 8.71209e-01 1.57959e+02 180.223 -2.25776e+01 -8.77037e-02 0.00000e+00 0.00000e+00 2.01517e+02 180.223 4.35585e+01 180.223 0.9776 
1 1 1 8   78  7  o 10 1.15259e+01 8.58037e-01 1.74612e+02 19.382  3.08786e+01  1.08629e+01  0.00000e+00 0.00000e+00 2.50667e+02 19.382  7.60546e+01 19.382  0.9846 
1 1 1 8   78  8  o 3  1.30205e+01 1.10885e+00 2.03009e+02 245.695 -1.61628e+01 -3.57890e+01 0.00000e+00 0.00000e+00 2.78608e+02 245.695 7.55986e+01 245.695 0.9872 
1 1 1 8   78  9  o 3  5.29114e+00 1.32698e+00 9.87243e+01 24.774  6.42015e+00  2.96294e+00  0.00000e+00 0.00000e+00 8.48872e+01 24.774  1.38371e+01 204.774 0.9263 
1 1 1 8   78  10 o 12 5.07361e+00 1.32660e+00 6.19543e+01 216.337 -3.62161e+00 -2.66390e+00 0.00000e+00 0.00000e+00 1.05302e+02 216.337 4.33474e+01 216.337 0.8802 
1 1 1 8   78  11 o 9  6.91184e+00 1.53643e+00 1.62446e+02 0.156   1.42887e+01  3.87887e-02  0.00000e+00 0.00000e+00 8.71092e+01 0.156   7.53372e+01 180.155 0.9643 
1 1 1 8   78  12 o 4  4.33043e+00 1.23895e+00 6.25692e+01 67.161  1.91402e+00  4.54452e+00  0.00000e+00 0.00000e+00 8.19598e+01 67.161  1.93906e+01 67.161  0.8918 
1 1 1 8   79  0  o 7  8.05519e+00 6.81440e-01 1.06897e+02 331.092 1.00416e+01  -5.54503e+00 0.00000e+00 0.00000e+00 1.81212e+02 331.092 7.43146e+01 331.092 0.9554 
1 1 1 8   79  1  o 18 1.21544e+01 7.88630e-01 2.36276e+02 156.166 -3.23016e+01 1.42697e+01  0.00000e+00 0.00000e+00 2.12400e+02 156.166 2.38767e+01 336.166 0.9857 
1 1 1 8   79  2  o 8  7.12293e+00 7.67808e-01 1.72639e+02 195.294 -1.57730e+01 -4.31319e+00 0.00000e+00 0.00000e+00 8.58771e+01 195.294 8.67619e+01 15.294  0.9689 
1 1 1 8   79  3  o 6  3.72452e+00 8.01272e-01 4.79953e+01 327.543 1.94811e+00  -1.23903e+00 0.00000e+00 0.00000e+00 5.56084e+01 327.543 7.61311e+00 327.543 0.7425 
1 1 1 8   79  4  o 11 1.01677e+01 6.83511e-01 1.68981e+02 107.442 -7.42910e+00 2.36454e+01  0.00000e+00 0.00000e+00 2.04215e+02 107.442 3.52342e+01 107.442 0.9796 
1 1 1 8   79  5  o 12 1.73343e+01 6.54183e-01 3.25342e+02 276.066 9.56836e+00  -9.00349e+01 0.00000e+00 0.00000e+00 3.20571e+02 276.066 4.77013e+00 96.066  0.9945 
1 1 1 8   79  6  o 8  7.99726e+00 1.00197e+00 9.99500e+01 104.792 -2.88607e+00 1.09295e+01  0.00000e+00 0.00000e+00 1.86123e+02 104.792 8.61735e+01 104.792 0.9547 
1 1 1 8   79  7  o 17 4.27203e+00 1.11790e+00 7.16253e+01 1.237   4.35876e+00  9.41499e-02  0.00000e+00 0.00000e+00 6.85947e+01 1.237   3.03055e+00 181.237 0.8761 
1 1 1 8   79  8  o 5  8.96467e+00 1.11898e+00 1.83987e+02 315.687 1.71901e+01  -1.67829e+01 0.00000e+00 0.00000e+00 1.44777e+02 315.687 3.92100e+01 135.687 0.9790 
1 1 1 8   79  9  o 4  1.25897e+01 1.11317e+00 2.86457e+02 72.360  1.65874e+01  5.21624e+01  0.00000e+00 0.00000e+00 1.80750e+02 72.360  1.05707e+02 252.360 0.9908 
1 1 1 8   79  10 o 5  4.86044e+00 1.40427e+00 1.24857e+02 213.120 -6.94364e+00 -4.52997e+00 0.00000e+00 0.00000e+00 4.57817e+01 213.120 7.90749e+01 33.120  0.9376 
1 1 1 8   79  11 o 2  9.61682e+00 1.33601e+00 1.40812e+02 128.078 -1.23856e+01 1.58086e+01  0.00000e+00 0.00000e+00 2.10088e+02 128.078 6.92769e+01 128.078 0.9748 
1 1 1 8   79  12 o 8  4.31085e+00 1.30708e+00 7.77461e+01 260.313 -9.60394e-01 -5.62631e+00 0.00000e+00 0.00000e+00 6.86472e+01 260.313 9.09892e+00 80.313  0.9076 
1 1 1 8   80  0  o 13 3.87368e+00 8.60202e-01 7.56298e+01 253.624 -1.05192e+00 -3.57979e+00 0.00000e+00 0.00000e+00 4.79496e+01 253.624 2.76802e+01 73.625  0.8523 
1 1 1 8   80  1  o 4  5.84094e+00 7.93753e-01 1.71049e+02 274.616 1.05765e+00  -1.30996e+01 0.00000e+00 0.00000e+00 3.91473e+01 274.616 1.31902e+02 94.616  0.9612 
1 1 1 8   80  2  o 17 5.32284e+00 8.78018e-01 1.34763e+02 4.928   8.95672e+00  7.72218e-01  0.00000e+00 0.00000e+00 5.31364e+01 4.928   8.16270e+01 184.928 0.9426 
1 1 1 8   80  3  o 6  5.59013e+00 8.88252e-01 8.28560e+01 284.663 1.59221e+00  -6.08511e+00 0.00000e+00 0.00000e+00 1.09072e+02 284.663 2.62164e+01 284.663 0.9166 
1 1 1 8   80  4  o 13 1.03729e+01 6.77138e-01 1.92625e+02 282.362 6.94102e+00  -3.16705e+01 0.00000e+00 0.00000e+00 1.89901e+02 282.362 2.72456e+00 102.362 0.9845 
1 1 1 8   80  5  o 11 5.25228e+00 9.84135e-01 1.36875e+02 115.572 -4.27250e+00 8.92848e+00  0.00000e+00 0.00000e+00 4.96631e+01 115.572 8.72117e+01 295.572 0.9481 
1 1 1 8   80  6  o 18 9.30817e+00 8.38030e-01 1.49373e+02 102.299 -4.76836e+00 2.18708e+01  0.00000e+00 0.00000e+00 1.91441e+02 102.299 4.20671e+01 102.299 0.9774 
1 1 1 8   80  7  o 15 5.87355e+00 1.04686e+00 4.15718e+01 333.963 3.31036e+00  -1.61720e+00 0.00000e+00 0.00000e+00 1.45479e+02 333.963 1.03907e+02 333.963 0.8502 
1 1 1 8   80  8  o 7  3.74554e+00 9.91063e-01 1.94081e+01 20.478  1.02083e+00  3.81231e-01  0.00000e+00 0.00000e+00 4.75445e+01 20.478  2.81364e+01 20.478  0.4773 
1 1 1 8   80  9  o 6  9.46778e+00 1.11693e+00 1.50956e+02 110.543 -7.69816e+00 2.05422e+01  0.00000e+00 0.00000e+00 1.95395e+02 110.543 4.44392e+01 110.543 0.9769 
1 1 1 8   80  10 o 2  7.20036e+00 1.22284e+00 1.02581e+02 191.665 -1.12391e+01 -2.32031e+00 0.00000e+00 0.00000e+00 1.54947e+02 191.665 5.23664e+01 191.665 0.9554 
1 1 1 8   80  11 o 9  4.00176e+00 1.23925e+00 4.47200e+01 240.608 -1.46170e+00 -2.59491e+00 0.00000e+00 0.00000e+00 7.63430e+01 240.608 3.16230e+01 240.608 0.8084 
1 1 1 8   80  12 o 1  4.50168e+00 1.27876e+00 1.13485e+02 279.899 1.51927e+00  -8.70571e+00 0.00000e+00 0.00000e+00 4.50874e+01 279.899 6.83971e+01 99.899  0.9416 
1 1 1 8   81  0  o 15 9.32707e+00 6.03419e-01 1.35031e+02 142.751 -1.46486e+01 1.11386e+01  0.00000e+00 0.00000e+00 2.04382e+02 142.751 6.93513e+01 142.751 0.9724 
1 1 1 8   81  1  o 17 4.91639e+00 8.28271e-01 5.58646e+01 254.320 -9.48148e-01 -3.37773e+00 0.00000e+00 0.00000e+00 9.90051e+01 254.320 4.31405e+01 254.320 0.8415 
1 1 1 8   81  2  o 16 6.49268e+00 7.50347e-01 1.36594e+02 108.612 -4.07960e+00 1.21139e+01  0.00000e+00 0.00000e+00 9.67869e+01 108.612 3.98074e+01 288.612 0.9600 
1 1 1 8   81  3  o 7  8.34042e+00 7.39460e-01 2.13555e+02 321.853 1.94375e+01  -1.52665e+01 0.00000e+00 0.00000e+00 9.23873e+01 321.853 1.21168e+02 141.853 0.9796 
1 1 1 8   81  4  o 8  1.37547e+01 6.19891e-01 2.43789e+02 182.829 -5.44666e+01 -2.69174e+00 0.00000e+00 0.00000e+00 2.66599e+02 182.829 2.28107e+01 182.829 0.9908 
1 1 1 8   81  5  o 10 6.70359e+00 9.02129e-01 1.65205e+02 97.876  -2.26239e+00 1.63548e+01  0.00000e+00 0.00000e+00 7.81404e+01 97.876  8.70644e+01 277.876 0.9692 
1 1 1 8   81  6  o 15 4.21963e+00 1.02684e+00 1.23951e+02 133.795 -5.36259e+00 5.59311e+00  0.00000e+00 0.00000e+00 2.35039e+01 133.795 1.00448e+02 313.795 0.9330 
1 1 1 8   81  7  o 16 4.69012e+00 1.00797e+00 6.95394e+01 136.226 -3.44778e+00 3.30336e+00  0.00000e+00 0.00000e+00 8.64134e+01 136.226 1.68740e+01 136.226 0.8879 
1 1 1 8   81  8  o 18 1.82182e+01 7.89675e-01 2.61823e+02 313.827 5.94313e+01  -6.19168e+01 0.00000e+00 0.00000e+00 4.16367e+02 313.827 1.54544e+02 313.827 0.9942 
1 1 1 8   81  9  o 13 1.13817e+01 9.85179e-01 2.02290e+02 165.943 -3.82705e+01 9.58236e+00  0.00000e+00 0.00000e+00 2.18375e+02 165.943 1.60851e+01 165.943 0.9872 
1 1 1 8   81  10 o 10 3.96254e+00 1.17166e+00 6.62936e+01 223.669 -3.22726e+00 -3.08074e+00 0.00000e+00 0.00000e+00 6.40991e+01 223.669 2.19452e+00 43.669  0.8792 
1 1 1 8   81  11 o 4  3.75840e+00 1.19368e+00 5.87790e+01 338.307 3.79514e+00  -1.50973e+00 0.00000e+00 0.00000e+00 6.30986e+01 338.307 4.31953e+00 338.307 0.8667 
1 1 1 8   81  12 o 8  4.30178e+00 1.31553e+00 9.59659e+01 118.195 -3.39220e+00 6.32786e+00  0.00000e+00 0.00000e+00 5.32610e+01 118.195 4.27049e+01 298.195 0.9275 
1 1 1 8   82  0  o 2  6.28050e+00 7.27929e-01 1.34051e+02 93.734  -7.52399e-01 1.15301e+01  0.00000e+00 0.00000e+00 9.05120e+01 93.734  4.35393e+01 273.733 0.9557 
1 1 1 8   82  1  o 18 1.75549e+01 5.63717e-01 2.83580e+02 255.523 -1.91884e+01 -7.43199e+01 0.00000e+00 0.00000e+00 3.69101e+02 255.523 8.55210e+01 255.523 0.9935 
1 1 1 8   82  2  o 14 5.27381e+00 8.15468e-01 1.01877e+02 68.112  2.73940e+00  6.81851e+00  0.00000e+00 0.00000e+00 8.15644e+01 68.112  2.03129e+01 248.112 0.9292 
1 1 1 8   82  3  o 3  1.56974e+01 6.04239e-01 2.44013e+02 201.529 -5.79234e+01 -2.28501e+01 0.00000e+00 0.00000e+00 3.38944e+02 201.529 9.49311e+01 201.529 0.9919 
1 1 1 8   82  4  o 3  2.64743e+00 8.05867e-01 3.44458e+01 10.864  1.34312e+00  2.57769e-01  0.00000e+00 0.00000e+00 2.12310e+01 10.864  1.32148e+01 190.864 0.5617 
1 1 1 8   82  5  o 17 5.53142e+00 8.98752e-01 1.10177e+02 62.575  4.38403e+00  8.44862e+00  0.00000e+00 0.00000e+00 8.57437e+01 62.575  2.44337e+01 242.575 0.9459 
1 1 1 8   82  6  o 8  3.97427e+00 1.00205e+00 5.50385e+01 233.423 -1.98571e+00 -2.67599e+00 0.00000e+00 0.00000e+00 6.87508e+01 233.423 1.37123e+01 233.423 0.8318 
1 1 1 8   82  7  o 12 1.21531e+01 7.78534e-01 2.29414e+02 9.152   5.17465e+01  8.33636e+00  0.00000e+00 0.00000e+00 2.21257e+02 9.152   8.15746e+00 189.152 0.9904 
1 1 1 8   82  8  o 13 1.28545e+01 8.73423e-01 2.81473e+02 188.856 -6.46732e+01 -1.00762e+01 0.00000e+00 0.00000e+00 1.96064e+02 188.856 8.54088e+01 8.856   0.9923 
1 1 1 8   82  9  o 10 9.15132e+00 1.12872e+00 1.60093e+02 353.483 2.39296e+01  -2.73347e+00 0.00000e+00 0.00000e+00 1.75245e+02 353.483 1.51516e+01 353.483 0.9790 
1 1 1 8   82  10 o 15 4.06666e+00 1.13208e+00 5.15683e+01 146.687 -3.05396e+00 2.00706e+00  0.00000e+00 0.00000e+00 7.75927e+01 146.687 2.60243e+01 146.687 0.8488 
1 1 1 8   82  11 o 2  4.37271e+00 1.32240e+00 7.79380e+01 297.129 2.65864e+00  -5.18890e+00 0.00000e+00 0.00000e+00 7.08538e+01 297.129 7.08417e+00 117.129 0.9096 
1 1 1 8   82  12 o 17 5.32287e+00 1.30439e+00 7.56655e+01 45.217  5.29512e+00  5.33544e+00  0.00000e+00 0.00000e+00 1.09618e+02 45.217  3.39529e+01 45.217  0.9309 
1 1 1 8   83  0  o 5  6.22360e+00 7.73751e-01 7.73836e+01 353.915 6.66344e+00  -7.10386e-01 0.00000e+00 0.00000e+00 1.37259e+02 353.915 5.98753e+01 353.915 0.9220 
1 1 1 8   83  1  o 5  7.44033e+00 7.13058e-01 9.82020e+01 50.492  6.51060e+00  7.89574e+00  0.00000e+00 0.00000e+00 1.66210e+02 50.492  6.80081e+01 50.492  0.9498 
1 1 1 8   83  2  o 7  1.45411e+01 5.91492e-01 1.94061e+02 134.714 -3.32735e+01 3.36074e+01  0.00000e+00 0.00000e+00 3.44344e+02 134.714 1.50283e+02 134.714 0.9894 
1 1 1 8   83  3  o 4  1.14611e+01 6.37529e-01 2.00359e+02 25.499  3.31818e+01  1.58264e+01  0.00000e+00 0.00000e+00 2.22761e+02 25.499  2.24021e+01 25.499  0.9863 
1 1 1 8   83  4  o 9  5.36653e+00 9.35412e-01 7.88195e+01 129.741 -3.96226e+00 4.76568e+00  0.00000e+00 0.00000e+00 1.05064e+02 129.741 2.62448e+01 129.741 0.9153 
1 1 1 8   83  5  o 15 7.83815e+00 7.99910e-01 1.49772e+02 268.328 -5.73788e-01 -1.96627e+01 0.00000e+00 0.00000e+00 1.36102e+02 268.328 1.36704e+01 88.328  0.9742 
1 1 1 8   83  6  o 9  8.14294e+00 8.77558e-01 1.73487e+02 341.340 2.22186e+01  -7.50312e+00 0.00000e+00 0.00000e+00 1.24779e+02 341.340 4.87080e+01 161.340 0.9784 
1 1 1 8   83  7  o 18 6.30623e+00 1.05494e+00 1.65470e+02 106.090 -4.45562e+00 1.54474e+01  0.00000e+00 0.00000e+00 6.31280e+01 106.090 1.02342e+02 286.090 0.9684 
1 1 1 8   83  8  o 2  4.83462e+00 1.18708e+00 1.09981e+02 137.730 -5.68668e+00 5.16900e+00  0.00000e+00 0.00000e+00 5.87489e+01 137.730 5.12321e+01 317.730 0.9325 
1 1 1 8   83  9  o 14 3.13987e+00 1.01330e+00 6.82449e+01 34.048  3.19763e+00  2.16072e+00  0.00000e+00 0.00000e+00 3.25527e+01 34.048  3.56922e+01 214.048 0.8579 
1 1 1 8   83  10 o 5  3.15036e+00 1.03704e+00 3.18093e+01 221.788 -1.38154e+00 -1.23473e+00 0.00000e+00 0.00000e+00 4.74001e+01 221.788 1.55908e+01 221.788 0.6721 
1 1 1 8   83  11 o 4  3.02082e+00 1.02670e+00 5.33848e+01 66.933  1.37397e+00  3.22640e+00  0.00000e+00 0.00000e+00 4.16795e+01 66.933  1.17053e+01 246.933 0.8415 
1 1 1 8   83  12 o 19 1.05596e+01 1.48769e+00 1.15291e+02 342.547 1.81337e+01  -5.70133e+00 0.00000e+00 0.00000e+00 2.68950e+02 342.547 1.53659e+02 342.547 0.9733 
1 1 1 8   84  0  o 10 8.91119e+00 6.53588e-01 1.53740e+02 43.853  1.61630e+01  1.55287e+01  0.00000e+00 0.00000e+00 1.71984e+02 43.853  1.82439e+01 43.853  0.9774 
1 1 1 8   84  1  o 11 9.93749e+00 6.29177e-01 1.73984e+02 147.639 -2.35024e+01 1.48925e+01  0.00000e+00 0.00000e+00 1.91006e+02 147.639 1.70216e+01 147.639 0.9819 
1 1 1 8   84  2  o 1  9.95266e+00 6.52964e-01 2.02285e+02 58.344  1.69356e+01  2.74680e+01  0.00000e+00 0.00000e+00 1.64284e+02 58.344  3.80006e+01 238.344 0.9844 
1 1 1 8   84  3  o 2  4.05684e+00 9.21636e-01 7.40606e+01 158.271 -3.96372e+00 1.57968e+00  0.00000e+00 0.00000e+00 5.84823e+01 158.271 1.55783e+01 338.271 0.8731 
1 1 1 8   84  4  o 12 3.24714e+00 9.16355e-01 8.19299e+01 286.054 1.13785e+00  -3.95417e+00 0.00000e+00 0.00000e+00 2.35307e+01 286.054 5.83992e+01 106.054 0.8678 
1 1 1 8   84  5  o 9  4.40432e+00 9.71931e-01 3.02611e+01 247.113 -8.03891e-01 -1.90431e+00 0.00000e+00 0.00000e+00 8.65281e+01 247.113 5.62670e+01 247.113 0.7085 
1 1 1 8   84  6  o 15 3.20622e+00 9.68463e-01 1.12518e+02 101.608 -1.17271e+00 5.70918e+00  0.00000e+00 0.00000e+00 3.36519e+00 281.608 1.15883e+02 281.608 0.9096 
1 1 1 8   84  7  o 6  6.10112e+00 1.24254e+00 9.21927e+01 133.604 -5.38564e+00 5.65469e+00  0.00000e+00 0.00000e+00 1.20974e+02 133.604 2.87817e+01 133.604 0.9336 
1 1 1 8   84  8  f 0  7.01425e+00 1.14849e+00 2.92897e+01 40.903  2.36410e+00  2.04808e+00  0.00000e+00 0.00000e+00 1.85676e+02 40.903  1.56386e+02 40.903  0.8190 
1 1 1 8   84  9  o 6  5.90657e+00 1.23141e+00 1.31971e+02 337.725 1.11345e+01  -4.56097e+00 0.00000e+00 0.00000e+00 7.96141e+01 337.725 5.23572e+01 157.725 0.9575 
1 1 1 8   84  10 o 17 4.57790e+00 1.27175e+00 5.33245e+01 129.690 -2.53233e+00 3.05127e+00  0.00000e+00 0.00000e+00 9.43006e+01 129.690 4.09761e+01 129.690 0.8622 
1 1 1 8   84  11 o 1  5.25082e+00 1.42647e+00 1.01630e+02 198.817 -7.92891e+00 -2.70181e+00 0.00000e+00 0.00000e+00 8.25792e+01 198.817 1.90511e+01 18.817  0.9383 
1 1 1 8   84  12 o 8  3.33603e+00 1.11595e+00 8.08565e+01 342.736 5.85680e+00  -1.82013e+00 0.00000e+00 0.00000e+00 3.31560e+01 342.736 4.77006e+01 162.736 0.9144 
1 1 1 8   85  0  o 7  7.65575e+00 6.79526e-01 1.41179e+02 252.556 -5.13934e+00 -1.63559e+01 0.00000e+00 0.00000e+00 1.36573e+02 252.556 4.60591e+00 72.556  0.9704 
1 1 1 8   85  1  o 17 7.03821e+00 7.61344e-01 1.64458e+02 1.616   1.75951e+01  4.96485e-01  0.00000e+00 0.00000e+00 9.11702e+01 1.616   7.32875e+01 181.616 0.9712 
1 1 1 8   85  2  o 4  6.78244e+00 7.63798e-01 8.69393e+01 104.143 -2.19759e+00 8.72122e+00  0.00000e+00 0.00000e+00 1.52221e+02 104.143 6.52817e+01 104.143 0.9426 
1 1 1 8   85  3  o 15 5.74587e+00 8.64272e-01 1.43759e+02 307.424 7.12354e+00  -9.30902e+00 0.00000e+00 0.00000e+00 6.18289e+01 307.424 8.19298e+01 127.424 0.9563 
1 1 1 8   85  4  o 10 8.11207e+00 8.03989e-01 1.55738e+02 277.845 2.88193e+00  -2.09150e+01 0.00000e+00 0.00000e+00 1.40517e+02 277.845 1.52208e+01 97.846  0.9760 
1 1 1 8   85  5  o 7  8.00962e+00 8.15941e-01 1.18177e+02 72.515  4.88271e+00  1.55003e+01  0.00000e+00 0.00000e+00 1.72164e+02 72.515  5.39872e+01 72.515  0.9687 
1 1 1 8   85  6  f 0  1.07787e+01 7.89689e-01 2.45428e+02 197.600 -4.42749e+01 -1.40445e+01 0.00000e+00 0.00000e+00 1.53533e+02 197.600 9.18944e+01 17.600  0.9892 
1 1 1 8   85  7  o 11 7.26620e+00 1.12630e+00 1.24495e+02 356.937 1.39526e+01  -7.46647e-01 0.00000e+00 0.00000e+00 1.37459e+02 356.937 1.29640e+01 356.937 0.9635 
1 1 1 8   85  8  o 12 5.08250e+00 1.11564e+00 8.61923e+01 17.408  6.67045e+00  2.09144e+00  0.00000e+00 0.00000e+00 8.97687e+01 17.408  3.57634e+00 17.408  0.9254 
1 1 1 8   85  9  o 19 3.95219e+00 1.15661e+00 6.76147e+01 110.482 -1.60514e+00 4.29726e+00  0.00000e+00 0.00000e+00 6.28915e+01 110.482 4.72323e+00 290.482 0.8828 
1 1 1 8   85  10 o 19 3.67924e+00 1.13981e+00 6.05137e+01 48.655  2.84474e+00  3.23295e+00  0.00000e+00 0.00000e+00 5.97796e+01 48.655  7.34116e-01 228.655 0.8743 
1 1 1 8   85  11 o 4  4.63192e+00 1.34563e+00 9.08577e+01 63.037  3.17382e+00  6.23886e+00  0.00000e+00 0.00000e+00 6.93973e+01 63.037  2.14604e+01 243.037 0.9255 
1 1 1 8   85  12 o 1  4.62127e+00 1.35514e+00 1.06946e+02 317.058 6.46874e+00  -6.02000e+00 0.00000e+00 0.00000e+00 5.56533e+01 317.058 5.12930e+01 137.058 0.9416 
1 1 1 8   86  0  o 15 1.00662e+01 5.95504e-01 1.88132e+02 26.197  2.77294e+01  1.36430e+01  0.00000e+00 0.00000e+00 1.81990e+02 26.197  6.14206e+00 206.197 0.9837 
1 1 1 8   86  1  o 19 4.31609e+00 8.18194e-01 8.21344e+01 98.962  -8.22864e-01 5.21747e+00  0.00000e+00 0.00000e+00 6.30300e+01 98.962  1.91044e+01 278.962 0.8995 
1 1 1 8   86  2  f 0  6.10601e+00 8.44201e-01 9.77112e+01 261.807 -1.30154e+00 -9.03982e+00 0.00000e+00 0.00000e+00 1.17753e+02 261.807 2.00418e+01 261.807 0.9436 
1 1 1 8   86  3  o 7  5.26446e+00 8.71980e-01 8.44562e+01 165.138 -6.30398e+00 1.67287e+00  0.00000e+00 0.00000e+00 9.66615e+01 165.138 1.22052e+01 165.138 0.9198 
1 1 1 8   86  4  o 7  5.25422e+00 9.12184e-01 9.58037e+01 191.225 -7.91113e+00 -1.56997e+00 0.00000e+00 0.00000e+00 8.81272e+01 191.225 7.67653e+00 11.225  0.9358 
1 1 1 8   86  5  o 13 9.25759e+00 8.44092e-01 1.33415e+02 83.785  2.32015e+00  2.13061e+01  0.00000e+00 0.00000e+00 2.04737e+02 83.785  7.13217e+01 83.785  0.9764 
1 1 1 8   86  6  o 7  7.04147e+00 9.63964e-01 1.51150e+02 193.365 -1.57319e+01 -3.73780e+00 0.00000e+00 0.00000e+00 1.03991e+02 193.365 4.71588e+01 13.365  0.9686 
1 1 1 8   86  7  o 11 6.05581e+00 1.26833e+00 1.10286e+02 357.868 9.15202e+00  -3.40611e-01 0.00000e+00 0.00000e+00 1.03494e+02 357.868 6.79227e+00 177.869 0.9437 
1 1 1 8   86  8  o 6  7.54105e+00 1.09536e+00 1.34496e+02 94.256  -1.25668e+00 1.68881e+01  0.00000e+00 0.00000e+00 1.39096e+02 94.256  4.60047e+00 94.256  0.9700 
1 1 1 8   86  9  f 0  6.86007e+00 1.28837e+00 1.25781e+02 250.822 -4.39408e+00 -1.26340e+01 0.00000e+00 0.00000e+00 1.20965e+02 250.822 4.81626e+00 70.822  0.9619 
1 1 1 8   86  10 f 0  4.07554e+00 1.19214e+00 1.11692e+02 285.508 2.32720e+00  -8.38688e+00 0.00000e+00 0.00000e+00 3.16321e+01 285.508 8.00599e+01 105.508 0.9407 
1 1 1 8   86  11 o 2  1.15741e+01 1.20145e+00 1.72878e+02 124.632 -2.38318e+01 3.45047e+01  0.00000e+00 0.00000e+00 2.54491e+02 124.632 8.16125e+01 124.632 0.9880 
1 1 1 8   86  12 o 19 3.94495e+00 1.22230e+00 1.11283e+02 291.958 3.43734e+00  -8.52574e+00 0.00000e+00 0.00000e+00 2.78325e+01 291.958 8.34507e+01 111.958 0.9439 
1 1 1 8   87  0  o 15 7.70477e+00 7.18648e-01 2.07069e+02 66.601  1.02764e+01  2.37484e+01  0.00000e+00 0.00000e+00 7.52371e+01 66.601  1.31832e+02 246.601 0.9805 
1 1 1 8   87  1  o 2  7.72883e+00 7.01942e-01 1.50740e+02 189.769 -1.74531e+01 -3.00484e+00 0.00000e+00 0.00000e+00 1.29890e+02 189.769 2.08505e+01 9.769   0.9713 
1 1 1 8   87  2  o 2  5.74926e+00 8.30174e-01 1.34006e+02 124.667 -7.07343e+00 1.02278e+01  0.00000e+00 0.00000e+00 7.21225e+01 124.667 6.18830e+01 304.667 0.9589 
1 1 1 8   87  3  o 1  4.91902e+00 9.49123e-01 1.20731e+02 187.199 -8.59678e+00 -1.08595e+00 0.00000e+00 0.00000e+00 5.22545e+01 187.199 6.84766e+01 7.200   0.9404 
1 1 1 8   87  4  o 1  4.12344e+00 9.36122e-01 3.97185e+01 110.920 -9.39747e-01 2.45844e+00  0.00000e+00 0.00000e+00 8.03564e+01 110.920 4.06379e+01 110.920 0.7786 
1 1 1 8   87  5  o 10 1.22035e+01 7.05786e-01 1.85600e+02 220.643 -3.14935e+01 -2.70342e+01 0.00000e+00 0.00000e+00 2.65296e+02 220.643 7.96960e+01 220.643 0.9879 
1 1 1 8   87  6  o 19 5.43382e+00 1.05604e+00 1.05983e+02 42.298  6.56635e+00  5.97448e+00  0.00000e+00 0.00000e+00 8.54341e+01 42.298  2.05487e+01 222.298 0.9419 
1 1 1 8   87  7  o 9  5.25209e+00 9.91484e-01 4.85618e+01 32.011  3.64019e+00  2.27564e+00  0.00000e+00 0.00000e+00 1.23091e+02 32.011  7.45293e+01 32.011  0.8739 
1 1 1 8   87  8  o 12 8.89031e+00 1.01863e+00 1.56086e+02 219.743 -2.00124e+01 -1.66402e+01 0.00000e+00 0.00000e+00 1.69901e+02 219.743 1.38154e+01 219.743 0.9806 
1 1 1 8   87  9  o 15 9.13085e+00 1.05278e+00 1.26014e+02 356.842 2.09775e+01  -1.15742e+00 0.00000e+00 0.00000e+00 2.07125e+02 356.842 8.11113e+01 356.842 0.9759 
1 1 1 8   87  10 o 8  4.54299e+00 1.28769e+00 9.56848e+01 319.489 5.77168e+00  -4.93136e+00 0.00000e+00 0.00000e+00 6.24997e+01 319.489 3.31852e+01 139.489 0.9316 
1 1 1 8   87  11 f 0  3.78056e+00 1.18546e+00 7.87668e+01 209.150 -5.22689e+00 -2.91521e+00 0.00000e+00 0.00000e+00 5.00775e+01 209.150 2.86893e+01 29.150  0.9121 
1 1 1 8   88  0  o 15 5.98299e+00 7.85322e-01 7.15299e+01 126.368 -4.18765e+00 5.68657e+00  0.00000e+00 0.00000e+00 1.35508e+02 126.368 6.39777e+01 126.368 0.9262 
1 1 1 8   88  1  o 7  4.50116e+00 9.16339e-01 7.32772e+01 264.138 -4.83069e-01 -4.70546e+00 0.00000e+00 0.00000e+00 7.58845e+01 264.138 2.60724e+00 264.138 0.8867 
1 1 1 8   88  2  o 7  6.45107e+00 8.92656e-01 1.41225e+02 94.358  -1.03988e+00 1.36441e+01  0.00000e+00 0.00000e+00 9.09330e+01 94.358  5.02916e+01 274.358 0.9627 
1 1 1 8   88  3  o 4  4.89134e+00 9.31034e-01 1.39017e+02 121.905 -5.67435e+00 9.11446e+00  0.00000e+00 0.00000e+00 3.51178e+01 121.905 1.03899e+02 301.905 0.9522 
1 1 1 8   88  4  o 1  3.19171e+00 9.07874e-01 6.26971e+01 222.243 -2.47843e+00 -2.25066e+00 0.00000e+00 0.00000e+00 3.66829e+01 222.243 2.60142e+01 42.243  0.8327 
1 1 1 8   88  5  o 10 7.52921e+00 8.99353e-01 1.46670e+02 322.978 1.38808e+01  -1.04681e+01 0.00000e+00 0.00000e+00 1.26645e+02 322.978 2.00251e+01 142.978 0.9708 
1 1 1 8   88  6  o 8  1.20153e+01 7.35126e-01 1.75183e+02 357.168 3.73881e+01  -1.84939e+00 0.00000e+00 0.00000e+00 2.68051e+02 357.168 9.28675e+01 357.168 0.9866 
1 1 1 8   88  7  o 19 6.06784e+00 1.05335e+00 6.84900e+01 184.044 -6.89090e+00 -4.87189e-01 0.00000e+00 0.00000e+00 1.41251e+02 184.044 7.27615e+01 184.044 0.9245 
1 1 1 8   88  8  o 1  6.12803e+00 1.14017e+00 8.27221e+01 302.041 4.67761e+00  -7.47375e+00 0.00000e+00 0.00000e+00 1.32958e+02 302.041 5.02355e+01 302.041 0.9415 
1 1 1 8   88  9  o 15 4.24234e+00 1.18701e+00 7.84097e+01 4.950   5.74074e+00  4.97186e-01  0.00000e+00 0.00000e+00 6.56466e+01 4.950   1.27630e+01 184.950 0.9085 
1 1 1 8   88  10 o 12 6.87590e+00 1.42505e+00 9.73515e+01 177.453 -1.05129e+01 4.67723e-01  0.00000e+00 0.00000e+00 1.47051e+02 177.453 4.96993e+01 177.453 0.9512 
1 1 1 8   88  11 o 13 3.45400e+00 1.10868e+00 9.82359e+01 172.033 -7.86063e+00 1.10010e+00  0.00000e+00 0.00000e+00 2.23641e+01 172.033 7.58718e+01 352.033 0.9347 
1 1 1 8   89  0  o 1  4.99927e+00 8.64041e-01 1.22597e+02 312.233 6.66205e+00  -7.33878e+00 0.00000e+00 0.00000e+00 5.44486e+01 312.233 6.81483e+01 132.233 0.9481 
1 1 1 8   89  1  o 7  1.30548e+01 5.98092e-01 2.28116e+02 175.589 -5.07872e+01 3.91757e+00  0.00000e+00 0.00000e+00 2.54836e+02 175.589 2.67197e+01 175.589 0.9901 
1 1 1 8   89  2  o 1  4.11916e+00 9.51393e-01 8.54304e+01 85.578  4.23677e-01  5.47889e+00  0.00000e+00 0.00000e+00 5.36883e+01 85.578  3.17420e+01 265.578 0.9037 
1 1 1 8   89  3  o 8  4.45136e+00 9.67082e-01 8.82996e+01 86.581  3.51088e-01  5.87607e+00  0.00000e+00 0.00000e+00 6.32006e+01 86.581  2.50990e+01 266.581 0.9106 
1 1 1 8   89  4  o 6  5.47359e+00 9.60291e-01 1.05951e+02 222.047 -6.88445e+00 -6.20901e+00 0.00000e+00 0.00000e+00 8.72895e+01 222.047 1.86611e+01 42.047  0.9444 
1 1 1 8   89  5  o 17 3.61641e+00 9.23922e-01 8.09230e+01 45.648  3.41244e+00  3.49050e+00  0.00000e+00 0.00000e+00 3.94753e+01 45.648  4.14477e+01 225.648 0.8906 
1 1 1 8   89  6  o 8  5.40833e+00 1.13199e+00 1.22608e+02 189.850 -9.92965e+00 -1.72417e+00 0.00000e+00 0.00000e+00 6.92621e+01 189.850 5.33463e+01 9.851   0.9490 
1 1 1 8   89  7  o 16 6.89798e+00 1.07601e+00 1.11838e+02 358.605 1.33136e+01  -3.24237e-01 0.00000e+00 0.00000e+00 1.36132e+02 358.605 2.42943e+01 358.605 0.9617 
1 1 1 8   89  8  o 14 6.99608e+00 1.20013e+00 1.13489e+02 127.301 -7.97368e+00 1.04666e+01  0.00000e+00 0.00000e+00 1.37849e+02 127.301 2.43606e+01 127.301 0.9612 
1 1 1 8   89  9  o 16 3.68153e+00 1.11495e+00 7.93426e+01 111.487 -2.10987e+00 5.35973e+00  0.00000e+00 0.00000e+00 4.56350e+01 111.487 3.37076e+01 291.487 0.9085 
1 1 1 8   89  10 o 9  3.30384e+00 1.05979e+00 1.17806e+02 212.337 -6.95693e+00 -4.40426e+00 0.00000e+00 0.00000e+00 2.13832e+00 32.337  1.19944e+02 32.337  0.9371 
1 1 1 8   89  11 o 8  4.51241e+00 1.29940e+00 1.01077e+02 158.172 -8.42670e+00 3.37516e+00  0.00000e+00 0.00000e+00 5.78720e+01 158.172 4.32046e+01 338.172 0.9432 
1 1 1 8   90  0  o 4  1.10455e+01 6.08208e-01 2.11218e+02 290.682 1.52854e+01  -4.04899e+01 0.00000e+00 0.00000e+00 1.96457e+02 290.682 1.47610e+01 110.682 0.9884 
1 1 1 8   90  1  o 3  2.54092e+00 7.77812e-01 3.30827e+01 346.867 1.39890e+00  -3.26378e-01 0.00000e+00 0.00000e+00 2.19694e+01 346.867 1.11133e+01 166.867 0.5800 
1 1 1 8   90  2  o 4  5.91016e+00 8.73259e-01 1.06376e+02 28.314  8.71154e+00  4.69345e+00  0.00000e+00 0.00000e+00 1.02966e+02 28.314  3.41007e+00 208.314 0.9480 
1 1 1 8   90  3  o 7  4.73682e+00 9.40944e-01 7.09448e+01 295.150 2.44402e+00  -5.20560e+00 0.00000e+00 0.00000e+00 8.98319e+01 295.150 1.88870e+01 295.150 0.9083 
1 1 1 8   90  4  o 11 5.20385e+00 9.51382e-01 6.07515e+01 230.552 -3.07139e+00 -3.73280e+00 0.00000e+00 0.00000e+00 1.12217e+02 230.552 5.14653e+01 230.552 0.8894 
1 1 1 8   90  5  o 1  5.12873e+00 1.01591e+00 6.75300e+01 24.690  4.81255e+00  2.21255e+00  0.00000e+00 0.00000e+00 1.04953e+02 24.690  3.74234e+01 24.690  0.8998 
1 1 1 8   90  6  o 11 6.64868e+00 1.00811e+00 6.18470e+01 181.831 -6.93547e+00 -2.21732e-01 0.00000e+00 0.00000e+00 1.67965e+02 181.831 1.06118e+02 181.831 0.9248 
1 1 1 8   90  7  o 1  5.30734e+00 1.14991e+00 1.01961e+02 17.305  8.45404e+00  2.63400e+00  0.00000e+00 0.00000e+00 8.48201e+01 17.305  1.71406e+01 197.305 0.9417 
1 1 1 8   90  8  o 1  3.84159e+00 1.12269e+00 9.73365e+01 125.346 -3.75855e+00 5.29943e+00  0.00000e+00 0.00000e+00 3.46452e+01 125.346 6.26913e+01 305.346 0.9194 
1 1 1 8   90  9  o 18 5.41274e+00 1.36669e+00 9.11241e+01 199.024 -7.68191e+00 -2.64863e+00 0.00000e+00 0.00000e+00 9.82029e+01 199.024 7.07883e+00 199.024 0.9363 
1 1 1 8   90  10 o 2  4.96123e+00 1.28878e+00 5.35951e+01 159.342 -4.80558e+00 1.81186e+00  0.00000e+00 0.00000e+00 1.12512e+02 159.342 5.89170e+01 159.342 0.8964 
1 1 1 8   90  11 o 16 2.94813e+00 9.90031e-01 7.18509e+01 126.766 -3.44749e+00 4.61414e+00  0.00000e+00 0.00000e+00 2.81469e+01 126.766 4.37040e+01 306.766 0.9085 
1 1 1 8   91  0  o 10 9.22956e+00 6.52533e-01 1.58518e+02 149.322 -2.19796e+01 1.30393e+01  0.00000e+00 0.00000e+00 1.79242e+02 149.322 2.07236e+01 149.322 0.9802 
1 1 1 8   91  1  o 8  4.62491e+00 8.79965e-01 5.61212e+01 313.978 2.82249e+00  -2.92505e+00 0.00000e+00 0.00000e+00 9.34432e+01 313.978 3.73220e+01 313.978 0.8660 
1 1 1 8   91  2  o 2  2.92165e+00 8.76642e-01 5.08099e+01 87.683  1.06708e-01  2.63691e+00  0.00000e+00 0.00000e+00 3.42383e+01 87.683  1.65716e+01 267.683 0.7793 
1 1 1 8   91  3  o 7  1.31207e+01 6.52937e-01 2.33238e+02 135.699 -4.20361e+01 4.10222e+01  0.00000e+00 0.00000e+00 2.52751e+02 135.699 1.95133e+01 135.699 0.9915 
1 1 1 8   91  4  o 9  6.84723e+00 9.07045e-01 6.07478e+01 12.571  6.83031e+00  1.52310e+00  0.00000e+00 0.00000e+00 1.76030e+02 12.571  1.15282e+02 12.571  0.9255 
1 1 1 8   91  5  o 13 3.19329e+00 9.51019e-01 2.21942e+01 54.183  7.06231e-01  9.78598e-01  0.00000e+00 0.00000e+00 3.92411e+01 54.183  1.70469e+01 54.183  0.5149 
1 1 1 8   91  6  o 13 4.77535e+00 1.08152e+00 1.07218e+02 120.650 -4.40543e+00 7.43436e+00  0.00000e+00 0.00000e+00 6.05449e+01 120.650 4.66734e+01 300.650 0.9402 
1 1 1 8   91  7  o 12 6.16483e+00 1.12574e+00 7.21522e+01 273.949 5.38219e-01  -7.79653e+00 0.00000e+00 0.00000e+00 1.42892e+02 273.949 7.07393e+01 273.949 0.9336 
1 1 1 8   91  8  f 0  4.12041e+00 1.13594e+00 7.71170e+01 18.170  5.44258e+00  1.78628e+00  0.00000e+00 0.00000e+00 6.26341e+01 18.170  1.44829e+01 198.170 0.9079 
1 1 1 8   91  9  o 14 4.45039e+00 1.31277e+00 8.42957e+01 71.040  2.06864e+00  6.02154e+00  0.00000e+00 0.00000e+00 6.82450e+01 71.040  1.60507e+01 251.040 0.9177 
1 1 1 8   91  10 o 14 5.00737e+00 1.21352e+00 1.24151e+02 11.466  1.19419e+01  2.42224e+00  0.00000e+00 0.00000e+00 5.49776e+01 11.466  6.91736e+01 191.466 0.9580 
1 1 1 8   91  11 o 4  4.36684e+00 1.28083e+00 7.94081e+01 172.923 -6.86320e+00 8.52105e-01  0.00000e+00 0.00000e+00 7.13024e+01 172.923 8.10569e+00 352.923 0.9246 
1 1 1 8   92  0  o 2  4.88309e+00 8.45951e-01 9.19662e+01 224.546 -5.79070e+00 -5.69961e+00 0.00000e+00 0.00000e+00 7.86755e+01 224.546 1.32907e+01 44.546  0.9363 
1 1 1 8   92  1  o 2  3.90638e+00 9.32779e-01 1.05379e+02 328.712 6.04283e+00  -3.67233e+00 0.00000e+00 0.00000e+00 2.97194e+01 328.712 7.56595e+01 148.712 0.9263 
1 1 1 8   92  2  o 5  7.20756e+00 8.06696e-01 1.72317e+02 210.086 -1.90903e+01 -1.10599e+01 0.00000e+00 0.00000e+00 9.06660e+01 210.086 8.16513e+01 30.086  0.9771 
1 1 1 8   92  3  o 19 1.32380e+01 6.56116e-01 1.89301e+02 5.826   4.86326e+01  4.96198e+00  0.00000e+00 0.00000e+00 3.00051e+02 5.826   1.10749e+02 5.826   0.9897 
1 1 1 8   92  4  o 1  3.09317e+00 9.06655e-01 7.50987e+01 227.319 -2.55845e+00 -2.77445e+00 0.00000e+00 0.00000e+00 2.36012e+01 227.319 5.14976e+01 47.319  0.8542 
1 1 1 8   92  5  o 11 8.18049e+00 9.17717e-01 1.16325e+02 119.599 -8.39483e+00 1.47782e+01  0.00000e+00 0.00000e+00 1.80132e+02 119.599 6.38060e+01 119.599 0.9701 
1 1 1 8   92  6  o 8  5.63624e+00 1.12745e+00 1.11002e+02 342.099 1.03330e+01  -3.33764e+00 0.00000e+00 0.00000e+00 8.95983e+01 342.099 2.14038e+01 162.099 0.9528 
1 1 1 8   92  7  o 9  4.18261e+00 1.04510e+00 4.02667e+01 75.706  7.71699e-01  3.02873e+00  0.00000e+00 0.00000e+00 8.76629e+01 75.706  4.73962e+01 75.706  0.8189 
1 1 1 8   92  8  o 8  4.35494e+00 1.07051e+00 8.81386e+01 2.079   7.84906e+00  2.84920e-01  0.00000e+00 0.00000e+00 6.37693e+01 2.079   2.43692e+01 182.079 0.9340 
1 1 1 8   92  9  o 9  4.24959e+00 1.29923e+00 1.01288e+02 90.494  -6.31515e-02 7.32673e+00  0.00000e+00 0.00000e+00 4.61274e+01 90.494  5.51602e+01 270.494 0.9290 
1 1 1 8   92  10 o 11 6.31731e+00 1.18981e+00 7.73205e+01 154.840 -9.56170e+00 4.49125e+00  0.00000e+00 0.00000e+00 1.47051e+02 154.840 6.97303e+01 154.840 0.9514 
1 1 1 8   92  11 o 2  3.00395e+00 9.86097e-01 4.13893e+01 296.124 1.59426e+00  -3.25087e+00 0.00000e+00 0.00000e+00 5.35807e+01 296.124 1.21914e+01 296.124 0.8472 
1 1 1 8   93  0  o 1  7.04489e+00 7.80168e-01 1.26455e+02 271.730 4.84363e-01  -1.60394e+01 0.00000e+00 0.00000e+00 1.28094e+02 271.730 1.63967e+00 271.730 0.9683 
1 1 1 8   93  1  o 15 3.24425e+00 8.82496e-01 5.28977e+01 345.492 2.63618e+00  -6.82143e-01 0.00000e+00 0.00000e+00 4.24294e+01 345.492 1.04682e+01 165.492 0.7872 
1 1 1 8   93  2  o 13 2.66495e+00 8.31020e-01 1.94098e+01 355.034 9.18241e-01  -7.97830e-02 0.00000e+00 0.00000e+00 2.21742e+01 355.034 2.76441e+00 355.034 0.4180 
1 1 1 8   93  3  o 11 9.63640e+00 7.32617e-01 1.49635e+02 65.607  1.16469e+01  2.56839e+01  0.00000e+00 0.00000e+00 2.03753e+02 65.607  5.41182e+01 65.607  0.9821 
1 1 1 8   93  4  o 13 1.15602e+01 7.18669e-01 1.61065e+02 52.380  2.24532e+01  2.91353e+01  0.00000e+00 0.00000e+00 2.64734e+02 52.380  1.03669e+02 52.380  0.9863 
1 1 1 8   93  5  o 13 8.50533e+00 8.82474e-01 9.41779e+01 299.237 7.57924e+00  -1.35410e+01 0.00000e+00 0.00000e+00 2.13052e+02 299.237 1.18874e+02 299.237 0.9672 
1 1 1 8   93  6  f 0  5.34478e+00 1.10831e+00 6.28530e+01 26.709  5.01671e+00  2.52409e+00  0.00000e+00 0.00000e+00 1.17978e+02 26.709  5.51246e+01 26.709  0.9059 
1 1 1 8   93  7  o 9  4.14221e+00 1.13774e+00 1.01798e+02 197.417 -6.90725e+00 -2.16691e+00 0.00000e+00 0.00000e+00 4.17637e+01 197.417 6.00348e+01 17.417  0.9281 
1 1 1 8   93  8  f 0  3.48450e+00 1.03460e+00 4.75817e+01 121.075 -1.86914e+00 3.10153e+00  0.00000e+00 0.00000e+00 6.26411e+01 121.075 1.50594e+01 121.075 0.8472 
1 1 1 8   93  9  o 11 3.59513e+00 1.13967e+00 1.01966e+02 281.256 1.44824e+00  -7.27653e+00 0.00000e+00 0.00000e+00 2.28387e+01 281.256 7.91275e+01 101.256 0.9299 
1 1 1 8   93  10 o 18 2.82494e+00 9.51045e-01 6.90546e+01 350.035 4.99167e+00  -8.76997e-01 0.00000e+00 0.00000e+00 2.52979e+01 350.035 4.37568e+01 170.035 0.8949 
1 1 1 8   94  0  o 17 2.70719e+00 8.07506e-01 6.14597e+01 216.786 -2.40481e+00 -1.79812e+00 0.00000e+00 0.00000e+00 2.03623e+01 216.786 4.10974e+01 36.786  0.8102 
1 1 1 8   94  1  o 10 7.55013e+00 7.77310e-01 9.83456e+01 7.141   1.33074e+01  1.66714e+00  0.00000e+00 0.00000e+00 1.72678e+02 7.141   7.43322e+01 7.141   0.9620 
1 1 1 8   94  2  o 18 1.60773e+01 6.19252e-01 2.53700e+02 225.434 -5.92894e+01 -6.01949e+01 0.00000e+00 0.00000e+00 3.42813e+02 225.434 8.91135e+01 225.434 0.9941 
1 1 1 8   94  3  o 17 5.29913e+00 9.51358e-01 6.73996e+01 351.114 6.00863e+00  -9.39378e-01 0.00000e+00 0.00000e+00 1.13331e+02 351.114 4.59319e+01 351.114 0.9136 
1 1 1 8   94  4  o 14 3.48601e+00 9.20655e-01 6.31387e+01 117.012 -1.81037e+00 3.55116e+00  0.00000e+00 0.00000e+00 4.91780e+01 117.012 1.39607e+01 297.012 0.8630 
1 1 1 8   94  5  o 4  1.26310e+01 7.38080e-01 1.83221e+02 295.815 2.28805e+01  -4.72980e+01 0.00000e+00 0.00000e+00 2.83866e+02 295.815 1.00645e+02 295.815 0.9904 
1 1 1 8   94  6  o 13 2.98646e+00 9.37907e-01 6.74474e+01 93.298  -2.30862e-01 4.00688e+00  0.00000e+00 0.00000e+00 2.88955e+01 93.298  3.85519e+01 273.297 0.8640 
1 1 1 8   94  7  f 0  4.69077e+00 1.17917e+00 8.17641e+01 214.266 -5.52263e+00 -3.76246e+00 0.00000e+00 0.00000e+00 7.96643e+01 214.266 2.09979e+00 34.266  0.9218 
1 1 1 8   94  8  o 12 4.04758e+00 1.15280e+00 6.71086e+01 358.092 5.30671e+00  -1.76737e-01 0.00000e+00 0.00000e+00 6.88866e+01 358.092 1.77803e+00 358.092 0.9001 
1 1 1 8   94  9  o 8  4.95269e+00 1.38359e+00 1.13420e+02 9.043   9.64156e+00  1.53444e+00  0.00000e+00 0.00000e+00 6.16796e+01 9.043   5.17409e+01 189.043 0.9473 
1 1 1 8   94  10 o 5  5.10701e+00 1.35606e+00 9.80387e+01 176.853 -9.23020e+00 5.07421e-01  0.00000e+00 0.00000e+00 8.18883e+01 176.853 1.61504e+01 356.853 0.9443 
1 1 1 8   95  0  o 18 6.12222e+00 8.38518e-01 1.45074e+02 215.416 -1.33419e+01 -9.48730e+00 0.00000e+00 0.00000e+00 7.61688e+01 215.416 6.89050e+01 35.416  0.9690 
1 1 1 8   95  1  o 12 6.65704e+00 8.36951e-01 8.31975e+01 244.438 -4.03067e+00 -8.42718e+00 0.00000e+00 0.00000e+00 1.51456e+02 244.438 6.82587e+01 244.438 0.9449 
1 1 1 8   95  2  o 12 5.39188e+00 9.62700e-01 8.44483e+01 20.634  7.20579e+00  2.71343e+00  0.00000e+00 0.00000e+00 1.03188e+02 20.634  1.87399e+01 20.634  0.9326 
1 1 1 8   95  3  o 18 8.00764e+00 8.51107e-01 1.14652e+02 31.476  1.45570e+01  8.91206e+00  0.00000e+00 0.00000e+00 1.75311e+02 31.476  6.06594e+01 31.476  0.9702 
1 1 1 8   95  4  o 12 1.28167e+01 6.92894e-01 2.10679e+02 346.373 5.65005e+01  -1.36968e+01 0.00000e+00 0.00000e+00 2.63573e+02 346.373 5.28943e+01 346.373 0.9914 
1 1 1 8   95  5  o 5  3.52086e+00 1.01644e+00 4.27429e+01 154.908 -2.42632e+00 1.13614e+00  0.00000e+00 0.00000e+00 6.01818e+01 154.908 1.74389e+01 154.908 0.7832 
1 1 1 8   95  6  o 13 3.92826e+00 1.07316e+00 1.15428e+02 170.985 -7.98653e+00 1.26712e+00  0.00000e+00 0.00000e+00 2.18091e+01 170.985 9.36190e+01 350.985 0.9360 
1 1 1 8   95  7  o 6  3.12302e+00 9.55010e-01 3.14538e+01 13.582  2.22476e+00  5.37496e-01  0.00000e+00 0.00000e+00 5.47944e+01 13.582  2.33406e+01 13.582  0.7399 
1 1 1 8   95  8  o 4  5.39106e+00 1.20967e+00 7.97701e+01 69.250  2.79376e+00  7.37400e+00  0.00000e+00 0.00000e+00 1.08189e+02 69.250  2.84194e+01 69.250  0.9343 
1 1 1 8   95  9  o 10 2.65489e+00 8.93822e-01 6.60189e+01 297.207 2.12868e+00  -4.14076e+00 0.00000e+00 0.00000e+00 2.16210e+01 297.207 4.43980e+01 117.207 0.8847 
1 1 1 8   95  10 o 8  3.25408e+00 1.05748e+00 8.52117e+01 161.490 -6.95077e+00 2.32709e+00  0.00000e+00 0.00000e+00 2.75577e+01 161.490 5.76541e+01 341.490 0.9290 
1 1 1 8   96  0  o 1  4.48213e+00 9.43273e-01 8.39390e+01 143.396 -5.16668e+00 3.83768e+00  0.00000e+00 0.00000e+00 6.95831e+01 143.396 1.43558e+01 323.396 0.9186 
1 1 1 8   96  1  o 18 3.46752e+00 9.21301e-01 6.87660e+01 261.182 -6.32597e-01 -4.07783e+00 0.00000e+00 0.00000e+00 4.35173e+01 261.182 2.52488e+01 81.182  0.8682 
1 1 1 8   96  2  o 6  3.50562e+00 9.09028e-01 1.18420e+02 25.422  6.73168e+00  3.19959e+00  0.00000e+00 0.00000e+00 3.23770e+00 25.422  1.15183e+02 205.422 0.9303 
1 1 1 8   96  3  o 15 5.96400e+00 9.15026e-01 8.54741e+01 96.645  -1.11896e+00 9.60474e+00  0.00000e+00 0.00000e+00 1.25210e+02 96.645  3.97356e+01 96.645  0.9468 
1 1 1 8   96  4  o 8  5.22792e+00 1.04242e+00 7.64962e+01 54.565  4.27470e+00  6.00726e+00  0.00000e+00 0.00000e+00 1.04828e+02 54.565  2.83314e+01 54.565  0.9295 
1 1 1 8   96  5  o 7  7.11516e+00 9.56356e-01 5.38458e+01 113.183 -2.96643e+00 6.92679e+00  0.00000e+00 0.00000e+00 1.93368e+02 113.183 1.39522e+02 113.183 0.9311 
1 1 1 8   96  6  o 17 1.05217e+01 8.58537e-01 1.25416e+02 241.818 -1.38094e+01 -2.57737e+01 0.00000e+00 0.00000e+00 2.60446e+02 241.818 1.35030e+02 241.818 0.9827 
1 1 1 8   96  7  o 14 2.99190e+00 9.45748e-01 4.55753e+01 359.228 2.94719e+00  -3.96896e-02 0.00000e+00 0.00000e+00 4.44087e+01 359.228 1.16660e+00 179.228 0.8060 
1 1 1 8   96  8  o 7  4.32775e+00 1.14914e+00 7.86798e+01 258.824 -1.32502e+00 -6.70680e+00 0.00000e+00 0.00000e+00 7.04569e+01 258.824 8.22284e+00 78.824  0.9237 
1 1 1 8   96  9  o 11 3.98366e+00 1.16354e+00 6.52393e+01 220.443 -4.49922e+00 -3.83498e+00 0.00000e+00 0.00000e+00 7.01270e+01 220.443 4.88770e+00 220.443 0.9110 
1 1 1 8   96  10 o 15 4.84104e+00 1.34612e+00 6.82946e+01 138.688 -4.96461e+00 4.36342e+00  0.00000e+00 0.00000e+00 9.79559e+01 138.688 2.96613e+01 138.688 0.9209 
1 1 1 8   97  0  o 18 4.94593e+00 8.55604e-01 6.72846e+01 254.888 -1.60801e+00 -5.95462e+00 0.00000e+00 0.00000e+00 1.01387e+02 254.888 3.41029e+01 254.888 0.9149 
1 1 1 8   97  1  o 9  2.99004e+00 8.77481e-01 4.33692e+01 170.721 -2.37918e+00 3.88729e-01  0.00000e+00 0.00000e+00 4.07960e+01 170.721 2.57314e+00 350.720 0.7549 
1 1 1 8   97  2  o 1  5.17461e+00 9.24401e-01 8.41398e+01 32.085  6.95389e+00  4.35967e+00  0.00000e+00 0.00000e+00 9.66779e+01 32.085  1.25380e+01 32.085  0.9369 
1 1 1 8   97  3  o 4  9.93159e+00 7.53183e-01 2.04510e+02 272.387 1.79827e+00  -4.31426e+01 0.00000e+00 0.00000e+00 1.61637e+02 272.387 4.28728e+01 92.387  0.9884 
1 1 1 8   97  4  o 13 5.52960e+00 1.04922e+00 9.34931e+01 321.356 7.50521e+00  -6.00069e+00 0.00000e+00 0.00000e+00 1.01743e+02 321.356 8.24996e+00 321.356 0.9464 
1 1 1 8   97  5  f 0  3.87874e+00 1.01359e+00 5.72672e+01 204.276 -3.76636e+00 -1.69867e+00 0.00000e+00 0.00000e+00 6.83951e+01 204.276 1.11279e+01 204.276 0.8684 
1 1 1 8   97  6  o 8  3.51329e+00 1.03331e+00 8.43108e+01 112.182 -2.35915e+00 5.78612e+00  0.00000e+00 0.00000e+00 3.57562e+01 112.182 4.85546e+01 292.182 0.9161 
1 1 1 8   97  7  o 3  5.93606e+00 1.09640e+00 6.31527e+01 272.470 3.28198e-01  -7.60693e+00 0.00000e+00 0.00000e+00 1.43186e+02 272.470 8.00331e+01 272.470 0.9318 
1 1 1 8   97  8  o 2  3.32156e+00 1.02380e+00 3.87841e+01 207.037 -2.77327e+00 -1.41533e+00 0.00000e+00 0.00000e+00 6.25636e+01 207.037 2.37795e+01 207.037 0.8180 
1 1 1 8   97  9  o 5  3.01046e+00 9.88832e-01 1.93297e+01 4.159   1.58083e+00  1.14938e-01  0.00000e+00 0.00000e+00 4.98765e+01 4.159   3.05468e+01 4.159   0.6165 
1 1 1 8   98  0  f 0  1.11455e+01 6.59560e-01 1.29974e+02 177.647 -3.19899e+01 1.31443e+00  0.00000e+00 0.00000e+00 2.78832e+02 177.647 1.48858e+02 177.647 0.9843 
1 1 1 8   98  1  o 13 4.32110e+00 9.34816e-01 9.52143e+01 68.172  2.84245e+00  7.09663e+00  0.00000e+00 0.00000e+00 5.49234e+01 68.172  4.02909e+01 248.172 0.9321 
1 1 1 8   98  2  o 3  3.72031e+00 9.63013e-01 4.11027e+01 356.858 2.83990e+00  -1.55907e-01 0.00000e+00 0.00000e+00 6.95581e+01 356.858 2.84555e+01 356.858 0.7978 
1 1 1 8   98  3  o 18 6.00608e+00 9.89394e-01 6.46112e+01 243.144 -3.17712e+00 -6.27436e+00 0.00000e+00 0.00000e+00 1.42767e+02 243.144 7.81561e+01 243.144 0.9259 
1 1 1 8   98  4  o 10 6.14273e+00 1.05424e+00 1.14728e+02 91.750  -3.96657e-01 1.29852e+01  0.00000e+00 0.00000e+00 1.05367e+02 91.750  9.36110e+00 271.750 0.9607 
1 1 1 8   98  5  o 5  2.95283e+00 9.24125e-01 5.17969e+01 83.286  3.77833e-01  3.20981e+00  0.00000e+00 0.00000e+00 3.91477e+01 83.286  1.26493e+01 263.286 0.8258 
1 1 1 8   98  6  o 6  5.61272e+00 1.15519e+00 9.60263e+01 68.380  3.91579e+00  9.88023e+00  0.00000e+00 0.00000e+00 1.03204e+02 68.380  7.17782e+00 68.380  0.9517 
1 1 1 8   98  7  o 17 8.58783e+00 1.03237e+00 1.66598e+02 241.042 -1.46779e+01 -2.65253e+01 0.00000e+00 0.00000e+00 1.48349e+02 241.042 1.82487e+01 61.042  0.9834 
1 1 1 8   98  8  o 10 2.52757e+00 8.25972e-01 5.22296e+01 68.117  1.38686e+00  3.45295e+00  0.00000e+00 0.00000e+00 2.80594e+01 68.117  2.41702e+01 248.117 0.8519 
1 1 1 8   98  9  o 9  3.57333e+00 1.02120e+00 3.63375e+01 105.999 -9.18288e-01 3.20263e+00  0.00000e+00 0.00000e+00 7.44748e+01 105.999 3.81373e+01 105.999 0.8318 
1 1 1 8   99  0  o 17 2.82230e+00 8.51878e-01 3.86424e+01 239.315 -1.11262e+00 -1.87498e+00 0.00000e+00 0.00000e+00 3.76162e+01 239.315 1.02621e+00 59.315  0.7253 
1 1 1 8   99  1  o 9  8.36148e+00 7.72029e-01 1.19189e+02 149.157 -1.89633e+01 1.13237e+01  0.00000e+00 0.00000e+00 1.85276e+02 149.157 6.60876e+01 149.157 0.9771 
1 1 1 8   99  2  o 18 7.69004e+00 8.45098e-01 1.41935e+02 321.500 1.69967e+01  -1.35200e+01 0.00000e+00 0.00000e+00 1.38033e+02 321.500 3.90149e+00 141.500 0.9767 
1 1 1 8   99  3  o 18 5.86583e+00 1.02798e+00 8.71031e+01 272.330 3.88128e-01  -9.53925e+00 0.00000e+00 0.00000e+00 1.19792e+02 272.330 3.26893e+01 272.330 0.9461 
1 1 1 8   99  4  o 9  5.34620e+00 1.04221e+00 7.08298e+01 147.109 -5.84721e+00 3.78137e+00  0.00000e+00 0.00000e+00 1.13580e+02 147.109 4.27498e+01 147.109 0.9251 
1 1 1 8   99  5  o 9  4.32358e+00 1.03403e+00 4.22787e+01 288.916 1.24908e+00  -3.64486e+00 0.00000e+00 0.00000e+00 9.59818e+01 288.916 5.37031e+01 288.916 0.8576 
1 1 1 8   99  6  o 15 4.01594e+00 1.11468e+00 8.77690e+01 64.906  3.01675e+00  6.44171e+00  0.00000e+00 0.00000e+00 5.10074e+01 64.906  3.67617e+01 244.906 0.9268 
1 1 1 8   99  7  o 14 2.82017e+00 9.17654e-01 9.71684e+01 155.877 -6.85646e+00 3.07040e+00  0.00000e+00 0.00000e+00 7.07419e-01 155.877 9.64610e+01 335.877 0.9308 
1 1 1 8   99  8  o 4  2.85824e+00 8.96994e-01 5.12028e+01 28.003  3.83132e+00  2.03744e+00  0.00000e+00 0.00000e+00 4.20741e+01 28.003  9.12875e+00 208.003 0.8754 
1 1 1 8   99  9  o 11 3.16314e+00 1.02087e+00 7.95535e+01 243.063 -3.19894e+00 -6.29533e+00 0.00000e+00 0.00000e+00 2.96423e+01 243.063 4.99112e+01 63.063  0.9262 
1 1 1 8   100 0  o 12 3.18248e+00 9.06285e-01 2.27155e+01 311.819 9.22124e-01  -1.03066e+00 0.00000e+00 0.00000e+00 4.43550e+01 311.819 2.16395e+01 311.819 0.5658 
1 1 1 8   100 1  o 1  3.85712e+00 9.65872e-01 6.85347e+01 99.946  -9.00537e-01 5.13570e+00  0.00000e+00 0.00000e+00 6.05271e+01 99.946  8.00753e+00 279.946 0.8981 
1 1 1 8   100 2  o 13 8.99974e+00 7.54237e-01 1.21845e+02 38.372  1.93461e+01  1.53180e+01  0.00000e+00 0.00000e+00 2.06662e+02 38.372  8.48179e+01 38.372  0.9795 
1 1 1 8   100 3  o 4  7.44046e+00 9.18467e-01 1.70655e+02 194.517 -2.44048e+01 -6.31942e+00 0.00000e+00 0.00000e+00 1.01103e+02 194.517 6.95522e+01 14.517  0.9800 
1 1 1 8   100 4  o 12 5.83907e+00 9.77069e-01 1.38567e+02 72.005  5.39007e+00  1.65941e+01  0.00000e+00 0.00000e+00 7.27537e+01 72.005  6.58130e+01 252.005 0.9709 
1 1 1 8   100 5  o 2  3.24500e+00 9.71678e-01 6.33569e+01 314.258 3.30231e+00  -3.38899e+00 0.00000e+00 0.00000e+00 4.39103e+01 314.258 1.94466e+01 134.258 0.8868 
1 1 1 8   100 6  f 0  8.82365e+00 9.58951e-01 9.93492e+01 70.741  6.50935e+00  1.86308e+01  0.00000e+00 0.00000e+00 2.21121e+02 70.741  1.21772e+02 70.741  0.9743 
1 1 1 8   100 7  o 3  3.75638e+00 1.08194e+00 5.12896e+01 322.284 3.35854e+00  -2.59724e+00 0.00000e+00 0.00000e+00 7.08512e+01 322.284 1.95616e+01 322.284 0.8723 
1 1 1 8   100 8  o 10 5.55422e+00 1.28999e+00 7.97720e+01 209.189 -7.81233e+00 -4.36423e+00 0.00000e+00 0.00000e+00 1.15293e+02 209.189 3.55207e+01 209.189 0.9423 
1 1 1 8   100 9  o 12 2.70167e+00 9.00459e-01 9.77177e+01 325.452 6.71723e+00  -4.62495e+00 0.00000e+00 0.00000e+00 3.44018e+00 145.452 1.01158e+02 145.452 0.9365 
1 1 1 8   101 0  o 3  6.56909e+00 9.04086e-01 1.44369e+02 218.863 -1.50435e+01 -1.21227e+01 0.00000e+00 0.00000e+00 9.38151e+01 218.863 5.05541e+01 38.863  0.9738 
1 1 1 8   101 1  o 19 1.00671e+01 7.11280e-01 1.56489e+02 124.268 -2.06253e+01 3.02718e+01  0.00000e+00 0.00000e+00 2.13318e+02 124.268 5.68288e+01 124.268 0.9863 
1 1 1 8   101 2  o 11 4.65710e+00 1.00432e+00 3.55423e+01 340.197 2.94532e+00  -1.06053e+00 0.00000e+00 0.00000e+00 1.06585e+02 340.197 7.10427e+01 340.197 0.8192 
1 1 1 8   101 3  f 0  5.85380e+00 1.00732e+00 4.48702e+01 28.562  4.58153e+00  2.49395e+00  0.00000e+00 0.00000e+00 1.51037e+02 28.562  1.06167e+02 28.562  0.8982 
1 1 1 8   101 4  o 19 4.38594e+00 1.05553e+00 5.55831e+01 207.559 -4.62603e+00 -2.41425e+00 0.00000e+00 0.00000e+00 9.12218e+01 207.559 3.56387e+01 207.559 0.8982 
1 1 1 8   101 5  o 17 2.25656e+00 7.65420e-01 3.44319e+01 107.927 -6.34104e-01 1.96005e+00  0.00000e+00 0.00000e+00 2.50565e+01 107.927 9.37539e+00 287.927 0.7074 
1 1 1 8   101 6  o 9  5.99857e+00 1.13007e+00 9.87432e+01 96.491  -1.36591e+00 1.20050e+01  0.00000e+00 0.00000e+00 1.15341e+02 96.491  1.65974e+01 96.491  0.9577 
1 1 1 8   101 7  o 1  3.14926e+00 9.87051e-01 9.70617e+01 323.937 6.50076e+00  -4.73397e+00 0.00000e+00 0.00000e+00 1.27317e+01 323.937 8.43300e+01 143.937 0.9356 
1 1 1 8   101 8  o 3  4.99936e+00 1.31132e+00 6.27468e+01 150.800 -5.58802e+00 3.12301e+00  0.00000e+00 0.00000e+00 1.08281e+02 150.800 4.55337e+01 150.800 0.9182 
1 1 1 8   102 0  o 18 6.13499e+00 8.86383e-01 5.29797e+01 32.082  5.64960e+00  3.54149e+00  0.00000e+00 0.00000e+00 1.57495e+02 32.082  1.04516e+02 32.082  0.9216 
1 1 1 8   102 1  o 4  8.19913e+00 7.76121e-01 1.19134e+02 103.006 -4.83995e+00 2.09537e+01  0.00000e+00 0.00000e+00 1.78981e+02 103.006 5.98463e+01 103.006 0.9765 
1 1 1 8   102 2  f 0  5.94131e+00 9.42861e-01 1.06207e+02 24.876  1.19192e+01  5.52664e+00  0.00000e+00 0.00000e+00 1.06477e+02 24.876  2.70632e-01 24.876  0.9612 
1 1 1 8   102 3  o 18 2.97668e+00 8.54785e-01 8.45127e+01 158.879 -5.70015e+00 2.20194e+00  0.00000e+00 0.00000e+00 1.68394e+01 158.879 6.76733e+01 338.879 0.9140 
1 1 1 8   102 4  o 4  5.46591e+00 1.09042e+00 7.87097e+01 233.172 -4.97747e+00 -6.64676e+00 0.00000e+00 0.00000e+00 1.12235e+02 233.172 3.35248e+01 233.172 0.9377 
1 1 1 8   102 5  o 3  4.45477e+00 1.07833e+00 3.45442e+01 238.939 -1.62117e+00 -2.69158e+00 0.00000e+00 0.00000e+00 1.01544e+02 238.939 6.70001e+01 238.939 0.8200 
1 1 1 8   102 6  o 18 3.29225e+00 9.65135e-01 3.62052e+01 44.572  2.07651e+00  2.04574e+00  0.00000e+00 0.00000e+00 6.23479e+01 44.572  2.61427e+01 44.572  0.8035 
1 1 1 8   102 7  o 13 3.41711e+00 1.02221e+00 7.94911e+01 77.302  1.45132e+00  6.44121e+00  0.00000e+00 0.00000e+00 3.77261e+01 77.302  4.17650e+01 257.302 0.9208 
1 1 1 8   102 8  o 15 3.72422e+00 1.15249e+00 6.73937e+01 307.798 3.75400e+00  -4.84001e+00 0.00000e+00 0.00000e+00 5.94326e+01 307.798 7.96107e+00 127.798 0.9143 
1 1 1 8   103 0  o 4  8.40622e+00 7.93162e-01 1.47166e+02 145.512 -2.35962e+01 1.62099e+01  0.00000e+00 0.00000e+00 1.60153e+02 145.512 1.29874e+01 145.512 0.9824 
1 1 1 8   103 1  o 6  4.48069e+00 1.02961e+00 5.21888e+01 44.196  3.46575e+00  3.36980e+00  0.00000e+00 0.00000e+00 9.61557e+01 44.196  4.39669e+01 44.196  0.8894 
1 1 1 8   103 2  o 5  2.82605e+00 8.15915e-01 2.90285e+01 6.436   2.03916e+00  2.30043e-01  0.00000e+00 0.00000e+00 4.52755e+01 6.436   1.62470e+01 6.436   0.7061 
1 1 1 8   103 3  o 10 2.59768e+00 8.41701e-01 2.53638e+01 201.360 -1.43346e+00 -5.60615e-01 0.00000e+00 0.00000e+00 3.32276e+01 201.360 7.86383e+00 201.360 0.6057 
1 1 1 8   103 4  o 16 3.87244e+00 1.01711e+00 9.74921e+01 41.956  6.23835e+00  5.60841e+00  0.00000e+00 0.00000e+00 3.78426e+01 41.956  5.96494e+01 221.956 0.9384 
1 1 1 8   103 5  o 5  3.38162e+00 9.66744e-01 2.07801e+01 116.405 -7.32412e-01 1.47508e+00  0.00000e+00 0.00000e+00 5.86206e+01 116.405 3.78405e+01 116.405 0.6304 
1 1 1 8   103 6  f 0  2.69251e+00 8.73937e-01 6.84271e+01 34.588  4.45224e+00  3.07003e+00  0.00000e+00 0.00000e+00 2.20346e+01 34.588  4.63926e+01 214.588 0.9021 
1 1 1 8   103 7  o 4  3.59565e+00 1.06120e+00 4.39185e+01 273.243 2.18463e-01  -3.85516e+00 0.00000e+00 0.00000e+00 7.09738e+01 273.243 2.70553e+01 273.243 0.8580 
1 1 1 8   103 8  o 5  4.65584e+00 1.14385e+00 8.03795e+01 123.810 -4.99879e+00 7.46422e+00  0.00000e+00 0.00000e+00 8.30378e+01 123.810 2.65833e+00 123.810 0.9426 
1 1 1 8   104 0  o 8  3.84315e+00 8.93851e-01 1.84704e+01 258.578 -3.30927e-01 -1.63804e+00 0.00000e+00 0.00000e+00 7.24188e+01 258.578 5.39484e+01 258.578 0.6357 
1 1 1 8   104 1  o 15 2.48734e+00 7.87070e-01 2.20960e+01 6.645   1.45378e+00  1.69364e-01  0.00000e+00 0.00000e+00 3.22406e+01 6.645   1.01445e+01 6.645   0.5870 
1 1 1 8   104 2  o 18 6.24420e+00 9.74763e-01 1.07066e+02 170.983 -1.39514e+01 2.21396e+00  0.00000e+00 0.00000e+00 1.16979e+02 170.983 9.91354e+00 170.983 0.9639 
1 1 1 8   104 3  o 19 6.80146e+00 9.84343e-01 8.43642e+01 340.936 1.20783e+01  -4.17403e+00 0.00000e+00 0.00000e+00 1.58732e+02 340.936 7.43682e+01 340.936 0.9600 
1 1 1 8   104 4  o 4  6.82070e+00 1.03758e+00 1.22129e+02 237.041 -9.75906e+00 -1.50510e+01 0.00000e+00 0.00000e+00 1.24647e+02 237.041 2.51770e+00 237.041 0.9717 
1 1 1 8   104 5  o 7  3.45631e+00 9.95308e-01 4.03207e+01 168.830 -3.25387e+00 6.42510e-01  0.00000e+00 0.00000e+00 6.66165e+01 168.830 2.62957e+01 168.830 0.8309 
1 1 1 8   104 6  o 14 4.22411e+00 1.05326e+00 4.28513e+01 67.778  1.73572e+00  4.24868e+00  0.00000e+00 0.00000e+00 9.60156e+01 67.778  5.31643e+01 67.778  0.8829 
1 1 1 8   104 7  o 12 3.25965e+00 1.01479e+00 4.14369e+01 118.208 -1.69542e+00 3.16092e+00  0.00000e+00 0.00000e+00 6.11781e+01 118.208 1.97412e+01 118.208 0.8455 
1 1 1 8   105 0  o 1  2.01579e+00 6.85122e-01 2.04466e+01 0.232   1.07307e+00  4.33958e-03  0.00000e+00 0.00000e+00 1.49173e+01 0.232   5.52925e+00 180.232 0.4717 
1 1 1 8   105 1  f 0  3.72359e+00 9.05314e-01 1.74791e+01 229.780 -1.00932e+00 -1.19351e+00 0.00000e+00 0.00000e+00 6.72115e+01 229.780 4.97324e+01 229.780 0.6113 
1 1 1 8   105 2  o 15 5.21383e+00 9.70915e-01 7.87863e+01 163.929 -8.88372e+00 2.55936e+00  0.00000e+00 0.00000e+00 1.04419e+02 163.929 2.56330e+01 163.929 0.9443 
1 1 1 8   105 3  o 3  1.04685e+01 7.88633e-01 1.50675e+02 335.905 3.79588e+01  -1.69756e+01 0.00000e+00 0.00000e+00 2.34238e+02 335.905 8.35630e+01 335.905 0.9879 
1 1 1 8   105 4  o 5  3.08313e+00 9.44957e-01 4.57191e+01 6.061   3.64495e+00  3.87038e-01  0.00000e+00 0.00000e+00 5.17492e+01 6.061   6.03018e+00 6.061   0.8493 
1 1 1 8   105 5  o 10 5.84819e+00 1.06682e+00 4.87742e+01 59.680  3.50729e+00  5.99712e+00  0.00000e+00 0.00000e+00 1.52583e+02 59.680  1.03808e+02 59.680  0.9249 
1 1 1 8   105 6  f 0  3.76070e+00 1.06019e+00 9.21775e+01 198.759 -8.03819e+00 -2.73008e+00 0.00000e+00 0.00000e+00 3.92877e+01 198.759 5.28898e+01 18.759  0.9391 
1 1 1 8   105 7  o 15 2.65089e+00 8.74851e-01 2.49219e+01 27.657  1.74116e+00  9.12477e-01  0.00000e+00 0.00000e+00 4.33647e+01 27.657  1.84429e+01 27.657  0.6921 
1 1 1 8   106 0  o 15 4.38162e+00 7.99408e-01 3.42323e+01 270.719 4.85227e-02  -3.86454e+00 0.00000e+00 0.00000e+00 1.05571e+02 270.719 7.13390e+01 270.719 0.8581 
1 1 1 8   106 1  o 12 4.04261e+00 9.85495e-01 8.89598e+01 218.189 -6.44116e+00 -5.06675e+00 0.00000e+00 0.00000e+00 5.19010e+01 218.189 3.70588e+01 38.189  0.9368 
1 1 1 8   106 2  o 4  5.21148e+00 1.06392e+00 8.31038e+01 20.784  8.53466e+00  3.23920e+00  0.00000e+00 0.00000e+00 9.98235e+01 20.784  1.67197e+01 20.784  0.9435 
1 1 1 8   106 3  o 3  3.04525e+00 9.25943e-01 5.24508e+01 82.577  5.60950e-01  4.30564e+00  0.00000e+00 0.00000e+00 4.67499e+01 82.577  5.70098e+00 262.577 0.8755 
1 1 1 8   106 4  o 13 1.99322e+00 6.92269e-01 3.62565e+00 327.556 1.92392e-01  -1.22301e-01 0.00000e+00 0.00000e+00 4.77452e+00 327.556 1.14887e+00 327.556 0.1133 
1 1 1 8   106 5  o 1  3.00696e+00 9.36581e-01 6.52208e+01 346.374 5.01297e+00  -1.21514e+00 0.00000e+00 0.00000e+00 3.51457e+01 346.374 3.00751e+01 166.374 0.8969 
1 1 1 8   106 6  o 1  2.49259e+00 8.39058e-01 4.98952e+01 167.964 -4.03606e+00 8.60561e-01  0.00000e+00 0.00000e+00 3.06395e+01 167.964 1.92557e+01 347.964 0.8682 
1 1 1 8   106 7  o 13 6.66509e+00 1.14173e+00 9.30837e+01 89.905  2.63619e-02  1.58209e+01  0.00000e+00 0.00000e+00 1.46958e+02 89.905  5.38740e+01 89.905  0.9679 
1 1 1 8   107 0  o 7  3.76967e+00 9.70509e-01 5.13456e+01 226.908 -3.01000e+00 -3.21749e+00 0.00000e+00 0.00000e+00 7.16134e+01 226.908 2.02678e+01 226.908 0.8775 
1 1 1 8   107 1  o 9  4.18348e+00 1.00971e+00 6.66335e+01 9.496   6.22010e+00  1.04047e+00  0.00000e+00 0.00000e+00 7.59875e+01 9.496   9.35407e+00 9.496   0.9169 
1 1 1 8   107 2  o 5  4.64567e+00 1.04014e+00 4.90877e+01 267.308 -2.61414e-01 -5.55936e+00 0.00000e+00 0.00000e+00 1.07281e+02 267.308 5.81932e+01 267.308 0.9050 
1 1 1 8   107 3  o 13 2.69582e+00 8.59396e-01 1.65581e+01 282.081 2.55970e-01  -1.19592e+00 0.00000e+00 0.00000e+00 3.55711e+01 282.081 1.90130e+01 282.081 0.5199 
1 1 1 8   107 4  o 12 5.86705e+00 1.07208e+00 7.94957e+01 301.992 6.15642e+00  -9.85551e+00 0.00000e+00 0.00000e+00 1.29153e+02 301.992 4.96569e+01 301.992 0.9560 
1 1 1 8   107 5  f 0  2.83036e+00 9.00103e-01 5.19636e+01 132.532 -2.83876e+00 3.09446e+00  0.00000e+00 0.00000e+00 3.97268e+01 132.532 1.22368e+01 312.532 0.8708 
1 1 1 8   107 6  o 9  5.24907e+00 1.15966e+00 7.79903e+01 152.939 -8.21625e+00 4.19738e+00  0.00000e+00 0.00000e+00 1.06381e+02 152.939 2.83907e+01 152.939 0.9441 
1 1 1 8   108 0  o 16 2.04950e+00 6.94534e-01 4.65517e+01 218.537 -2.42068e+00 -1.92806e+00 0.00000e+00 0.00000e+00 1.56523e+01 218.537 3.08994e+01 38.537  0.8167 
1 1 1 8   108 1  o 9  3.29387e+00 9.09157e-01 6.12500e+01 231.882 -3.34128e+00 -4.25857e+00 0.00000e+00 0.00000e+00 4.92075e+01 231.882 1.20425e+01 51.882  0.9022 
1 1 1 8   108 2  o 13 4.27128e+00 1.04168e+00 4.97788e+01 37.056  3.94984e+00  2.98244e+00  0.00000e+00 0.00000e+00 9.19071e+01 37.056  4.21282e+01 37.056  0.8922 
1 1 1 8   108 3  o 1  7.87169e+00 9.27044e-01 1.13827e+02 235.775 -1.36951e+01 -2.01330e+01 0.00000e+00 0.00000e+00 1.72817e+02 235.775 5.89900e+01 235.775 0.9792 
1 1 1 8   108 4  o 10 3.09076e+00 9.42884e-01 3.63376e+01 67.352  1.23303e+00  2.95518e+00  0.00000e+00 0.00000e+00 5.83646e+01 67.352  2.20269e+01 67.352  0.8239 
1 1 1 8   108 5  o 18 4.38520e+00 1.07933e+00 4.79194e+01 208.567 -4.59315e+00 -2.50081e+00 0.00000e+00 0.00000e+00 9.86135e+01 208.567 5.06941e+01 208.567 0.8985 
1 1 1 8   108 6  o 18 4.00328e+00 9.95869e-01 5.36282e+01 10.937  6.21031e+00  1.20003e+00  0.00000e+00 0.00000e+00 8.29221e+01 10.937  2.92939e+01 10.937  0.9171 
1 1 1 8   109 0  o 8  3.08361e+00 9.05649e-01 4.79958e+01 129.536 -2.47571e+00 2.99946e+00  0.00000e+00 0.00000e+00 5.04205e+01 129.536 2.42475e+00 129.536 0.8591 
1 1 1 8   109 1  o 8  2.45696e+00 7.90917e-01 3.59646e+01 272.731 1.33634e-01  -2.80167e+00 0.00000e+00 0.00000e+00 3.65703e+01 272.731 6.05677e-01 272.731 0.7945 
1 1 1 8   109 2  o 9  3.71961e+00 9.83507e-01 4.77638e+01 131.809 -3.05085e+00 3.41110e+00  0.00000e+00 0.00000e+00 7.42498e+01 131.809 2.64860e+01 131.809 0.8825 
1 1 1 8   109 3  o 16 3.22053e+00 9.51677e-01 6.51766e+01 189.723 -5.85096e+00 -1.00252e+00 0.00000e+00 0.00000e+00 4.39344e+01 189.723 2.12422e+01 9.723   0.9114 
1 1 1 8   109 4  o 3  3.57825e+00 9.85168e-01 5.51292e+01 87.928  2.03450e-01  5.62322e+00  0.00000e+00 0.00000e+00 6.54210e+01 87.928  1.02917e+01 87.928  0.9061 
1 1 1 8   109 5  o 14 3.36382e+00 1.00519e+00 2.28266e+01 229.960 -1.36975e+00 -1.63008e+00 0.00000e+00 0.00000e+00 6.69596e+01 229.960 4.41330e+01 229.960 0.7179 
1 1 1 8   109 6  o 12 2.72939e+00 8.93034e-01 3.27390e+01 140.422 -2.34070e+00 1.93488e+00  0.00000e+00 0.00000e+00 4.97312e+01 140.422 1.69922e+01 140.422 0.8127 
1 1 1 8   110 0  o 8  4.39812e+00 9.81965e-01 1.05063e+02 240.738 -6.15500e+00 -1.09850e+01 0.00000e+00 0.00000e+00 5.16489e+01 240.738 5.34145e+01 60.738  0.9594 
1 1 1 8   110 1  o 13 2.99591e+00 8.82505e-01 2.97909e+01 5.534   2.66820e+00  2.58509e-01  0.00000e+00 0.00000e+00 5.73869e+01 5.534   2.75959e+01 5.534   0.7833 
1 1 1 8   110 2  o 8  6.81098e+00 9.79035e-01 1.12890e+02 97.190  -2.64686e+00 2.09819e+01  0.00000e+00 0.00000e+00 1.34132e+02 97.190  2.12419e+01 97.190  0.9761 
1 1 1 8   110 3  o 16 2.92518e+00 9.04078e-01 8.23240e+01 126.437 -4.11191e+00 5.56978e+00  0.00000e+00 0.00000e+00 1.81976e+01 126.437 6.41264e+01 306.437 0.9247 
1 1 1 8   110 4  o 7  2.82750e+00 8.73165e-01 3.56230e+01 319.022 2.49645e+00  -2.16842e+00 0.00000e+00 0.00000e+00 5.16390e+01 319.022 1.60160e+01 319.022 0.8303 
1 1 1 8   110 5  o 12 2.54737e+00 8.41167e-01 2.82217e+01 33.801  2.12253e+00  1.42098e+00  0.00000e+00 0.00000e+00 4.47592e+01 33.801  1.65375e+01 33.801  0.7708 
1 1 1 8   111 0  o 3  3.46298e+00 9.52355e-01 3.83038e+01 10.549  3.68203e+00  6.85695e-01  0.00000e+00 0.00000e+00 7.13617e+01 10.549  3.30579e+01 10.549  0.8530 
1 1 1 8   111 1  o 12 2.45695e+00 7.94308e-01 5.47739e+01 103.050 -9.59148e-01 4.13789e+00  0.00000e+00 0.00000e+00 2.48301e+01 103.050 2.99439e+01 283.050 0.8724 
1 1 1 8   111 2  o 12 2.34648e+00 7.76237e-01 3.87534e+01 162.458 -3.07304e+00 9.71427e-01  0.00000e+00 0.00000e+00 3.31742e+01 162.458 5.57915e+00 342.458 0.8252 
1 1 1 8   111 3  f 0  3.43505e+00 9.25557e-01 2.13095e+01 27.155  2.02320e+00  1.03775e+00  0.00000e+00 0.00000e+00 7.28738e+01 27.155  5.15644e+01 27.155  0.7380 
1 1 1 8   111 4  f 0  3.20160e+00 9.57129e-01 6.37363e+01 13.462  6.10440e+00  1.46126e+00  0.00000e+00 0.00000e+00 4.52867e+01 13.462  1.84495e+01 193.462 0.9165 
1 1 1 8   111 5  o 4  2.52680e+00 8.38015e-01 4.88401e+01 113.088 -1.69267e+00 3.97078e+00  0.00000e+00 0.00000e+00 3.32855e+01 113.088 1.55546e+01 293.088 0.8747 
1 1 1 8   112 0  o 3  3.96137e+00 9.43213e-01 6.18715e+01 91.182  -1.50606e-01 7.30086e+00  0.00000e+00 0.00000e+00 7.46835e+01 91.182  1.28120e+01 91.182  0.9288 
1 1 1 8   112 1  o 14 5.13175e+00 9.84320e-01 5.79428e+01 238.895 -4.20633e+00 -6.97144e+00 0.00000e+00 0.00000e+00 1.20466e+02 238.895 6.25235e+01 238.895 0.9364 
1 1 1 8   112 2  o 17 2.71123e+00 8.69000e-01 4.47997e+01 358.519 4.00418e+00  -1.03487e-01 0.00000e+00 0.00000e+00 4.21625e+01 358.519 2.63725e+00 178.520 0.8637 
1 1 1 8   112 3  o 13 6.12683e+00 1.05228e+00 6.07411e+01 44.173  7.40566e+00  7.19497e+00  0.00000e+00 0.00000e+00 1.55501e+02 44.173  9.47598e+01 44.173  0.9503 
1 1 1 8   112 4  o 7  2.86128e+00 8.85034e-01 4.26610e+01 247.915 -1.57503e+00 -3.88185e+00 0.00000e+00 0.00000e+00 4.98505e+01 247.915 7.18948e+00 247.915 0.8704 
1 1 1 8   112 5  o 14 3.38437e+00 1.01161e+00 3.09830e+01 247.729 -1.23266e+00 -3.00990e+00 0.00000e+00 0.00000e+00 7.29935e+01 247.729 4.20105e+01 247.729 0.8271 
1 1 1 8   113 0  o 6  6.48167e+00 1.00602e+00 1.06047e+02 91.897  -5.96227e-01 1.80043e+01  0.00000e+00 0.00000e+00 1.27677e+02 91.897  2.16298e+01 91.897  0.9718 
1 1 1 8   113 1  o 7  8.71465e+00 8.53522e-01 1.34363e+02 298.715 1.70756e+01  -3.11699e+01 0.00000e+00 0.00000e+00 1.84499e+02 298.715 5.01362e+01 298.715 0.9858 
1 1 1 8   113 2  o 7  6.14284e+00 1.01946e+00 8.76457e+01 119.767 -7.68255e+00 1.34322e+01  0.00000e+00 0.00000e+00 1.32903e+02 119.767 4.52569e+01 119.767 0.9671 
1 1 1 8   113 3  o 13 3.10907e+00 9.00108e-01 3.91976e+01 139.062 -3.18903e+00 2.76612e+00  0.00000e+00 0.00000e+00 6.14114e+01 139.062 2.22137e+01 139.062 0.8715 
1 1 1 8   113 4  o 18 3.76933e+00 1.01359e+00 6.63303e+01 312.967 5.10911e+00  -5.48523e+00 0.00000e+00 0.00000e+00 6.39382e+01 312.967 2.39204e+00 132.967 0.9307 
1 1 1 8   114 0  o 11 2.51206e+00 8.02892e-01 3.13738e+01 88.512  7.44663e-02  2.86645e+00  0.00000e+00 0.00000e+00 4.31400e+01 88.512  1.17662e+01 88.512  0.7997 
1 1 1 8   114 1  o 10 2.86297e+00 8.63645e-01 8.44871e+01 336.124 7.66509e+00  -3.39278e+00 0.00000e+00 0.00000e+00 1.51856e+01 336.124 6.93015e+01 156.124 0.9383 
1 1 1 8   114 2  o 1  3.37762e+00 9.86110e-01 6.11303e+01 156.440 -5.79712e+00 2.52787e+00  0.00000e+00 0.00000e+00 5.38314e+01 156.440 7.29890e+00 336.440 0.9171 
1 1 1 8   114 3  o 2  6.91770e+00 1.02722e+00 1.03870e+02 163.985 -2.04017e+01 5.85597e+00  0.00000e+00 0.00000e+00 1.46780e+02 163.985 4.29096e+01 163.985 0.9762 
1 1 1 8   114 4  o 3  4.86977e+00 1.13476e+00 7.95225e+01 311.233 6.95156e+00  -7.93140e+00 0.00000e+00 0.00000e+00 9.24588e+01 311.233 1.29363e+01 311.233 0.9513 
1 1 1 8   115 0  o 13 3.32182e+00 9.48272e-01 7.32932e+01 337.542 7.18754e+00  -2.97100e+00 0.00000e+00 0.00000e+00 4.16678e+01 337.542 3.16253e+01 157.542 0.9333 
1 1 1 8   115 1  o 3  3.49987e+00 9.59986e-01 5.53635e+01 225.258 -4.17580e+00 -4.21360e+00 0.00000e+00 0.00000e+00 6.29376e+01 225.258 7.57414e+00 225.258 0.9113 
1 1 1 8   115 2  o 15 4.41427e+00 1.05643e+00 6.72146e+01 234.667 -4.90305e+00 -6.91650e+00 0.00000e+00 0.00000e+00 8.65714e+01 234.667 1.93568e+01 234.667 0.9390 
1 1 1 8   115 3  o 19 3.61408e+00 1.00946e+00 2.48524e+01 8.478   2.80099e+00  4.17510e-01  0.00000e+00 0.00000e+00 8.19969e+01 8.478   5.71446e+01 8.478   0.7967 
1 1 1 8   115 4  o 2  2.29619e+00 7.72446e-01 2.42113e+01 151.853 -2.20861e+00 1.18162e+00  0.00000e+00 0.00000e+00 4.10214e+01 151.853 1.68101e+01 151.853 0.7655 
1 1 1 8   116 0  o 9  3.33481e+00 9.58760e-01 3.03526e+01 143.034 -2.67170e+00 2.01078e+00  0.00000e+00 0.00000e+00 7.25616e+01 143.034 4.22090e+01 143.034 0.8325 
1 1 1 8   116 1  o 12 3.48296e+00 9.53824e-01 5.51880e+01 282.062 1.33329e+00  -6.23933e+00 0.00000e+00 0.00000e+00 6.33562e+01 282.062 8.16813e+00 282.062 0.9179 
1 1 1 8   116 2  o 10 2.37342e+00 7.79931e-01 4.39849e+01 160.324 -4.07647e+00 1.45769e+00  0.00000e+00 0.00000e+00 3.30466e+01 160.324 1.09383e+01 340.323 0.8751 
1 1 1 8   116 3  o 14 2.31190e+00 7.75036e-01 4.88321e+01 93.499  -2.87654e-01 4.70448e+00  0.00000e+00 0.00000e+00 2.71751e+01 93.499  2.16570e+01 273.499 0.8863 
1 1 1 8   116 4  o 7  2.07658e+00 7.16303e-01 4.17299e+01 144.142 -3.52859e+00 2.55035e+00  0.00000e+00 0.00000e+00 2.57463e+01 144.142 1.59836e+01 324.142 0.8759 
1 1 1 8   117 0  o 2  2.15361e+00 7.27862e-01 3.21019e+01 127.857 -1.87096e+00 2.40712e+00  0.00000e+00 0.00000e+00 3.28233e+01 127.857 7.21368e-01 127.857 0.8135 
1 1 1 8   117 1  o 12 3.40725e+00 9.79063e-01 7.91659e+01 201.859 -7.82673e+00 -3.13980e+00 0.00000e+00 0.00000e+00 3.93914e+01 201.859 3.97745e+01 21.859  0.9387 
1 1 1 8   117 2  o 7  2.50181e+00 8.04173e-01 4.69463e+01 105.353 -1.34470e+00 4.89746e+00  0.00000e+00 0.00000e+00 3.60895e+01 105.353 1.08568e+01 285.353 0.8952 
1 1 1 8   117 3  o 15 4.66641e+00 1.03207e+00 6.24641e+01 231.618 -6.00635e+00 -7.58292e+00 0.00000e+00 0.00000e+00 1.01377e+02 231.618 3.89126e+01 231.618 0.9468 
1 1 1 8   118 0  o 19 2.61883e+00 8.37757e-01 6.10428e+01 134.909 -4.67159e+00 4.68648e+00  0.00000e+00 0.00000e+00 2.83080e+01 134.909 3.27348e+01 314.909 0.9210 
1 1 1 8   118 1  o 13 2.81251e+00 8.76416e-01 6.66810e+01 128.673 -4.37805e+00 5.47005e+00  0.00000e+00 0.00000e+00 2.97867e+01 128.673 3.68943e+01 308.673 0.9256 
1 1 1 8   118 2  o 16 5.72564e+00 1.09000e+00 6.18075e+01 26.924  9.43107e+00  4.78955e+00  0.00000e+00 0.00000e+00 1.40117e+02 26.924  7.83099e+01 26.924  0.9515 
1 1 1 8   118 3  o 8  2.98243e+00 9.19480e-01 5.85292e+01 335.821 5.60301e+00  -2.51565e+00 0.00000e+00 0.00000e+00 4.25808e+01 335.821 1.59484e+01 155.821 0.9145 
1 1 1 8   119 1  o 16 2.70398e+00 8.29741e-01 5.02777e+01 326.967 5.41354e+00  -3.52006e+00 0.00000e+00 0.00000e+00 4.17684e+01 326.967 8.50935e+00 146.967 0.9189 
1 1 1 8   119 2  o 1  2.03170e+00 7.03785e-01 5.91642e+01 43.945  3.94171e+00  3.79913e+00  0.00000e+00 0.00000e+00 8.83930e+00 43.945  5.03249e+01 223.945 0.9033 
1 1 1 8   119 3  f 0  3.01108e+00 9.42391e-01 6.20181e+01 205.393 -6.58643e+00 -3.12646e+00 0.00000e+00 0.00000e+00 4.16075e+01 205.393 2.04107e+01 25.393  0.9286 
1 1 1 8   120 2  o 11 4.03274e+00 1.06048e+00 4.82672e+01 114.136 -2.65244e+00 5.91974e+00  0.00000e+00 0.00000e+00 8.90560e+01 114.136 4.07888e+01 114.136 0.9193 
1 1 1 8   120 3  o 19 3.32997e+00 1.00407e+00 7.08671e+01 255.799 -1.97885e+00 -7.82001e+00 0.00000e+00 0.00000e+00 4.45772e+01 255.799 2.62899e+01 75.799  0.9358 
1 1 1 9   0   0  o 18 3.47891e+01 1.09525e+00 6.68502e+02 180.000 -1.57568e+01 0.00000e+00  0.00000e+00 0.00000e+00 6.46854e+02 180.000 2.16477e+01 0.000   1.0000 
1 1 1 9   0   1  o 3  1.49873e+01 8.14227e-01 2.62624e+02 0.000   3.14489e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.02128e+02 0.000   3.95037e+01 0.000   0.9963 
1 1 1 9   0   2  o 2  1.09682e+01 9.79468e-01 2.35417e+02 0.000   2.44901e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.73388e+02 0.000   6.20282e+01 180.000 0.9852 
1 1 1 9   0   3  o 10 1.15796e+01 9.65268e-01 1.32684e+02 0.000   1.31601e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.46680e+02 0.000   1.13996e+02 0.000   0.8658 
1 1 1 9   0   4  o 13 1.09901e+01 1.05948e+00 1.03645e+02 0.000   1.18645e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.41358e+02 0.000   1.37713e+02 0.000   0.8295 
1 1 1 9   0   5  o 9  2.24347e+01 1.02455e+00 2.87621e+02 0.000   7.74784e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.61510e+02 0.000   2.73889e+02 0.000   1.0000 
1 1 1 9   0   6  o 19 2.05987e+01 1.05720e+00 3.66701e+02 180.000 -1.05168e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.12961e+02 180.000 4.62609e+01 180.000 1.0000 
1 1 1 9   0   7  o 16 4.09907e+00 2.29048e+00 4.02970e+02 0.000   2.39954e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.50360e+02 180.000 6.53331e+02 180.000 0.9837 
1 1 1 9   0   8  o 14 1.64116e+01 1.32414e+00 1.51124e+02 0.000   5.25896e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.69943e+02 0.000   3.18819e+02 0.000   0.9999 
1 1 1 9   0   9  o 6  1.45578e+01 1.51259e+00 2.11754e+02 0.000   8.18469e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.39104e+02 0.000   1.27350e+02 0.000   1.0000 
1 1 1 9   0   10 o 10 4.96556e+00 2.54295e+00 8.31478e+01 180.000 -1.10313e+00 0.00000e+00  0.00000e+00 0.00000e+00 6.74388e+01 180.000 1.57090e+01 0.000   0.8016 
1 1 1 9   0   11 o 6  5.53765e+00 2.88310e+00 4.95475e+01 0.000   7.59585e-01  0.00000e+00  0.00000e+00 0.00000e+00 8.46663e+01 0.000   3.51188e+01 0.000   0.6408 
1 1 1 9   0   12 f 0  3.08835e+00 2.09256e+00 1.44625e+01 180.000 -1.73702e-01 0.00000e+00  0.00000e+00 0.00000e+00 5.61800e+00 180.000 8.84447e+00 0.000   0.1720 
1 1 1 9   0   13 o 6  6.07260e+00 3.63628e+00 1.02715e+02 180.000 -1.65452e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.10599e+02 180.000 7.88401e+00 180.000 0.9295 
1 1 1 9   1   0  o 1  1.02877e+01 6.28211e-01 1.63774e+02 154.960 -2.07923e+00 9.71307e-01  0.00000e+00 0.00000e+00 1.24348e+02 154.960 3.94258e+01 334.960 0.7407 
1 1 1 9   1   1  o 14 2.25204e+01 7.14946e-01 4.96493e+02 96.731  -2.08264e+00 1.76468e+01  0.00000e+00 0.00000e+00 3.30948e+02 96.731  1.65546e+02 276.731 0.9714 
1 1 1 9   1   2  o 16 5.48118e+01 1.12084e+00 1.19365e+03 77.869  2.53708e+01  1.18036e+02  0.00000e+00 0.00000e+00 8.71393e+02 77.869  3.22256e+02 257.869 0.9958 
1 1 1 9   1   3  o 10 2.54929e+01 6.82786e-01 3.76958e+02 263.248 -1.93522e+00 -1.63465e+01 0.00000e+00 0.00000e+00 5.57920e+02 263.248 1.80962e+02 263.248 0.9691 
1 1 1 9   1   4  o 12 1.81566e+01 6.67982e-01 2.61428e+02 341.119 9.39803e+00  -3.21423e+00 0.00000e+00 0.00000e+00 3.90153e+02 341.119 1.28725e+02 341.119 0.9482 
1 1 1 9   1   5  o 1  2.07705e+01 7.19018e-01 2.12097e+02 54.669  6.11986e+00  8.63340e+00  0.00000e+00 0.00000e+00 5.35927e+02 54.669  3.23831e+02 54.669  0.9515 
1 1 1 9   1   6  o 8  2.93740e+01 7.89850e-01 5.93736e+02 86.732  2.75903e+00  4.83178e+01  0.00000e+00 0.00000e+00 5.06524e+02 86.732  8.72119e+01 266.732 0.9896 
1 1 1 9   1   7  o 9  2.67975e+01 8.28666e-01 4.42577e+02 178.925 -3.85547e+01 7.23746e-01  0.00000e+00 0.00000e+00 5.58438e+02 178.925 1.15860e+02 178.925 0.9869 
1 1 1 9   1   8  o 10 7.08636e+00 1.38478e+00 6.37768e+01 244.690 -7.56180e-01 -1.59899e+00 0.00000e+00 0.00000e+00 1.12127e+02 244.690 4.83504e+01 244.690 0.6559 
1 1 1 9   1   9  o 7  1.39624e+01 1.11476e+00 2.17649e+02 219.879 -1.22613e+01 -1.02443e+01 0.00000e+00 0.00000e+00 2.93867e+02 219.879 7.62175e+01 219.879 0.9682 
1 1 1 9   1   10 o 16 9.09127e+00 1.43051e+00 1.46231e+02 325.365 6.64179e+00  -4.58782e+00 0.00000e+00 0.00000e+00 1.75633e+02 325.365 2.94020e+01 325.365 0.9358 
1 1 1 9   1   11 o 19 9.28438e+00 1.72647e+00 2.15110e+02 101.712 -2.55975e+00 1.23470e+01  0.00000e+00 0.00000e+00 1.21805e+02 101.712 9.33054e+01 281.712 0.9595 
1 1 1 9   1   12 o 12 5.11314e+00 1.62044e+00 5.64648e+01 49.226  1.37810e+00  1.59798e+00  0.00000e+00 0.00000e+00 8.17670e+01 49.226  2.53021e+01 49.226  0.7151 
1 1 1 9   1   13 o 13 4.97636e+00 1.71417e+00 3.95495e+01 289.965 5.64272e-01  -1.55326e+00 0.00000e+00 0.00000e+00 7.92445e+01 289.965 3.96950e+01 289.965 0.6317 
1 1 1 9   2   0  o 8  2.77323e+01 6.72013e-01 4.98444e+02 242.906 -8.56054e+00 -1.67330e+01 0.00000e+00 0.00000e+00 5.21805e+02 242.906 2.33615e+01 242.906 0.9730 
1 1 1 9   2   1  o 7  3.41955e+01 7.68756e-01 5.99677e+02 31.761  2.76334e+01  1.71075e+01  0.00000e+00 0.00000e+00 6.73600e+02 31.761  7.39238e+01 31.761  0.9845 
1 1 1 9   2   2  o 1  2.56916e+01 6.78644e-01 4.42126e+02 273.083 1.15921e+00  -2.15226e+01 0.00000e+00 0.00000e+00 5.07017e+02 273.083 6.48907e+01 273.083 0.9765 
1 1 1 9   2   3  o 6  1.66389e+01 6.26472e-01 4.57858e+02 272.605 5.94370e-01  -1.30638e+01 0.00000e+00 0.00000e+00 1.47186e+02 272.605 3.10672e+02 92.605  0.9610 
1 1 1 9   2   4  o 10 3.81040e+01 8.65526e-01 6.00911e+02 72.622  1.41383e+01  4.51758e+01  0.00000e+00 0.00000e+00 8.25844e+02 72.622  2.24934e+02 72.622  0.9894 
1 1 1 9   2   5  o 16 5.47033e+01 1.14479e+00 9.15649e+02 206.257 -1.04138e+02 -5.13698e+01 0.00000e+00 0.00000e+00 1.14588e+03 206.257 2.30228e+02 206.257 0.9957 
1 1 1 9   2   6  o 19 3.84494e+01 8.98855e-01 6.41206e+02 351.885 6.70712e+01  -9.56285e+00 0.00000e+00 0.00000e+00 8.03320e+02 351.885 1.62115e+02 351.885 0.9926 
1 1 1 9   2   7  o 14 2.77300e+01 8.33367e-01 4.56016e+02 43.516  2.97970e+01  2.82920e+01  0.00000e+00 0.00000e+00 5.80676e+02 43.516  1.24660e+02 43.516  0.9878 
1 1 1 9   2   8  o 7  3.40969e+01 9.26652e-01 5.82807e+02 24.095  7.70274e+01  3.44483e+01  0.00000e+00 0.00000e+00 6.99922e+02 24.095  1.17115e+02 24.095  0.9941 
1 1 1 9   2   9  o 4  1.01110e+01 1.30190e+00 1.71713e+02 214.307 -7.21465e+00 -4.92287e+00 0.00000e+00 0.00000e+00 1.88261e+02 214.307 1.65478e+01 214.307 0.9409 
1 1 1 9   2   10 o 3  5.21750e+00 1.42233e+00 8.32447e+01 322.609 2.10077e+00  -1.60563e+00 0.00000e+00 0.00000e+00 7.06748e+01 322.609 1.25699e+01 142.609 0.7798 
1 1 1 9   2   11 f 0  1.02872e+01 1.68868e+00 1.07367e+02 77.944  1.47920e+00  6.92602e+00  0.00000e+00 0.00000e+00 2.53077e+02 77.944  1.45710e+02 77.944  0.9264 
1 1 1 9   2   12 f 0  7.54934e+00 1.93876e+00 2.33501e+02 7.169   1.10522e+01  1.39018e+00  0.00000e+00 0.00000e+00 3.87905e+01 7.169   1.94711e+02 187.169 0.9540 
1 1 1 9   2   13 o 13 7.18067e+00 2.10948e+00 1.86993e+02 315.368 6.47116e+00  -6.38859e+00 0.00000e+00 0.00000e+00 6.89934e+01 315.368 1.18000e+02 135.368 0.9433 
1 1 1 9   3   0  o 4  9.88344e+00 6.27885e-01 1.37411e+02 134.874 -1.30427e+00 1.31004e+00  0.00000e+00 0.00000e+00 1.13434e+02 134.874 2.39771e+01 314.873 0.6713 
1 1 1 9   3   1  o 10 1.67081e+01 5.69032e-01 6.59224e+01 259.448 -3.22082e-01 -1.72910e+00 0.00000e+00 0.00000e+00 3.47307e+02 259.448 2.81385e+02 259.448 0.6539 
1 1 1 9   3   2  o 6  2.25535e+01 7.52693e-01 3.98013e+02 130.311 -1.09727e+01 1.29335e+01  0.00000e+00 0.00000e+00 4.29676e+02 130.311 3.16636e+01 130.311 0.9701 
1 1 1 9   3   3  o 2  2.56370e+01 6.83951e-01 4.20361e+02 97.135  -2.29114e+00 1.83034e+01  0.00000e+00 0.00000e+00 5.23062e+02 97.135  1.02701e+02 97.135  0.9725 
1 1 1 9   3   4  o 11 2.17993e+01 6.88709e-01 5.18895e+02 298.437 1.12533e+01  -2.07806e+01 0.00000e+00 0.00000e+00 2.88457e+02 298.437 2.30438e+02 118.437 0.9786 
1 1 1 9   3   5  o 9  2.61917e+01 7.44366e-01 4.34445e+02 150.421 -2.37233e+01 1.34653e+01  0.00000e+00 0.00000e+00 5.38531e+02 150.421 1.04086e+02 150.421 0.9815 
1 1 1 9   3   6  o 15 1.80275e+01 7.51892e-01 4.82811e+02 274.401 2.00911e+00  -2.61067e+01 0.00000e+00 0.00000e+00 1.86363e+02 274.401 2.96448e+02 94.401  0.9807 
1 1 1 9   3   7  o 9  3.54959e+01 9.04585e-01 5.84798e+02 43.862  4.82519e+01  4.63728e+01  0.00000e+00 0.00000e+00 7.48590e+02 43.862  1.63792e+02 43.862  0.9925 
1 1 1 9   3   8  o 18 1.06265e+01 1.25766e+00 2.35070e+02 153.703 -8.98517e+00 4.44013e+00  0.00000e+00 0.00000e+00 1.46466e+02 153.703 8.86035e+01 333.703 0.9487 
1 1 1 9   3   9  o 16 5.50574e+00 1.43211e+00 3.95791e+01 258.544 -2.10539e-01 -1.03896e+00 0.00000e+00 0.00000e+00 5.77680e+01 258.544 1.81889e+01 258.544 0.4673 
1 1 1 9   3   10 o 6  1.71214e+01 1.04898e+00 3.28034e+02 171.324 -3.78124e+01 5.76964e+00  0.00000e+00 0.00000e+00 3.11154e+02 171.324 1.68805e+01 351.324 0.9868 
1 1 1 9   3   11 o 9  1.26119e+01 1.60255e+00 1.75379e+02 335.599 1.33743e+01  -6.06722e+00 0.00000e+00 0.00000e+00 2.85066e+02 335.599 1.09687e+02 335.599 0.9653 
1 1 1 9   3   12 o 3  8.46209e+00 1.93837e+00 1.98310e+02 172.176 -1.05063e+01 1.44365e+00  0.00000e+00 0.00000e+00 1.06139e+02 172.176 9.21713e+01 352.176 0.9516 
1 1 1 9   3   13 o 10 6.33439e+00 2.00773e+00 9.73759e+01 262.801 -5.53067e-01 -4.37891e+00 0.00000e+00 0.00000e+00 1.12745e+02 262.801 1.53694e+01 262.801 0.8777 
1 1 1 9   4   0  f 0  3.89519e+01 8.37049e-01 6.75491e+02 351.956 3.51644e+01  -4.96979e+00 0.00000e+00 0.00000e+00 7.76339e+02 351.956 1.00848e+02 351.956 0.9858 
1 1 1 9   4   1  o 3  1.47144e+01 5.78889e-01 3.06426e+02 328.273 6.11748e+00  -3.78225e+00 0.00000e+00 0.00000e+00 2.09808e+02 328.273 9.66185e+01 148.273 0.9276 
1 1 1 9   4   2  o 5  6.01620e+01 1.41460e+00 1.31406e+03 164.415 -1.36784e+02 3.81516e+01  0.00000e+00 0.00000e+00 9.53923e+02 164.415 3.60137e+02 344.415 0.9965 
1 1 1 9   4   3  o 17 3.34041e+01 7.84326e-01 7.07807e+02 263.949 -4.24360e+00 -4.00297e+01 0.00000e+00 0.00000e+00 5.40383e+02 263.949 1.67424e+02 83.949  0.9875 
1 1 1 9   4   4  o 2  1.82581e+01 6.73830e-01 3.74878e+02 48.551  9.46929e+00  1.07222e+01  0.00000e+00 0.00000e+00 2.91491e+02 48.551  8.33864e+01 228.551 0.9644 
1 1 1 9   4   5  o 6  2.90705e+01 7.69524e-01 5.82243e+02 161.982 -3.85081e+01 1.25254e+01  0.00000e+00 0.00000e+00 5.04354e+02 161.982 7.78882e+01 341.982 0.9876 
1 1 1 9   4   6  o 16 8.61855e+00 1.08025e+00 2.66769e+02 113.456 -2.66079e+00 6.13242e+00  0.00000e+00 0.00000e+00 3.39390e+01 113.456 2.32830e+02 293.455 0.9218 
1 1 1 9   4   7  o 19 1.41858e+01 9.21931e-01 3.26084e+02 112.241 -5.63194e+00 1.37722e+01  0.00000e+00 0.00000e+00 1.92453e+02 112.241 1.33631e+02 292.241 0.9658 
1 1 1 9   4   8  f 0  5.46335e+00 1.43299e+00 1.86068e+02 2.723   3.93206e+00  1.86979e-01  0.00000e+00 0.00000e+00 8.04294e+00 182.722 1.94111e+02 182.722 0.8610 
1 1 1 9   4   9  o 4  1.07853e+01 1.25110e+00 2.50112e+02 230.545 -8.72637e+00 -1.06029e+01 0.00000e+00 0.00000e+00 1.42836e+02 230.545 1.07276e+02 50.545  0.9629 
1 1 1 9   4   10 o 9  4.41998e+00 1.32213e+00 1.20525e+02 137.781 -2.47946e+00 2.24970e+00  0.00000e+00 0.00000e+00 1.87181e+01 137.781 1.01807e+02 317.781 0.8327 
1 1 1 9   4   11 o 18 2.12169e+01 1.37488e+00 3.33904e+02 352.884 5.10107e+01  -6.36810e+00 0.00000e+00 0.00000e+00 4.60670e+02 352.884 1.26765e+02 352.884 0.9902 
1 1 1 9   4   12 o 10 1.02542e+01 1.88782e+00 1.03572e+02 327.714 5.80736e+00  -3.66934e+00 0.00000e+00 0.00000e+00 2.54659e+02 327.714 1.51087e+02 327.714 0.9240 
1 1 1 9   4   13 o 9  6.70972e+00 2.04549e+00 8.49961e+01 225.905 -2.78193e+00 -2.87119e+00 0.00000e+00 0.00000e+00 1.33948e+02 225.905 4.89516e+01 225.905 0.8634 
1 1 1 9   5   0  o 15 1.27630e+01 5.87233e-01 4.21851e+02 128.233 -4.53512e+00 5.75635e+00  0.00000e+00 0.00000e+00 2.64462e+01 128.233 3.95405e+02 308.233 0.9290 
1 1 1 9   5   1  o 2  2.50248e+01 6.42767e-01 5.17896e+02 150.036 -1.78514e+01 1.02916e+01  0.00000e+00 0.00000e+00 4.05297e+02 150.036 1.12599e+02 330.036 0.9754 
1 1 1 9   5   2  o 19 2.26378e+01 7.95432e-01 5.69896e+02 251.629 -7.65356e+00 -2.30466e+01 0.00000e+00 0.00000e+00 2.68691e+02 251.629 3.01206e+02 71.629  0.9792 
1 1 1 9   5   3  o 11 3.30098e+01 7.81646e-01 5.63980e+02 64.318  1.37276e+01  2.85469e+01  0.00000e+00 0.00000e+00 6.65195e+02 64.318  1.01215e+02 64.318  0.9841 
1 1 1 9   5   4  o 12 2.12996e+01 6.89176e-01 3.38416e+02 209.171 -1.31362e+01 -7.33279e+00 0.00000e+00 0.00000e+00 4.40386e+02 209.171 1.01970e+02 209.171 0.9662 
1 1 1 9   5   5  o 17 2.59060e+01 7.39708e-01 2.10458e+02 76.084  3.14206e+00  1.26816e+01  0.00000e+00 0.00000e+00 7.31725e+02 76.084  5.21267e+02 76.084  0.9609 
1 1 1 9   5   6  o 9  2.62215e+01 7.71151e-01 4.72554e+02 125.726 -2.17085e+01 3.01820e+01  0.00000e+00 0.00000e+00 5.06461e+02 125.726 3.39067e+01 125.726 0.9865 
1 1 1 9   5   7  o 5  2.76370e+01 8.35242e-01 4.13430e+02 341.558 3.51754e+01  -1.17301e+01 0.00000e+00 0.00000e+00 6.18361e+02 341.558 2.04931e+02 341.558 0.9864 
1 1 1 9   5   8  o 1  1.68287e+01 9.37593e-01 3.23406e+02 143.910 -1.86270e+01 1.35782e+01  0.00000e+00 0.00000e+00 2.99486e+02 143.910 2.39204e+01 323.910 0.9781 
1 1 1 9   5   9  o 1  6.02548e+00 1.47698e+00 1.04440e+02 201.717 -2.80828e+00 -1.11851e+00 0.00000e+00 0.00000e+00 8.06114e+01 201.717 2.38290e+01 21.717  0.8117 
1 1 1 9   5   10 f 0  1.56504e+01 1.34293e+00 3.09991e+02 259.868 -5.25088e+00 -2.93821e+01 0.00000e+00 0.00000e+00 2.72056e+02 259.868 3.79359e+01 79.868  0.9831 
1 1 1 9   5   11 o 2  7.62244e+00 1.62348e+00 6.77397e+01 196.053 -3.26594e+00 -9.39760e-01 0.00000e+00 0.00000e+00 1.73148e+02 196.053 1.05408e+02 196.053 0.8356 
1 1 1 9   5   12 o 10 1.19977e+01 1.77298e+00 2.20866e+02 139.276 -1.36906e+01 1.17858e+01  0.00000e+00 0.00000e+00 2.19984e+02 139.276 8.82461e-01 319.276 0.9719 
1 1 1 9   5   13 o 13 7.15768e+00 2.06176e+00 6.50660e+01 19.211  3.05565e+00  1.06477e+00  0.00000e+00 0.00000e+00 1.58369e+02 19.211  9.33027e+01 19.211  0.8260 
1 1 1 9   5   14 o 2  7.54237e+00 2.33926e+00 1.99501e+02 203.199 -8.76502e+00 -3.75645e+00 0.00000e+00 0.00000e+00 7.00222e+01 203.199 1.29479e+02 23.199  0.9460 
1 1 1 9   6   0  o 19 6.47410e+01 1.29114e+00 1.32518e+03 325.956 1.09549e+02  -7.40139e+01 0.00000e+00 0.00000e+00 1.11324e+03 325.956 2.11943e+02 145.956 0.9962 
1 1 1 9   6   1  o 7  1.46616e+01 5.83324e-01 2.63791e+02 169.193 -6.04647e+00 1.15420e+00  0.00000e+00 0.00000e+00 2.43420e+02 169.193 2.03709e+01 349.193 0.9147 
1 1 1 9   6   2  o 9  4.36397e+01 1.10596e+00 7.90269e+02 107.368 -1.89610e+01 6.06224e+01  0.00000e+00 0.00000e+00 8.47589e+02 107.368 5.73207e+01 107.368 0.9921 
1 1 1 9   6   3  o 18 3.66289e+01 9.52832e-01 6.57453e+02 31.103  3.47206e+01  2.09469e+01  0.00000e+00 0.00000e+00 7.11326e+02 31.103  5.38734e+01 31.103  0.9876 
1 1 1 9   6   4  o 10 4.10816e+01 1.05960e+00 7.69793e+02 195.039 -6.21137e+01 -1.66887e+01 0.00000e+00 0.00000e+00 7.72762e+02 195.039 2.96962e+00 195.039 0.9922 
1 1 1 9   6   5  o 13 2.84999e+01 7.57319e-01 7.41051e+02 251.169 -1.63084e+01 -4.78208e+01 0.00000e+00 0.00000e+00 3.26863e+02 251.169 4.14188e+02 71.169  0.9901 
1 1 1 9   6   6  o 7  1.91076e+01 7.62060e-01 2.77905e+02 311.336 1.05243e+01  -1.19643e+01 0.00000e+00 0.00000e+00 4.22209e+02 311.336 1.44305e+02 311.336 0.9681 
1 1 1 9   6   7  o 19 2.45835e+01 8.14521e-01 4.95292e+02 136.625 -2.87658e+01 2.71784e+01  0.00000e+00 0.00000e+00 4.23288e+02 136.625 7.20037e+01 316.625 0.9873 
1 1 1 9   6   8  o 17 2.25076e+01 8.47708e-01 3.78270e+02 58.979  1.88159e+01  3.12894e+01  0.00000e+00 0.00000e+00 4.61746e+02 58.979  8.34769e+01 58.979  0.9862 
1 1 1 9   6   9  o 19 1.91341e+01 9.26005e-01 2.58814e+02 172.222 -2.67772e+01 3.65759e+00  0.00000e+00 0.00000e+00 4.51646e+02 172.222 1.92832e+02 172.222 0.9813 
1 1 1 9   6   10 o 6  7.65969e+00 1.63136e+00 1.26364e+02 318.363 4.04493e+00  -3.59591e+00 0.00000e+00 0.00000e+00 1.35040e+02 318.363 8.67565e+00 318.363 0.9021 
1 1 1 9   6   11 o 7  5.94462e+00 1.64274e+00 8.85342e+01 181.409 -3.43531e+00 -8.45066e-02 0.00000e+00 0.00000e+00 9.97972e+01 181.409 1.12630e+01 181.409 0.8377 
1 1 1 9   6   12 o 18 1.11403e+01 2.11626e+00 1.57967e+02 230.591 -6.49675e+00 -7.90688e+00 0.00000e+00 0.00000e+00 2.42061e+02 230.591 8.40936e+01 230.591 0.9498 
1 1 1 9   6   13 o 17 5.08035e+00 1.66695e+00 3.34992e+01 2.026   1.46466e+00  5.18012e-02  0.00000e+00 0.00000e+00 7.92958e+01 2.026   4.57966e+01 2.026   0.5875 
1 1 1 9   6   14 o 2  5.34758e+00 1.77359e+00 4.89889e+01 190.880 -2.26811e+00 -4.35957e-01 0.00000e+00 0.00000e+00 1.01013e+02 190.880 5.20245e+01 190.880 0.7426 
1 1 1 9   7   0  o 2  3.18445e+01 7.25120e-01 7.84423e+02 88.027  1.36918e+00  3.97381e+01  0.00000e+00 0.00000e+00 4.04280e+02 88.027  3.80143e+02 268.027 0.9873 
1 1 1 9   7   1  o 8  3.38593e+01 7.64757e-01 6.82187e+02 125.750 -2.08975e+01 2.90285e+01  0.00000e+00 0.00000e+00 5.80325e+02 125.750 1.01863e+02 305.750 0.9859 
1 1 1 9   7   2  o 13 6.27361e+01 1.46985e+00 1.28981e+03 15.060  1.39215e+02  3.74586e+01  0.00000e+00 0.00000e+00 1.07523e+03 15.060  2.14580e+02 195.060 0.9965 
1 1 1 9   7   3  o 17 4.14022e+01 1.03965e+00 7.24391e+02 174.887 -4.99714e+01 4.47132e+00  0.00000e+00 0.00000e+00 8.26480e+02 174.887 1.02089e+02 174.887 0.9900 
1 1 1 9   7   4  o 7  3.50044e+01 9.57325e-01 7.55328e+02 170.804 -5.58536e+01 9.04235e+00  0.00000e+00 0.00000e+00 5.57593e+02 170.804 1.97735e+02 350.804 0.9911 
1 1 1 9   7   5  f 0  9.01133e+00 8.96609e-01 1.49376e+02 27.357  2.82898e+00  1.46369e+00  0.00000e+00 0.00000e+00 1.31237e+02 27.357  1.81394e+01 207.357 0.8228 
1 1 1 9   7   6  o 10 1.34348e+01 8.33834e-01 1.78787e+02 236.794 -3.91876e+00 -5.98722e+00 0.00000e+00 0.00000e+00 2.92688e+02 236.794 1.13901e+02 236.794 0.9272 
1 1 1 9   7   7  o 10 3.95318e+01 9.26542e-01 7.38270e+02 29.849  8.12450e+01  4.66215e+01  0.00000e+00 0.00000e+00 7.49854e+02 29.849  1.15847e+01 29.849  0.9946 
1 1 1 9   7   8  o 6  9.52644e+00 1.22446e+00 1.63821e+02 167.215 -6.13452e+00 1.39206e+00  0.00000e+00 0.00000e+00 1.66636e+02 167.215 2.81488e+00 167.215 0.9166 
1 1 1 9   7   9  o 9  1.70307e+01 9.98666e-01 2.50260e+02 113.308 -9.06632e+00 2.10438e+01  0.00000e+00 0.00000e+00 3.79904e+02 113.308 1.29644e+02 113.308 0.9779 
1 1 1 9   7   10 o 10 1.77756e+01 1.25602e+00 2.14834e+02 154.118 -2.16874e+01 1.05223e+01  0.00000e+00 0.00000e+00 4.43492e+02 154.118 2.28658e+02 154.118 0.9790 
1 1 1 9   7   11 o 2  4.43074e+00 1.42362e+00 7.83270e+01 295.364 1.05817e+00  -2.23210e+00 0.00000e+00 0.00000e+00 4.93075e+01 295.364 2.90195e+01 115.364 0.7617 
1 1 1 9   7   12 o 11 1.45069e+01 2.06664e+00 2.07968e+02 19.786  1.68896e+01  6.07596e+00  0.00000e+00 0.00000e+00 3.24964e+02 19.786  1.16996e+02 19.786  0.9717 
1 1 1 9   7   13 o 14 7.64799e+00 2.08818e+00 2.70994e+01 330.871 1.23978e+00  -6.90876e-01 0.00000e+00 0.00000e+00 1.39241e+02 330.871 1.12141e+02 330.871 0.5755 
1 1 1 9   7   14 o 15 8.82963e+00 2.19558e+00 7.11117e+01 64.081  1.89174e+00  3.89257e+00  0.00000e+00 0.00000e+00 2.20730e+02 64.081  1.49619e+02 64.081  0.8750 
1 1 1 9   8   0  o 8  3.20256e+01 7.36726e-01 5.60527e+02 325.522 2.35054e+01  -1.61415e+01 0.00000e+00 0.00000e+00 6.28813e+02 325.522 6.82865e+01 325.522 0.9823 
1 1 1 9   8   1  o 6  3.65705e+01 8.09617e-01 6.64250e+02 293.556 1.49821e+01  -3.43645e+01 0.00000e+00 0.00000e+00 7.00224e+02 293.556 3.59745e+01 293.556 0.9866 
1 1 1 9   8   2  o 3  4.75240e+01 9.93015e-01 9.66023e+02 193.560 -8.26841e+01 -1.99424e+01 0.00000e+00 0.00000e+00 8.21159e+02 193.560 1.44864e+02 13.560  0.9941 
1 1 1 9   8   3  o 3  2.32264e+01 7.64056e-01 4.34938e+02 15.555  1.67001e+01  4.64877e+00  0.00000e+00 0.00000e+00 4.18138e+02 15.555  1.68008e+01 195.555 0.9707 
1 1 1 9   8   4  o 13 1.98918e+01 7.91723e-01 3.47961e+02 184.879 -1.49196e+01 -1.27351e+00 0.00000e+00 0.00000e+00 3.79206e+02 184.879 3.12452e+01 184.879 0.9660 
1 1 1 9   8   5  o 9  2.93787e+01 7.69461e-01 5.24819e+02 28.479  3.60891e+01  1.95780e+01  0.00000e+00 0.00000e+00 5.73418e+02 28.479  4.85986e+01 28.479  0.9877 
1 1 1 9   8   6  o 13 1.57413e+01 7.91608e-01 2.27829e+02 85.615  8.19392e-01  1.06844e+01  0.00000e+00 0.00000e+00 3.39410e+02 85.615  1.11581e+02 85.615  0.9521 
1 1 1 9   8   7  f 0  2.37742e+01 8.14492e-01 6.02117e+02 263.449 -5.73563e+00 -4.99468e+01 0.00000e+00 0.00000e+00 2.88637e+02 263.449 3.13480e+02 83.449  0.9900 
1 1 1 9   8   8  o 7  1.34216e+01 1.02915e+00 2.37055e+02 75.570  3.45808e+00  1.34393e+01  0.00000e+00 0.00000e+00 2.52187e+02 75.570  1.51318e+01 75.570  0.9633 
1 1 1 9   8   9  o 15 9.78044e+00 1.25880e+00 2.15673e+02 100.987 -2.03806e+00 1.04975e+01  0.00000e+00 0.00000e+00 1.36627e+02 100.987 7.90462e+01 280.987 0.9520 
1 1 1 9   8   10 o 10 8.75460e+00 1.66890e+00 1.69241e+02 143.636 -6.57869e+00 4.84387e+00  0.00000e+00 0.00000e+00 1.40941e+02 143.636 2.82993e+01 323.636 0.9366 
1 1 1 9   8   11 o 2  1.76042e+01 1.52322e+00 3.34989e+02 4.891   4.02204e+01  3.44164e+00  0.00000e+00 0.00000e+00 3.22454e+02 4.891   1.25348e+01 184.891 0.9875 
1 1 1 9   8   12 o 12 7.74135e+00 2.45475e+00 1.91592e+02 180.058 -7.36785e+00 -7.47796e-03 0.00000e+00 0.00000e+00 8.04104e+01 180.058 1.11181e+02 0.058   0.9294 
1 1 1 9   8   13 o 9  7.22959e+00 2.21644e+00 7.53473e+01 141.039 -2.70686e+00 2.18892e+00  0.00000e+00 0.00000e+00 1.54172e+02 141.039 7.88246e+01 141.039 0.8401 
1 1 1 9   8   14 o 14 8.70784e+00 2.12672e+00 9.44339e+01 299.032 2.86109e+00  -5.15479e+00 0.00000e+00 0.00000e+00 2.05106e+02 299.032 1.10672e+02 299.032 0.9107 
1 1 1 9   9   0  o 18 3.19478e+01 7.31350e-01 6.22365e+02 160.853 -2.97895e+01 1.03432e+01  0.00000e+00 0.00000e+00 5.66120e+02 160.853 5.62457e+01 340.852 0.9840 
1 1 1 9   9   1  o 14 3.81432e+01 9.60530e-01 9.98934e+02 108.054 -1.80553e+01 5.53917e+01  0.00000e+00 0.00000e+00 4.31124e+02 108.054 5.67810e+02 288.054 0.9914 
1 1 1 9   9   2  o 6  5.59162e+01 1.14208e+00 1.10922e+03 25.007  9.64897e+01  4.50076e+01  0.00000e+00 0.00000e+00 9.96021e+02 25.007  1.13200e+02 205.007 0.9953 
1 1 1 9   9   3  o 14 5.02089e+01 1.21392e+00 8.56111e+02 183.397 -7.15163e+01 -4.24491e+00 0.00000e+00 0.00000e+00 1.03028e+03 183.397 1.74174e+02 183.397 0.9930 
1 1 1 9   9   4  o 17 2.16807e+01 8.06770e-01 4.33529e+02 349.374 1.99448e+01  -3.74174e+00 0.00000e+00 0.00000e+00 3.66428e+02 349.374 6.71010e+01 169.374 0.9750 
1 1 1 9   9   5  o 4  2.90429e+01 7.73853e-01 4.56155e+02 211.251 -3.01236e+01 -1.82804e+01 0.00000e+00 0.00000e+00 6.27261e+02 211.251 1.71106e+02 211.251 0.9857 
1 1 1 9   9   6  o 19 1.90247e+01 7.54328e-01 4.26963e+02 65.484  1.00939e+01  2.21324e+01  0.00000e+00 0.00000e+00 2.78087e+02 65.484  1.48875e+02 245.484 0.9792 
1 1 1 9   9   7  o 4  2.40206e+01 7.98163e-01 5.03569e+02 125.260 -2.45435e+01 3.47159e+01  0.00000e+00 0.00000e+00 3.94726e+02 125.260 1.08843e+02 305.259 0.9882 
1 1 1 9   9   8  o 4  9.48155e+00 1.28103e+00 2.14563e+02 355.766 8.43631e+00  -6.24562e-01 0.00000e+00 0.00000e+00 1.22302e+02 355.766 9.22600e+01 175.766 0.9389 
1 1 1 9   9   9  o 8  2.93393e+01 9.16912e-01 4.40307e+02 327.792 6.02206e+01  -3.79347e+01 0.00000e+00 0.00000e+00 6.61921e+02 327.792 2.21614e+02 327.792 0.9929 
1 1 1 9   9   10 o 19 7.40536e+00 1.54088e+00 1.32155e+02 14.600  5.45238e+00  1.42027e+00  0.00000e+00 0.00000e+00 1.21712e+02 14.600  1.04436e+01 194.600 0.9063 
1 1 1 9   9   11 o 18 1.31733e+01 1.64545e+00 2.21626e+02 5.610   1.97067e+01  1.93580e+00  0.00000e+00 0.00000e+00 2.63793e+02 5.610   4.21670e+01 5.610   0.9744 
1 1 1 9   9   12 o 5  5.93474e+00 2.33521e+00 6.81031e+01 205.917 -1.98789e+00 -9.66000e-01 0.00000e+00 0.00000e+00 9.55491e+01 205.917 2.74460e+01 205.917 0.7294 
1 1 1 9   9   13 o 8  1.47244e+01 2.24209e+00 2.28214e+02 313.142 1.47361e+01  -1.57241e+01 0.00000e+00 0.00000e+00 3.15127e+02 313.142 8.69128e+01 313.142 0.9765 
1 1 1 9   9   14 f 0  7.52943e+00 2.09929e+00 1.37582e+02 331.839 6.65094e+00  -3.56042e+00 0.00000e+00 0.00000e+00 1.27230e+02 331.839 1.03521e+01 151.839 0.9311 
1 1 1 9   10  0  o 11 2.84790e+01 6.82293e-01 6.31730e+02 346.817 2.77843e+01  -6.50826e+00 0.00000e+00 0.00000e+00 4.25862e+02 346.817 2.05867e+02 166.817 0.9823 
1 1 1 9   10  1  o 16 3.24990e+01 8.62074e-01 4.07444e+02 225.186 -1.43209e+01 -1.44142e+01 0.00000e+00 0.00000e+00 7.90927e+02 225.186 3.83484e+02 225.186 0.9751 
1 1 1 9   10  2  o 5  1.93334e+01 6.29461e-01 3.66492e+02 151.356 -1.09810e+01 5.99808e+00  0.00000e+00 0.00000e+00 3.34971e+02 151.356 3.15211e+01 331.356 0.9592 
1 1 1 9   10  3  o 18 6.04103e+00 1.06150e+00 1.20825e+02 345.881 1.19195e+00  -2.99816e-01 0.00000e+00 0.00000e+00 1.58464e+00 165.881 1.22410e+02 165.881 0.5217 
1 1 1 9   10  4  o 19 3.34573e+01 9.29668e-01 5.15484e+02 355.003 3.67311e+01  -3.21148e+00 0.00000e+00 0.00000e+00 7.33271e+02 355.003 2.17787e+02 355.003 0.9863 
1 1 1 9   10  5  o 16 3.23537e+01 7.89207e-01 3.80411e+02 112.246 -1.23666e+01 3.02345e+01  0.00000e+00 0.00000e+00 8.25090e+02 112.246 4.44679e+02 112.246 0.9846 
1 1 1 9   10  6  o 2  2.90969e+01 7.78023e-01 5.92499e+02 263.874 -5.24994e+00 -4.89139e+01 0.00000e+00 0.00000e+00 4.97419e+02 263.874 9.50802e+01 83.874  0.9898 
1 1 1 9   10  7  o 8  3.34263e+01 8.61682e-01 5.39667e+02 102.010 -1.30873e+01 6.15189e+01  0.00000e+00 0.00000e+00 7.15209e+02 102.010 1.75542e+02 102.010 0.9920 
1 1 1 9   10  8  o 13 2.11129e+01 8.78355e-01 2.35721e+02 349.448 2.18162e+01  -4.06390e+00 0.00000e+00 0.00000e+00 5.44980e+02 349.448 3.09259e+02 349.448 0.9772 
1 1 1 9   10  9  o 19 6.39212e+00 1.48424e+00 1.01823e+02 78.007  6.52104e-01  3.06969e+00  0.00000e+00 0.00000e+00 9.64143e+01 78.007  5.40877e+00 258.007 0.8197 
1 1 1 9   10  10 o 19 1.49129e+01 1.25550e+00 2.14793e+02 354.160 2.00761e+01  -2.05328e+00 0.00000e+00 0.00000e+00 3.35143e+02 354.160 1.20350e+02 354.160 0.9749 
1 1 1 9   10  11 o 14 6.46583e+00 1.72386e+00 1.53848e+02 241.220 -3.14038e+00 -5.71706e+00 0.00000e+00 0.00000e+00 7.10464e+01 241.220 8.28015e+01 61.220  0.9198 
1 1 1 9   10  12 o 11 8.25187e+00 2.80318e+00 1.23220e+02 179.189 -4.45196e+00 6.30373e-02  0.00000e+00 0.00000e+00 1.50950e+02 179.189 2.77303e+01 179.189 0.8789 
1 1 1 9   10  13 o 17 6.63332e+00 2.04921e+00 1.30841e+02 208.575 -5.43197e+00 -2.95854e+00 0.00000e+00 0.00000e+00 9.85451e+01 208.575 3.22963e+01 28.575  0.9151 
1 1 1 9   10  14 o 10 6.29344e+00 1.95429e+00 3.82479e+01 98.089  -2.68308e-01 1.88772e+00  0.00000e+00 0.00000e+00 1.23827e+02 98.089  8.55794e+01 98.089  0.6818 
1 1 1 9   11  0  o 9  2.56887e+01 6.51752e-01 4.58949e+02 146.843 -1.53485e+01 1.00274e+01  0.00000e+00 0.00000e+00 4.85298e+02 146.843 2.63489e+01 146.843 0.9723 
1 1 1 9   11  1  o 16 3.01708e+01 8.37384e-01 7.18600e+02 2.910   3.32071e+01  1.68786e+00  0.00000e+00 0.00000e+00 4.05040e+02 2.910   3.13560e+02 182.910 0.9848 
1 1 1 9   11  2  o 6  2.40962e+01 6.63640e-01 3.96307e+02 95.429  -1.59035e+00 1.67337e+01  0.00000e+00 0.00000e+00 4.87613e+02 95.429  9.13056e+01 95.429  0.9698 
1 1 1 9   11  3  o 6  1.20846e+01 7.03398e-01 4.37515e+02 81.550  1.33411e+00  8.98010e+00  0.00000e+00 0.00000e+00 6.27387e+00 261.550 4.43789e+02 261.550 0.9432 
1 1 1 9   11  4  o 13 2.35831e+01 6.97377e-01 3.95591e+02 161.073 -1.91351e+01 6.56130e+00  0.00000e+00 0.00000e+00 4.74440e+02 161.073 7.88488e+01 161.073 0.9750 
1 1 1 9   11  5  o 9  3.63468e+01 8.31071e-01 6.35765e+02 0.309   6.10605e+01  3.28827e-01  0.00000e+00 0.00000e+00 7.28389e+02 0.309   9.26238e+01 0.309   0.9918 
1 1 1 9   11  6  o 1  1.08379e+01 9.35709e-01 2.97959e+02 51.459  5.65200e+00  7.09508e+00  0.00000e+00 0.00000e+00 8.88744e+01 51.459  2.09085e+02 231.459 0.9432 
1 1 1 9   11  7  o 8  1.58661e+01 8.97841e-01 2.26747e+02 324.236 1.01237e+01  -7.29170e+00 0.00000e+00 0.00000e+00 3.49078e+02 324.236 1.22331e+02 324.236 0.9590 
1 1 1 9   11  8  o 7  1.78697e+01 9.06533e-01 2.52663e+02 163.824 -1.92323e+01 5.57869e+00  0.00000e+00 0.00000e+00 4.06403e+02 163.824 1.53739e+02 163.824 0.9747 
1 1 1 9   11  9  o 15 1.94874e+01 9.30121e-01 2.95386e+02 288.243 9.88823e+00  -3.00000e+01 0.00000e+00 0.00000e+00 4.30113e+02 288.243 1.34727e+02 288.243 0.9840 
1 1 1 9   11  10 o 12 7.27784e+00 1.60616e+00 2.02023e+02 75.497  2.16224e+00  8.35919e+00  0.00000e+00 0.00000e+00 5.67908e+01 75.497  1.45232e+02 255.497 0.9402 
1 1 1 9   11  11 f 0  8.32057e+00 1.78556e+00 1.30194e+02 248.062 -2.58323e+00 -6.41354e+00 0.00000e+00 0.00000e+00 1.60706e+02 248.062 3.05122e+01 248.062 0.9246 
1 1 1 9   11  12 o 4  8.04414e+00 2.64512e+00 1.33727e+02 274.343 3.83999e-01  -5.05609e+00 0.00000e+00 0.00000e+00 1.38423e+02 274.343 4.69680e+00 274.343 0.8950 
1 1 1 9   11  13 o 7  8.80981e+00 2.99708e+00 1.79547e+02 214.358 -5.65981e+00 -3.86929e+00 0.00000e+00 0.00000e+00 1.28006e+02 214.358 5.15410e+01 34.358  0.9239 
1 1 1 9   11  14 o 6  1.04453e+01 2.24028e+00 2.55513e+02 200.760 -1.67738e+01 -6.35843e+00 0.00000e+00 0.00000e+00 1.27835e+02 200.760 1.27678e+02 20.760  0.9717 
1 1 1 9   12  0  o 4  2.17410e+01 6.08184e-01 5.09249e+02 330.320 1.49514e+01  -8.52117e+00 0.00000e+00 0.00000e+00 2.88355e+02 330.320 2.20894e+02 150.320 0.9705 
1 1 1 9   12  1  o 12 1.57810e+01 8.80765e-01 3.39664e+02 269.952 -8.40638e-03 -1.00484e+01 0.00000e+00 0.00000e+00 2.26567e+02 269.952 1.13097e+02 89.952  0.9489 
1 1 1 9   12  2  o 10 1.91324e+01 6.25549e-01 4.18638e+02 69.700  4.88999e+00  1.32194e+01  0.00000e+00 0.00000e+00 2.78878e+02 69.700  1.39760e+02 249.700 0.9638 
1 1 1 9   12  3  o 19 1.49527e+01 7.44617e-01 3.82269e+02 249.977 -4.10113e+00 -1.12537e+01 0.00000e+00 0.00000e+00 1.59278e+02 249.977 2.22991e+02 69.977  0.9573 
1 1 1 9   12  4  f 0  3.30626e+01 7.70931e-01 5.73455e+02 107.000 -1.22608e+01 4.01044e+01  0.00000e+00 0.00000e+00 6.62572e+02 107.000 8.91168e+01 107.000 0.9880 
1 1 1 9   12  5  o 7  1.94322e+01 7.07707e-01 3.23069e+02 252.996 -4.79304e+00 -1.56732e+01 0.00000e+00 0.00000e+00 3.89481e+02 252.996 6.64123e+01 252.996 0.9690 
1 1 1 9   12  6  o 14 1.17088e+01 9.24619e-01 2.32592e+02 307.607 4.66720e+00  -6.05902e+00 0.00000e+00 0.00000e+00 1.80425e+02 307.607 5.21664e+01 127.607 0.9321 
1 1 1 9   12  7  o 7  1.44921e+01 9.55957e-01 1.64803e+02 293.326 3.25246e+00  -7.54275e+00 0.00000e+00 0.00000e+00 3.49045e+02 293.326 1.84242e+02 293.326 0.9370 
1 1 1 9   12  8  o 1  2.16287e+01 8.70090e-01 3.96508e+02 270.861 6.06523e-01  -4.03512e+01 0.00000e+00 0.00000e+00 4.11669e+02 270.861 1.51611e+01 270.861 0.9875 
1 1 1 9   12  9  o 17 7.72178e+00 1.42389e+00 1.95327e+02 22.453  6.82056e+00  2.81862e+00  0.00000e+00 0.00000e+00 7.62208e+01 22.453  1.19106e+02 202.453 0.9295 
1 1 1 9   12  10 o 18 6.26515e+00 1.61799e+00 1.45795e+02 249.643 -1.85698e+00 -5.00470e+00 0.00000e+00 0.00000e+00 6.76380e+01 249.643 7.81573e+01 69.643  0.9007 
1 1 1 9   12  11 o 18 1.18389e+01 1.86665e+00 2.04909e+02 351.824 1.47897e+01  -2.12481e+00 0.00000e+00 0.00000e+00 2.27506e+02 351.824 2.25979e+01 351.824 0.9659 
1 1 1 9   12  12 o 12 8.63100e+00 2.50577e+00 1.08131e+02 120.004 -2.34943e+00 4.06875e+00  0.00000e+00 0.00000e+00 1.80892e+02 120.004 7.27611e+01 120.004 0.8859 
1 1 1 9   12  13 o 18 1.11779e+01 2.70844e+00 1.51967e+02 92.440  -3.62261e-01 8.50150e+00  0.00000e+00 0.00000e+00 2.44737e+02 92.440  9.27702e+01 92.440  0.9393 
1 1 1 9   12  14 f 0  5.62273e+00 1.80722e+00 8.12541e+01 296.394 1.75501e+00  -3.53631e+00 0.00000e+00 0.00000e+00 1.01689e+02 296.394 2.04344e+01 296.394 0.8615 
1 1 1 9   13  0  o 11 1.44569e+01 5.92893e-01 4.99434e+02 85.818  8.17148e-01  1.11744e+01  0.00000e+00 0.00000e+00 2.20589e+01 85.818  4.77375e+02 265.818 0.9543 
1 1 1 9   13  1  o 3  2.13231e+01 7.33294e-01 3.65294e+02 266.352 -9.34821e-01 -1.46632e+01 0.00000e+00 0.00000e+00 4.13060e+02 266.352 4.77655e+01 266.352 0.9653 
1 1 1 9   13  2  o 12 2.09465e+01 6.49940e-01 3.73193e+02 22.450  1.24194e+01  5.13148e+00  0.00000e+00 0.00000e+00 3.89002e+02 22.450  1.58096e+01 22.450  0.9620 
1 1 1 9   13  3  o 10 2.01789e+01 7.82690e-01 3.84187e+02 156.980 -1.48915e+01 6.32729e+00  0.00000e+00 0.00000e+00 3.55227e+02 156.980 2.89600e+01 336.980 0.9686 
1 1 1 9   13  4  o 9  1.81488e+01 6.87815e-01 2.37955e+02 258.181 -1.96371e+00 -9.38446e+00 0.00000e+00 0.00000e+00 4.11878e+02 258.181 1.73923e+02 258.181 0.9463 
1 1 1 9   13  5  o 9  2.17487e+01 7.00364e-01 4.25394e+02 6.525   2.39884e+01  2.74388e+00  0.00000e+00 0.00000e+00 3.80359e+02 6.525   4.50355e+01 186.525 0.9791 
1 1 1 9   13  6  o 15 2.04022e+01 7.57405e-01 2.32105e+02 37.330  1.07192e+01  8.17474e+00  0.00000e+00 0.00000e+00 5.10730e+02 37.330  2.78625e+02 37.330  0.9622 
1 1 1 9   13  7  o 4  2.31521e+01 9.80403e-01 5.04521e+02 235.410 -2.21690e+01 -3.21479e+01 0.00000e+00 0.00000e+00 3.60265e+02 235.410 1.44256e+02 55.410  0.9871 
1 1 1 9   13  8  o 5  1.20419e+01 1.15073e+00 2.75140e+02 323.019 1.18452e+01  -8.91989e+00 0.00000e+00 0.00000e+00 1.64840e+02 323.019 1.10300e+02 143.019 0.9657 
1 1 1 9   13  9  o 14 8.46878e+00 1.39277e+00 2.77170e+02 325.953 1.01385e+01  -6.85047e+00 0.00000e+00 0.00000e+00 2.98239e+01 325.953 2.47346e+02 145.953 0.9582 
1 1 1 9   13  10 o 10 1.81747e+01 1.18556e+00 2.83656e+02 202.648 -3.20808e+01 -1.33855e+01 0.00000e+00 0.00000e+00 3.93793e+02 202.648 1.10136e+02 202.648 0.9855 
1 1 1 9   13  11 o 12 6.52456e+00 1.77953e+00 1.02456e+02 113.820 -1.74157e+00 3.94497e+00  0.00000e+00 0.00000e+00 1.13298e+02 113.820 1.08423e+01 113.820 0.8745 
1 1 1 9   13  12 o 2  5.27054e+00 2.26265e+00 3.94154e+01 353.781 1.19745e+00  -1.30481e-01 0.00000e+00 0.00000e+00 6.30207e+01 353.781 2.36052e+01 353.781 0.5142 
1 1 1 9   13  13 o 4  1.54984e+01 2.36756e+00 2.56314e+02 154.576 -2.10228e+01 9.99296e+00  0.00000e+00 0.00000e+00 3.16552e+02 154.576 6.02383e+01 154.576 0.9783 
1 1 1 9   13  14 o 12 7.88961e+00 2.08948e+00 1.02976e+02 330.998 5.20387e+00  -2.88476e+00 0.00000e+00 0.00000e+00 1.68638e+02 330.998 6.56626e+01 330.998 0.9116 
1 1 1 9   14  0  o 10 2.48557e+01 6.46587e-01 5.36744e+02 146.296 -1.71495e+01 1.14390e+01  0.00000e+00 0.00000e+00 3.79705e+02 146.296 1.57040e+02 326.296 0.9754 
1 1 1 9   14  1  o 17 1.13639e+01 6.34519e-01 2.07575e+02 318.645 3.34819e+00  -2.94713e+00 0.00000e+00 0.00000e+00 1.70189e+02 318.645 3.73860e+01 138.645 0.8792 
1 1 1 9   14  2  o 15 5.66264e+01 1.15742e+00 1.17221e+03 311.595 7.33899e+01  -8.26764e+01 0.00000e+00 0.00000e+00 9.59810e+02 311.595 2.12398e+02 131.595 0.9955 
1 1 1 9   14  3  o 2  4.34858e+01 8.99610e-01 7.58078e+02 129.799 -4.36215e+01 5.23586e+01  0.00000e+00 0.00000e+00 8.74877e+02 129.799 1.16799e+02 129.799 0.9926 
1 1 1 9   14  4  o 4  1.60240e+01 6.84825e-01 3.30021e+02 199.330 -1.10645e+01 -3.88124e+00 0.00000e+00 0.00000e+00 2.49798e+02 199.330 8.02232e+01 19.330  0.9564 
1 1 1 9   14  5  o 12 2.59015e+01 7.26556e-01 5.54514e+02 227.649 -2.51816e+01 -2.76247e+01 0.00000e+00 0.00000e+00 4.12370e+02 227.649 1.42145e+02 47.649  0.9865 
1 1 1 9   14  6  o 19 3.97370e+01 8.93845e-01 5.69657e+02 250.780 -2.35200e+01 -6.74639e+01 0.00000e+00 0.00000e+00 9.23430e+02 250.780 3.53773e+02 250.780 0.9930 
1 1 1 9   14  7  o 17 1.25654e+01 9.61494e-01 3.56966e+02 183.540 -1.49843e+01 -9.27101e-01 0.00000e+00 0.00000e+00 1.02375e+02 183.540 2.54592e+02 3.540   0.9661 
1 1 1 9   14  8  o 2  1.09204e+01 1.17463e+00 2.09527e+02 352.700 1.00999e+01  -1.29385e+00 0.00000e+00 0.00000e+00 1.82802e+02 352.700 2.67247e+01 172.700 0.9495 
1 1 1 9   14  9  o 9  2.34490e+01 1.04644e+00 4.47315e+02 123.344 -3.27459e+01 4.97677e+01  0.00000e+00 0.00000e+00 4.32265e+02 123.344 1.50504e+01 303.344 0.9916 
1 1 1 9   14  10 o 18 7.32343e+00 1.69587e+00 1.56747e+02 304.011 3.86536e+00  -5.72827e+00 0.00000e+00 0.00000e+00 9.93248e+01 304.011 5.74219e+01 124.011 0.9245 
1 1 1 9   14  11 o 17 5.15171e+00 1.53155e+00 4.01429e+01 254.747 -3.89838e-01 -1.42963e+00 0.00000e+00 0.00000e+00 7.50954e+01 254.747 3.49525e+01 254.747 0.5916 
1 1 1 9   14  12 o 8  8.96867e+00 2.52640e+00 1.57959e+02 332.428 6.39392e+00  -3.33861e+00 0.00000e+00 0.00000e+00 1.56572e+02 332.428 1.38768e+00 152.429 0.9278 
1 1 1 9   14  13 o 19 5.21295e+00 1.63134e+00 1.30816e+02 342.845 5.66147e+00  -1.74765e+00 0.00000e+00 0.00000e+00 4.86474e+01 342.845 8.21687e+01 162.845 0.9112 
1 1 1 9   14  14 o 8  6.82491e+00 1.97642e+00 1.26998e+02 285.400 1.79934e+00  -6.53255e+00 0.00000e+00 0.00000e+00 1.10883e+02 285.400 1.61150e+01 105.400 0.9229 
1 1 1 9   15  0  o 15 1.00812e+01 6.52852e-01 2.41533e+02 190.201 -4.54286e+00 -8.17504e-01 0.00000e+00 0.00000e+00 9.51737e+01 190.201 1.46360e+02 10.201  0.8836 
1 1 1 9   15  1  o 11 2.12308e+01 6.30283e-01 4.50006e+02 126.827 -1.01164e+01 1.35094e+01  0.00000e+00 0.00000e+00 3.28578e+02 126.827 1.21427e+02 306.827 0.9699 
1 1 1 9   15  2  o 6  8.78445e+00 7.33350e-01 1.30619e+02 183.647 -1.95175e+00 -1.24415e-01 0.00000e+00 0.00000e+00 9.87429e+01 183.647 3.18764e+01 3.647   0.6904 
1 1 1 9   15  3  f 0  5.30739e+01 1.04748e+00 1.12957e+03 177.058 -1.22355e+02 6.28912e+00  0.00000e+00 0.00000e+00 8.69929e+02 177.058 2.59638e+02 357.058 0.9959 
1 1 1 9   15  4  o 1  1.43677e+01 6.91138e-01 1.70298e+02 295.080 2.53955e+00  -5.42636e+00 0.00000e+00 0.00000e+00 3.25577e+02 295.080 1.55279e+02 295.080 0.9122 
1 1 1 9   15  5  o 13 2.00970e+01 7.08835e-01 4.50736e+02 323.142 1.88683e+01  -1.41450e+01 0.00000e+00 0.00000e+00 2.93380e+02 323.142 1.57356e+02 143.142 0.9786 
1 1 1 9   15  6  o 19 1.47706e+01 8.32183e-01 2.27503e+02 128.706 -6.66404e+00 8.31631e+00  0.00000e+00 0.00000e+00 3.04489e+02 128.706 7.69862e+01 128.706 0.9519 
1 1 1 9   15  7  o 19 1.42943e+01 9.24320e-01 3.21748e+02 63.934  6.78571e+00  1.38722e+01  0.00000e+00 0.00000e+00 2.01290e+02 63.934  1.20458e+02 243.934 0.9671 
1 1 1 9   15  8  o 14 1.51651e+01 9.81299e-01 1.51291e+02 228.978 -6.80269e+00 -7.81965e+00 0.00000e+00 0.00000e+00 3.94036e+02 228.978 2.42746e+02 228.978 0.9505 
1 1 1 9   15  9  f 0  1.44363e+01 1.25323e+00 3.22969e+02 220.265 -1.92013e+01 -1.62639e+01 0.00000e+00 0.00000e+00 2.12160e+02 220.265 1.10809e+02 40.265  0.9799 
1 1 1 9   15  10 o 5  1.08478e+01 1.57875e+00 2.54065e+02 130.863 -1.13385e+01 1.31066e+01  0.00000e+00 0.00000e+00 1.44175e+02 130.863 1.09890e+02 310.863 0.9707 
1 1 1 9   15  11 o 6  5.21295e+00 2.19339e+00 1.30431e+02 295.557 1.57502e+00  -3.29366e+00 0.00000e+00 0.00000e+00 3.68266e+01 295.557 9.36044e+01 115.557 0.8486 
1 1 1 9   15  12 f 0  6.64795e+00 2.41113e+00 1.82524e+02 271.399 1.59549e-01  -6.53152e+00 0.00000e+00 0.00000e+00 4.86212e+01 271.399 1.33903e+02 91.399  0.9199 
1 1 1 9   15  13 o 8  5.93412e+00 1.78830e+00 1.07321e+02 36.014  4.11152e+00  2.98869e+00  0.00000e+00 0.00000e+00 9.33957e+01 36.014  1.39251e+01 216.014 0.8953 
1 1 1 9   15  14 o 4  5.86587e+00 1.80683e+00 7.08774e+01 2.066   3.67465e+00  1.32558e-01  0.00000e+00 0.00000e+00 1.17376e+02 2.066   4.64981e+01 2.066   0.8498 
1 1 1 9   16  0  f 0  1.96331e+01 6.05302e-01 2.91487e+02 22.662  1.00047e+01  4.17738e+00  0.00000e+00 0.00000e+00 4.15472e+02 22.662  1.23985e+02 22.662  0.9527 
1 1 1 9   16  1  f 0  1.83791e+01 5.92557e-01 2.67967e+02 6.572   8.63374e+00  9.94623e-01  0.00000e+00 0.00000e+00 3.85631e+02 6.572   1.17665e+02 6.572   0.9406 
1 1 1 9   16  2  o 2  2.66371e+01 6.70563e-01 4.11898e+02 346.000 1.83443e+01  -4.57385e+00 0.00000e+00 0.00000e+00 5.68474e+02 346.000 1.56576e+02 346.000 0.9732 
1 1 1 9   16  3  f 0  2.43704e+01 6.76958e-01 3.72186e+02 346.840 1.84712e+01  -4.31863e+00 0.00000e+00 0.00000e+00 5.25033e+02 346.840 1.52847e+02 346.840 0.9733 
1 1 1 9   16  4  o 6  2.61260e+01 7.05964e-01 3.71130e+02 77.437  5.14957e+00  2.31070e+01  0.00000e+00 0.00000e+00 5.96178e+02 77.437  2.25047e+02 77.437  0.9786 
1 1 1 9   16  5  o 11 4.30296e+01 9.17263e-01 8.03094e+02 270.245 3.97390e-01  -9.29972e+01 0.00000e+00 0.00000e+00 8.16189e+02 270.245 1.30952e+01 270.245 0.9946 
1 1 1 9   16  6  o 1  2.95200e+01 8.02140e-01 4.44698e+02 32.644  3.50994e+01  2.24852e+01  0.00000e+00 0.00000e+00 6.58765e+02 32.644  2.14068e+02 32.644  0.9879 
1 1 1 9   16  7  o 4  2.34915e+01 8.15788e-01 3.55655e+02 238.320 -1.68961e+01 -2.73782e+01 0.00000e+00 0.00000e+00 5.19234e+02 238.320 1.63578e+02 238.320 0.9843 
1 1 1 9   16  8  o 13 2.07210e+01 8.62449e-01 3.95067e+02 6.445   3.73839e+01  4.22281e+00  0.00000e+00 0.00000e+00 3.78360e+02 6.445   1.67065e+01 186.445 0.9866 
1 1 1 9   16  9  o 12 8.09033e+00 1.46052e+00 2.28619e+02 148.363 -8.18068e+00 5.04001e+00  0.00000e+00 0.00000e+00 6.10147e+01 148.363 1.67605e+02 328.363 0.9464 
1 1 1 9   16  10 o 8  1.56957e+01 1.32504e+00 2.83914e+02 348.304 3.00369e+01  -6.21837e+00 0.00000e+00 0.00000e+00 2.99903e+02 348.304 1.59893e+01 348.304 0.9836 
1 1 1 9   16  11 f 0  1.26797e+01 2.00094e+00 3.42762e+02 308.510 1.58454e+01  -1.99130e+01 0.00000e+00 0.00000e+00 1.27108e+02 308.510 2.15654e+02 128.510 0.9802 
1 1 1 9   16  12 o 18 5.31703e+00 2.29763e+00 1.40613e+02 161.170 -4.13549e+00 1.41026e+00  0.00000e+00 0.00000e+00 3.54947e+01 161.170 1.05119e+02 341.170 0.8764 
1 1 1 9   16  13 o 2  1.06848e+01 1.93040e+00 2.00582e+02 24.797  1.46672e+01  6.77629e+00  0.00000e+00 0.00000e+00 1.90381e+02 24.797  1.02015e+01 204.797 0.9685 
1 1 1 9   17  0  o 19 3.34063e+01 7.25580e-01 4.82438e+02 104.954 -7.31648e+00 2.73935e+01  0.00000e+00 0.00000e+00 7.57665e+02 104.954 2.75227e+02 104.954 0.9822 
1 1 1 9   17  1  o 6  1.90799e+01 5.96306e-01 4.24188e+02 356.582 1.42159e+01  -8.49074e-01 0.00000e+00 0.00000e+00 2.71359e+02 356.582 1.52829e+02 176.582 0.9642 
1 1 1 9   17  2  o 1  1.03622e+01 6.98911e-01 2.07688e+02 188.714 -3.65603e+00 -5.60374e-01 0.00000e+00 0.00000e+00 1.25732e+02 188.714 8.19566e+01 8.714   0.8508 
1 1 1 9   17  3  o 9  2.25086e+01 7.38152e-01 3.71048e+02 265.441 -1.38085e+00 -1.73174e+01 0.00000e+00 0.00000e+00 4.55465e+02 265.441 8.44173e+01 265.441 0.9708 
1 1 1 9   17  4  f 0  3.01213e+01 7.39618e-01 4.56818e+02 106.282 -9.37916e+00 3.21118e+01  0.00000e+00 0.00000e+00 6.65531e+02 106.282 2.08713e+02 106.282 0.9849 
1 1 1 9   17  5  o 11 2.77592e+01 7.56287e-01 4.37817e+02 36.754  2.65334e+01  1.98162e+01  0.00000e+00 0.00000e+00 5.96447e+02 36.754  1.58629e+02 36.754  0.9848 
1 1 1 9   17  6  o 8  1.93256e+01 7.88214e-01 3.62308e+02 221.301 -1.61879e+01 -1.42221e+01 0.00000e+00 0.00000e+00 3.51707e+02 221.301 1.06014e+01 41.301  0.9765 
1 1 1 9   17  7  o 1  4.61321e+01 1.01174e+00 7.44079e+02 64.330  5.57177e+01  1.15929e+02  0.00000e+00 0.00000e+00 9.94478e+02 64.330  2.50399e+02 64.330  0.9961 
1 1 1 9   17  8  o 7  2.46605e+01 8.56023e-01 3.58847e+02 321.183 3.16600e+01  -2.54710e+01 0.00000e+00 0.00000e+00 5.62512e+02 321.183 2.03665e+02 321.183 0.9876 
1 1 1 9   17  9  o 9  1.27744e+01 1.29193e+00 2.05415e+02 254.573 -3.79457e+00 -1.37508e+01 0.00000e+00 0.00000e+00 2.60512e+02 254.573 5.50974e+01 254.573 0.9643 
1 1 1 9   17  10 o 1  2.15044e+01 1.15639e+00 3.37477e+02 348.130 4.92450e+01  -1.03510e+01 0.00000e+00 0.00000e+00 4.67615e+02 348.130 1.30138e+02 348.130 0.9900 
1 1 1 9   17  11 f 0  5.29224e+00 2.19202e+00 2.34384e+02 134.658 -4.68621e+00 4.74255e+00  0.00000e+00 0.00000e+00 4.99901e+01 314.658 2.84374e+02 314.658 0.9216 
1 1 1 9   17  12 o 7  4.34308e+00 1.98599e+00 7.13922e+01 270.653 2.41947e-02  -2.12440e+00 0.00000e+00 0.00000e+00 4.63268e+01 270.653 2.50653e+01 90.652  0.7172 
1 1 1 9   17  13 o 12 7.61401e+00 1.91255e+00 2.64476e+02 42.917  1.12224e+01  1.04346e+01  0.00000e+00 0.00000e+00 1.36122e+01 42.917  2.50864e+02 222.917 0.9668 
1 1 1 9   18  0  o 16 4.40632e+01 8.82880e-01 8.05058e+02 235.191 -3.52255e+01 -5.06651e+01 0.00000e+00 0.00000e+00 8.46655e+02 235.191 4.15977e+01 235.191 0.9919 
1 1 1 9   18  1  o 2  3.16974e+01 7.17348e-01 4.25588e+02 354.345 2.29576e+01  -2.27311e+00 0.00000e+00 0.00000e+00 7.46472e+02 354.345 3.20885e+02 354.345 0.9781 
1 1 1 9   18  2  f 0  1.00263e+01 7.24376e-01 2.04038e+02 99.964  -6.06823e-01 3.45417e+00  0.00000e+00 0.00000e+00 1.15006e+02 99.964  8.90318e+01 279.964 0.8415 
1 1 1 9   18  3  o 16 1.32316e+01 1.07088e+00 2.31387e+02 183.721 -6.46938e+00 -4.20784e-01 0.00000e+00 0.00000e+00 2.28673e+02 183.721 2.71342e+00 3.721   0.9193 
1 1 1 9   18  4  o 4  1.52865e+01 7.16853e-01 2.16504e+02 120.994 -4.09291e+00 6.81327e+00  0.00000e+00 0.00000e+00 3.24064e+02 120.994 1.07560e+02 120.994 0.9348 
1 1 1 9   18  5  o 16 4.62098e+01 9.63611e-01 7.62654e+02 303.715 5.35665e+01  -8.02731e+01 0.00000e+00 0.00000e+00 9.76488e+02 303.715 2.13834e+02 303.715 0.9948 
1 1 1 9   18  6  o 4  4.74299e+01 1.00208e+00 8.46320e+02 205.795 -1.08610e+02 -5.24926e+01 0.00000e+00 0.00000e+00 9.40659e+02 205.795 9.43387e+01 205.795 0.9958 
1 1 1 9   18  7  f 0  2.41181e+01 8.07797e-01 4.51338e+02 36.347  3.70465e+01  2.72606e+01  0.00000e+00 0.00000e+00 4.51125e+02 36.347  2.12306e-01 216.347 0.9891 
1 1 1 9   18  8  o 14 1.93981e+01 8.89496e-01 3.15550e+02 48.127  2.00147e+01  2.23279e+01  0.00000e+00 0.00000e+00 4.05907e+02 48.127  9.03568e+01 48.127  0.9832 
1 1 1 9   18  9  o 17 1.25866e+01 1.29023e+00 2.68637e+02 0.070   1.99444e+01  2.42120e-02  0.00000e+00 0.00000e+00 1.95327e+02 0.070   7.33101e+01 180.070 0.9746 
1 1 1 9   18  10 o 9  7.17360e+00 1.68550e+00 1.55170e+02 151.647 -5.66748e+00 3.05844e+00  0.00000e+00 0.00000e+00 9.40391e+01 151.647 6.11310e+01 331.647 0.9187 
1 1 1 9   18  11 o 16 7.83202e+00 2.47327e+00 7.00368e+01 309.825 1.66518e+00  -1.99683e+00 0.00000e+00 0.00000e+00 1.59559e+02 309.825 8.95222e+01 309.825 0.7755 
1 1 1 9   18  12 o 7  9.22721e+00 2.41219e+00 7.59812e+01 180.498 -3.94129e+00 -3.42580e-02 0.00000e+00 0.00000e+00 2.24334e+02 180.498 1.48353e+02 180.498 0.8612 
1 1 1 9   18  13 o 6  5.49007e+00 1.65620e+00 4.02651e+01 230.113 -1.24139e+00 -1.48536e+00 0.00000e+00 0.00000e+00 1.02201e+02 230.113 6.19363e+01 230.113 0.6869 
1 1 1 9   19  0  o 10 1.86486e+01 7.45631e-01 1.43226e+02 9.359   4.60440e+00  7.58828e-01  0.00000e+00 0.00000e+00 4.80490e+02 9.359   3.37263e+02 9.359   0.8850 
1 1 1 9   19  1  o 18 3.31744e+01 7.73449e-01 3.88923e+02 86.894  1.18844e+00  2.19044e+01  0.00000e+00 0.00000e+00 8.36252e+02 86.894  4.47330e+02 86.894  0.9769 
1 1 1 9   19  2  o 7  1.27335e+01 6.72361e-01 2.92464e+02 144.229 -6.34623e+00 4.57214e+00  0.00000e+00 0.00000e+00 1.57108e+02 144.229 1.35355e+02 324.229 0.9337 
1 1 1 9   19  3  o 19 3.60160e+01 9.30173e-01 6.68016e+02 320.235 3.95186e+01  -3.28851e+01 0.00000e+00 0.00000e+00 6.80848e+02 320.235 1.28319e+01 320.235 0.9902 
1 1 1 9   19  4  o 17 9.62533e+00 9.11536e-01 4.56959e+02 48.058  6.94848e+00  7.73279e+00  0.00000e+00 0.00000e+00 1.10842e+02 228.058 5.67801e+02 228.058 0.9506 
1 1 1 9   19  5  o 13 2.21566e+01 7.22169e-01 3.59456e+02 219.707 -1.71089e+01 -1.42075e+01 0.00000e+00 0.00000e+00 4.59670e+02 219.707 1.00214e+02 219.707 0.9773 
1 1 1 9   19  6  o 18 2.18625e+01 7.74697e-01 3.75690e+02 90.415  -1.89042e-01 2.60715e+01  0.00000e+00 0.00000e+00 4.35379e+02 90.415  5.96886e+01 90.415  0.9806 
1 1 1 9   19  7  o 5  5.04481e+00 1.32069e+00 1.61607e+02 175.780 -3.15414e+00 2.32717e-01  0.00000e+00 0.00000e+00 4.85969e+00 355.780 1.66467e+02 355.780 0.8213 
1 1 1 9   19  8  o 16 2.38296e+01 8.69197e-01 4.70932e+02 317.321 4.04616e+01  -3.73095e+01 0.00000e+00 0.00000e+00 4.22230e+02 317.321 4.87013e+01 137.321 0.9909 
1 1 1 9   19  9  o 11 9.30892e+00 1.55951e+00 8.55750e+01 270.984 7.42321e-02  -4.32199e+00 0.00000e+00 0.00000e+00 2.22441e+02 270.984 1.36866e+02 270.984 0.8749 
1 1 1 9   19  10 o 6  1.06170e+01 1.62922e+00 1.31363e+02 285.163 2.29828e+00  -8.48096e+00 0.00000e+00 0.00000e+00 2.46505e+02 285.163 1.15142e+02 285.163 0.9412 
1 1 1 9   19  11 o 2  5.40029e+00 2.21967e+00 1.12591e+02 21.597  3.16960e+00  1.25472e+00  0.00000e+00 0.00000e+00 5.81112e+01 21.597  5.44801e+01 201.597 0.8362 
1 1 1 9   19  12 o 19 4.68691e+00 2.10493e+00 3.78913e+01 215.603 -9.51715e-01 -6.81450e-01 0.00000e+00 0.00000e+00 5.12957e+01 215.603 1.34044e+01 215.603 0.5036 
1 1 1 9   19  13 o 12 5.86323e+00 1.71781e+00 9.05729e+01 174.082 -4.62999e+00 4.79916e-01  0.00000e+00 0.00000e+00 1.05369e+02 174.082 1.47965e+01 174.082 0.8847 
1 1 1 9   20  0  o 1  1.59288e+01 5.87286e-01 1.73526e+02 13.661  4.61472e+00  1.12165e+00  0.00000e+00 0.00000e+00 3.60515e+02 13.661  1.86988e+02 13.661  0.8872 
1 1 1 9   20  1  o 4  2.39104e+01 7.48052e-01 1.75637e+02 33.822  5.98547e+00  4.01021e+00  0.00000e+00 0.00000e+00 6.62904e+02 33.822  4.87267e+02 33.822  0.9278 
1 1 1 9   20  2  o 13 3.19186e+01 7.29261e-01 5.25726e+02 215.791 -2.84231e+01 -2.04928e+01 0.00000e+00 0.00000e+00 6.63815e+02 215.791 1.38090e+02 215.791 0.9856 
1 1 1 9   20  3  o 19 3.95281e+01 1.46330e+00 6.48682e+02 322.952 4.25082e+01  -3.20883e+01 0.00000e+00 0.00000e+00 8.32146e+02 322.952 1.83464e+02 322.952 0.9906 
1 1 1 9   20  4  o 19 3.10005e+01 7.62313e-01 5.29225e+02 352.788 4.33211e+01  -5.48189e+00 0.00000e+00 0.00000e+00 6.29863e+02 352.788 1.00637e+02 352.788 0.9885 
1 1 1 9   20  5  o 11 3.69302e+01 8.42270e-01 7.34304e+02 109.826 -2.74254e+01 7.60696e+01  0.00000e+00 0.00000e+00 6.54040e+02 109.826 8.02642e+01 289.826 0.9938 
1 1 1 9   20  6  o 19 1.21312e+01 9.30994e-01 2.24482e+02 226.267 -5.86820e+00 -6.13361e+00 0.00000e+00 0.00000e+00 2.06489e+02 226.267 1.79930e+01 46.267  0.9391 
1 1 1 9   20  7  o 5  7.97481e+00 1.23407e+00 1.66453e+02 358.573 5.22283e+00  -1.30128e-01 0.00000e+00 0.00000e+00 1.04551e+02 358.573 6.19025e+01 178.573 0.8983 
1 1 1 9   20  8  o 16 2.90476e+01 9.89313e-01 4.46965e+02 347.310 6.51366e+01  -1.46668e+01 0.00000e+00 0.00000e+00 6.43486e+02 347.310 1.96520e+02 347.310 0.9925 
1 1 1 9   20  9  o 7  1.71359e+01 1.15265e+00 3.92422e+02 325.285 3.37702e+01  -2.33964e+01 0.00000e+00 0.00000e+00 2.47697e+02 325.285 1.44724e+02 145.285 0.9878 
1 1 1 9   20  10 o 3  1.03530e+01 1.52045e+00 1.71944e+02 157.777 -1.08108e+01 4.41694e+00  0.00000e+00 0.00000e+00 2.02350e+02 157.777 3.04059e+01 157.777 0.9562 
1 1 1 9   20  11 o 11 1.18277e+01 2.28333e+00 2.12920e+02 36.859  1.09567e+01  8.21421e+00  0.00000e+00 0.00000e+00 2.17517e+02 36.859  4.59738e+00 36.859  0.9628 
1 1 1 9   20  12 o 16 6.64911e+00 1.72268e+00 1.14306e+02 49.502  3.97567e+00  4.65525e+00  0.00000e+00 0.00000e+00 1.15389e+02 49.502  1.08355e+00 49.502  0.9142 
1 1 1 9   20  13 o 10 4.97686e+00 1.56415e+00 2.81282e+01 214.717 -1.09995e+00 -7.62114e-01 0.00000e+00 0.00000e+00 7.59231e+01 214.717 4.77949e+01 214.717 0.5535 
1 1 1 9   21  0  o 10 3.74762e+01 7.82419e-01 1.00254e+03 299.813 3.17086e+01  -5.53378e+01 0.00000e+00 0.00000e+00 4.02406e+02 299.813 6.00138e+02 119.813 0.9921 
1 1 1 9   21  1  o 15 2.74012e+01 6.67445e-01 4.05632e+02 53.979  1.12371e+01  1.54544e+01  0.00000e+00 0.00000e+00 6.02631e+02 53.979  1.97000e+02 53.979  0.9735 
1 1 1 9   21  2  f 0  3.65999e+01 7.98140e-01 8.32853e+02 302.552 3.40723e+01  -5.33763e+01 0.00000e+00 0.00000e+00 5.39996e+02 302.552 2.92856e+02 122.552 0.9921 
1 1 1 9   21  3  o 16 1.90726e+01 7.81558e-01 3.20378e+02 222.114 -9.99510e+00 -9.03566e+00 0.00000e+00 0.00000e+00 3.73593e+02 222.114 5.32147e+01 222.114 0.9621 
1 1 1 9   21  4  o 1  3.23210e+01 7.67932e-01 5.76531e+02 123.067 -2.69953e+01 4.14628e+01  0.00000e+00 0.00000e+00 6.33524e+02 123.067 5.69934e+01 123.067 0.9898 
1 1 1 9   21  5  o 10 1.92030e+01 8.39665e-01 2.68789e+02 5.382   1.52895e+01  1.44033e+00  0.00000e+00 0.00000e+00 4.33525e+02 5.382   1.64736e+02 5.382   0.9669 
1 1 1 9   21  6  o 15 2.83447e+01 7.90778e-01 4.21344e+02 133.933 -2.70461e+01 2.80725e+01  0.00000e+00 0.00000e+00 6.37013e+02 133.933 2.15668e+02 133.933 0.9871 
1 1 1 9   21  7  o 12 2.35920e+01 8.23391e-01 3.81406e+02 319.307 2.85680e+01  -2.45667e+01 0.00000e+00 0.00000e+00 4.99062e+02 319.307 1.17655e+02 319.307 0.9866 
1 1 1 9   21  8  o 17 1.01892e+01 1.36582e+00 2.14158e+02 108.545 -3.27989e+00 9.77719e+00  0.00000e+00 0.00000e+00 1.52030e+02 108.545 6.21283e+01 288.545 0.9502 
1 1 1 9   21  9  o 2  1.05541e+01 1.47097e+00 1.39537e+02 217.403 -6.69942e+00 -5.12267e+00 0.00000e+00 0.00000e+00 2.35113e+02 217.403 9.55761e+01 217.403 0.9387 
1 1 1 9   21  10 o 14 1.20985e+01 1.75059e+00 1.60343e+02 32.639  9.79024e+00  6.27054e+00  0.00000e+00 0.00000e+00 2.76942e+02 32.639  1.16599e+02 32.639  0.9560 
1 1 1 9   21  11 o 14 1.51433e+01 1.82130e+00 2.68278e+02 19.831  2.55355e+01  9.20919e+00  0.00000e+00 0.00000e+00 2.93460e+02 19.831  2.51811e+01 19.831  0.9814 
1 1 1 9   21  12 f 0  7.61242e+00 1.76441e+00 2.53086e+02 194.698 -1.46695e+01 -3.84796e+00 0.00000e+00 0.00000e+00 2.48966e+01 194.698 2.28190e+02 14.698  0.9664 
1 1 1 9   21  13 o 10 5.67491e+00 1.63134e+00 3.62948e+01 221.074 -1.40766e+00 -1.22684e+00 0.00000e+00 0.00000e+00 1.08325e+02 221.074 7.20303e+01 221.074 0.6747 
1 1 1 9   22  0  o 3  2.08405e+01 7.56598e-01 3.20957e+02 304.170 6.43652e+00  -9.48159e+00 0.00000e+00 0.00000e+00 4.31303e+02 304.170 1.10347e+02 304.170 0.9553 
1 1 1 9   22  1  o 3  2.04382e+01 6.15949e-01 3.19574e+02 208.172 -1.21327e+01 -6.49776e+00 0.00000e+00 0.00000e+00 4.24312e+02 208.172 1.04738e+02 208.172 0.9630 
1 1 1 9   22  2  o 9  3.16716e+01 8.49389e-01 4.50446e+02 205.672 -2.65544e+01 -1.27638e+01 0.00000e+00 0.00000e+00 7.26468e+02 205.672 2.76022e+02 205.672 0.9829 
1 1 1 9   22  3  o 9  3.83131e+01 9.85976e-01 6.13998e+02 185.095 -5.60723e+01 -4.99917e+00 0.00000e+00 0.00000e+00 8.21888e+02 185.095 2.07890e+02 185.095 0.9911 
1 1 1 9   22  4  o 7  2.18170e+01 7.72814e-01 4.09595e+02 307.754 1.42017e+01  -1.83393e+01 0.00000e+00 0.00000e+00 3.97552e+02 307.754 1.20435e+01 127.754 0.9782 
1 1 1 9   22  5  o 12 1.96653e+01 8.62878e-01 4.61346e+02 312.642 1.74025e+01  -1.88970e+01 0.00000e+00 0.00000e+00 2.67850e+02 312.642 1.93496e+02 132.642 0.9803 
1 1 1 9   22  6  o 2  3.16281e+01 8.20515e-01 5.93124e+02 72.878  1.79337e+01  5.82154e+01  0.00000e+00 0.00000e+00 5.93349e+02 72.878  2.25087e-01 72.878  0.9918 
1 1 1 9   22  7  o 5  6.62236e+00 1.39071e+00 2.05300e+02 30.337  4.45996e+00  2.61003e+00  0.00000e+00 0.00000e+00 1.94145e+01 30.337  1.85886e+02 210.337 0.8971 
1 1 1 9   22  8  o 4  1.57434e+01 1.11777e+00 2.42099e+02 229.667 -1.34673e+01 -1.58615e+01 0.00000e+00 0.00000e+00 3.38831e+02 229.667 9.67310e+01 229.667 0.9757 
1 1 1 9   22  9  o 15 4.07058e+00 1.32085e+00 6.33434e+01 50.518  9.82111e-01  1.19217e+00  0.00000e+00 0.00000e+00 3.00846e+01 50.518  3.32588e+01 230.518 0.6070 
1 1 1 9   22  10 o 15 1.23782e+01 1.60047e+00 2.75305e+02 346.735 2.12911e+01  -5.01918e+00 0.00000e+00 0.00000e+00 1.81841e+02 346.735 9.34636e+01 166.735 0.9769 
1 1 1 9   22  11 o 1  8.05650e+00 2.54333e+00 9.43954e+01 311.348 2.39988e+00  -2.72709e+00 0.00000e+00 0.00000e+00 1.63742e+02 311.348 6.93465e+01 311.348 0.8477 
1 1 1 9   22  12 o 6  5.76378e+00 1.59926e+00 1.09940e+02 250.320 -1.83011e+00 -5.11695e+00 0.00000e+00 0.00000e+00 8.66126e+01 250.320 2.33273e+01 70.320  0.9026 
1 1 1 9   22  13 o 7  5.17839e+00 1.62413e+00 9.42030e+01 53.037  2.66852e+00  3.54595e+00  0.00000e+00 0.00000e+00 7.76043e+01 53.037  1.65987e+01 233.037 0.8785 
1 1 1 9   23  0  o 11 3.10264e+01 6.97443e-01 6.18106e+02 188.410 -3.25368e+01 -4.81070e+00 0.00000e+00 0.00000e+00 5.36173e+02 188.410 8.19330e+01 8.410   0.9847 
1 1 1 9   23  1  o 16 3.27316e+01 7.31963e-01 4.52304e+02 316.056 2.22545e+01  -2.14489e+01 0.00000e+00 0.00000e+00 7.64592e+02 316.056 3.12288e+02 316.056 0.9837 
1 1 1 9   23  2  o 14 4.78449e+00 1.02692e+00 2.43485e+01 177.905 -2.47219e-01 9.04459e-03  0.00000e+00 0.00000e+00 2.14493e+00 357.905 2.64935e+01 357.905 0.1228 
1 1 1 9   23  3  o 13 2.41332e+01 6.81297e-01 3.99450e+02 111.809 -8.74783e+00 2.18609e+01  0.00000e+00 0.00000e+00 4.93498e+02 111.809 9.40486e+01 111.809 0.9785 
1 1 1 9   23  4  o 7  2.59012e+01 7.10962e-01 5.08467e+02 329.769 2.96237e+01  -1.72630e+01 0.00000e+00 0.00000e+00 4.56680e+02 329.769 5.17862e+01 149.769 0.9853 
1 1 1 9   23  5  o 3  2.14622e+01 8.96015e-01 3.48545e+02 171.592 -2.08336e+01 3.07953e+00  0.00000e+00 0.00000e+00 4.43679e+02 171.592 9.51337e+01 171.592 0.9760 
1 1 1 9   23  6  f 0  1.34698e+01 9.27672e-01 1.41950e+02 358.669 6.61835e+00  -1.53713e-01 0.00000e+00 0.00000e+00 3.27282e+02 358.669 1.85333e+02 358.669 0.9210 
1 1 1 9   23  7  f 0  8.65822e+00 1.23522e+00 1.70013e+02 218.111 -4.66367e+00 -3.65829e+00 0.00000e+00 0.00000e+00 1.28379e+02 218.111 4.16342e+01 38.111  0.9112 
1 1 1 9   23  8  o 16 1.45967e+01 1.14906e+00 3.68108e+02 274.495 2.27784e+00  -2.89751e+01 0.00000e+00 0.00000e+00 1.74325e+02 274.495 1.93783e+02 94.495  0.9826 
1 1 1 9   23  9  o 11 2.52544e+01 1.07699e+00 3.88505e+02 36.559  5.30863e+01  3.93665e+01  0.00000e+00 0.00000e+00 5.59158e+02 36.559  1.70653e+02 36.559  0.9924 
1 1 1 9   23  10 o 4  7.48476e+00 1.79843e+00 1.77426e+02 112.377 -3.10641e+00 7.54539e+00  0.00000e+00 0.00000e+00 8.75732e+01 112.377 8.98529e+01 292.377 0.9366 
1 1 1 9   23  11 o 12 4.76256e+00 2.06795e+00 6.40225e+01 198.079 -1.77119e+00 -5.78206e-01 0.00000e+00 0.00000e+00 5.72877e+01 198.079 6.73478e+00 18.079  0.6740 
1 1 1 9   23  12 o 12 3.61566e+00 1.25630e+00 9.45167e+01 309.635 2.12252e+00  -2.56249e+00 0.00000e+00 0.00000e+00 1.90736e+01 309.635 7.54431e+01 129.635 0.8316 
1 1 1 9   23  13 o 16 7.48195e+00 1.80551e+00 1.59091e+02 168.989 -9.51017e+00 1.85054e+00  0.00000e+00 0.00000e+00 1.08460e+02 168.989 5.06317e+01 348.989 0.9469 
1 1 1 9   24  0  o 11 2.22929e+01 6.14539e-01 4.09149e+02 108.132 -5.97082e+00 1.82328e+01  0.00000e+00 0.00000e+00 4.10814e+02 108.132 1.66510e+00 108.132 0.9736 
1 1 1 9   24  1  o 18 3.96348e+01 9.57661e-01 6.54701e+02 284.160 1.30379e+01  -5.16773e+01 0.00000e+00 0.00000e+00 8.29064e+02 284.160 1.74363e+02 284.160 0.9906 
1 1 1 9   24  2  o 19 3.43766e+01 8.92113e-01 5.14315e+02 49.349  2.46454e+01  2.87030e+01  0.00000e+00 0.00000e+00 7.67911e+02 49.349  2.53596e+02 49.349  0.9867 
1 1 1 9   24  3  o 13 3.98341e+01 8.46815e-01 7.44054e+02 101.286 -1.38027e+01 6.91607e+01  0.00000e+00 0.00000e+00 7.51370e+02 101.286 7.31582e+00 101.286 0.9929 
1 1 1 9   24  4  o 12 2.68265e+01 7.11172e-01 4.25180e+02 262.583 -4.03024e+00 -3.09590e+01 0.00000e+00 0.00000e+00 5.72906e+02 262.583 1.47726e+02 262.583 0.9839 
1 1 1 9   24  5  o 19 1.53877e+01 9.90278e-01 2.46964e+02 151.483 -1.04258e+01 5.66483e+00  0.00000e+00 0.00000e+00 3.09898e+02 151.483 6.29333e+01 151.483 0.9569 
1 1 1 9   24  6  o 16 2.59602e+01 7.90861e-01 3.91719e+02 311.871 2.38044e+01  -2.65571e+01 0.00000e+00 0.00000e+00 5.76237e+02 311.871 1.84518e+02 311.871 0.9859 
1 1 1 9   24  7  o 19 2.03441e+01 8.27267e-01 2.72782e+02 146.489 -2.08183e+01 1.37848e+01  0.00000e+00 0.00000e+00 4.81043e+02 146.489 2.08261e+02 146.489 0.9798 
1 1 1 9   24  8  o 13 2.78218e+01 9.98294e-01 5.12101e+02 307.817 4.70683e+01  -6.06435e+01 0.00000e+00 0.00000e+00 5.33113e+02 307.817 2.10117e+01 307.817 0.9935 
1 1 1 9   24  9  o 12 1.41694e+01 1.27576e+00 1.37846e+02 214.599 -1.02029e+01 -7.03834e+00 0.00000e+00 0.00000e+00 3.75805e+02 214.599 2.37960e+02 214.599 0.9588 
1 1 1 9   24  10 o 1  9.10479e+00 1.93343e+00 1.68265e+02 301.022 4.57732e+00  -7.61133e+00 0.00000e+00 0.00000e+00 1.55911e+02 301.022 1.23542e+01 121.022 0.9419 
1 1 1 9   24  11 o 18 3.66125e+00 1.74562e+00 6.79652e+01 136.736 -1.28935e+00 1.21350e+00  0.00000e+00 0.00000e+00 2.28368e+01 136.736 4.51284e+01 316.736 0.6563 
1 1 1 9   24  12 o 3  4.73882e+00 1.43781e+00 4.17043e+01 90.514  -1.69353e-02 1.88782e+00  0.00000e+00 0.00000e+00 7.97584e+01 90.514  3.80541e+01 90.514  0.6785 
1 1 1 9   24  13 o 2  3.82834e+00 1.30118e+00 6.94283e+01 274.230 2.10058e-01  -2.83978e+00 0.00000e+00 0.00000e+00 4.59443e+01 274.230 2.34840e+01 94.230  0.7980 
1 1 1 9   25  0  o 9  1.62650e+01 6.35853e-01 2.00579e+02 65.172  2.86897e+00  6.20096e+00  0.00000e+00 0.00000e+00 3.66929e+02 65.172  1.66351e+02 65.172  0.9236 
1 1 1 9   25  1  o 8  2.96120e+01 6.88938e-01 5.46695e+02 95.693  -3.34581e+00 3.35644e+01  0.00000e+00 0.00000e+00 5.55615e+02 95.693  8.91986e+00 95.693  0.9851 
1 1 1 9   25  2  o 12 3.17616e+01 8.37309e-01 4.31890e+02 112.216 -1.13974e+01 2.79059e+01  0.00000e+00 0.00000e+00 7.48606e+02 112.216 3.16716e+02 112.216 0.9833 
1 1 1 9   25  3  o 8  2.87172e+01 8.10973e-01 3.31345e+02 292.386 8.62729e+00  -2.09456e+01 0.00000e+00 0.00000e+00 7.30145e+02 292.386 3.98799e+02 292.386 0.9777 
1 1 1 9   25  4  o 7  2.29363e+01 7.02716e-01 2.69534e+02 179.265 -1.68961e+01 2.16660e-01  0.00000e+00 0.00000e+00 5.71697e+02 179.265 3.02163e+02 179.265 0.9699 
1 1 1 9   25  5  o 8  2.06289e+01 9.31091e-01 4.88820e+02 88.668  7.34888e-01  3.16044e+01  0.00000e+00 0.00000e+00 2.78859e+02 88.668  2.09962e+02 268.668 0.9841 
1 1 1 9   25  6  o 8  1.78096e+01 8.29280e-01 3.59866e+02 81.701  3.14489e+00  2.15603e+01  0.00000e+00 0.00000e+00 2.98010e+02 81.701  6.18560e+01 261.701 0.9768 
1 1 1 9   25  7  o 4  1.08594e+01 1.08220e+00 2.41746e+02 250.477 -3.78063e+00 -1.06626e+01 0.00000e+00 0.00000e+00 1.50325e+02 250.477 9.14213e+01 70.477  0.9547 
1 1 1 9   25  8  o 6  1.76858e+01 1.08914e+00 3.32918e+02 271.339 7.25564e-01  -3.10389e+01 0.00000e+00 0.00000e+00 3.24973e+02 271.339 7.94513e+00 91.339  0.9838 
1 1 1 9   25  9  o 18 7.73032e+00 1.71542e+00 3.66142e+02 121.583 -8.16241e+00 1.32769e+01  0.00000e+00 0.00000e+00 8.34205e+01 301.583 4.49563e+02 301.583 0.9674 
1 1 1 9   25  10 o 8  1.22236e+01 1.78509e+00 2.08817e+02 269.988 -3.24520e-03 -1.57405e+01 0.00000e+00 0.00000e+00 2.38292e+02 269.988 2.94756e+01 269.988 0.9677 
1 1 1 9   25  11 o 14 9.59277e+00 2.47105e+00 1.95662e+02 166.230 -9.04085e+00 2.21564e+00  0.00000e+00 0.00000e+00 1.46767e+02 166.230 4.88947e+01 346.230 0.9447 
1 1 1 9   25  12 o 7  5.19311e+00 1.59346e+00 1.15877e+02 158.044 -4.90926e+00 1.97905e+00  0.00000e+00 0.00000e+00 6.06313e+01 158.044 5.52453e+01 338.044 0.8998 
1 1 1 9   25  13 f 0  6.33622e+00 1.62545e+00 1.22401e+02 29.957  6.55571e+00  3.77844e+00  0.00000e+00 0.00000e+00 1.00433e+02 29.957  2.19684e+01 209.957 0.9314 
1 1 1 9   26  0  f 0  1.83631e+01 6.44731e-01 4.73205e+02 68.540  6.64470e+00  1.69030e+01  0.00000e+00 0.00000e+00 2.01074e+02 68.540  2.72131e+02 248.540 0.9721 
1 1 1 9   26  1  o 10 1.78118e+01 6.03087e-01 3.45230e+02 128.421 -8.33613e+00 1.05097e+01  0.00000e+00 0.00000e+00 3.02228e+02 128.421 4.30021e+01 308.421 0.9620 
1 1 1 9   26  2  o 5  2.84878e+01 7.09847e-01 3.84999e+02 346.278 2.60475e+01  -6.36005e+00 0.00000e+00 0.00000e+00 6.71483e+02 346.278 2.86484e+02 346.278 0.9812 
1 1 1 9   26  3  o 3  2.73528e+01 7.02086e-01 4.75186e+02 147.721 -2.93437e+01 1.85355e+01  0.00000e+00 0.00000e+00 5.43883e+02 147.721 6.86970e+01 147.721 0.9855 
1 1 1 9   26  4  o 14 3.26685e+01 7.80118e-01 5.51055e+02 28.471  4.39853e+01  2.38533e+01  0.00000e+00 0.00000e+00 6.71760e+02 28.471  1.20704e+02 28.471  0.9900 
1 1 1 9   26  5  f 0  1.31611e+01 9.11154e-01 1.69431e+02 190.703 -6.65922e+00 -1.25866e+00 0.00000e+00 0.00000e+00 2.89899e+02 190.703 1.20468e+02 190.703 0.9230 
1 1 1 9   26  6  o 12 1.52357e+01 8.75377e-01 2.46583e+02 141.564 -9.93200e+00 7.88208e+00  0.00000e+00 0.00000e+00 3.06350e+02 141.564 5.97664e+01 141.564 0.9597 
1 1 1 9   26  7  o 9  1.46196e+01 9.44306e-01 3.49915e+02 300.777 1.21583e+01  -2.04140e+01 0.00000e+00 0.00000e+00 1.91147e+02 300.777 1.58768e+02 120.777 0.9787 
1 1 1 9   26  8  o 1  2.68273e+01 9.91648e-01 4.19237e+02 136.082 -4.39340e+01 4.23052e+01  0.00000e+00 0.00000e+00 5.86758e+02 136.082 1.67521e+02 136.082 0.9918 
1 1 1 9   26  9  o 9  1.02049e+01 1.53633e+00 2.01087e+02 296.310 5.25181e+00  -1.06217e+01 0.00000e+00 0.00000e+00 1.68047e+02 296.310 3.30398e+01 116.310 0.9568 
1 1 1 9   26  10 f 0  2.50838e+01 1.33903e+00 3.90268e+02 160.609 -6.78973e+01 2.38988e+01  0.00000e+00 0.00000e+00 5.51192e+02 160.609 1.60924e+02 160.609 0.9930 
1 1 1 9   26  11 o 7  7.90274e+00 2.48152e+00 2.38977e+02 152.072 -8.44638e+00 4.47746e+00  0.00000e+00 0.00000e+00 4.35529e+01 152.072 1.95425e+02 332.072 0.9462 
1 1 1 9   26  12 o 19 1.01484e+01 1.81330e+00 2.75363e+02 96.456  -2.39674e+00 2.11820e+01  0.00000e+00 0.00000e+00 9.88663e+01 96.456  1.76497e+02 276.456 0.9763 
1 1 1 9   26  13 o 10 8.35443e+00 1.83502e+00 1.39257e+02 290.929 3.52881e+00  -9.22710e+00 0.00000e+00 0.00000e+00 1.59767e+02 290.929 2.05101e+01 290.929 0.9479 
1 1 1 9   27  0  o 12 3.04190e+01 7.71673e-01 4.06209e+02 118.048 -1.25640e+01 2.35816e+01  0.00000e+00 0.00000e+00 7.21055e+02 118.048 3.14846e+02 118.048 0.9811 
1 1 1 9   27  1  o 1  2.48898e+01 6.40708e-01 4.03669e+02 320.555 1.72797e+01  -1.42164e+01 0.00000e+00 0.00000e+00 5.15513e+02 320.555 1.11844e+02 320.555 0.9774 
1 1 1 9   27  2  o 4  1.24202e+01 6.92955e-01 3.62864e+02 205.840 -9.89460e+00 -4.79185e+00 0.00000e+00 0.00000e+00 8.46653e+01 205.840 2.78199e+02 25.840  0.9534 
1 1 1 9   27  3  o 12 9.41234e+00 8.90392e-01 1.30976e+01 174.347 -3.21897e-01 3.18632e-02  0.00000e+00 0.00000e+00 4.37094e+01 174.347 3.06118e+01 174.347 0.1597 
1 1 1 9   27  4  o 6  1.98924e+01 6.97487e-01 4.07305e+02 96.659  -2.83501e+00 2.42846e+01  0.00000e+00 0.00000e+00 3.29242e+02 96.659  7.80629e+01 276.659 0.9793 
1 1 1 9   27  5  o 4  3.02982e+01 9.55003e-01 4.96208e+02 181.982 -4.53314e+01 -1.56859e+00 0.00000e+00 0.00000e+00 6.36707e+02 181.982 1.40499e+02 181.982 0.9889 
1 1 1 9   27  6  o 4  7.46123e+00 1.34907e+00 1.31275e+02 0.358   3.47432e+00  2.17374e-02  0.00000e+00 0.00000e+00 1.05641e+02 0.358   2.56340e+01 180.358 0.8398 
1 1 1 9   27  7  o 12 9.68474e+00 1.44203e+00 2.56651e+02 352.662 1.03500e+01  -1.33287e+00 0.00000e+00 0.00000e+00 9.15249e+01 352.662 1.65126e+02 172.662 0.9508 
1 1 1 9   27  8  o 12 1.87704e+01 1.07877e+00 4.55724e+02 182.930 -4.54010e+01 -2.32377e+00 0.00000e+00 0.00000e+00 2.46086e+02 182.930 2.09638e+02 2.930   0.9889 
1 1 1 9   27  9  o 11 1.23011e+01 1.53711e+00 2.48765e+02 340.742 1.66440e+01  -5.81499e+00 0.00000e+00 0.00000e+00 2.02849e+02 340.742 4.59165e+01 160.742 0.9712 
1 1 1 9   27  10 o 15 9.10277e+00 1.76376e+00 1.29442e+02 101.886 -1.50783e+00 7.16412e+00  0.00000e+00 0.00000e+00 1.90140e+02 101.886 6.06980e+01 101.886 0.9290 
1 1 1 9   27  11 o 9  6.28480e+00 1.60834e+00 4.21135e+01 240.105 -1.01297e+00 -1.76199e+00 0.00000e+00 0.00000e+00 1.24825e+02 240.105 8.27115e+01 240.105 0.7030 
1 1 1 9   27  12 o 7  1.00763e+01 1.77681e+00 2.43160e+02 30.190  1.64522e+01  9.57164e+00  0.00000e+00 0.00000e+00 1.27286e+02 30.190  1.15873e+02 210.190 0.9734 
1 1 1 9   27  13 o 7  4.26946e+00 1.42168e+00 7.03679e+01 15.544  3.13185e+00  8.71127e-01  0.00000e+00 0.00000e+00 6.29284e+01 15.544  7.43950e+00 195.544 0.8269 
1 1 1 9   28  0  o 19 1.48776e+01 6.43696e-01 2.11787e+02 26.287  6.13371e+00  3.02972e+00  0.00000e+00 0.00000e+00 3.07257e+02 26.287  9.54698e+01 26.287  0.9237 
1 1 1 9   28  1  o 13 5.08981e+00 9.67393e-01 4.44305e+01 53.740  2.90581e-01  3.96160e-01  0.00000e+00 0.00000e+00 1.43802e+00 53.740  4.29925e+01 233.740 0.2385 
1 1 1 9   28  2  o 19 1.23934e+01 6.83396e-01 2.98044e+02 255.572 -2.21292e+00 -8.60112e+00 0.00000e+00 0.00000e+00 1.43110e+02 255.572 1.54934e+02 75.572  0.9419 
1 1 1 9   28  3  o 2  4.31391e+00 1.07920e+00 1.43654e+02 349.162 1.53443e+00  -2.93773e-01 0.00000e+00 0.00000e+00 4.39965e+01 169.162 1.87651e+02 169.162 0.6112 
1 1 1 9   28  4  o 9  3.02482e+01 9.91783e-01 5.13131e+02 179.574 -4.53976e+01 3.37510e-01  0.00000e+00 0.00000e+00 6.17742e+02 179.574 1.04611e+02 179.574 0.9889 
1 1 1 9   28  5  o 18 4.28468e+01 9.34978e-01 6.62046e+02 62.606  4.06560e+01  7.84542e+01  0.00000e+00 0.00000e+00 9.48734e+02 62.606  2.86687e+02 62.606  0.9943 
1 1 1 9   28  6  o 14 2.60973e+01 8.02395e-01 5.56617e+02 232.393 -3.74468e+01 -4.86134e+01 0.00000e+00 0.00000e+00 4.22034e+02 232.393 1.34583e+02 52.393  0.9918 
1 1 1 9   28  7  o 14 2.37126e+01 9.68076e-01 3.81527e+02 96.245  -4.44275e+00 4.05994e+01  0.00000e+00 0.00000e+00 5.03957e+02 96.245  1.22429e+02 96.245  0.9877 
1 1 1 9   28  8  o 9  1.37080e+01 1.18668e+00 2.56050e+02 189.647 -1.89977e+01 -3.22933e+00 0.00000e+00 0.00000e+00 2.48543e+02 189.647 7.50647e+00 9.647   0.9737 
1 1 1 9   28  9  o 10 2.79652e+01 1.20622e+00 4.54537e+02 79.258  1.58830e+01  8.37183e+01  0.00000e+00 0.00000e+00 5.96288e+02 79.258  1.41751e+02 79.258  0.9941 
1 1 1 9   28  10 o 6  7.46593e+00 1.87233e+00 1.74632e+02 171.336 -7.92976e+00 1.20839e+00  0.00000e+00 0.00000e+00 8.92864e+01 171.336 8.53456e+01 351.335 0.9354 
1 1 1 9   28  11 o 9  1.17863e+01 1.65011e+00 2.81544e+02 109.316 -7.91222e+00 2.25734e+01  0.00000e+00 0.00000e+00 1.54330e+02 109.316 1.27214e+02 289.316 0.9789 
1 1 1 9   28  12 o 17 1.12726e+01 1.84090e+00 1.17826e+02 301.115 5.36069e+00  -8.88142e+00 0.00000e+00 0.00000e+00 2.86835e+02 301.115 1.69009e+02 301.115 0.9505 
1 1 1 9   28  13 o 14 5.79221e+00 1.72067e+00 1.21961e+02 106.761 -1.85641e+00 6.16370e+00  0.00000e+00 0.00000e+00 7.89186e+01 106.761 4.30428e+01 286.761 0.9187 
1 1 1 9   29  0  o 19 2.37961e+01 6.89470e-01 4.19983e+02 200.752 -2.07022e+01 -7.84415e+00 0.00000e+00 0.00000e+00 4.58160e+02 200.752 3.81767e+01 200.752 0.9771 
1 1 1 9   29  1  o 8  2.13300e+01 6.26670e-01 2.67190e+02 37.368  1.11043e+01  8.48013e+00  0.00000e+00 0.00000e+00 5.09229e+02 37.368  2.42040e+02 37.368  0.9635 
1 1 1 9   29  2  o 19 1.81422e+01 6.46288e-01 3.02357e+02 231.521 -8.20424e+00 -1.03218e+01 0.00000e+00 0.00000e+00 3.56679e+02 231.521 5.43220e+01 231.521 0.9613 
1 1 1 9   29  3  o 10 1.52234e+01 7.29387e-01 2.37792e+02 214.792 -8.12108e+00 -5.64267e+00 0.00000e+00 0.00000e+00 3.07683e+02 214.792 6.98909e+01 214.792 0.9480 
1 1 1 9   29  4  o 7  3.07237e+01 7.59214e-01 7.12389e+02 42.804  4.57734e+01  4.23924e+01  0.00000e+00 0.00000e+00 4.39688e+02 42.804  2.72701e+02 222.804 0.9920 
1 1 1 9   29  5  o 10 1.46646e+01 8.45365e-01 1.95920e+02 67.582  3.55273e+00  8.61212e+00  0.00000e+00 0.00000e+00 3.27826e+02 67.582  1.31905e+02 67.582  0.9447 
1 1 1 9   29  6  o 14 2.04523e+01 8.06162e-01 2.54088e+02 66.313  8.78837e+00  2.00328e+01  0.00000e+00 0.00000e+00 5.01256e+02 66.313  2.47168e+02 66.313  0.9769 
1 1 1 9   29  7  o 16 1.48677e+01 1.22164e+00 1.91136e+02 301.764 6.87755e+00  -1.11079e+01 0.00000e+00 0.00000e+00 3.48980e+02 301.764 1.57844e+02 301.764 0.9609 
1 1 1 9   29  8  o 3  8.14043e+00 1.50617e+00 2.16803e+02 88.886  1.75829e-01  9.04112e+00  0.00000e+00 0.00000e+00 7.33690e+01 88.886  1.43434e+02 268.886 0.9430 
1 1 1 9   29  9  o 13 9.30002e+00 1.80358e+00 2.68489e+02 306.802 8.63186e+00  -1.15375e+01 0.00000e+00 0.00000e+00 7.05855e+01 306.802 1.97904e+02 126.802 0.9647 
1 1 1 9   29  10 o 2  1.04500e+01 1.81661e+00 2.06129e+02 306.763 8.11518e+00  -1.08623e+01 0.00000e+00 0.00000e+00 1.73896e+02 306.763 3.22331e+01 126.763 0.9624 
1 1 1 9   29  11 o 11 6.38150e+00 1.70524e+00 1.06130e+02 107.591 -1.51900e+00 4.79100e+00  0.00000e+00 0.00000e+00 1.09386e+02 107.591 3.25565e+00 107.591 0.8940 
1 1 1 9   29  12 o 8  1.27229e+01 1.57754e+00 1.86491e+02 260.358 -3.59252e+00 -2.11467e+01 0.00000e+00 0.00000e+00 2.82639e+02 260.358 9.61479e+01 260.358 0.9764 
1 1 1 9   29  13 o 7  7.15471e+00 1.84022e+00 8.82138e+01 216.182 -4.32220e+00 -3.16124e+00 0.00000e+00 0.00000e+00 1.55133e+02 216.182 6.69196e+01 216.182 0.9010 
1 1 1 9   30  0  o 4  3.82220e+01 7.99451e-01 6.33615e+02 47.815  3.94342e+01  4.35131e+01  0.00000e+00 0.00000e+00 7.97410e+02 47.815  1.63795e+02 47.815  0.9914 
1 1 1 9   30  1  f 0  3.07947e+01 7.13554e-01 6.05556e+02 59.469  2.27434e+01  3.85623e+01  0.00000e+00 0.00000e+00 5.44658e+02 59.469  6.08980e+01 239.469 0.9888 
1 1 1 9   30  2  o 17 1.50043e+01 6.60683e-01 3.15175e+02 298.867 6.10329e+00  -1.10713e+01 0.00000e+00 0.00000e+00 2.28865e+02 298.867 8.63101e+01 118.867 0.9596 
1 1 1 9   30  3  o 8  1.06303e+01 8.00856e-01 2.09606e+02 341.163 5.85927e+00  -1.99892e+00 0.00000e+00 0.00000e+00 1.58092e+02 341.163 5.15139e+01 161.163 0.9152 
1 1 1 9   30  4  o 19 3.05724e+01 7.68522e-01 4.83459e+02 281.160 9.13879e+00  -4.63236e+01 0.00000e+00 0.00000e+00 6.59848e+02 281.160 1.76389e+02 281.160 0.9894 
1 1 1 9   30  5  o 5  2.09412e+01 9.30342e-01 4.20670e+02 56.849  1.54313e+01  2.36252e+01  0.00000e+00 0.00000e+00 3.56804e+02 56.849  6.38661e+01 236.849 0.9821 
1 1 1 9   30  6  o 3  2.43828e+01 7.96453e-01 4.69726e+02 37.418  3.81880e+01  2.92160e+01  0.00000e+00 0.00000e+00 4.42391e+02 37.418  2.73350e+01 217.418 0.9895 
1 1 1 9   30  7  o 7  1.75598e+01 1.05025e+00 3.09499e+02 210.145 -2.22890e+01 -1.29441e+01 0.00000e+00 0.00000e+00 3.41290e+02 210.145 3.17909e+01 210.145 0.9804 
1 1 1 9   30  8  o 7  8.21117e+00 1.55289e+00 1.50450e+02 3.305   6.21978e+00  3.59211e-01  0.00000e+00 0.00000e+00 1.33785e+02 3.305   1.66654e+01 183.305 0.9158 
1 1 1 9   30  9  o 2  1.43194e+01 1.43808e+00 2.31809e+02 121.284 -1.13971e+01 1.87564e+01  0.00000e+00 0.00000e+00 2.96885e+02 121.284 6.50761e+01 121.284 0.9769 
1 1 1 9   30  10 o 16 1.46064e+01 1.75169e+00 2.76925e+02 154.038 -2.37311e+01 1.15548e+01  0.00000e+00 0.00000e+00 2.64410e+02 154.038 1.25151e+01 334.038 0.9809 
1 1 1 9   30  11 o 2  1.29596e+01 1.65133e+00 1.85581e+02 26.443  1.63771e+01  8.14507e+00  0.00000e+00 0.00000e+00 2.90377e+02 26.443  1.04796e+02 26.443  0.9723 
1 1 1 9   30  12 o 3  5.21235e+00 1.51414e+00 1.02842e+02 290.030 1.71598e+00  -4.70697e+00 0.00000e+00 0.00000e+00 7.30425e+01 290.030 2.97996e+01 110.030 0.8936 
1 1 1 9   30  13 o 5  5.03283e+00 1.57570e+00 1.17046e+02 72.526  1.74598e+00  5.54618e+00  0.00000e+00 0.00000e+00 5.57074e+01 72.526  6.13381e+01 252.526 0.9094 
1 1 1 9   31  0  o 8  2.89635e+01 6.74826e-01 6.67009e+02 304.832 2.68830e+01  -3.86328e+01 0.00000e+00 0.00000e+00 4.14962e+02 304.832 2.52047e+02 124.832 0.9893 
1 1 1 9   31  1  f 0  2.54351e+01 6.59682e-01 3.71925e+02 86.201  1.50587e+00  2.26753e+01  0.00000e+00 0.00000e+00 5.67430e+02 86.201  1.95505e+02 86.201  0.9777 
1 1 1 9   31  2  o 1  1.91392e+01 6.44967e-01 1.49934e+02 185.856 -7.46472e+00 -7.65660e-01 0.00000e+00 0.00000e+00 5.23123e+02 185.856 3.73189e+02 185.856 0.9308 
1 1 1 9   31  3  o 12 3.76498e+01 8.29455e-01 6.58527e+02 259.096 -1.29617e+01 -6.72812e+01 0.00000e+00 0.00000e+00 7.53851e+02 259.096 9.53237e+01 259.096 0.9927 
1 1 1 9   31  4  o 1  1.43056e+01 7.71227e-01 2.92558e+02 242.335 -6.18511e+00 -1.17983e+01 0.00000e+00 0.00000e+00 2.27427e+02 242.335 6.51307e+01 62.335  0.9617 
1 1 1 9   31  5  o 1  8.35759e+00 1.16748e+00 1.42534e+02 137.435 -2.93273e+00 2.69348e+00  0.00000e+00 0.00000e+00 1.30041e+02 137.435 1.24925e+01 317.435 0.8628 
1 1 1 9   31  6  o 9  1.34163e+01 9.29926e-01 2.22385e+02 327.780 1.07066e+01  -6.74757e+00 0.00000e+00 0.00000e+00 2.64286e+02 327.780 4.19003e+01 327.780 0.9596 
1 1 1 9   31  7  o 5  1.34182e+01 1.15179e+00 2.77106e+02 274.881 1.56986e+00  -1.83827e+01 0.00000e+00 0.00000e+00 2.16146e+02 274.881 6.09599e+01 94.881  0.9725 
1 1 1 9   31  8  o 8  8.92610e+00 1.55633e+00 1.04874e+02 316.911 3.70938e+00  -3.46990e+00 0.00000e+00 0.00000e+00 1.97132e+02 316.911 9.22584e+01 316.911 0.8952 
1 1 1 9   31  9  o 10 6.10193e+00 1.58734e+00 9.72331e+01 122.511 -1.91190e+00 2.99982e+00  0.00000e+00 0.00000e+00 9.73929e+01 122.511 1.59711e-01 122.511 0.8440 
1 1 1 9   31  10 o 14 1.48763e+01 1.68331e+00 2.20811e+02 317.861 1.63819e+01  -1.48222e+01 0.00000e+00 0.00000e+00 3.28362e+02 317.861 1.07551e+02 317.861 0.9771 
1 1 1 9   31  11 o 19 3.66654e+00 1.23221e+00 1.08495e+02 319.226 2.88285e+00  -2.48617e+00 0.00000e+00 0.00000e+00 1.00037e+01 319.226 9.84911e+01 139.226 0.8557 
1 1 1 9   31  12 o 3  8.86525e+00 1.89268e+00 2.34594e+02 178.854 -1.61575e+01 3.23190e-01  0.00000e+00 0.00000e+00 8.96113e+01 178.854 1.44982e+02 358.854 0.9685 
1 1 1 9   31  13 o 7  8.47895e+00 1.94370e+00 1.93109e+02 84.751  1.19460e+00  1.30025e+01  0.00000e+00 0.00000e+00 1.14400e+02 84.751  7.87085e+01 264.751 0.9609 
1 1 1 9   32  0  o 1  1.33337e+01 8.74112e-01 1.70681e+02 275.634 5.28855e-01  -5.36048e+00 0.00000e+00 0.00000e+00 2.83230e+02 275.634 1.12549e+02 275.634 0.9016 
1 1 1 9   32  1  o 6  2.02873e+01 6.16076e-01 4.73802e+02 253.068 -7.50582e+00 -2.46557e+01 0.00000e+00 0.00000e+00 2.77413e+02 253.068 1.96388e+02 73.068  0.9804 
1 1 1 9   32  2  o 1  1.38367e+01 1.08860e+00 3.59744e+02 169.878 -1.29521e+01 2.31226e+00  0.00000e+00 0.00000e+00 1.42717e+02 169.878 2.17028e+02 349.878 0.9612 
1 1 1 9   32  3  o 8  1.58133e+01 6.88217e-01 2.36330e+02 293.708 4.52635e+00  -1.03074e+01 0.00000e+00 0.00000e+00 3.34019e+02 293.708 9.76895e+01 293.708 0.9545 
1 1 1 9   32  4  o 9  2.94193e+01 7.49433e-01 5.02640e+02 150.675 -3.97307e+01 2.23189e+01  0.00000e+00 0.00000e+00 5.96928e+02 150.675 9.42878e+01 150.675 0.9890 
1 1 1 9   32  5  o 1  1.38295e+01 8.40222e-01 1.92215e+02 80.388  1.50573e+00  8.89111e+00  0.00000e+00 0.00000e+00 3.00590e+02 80.388  1.08375e+02 80.388  0.9428 
1 1 1 9   32  6  o 2  2.01047e+01 8.48369e-01 2.85279e+02 197.936 -2.44701e+01 -7.92075e+00 0.00000e+00 0.00000e+00 4.59695e+02 197.936 1.74416e+02 197.936 0.9804 
1 1 1 9   32  7  o 13 9.30986e+00 1.48653e+00 1.73377e+02 320.290 6.15928e+00  -5.11542e+00 0.00000e+00 0.00000e+00 1.55726e+02 320.290 1.76503e+01 140.290 0.9353 
1 1 1 9   32  8  o 14 1.92832e+01 8.76491e-01 3.54101e+02 174.208 -4.57974e+01 4.64546e+00  0.00000e+00 0.00000e+00 3.66693e+02 174.208 1.25928e+01 174.208 0.9891 
1 1 1 9   32  9  o 2  1.57202e+01 1.29594e+00 3.05246e+02 23.824  3.12565e+01  1.38014e+01  0.00000e+00 0.00000e+00 2.80004e+02 23.824  2.52414e+01 203.824 0.9853 
1 1 1 9   32  10 o 3  5.59654e+00 1.57746e+00 1.15076e+02 39.372  3.49635e+00  2.86909e+00  0.00000e+00 0.00000e+00 7.11900e+01 39.372  4.38857e+01 219.372 0.8810 
1 1 1 9   32  11 o 3  6.92677e+00 1.67194e+00 1.61644e+02 207.239 -8.01614e+00 -4.12670e+00 0.00000e+00 0.00000e+00 8.49965e+01 207.239 7.66479e+01 27.239  0.9428 
1 1 1 9   32  12 o 19 8.91446e+00 1.68269e+00 1.85357e+02 355.984 1.39324e+01  -9.78102e-01 0.00000e+00 0.00000e+00 1.38923e+02 355.984 4.64344e+01 175.984 0.9635 
1 1 1 9   32  13 o 16 4.72358e+00 1.55223e+00 3.89748e+01 237.909 -9.82760e-01 -1.56717e+00 0.00000e+00 0.00000e+00 8.07312e+01 237.909 4.17564e+01 237.909 0.6715 
1 1 1 9   33  0  o 11 1.99840e+01 6.01719e-01 2.92844e+02 226.272 -1.08549e+01 -1.13479e+01 0.00000e+00 0.00000e+00 4.37181e+02 226.272 1.44337e+02 226.272 0.9676 
1 1 1 9   33  1  o 7  7.97116e+00 7.77181e-01 1.50262e+02 100.913 -5.87401e-01 3.04652e+00  0.00000e+00 0.00000e+00 9.57727e+01 100.913 5.44892e+01 280.913 0.8173 
1 1 1 9   33  2  o 19 2.27893e+01 7.95864e-01 3.80324e+02 244.327 -1.01789e+01 -2.11755e+01 0.00000e+00 0.00000e+00 4.62036e+02 244.327 8.17124e+01 244.327 0.9785 
1 1 1 9   33  3  o 3  2.07927e+01 6.62185e-01 3.06260e+02 165.721 -1.77285e+01 4.51192e+00  0.00000e+00 0.00000e+00 4.57582e+02 165.721 1.51322e+02 165.721 0.9723 
1 1 1 9   33  4  o 19 4.56554e+01 1.27648e+00 7.57172e+02 314.533 7.23558e+01  -7.35443e+01 0.00000e+00 0.00000e+00 9.59731e+02 314.533 2.02559e+02 314.533 0.9951 
1 1 1 9   33  5  o 15 6.28855e+00 1.21495e+00 1.95904e+02 114.981 -1.89065e+00 4.05800e+00  0.00000e+00 0.00000e+00 1.31533e+01 114.981 1.82751e+02 294.981 0.8796 
1 1 1 9   33  6  o 10 1.67455e+01 1.13523e+00 1.71318e+02 10.325  1.20342e+01  2.19231e+00  0.00000e+00 0.00000e+00 4.35108e+02 10.325  2.63790e+02 10.325  0.9582 
1 1 1 9   33  7  o 9  1.46177e+01 1.13766e+00 2.40896e+02 320.032 1.41084e+01  -1.18249e+01 0.00000e+00 0.00000e+00 2.96320e+02 320.032 5.54246e+01 320.032 0.9724 
1 1 1 9   33  8  o 1  1.71776e+01 1.19477e+00 2.76460e+02 134.832 -2.18169e+01 2.19454e+01  0.00000e+00 0.00000e+00 3.62083e+02 134.832 8.56231e+01 134.832 0.9837 
1 1 1 9   33  9  o 15 7.01675e+00 1.76243e+00 1.23087e+02 288.666 1.66570e+00  -4.93068e+00 0.00000e+00 0.00000e+00 1.14962e+02 288.666 8.12584e+00 108.666 0.8979 
1 1 1 9   33  10 o 1  7.26520e+00 1.62431e+00 4.96922e+01 303.030 1.45550e+00  -2.23870e+00 0.00000e+00 0.00000e+00 1.65006e+02 303.030 1.15314e+02 303.030 0.7823 
1 1 1 9   33  11 o 7  4.95821e+00 1.46226e+00 1.09468e+02 99.336  -7.86869e-01 4.78645e+00  0.00000e+00 0.00000e+00 5.71399e+01 99.336  5.23286e+01 279.336 0.8898 
1 1 1 9   33  12 o 14 6.76939e+00 1.77178e+00 9.92760e+01 108.316 -1.73741e+00 5.24849e+00  0.00000e+00 0.00000e+00 1.31833e+02 108.316 3.25575e+01 108.316 0.9044 
1 1 1 9   33  13 o 7  1.02381e+01 2.16411e+00 1.72333e+02 24.938  1.12225e+01  5.21845e+00  0.00000e+00 0.00000e+00 1.98061e+02 24.938  2.57277e+01 24.938  0.9587 
1 1 1 9   34  0  o 15 2.72469e+01 6.47130e-01 5.39167e+02 174.672 -3.82259e+01 3.56499e+00  0.00000e+00 0.00000e+00 4.75905e+02 174.672 6.32616e+01 354.672 0.9869 
1 1 1 9   34  1  o 10 1.28060e+01 6.29836e-01 1.85123e+02 330.866 5.69579e+00  -3.17471e+00 0.00000e+00 0.00000e+00 2.59656e+02 330.866 7.45335e+01 330.866 0.9198 
1 1 1 9   34  2  o 1  2.76999e+01 6.77742e-01 4.60110e+02 73.190  1.03059e+01  3.41137e+01  0.00000e+00 0.00000e+00 5.71391e+02 73.190  1.11282e+02 73.190  0.9859 
1 1 1 9   34  3  o 7  1.70132e+01 6.65701e-01 3.66768e+02 238.157 -1.06095e+01 -1.70828e+01 0.00000e+00 0.00000e+00 2.59802e+02 238.157 1.06966e+02 58.157  0.9748 
1 1 1 9   34  4  o 9  2.84314e+01 8.86106e-01 3.98930e+02 302.929 1.99068e+01  -3.07372e+01 0.00000e+00 0.00000e+00 6.60604e+02 302.929 2.61674e+02 302.929 0.9863 
1 1 1 9   34  5  o 19 1.10608e+01 9.53402e-01 1.69549e+02 114.799 -2.96510e+00 6.41724e+00  0.00000e+00 0.00000e+00 2.17624e+02 114.799 4.80747e+01 114.799 0.9263 
1 1 1 9   34  6  o 2  1.04438e+01 1.23486e+00 2.50634e+02 7.105   1.14125e+01  1.42245e+00  0.00000e+00 0.00000e+00 1.26469e+02 7.105   1.24166e+02 187.105 0.9555 
1 1 1 9   34  7  o 16 1.76610e+01 9.93813e-01 3.62008e+02 148.037 -2.91420e+01 1.81840e+01  0.00000e+00 0.00000e+00 2.95595e+02 148.037 6.64135e+01 328.037 0.9853 
1 1 1 9   34  8  o 12 4.21542e+00 1.36902e+00 8.50500e+01 320.698 1.72051e+00  -1.40834e+00 0.00000e+00 0.00000e+00 3.14248e+01 320.698 5.36253e+01 140.698 0.7313 
1 1 1 9   34  9  o 3  1.20059e+01 1.60848e+00 1.72439e+02 56.634  7.27835e+00  1.10523e+01  0.00000e+00 0.00000e+00 2.63649e+02 56.634  9.12103e+01 56.634  0.9614 
1 1 1 9   34  10 o 3  5.36139e+00 1.53099e+00 1.85343e+02 275.590 7.37106e-01  -7.53060e+00 0.00000e+00 0.00000e+00 3.26337e+00 275.590 1.82079e+02 95.590  0.9314 
1 1 1 9   34  11 o 9  1.21215e+01 1.49456e+00 2.36094e+02 83.670  2.86139e+00  2.57929e+01  0.00000e+00 0.00000e+00 2.12713e+02 83.670  2.33811e+01 263.670 0.9805 
1 1 1 9   34  12 o 4  4.60401e+00 1.51227e+00 1.45144e+02 158.384 -5.88342e+00 2.33127e+00  0.00000e+00 0.00000e+00 1.42539e+01 158.384 1.30890e+02 338.384 0.9172 
1 1 1 9   34  13 o 6  6.02478e+00 1.79716e+00 7.64657e+01 17.848  3.89965e+00  1.25565e+00  0.00000e+00 0.00000e+00 1.20663e+02 17.848  4.41972e+01 17.848  0.8671 
1 1 1 9   35  0  o 19 2.22162e+01 6.77831e-01 4.90206e+02 130.178 -1.92572e+01 2.28058e+01  0.00000e+00 0.00000e+00 3.34195e+02 130.178 1.56011e+02 310.178 0.9831 
1 1 1 9   35  1  f 0  1.29276e+01 6.47754e-01 1.44581e+02 324.924 4.19034e+00  -2.94239e+00 0.00000e+00 0.00000e+00 2.92830e+02 324.924 1.48250e+02 324.924 0.8961 
1 1 1 9   35  2  o 3  1.43891e+01 6.74328e-01 1.82470e+02 183.763 -7.89554e+00 -5.19356e-01 0.00000e+00 0.00000e+00 3.25387e+02 183.763 1.42918e+02 183.763 0.9345 
1 1 1 9   35  3  o 16 1.93742e+01 6.78400e-01 2.55376e+02 247.985 -5.94788e+00 -1.47101e+01 0.00000e+00 0.00000e+00 4.53064e+02 247.985 1.97688e+02 247.985 0.9680 
1 1 1 9   35  4  o 4  1.19497e+01 1.20047e+00 1.48829e+02 192.471 -5.37273e+00 -1.18829e+00 0.00000e+00 0.00000e+00 2.59255e+02 192.471 1.10426e+02 192.471 0.9039 
1 1 1 9   35  5  o 12 3.61122e+01 8.25702e-01 5.20781e+02 280.539 1.44394e+01  -7.76157e+01 0.00000e+00 0.00000e+00 8.35071e+02 280.539 3.14289e+02 280.539 0.9936 
1 1 1 9   35  6  o 5  1.99935e+01 1.11591e+00 2.09325e+02 172.615 -1.82589e+01 2.36656e+00  0.00000e+00 0.00000e+00 5.25350e+02 172.615 3.16025e+02 172.615 0.9725 
1 1 1 9   35  7  o 9  1.14016e+01 1.29840e+00 2.29165e+02 284.224 3.24261e+00  -1.27925e+01 0.00000e+00 0.00000e+00 1.84991e+02 284.224 4.41734e+01 104.224 0.9613 
1 1 1 9   35  8  o 4  2.32528e+01 1.07598e+00 3.57573e+02 52.257  3.43822e+01  4.44159e+01  0.00000e+00 0.00000e+00 5.13101e+02 52.257  1.55528e+02 52.257  0.9911 
1 1 1 9   35  9  o 15 1.19965e+01 1.58138e+00 1.95667e+02 278.700 2.38008e+00  -1.55546e+01 0.00000e+00 0.00000e+00 2.42865e+02 278.700 4.71984e+01 278.700 0.9677 
1 1 1 9   35  10 o 19 1.08311e+01 1.40977e+00 1.34041e+02 261.808 -1.71821e+00 -1.19348e+01 0.00000e+00 0.00000e+00 2.57673e+02 261.808 1.23632e+02 261.808 0.9576 
1 1 1 9   35  11 o 10 8.73618e+00 1.63944e+00 1.66243e+02 113.246 -4.81553e+00 1.12106e+01  0.00000e+00 0.00000e+00 1.49789e+02 113.246 1.64534e+01 293.246 0.9581 
1 1 1 9   35  12 o 8  1.09073e+01 1.61324e+00 1.65593e+02 14.778  1.62375e+01  4.28353e+00  0.00000e+00 0.00000e+00 2.33642e+02 14.778  6.80498e+01 14.778  0.9698 
1 1 1 9   35  13 o 1  9.04365e+00 2.08906e+00 1.92334e+02 351.208 1.24205e+01  -1.92097e+00 0.00000e+00 0.00000e+00 1.35005e+02 351.208 5.73296e+01 171.208 0.9594 
1 1 1 9   36  0  o 2  1.95940e+01 8.33660e-01 3.74068e+02 24.413  1.80196e+01  8.17887e+00  0.00000e+00 0.00000e+00 3.46518e+02 24.413  2.75502e+01 204.413 0.9744 
1 1 1 9   36  1  o 7  9.15000e+00 9.56236e-01 1.80257e+02 58.795  2.33175e+00  3.84945e+00  0.00000e+00 0.00000e+00 1.23865e+02 58.795  5.63916e+01 238.795 0.8803 
1 1 1 9   36  2  o 1  1.24258e+01 6.91428e-01 2.38912e+02 320.443 6.55471e+00  -5.41426e+00 0.00000e+00 0.00000e+00 2.01822e+02 320.443 3.70902e+01 140.443 0.9392 
1 1 1 9   36  3  o 6  4.14016e+01 8.44686e-01 7.35255e+02 112.767 -3.59494e+01 8.56581e+01  0.00000e+00 0.00000e+00 8.20167e+02 112.767 8.49113e+01 112.767 0.9946 
1 1 1 9   36  4  o 18 6.14426e+00 1.38888e+00 1.73625e+02 66.283  1.38350e+00  3.14918e+00  0.00000e+00 0.00000e+00 2.08675e+01 66.283  1.52757e+02 246.283 0.8379 
1 1 1 9   36  5  o 19 4.86054e+00 1.28751e+00 1.10747e+02 295.770 9.07999e-01  -1.88078e+00 0.00000e+00 0.00000e+00 1.99649e+01 295.770 9.07825e+01 115.770 0.7118 
1 1 1 9   36  6  o 19 2.85667e+01 9.57093e-01 4.95474e+02 107.184 -2.02260e+01 6.54024e+01  0.00000e+00 0.00000e+00 5.75947e+02 107.184 8.04729e+01 107.184 0.9927 
1 1 1 9   36  7  o 4  5.79776e+00 1.44055e+00 1.19830e+02 14.953  3.44582e+00  9.20250e-01  0.00000e+00 0.00000e+00 6.51580e+01 14.953  5.46723e+01 194.953 0.8445 
1 1 1 9   36  8  f 0  1.68081e+01 1.16820e+00 2.13435e+02 344.668 2.23654e+01  -6.13188e+00 0.00000e+00 0.00000e+00 4.07698e+02 344.668 1.94263e+02 344.668 0.9782 
1 1 1 9   36  9  o 3  1.22059e+01 1.75794e+00 2.31925e+02 254.940 -4.58367e+00 -1.70352e+01 0.00000e+00 0.00000e+00 2.15854e+02 254.940 1.60712e+01 74.940  0.9712 
1 1 1 9   36  10 o 2  6.88753e+00 1.62680e+00 7.40292e+01 135.749 -2.68147e+00 2.61228e+00  0.00000e+00 0.00000e+00 1.47806e+02 135.749 7.37764e+01 135.749 0.8529 
1 1 1 9   36  11 o 2  5.69705e+00 1.59055e+00 7.38954e+01 6.386   3.46640e+00  3.87948e-01  0.00000e+00 0.00000e+00 1.06877e+02 6.386   3.29813e+01 6.386   0.8405 
1 1 1 9   36  12 o 1  1.13581e+01 1.99597e+00 2.44437e+02 313.894 1.42268e+01  -1.47869e+01 0.00000e+00 0.00000e+00 1.73646e+02 313.894 7.07913e+01 133.894 0.9753 
1 1 1 9   36  13 o 13 5.24907e+00 1.64108e+00 4.16225e+01 256.949 -4.96496e-01 -2.14183e+00 0.00000e+00 0.00000e+00 1.02506e+02 256.949 6.08839e+01 256.949 0.7278 
1 1 1 9   37  0  o 7  3.68502e+01 8.45061e-01 6.13814e+02 55.435  3.53646e+01  5.13316e+01  0.00000e+00 0.00000e+00 7.65654e+02 55.435  1.51840e+02 55.435  0.9919 
1 1 1 9   37  1  o 5  1.43956e+01 7.15495e-01 1.58784e+02 215.615 -5.57638e+00 -3.99455e+00 0.00000e+00 0.00000e+00 3.43323e+02 215.615 1.84539e+02 215.615 0.9239 
1 1 1 9   37  2  o 15 2.82644e+01 7.91614e-01 4.92347e+02 159.916 -4.16016e+01 1.52105e+01  0.00000e+00 0.00000e+00 5.62836e+02 159.916 7.04893e+01 159.916 0.9886 
1 1 1 9   37  3  o 18 1.16684e+01 7.77617e-01 1.13604e+02 271.170 8.56178e-02  -4.19134e+00 0.00000e+00 0.00000e+00 2.70043e+02 271.170 1.56439e+02 271.170 0.8705 
1 1 1 9   37  4  o 3  4.21336e+01 1.04516e+00 6.77008e+02 108.516 -2.99478e+01 8.94224e+01  0.00000e+00 0.00000e+00 9.06118e+02 108.516 2.29110e+02 108.516 0.9947 
1 1 1 9   37  5  o 9  2.08671e+01 7.82839e-01 3.44571e+02 161.448 -2.94693e+01 9.88975e+00  0.00000e+00 0.00000e+00 4.30961e+02 161.448 8.63904e+01 161.448 0.9838 
1 1 1 9   37  6  o 9  2.26172e+01 9.42544e-01 4.71322e+02 296.928 2.50203e+01  -4.92573e+01 0.00000e+00 0.00000e+00 3.75367e+02 296.928 9.59544e+01 116.928 0.9909 
1 1 1 9   37  7  o 7  2.24234e+01 8.34523e-01 3.73263e+02 80.561  8.28722e+00  4.98498e+01  0.00000e+00 0.00000e+00 4.65422e+02 80.561  9.21591e+01 80.561  0.9901 
1 1 1 9   37  8  o 15 8.48541e+00 1.67440e+00 1.81775e+02 104.920 -2.27287e+00 8.52977e+00  0.00000e+00 0.00000e+00 1.20013e+02 104.920 6.17627e+01 284.920 0.9415 
1 1 1 9   37  9  o 16 1.09232e+01 1.35646e+00 2.24375e+02 289.352 5.92960e+00  -1.68833e+01 0.00000e+00 0.00000e+00 1.76478e+02 289.352 4.78970e+01 109.352 0.9716 
1 1 1 9   37  10 o 18 8.83157e+00 1.57837e+00 2.69698e+02 124.809 -1.01866e+01 1.46516e+01  0.00000e+00 0.00000e+00 5.42999e+01 124.809 2.15398e+02 304.809 0.9716 
1 1 1 9   37  11 o 12 6.39767e+00 1.63447e+00 1.33564e+02 34.829  6.03897e+00  4.20166e+00  0.00000e+00 0.00000e+00 9.08742e+01 34.829  4.26894e+01 214.829 0.9293 
1 1 1 9   37  12 o 3  1.09164e+01 1.71881e+00 9.50227e+01 34.398  7.30917e+00  5.00424e+00  0.00000e+00 0.00000e+00 2.92926e+02 34.398  1.97903e+02 34.398  0.9417 
1 1 1 9   37  13 o 17 6.72589e+00 1.84727e+00 1.38762e+02 347.441 7.72908e+00  -1.72189e+00 0.00000e+00 0.00000e+00 9.83417e+01 347.441 4.04201e+01 167.441 0.9345 
1 1 1 9   38  0  o 7  2.77678e+01 6.52582e-01 4.44538e+02 313.276 2.55019e+01  -2.70843e+01 0.00000e+00 0.00000e+00 5.89089e+02 313.276 1.44552e+02 313.276 0.9865 
1 1 1 9   38  1  o 18 1.66897e+01 7.05584e-01 1.51799e+02 290.787 2.56903e+00  -6.76754e+00 0.00000e+00 0.00000e+00 4.32897e+02 290.787 2.81098e+02 290.787 0.9281 
1 1 1 9   38  2  o 19 2.43837e+01 6.62330e-01 4.96003e+02 88.508  9.78328e-01  3.75695e+01  0.00000e+00 0.00000e+00 4.12329e+02 88.508  8.36740e+01 268.508 0.9866 
1 1 1 9   38  3  o 17 1.40426e+01 6.95835e-01 2.66531e+02 266.081 -8.39900e-01 -1.22590e+01 0.00000e+00 0.00000e+00 2.41733e+02 266.081 2.47982e+01 86.081  0.9584 
1 1 1 9   38  4  o 3  3.01323e+01 9.07759e-01 5.15014e+02 30.882  5.05724e+01  3.02459e+01  0.00000e+00 0.00000e+00 6.13412e+02 30.882  9.83984e+01 30.882  0.9915 
1 1 1 9   38  5  o 1  1.88126e+01 9.27565e-01 2.79778e+02 320.727 1.80181e+01  -1.47334e+01 0.00000e+00 0.00000e+00 4.15418e+02 320.727 1.35640e+02 320.727 0.9783 
1 1 1 9   38  6  o 15 7.94970e+00 1.38157e+00 1.87590e+02 273.323 4.06039e-01  -6.99285e+00 0.00000e+00 0.00000e+00 9.03649e+01 273.323 9.72248e+01 93.323  0.9256 
1 1 1 9   38  7  o 18 1.74510e+01 1.08124e+00 3.66004e+02 51.641  2.47004e+01  3.12103e+01  0.00000e+00 0.00000e+00 2.84856e+02 51.641  8.11482e+01 231.641 0.9874 
1 1 1 9   38  8  o 13 1.18304e+01 1.50513e+00 1.80691e+02 264.943 -1.21722e+00 -1.37544e+01 0.00000e+00 0.00000e+00 2.49649e+02 264.943 6.89573e+01 264.943 0.9631 
1 1 1 9   38  9  f 0  6.57107e+00 1.35867e+00 9.43296e+01 155.228 -4.28686e+00 1.97827e+00  0.00000e+00 0.00000e+00 1.25655e+02 155.228 3.13259e+01 155.228 0.8865 
1 1 1 9   38  10 o 6  1.32084e+01 1.33572e+00 1.74960e+02 38.609  1.56862e+01  1.25261e+01  0.00000e+00 0.00000e+00 3.11154e+02 38.609  1.36194e+02 38.609  0.9748 
1 1 1 9   38  11 o 3  3.79991e+00 1.23363e+00 7.12564e+01 288.454 8.76741e-01  -2.62729e+00 0.00000e+00 0.00000e+00 4.22551e+01 288.454 2.90013e+01 108.454 0.7914 
1 1 1 9   38  12 o 1  1.58141e+01 1.40815e+00 2.39691e+02 239.346 -2.14609e+01 -3.62107e+01 0.00000e+00 0.00000e+00 3.49888e+02 239.346 1.10198e+02 239.346 0.9880 
1 1 1 9   38  13 o 19 5.25041e+00 1.64824e+00 1.25222e+02 83.743  7.26851e-01  6.62908e+00  0.00000e+00 0.00000e+00 5.72927e+01 83.743  6.79294e+01 263.743 0.9216 
1 1 1 9   39  0  o 5  2.51520e+01 6.35801e-01 4.88514e+02 51.391  2.20016e+01  2.75519e+01  0.00000e+00 0.00000e+00 4.46932e+02 51.391  4.15814e+01 231.391 0.9857 
1 1 1 9   39  1  o 17 5.26062e+01 1.09806e+00 7.66502e+02 319.101 9.36290e+01  -8.11008e+01 0.00000e+00 0.00000e+00 1.21099e+03 319.101 4.44488e+02 319.101 0.9960 
1 1 1 9   39  2  o 2  2.57419e+01 8.40957e-01 4.12365e+02 84.736  3.06845e+00  3.33027e+01  0.00000e+00 0.00000e+00 5.44838e+02 84.736  1.32472e+02 84.736  0.9849 
1 1 1 9   39  3  o 18 1.23468e+01 7.55201e-01 2.22591e+02 353.194 9.60818e+00  -1.14666e+00 0.00000e+00 0.00000e+00 2.18848e+02 353.194 3.74276e+00 173.194 0.9468 
1 1 1 9   39  4  o 4  1.73674e+01 9.05007e-01 3.39488e+02 139.907 -1.87502e+01 1.57853e+01  0.00000e+00 0.00000e+00 3.02902e+02 139.907 3.65865e+01 319.907 0.9794 
1 1 1 9   39  5  o 13 1.35051e+01 1.00269e+00 1.89173e+02 203.202 -1.07867e+01 -4.62371e+00 0.00000e+00 0.00000e+00 2.98677e+02 203.202 1.09504e+02 203.202 0.9564 
1 1 1 9   39  6  o 4  2.76530e+01 1.00505e+00 5.09244e+02 344.423 7.56279e+01  -2.10824e+01 0.00000e+00 0.00000e+00 5.28571e+02 344.423 1.93276e+01 344.423 0.9936 
1 1 1 9   39  7  o 18 1.06677e+01 1.47056e+00 2.45560e+02 62.430  6.94250e+00  1.32966e+01  0.00000e+00 0.00000e+00 1.43689e+02 62.430  1.01871e+02 242.430 0.9661 
1 1 1 9   39  8  o 2  7.25585e+00 1.56041e+00 2.11300e+02 224.182 -6.65835e+00 -6.47100e+00 0.00000e+00 0.00000e+00 4.75204e+01 224.182 1.63780e+02 44.182  0.9445 
1 1 1 9   39  9  o 14 6.26685e+00 1.43668e+00 1.14734e+02 49.069  3.50872e+00  4.04618e+00  0.00000e+00 0.00000e+00 9.84837e+01 49.069  1.62502e+01 229.069 0.9010 
1 1 1 9   39  10 o 13 1.19264e+01 1.31756e+00 3.08981e+02 317.615 2.26388e+01  -2.06614e+01 0.00000e+00 0.00000e+00 1.33859e+02 317.615 1.75122e+02 137.615 0.9835 
1 1 1 9   39  11 o 17 7.20555e+00 1.62890e+00 1.34961e+02 22.197  7.89195e+00  3.22015e+00  0.00000e+00 0.00000e+00 1.20499e+02 22.197  1.44617e+01 202.197 0.9394 
1 1 1 9   39  12 o 8  4.08761e+00 1.34231e+00 7.73357e+01 244.305 -1.55325e+00 -3.22814e+00 0.00000e+00 0.00000e+00 5.30261e+01 244.305 2.43096e+01 64.305  0.8453 
1 1 1 9   39  13 o 14 5.04750e+00 1.60249e+00 9.73182e+01 330.131 4.27440e+00  -2.45486e+00 0.00000e+00 0.00000e+00 7.24285e+01 330.131 2.48898e+01 150.130 0.8917 
1 1 1 9   40  0  f 0  2.48804e+01 6.34478e-01 4.02741e+02 19.792  3.03526e+01  1.09231e+01  0.00000e+00 0.00000e+00 5.21244e+02 19.792  1.18502e+02 19.792  0.9844 
1 1 1 9   40  1  o 2  2.75762e+01 7.46862e-01 6.61593e+02 207.498 -4.98632e+01 -2.59545e+01 0.00000e+00 0.00000e+00 3.69808e+02 207.498 2.91785e+02 27.498  0.9911 
1 1 1 9   40  2  o 3  1.44231e+01 6.97554e-01 2.98217e+02 261.898 -1.92616e+00 -1.35299e+01 0.00000e+00 0.00000e+00 2.25930e+02 261.898 7.22866e+01 81.898  0.9627 
1 1 1 9   40  3  o 2  2.65441e+01 7.08496e-01 4.07938e+02 213.502 -3.10218e+01 -2.05342e+01 0.00000e+00 0.00000e+00 5.80731e+02 213.502 1.72793e+02 213.502 0.9865 
1 1 1 9   40  4  o 18 2.00019e+01 7.09386e-01 4.39902e+02 9.918   3.67589e+01  6.42755e+00  0.00000e+00 0.00000e+00 3.05235e+02 9.918   1.34667e+02 189.918 0.9865 
1 1 1 9   40  5  o 9  1.30661e+01 1.00407e+00 1.97288e+02 342.052 1.10084e+01  -3.56586e+00 0.00000e+00 0.00000e+00 2.74338e+02 342.052 7.70502e+01 342.052 0.9558 
1 1 1 9   40  6  f 0  1.34957e+01 1.24843e+00 3.86784e+02 148.986 -2.27186e+01 1.36582e+01  0.00000e+00 0.00000e+00 1.13203e+02 148.986 2.73581e+02 328.986 0.9810 
1 1 1 9   40  7  o 19 9.30233e+00 1.48304e+00 1.83910e+02 17.705  9.69661e+00  3.09560e+00  0.00000e+00 0.00000e+00 1.49669e+02 17.705  3.42409e+01 197.705 0.9495 
1 1 1 9   40  8  o 5  1.74000e+01 1.72929e+00 3.00726e+02 219.411 -2.44681e+01 -2.01062e+01 0.00000e+00 0.00000e+00 3.45880e+02 219.411 4.51542e+01 219.411 0.9841 
1 1 1 9   40  9  o 7  3.90956e+00 1.23157e+00 6.80473e+01 225.005 -1.51883e+00 -1.51907e+00 0.00000e+00 0.00000e+00 3.83296e+01 225.005 2.97177e+01 45.005  0.7207 
1 1 1 9   40  10 o 9  1.19617e+01 1.34600e+00 1.63567e+02 76.480  4.00446e+00  1.66548e+01  0.00000e+00 0.00000e+00 2.74579e+02 76.480  1.11011e+02 76.480  0.9704 
1 1 1 9   40  11 o 8  1.38256e+01 1.34886e+00 2.60870e+02 212.201 -3.11457e+01 -1.96141e+01 0.00000e+00 0.00000e+00 2.53739e+02 212.201 7.13073e+00 32.201  0.9863 
1 1 1 9   40  12 o 11 4.31587e+00 1.35770e+00 8.05327e+01 109.836 -1.33060e+00 3.68852e+00  0.00000e+00 0.00000e+00 5.95570e+01 109.836 2.09757e+01 289.836 0.8604 
1 1 1 9   40  13 o 9  6.02292e+00 1.77752e+00 9.68952e+01 263.550 -5.91028e-01 -5.22772e+00 0.00000e+00 0.00000e+00 1.07311e+02 263.550 1.04160e+01 263.550 0.8991 
1 1 1 9   41  0  o 16 1.90731e+01 6.88817e-01 2.93767e+02 324.985 1.41951e+01  -9.94518e+00 0.00000e+00 0.00000e+00 4.04639e+02 324.985 1.10872e+02 324.985 0.9707 
1 1 1 9   41  1  o 9  1.12451e+01 7.47737e-01 1.77446e+02 324.716 5.16736e+00  -3.65652e+00 0.00000e+00 0.00000e+00 2.11754e+02 324.716 3.43087e+01 324.716 0.9172 
1 1 1 9   41  2  o 4  1.56750e+01 6.87032e-01 1.81520e+02 225.584 -6.52648e+00 -6.66085e+00 0.00000e+00 0.00000e+00 3.77451e+02 225.584 1.95930e+02 225.584 0.9448 
1 1 1 9   41  3  o 16 3.37773e+01 7.64115e-01 6.82016e+02 109.289 -2.94228e+01 8.40704e+01  0.00000e+00 0.00000e+00 5.85999e+02 109.289 9.60172e+01 289.289 0.9944 
1 1 1 9   41  4  o 1  2.31997e+01 7.13360e-01 4.72802e+02 131.863 -3.19203e+01 3.56225e+01  0.00000e+00 0.00000e+00 3.93981e+02 131.863 7.88212e+01 311.863 0.9895 
1 1 1 9   41  5  o 4  1.18124e+01 1.07618e+00 1.85162e+02 152.991 -9.21879e+00 4.69898e+00  0.00000e+00 0.00000e+00 2.38761e+02 152.991 5.35987e+01 152.991 0.9504 
1 1 1 9   41  6  o 12 1.68151e+01 1.07578e+00 2.61673e+02 60.377  1.15616e+01  2.03333e+01  0.00000e+00 0.00000e+00 3.59591e+02 60.377  9.79176e+01 60.377  0.9784 
1 1 1 9   41  7  o 9  1.26122e+01 1.27933e+00 1.68871e+02 107.901 -4.17334e+00 1.29205e+01  0.00000e+00 0.00000e+00 2.89498e+02 107.901 1.20627e+02 107.901 0.9624 
1 1 1 9   41  8  o 9  8.35139e+00 1.89085e+00 8.80116e+01 152.964 -3.74338e+00 1.91031e+00  0.00000e+00 0.00000e+00 1.86607e+02 152.964 9.85951e+01 152.964 0.8709 
1 1 1 9   41  9  o 8  9.59156e+00 1.45541e+00 2.30819e+02 72.580  5.29195e+00  1.68656e+01  0.00000e+00 0.00000e+00 1.20887e+02 72.580  1.09932e+02 252.580 0.9713 
1 1 1 9   41  10 o 12 1.75427e+01 1.17138e+00 2.98327e+02 204.565 -4.67528e+01 -2.13701e+01 0.00000e+00 0.00000e+00 3.57331e+02 204.565 5.90041e+01 204.565 0.9902 
1 1 1 9   41  11 o 16 8.57556e+00 1.64461e+00 1.98189e+02 10.459  1.45585e+01  2.68739e+00  0.00000e+00 0.00000e+00 1.14269e+02 10.459  8.39195e+01 190.459 0.9656 
1 1 1 9   41  12 o 4  5.60627e+00 1.63483e+00 7.05290e+01 289.755 1.27493e+00  -3.54994e+00 0.00000e+00 0.00000e+00 1.10098e+02 289.755 3.95688e+01 289.755 0.8541 
1 1 1 9   41  13 o 4  5.44764e+00 1.67863e+00 5.47631e+01 51.517  1.86253e+00  2.34299e+00  0.00000e+00 0.00000e+00 1.11507e+02 51.517  5.67441e+01 51.517  0.8095 
1 1 1 9   42  0  o 3  2.29292e+01 6.28719e-01 4.19637e+02 276.365 3.41381e+00  -3.06026e+01 0.00000e+00 0.00000e+00 4.31046e+02 276.365 1.14094e+01 276.365 0.9836 
1 1 1 9   42  1  o 3  7.96723e+00 8.33551e-01 1.61377e+02 326.924 3.49078e+00  -2.27356e+00 0.00000e+00 0.00000e+00 1.00035e+02 326.924 6.13428e+01 146.924 0.8696 
1 1 1 9   42  2  f 0  2.43536e+01 6.67928e-01 4.40065e+02 145.260 -3.11715e+01 2.16165e+01  0.00000e+00 0.00000e+00 4.66864e+02 145.260 2.67997e+01 145.260 0.9867 
1 1 1 9   42  3  o 19 1.59494e+01 7.12105e-01 2.94824e+02 19.687  1.88771e+01  6.75422e+00  0.00000e+00 0.00000e+00 2.92035e+02 19.687  2.78887e+00 199.687 0.9747 
1 1 1 9   42  4  o 10 1.75207e+01 8.80378e-01 3.07061e+02 288.912 7.76475e+00  -2.26635e+01 0.00000e+00 0.00000e+00 3.40465e+02 288.912 3.34033e+01 288.912 0.9789 
1 1 1 9   42  5  o 9  1.71385e+01 9.33058e-01 3.24049e+02 176.810 -2.87669e+01 1.60329e+00  0.00000e+00 0.00000e+00 3.11728e+02 176.810 1.23211e+01 356.810 0.9825 
1 1 1 9   42  6  o 1  5.91670e+00 1.37841e+00 1.25986e+02 290.065 1.33425e+00  -3.65288e+00 0.00000e+00 0.00000e+00 6.59456e+01 290.065 6.00401e+01 110.065 0.8591 
1 1 1 9   42  7  o 18 1.02980e+01 1.82564e+00 1.84127e+02 244.329 -4.28691e+00 -8.91904e+00 0.00000e+00 0.00000e+00 1.84494e+02 244.329 3.66439e-01 244.329 0.9480 
1 1 1 9   42  8  o 1  7.54392e+00 1.46384e+00 2.17492e+02 338.763 1.07502e+01  -4.17778e+00 0.00000e+00 0.00000e+00 5.46774e+01 338.763 1.62815e+02 158.763 0.9556 
1 1 1 9   42  9  o 17 1.01423e+01 1.36779e+00 2.52102e+02 185.357 -2.08121e+01 -1.95145e+00 0.00000e+00 0.00000e+00 1.21475e+02 185.357 1.30627e+02 5.357   0.9758 
1 1 1 9   42  10 o 10 7.28622e+00 1.55254e+00 2.14830e+02 52.362  8.17029e+00  1.05946e+01  0.00000e+00 0.00000e+00 4.96639e+01 52.362  1.65167e+02 232.362 0.9619 
1 1 1 9   42  11 o 17 7.25176e+00 1.70715e+00 1.75988e+02 295.455 4.72336e+00  -9.92269e+00 0.00000e+00 0.00000e+00 8.48524e+01 295.455 9.11356e+01 115.455 0.9534 
1 1 1 9   42  12 o 7  5.20308e+00 1.55514e+00 1.00558e+02 166.419 -5.10097e+00 1.23226e+00  0.00000e+00 0.00000e+00 7.58282e+01 166.419 2.47300e+01 346.419 0.8988 
1 1 1 9   42  13 o 9  5.85842e+00 1.59945e+00 1.34297e+02 298.538 3.95506e+00  -7.27283e+00 0.00000e+00 0.00000e+00 7.27686e+01 298.538 6.15282e+01 118.538 0.9375 
1 1 1 9   43  0  o 12 1.43232e+01 6.50921e-01 2.76323e+02 256.779 -2.97903e+00 -1.26799e+01 0.00000e+00 0.00000e+00 2.42690e+02 256.779 3.36322e+01 76.779  0.9608 
1 1 1 9   43  1  f 0  3.08457e+01 8.00911e-01 4.82656e+02 80.503  8.60358e+00  5.14271e+01  0.00000e+00 0.00000e+00 6.69820e+02 80.503  1.87164e+02 80.503  0.9904 
1 1 1 9   43  2  o 13 1.01985e+01 1.01785e+00 1.68105e+02 120.923 -2.91799e+00 4.87107e+00  0.00000e+00 0.00000e+00 1.80977e+02 120.923 1.28720e+01 120.923 0.9071 
1 1 1 9   43  3  o 13 3.71593e+00 1.07970e+00 7.01717e+01 301.972 5.56186e-01  -8.91039e-01 0.00000e+00 0.00000e+00 5.09926e+00 121.972 7.52709e+01 121.972 0.4640 
1 1 1 9   43  4  o 6  2.91281e+01 8.94022e-01 4.16473e+02 97.447  -7.34981e+00 5.62302e+01  0.00000e+00 0.00000e+00 6.73373e+02 97.447  2.56901e+02 97.447  0.9911 
1 1 1 9   43  5  o 16 2.47273e+01 8.86449e-01 3.68293e+02 322.320 4.12490e+01  -3.18573e+01 0.00000e+00 0.00000e+00 5.56242e+02 322.320 1.87948e+02 322.320 0.9904 
1 1 1 9   43  6  o 13 6.30165e+00 1.53762e+00 1.25223e+02 240.952 -1.94100e+00 -3.49480e+00 0.00000e+00 0.00000e+00 8.02000e+01 240.952 4.50226e+01 60.952  0.8634 
1 1 1 9   43  7  o 5  1.30961e+01 1.53586e+00 3.01753e+02 90.902  -3.74377e-01 2.37727e+01  0.00000e+00 0.00000e+00 1.82151e+02 90.902  1.19602e+02 270.902 0.9787 
1 1 1 9   43  8  o 9  4.62741e+00 1.31906e+00 8.20952e+01 12.426  2.74972e+00  6.05875e-01  0.00000e+00 0.00000e+00 5.68429e+01 12.426  2.52523e+01 192.426 0.7954 
1 1 1 9   43  9  f 0  5.17489e+00 1.37659e+00 1.41328e+02 105.550 -1.65250e+00 5.93871e+00  0.00000e+00 0.00000e+00 3.73571e+01 105.550 1.03971e+02 285.550 0.9148 
1 1 1 9   43  10 o 12 9.02651e+00 1.54244e+00 1.82328e+02 58.066  7.70276e+00  1.23589e+01  0.00000e+00 0.00000e+00 1.46379e+02 58.066  3.59491e+01 238.066 0.9650 
1 1 1 9   43  11 o 3  9.31410e+00 1.44905e+00 1.29910e+02 170.007 -1.13896e+01 2.00691e+00  0.00000e+00 0.00000e+00 2.05909e+02 170.007 7.59999e+01 170.007 0.9557 
1 1 1 9   43  12 o 5  5.40367e+00 1.58288e+00 1.03361e+02 48.016  3.68722e+00  4.09741e+00  0.00000e+00 0.00000e+00 8.08683e+01 48.016  2.24924e+01 228.016 0.9040 
1 1 1 9   43  13 o 6  5.28213e+00 1.62394e+00 9.59267e+01 256.780 -1.21658e+00 -5.17888e+00 0.00000e+00 0.00000e+00 8.33417e+01 256.780 1.25850e+01 76.780  0.9003 
1 1 1 9   44  0  o 6  4.13469e+01 8.23149e-01 6.85043e+02 161.020 -9.34643e+01 3.21453e+01  0.00000e+00 0.00000e+00 8.66206e+02 161.020 1.81164e+02 161.020 0.9949 
1 1 1 9   44  1  o 3  1.07992e+01 7.55528e-01 2.04171e+02 180.942 -7.53287e+00 -1.23905e-01 0.00000e+00 0.00000e+00 1.75105e+02 180.942 2.90661e+01 0.942   0.9311 
1 1 1 9   44  2  o 8  2.37467e+01 6.70118e-01 4.11630e+02 6.687   3.77904e+01  4.43039e+00  0.00000e+00 0.00000e+00 4.72526e+02 6.687   6.08956e+01 6.687   0.9868 
1 1 1 9   44  3  o 2  1.71010e+01 8.04055e-01 2.39727e+02 295.118 7.50219e+00  -1.60025e+01 0.00000e+00 0.00000e+00 3.87128e+02 295.118 1.47401e+02 295.118 0.9713 
1 1 1 9   44  4  o 14 2.85352e+01 9.05864e-01 4.40510e+02 152.919 -5.09980e+01 2.60752e+01  0.00000e+00 0.00000e+00 6.27119e+02 152.919 1.86609e+02 152.919 0.9912 
1 1 1 9   44  5  o 19 1.61080e+01 1.10409e+00 2.94194e+02 14.244  2.41632e+01  6.13411e+00  0.00000e+00 0.00000e+00 3.01540e+02 14.244  7.34525e+00 14.244  0.9797 
1 1 1 9   44  6  o 19 3.82539e+01 1.31769e+00 6.89989e+02 180.081 -1.53893e+02 -2.17774e-01 0.00000e+00 0.00000e+00 7.49388e+02 180.081 5.93990e+01 180.081 0.9967 
1 1 1 9   44  7  o 7  7.03642e+00 1.76424e+00 1.67634e+02 44.050  4.96633e+00  4.80424e+00  0.00000e+00 0.00000e+00 7.79289e+01 44.050  8.97052e+01 224.050 0.9245 
1 1 1 9   44  8  o 6  1.41747e+01 1.02660e+00 2.54400e+02 257.410 -6.43576e+00 -2.88149e+01 0.00000e+00 0.00000e+00 2.71480e+02 257.410 1.70799e+01 257.410 0.9829 
1 1 1 9   44  9  o 17 6.15920e+00 1.41387e+00 1.42727e+02 39.266  5.48870e+00  4.48697e+00  0.00000e+00 0.00000e+00 7.26342e+01 39.266  7.00930e+01 219.266 0.9265 
1 1 1 9   44  10 o 7  8.80293e+00 1.48483e+00 1.20863e+02 125.015 -5.55289e+00 7.92602e+00  0.00000e+00 0.00000e+00 1.93619e+02 125.015 7.27556e+01 125.015 0.9468 
1 1 1 9   44  11 o 14 4.49398e+00 1.39626e+00 1.19335e+02 168.641 -5.29687e+00 1.06409e+00  0.00000e+00 0.00000e+00 3.35585e+01 168.641 8.57765e+01 348.641 0.9020 
1 1 1 9   44  12 o 7  3.79715e+00 1.26487e+00 2.68507e+01 99.497  -2.06044e-01 1.23170e+00  0.00000e+00 0.00000e+00 4.86973e+01 99.497  2.18465e+01 99.497  0.5276 
1 1 1 9   44  13 o 3  4.77258e+00 1.52993e+00 8.74312e+01 332.982 3.99419e+00  -2.03676e+00 0.00000e+00 0.00000e+00 7.08435e+01 332.982 1.65878e+01 152.982 0.8798 
1 1 1 9   45  0  o 18 1.36758e+01 7.73954e-01 1.50409e+02 219.593 -5.39994e+00 -4.46606e+00 0.00000e+00 0.00000e+00 3.26877e+02 219.593 1.76468e+02 219.593 0.9256 
1 1 1 9   45  1  o 18 2.30197e+01 6.48812e-01 4.06653e+02 46.065  2.53792e+01  2.63410e+01  0.00000e+00 0.00000e+00 4.49630e+02 46.065  4.29771e+01 46.065  0.9862 
1 1 1 9   45  2  o 17 3.59231e+01 7.74746e-01 5.56693e+02 266.863 -4.61392e+00 -8.41866e+01 0.00000e+00 0.00000e+00 7.90529e+02 266.863 2.33836e+02 266.863 0.9941 
1 1 1 9   45  3  o 6  1.84914e+01 6.82961e-01 4.04217e+02 139.775 -2.60785e+01 2.20574e+01  0.00000e+00 0.00000e+00 2.83266e+02 139.775 1.20951e+02 319.775 0.9853 
1 1 1 9   45  4  o 2  3.32778e+01 9.32719e-01 5.35454e+02 51.731  5.35073e+01  6.78278e+01  0.00000e+00 0.00000e+00 7.13186e+02 51.731  1.77732e+02 51.731  0.9942 
1 1 1 9   45  5  o 7  5.46132e+00 1.33202e+00 1.55332e+02 76.355  1.00295e+00  4.13136e+00  0.00000e+00 0.00000e+00 2.45259e+01 76.355  1.30807e+02 256.355 0.8725 
1 1 1 9   45  6  o 6  1.33934e+01 1.31735e+00 1.69783e+02 160.663 -1.28552e+01 4.51109e+00  0.00000e+00 0.00000e+00 3.16829e+02 160.663 1.47046e+02 160.663 0.9626 
1 1 1 9   45  7  o 2  1.34380e+01 1.73348e+00 2.02927e+02 75.336  3.92526e+00  1.50007e+01  0.00000e+00 0.00000e+00 2.87635e+02 75.336  8.47083e+01 75.336  0.9672 
1 1 1 9   45  8  f 0  9.03667e+00 1.30682e+00 2.03406e+02 103.523 -3.33907e+00 1.38834e+01  0.00000e+00 0.00000e+00 1.25473e+02 103.523 7.79332e+01 283.523 0.9643 
1 1 1 9   45  9  o 15 9.73942e+00 1.36499e+00 2.68885e+02 111.048 -8.07481e+00 2.09826e+01  0.00000e+00 0.00000e+00 9.03578e+01 111.048 1.78527e+02 291.048 0.9775 
1 1 1 9   45  10 o 15 7.29118e+00 1.57058e+00 1.87500e+02 103.750 -2.71769e+00 1.11060e+01  0.00000e+00 0.00000e+00 7.52495e+01 103.750 1.12250e+02 283.750 0.9552 
1 1 1 9   45  11 o 8  5.96390e+00 1.57411e+00 1.14245e+02 101.509 -1.27242e+00 6.24931e+00  0.00000e+00 0.00000e+00 9.22091e+01 101.509 2.20364e+01 281.509 0.9179 
1 1 1 9   45  12 o 9  4.90926e+00 1.50510e+00 8.91904e+01 118.153 -2.09186e+00 3.90901e+00  0.00000e+00 0.00000e+00 7.33848e+01 118.153 1.58055e+01 298.153 0.8783 
1 1 1 9   45  13 o 14 4.09496e+00 1.36947e+00 1.02841e+02 144.548 -4.31885e+00 3.07513e+00  0.00000e+00 0.00000e+00 3.60460e+01 144.548 6.67954e+01 324.548 0.8999 
1 1 1 9   46  0  o 8  3.02956e+01 6.93119e-01 4.90726e+02 208.649 -5.06895e+01 -2.76932e+01 0.00000e+00 0.00000e+00 6.41483e+02 208.649 1.50758e+02 208.649 0.9913 
1 1 1 9   46  1  o 9  1.77779e+01 1.02488e+00 2.13464e+02 88.365  4.41447e-01  1.54691e+01  0.00000e+00 0.00000e+00 4.34948e+02 88.365  2.21484e+02 88.365  0.9671 
1 1 1 9   46  2  f 0  2.32036e+01 6.63704e-01 4.81422e+02 346.707 4.76856e+01  -1.12666e+01 0.00000e+00 0.00000e+00 3.84901e+02 346.707 9.65215e+01 166.707 0.9897 
1 1 1 9   46  3  o 6  2.47245e+01 8.17538e-01 4.49580e+02 123.182 -2.87520e+01 4.39683e+01  0.00000e+00 0.00000e+00 4.74364e+02 123.182 2.47841e+01 123.182 0.9904 
1 1 1 9   46  4  o 2  1.04135e+01 1.04587e+00 2.26055e+02 46.207  8.25696e+00  8.61254e+00  0.00000e+00 0.00000e+00 1.50063e+02 46.207  7.59917e+01 226.207 0.9571 
1 1 1 9   46  5  o 2  1.26667e+01 9.85770e-01 1.83592e+02 148.123 -1.13530e+01 7.06028e+00  0.00000e+00 0.00000e+00 2.76201e+02 148.123 9.26087e+01 148.123 0.9618 
1 1 1 9   46  6  o 13 2.09708e+01 1.17053e+00 4.23168e+02 151.135 -5.08428e+01 2.80260e+01  0.00000e+00 0.00000e+00 3.61433e+02 151.135 6.17355e+01 331.135 0.9913 
1 1 1 9   46  7  o 4  1.17762e+01 1.29901e+00 1.87091e+02 123.504 -8.64538e+00 1.30595e+01  0.00000e+00 0.00000e+00 2.42902e+02 123.504 5.58113e+01 123.504 0.9675 
1 1 1 9   46  8  o 19 5.57603e+00 1.34996e+00 1.11974e+02 254.583 -1.27905e+00 -4.63820e+00 0.00000e+00 0.00000e+00 7.50459e+01 254.583 3.69277e+01 74.583  0.8888 
1 1 1 9   46  9  o 12 1.65614e+01 1.12071e+00 3.12663e+02 153.261 -4.16437e+01 2.09799e+01  0.00000e+00 0.00000e+00 3.05456e+02 153.261 7.20784e+00 333.261 0.9892 
1 1 1 9   46  10 o 13 3.56662e+00 1.18179e+00 4.11226e+01 145.569 -1.31217e+00 8.99506e-01  0.00000e+00 0.00000e+00 4.19962e+01 145.569 8.73622e-01 145.569 0.6178 
1 1 1 9   46  11 f 0  3.79901e+00 1.24948e+00 3.75108e+01 210.109 -1.35757e+00 -7.87255e-01 0.00000e+00 0.00000e+00 5.02825e+01 210.109 1.27717e+01 210.109 0.6128 
1 1 1 9   46  12 o 6  4.92422e+00 1.47414e+00 7.01272e+01 268.531 -9.88432e-02 -3.85490e+00 0.00000e+00 0.00000e+00 8.91010e+01 268.531 1.89738e+01 268.531 0.8578 
1 1 1 9   46  13 o 9  4.16035e+00 1.39713e+00 6.67627e+01 226.617 -2.33534e+00 -2.47104e+00 0.00000e+00 0.00000e+00 6.42542e+01 226.617 2.50855e+00 46.617  0.8357 
1 1 1 9   47  0  o 7  1.43288e+01 6.44425e-01 2.61596e+02 30.303  1.38527e+01  8.09599e+00  0.00000e+00 0.00000e+00 2.61417e+02 30.303  1.79303e-01 210.303 0.9683 
1 1 1 9   47  1  o 3  2.95785e+01 7.41948e-01 4.67028e+02 297.718 2.70912e+01  -5.15611e+01 0.00000e+00 0.00000e+00 6.38690e+02 297.718 1.71663e+02 297.718 0.9914 
1 1 1 9   47  2  o 17 2.35043e+01 6.77593e-01 3.31734e+02 183.367 -3.56031e+01 -2.09437e+00 0.00000e+00 0.00000e+00 5.42277e+02 183.367 2.10543e+02 183.367 0.9859 
1 1 1 9   47  3  o 8  6.78704e+00 1.26808e+00 2.46576e+02 6.245   7.09285e+00  7.76208e-01  0.00000e+00 0.00000e+00 9.21803e+00 186.245 2.55794e+02 186.245 0.9270 
1 1 1 9   47  4  o 14 3.01345e+01 1.06821e+00 4.87309e+02 204.498 -7.35087e+01 -3.34963e+01 0.00000e+00 0.00000e+00 6.42648e+02 204.498 1.55339e+02 204.498 0.9938 
1 1 1 9   47  5  o 15 1.25450e+01 1.46653e+00 3.19104e+02 19.493  1.95306e+01  6.91336e+00  0.00000e+00 0.00000e+00 1.42706e+02 19.493  1.76398e+02 199.493 0.9756 
1 1 1 9   47  6  o 11 8.26145e+00 1.60284e+00 2.18571e+02 165.446 -9.86376e+00 2.56082e+00  0.00000e+00 0.00000e+00 7.74648e+01 165.446 1.41106e+02 345.446 0.9496 
1 1 1 9   47  7  o 13 6.16755e+00 1.28676e+00 1.89926e+02 58.366  4.42767e+00  7.18762e+00  0.00000e+00 0.00000e+00 2.85497e+01 58.366  1.61376e+02 238.366 0.9388 
1 1 1 9   47  8  o 11 1.42121e+01 1.02898e+00 2.57984e+02 261.975 -4.43727e+00 -3.14731e+01 0.00000e+00 0.00000e+00 2.69746e+02 261.975 1.17620e+01 261.975 0.9841 
1 1 1 9   47  9  o 12 5.06491e+00 1.33899e+00 1.04739e+02 106.210 -1.30125e+00 4.47608e+00  0.00000e+00 0.00000e+00 6.43389e+01 106.210 4.04003e+01 286.210 0.8849 
1 1 1 9   47  10 o 13 7.49190e+00 1.58430e+00 1.29237e+02 255.878 -2.02700e+00 -8.05660e+00 0.00000e+00 0.00000e+00 1.35736e+02 255.878 6.49855e+00 255.878 0.9377 
1 1 1 9   47  11 o 3  3.88477e+00 1.23829e+00 7.37465e+01 194.199 -3.40431e+00 -8.61373e-01 0.00000e+00 0.00000e+00 4.95462e+01 194.199 2.42003e+01 14.199  0.8417 
1 1 1 9   47  12 o 2  7.05004e+00 1.70802e+00 1.39677e+02 111.985 -3.39655e+00 8.41305e+00  0.00000e+00 0.00000e+00 1.10959e+02 111.985 2.87175e+01 291.985 0.9432 
1 1 1 9   47  13 f 0  4.78137e+00 1.53925e+00 4.08367e+01 289.215 7.27385e-01  -2.08703e+00 0.00000e+00 0.00000e+00 9.05734e+01 289.215 4.97366e+01 289.215 0.7294 
1 1 1 9   48  0  o 3  1.54920e+01 6.16882e-01 2.82630e+02 203.494 -1.71345e+01 -7.44828e+00 0.00000e+00 0.00000e+00 2.85417e+02 203.494 2.78659e+00 203.494 0.9729 
1 1 1 9   48  1  o 10 1.73371e+01 6.40108e-01 2.50046e+02 106.248 -5.31876e+00 1.82499e+01  0.00000e+00 0.00000e+00 3.86175e+02 106.248 1.36129e+02 106.248 0.9733 
1 1 1 9   48  2  o 13 2.11839e+01 7.28005e-01 2.42947e+02 73.563  6.96853e+00  2.36202e+01  0.00000e+00 0.00000e+00 5.39567e+02 73.563  2.96620e+02 73.563  0.9795 
1 1 1 9   48  3  o 2  2.63239e+01 9.85779e-01 4.29274e+02 332.412 4.80429e+01  -2.51031e+01 0.00000e+00 0.00000e+00 5.54482e+02 332.412 1.25207e+02 332.412 0.9907 
1 1 1 9   48  4  o 18 2.56369e+01 1.02051e+00 4.69774e+02 188.271 -6.36586e+01 -9.25428e+00 0.00000e+00 0.00000e+00 4.89866e+02 188.271 2.00914e+01 188.271 0.9922 
1 1 1 9   48  5  o 11 1.61026e+01 1.20139e+00 2.05962e+02 88.116  6.57029e-01  1.99793e+01  0.00000e+00 0.00000e+00 3.86190e+02 88.116  1.80228e+02 88.116  0.9747 
1 1 1 9   48  6  o 6  7.51803e+00 1.77354e+00 1.65382e+02 358.066 6.86127e+00  -2.31737e-01 0.00000e+00 0.00000e+00 9.67191e+01 358.066 6.86628e+01 178.066 0.9240 
1 1 1 9   48  7  o 7  1.64438e+01 9.16550e-01 3.67420e+02 320.021 3.92889e+01  -3.29431e+01 0.00000e+00 0.00000e+00 2.46915e+02 320.021 1.20505e+02 140.021 0.9902 
1 1 1 9   48  8  o 4  1.21754e+01 1.10883e+00 2.61571e+02 114.621 -1.22114e+01 2.66464e+01  0.00000e+00 0.00000e+00 1.89852e+02 114.621 7.17192e+01 294.621 0.9828 
1 1 1 9   48  9  o 11 3.42047e+00 1.11837e+00 6.84063e+01 354.855 2.34211e+00  -2.10865e-01 0.00000e+00 0.00000e+00 2.80800e+01 354.855 4.03263e+01 174.855 0.7478 
1 1 1 9   48  10 o 15 1.07286e+01 1.46692e+00 1.33278e+02 211.180 -1.17319e+01 -7.09946e+00 0.00000e+00 0.00000e+00 2.56271e+02 211.180 1.22993e+02 211.180 0.9628 
1 1 1 9   48  11 o 6  5.74256e+00 1.55324e+00 1.64970e+02 37.518  7.52997e+00  5.78180e+00  0.00000e+00 0.00000e+00 3.97905e+01 37.518  1.25179e+02 217.518 0.9458 
1 1 1 9   48  12 f 0  5.36979e+00 1.58857e+00 4.37839e+01 277.591 3.26972e-01  -2.45364e+00 0.00000e+00 0.00000e+00 1.10486e+02 277.591 6.67024e+01 277.591 0.7623 
1 1 1 9   48  13 o 8  4.39594e+00 1.44065e+00 1.17928e+02 42.511  4.38473e+00  4.01948e+00  0.00000e+00 0.00000e+00 3.30325e+01 42.511  8.48958e+01 222.511 0.9115 
1 1 1 9   49  0  o 12 1.37676e+01 1.14122e+00 1.86301e+02 247.445 -4.01191e+00 -9.65920e+00 0.00000e+00 0.00000e+00 3.07070e+02 247.445 1.20768e+02 247.445 0.9509 
1 1 1 9   49  1  o 9  1.39340e+01 7.60256e-01 2.30455e+02 261.330 -2.18379e+00 -1.43222e+01 0.00000e+00 0.00000e+00 2.76360e+02 261.330 4.59054e+01 261.330 0.9648 
1 1 1 9   49  2  o 13 1.32031e+01 7.73160e-01 1.66557e+02 244.199 -4.44141e+00 -9.18697e+00 0.00000e+00 0.00000e+00 3.06242e+02 244.199 1.39686e+02 244.199 0.9497 
1 1 1 9   49  3  o 5  1.42897e+01 1.04556e+00 3.88709e+02 152.045 -2.48327e+01 1.31786e+01  0.00000e+00 0.00000e+00 1.40563e+02 152.045 2.48146e+02 332.045 0.9821 
1 1 1 9   49  4  o 17 8.40947e+00 1.27915e+00 2.40658e+02 359.250 1.02543e+01  -1.34222e-01 0.00000e+00 0.00000e+00 6.06716e+01 359.250 1.79987e+02 179.250 0.9499 
1 1 1 9   49  5  o 11 9.43286e+00 1.48608e+00 1.82842e+02 63.610  4.36013e+00  8.78719e+00  0.00000e+00 0.00000e+00 1.54352e+02 63.610  2.84900e+01 243.610 0.9476 
1 1 1 9   49  6  f 0  8.88013e+00 1.53128e+00 1.75059e+02 332.873 8.85010e+00  -4.53414e+00 0.00000e+00 0.00000e+00 1.42631e+02 332.873 3.24278e+01 152.873 0.9483 
1 1 1 9   49  7  o 4  8.84413e+00 1.29074e+00 8.93876e+01 151.415 -5.19242e+00 2.82919e+00  0.00000e+00 0.00000e+00 2.14554e+02 151.415 1.25167e+02 151.415 0.9110 
1 1 1 9   49  8  o 10 8.45848e+00 1.32062e+00 1.69518e+02 126.960 -7.17587e+00 9.53669e+00  0.00000e+00 0.00000e+00 1.35868e+02 126.960 3.36500e+01 306.960 0.9571 
1 1 1 9   49  9  o 13 1.32513e+01 1.15101e+00 1.74367e+02 306.371 1.41944e+01  -1.92729e+01 0.00000e+00 0.00000e+00 3.14852e+02 306.371 1.40485e+02 306.371 0.9789 
1 1 1 9   49  10 o 3  8.58559e+00 1.41601e+00 1.59971e+02 130.835 -9.08051e+00 1.05070e+01  0.00000e+00 0.00000e+00 1.51880e+02 130.835 8.09130e+00 310.835 0.9633 
1 1 1 9   49  11 o 9  3.76230e+00 1.23586e+00 1.62013e+02 213.844 -6.11834e+00 -4.10266e+00 0.00000e+00 0.00000e+00 3.02000e+01 33.844  1.92213e+02 33.844  0.9294 
1 1 1 9   49  12 o 16 6.41183e+00 1.49516e+00 1.18021e+02 161.209 -7.66512e+00 2.60801e+00  0.00000e+00 0.00000e+00 1.08144e+02 161.209 9.87746e+00 341.209 0.9360 
1 1 1 9   49  13 o 12 5.19779e+00 1.56016e+00 1.03343e+02 163.066 -5.79617e+00 1.76477e+00  0.00000e+00 0.00000e+00 7.54670e+01 163.066 2.78756e+01 343.066 0.9133 
1 1 1 9   50  0  o 11 2.37860e+01 7.96054e-01 3.88953e+02 161.409 -4.15542e+01 1.39775e+01  0.00000e+00 0.00000e+00 4.97022e+02 161.409 1.08069e+02 161.409 0.9885 
1 1 1 9   50  1  o 15 1.16331e+01 7.88639e-01 1.84568e+02 21.152  9.47657e+00  3.66664e+00  0.00000e+00 0.00000e+00 2.31744e+02 21.152  4.71755e+01 21.152  0.9494 
1 1 1 9   50  2  o 4  1.78667e+01 9.31550e-01 3.06476e+02 282.484 5.73018e+00  -2.58819e+01 0.00000e+00 0.00000e+00 3.54317e+02 282.484 4.78407e+01 282.484 0.9810 
1 1 1 9   50  3  o 5  1.65996e+01 9.49691e-01 3.07155e+02 13.039  2.79719e+01  6.47790e+00  0.00000e+00 0.00000e+00 3.07825e+02 13.039  6.69387e-01 13.039  0.9824 
1 1 1 9   50  4  o 5  1.96730e+01 8.21914e-01 3.27053e+02 292.811 1.50979e+01  -3.58973e+01 0.00000e+00 0.00000e+00 4.05352e+02 292.811 7.82989e+01 292.811 0.9871 
1 1 1 9   50  5  o 9  6.55301e+00 1.59890e+00 1.51342e+02 63.137  2.55696e+00  5.04809e+00  0.00000e+00 0.00000e+00 7.27748e+01 63.137  7.85676e+01 243.137 0.9067 
1 1 1 9   50  6  o 19 1.17030e+01 1.51069e+00 2.20057e+02 232.178 -9.72434e+00 -1.25268e+01 0.00000e+00 0.00000e+00 2.07234e+02 232.178 1.28222e+01 52.178  0.9679 
1 1 1 9   50  7  o 13 3.85811e+00 1.16086e+00 4.69248e+01 193.011 -1.37941e+00 -3.18732e-01 0.00000e+00 0.00000e+00 3.66949e+01 193.011 1.02299e+01 13.011  0.5746 
1 1 1 9   50  8  o 12 1.05869e+01 1.19628e+00 1.92486e+02 251.176 -5.97192e+00 -1.75183e+01 0.00000e+00 0.00000e+00 1.95866e+02 251.176 3.38044e+00 251.176 0.9726 
1 1 1 9   50  9  o 18 5.74390e+00 1.35635e+00 1.43562e+02 50.033  5.14882e+00  6.14334e+00  0.00000e+00 0.00000e+00 5.90398e+01 50.033  8.45218e+01 230.033 0.9354 
1 1 1 9   50  10 o 5  4.18861e+00 1.26762e+00 6.98023e+01 255.571 -7.64951e-01 -2.97302e+00 0.00000e+00 0.00000e+00 5.89033e+01 255.571 1.08990e+01 75.571  0.8150 
1 1 1 9   50  11 o 10 4.28791e+00 1.33176e+00 4.59732e+00 120.483 -1.13697e-01 1.93152e-01  0.00000e+00 0.00000e+00 1.34015e+01 120.483 8.80416e+00 120.483 0.1114 
1 1 1 9   50  12 o 14 6.41516e+00 1.73645e+00 1.11388e+02 278.935 1.07359e+00  -6.82883e+00 0.00000e+00 0.00000e+00 1.12086e+02 278.935 6.97774e-01 278.935 0.9245 
1 1 1 9   50  13 o 11 4.71415e+00 1.49556e+00 1.16620e+02 72.880  1.88560e+00  6.12161e+00  0.00000e+00 0.00000e+00 4.64119e+01 72.880  7.02079e+01 252.880 0.9182 
1 1 1 9   51  0  o 1  1.52215e+01 6.95912e-01 1.86007e+02 359.605 1.32632e+01  -9.14825e-02 0.00000e+00 0.00000e+00 3.65397e+02 359.605 1.79390e+02 359.605 0.9615 
1 1 1 9   51  1  o 7  2.12159e+01 7.24519e-01 4.02096e+02 232.039 -2.62666e+01 -3.36668e+01 0.00000e+00 0.00000e+00 3.88056e+02 232.039 1.40398e+01 52.039  0.9882 
1 1 1 9   51  2  o 4  2.70548e+01 9.70045e-01 4.54129e+02 62.308  2.93107e+01  5.58470e+01  0.00000e+00 0.00000e+00 5.57654e+02 62.308  1.03525e+02 62.308  0.9920 
1 1 1 9   51  3  o 13 1.76576e+01 9.77683e-01 2.89031e+02 292.514 1.06107e+01  -2.55982e+01 0.00000e+00 0.00000e+00 3.64631e+02 292.514 7.56004e+01 292.514 0.9818 
1 1 1 9   51  4  o 4  1.64511e+01 1.26044e+00 3.24628e+02 238.084 -1.67540e+01 -2.68993e+01 0.00000e+00 0.00000e+00 2.85893e+02 238.084 3.87354e+01 58.084  0.9841 
1 1 1 9   51  5  o 13 3.57701e+00 1.52417e+00 1.74022e+02 36.576  2.89593e+00  2.14883e+00  0.00000e+00 0.00000e+00 5.98307e+01 216.576 2.33852e+02 216.576 0.8465 
1 1 1 9   51  6  o 10 1.05949e+01 9.88295e-01 2.40559e+02 187.377 -1.98284e+01 -2.56714e+00 0.00000e+00 0.00000e+00 1.48908e+02 187.377 9.16508e+01 7.377   0.9747 
1 1 1 9   51  7  f 0  6.18208e+00 1.35044e+00 7.28571e+01 169.211 -3.37295e+00 6.42768e-01  0.00000e+00 0.00000e+00 1.22421e+02 169.211 4.95644e+01 169.211 0.8376 
1 1 1 9   51  8  o 9  7.49957e+00 1.30638e+00 1.16170e+02 213.775 -6.37779e+00 -4.26545e+00 0.00000e+00 0.00000e+00 1.47510e+02 213.775 3.13400e+01 213.775 0.9324 
1 1 1 9   51  9  o 13 8.17324e+00 1.40397e+00 1.37704e+02 162.405 -1.01607e+01 3.22212e+00  0.00000e+00 0.00000e+00 1.55632e+02 162.405 1.79280e+01 162.405 0.9519 
1 1 1 9   51  10 o 7  4.74110e+00 1.31159e+00 6.46402e+01 241.120 -1.55998e+00 -2.82821e+00 0.00000e+00 0.00000e+00 8.29205e+01 241.120 1.82803e+01 241.120 0.8256 
1 1 1 9   51  11 o 6  5.71104e+00 1.57853e+00 5.58967e+01 225.568 -2.20839e+00 -2.25265e+00 0.00000e+00 0.00000e+00 1.20759e+02 225.568 6.48622e+01 225.568 0.8208 
1 1 1 9   51  12 o 17 5.12425e+00 1.53650e+00 5.03227e+01 161.067 -2.67095e+00 9.16188e-01  0.00000e+00 0.00000e+00 1.03353e+02 161.067 5.30302e+01 161.067 0.7961 
1 1 1 9   51  13 o 13 5.67196e+00 1.58094e+00 1.01643e+02 164.380 -6.32359e+00 1.76794e+00  0.00000e+00 0.00000e+00 9.49374e+01 164.380 6.70522e+00 344.380 0.9203 
1 1 1 9   52  0  o 9  9.70425e+00 1.11210e+00 1.86172e+02 237.651 -4.52487e+00 -7.14401e+00 0.00000e+00 0.00000e+00 1.57034e+02 237.651 2.91374e+01 57.651  0.9389 
1 1 1 9   52  1  o 5  1.08860e+01 7.67692e-01 2.00724e+02 99.114  -1.84145e+00 1.14785e+01  0.00000e+00 0.00000e+00 1.91423e+02 99.114  9.30137e+00 279.114 0.9560 
1 1 1 9   52  2  o 16 1.33171e+01 9.77970e-01 2.14765e+02 60.668  7.83948e+00  1.39513e+01  0.00000e+00 0.00000e+00 2.71242e+02 60.668  5.64779e+01 60.668  0.9682 
1 1 1 9   52  3  o 14 1.23492e+01 1.05309e+00 2.32114e+02 140.066 -1.24399e+01 1.04139e+01  0.00000e+00 0.00000e+00 2.18866e+02 140.066 1.32480e+01 320.066 0.9687 
1 1 1 9   52  4  o 16 7.71905e+00 1.58300e+00 1.72941e+02 101.517 -1.46964e+00 7.21253e+00  0.00000e+00 0.00000e+00 9.75489e+01 101.517 7.53925e+01 281.517 0.9294 
1 1 1 9   52  5  o 18 8.32128e+00 1.65292e+00 1.91473e+02 263.439 -1.04990e+00 -9.12810e+00 0.00000e+00 0.00000e+00 1.04713e+02 263.439 8.67599e+01 83.439  0.9439 
1 1 1 9   52  6  o 4  1.33259e+01 9.24244e-01 2.17526e+02 264.310 -2.31995e+00 -2.32841e+01 0.00000e+00 0.00000e+00 2.74136e+02 264.310 5.66097e+01 264.310 0.9784 
1 1 1 9   52  7  o 19 1.02752e+01 1.11187e+00 1.60814e+02 6.138   1.38441e+01  1.48878e+00  0.00000e+00 0.00000e+00 2.12466e+02 6.138   5.16513e+01 6.138   0.9634 
1 1 1 9   52  8  o 8  1.18772e+01 1.14166e+00 2.58330e+02 66.314  1.10039e+01  2.50843e+01  0.00000e+00 0.00000e+00 1.81248e+02 66.314  7.70815e+01 246.314 0.9816 
1 1 1 9   52  9  o 5  4.88349e+00 1.32260e+00 8.45783e+01 303.446 2.30498e+00  -3.48963e+00 0.00000e+00 0.00000e+00 7.56248e+01 303.446 8.95354e+00 123.446 0.8702 
1 1 1 9   52  10 o 19 8.56438e+00 1.54670e+00 2.08053e+02 313.325 1.17998e+01  -1.25107e+01 0.00000e+00 0.00000e+00 1.05217e+02 313.325 1.02835e+02 133.325 0.9705 
1 1 1 9   52  11 o 6  3.08803e+00 1.06415e+00 5.02899e+01 100.884 -4.02532e-01 2.09344e+00  0.00000e+00 0.00000e+00 3.32872e+01 100.884 1.70027e+01 280.884 0.7183 
1 1 1 9   52  12 o 7  5.47375e+00 1.59361e+00 6.72752e+01 289.914 1.29698e+00  -3.58003e+00 0.00000e+00 0.00000e+00 1.09156e+02 289.914 4.18806e+01 289.914 0.8557 
1 1 1 9   52  13 o 3  4.84040e+00 1.54854e+00 9.51920e+01 52.770  3.18242e+00  4.18814e+00  0.00000e+00 0.00000e+00 6.86692e+01 52.770  2.65228e+01 232.770 0.8991 
1 1 1 9   53  0  o 12 2.26021e+01 7.13766e-01 3.82842e+02 106.302 -1.30002e+01 4.44521e+01  0.00000e+00 0.00000e+00 4.59202e+02 106.302 7.63605e+01 106.302 0.9891 
1 1 1 9   53  1  o 17 1.56710e+01 7.88710e-01 2.42135e+02 157.172 -2.03035e+01 8.54628e+00  0.00000e+00 0.00000e+00 3.34733e+02 157.172 9.25979e+01 157.172 0.9770 
1 1 1 9   53  2  o 5  1.82226e+01 9.27057e-01 2.59543e+02 162.928 -2.47739e+01 7.60795e+00  0.00000e+00 0.00000e+00 4.13825e+02 162.928 1.54282e+02 162.928 0.9805 
1 1 1 9   53  3  o 9  1.29781e+01 1.07681e+00 2.76583e+02 268.103 -6.79956e-01 -2.05296e+01 0.00000e+00 0.00000e+00 2.00560e+02 268.103 7.60238e+01 88.103  0.9753 
1 1 1 9   53  4  o 12 1.60201e+01 1.17417e+00 3.02962e+02 250.377 -1.06528e+01 -2.98790e+01 0.00000e+00 0.00000e+00 2.91401e+02 250.377 1.15607e+01 70.377  0.9841 
1 1 1 9   53  5  o 10 6.87216e+00 1.85614e+00 2.27126e+02 29.762  7.64544e+00  4.37180e+00  0.00000e+00 0.00000e+00 1.67925e+01 29.762  2.10334e+02 209.762 0.9414 
1 1 1 9   53  6  o 17 6.07190e+00 1.11370e+00 1.33458e+02 50.049  4.14428e+00  4.94763e+00  0.00000e+00 0.00000e+00 7.69091e+01 50.049  5.65490e+01 230.049 0.9189 
1 1 1 9   53  7  o 11 4.10291e+00 1.27743e+00 1.33589e+02 112.802 -1.82736e+00 4.34675e+00  0.00000e+00 0.00000e+00 3.52044e+00 112.802 1.30068e+02 292.802 0.8863 
1 1 1 9   53  8  o 3  3.87668e+00 1.15917e+00 4.26071e+01 21.800  1.45471e+00  5.81842e-01  0.00000e+00 0.00000e+00 4.68666e+01 21.800  4.25949e+00 21.800  0.6122 
1 1 1 9   53  9  f 0  5.14505e+00 1.35903e+00 7.31629e+00 311.962 2.42068e-01  -2.69203e-01 0.00000e+00 0.00000e+00 2.72264e+01 311.962 1.99101e+01 311.962 0.1781 
1 1 1 9   53  10 o 12 5.63584e+00 1.43851e+00 1.12503e+02 162.049 -6.07705e+00 1.96877e+00  0.00000e+00 0.00000e+00 8.24698e+01 162.049 3.00334e+01 342.049 0.9180 
1 1 1 9   53  11 o 17 4.15098e+00 1.30783e+00 6.72407e+01 49.935  2.03364e+00  2.41804e+00  0.00000e+00 0.00000e+00 6.11730e+01 49.935  6.06766e+00 229.935 0.8211 
1 1 1 9   53  12 o 9  6.73054e+00 1.65371e+00 2.59591e+02 199.253 -1.72630e+01 -6.02966e+00 0.00000e+00 0.00000e+00 1.31350e+01 19.253  2.72726e+02 19.253  0.9723 
1 1 1 9   53  13 o 16 6.28865e+00 1.76876e+00 1.17588e+02 21.192  6.86876e+00  2.66307e+00  0.00000e+00 0.00000e+00 1.02451e+02 21.192  1.51366e+01 201.192 0.9294 
1 1 1 9   54  0  o 11 7.06980e+00 9.41938e-01 1.46059e+02 125.804 -3.28160e+00 4.54934e+00  0.00000e+00 0.00000e+00 9.51067e+01 125.804 5.09526e+01 305.804 0.9058 
1 1 1 9   54  1  o 14 2.95778e+01 9.93354e-01 6.03304e+02 241.679 -4.53750e+01 -8.41964e+01 0.00000e+00 0.00000e+00 5.05083e+02 241.679 9.82213e+01 61.679  0.9948 
1 1 1 9   54  2  o 15 2.02427e+01 9.50092e-01 3.89532e+02 50.302  2.91188e+01  3.50758e+01  0.00000e+00 0.00000e+00 3.64826e+02 50.302  2.47061e+01 230.302 0.9890 
1 1 1 9   54  3  o 14 2.53803e+01 8.15988e-01 4.83081e+02 338.612 7.53356e+01  -2.95048e+01 0.00000e+00 0.00000e+00 4.67550e+02 338.612 1.55308e+01 158.612 0.9938 
1 1 1 9   54  4  o 13 1.51583e+01 1.42055e+00 2.83673e+02 143.631 -2.10449e+01 1.54981e+01  0.00000e+00 0.00000e+00 2.76675e+02 143.631 6.99788e+00 323.631 0.9807 
1 1 1 9   54  5  o 6  4.91798e+00 1.35168e+00 1.51963e+02 155.742 -4.42402e+00 1.99366e+00  0.00000e+00 0.00000e+00 1.30130e+01 155.742 1.38950e+02 335.742 0.8898 
1 1 1 9   54  6  o 17 1.40681e+01 8.34426e-01 3.00949e+02 282.736 8.07890e+00  -3.57443e+01 0.00000e+00 0.00000e+00 2.22117e+02 282.736 7.88315e+01 102.736 0.9863 
1 1 1 9   54  7  o 8  4.01969e+00 1.26175e+00 1.67436e+02 305.060 3.29578e+00  -4.69637e+00 0.00000e+00 0.00000e+00 2.98326e+01 125.060 1.97269e+02 125.060 0.9081 
1 1 1 9   54  8  o 3  2.07052e+01 9.50105e-01 3.39418e+02 277.659 1.00652e+01  -7.48435e+01 0.00000e+00 0.00000e+00 4.35861e+02 277.659 9.64432e+01 277.659 0.9934 
1 1 1 9   54  9  o 6  4.55503e+00 1.29202e+00 9.61064e+01 54.074  2.68516e+00  3.70587e+00  0.00000e+00 0.00000e+00 5.53992e+01 54.074  4.07072e+01 234.074 0.8825 
1 1 1 9   54  10 o 4  7.20356e+00 1.55820e+00 1.15974e+02 222.169 -6.28902e+00 -5.69641e+00 0.00000e+00 0.00000e+00 1.38921e+02 222.169 2.29471e+01 222.169 0.9391 
1 1 1 9   54  11 o 11 9.16503e+00 1.61485e+00 1.33420e+02 48.833  8.23173e+00  9.41409e+00  0.00000e+00 0.00000e+00 1.97717e+02 48.833  6.42973e+01 48.833  0.9591 
1 1 1 9   54  12 o 11 3.95120e+00 1.28838e+00 8.66046e+01 310.655 3.06067e+00  -3.56402e+00 0.00000e+00 0.00000e+00 4.52034e+01 310.655 4.14012e+01 130.655 0.8859 
1 1 1 9   54  13 o 16 7.65857e+00 1.91186e+00 6.47839e+01 16.008  4.35508e+00  1.24946e+00  0.00000e+00 0.00000e+00 1.89258e+02 16.008  1.24474e+02 16.008  0.8812 
1 1 1 9   55  0  o 2  1.01297e+01 9.65815e-01 2.13737e+02 174.699 -1.17115e+01 1.08674e+00  0.00000e+00 0.00000e+00 1.51083e+02 174.699 6.26532e+01 354.699 0.9565 
1 1 1 9   55  1  o 1  3.43263e+01 1.08005e+00 7.64678e+02 64.048  6.46050e+01  1.32744e+02  0.00000e+00 0.00000e+00 5.23849e+02 64.048  2.40829e+02 244.048 0.9966 
1 1 1 9   55  2  o 12 7.25157e+00 1.19930e+00 1.01070e+02 219.518 -3.13767e+00 -2.58818e+00 0.00000e+00 0.00000e+00 1.35545e+02 219.518 3.44755e+01 219.518 0.8661 
1 1 1 9   55  3  o 15 1.40837e+01 1.15777e+00 2.20995e+02 289.615 6.87126e+00  -1.92804e+01 0.00000e+00 0.00000e+00 2.96595e+02 289.615 7.55991e+01 289.615 0.9753 
1 1 1 9   55  4  o 5  1.52414e+01 9.78721e-01 3.56624e+02 118.341 -1.84321e+01 3.41740e+01  0.00000e+00 0.00000e+00 2.10365e+02 118.341 1.46259e+02 298.341 0.9870 
1 1 1 9   55  5  o 9  6.25689e+00 1.18169e+00 8.50558e+01 219.534 -3.06652e+00 -2.53092e+00 0.00000e+00 0.00000e+00 1.18376e+02 219.534 3.33207e+01 219.534 0.8626 
1 1 1 9   55  6  o 18 8.08412e+00 1.04739e+00 2.71770e+02 259.393 -3.44442e+00 -1.83924e+01 0.00000e+00 0.00000e+00 2.46901e+01 259.393 2.47080e+02 79.393  0.9729 
1 1 1 9   55  7  o 19 4.13707e+00 1.51947e+00 4.94241e+01 260.162 -2.75726e-01 -1.59004e+00 0.00000e+00 0.00000e+00 4.77272e+01 260.162 1.69692e+00 80.162  0.6230 
1 1 1 9   55  8  o 13 6.10229e+00 1.37575e+00 7.39565e+01 148.811 -3.71977e+00 2.25177e+00  0.00000e+00 0.00000e+00 1.27441e+02 148.811 5.34847e+01 148.811 0.8757 
1 1 1 9   55  9  o 9  1.04388e+01 1.27795e+00 2.11195e+02 158.111 -2.16194e+01 8.68597e+00  0.00000e+00 0.00000e+00 1.73628e+02 158.111 3.75669e+01 338.111 0.9783 
1 1 1 9   55  10 o 12 3.69816e+00 1.17912e+00 8.63915e+01 70.272  1.33878e+00  3.73328e+00  0.00000e+00 0.00000e+00 3.37363e+01 70.272  5.26552e+01 250.272 0.8622 
1 1 1 9   55  11 o 12 1.08460e+01 1.45629e+00 2.16831e+02 63.054  1.13838e+01  2.23938e+01  0.00000e+00 0.00000e+00 1.83456e+02 63.054  3.33743e+01 243.054 0.9799 
1 1 1 9   55  12 o 3  4.00460e+00 1.28961e+00 9.84731e+01 200.769 -4.82879e+00 -1.83128e+00 0.00000e+00 0.00000e+00 3.67834e+01 200.769 6.16897e+01 20.769  0.8971 
1 1 1 9   55  13 o 6  7.58586e+00 1.89672e+00 1.57315e+02 6.219   1.10178e+01  1.20061e+00  0.00000e+00 0.00000e+00 1.14985e+02 6.219   4.23303e+01 186.219 0.9538 
1 1 1 9   56  0  o 11 1.64887e+01 7.17262e-01 2.75603e+02 301.696 1.43928e+01  -2.33074e+01 0.00000e+00 0.00000e+00 3.33713e+02 301.696 5.81099e+01 301.696 0.9816 
1 1 1 9   56  1  o 7  9.59370e+00 9.79809e-01 1.41000e+02 25.006  7.16604e+00  3.34243e+00  0.00000e+00 0.00000e+00 1.96610e+02 25.006  5.56094e+01 25.006  0.9344 
1 1 1 9   56  2  o 17 9.95222e+00 9.96310e-01 1.72043e+02 1.298   1.12031e+01  2.53853e-01  0.00000e+00 0.00000e+00 1.85716e+02 1.298   1.36728e+01 1.298   0.9543 
1 1 1 9   56  3  f 0  7.19796e+00 1.35011e+00 1.30463e+02 123.109 -3.19196e+00 4.89473e+00  0.00000e+00 0.00000e+00 1.16293e+02 123.109 1.41699e+01 303.109 0.9099 
1 1 1 9   56  4  o 8  1.30951e+01 1.07742e+00 2.48919e+02 196.358 -2.33026e+01 -6.83995e+00 0.00000e+00 0.00000e+00 2.34280e+02 196.358 1.46386e+01 16.358  0.9792 
1 1 1 9   56  5  o 4  6.68508e+00 1.13849e+00 1.50531e+02 268.137 -2.58652e-01 -7.95159e+00 0.00000e+00 0.00000e+00 8.49959e+01 268.137 6.55355e+01 88.137  0.9349 
1 1 1 9   56  6  o 8  4.85623e+00 1.17125e+00 5.96969e+01 233.317 -1.42555e+00 -1.91374e+00 0.00000e+00 0.00000e+00 7.79427e+01 233.317 1.82458e+01 233.317 0.7520 
1 1 1 9   56  7  o 12 3.75608e+00 1.56909e+00 1.23627e+02 105.652 -9.79798e-01 3.49691e+00  0.00000e+00 0.00000e+00 3.63363e+00 285.652 1.27261e+02 285.652 0.8477 
1 1 1 9   56  8  o 10 5.13729e+00 1.28197e+00 7.67697e+01 197.848 -3.77797e+00 -1.21648e+00 0.00000e+00 0.00000e+00 9.01644e+01 197.848 1.33947e+01 197.848 0.8623 
1 1 1 9   56  9  o 7  2.72482e+00 9.35505e-01 1.89611e+01 348.788 6.22091e-01  -1.23318e-01 0.00000e+00 0.00000e+00 1.20590e+01 348.788 6.90205e+00 168.788 0.3022 
1 1 1 9   56  10 o 7  4.70879e+00 1.35381e+00 1.10391e+02 114.481 -2.43230e+00 5.34181e+00  0.00000e+00 0.00000e+00 5.10696e+01 114.481 5.93212e+01 294.481 0.9103 
1 1 1 9   56  11 o 12 9.89901e+00 1.51548e+00 1.76736e+02 300.828 9.48040e+00  -1.58861e+01 0.00000e+00 0.00000e+00 1.85823e+02 300.828 9.08735e+00 300.828 0.9726 
1 1 1 9   56  12 o 3  4.49431e+00 1.38710e+00 3.23921e+01 323.933 1.39580e+00  -1.01661e+00 0.00000e+00 0.00000e+00 7.71423e+01 323.933 4.47503e+01 323.933 0.6474 
1 1 1 9   56  13 o 3  4.92297e+00 1.50481e+00 6.07409e+01 333.264 3.36645e+00  -1.69581e+00 0.00000e+00 0.00000e+00 9.74709e+01 333.264 3.67300e+01 333.264 0.8540 
1 1 1 9   57  0  o 8  2.42636e+01 6.84658e-01 4.62590e+02 262.025 -9.60105e+00 -6.85359e+01 0.00000e+00 0.00000e+00 4.44100e+02 262.025 1.84895e+01 82.025  0.9927 
1 1 1 9   57  1  o 18 1.94403e+01 9.84775e-01 4.29834e+02 30.663  4.56708e+01  2.70775e+01  0.00000e+00 0.00000e+00 2.95240e+02 30.663  1.34593e+02 210.663 0.9905 
1 1 1 9   57  2  o 1  1.64354e+01 9.41281e-01 3.49828e+02 217.972 -3.15394e+01 -2.46168e+01 0.00000e+00 0.00000e+00 2.61410e+02 217.972 8.84182e+01 37.972  0.9874 
1 1 1 9   57  3  o 8  2.46940e+01 1.47163e+00 1.78656e+02 85.606  1.98661e+00  2.58549e+01  0.00000e+00 0.00000e+00 7.33499e+02 85.606  5.54843e+02 85.606  0.9805 
1 1 1 9   57  4  o 13 1.81901e+01 1.00488e+00 3.13973e+02 250.066 -1.40378e+01 -3.87075e+01 0.00000e+00 0.00000e+00 3.63010e+02 250.066 4.90376e+01 250.066 0.9878 
1 1 1 9   57  5  o 8  9.00618e+00 1.00515e+00 1.20268e+02 92.434  -3.78840e-01 8.91067e+00  0.00000e+00 0.00000e+00 1.99460e+02 92.434  7.91926e+01 92.434  0.9421 
1 1 1 9   57  6  o 8  1.20826e+01 9.02680e-01 2.79021e+02 146.639 -2.79229e+01 1.83847e+01  0.00000e+00 0.00000e+00 1.69413e+02 146.639 1.09607e+02 326.639 0.9849 
1 1 1 9   57  7  o 8  3.16086e+00 1.38916e+00 4.08565e+01 275.031 9.13662e-02  -1.03783e+00 0.00000e+00 0.00000e+00 1.40526e+01 275.031 2.68038e+01 95.031  0.4610 
1 1 1 9   57  8  o 19 8.55453e+00 1.19914e+00 1.61005e+02 90.961  -2.30513e-01 1.37402e+01  0.00000e+00 0.00000e+00 1.49346e+02 90.961  1.16587e+01 270.961 0.9629 
1 1 1 9   57  9  o 3  3.56543e+00 1.12867e+00 8.95627e+01 41.059  2.78344e+00  2.42465e+00  0.00000e+00 0.00000e+00 2.46722e+01 41.059  6.48905e+01 221.059 0.8505 
1 1 1 9   57  10 o 13 5.23852e+00 1.40152e+00 1.64733e+02 100.367 -1.70313e+00 9.31012e+00  0.00000e+00 0.00000e+00 2.18314e+01 100.367 1.42901e+02 280.367 0.9456 
1 1 1 9   57  11 o 14 7.55919e+00 1.55532e+00 8.92872e+01 331.256 6.42439e+00  -3.52361e+00 0.00000e+00 0.00000e+00 1.75130e+02 331.256 8.58430e+01 331.256 0.9290 
1 1 1 9   57  12 o 10 4.94032e+00 1.53320e+00 1.08323e+02 64.064  2.68710e+00  5.52495e+00  0.00000e+00 0.00000e+00 6.17365e+01 64.064  4.65863e+01 244.064 0.9145 
1 1 1 9   57  13 o 14 1.37892e+01 1.72797e+00 2.91861e+02 252.332 -1.30840e+01 -4.10768e+01 0.00000e+00 0.00000e+00 2.20898e+02 252.332 7.09631e+01 72.332  0.9883 
1 1 1 9   58  0  o 10 1.14759e+01 8.46755e-01 1.45883e+02 277.227 1.42470e+00  -1.12349e+01 0.00000e+00 0.00000e+00 2.66485e+02 277.227 1.20603e+02 277.227 0.9548 
1 1 1 9   58  1  o 4  9.33003e+00 1.01306e+00 2.17975e+02 118.885 -6.71583e+00 1.21733e+01  0.00000e+00 0.00000e+00 1.20403e+02 118.885 9.75717e+01 298.885 0.9633 
1 1 1 9   58  2  o 8  1.28881e+01 9.90792e-01 1.98943e+02 60.529  8.69683e+00  1.53898e+01  0.00000e+00 0.00000e+00 2.72463e+02 60.529  7.35207e+01 60.529  0.9713 
1 1 1 9   58  3  o 2  1.38846e+01 1.02714e+00 2.49104e+02 21.079  2.44350e+01  9.41849e+00  0.00000e+00 0.00000e+00 2.63790e+02 21.079  1.46863e+01 21.079  0.9807 
1 1 1 9   58  4  o 8  5.34615e+00 1.18989e+00 4.80577e+01 221.271 -1.43765e+00 -1.26173e+00 0.00000e+00 0.00000e+00 8.94813e+01 221.271 4.14236e+01 221.271 0.6829 
1 1 1 9   58  5  o 12 4.17950e+00 1.10610e+00 7.22278e+00 74.718  6.64962e-02  2.43376e-01  0.00000e+00 0.00000e+00 1.24844e+01 74.718  5.26161e+00 74.718  0.1252 
1 1 1 9   58  6  o 11 4.63968e+00 1.16381e+00 1.06350e+02 0.215   4.37232e+00  1.64296e-02  0.00000e+00 0.00000e+00 4.68577e+01 0.215   5.94926e+01 180.215 0.8765 
1 1 1 9   58  7  o 10 6.33134e+00 1.40041e+00 1.25108e+02 273.093 3.78775e-01  -7.00850e+00 0.00000e+00 0.00000e+00 9.57096e+01 273.093 2.93982e+01 93.094  0.9257 
1 1 1 9   58  8  o 9  5.09521e+00 1.26812e+00 1.34354e+02 290.025 2.35711e+00  -6.46729e+00 0.00000e+00 0.00000e+00 4.30399e+01 290.025 9.13140e+01 110.025 0.9242 
1 1 1 9   58  9  o 11 3.03022e+00 1.01595e+00 5.91352e+01 190.670 -2.25681e+00 -4.25210e-01 0.00000e+00 0.00000e+00 2.54296e+01 190.670 3.37056e+01 10.670  0.7409 
1 1 1 9   58  10 o 11 3.60354e+00 1.16250e+00 1.07274e+02 297.617 2.24881e+00  -4.29847e+00 0.00000e+00 0.00000e+00 1.34718e+01 297.617 9.38023e+01 117.617 0.8898 
1 1 1 9   58  11 o 8  4.61489e+00 1.39251e+00 4.39968e+01 90.652  -2.77303e-02 2.43510e+00  0.00000e+00 0.00000e+00 8.76531e+01 90.652  4.36563e+01 90.652  0.7578 
1 1 1 9   58  12 o 19 3.68427e+00 1.23140e+00 6.24749e+01 119.171 -1.55145e+00 2.77935e+00  0.00000e+00 0.00000e+00 5.15885e+01 119.171 1.08864e+01 299.171 0.8227 
1 1 1 9   58  13 f 0  3.84906e+00 1.31243e+00 1.14557e+02 275.330 5.97685e-01  -6.40626e+00 0.00000e+00 0.00000e+00 1.84555e+01 275.330 9.61011e+01 95.330  0.9186 
1 1 1 9   59  0  o 13 1.12165e+01 8.27571e-01 2.26543e+02 259.245 -3.38265e+00 -1.78089e+01 0.00000e+00 0.00000e+00 1.83713e+02 259.245 4.28305e+01 79.245  0.9720 
1 1 1 9   59  1  o 18 1.43462e+01 8.99985e-01 2.71418e+02 31.901  2.33155e+01  1.45134e+01  0.00000e+00 0.00000e+00 2.58675e+02 31.901  1.27438e+01 211.901 0.9816 
1 1 1 9   59  2  o 15 1.06036e+01 1.09454e+00 1.82028e+02 233.615 -7.91861e+00 -1.07466e+01 0.00000e+00 0.00000e+00 2.01961e+02 233.615 1.99332e+01 233.615 0.9618 
1 1 1 9   59  3  o 4  7.17606e+00 1.20558e+00 1.18993e+02 173.350 -5.77193e+00 6.72932e-01  0.00000e+00 0.00000e+00 1.26750e+02 173.350 7.75733e+00 173.350 0.9093 
1 1 1 9   59  4  o 10 1.55880e+01 7.82366e-01 3.25499e+02 158.713 -4.15653e+01 1.61949e+01  0.00000e+00 0.00000e+00 2.55014e+02 158.713 7.04847e+01 338.713 0.9887 
1 1 1 9   59  5  o 16 1.36595e+01 8.22627e-01 2.19835e+02 162.572 -2.64489e+01 8.30274e+00  0.00000e+00 0.00000e+00 2.85334e+02 162.572 6.54982e+01 162.572 0.9818 
1 1 1 9   59  6  o 19 8.42505e+00 1.09715e+00 1.96631e+02 103.002 -3.41609e+00 1.47942e+01  0.00000e+00 0.00000e+00 1.10104e+02 103.002 8.65266e+01 283.002 0.9665 
1 1 1 9   59  7  o 8  4.90641e+00 1.20053e+00 1.07821e+02 22.984  4.93145e+00  2.09162e+00  0.00000e+00 0.00000e+00 5.87086e+01 22.984  4.91120e+01 202.984 0.9010 
1 1 1 9   59  8  o 10 4.79048e+00 1.28441e+00 9.60998e+01 134.026 -3.35791e+00 3.47406e+00  0.00000e+00 0.00000e+00 6.43641e+01 134.026 3.17357e+01 314.026 0.8893 
1 1 1 9   59  9  o 8  1.47274e+01 1.00895e+00 2.56716e+02 304.179 2.63367e+01  -3.87845e+01 0.00000e+00 0.00000e+00 2.91958e+02 304.179 3.52418e+01 304.179 0.9893 
1 1 1 9   59  10 o 9  7.45392e+00 1.53692e+00 1.55068e+02 332.713 1.06872e+01  -5.51291e+00 0.00000e+00 0.00000e+00 1.13644e+02 332.713 4.14243e+01 152.713 0.9575 
1 1 1 9   59  11 o 18 1.18917e+01 1.40067e+00 2.06195e+02 181.936 -2.85448e+01 -9.64761e-01 0.00000e+00 0.00000e+00 2.33506e+02 181.936 2.73109e+01 181.936 0.9823 
1 1 1 9   59  12 o 8  5.35707e+00 1.52428e+00 9.20084e+01 319.205 4.16912e+00  -3.59804e+00 0.00000e+00 0.00000e+00 9.02038e+01 319.205 1.80460e+00 139.205 0.9039 
1 1 1 9   59  13 o 18 1.12753e+01 1.70536e+00 1.67463e+02 96.158  -2.22895e+00 2.06604e+01  0.00000e+00 0.00000e+00 2.46298e+02 96.158  7.88346e+01 96.158  0.9756 
1 1 1 9   60  0  o 12 8.91069e+00 9.11296e-01 1.83697e+02 350.757 1.11579e+01  -1.81572e+00 0.00000e+00 0.00000e+00 1.36362e+02 350.757 4.73343e+01 170.757 0.9547 
1 1 1 9   60  1  o 7  1.42101e+01 8.04889e-01 2.46890e+02 95.062  -2.18342e+00 2.46502e+01  0.00000e+00 0.00000e+00 2.76996e+02 95.062  3.01065e+01 95.062  0.9796 
1 1 1 9   60  2  o 18 7.13188e+00 1.24088e+00 1.28633e+02 219.943 -4.97191e+00 -4.16347e+00 0.00000e+00 0.00000e+00 1.18184e+02 219.943 1.04490e+01 39.943  0.9193 
1 1 1 9   60  3  o 4  1.77247e+01 9.75946e-01 3.97406e+02 270.508 4.90256e-01  -5.53411e+01 0.00000e+00 0.00000e+00 2.63938e+02 270.508 1.33467e+02 90.508  0.9909 
1 1 1 9   60  4  o 15 6.37086e+00 1.06251e+00 8.45436e+01 75.983  1.05476e+00  4.22513e+00  0.00000e+00 0.00000e+00 1.25605e+02 75.983  4.10616e+01 75.983  0.8759 
1 1 1 9   60  5  o 18 4.45560e+00 1.13845e+00 5.16000e+01 331.681 1.68545e+00  -9.08234e-01 0.00000e+00 0.00000e+00 6.30539e+01 331.681 1.14539e+01 331.681 0.6832 
1 1 1 9   60  6  o 2  8.84056e+00 1.00114e+00 2.12234e+02 64.169  8.14035e+00  1.68161e+01  0.00000e+00 0.00000e+00 1.11697e+02 64.169  1.00537e+02 244.169 0.9729 
1 1 1 9   60  7  o 8  1.22998e+01 9.24967e-01 2.07651e+02 173.794 -3.00861e+01 3.27170e+00  0.00000e+00 0.00000e+00 2.47869e+02 173.794 4.02177e+01 173.794 0.9833 
1 1 1 9   60  8  o 10 3.69372e+00 1.12689e+00 7.39125e+01 4.621   3.09943e+00  2.50524e-01  0.00000e+00 0.00000e+00 3.98399e+01 4.621   3.40726e+01 184.621 0.8178 
1 1 1 9   60  9  o 2  3.84548e+00 1.18265e+00 5.36366e+01 63.950  1.14489e+00  2.34217e+00  0.00000e+00 0.00000e+00 5.87453e+01 63.950  5.10875e+00 63.950  0.7762 
1 1 1 9   60  10 o 14 7.50751e+00 1.51549e+00 1.49254e+02 200.697 -1.14061e+01 -4.30925e+00 0.00000e+00 0.00000e+00 1.21515e+02 200.697 2.77387e+01 20.697  0.9581 
1 1 1 9   60  11 o 2  4.60093e+00 1.40219e+00 1.88619e+02 358.495 1.06955e+01  -2.80941e-01 0.00000e+00 0.00000e+00 2.37682e+01 178.495 2.12387e+02 178.495 0.9521 
1 1 1 9   60  12 o 2  4.49672e+00 1.42157e+00 3.02530e+01 177.193 -1.68594e+00 8.26514e-02  0.00000e+00 0.00000e+00 7.78966e+01 177.193 4.76436e+01 177.193 0.6393 
1 1 1 9   60  13 o 18 8.11012e+00 1.79586e+00 1.51350e+02 36.973  1.00794e+01  7.58789e+00  0.00000e+00 0.00000e+00 1.41293e+02 36.973  1.00575e+01 216.973 0.9595 
1 1 1 9   61  0  o 9  8.56429e+00 9.01514e-01 1.34233e+02 94.698  -6.84323e-01 8.32678e+00  0.00000e+00 0.00000e+00 1.67986e+02 94.698  3.37528e+01 94.698  0.9381 
1 1 1 9   61  1  o 3  1.45449e+01 8.45864e-01 2.22532e+02 238.367 -1.34818e+01 -2.18864e+01 0.00000e+00 0.00000e+00 3.14029e+02 238.367 9.14972e+01 238.367 0.9804 
1 1 1 9   61  2  o 13 1.40032e+01 1.25247e+00 2.51146e+02 198.064 -2.41327e+01 -7.87120e+00 0.00000e+00 0.00000e+00 2.65443e+02 198.064 1.42973e+01 198.064 0.9801 
1 1 1 9   61  3  o 6  1.19644e+01 1.03443e+00 2.70920e+02 93.500  -1.61816e+00 2.64533e+01  0.00000e+00 0.00000e+00 1.70927e+02 93.500  9.99929e+01 273.500 0.9809 
1 1 1 9   61  4  o 5  7.08340e+00 1.05311e+00 1.87350e+02 125.862 -6.60793e+00 9.14112e+00  0.00000e+00 0.00000e+00 6.72495e+01 125.862 1.20101e+02 305.862 0.9546 
1 1 1 9   61  5  o 17 7.36637e+00 1.11679e+00 1.18529e+02 119.314 -3.85918e+00 6.87310e+00  0.00000e+00 0.00000e+00 1.40618e+02 119.314 2.20889e+01 119.314 0.9342 
1 1 1 9   61  6  o 7  8.07273e+00 1.11419e+00 1.43218e+02 359.052 1.04057e+01  -1.72173e-01 0.00000e+00 0.00000e+00 1.45784e+02 359.052 2.56594e+00 359.052 0.9507 
1 1 1 9   61  7  o 13 6.47183e+00 1.18940e+00 9.89480e+01 243.230 -2.89221e+00 -5.73307e+00 0.00000e+00 0.00000e+00 1.24881e+02 243.230 2.59328e+01 243.230 0.9184 
1 1 1 9   61  8  o 17 6.10105e+00 1.36892e+00 1.26932e+02 71.236  2.48330e+00  7.30979e+00  0.00000e+00 0.00000e+00 8.73475e+01 71.236  3.95849e+01 251.236 0.9328 
1 1 1 9   61  9  o 9  9.27095e+00 1.23141e+00 1.40012e+02 168.014 -1.53855e+01 3.26644e+00  0.00000e+00 0.00000e+00 1.97724e+02 168.014 5.77124e+01 168.014 0.9677 
1 1 1 9   61  10 o 2  7.54018e+00 1.43207e+00 8.94379e+01 246.422 -2.92282e+00 -6.69705e+00 0.00000e+00 0.00000e+00 1.74159e+02 246.422 8.47211e+01 246.422 0.9288 
1 1 1 9   61  11 o 18 9.07839e+00 1.53593e+00 1.60570e+02 169.693 -1.60481e+01 2.91848e+00  0.00000e+00 0.00000e+00 1.70389e+02 169.693 9.81948e+00 169.693 0.9688 
1 1 1 9   61  12 o 10 3.99279e+00 1.31672e+00 9.94708e+01 41.222  4.07513e+00  3.57030e+00  0.00000e+00 0.00000e+00 3.60377e+01 41.222  6.34331e+01 221.222 0.9022 
1 1 1 9   61  13 o 10 4.89150e+00 1.48194e+00 3.98389e+01 144.450 -2.12061e+00 1.51543e+00  0.00000e+00 0.00000e+00 1.02901e+02 144.450 6.30623e+01 144.450 0.7761 
1 1 1 9   62  0  o 5  7.82888e+00 9.27675e-01 2.35587e+02 121.154 -7.03195e+00 1.16321e+01  0.00000e+00 0.00000e+00 4.78146e+01 121.154 1.87772e+02 301.154 0.9625 
1 1 1 9   62  1  o 3  2.15886e+01 8.55434e-01 4.29459e+02 26.162  6.22755e+01  3.05923e+01  0.00000e+00 0.00000e+00 3.76895e+02 26.162  5.25636e+01 206.162 0.9928 
1 1 1 9   62  2  o 11 1.24910e+01 1.37688e+00 1.14726e+02 255.994 -2.41656e+00 -9.68817e+00 0.00000e+00 0.00000e+00 3.31151e+02 255.994 2.16425e+02 255.994 0.9485 
1 1 1 9   62  3  o 18 8.12571e+00 1.08608e+00 2.04875e+02 164.010 -1.28286e+01 3.67606e+00  0.00000e+00 0.00000e+00 8.92933e+01 164.010 1.15582e+02 344.010 0.9618 
1 1 1 9   62  4  o 7  4.76559e+00 1.09056e+00 1.49647e+02 283.824 1.44270e+00  -5.86315e+00 0.00000e+00 0.00000e+00 1.41439e+01 283.824 1.35503e+02 103.824 0.9129 
1 1 1 9   62  5  o 15 5.57450e+00 1.09279e+00 1.00749e+02 327.737 4.49252e+00  -2.83594e+00 0.00000e+00 0.00000e+00 8.81779e+01 327.737 1.25709e+01 147.737 0.9002 
1 1 1 9   62  6  o 1  6.21975e+00 1.19894e+00 1.78698e+02 322.199 8.51867e+00  -6.60797e+00 0.00000e+00 0.00000e+00 4.43420e+01 322.199 1.34356e+02 142.199 0.9524 
1 1 1 9   62  7  o 14 1.01971e+01 1.01252e+00 1.93004e+02 141.550 -1.80778e+01 1.43539e+01  0.00000e+00 0.00000e+00 1.82503e+02 141.550 1.05010e+01 321.550 0.9781 
1 1 1 9   62  8  o 18 3.73013e+00 1.13302e+00 1.07260e+02 347.994 4.51139e+00  -9.59384e-01 0.00000e+00 0.00000e+00 1.68113e+01 347.994 9.04488e+01 167.994 0.8835 
1 1 1 9   62  9  o 8  6.54825e+00 1.36605e+00 4.50041e+01 164.049 -3.15830e+00 9.02734e-01  0.00000e+00 0.00000e+00 1.59331e+02 164.049 1.14327e+02 164.049 0.8290 
1 1 1 9   62  10 o 2  7.89548e+00 1.42646e+00 1.57679e+02 259.827 -2.45272e+00 -1.36685e+01 0.00000e+00 0.00000e+00 1.28538e+02 259.827 2.91411e+01 79.827  0.9633 
1 1 1 9   62  11 o 2  7.09429e+00 1.64224e+00 1.77087e+02 199.811 -1.25007e+01 -4.50324e+00 0.00000e+00 0.00000e+00 7.95633e+01 199.811 9.75233e+01 19.811  0.9616 
1 1 1 9   62  12 o 10 4.63372e+00 1.42026e+00 1.04776e+02 46.099  4.32065e+00  4.48973e+00  0.00000e+00 0.00000e+00 5.48200e+01 46.099  4.99562e+01 226.099 0.9158 
1 1 1 9   62  13 o 13 6.13979e+00 1.55048e+00 1.03123e+02 35.378  6.57979e+00  4.67214e+00  0.00000e+00 0.00000e+00 1.12880e+02 35.378  9.75716e+00 35.378  0.9358 
1 1 1 9   63  0  f 0  2.93654e+01 7.65142e-01 6.46648e+02 347.813 1.54252e+02  -3.33128e+01 0.00000e+00 0.00000e+00 4.54108e+02 347.813 1.92540e+02 167.813 0.9968 
1 1 1 9   63  1  o 9  6.22641e+00 1.07416e+00 8.82649e+01 348.427 4.15584e+00  -8.51036e-01 0.00000e+00 0.00000e+00 1.16025e+02 348.427 2.77598e+01 348.427 0.8722 
1 1 1 9   63  2  o 2  1.15536e+01 9.06424e-01 1.79990e+02 233.724 -1.04353e+01 -1.42182e+01 0.00000e+00 0.00000e+00 2.42224e+02 233.724 6.22336e+01 233.724 0.9712 
1 1 1 9   63  3  o 11 6.68062e+00 9.62517e-01 9.04610e+01 51.344  3.30538e+00  4.13227e+00  0.00000e+00 0.00000e+00 1.35753e+02 51.344  4.52918e+01 51.344  0.8997 
1 1 1 9   63  4  o 19 1.54973e+01 7.16474e-01 2.75567e+02 252.478 -1.34968e+01 -4.27486e+01 0.00000e+00 0.00000e+00 3.01215e+02 252.478 2.56480e+01 252.478 0.9888 
1 1 1 9   63  5  o 6  7.56052e+00 1.00713e+00 1.08708e+02 230.038 -5.24542e+00 -6.25970e+00 0.00000e+00 0.00000e+00 1.57858e+02 230.038 4.91499e+01 230.038 0.9366 
1 1 1 9   63  6  o 13 9.79644e+00 9.68840e-01 1.49649e+02 313.154 1.12173e+01  -1.19646e+01 0.00000e+00 0.00000e+00 2.07709e+02 313.154 5.80597e+01 313.154 0.9690 
1 1 1 9   63  7  o 12 7.94324e+00 1.13442e+00 1.76540e+02 11.260  1.55544e+01  3.09668e+00  0.00000e+00 0.00000e+00 1.12885e+02 11.260  6.36544e+01 191.260 0.9679 
1 1 1 9   63  8  o 9  6.83806e+00 1.24963e+00 6.66254e+01 107.388 -1.51882e+00 4.85008e+00  0.00000e+00 0.00000e+00 1.63799e+02 107.388 9.71734e+01 107.388 0.8953 
1 1 1 9   63  9  o 16 4.52805e+00 1.22445e+00 7.21792e+01 286.546 1.12946e+00  -3.80167e+00 0.00000e+00 0.00000e+00 7.47465e+01 286.546 2.56721e+00 286.546 0.8622 
1 1 1 9   63  10 o 18 8.74543e+00 1.40933e+00 1.43917e+02 164.117 -1.44133e+01 4.10102e+00  0.00000e+00 0.00000e+00 1.73960e+02 164.117 3.00434e+01 164.117 0.9660 
1 1 1 9   63  11 o 1  1.00493e+01 1.48125e+00 1.69239e+02 99.004  -3.16530e+00 1.99759e+01  0.00000e+00 0.00000e+00 1.99299e+02 99.004  3.00592e+01 99.004  0.9750 
1 1 1 9   63  12 o 9  3.72895e+00 1.24820e+00 5.02998e+01 42.362  2.09853e+00  1.91369e+00  0.00000e+00 0.00000e+00 6.15138e+01 42.362  1.12140e+01 42.362  0.7974 
1 1 1 9   63  13 o 11 4.58826e+00 1.48132e+00 9.74560e+01 70.283  1.99571e+00  5.56845e+00  0.00000e+00 0.00000e+00 5.96592e+01 70.283  3.77967e+01 250.283 0.9110 
1 1 1 9   64  0  o 11 7.00803e+00 9.55712e-01 1.59389e+02 290.004 3.20215e+00  -8.79581e+00 0.00000e+00 0.00000e+00 8.95971e+01 290.004 6.97919e+01 110.004 0.9450 
1 1 1 9   64  1  o 6  6.31664e+00 9.62200e-01 1.16342e+02 169.933 -6.03628e+00 1.07162e+00  0.00000e+00 0.00000e+00 1.00878e+02 169.933 1.54641e+01 349.933 0.9143 
1 1 1 9   64  2  o 14 4.02542e+00 1.10400e+00 9.07249e+01 269.206 -4.03268e-02 -2.90818e+00 0.00000e+00 0.00000e+00 3.08768e+01 269.206 5.98481e+01 89.206  0.8030 
1 1 1 9   64  3  o 15 9.99471e+00 8.31844e-01 2.06774e+02 68.780  6.87747e+00  1.77126e+01  0.00000e+00 0.00000e+00 1.59274e+02 68.780  4.75001e+01 248.780 0.9733 
1 1 1 9   64  4  o 7  1.08606e+01 8.08954e-01 1.63416e+02 196.513 -1.70492e+01 -5.05440e+00 0.00000e+00 0.00000e+00 2.33645e+02 196.513 7.02282e+01 196.513 0.9715 
1 1 1 9   64  5  o 11 9.80851e+00 8.67527e-01 1.65604e+02 68.700  5.79123e+00  1.48541e+01  0.00000e+00 0.00000e+00 1.91788e+02 68.700  2.61843e+01 68.700  0.9681 
1 1 1 9   64  6  o 9  4.67572e+00 1.14876e+00 8.25745e+01 241.237 -1.99112e+00 -3.62735e+00 0.00000e+00 0.00000e+00 7.02901e+01 241.237 1.22844e+01 61.237  0.8686 
1 1 1 9   64  7  f 0  6.11726e+00 1.21170e+00 5.65764e+01 167.747 -3.69515e+00 8.02514e-01  0.00000e+00 0.00000e+00 1.40171e+02 167.747 8.35943e+01 167.747 0.8546 
1 1 1 9   64  8  o 13 8.00993e+00 1.22891e+00 1.29877e+02 145.881 -9.57054e+00 6.48444e+00  0.00000e+00 0.00000e+00 1.58214e+02 145.881 2.83373e+01 145.881 0.9557 
1 1 1 9   64  9  o 3  4.30585e+00 1.25469e+00 7.26917e+01 317.981 2.86150e+00  -2.57822e+00 0.00000e+00 0.00000e+00 6.62491e+01 317.981 6.44252e+00 137.981 0.8576 
1 1 1 9   64  10 o 8  5.67702e+00 1.46404e+00 1.51422e+02 122.218 -5.33665e+00 8.46851e+00  0.00000e+00 0.00000e+00 5.11761e+01 122.218 1.00246e+02 302.218 0.9487 
1 1 1 9   64  11 o 7  8.27287e+00 1.56358e+00 9.58714e+01 124.429 -4.99726e+00 7.29027e+00  0.00000e+00 0.00000e+00 1.97092e+02 124.429 1.01220e+02 124.429 0.9416 
1 1 1 9   64  12 o 9  4.75156e+00 1.47255e+00 1.12783e+02 229.262 -4.48419e+00 -5.20639e+00 0.00000e+00 0.00000e+00 5.22908e+01 229.262 6.04926e+01 49.262  0.9241 
1 1 1 9   64  13 o 1  7.86516e+00 1.87534e+00 1.86858e+02 244.285 -6.55548e+00 -1.36124e+01 0.00000e+00 0.00000e+00 9.87651e+01 244.285 8.80929e+01 64.285  0.9663 
1 1 1 9   65  0  o 15 8.89644e+00 7.79504e-01 5.89730e+01 250.510 -1.53514e+00 -4.33749e+00 0.00000e+00 0.00000e+00 2.36402e+02 250.510 1.77429e+02 250.510 0.8832 
1 1 1 9   65  1  o 18 6.47823e+00 1.09258e+00 1.19768e+02 17.813  5.90416e+00  1.89708e+00  0.00000e+00 0.00000e+00 1.03222e+02 17.813  1.65453e+01 197.813 0.9154 
1 1 1 9   65  2  o 1  1.82850e+01 6.41961e-01 3.67021e+02 80.061  1.10535e+01  6.30822e+01  0.00000e+00 0.00000e+00 3.15352e+02 80.061  5.16693e+01 260.061 0.9922 
1 1 1 9   65  3  o 2  3.80718e+00 9.57743e-01 1.01898e+02 142.537 -2.99304e+00 2.29354e+00  0.00000e+00 0.00000e+00 2.04347e+01 142.537 8.14635e+01 322.537 0.8541 
1 1 1 9   65  4  o 7  1.22533e+01 7.48866e-01 2.60557e+02 181.614 -3.28449e+01 -9.25370e-01 0.00000e+00 0.00000e+00 1.93428e+02 181.614 6.71288e+01 1.614   0.9847 
1 1 1 9   65  5  o 9  1.34049e+01 7.84861e-01 2.15652e+02 266.036 -2.28032e+00 -3.29044e+01 0.00000e+00 0.00000e+00 2.81074e+02 266.036 6.54223e+01 266.036 0.9847 
1 1 1 9   65  6  o 12 5.07804e+00 1.27605e+00 7.56222e+01 18.190  3.51193e+00  1.15399e+00  0.00000e+00 0.00000e+00 8.69515e+01 18.190  1.13293e+01 18.190  0.8508 
1 1 1 9   65  7  o 2  3.46716e+00 1.04476e+00 1.27112e+02 47.067  3.50746e+00  3.77014e+00  0.00000e+00 0.00000e+00 1.01152e+01 227.067 1.37227e+02 227.067 0.8967 
1 1 1 9   65  8  o 5  3.78032e+00 1.11686e+00 5.84247e+01 87.874  1.05203e-01  2.83414e+00  0.00000e+00 0.00000e+00 5.49547e+01 87.874  3.47000e+00 267.874 0.7971 
1 1 1 9   65  9  o 4  4.98047e+00 1.33444e+00 1.39140e+02 187.205 -8.36646e+00 -1.05774e+00 0.00000e+00 0.00000e+00 3.67410e+01 187.205 1.02399e+02 7.205   0.9387 
1 1 1 9   65  10 o 1  4.03561e+00 1.24015e+00 4.00472e+01 62.741  9.49595e-01  1.84305e+00  0.00000e+00 0.00000e+00 6.76399e+01 62.741  2.75927e+01 62.741  0.7095 
1 1 1 9   65  11 o 15 7.33196e+00 1.61967e+00 5.52307e+01 351.105 4.20689e+00  -6.58384e-01 0.00000e+00 0.00000e+00 1.85386e+02 351.105 1.30156e+02 351.105 0.8728 
1 1 1 9   65  12 o 15 4.34425e+00 1.32740e+00 4.80880e+01 141.758 -2.45720e+00 1.93652e+00  0.00000e+00 0.00000e+00 8.56617e+01 141.758 3.75737e+01 141.758 0.8191 
1 1 1 9   65  13 o 13 5.52239e+00 1.64339e+00 4.09330e+01 318.267 2.05751e+00  -1.83532e+00 0.00000e+00 0.00000e+00 1.23052e+02 318.267 8.21191e+01 318.267 0.7903 
1 1 1 9   66  0  o 13 5.63856e+00 1.09215e+00 1.05342e+02 305.989 2.92679e+00  -4.03004e+00 0.00000e+00 0.00000e+00 8.38891e+01 305.989 2.14531e+01 125.989 0.8929 
1 1 1 9   66  1  o 7  1.19127e+01 8.33802e-01 2.37543e+02 47.674  1.73007e+01  1.89957e+01  0.00000e+00 0.00000e+00 2.01530e+02 47.674  3.60131e+01 227.674 0.9803 
1 1 1 9   66  2  o 12 9.76263e+00 7.50549e-01 1.64489e+02 289.121 4.94818e+00  -1.42722e+01 0.00000e+00 0.00000e+00 1.90285e+02 289.121 2.57964e+01 289.121 0.9663 
1 1 1 9   66  3  o 19 3.29170e+00 9.16283e-01 4.69851e+01 269.038 -2.51214e-02 -1.49669e+00 0.00000e+00 0.00000e+00 2.67312e+01 269.038 2.02540e+01 89.038  0.5954 
1 1 1 9   66  4  o 1  1.21887e+01 7.57925e-01 2.24282e+02 257.153 -6.56641e+00 -2.87939e+01 0.00000e+00 0.00000e+00 2.26431e+02 257.153 2.14964e+00 257.153 0.9829 
1 1 1 9   66  5  o 5  1.18863e+01 8.09419e-01 1.87872e+02 72.479  7.99548e+00  2.53262e+01  0.00000e+00 0.00000e+00 2.50833e+02 72.479  6.29617e+01 72.479  0.9810 
1 1 1 9   66  6  o 4  4.61133e+00 1.29250e+00 8.05163e+01 130.717 -2.40466e+00 2.79395e+00  0.00000e+00 0.00000e+00 6.70057e+01 130.717 1.35106e+01 310.717 0.8503 
1 1 1 9   66  7  o 2  1.47101e+01 8.67347e-01 2.62595e+02 49.879  3.24259e+01  3.84790e+01  0.00000e+00 0.00000e+00 2.85320e+02 49.879  2.27247e+01 49.879  0.9900 
1 1 1 9   66  8  o 17 3.84499e+00 1.11810e+00 7.23559e+01 69.974  1.22733e+00  3.36734e+00  0.00000e+00 0.00000e+00 4.99256e+01 69.974  2.24303e+01 249.974 0.8454 
1 1 1 9   66  9  o 17 9.57977e+00 1.30509e+00 1.88571e+02 342.615 2.01040e+01  -6.29457e+00 0.00000e+00 0.00000e+00 1.63103e+02 342.615 2.54681e+01 162.615 0.9760 
1 1 1 9   66  10 o 6  3.18840e+00 1.06869e+00 5.35010e+01 141.002 -2.10162e+00 1.70174e+00  0.00000e+00 0.00000e+00 4.06817e+01 141.002 1.28194e+01 321.002 0.7855 
1 1 1 9   66  11 o 16 6.74551e+00 1.61800e+00 1.25086e+02 160.159 -8.64575e+00 3.11959e+00  0.00000e+00 0.00000e+00 1.14292e+02 160.159 1.07947e+01 340.159 0.9439 
1 1 1 9   66  12 o 10 5.47116e+00 1.56140e+00 6.15789e+01 174.183 -4.08416e+00 4.16075e-01  0.00000e+00 0.00000e+00 1.16786e+02 174.183 5.52073e+01 174.183 0.8675 
1 1 1 9   67  0  o 19 1.44262e+01 7.55154e-01 2.75039e+02 257.153 -8.27890e+00 -3.63016e+01 0.00000e+00 0.00000e+00 2.59730e+02 257.153 1.53089e+01 77.153  0.9865 
1 1 1 9   67  1  o 17 7.12301e+00 9.89252e-01 1.69375e+02 88.879  2.06850e-01  1.05675e+01  0.00000e+00 0.00000e+00 8.53782e+01 88.879  8.39969e+01 268.879 0.9514 
1 1 1 9   67  2  o 4  3.37732e+00 9.40424e-01 8.79560e+01 318.197 2.12936e+00  -1.90410e+00 0.00000e+00 0.00000e+00 1.34805e+01 318.197 7.44756e+01 138.197 0.7988 
1 1 1 9   67  3  o 7  9.23576e+00 9.25743e-01 1.41368e+02 280.238 2.25773e+00  -1.25008e+01 0.00000e+00 0.00000e+00 1.92005e+02 280.238 5.06372e+01 280.238 0.9598 
1 1 1 9   67  4  o 16 4.94188e+00 1.11850e+00 6.29690e+01 167.635 -2.92827e+00 6.41970e-01  0.00000e+00 0.00000e+00 8.75623e+01 167.635 2.45933e+01 167.635 0.8098 
1 1 1 9   67  5  o 4  8.20019e+00 9.64880e-01 1.78001e+02 74.358  4.57475e+00  1.63387e+01  0.00000e+00 0.00000e+00 1.21231e+02 74.358  5.67702e+01 254.358 0.9701 
1 1 1 9   67  6  o 18 1.88751e+01 1.00688e+00 3.24780e+02 250.121 -2.49823e+01 -6.90908e+01 0.00000e+00 0.00000e+00 3.80411e+02 250.121 5.56303e+01 250.121 0.9932 
1 1 1 9   67  7  o 8  1.16633e+01 9.22625e-01 1.53847e+02 332.186 2.07984e+01  -1.09724e+01 0.00000e+00 0.00000e+00 2.75454e+02 332.186 1.21607e+02 332.186 0.9785 
1 1 1 9   67  8  o 5  3.77753e+00 1.11885e+00 3.44111e+01 137.909 -1.23940e+00 1.11954e+00  0.00000e+00 0.00000e+00 5.58793e+01 137.909 2.14682e+01 137.909 0.6355 
1 1 1 9   67  9  o 16 1.06286e+01 1.24756e+00 2.09075e+02 299.274 1.34705e+01  -2.40294e+01 0.00000e+00 0.00000e+00 1.83313e+02 299.274 2.57620e+01 119.274 0.9817 
1 1 1 9   67  10 o 12 3.89265e+00 1.22057e+00 3.50056e+01 223.794 -1.34545e+00 -1.28999e+00 0.00000e+00 0.00000e+00 6.36577e+01 223.794 2.86522e+01 223.794 0.6741 
1 1 1 9   67  11 o 13 7.92215e+00 1.59651e+00 1.10544e+02 257.097 -2.20638e+00 -9.63158e+00 0.00000e+00 0.00000e+00 1.71741e+02 257.097 6.11963e+01 257.097 0.9480 
1 1 1 9   67  12 o 9  4.27969e+00 1.38322e+00 9.98947e+01 227.291 -4.20288e+00 -4.55321e+00 0.00000e+00 0.00000e+00 4.72976e+01 227.291 5.25972e+01 47.291  0.9153 
1 1 1 9   68  0  o 3  7.07995e+00 1.00047e+00 1.03401e+02 69.043  2.50491e+00  6.54020e+00  0.00000e+00 0.00000e+00 1.42797e+02 69.043  3.93959e+01 69.043  0.9256 
1 1 1 9   68  1  o 17 1.61858e+01 7.51426e-01 3.03774e+02 324.549 4.08636e+01  -2.90953e+01 0.00000e+00 0.00000e+00 2.98442e+02 324.549 5.33256e+00 144.549 0.9900 
1 1 1 9   68  2  f 0  1.29544e+01 6.55897e-01 2.47684e+02 252.585 -1.05030e+01 -3.34841e+01 0.00000e+00 0.00000e+00 2.32322e+02 252.585 1.53624e+01 72.585  0.9856 
1 1 1 9   68  3  f 0  2.95283e+00 8.42921e-01 1.25385e+02 147.602 -3.09631e+00 1.96483e+00  0.00000e+00 0.00000e+00 3.10796e+01 327.602 1.56465e+02 327.602 0.8494 
1 1 1 9   68  4  o 5  1.80948e+01 6.91461e-01 2.58961e+02 151.415 -5.09996e+01 2.77887e+01  0.00000e+00 0.00000e+00 4.15638e+02 151.415 1.56677e+02 151.415 0.9914 
1 1 1 9   68  5  o 9  4.38870e+00 1.02956e+00 9.66967e+01 147.977 -3.85889e+00 2.41346e+00  0.00000e+00 0.00000e+00 4.88558e+01 147.977 4.78409e+01 327.977 0.8818 
1 1 1 9   68  6  o 2  5.90995e+00 1.33637e+00 5.61245e+01 341.589 3.31690e+00  -1.10408e+00 0.00000e+00 0.00000e+00 1.30786e+02 341.589 7.46616e+01 341.589 0.8409 
1 1 1 9   68  7  o 16 4.70818e+00 1.16116e+00 1.16535e+02 357.923 6.30365e+00  -2.28555e-01 0.00000e+00 0.00000e+00 4.58213e+01 357.923 7.07137e+01 177.923 0.9169 
1 1 1 9   68  8  o 14 5.34436e+00 1.28818e+00 1.56883e+02 114.371 -4.04214e+00 8.92283e+00  0.00000e+00 0.00000e+00 3.35441e+01 114.371 1.23339e+02 294.371 0.9475 
1 1 1 9   68  9  o 18 1.13271e+01 1.14427e+00 1.88390e+02 274.877 2.54480e+00  -2.98261e+01 0.00000e+00 0.00000e+00 2.30335e+02 274.877 4.19443e+01 274.877 0.9832 
1 1 1 9   68  10 o 1  3.51786e+00 1.16253e+00 1.02301e+02 248.610 -1.78373e+00 -4.55382e+00 0.00000e+00 0.00000e+00 1.54986e+01 248.610 8.68027e+01 68.610  0.8908 
1 1 1 9   68  11 o 8  8.75859e+00 1.64131e+00 2.00273e+02 130.999 -1.26947e+01 1.46040e+01  0.00000e+00 0.00000e+00 1.20266e+02 130.999 8.00073e+01 310.999 0.9738 
1 1 1 9   68  12 o 1  8.22000e+00 1.80168e+00 1.46847e+02 177.049 -1.27489e+01 6.57161e-01  0.00000e+00 0.00000e+00 1.49613e+02 177.049 2.76602e+00 177.049 0.9600 
1 1 1 9   69  0  o 6  7.54372e+00 9.32496e-01 1.44106e+02 272.552 4.65420e-01  -1.04441e+01 0.00000e+00 0.00000e+00 1.25348e+02 272.552 1.87584e+01 92.552  0.9509 
1 1 1 9   69  1  o 18 3.20047e+00 9.01917e-01 4.31545e+01 263.114 -1.67825e-01 -1.38963e+00 0.00000e+00 0.00000e+00 2.54358e+01 263.114 1.77187e+01 83.114  0.5703 
1 1 1 9   69  2  o 6  3.85577e+00 8.45678e-01 8.42217e+01 194.208 -3.30927e+00 -8.37873e-01 0.00000e+00 0.00000e+00 3.70013e+01 194.208 4.72203e+01 14.208  0.8365 
1 1 1 9   69  3  o 4  1.78681e+01 6.38477e-01 3.24974e+02 110.409 -2.30086e+01 6.18375e+01  0.00000e+00 0.00000e+00 3.41649e+02 110.409 1.66742e+01 110.409 0.9924 
1 1 1 9   69  4  o 1  6.14519e+00 1.02878e+00 1.01393e+02 299.275 3.45121e+00  -6.15621e+00 0.00000e+00 0.00000e+00 1.12604e+02 299.275 1.12101e+01 299.275 0.9262 
1 1 1 9   69  5  o 1  9.53469e+00 9.04955e-01 1.64756e+02 289.985 6.33396e+00  -1.74162e+01 0.00000e+00 0.00000e+00 1.83963e+02 289.985 1.92071e+01 289.985 0.9726 
1 1 1 9   69  6  o 16 1.02957e+01 1.00137e+00 1.97336e+02 180.455 -2.49546e+01 -1.98315e-01 0.00000e+00 0.00000e+00 1.81983e+02 180.455 1.53524e+01 0.455   0.9798 
1 1 1 9   69  7  o 8  6.03755e+00 1.27350e+00 1.05375e+02 203.470 -6.86880e+00 -2.98234e+00 0.00000e+00 0.00000e+00 1.05899e+02 203.470 5.23673e-01 203.470 0.9306 
1 1 1 9   69  8  o 8  4.44504e+00 1.30824e+00 1.26454e+02 239.605 -3.21539e+00 -5.48159e+00 0.00000e+00 0.00000e+00 2.68940e+01 239.605 9.95601e+01 59.605  0.9175 
1 1 1 9   69  9  o 6  3.60031e+00 1.13302e+00 4.61443e+01 42.658  1.75166e+00  1.61398e+00  0.00000e+00 0.00000e+00 5.55700e+01 42.658  9.42576e+00 42.658  0.7515 
1 1 1 9   69  10 o 18 5.06368e+00 1.40691e+00 5.84303e+01 233.102 -2.19476e+00 -2.92338e+00 0.00000e+00 0.00000e+00 1.03118e+02 233.102 4.46875e+01 233.102 0.8488 
1 1 1 9   69  11 o 14 3.94186e+00 1.26592e+00 6.34512e+01 288.981 1.21576e+00  -3.53472e+00 0.00000e+00 0.00000e+00 6.28344e+01 288.981 6.16740e-01 108.981 0.8526 
1 1 1 9   69  12 o 9  4.77898e+00 1.46396e+00 3.57326e+01 323.113 1.83142e+00  -1.37444e+00 0.00000e+00 0.00000e+00 9.71134e+01 323.113 6.13808e+01 323.113 0.7401 
1 1 1 9   70  0  o 18 1.00069e+01 1.05984e+00 1.27997e+02 68.059  4.43558e+00  1.10113e+01  0.00000e+00 0.00000e+00 2.31630e+02 68.059  1.03633e+02 68.059  0.9569 
1 1 1 9   70  1  o 14 7.69722e+00 8.32421e-01 1.29307e+02 234.216 -6.14214e+00 -8.52128e+00 0.00000e+00 0.00000e+00 1.45737e+02 234.216 1.64300e+01 234.216 0.9511 
1 1 1 9   70  2  o 14 1.26001e+01 6.62475e-01 2.16192e+02 190.832 -2.78216e+01 -5.32324e+00 0.00000e+00 0.00000e+00 2.48871e+02 190.832 3.26788e+01 190.832 0.9822 
1 1 1 9   70  3  o 15 5.98920e+00 9.40359e-01 1.14263e+02 322.972 6.18233e+00  -4.66345e+00 0.00000e+00 0.00000e+00 9.57689e+01 322.972 1.84944e+01 142.972 0.9330 
1 1 1 9   70  4  o 12 9.87616e+00 7.86137e-01 2.12028e+02 158.686 -2.29890e+01 8.96951e+00  0.00000e+00 0.00000e+00 1.51638e+02 158.686 6.03901e+01 338.686 0.9795 
1 1 1 9   70  5  o 19 1.32675e+01 7.42477e-01 2.09249e+02 275.205 3.39076e+00  -3.72196e+01 0.00000e+00 0.00000e+00 2.82830e+02 275.205 7.35808e+01 275.205 0.9865 
1 1 1 9   70  6  o 10 1.29000e+01 8.72041e-01 1.67500e+02 46.965  2.02062e+01  2.16418e+01  0.00000e+00 0.00000e+00 3.09235e+02 46.965  1.41735e+02 46.965  0.9830 
1 1 1 9   70  7  o 15 4.12992e+00 1.17548e+00 3.06063e+01 143.006 -1.25281e+00 9.43848e-01  0.00000e+00 0.00000e+00 6.45141e+01 143.006 3.39078e+01 143.006 0.6126 
1 1 1 9   70  8  o 14 1.14879e+01 1.36374e+00 2.07662e+02 116.316 -1.19308e+01 2.41227e+01  0.00000e+00 0.00000e+00 2.16087e+02 116.316 8.42493e+00 116.316 0.9812 
1 1 1 9   70  9  o 11 5.42465e+00 1.38661e+00 9.26582e+01 359.422 6.26431e+00  -6.31529e-02 0.00000e+00 0.00000e+00 9.41631e+01 359.422 1.50485e+00 359.422 0.9163 
1 1 1 9   70  10 o 3  3.13833e+00 1.06412e+00 3.71605e+01 259.772 -3.33513e-01 -1.84836e+00 0.00000e+00 0.00000e+00 4.26463e+01 259.772 5.48577e+00 259.772 0.6767 
1 1 1 9   70  11 o 5  8.61209e+00 1.54631e+00 1.67156e+02 11.565  1.74080e+01  3.56221e+00  0.00000e+00 0.00000e+00 1.47135e+02 11.565  2.00211e+01 191.565 0.9714 
1 1 1 9   70  12 o 9  7.31056e+00 1.76658e+00 1.72311e+02 91.004  -2.45866e-01 1.40286e+01  0.00000e+00 0.00000e+00 9.22606e+01 91.004  8.00505e+01 271.004 0.9637 
1 1 1 9   71  0  o 7  5.63406e+00 1.08632e+00 1.61716e+02 197.642 -7.89874e+00 -2.51202e+00 0.00000e+00 0.00000e+00 3.66314e+01 197.642 1.25085e+02 17.642  0.9376 
1 1 1 9   71  1  o 7  1.03482e+01 6.99275e-01 1.72879e+02 311.613 1.32805e+01  -1.49512e+01 0.00000e+00 0.00000e+00 2.05966e+02 311.613 3.30862e+01 311.613 0.9747 
1 1 1 9   71  2  o 12 1.14345e+01 6.69227e-01 2.28210e+02 136.415 -2.23248e+01 2.12484e+01  0.00000e+00 0.00000e+00 1.94373e+02 136.415 3.38370e+01 316.415 0.9836 
1 1 1 9   71  3  f 0  1.82874e+01 6.60181e-01 2.18098e+02 353.577 5.17090e+01  -5.82087e+00 0.00000e+00 0.00000e+00 4.62498e+02 353.577 2.44400e+02 353.577 0.9903 
1 1 1 9   71  4  o 4  9.65202e+00 8.20506e-01 2.21055e+02 203.627 -2.38500e+01 -1.04332e+01 0.00000e+00 0.00000e+00 1.34679e+02 203.627 8.63765e+01 23.627  0.9806 
1 1 1 9   71  5  o 12 4.93970e+00 1.13371e+00 6.14740e+01 151.356 -3.11591e+00 1.70198e+00  0.00000e+00 0.00000e+00 9.51794e+01 151.356 3.37054e+01 151.356 0.8437 
1 1 1 9   71  6  o 10 8.21255e+00 1.03769e+00 1.08427e+02 280.990 2.07405e+00  -1.06799e+01 0.00000e+00 0.00000e+00 1.85728e+02 280.990 7.73011e+01 280.990 0.9529 
1 1 1 9   71  7  o 2  1.58346e+01 8.66983e-01 2.80607e+02 227.590 -4.37438e+01 -4.78883e+01 0.00000e+00 0.00000e+00 3.09979e+02 227.590 2.93721e+01 227.590 0.9923 
1 1 1 9   71  8  o 3  9.72059e+00 1.40845e+00 1.47203e+02 100.864 -3.17705e+00 1.65538e+01  0.00000e+00 0.00000e+00 2.07131e+02 100.864 5.99282e+01 100.864 0.9699 
1 1 1 9   71  9  o 8  1.06584e+01 1.27195e+00 1.89346e+02 308.100 1.72763e+01  -2.20336e+01 0.00000e+00 0.00000e+00 2.03963e+02 308.100 1.46169e+01 308.100 0.9820 
1 1 1 9   71  10 o 17 3.58207e+00 1.13142e+00 8.63800e+01 251.857 -1.44593e+00 -4.41269e+00 0.00000e+00 0.00000e+00 3.26427e+01 251.857 5.37373e+01 71.857  0.8844 
1 1 1 9   71  11 o 18 4.28491e+00 1.33386e+00 9.36229e+01 17.624  5.69352e+00  1.80867e+00  0.00000e+00 0.00000e+00 5.31473e+01 17.624  4.04756e+01 197.624 0.9120 
1 1 1 9   71  12 o 8  4.79975e+00 1.48530e+00 1.08964e+02 249.820 -2.48283e+00 -6.75532e+00 0.00000e+00 0.00000e+00 5.82176e+01 249.820 5.07467e+01 69.820  0.9277 
1 1 1 9   72  0  o 12 1.45830e+01 6.10184e-01 2.70057e+02 65.029  1.90020e+01  4.08032e+01  0.00000e+00 0.00000e+00 2.71297e+02 65.029  1.24064e+00 65.029  0.9888 
1 1 1 9   72  1  o 14 7.72863e+00 7.77170e-01 1.23639e+02 218.900 -8.48432e+00 -6.84590e+00 0.00000e+00 0.00000e+00 1.52952e+02 218.900 2.93129e+01 218.900 0.9530 
1 1 1 9   72  2  o 11 1.15924e+01 6.72497e-01 2.46171e+02 176.686 -3.70585e+01 2.14555e+00  0.00000e+00 0.00000e+00 1.83381e+02 176.686 6.27900e+01 356.686 0.9864 
1 1 1 9   72  3  o 12 6.04891e+00 9.72892e-01 1.07712e+02 64.019  3.13287e+00  6.42867e+00  0.00000e+00 0.00000e+00 1.03010e+02 64.019  4.70273e+00 244.019 0.9272 
1 1 1 9   72  4  o 18 1.26990e+01 7.28088e-01 1.70802e+02 138.254 -2.17618e+01 1.94207e+01  0.00000e+00 0.00000e+00 2.98143e+02 138.254 1.27340e+02 138.254 0.9827 
1 1 1 9   72  5  o 2  4.21604e+00 1.01462e+00 9.54392e+01 300.229 2.47032e+00  -4.23953e+00 0.00000e+00 0.00000e+00 4.57612e+01 300.229 4.96780e+01 120.229 0.8912 
1 1 1 9   72  6  o 6  7.40926e+00 1.07570e+00 1.17747e+02 328.428 9.75356e+00  -5.99388e+00 0.00000e+00 0.00000e+00 1.48253e+02 328.428 3.05062e+01 328.428 0.9553 
1 1 1 9   72  7  o 5  3.64800e+00 1.07106e+00 8.13666e+01 109.356 -1.34296e+00 3.82285e+00  0.00000e+00 0.00000e+00 3.72869e+01 109.356 4.40797e+01 289.356 0.8655 
1 1 1 9   72  8  o 4  6.40550e+00 1.43502e+00 1.05270e+02 340.687 7.45450e+00  -2.61246e+00 0.00000e+00 0.00000e+00 1.19633e+02 340.687 1.43629e+01 340.687 0.9344 
1 1 1 9   72  9  o 10 8.14769e+00 1.37254e+00 1.54800e+02 131.232 -1.04891e+01 1.19680e+01  0.00000e+00 0.00000e+00 1.41539e+02 131.232 1.32617e+01 311.232 0.9681 
1 1 1 9   72  10 o 17 4.22565e+00 1.23556e+00 5.69593e+01 211.133 -2.96829e+00 -1.79295e+00 0.00000e+00 0.00000e+00 7.62774e+01 211.133 1.93181e+01 211.133 0.8394 
1 1 1 9   72  11 o 7  9.69524e+00 1.61243e+00 1.54419e+02 51.921  1.08001e+01  1.37841e+01  0.00000e+00 0.00000e+00 1.99109e+02 51.921  4.46899e+01 51.921  0.9710 
1 1 1 9   72  12 o 12 6.54529e+00 1.69552e+00 8.02867e+01 3.321   6.45405e+00  3.74551e-01  0.00000e+00 0.00000e+00 1.45526e+02 3.321   6.52394e+01 3.321   0.9190 
1 1 1 9   73  0  o 9  5.67221e+00 8.52692e-01 1.11712e+02 96.984  -9.00738e-01 7.35249e+00  0.00000e+00 0.00000e+00 8.62480e+01 96.984  2.54636e+01 276.984 0.9298 
1 1 1 9   73  1  o 8  1.07543e+01 6.69997e-01 1.37281e+02 71.178  6.19707e+00  1.81810e+01  0.00000e+00 0.00000e+00 2.55849e+02 71.178  1.18568e+02 71.178  0.9736 
1 1 1 9   73  2  o 3  5.01284e+00 9.62057e-01 2.76299e+01 40.401  1.16379e+00  9.90505e-01  0.00000e+00 0.00000e+00 8.59012e+01 40.401  5.82713e+01 40.401  0.6030 
1 1 1 9   73  3  o 6  1.21574e+01 6.96325e-01 1.73013e+02 342.991 2.56204e+01  -7.83726e+00 0.00000e+00 0.00000e+00 2.75070e+02 342.991 1.02057e+02 342.991 0.9812 
1 1 1 9   73  4  o 14 3.62726e+00 9.78317e-01 8.54620e+01 116.048 -1.71592e+00 3.51061e+00  0.00000e+00 0.00000e+00 3.17184e+01 116.048 5.37436e+01 296.048 0.8599 
1 1 1 9   73  5  o 3  7.62821e+00 9.79503e-01 1.62651e+02 39.459  1.22205e+01  1.00590e+01  0.00000e+00 0.00000e+00 1.14760e+02 39.459  4.78904e+01 219.458 0.9679 
1 1 1 9   73  6  o 7  1.04397e+01 9.07016e-01 1.79215e+02 196.811 -2.57184e+01 -7.77040e+00 0.00000e+00 0.00000e+00 2.05679e+02 196.811 2.64643e+01 196.811 0.9812 
1 1 1 9   73  7  o 6  2.32178e+00 8.01706e-01 3.96968e+01 196.368 -1.45384e+00 -4.26996e-01 0.00000e+00 0.00000e+00 1.26347e+01 196.368 2.70621e+01 16.368  0.5999 
1 1 1 9   73  8  o 14 6.71425e+00 1.43700e+00 1.34869e+02 56.053  5.98960e+00  8.89769e+00  0.00000e+00 0.00000e+00 1.05320e+02 56.053  2.95490e+01 236.053 0.9522 
1 1 1 9   73  9  o 19 9.57056e+00 1.26406e+00 1.75712e+02 169.125 -2.26509e+01 4.35177e+00  0.00000e+00 0.00000e+00 1.75912e+02 169.125 1.99406e-01 169.125 0.9781 
1 1 1 9   73  10 o 17 3.44027e+00 1.13144e+00 8.25674e+01 275.747 4.43788e-01  -4.40952e+00 0.00000e+00 0.00000e+00 3.09091e+01 275.747 5.16583e+01 95.747  0.8783 
1 1 1 9   73  11 o 5  7.84015e+00 1.63478e+00 1.48798e+02 349.988 1.37252e+01  -2.42308e+00 0.00000e+00 0.00000e+00 1.34796e+02 349.988 1.40024e+01 169.988 0.9634 
1 1 1 9   73  12 o 13 3.75462e+00 1.23781e+00 8.22687e+01 270.097 9.60187e-03  -5.67984e+00 0.00000e+00 0.00000e+00 4.55567e+01 270.097 3.67120e+01 90.097  0.9071 
1 1 1 9   74  0  o 14 6.90975e+00 9.52807e-01 1.13906e+02 336.242 8.40457e+00  -3.69957e+00 0.00000e+00 0.00000e+00 1.30838e+02 336.242 1.69319e+01 336.242 0.9439 
1 1 1 9   74  1  o 11 6.50045e+00 8.54055e-01 8.25173e+01 219.646 -4.74746e+00 -3.93394e+00 0.00000e+00 0.00000e+00 1.40726e+02 219.646 5.82091e+01 219.646 0.9149 
1 1 1 9   74  2  o 5  1.73530e+01 6.40691e-01 2.33400e+02 52.667  3.32573e+01  4.36045e+01  0.00000e+00 0.00000e+00 4.12224e+02 52.667  1.78824e+02 52.667  0.9908 
1 1 1 9   74  3  o 7  7.04112e+00 9.22253e-01 1.13245e+02 155.714 -9.09155e+00 4.10239e+00  0.00000e+00 0.00000e+00 1.37570e+02 155.714 2.43245e+01 155.714 0.9485 
1 1 1 9   74  4  o 3  8.72480e+00 8.60267e-01 9.60750e+01 67.048  4.27114e+00  1.00859e+01  0.00000e+00 0.00000e+00 2.16313e+02 67.048  1.20238e+02 67.048  0.9532 
1 1 1 9   74  5  o 6  6.31903e+00 1.03770e+00 9.20221e+01 200.478 -7.45372e+00 -2.78364e+00 0.00000e+00 0.00000e+00 1.29897e+02 200.478 3.78747e+01 200.478 0.9349 
1 1 1 9   74  6  o 8  3.05719e+00 9.37226e-01 8.20522e+01 340.974 3.34561e+00  -1.15368e+00 0.00000e+00 0.00000e+00 1.47785e+01 340.974 6.72737e+01 160.974 0.8431 
1 1 1 9   74  7  o 2  1.32196e+01 8.87380e-01 2.44617e+02 238.984 -2.42817e+01 -4.03860e+01 0.00000e+00 0.00000e+00 2.46688e+02 238.984 2.07096e+00 238.984 0.9893 
1 1 1 9   74  8  o 6  3.82973e+00 1.15116e+00 4.63949e+01 72.849  7.59234e-01  2.46008e+00  0.00000e+00 0.00000e+00 6.47846e+01 72.849  1.83897e+01 72.849  0.7729 
1 1 1 9   74  9  o 13 7.40334e+00 1.45732e+00 5.84199e+01 299.508 2.54382e+00  -4.49465e+00 0.00000e+00 0.00000e+00 1.91001e+02 299.508 1.32581e+02 299.508 0.8971 
1 1 1 9   74  10 o 6  5.13155e+00 1.40991e+00 7.62831e+01 29.577  4.59054e+00  2.60535e+00  0.00000e+00 0.00000e+00 9.70246e+01 29.577  2.07415e+01 29.577  0.8995 
1 1 1 9   74  11 o 11 3.25175e+00 1.09255e+00 4.05317e+01 218.071 -1.86071e+00 -1.45747e+00 0.00000e+00 0.00000e+00 5.09302e+01 218.071 1.03985e+01 218.071 0.7493 
1 1 1 9   74  12 o 4  1.02811e+01 1.78325e+00 1.61074e+02 329.390 1.59916e+01  -9.46116e+00 0.00000e+00 0.00000e+00 2.14192e+02 329.390 5.31177e+01 329.390 0.9727 
1 1 1 9   75  0  o 7  1.46082e+01 6.23057e-01 2.26608e+02 267.506 -1.96317e+00 -4.50713e+01 0.00000e+00 0.00000e+00 3.15367e+02 267.506 8.87589e+01 267.506 0.9889 
1 1 1 9   75  1  o 10 2.05671e+01 6.26292e-01 3.44957e+02 95.113  -8.59512e+00 9.60548e+01  0.00000e+00 0.00000e+00 4.22939e+02 95.113  7.79820e+01 95.113  0.9948 
1 1 1 9   75  2  o 14 1.16806e+01 6.78387e-01 2.19585e+02 236.096 -1.95802e+01 -2.91344e+01 0.00000e+00 0.00000e+00 2.12630e+02 236.096 6.95521e+00 56.096  0.9857 
1 1 1 9   75  3  o 6  1.20369e+01 7.21729e-01 2.14144e+02 104.987 -9.36031e+00 3.49653e+01  0.00000e+00 0.00000e+00 2.31545e+02 104.987 1.74008e+01 104.987 0.9861 
1 1 1 9   75  4  o 18 1.44788e+01 7.38246e-01 2.48809e+02 289.744 1.76385e+01  -4.91426e+01 0.00000e+00 0.00000e+00 2.89708e+02 289.744 4.08985e+01 289.744 0.9904 
1 1 1 9   75  5  o 10 1.02131e+01 8.39244e-01 2.09979e+02 233.438 -1.88453e+01 -2.54107e+01 0.00000e+00 0.00000e+00 1.67497e+02 233.438 4.24825e+01 53.438  0.9841 
1 1 1 9   75  6  o 4  3.55444e+00 9.83665e-01 5.03860e+01 228.784 -1.68854e+00 -1.92771e+00 0.00000e+00 0.00000e+00 5.26300e+01 228.784 2.24405e+00 228.784 0.7716 
1 1 1 9   75  7  o 11 7.77074e+00 1.15200e+00 7.17975e+01 86.150  4.89965e-01  7.28114e+00  0.00000e+00 0.00000e+00 1.99250e+02 86.150  1.27453e+02 86.150  0.9287 
1 1 1 9   75  8  o 18 4.33446e+00 1.20823e+00 8.48158e+01 359.740 5.31842e+00  -2.41597e-02 0.00000e+00 0.00000e+00 6.17299e+01 359.740 2.30859e+01 179.740 0.9003 
1 1 1 9   75  9  o 4  3.55535e+00 1.13148e+00 2.25895e+01 340.031 1.07889e+00  -3.92011e-01 0.00000e+00 0.00000e+00 4.36716e+01 340.031 2.10821e+01 340.031 0.4963 
1 1 1 9   75  10 o 19 4.56483e+00 1.29733e+00 7.11868e+01 206.128 -4.30668e+00 -2.11241e+00 0.00000e+00 0.00000e+00 8.10622e+01 206.128 9.87540e+00 206.128 0.8884 
1 1 1 9   75  11 o 8  5.55974e+00 1.51774e+00 1.05283e+02 259.396 -1.39664e+00 -7.45992e+00 0.00000e+00 0.00000e+00 8.90961e+01 259.396 1.61873e+01 79.396  0.9316 
1 1 1 9   75  12 o 8  4.60146e+00 1.45125e+00 1.16764e+02 83.273  9.51072e-01  8.06351e+00  0.00000e+00 0.00000e+00 4.48602e+01 83.273  7.19035e+01 263.273 0.9362 
1 1 1 9   76  0  o 19 6.80972e+00 8.35575e-01 1.04420e+02 98.668  -1.29614e+00 8.50182e+00  0.00000e+00 0.00000e+00 1.35675e+02 98.668  3.12551e+01 98.668  0.9399 
1 1 1 9   76  1  o 11 5.88038e+00 9.22034e-01 1.32627e+02 33.524  8.08246e+00  5.35446e+00  0.00000e+00 0.00000e+00 7.63157e+01 33.524  5.63117e+01 213.524 0.9469 
1 1 1 9   76  2  o 10 2.63148e+00 8.17968e-01 1.69786e+01 48.215  4.02574e-01  4.50494e-01  0.00000e+00 0.00000e+00 1.15742e+01 48.215  5.40438e+00 228.215 0.2891 
1 1 1 9   76  3  o 4  4.96353e+00 1.06713e+00 9.69426e+01 83.502  6.47359e-01  5.68396e+00  0.00000e+00 0.00000e+00 7.22137e+01 83.502  2.47289e+01 263.502 0.9078 
1 1 1 9   76  4  o 16 6.60249e+00 9.87610e-01 1.46070e+02 359.731 1.20519e+01  -5.65329e-02 0.00000e+00 0.00000e+00 9.13166e+01 359.731 5.47529e+01 179.731 0.9576 
1 1 1 9   76  5  o 2  5.83297e+00 1.06159e+00 1.06920e+02 190.853 -8.07189e+00 -1.54758e+00 0.00000e+00 0.00000e+00 9.83179e+01 190.853 8.60233e+00 10.853  0.9370 
1 1 1 9   76  6  o 10 3.29460e+00 1.00991e+00 5.67302e+01 344.953 2.65734e+00  -7.14384e-01 0.00000e+00 0.00000e+00 4.09828e+01 344.953 1.57474e+01 164.953 0.7898 
1 1 1 9   76  7  o 16 8.68608e+00 1.11872e+00 1.22099e+02 185.523 -1.49848e+01 -1.44901e+00 0.00000e+00 0.00000e+00 1.93039e+02 185.523 7.09405e+01 185.523 0.9662 
1 1 1 9   76  8  o 9  8.94650e+00 1.19624e+00 1.91900e+02 1.482   2.42492e+01  6.27225e-01  0.00000e+00 0.00000e+00 1.37012e+02 1.482   5.48880e+01 181.482 0.9792 
1 1 1 9   76  9  o 8  7.36588e+00 1.44822e+00 9.11719e+01 126.897 -4.97791e+00 6.63070e+00  0.00000e+00 0.00000e+00 1.68094e+02 126.897 7.69220e+01 126.897 0.9376 
1 1 1 9   76  10 o 18 3.94867e+00 1.25396e+00 8.61037e+01 167.139 -5.04201e+00 1.15120e+00  0.00000e+00 0.00000e+00 4.68674e+01 167.139 3.92363e+01 347.139 0.8972 
1 1 1 9   76  11 o 6  5.32299e+00 1.53589e+00 6.87510e+01 336.808 4.45607e+00  -1.90913e+00 0.00000e+00 0.00000e+00 1.08954e+02 336.808 4.02033e+01 336.808 0.8897 
1 1 1 9   76  12 o 12 4.58125e+00 1.46359e+00 8.09347e+01 152.158 -4.87193e+00 2.57329e+00  0.00000e+00 0.00000e+00 7.44083e+01 152.158 6.52639e+00 332.158 0.9040 
1 1 1 9   77  0  o 19 1.15791e+01 6.47455e-01 1.42455e+02 156.678 -2.10415e+01 9.07143e+00  0.00000e+00 0.00000e+00 2.82215e+02 156.678 1.39760e+02 156.678 0.9779 
1 1 1 9   77  1  o 6  1.08130e+01 6.85207e-01 2.52856e+02 269.330 -4.55049e-01 -3.89141e+01 0.00000e+00 0.00000e+00 1.47556e+02 269.330 1.05300e+02 89.330  0.9871 
1 1 1 9   77  2  o 10 9.03261e+00 7.74095e-01 1.64984e+02 57.833  1.07325e+01  1.70649e+01  0.00000e+00 0.00000e+00 1.65455e+02 57.833  4.70868e-01 57.833  0.9749 
1 1 1 9   77  3  f 0  3.36304e+00 9.05560e-01 3.13932e+01 290.199 4.80698e-01  -1.30655e+00 0.00000e+00 0.00000e+00 4.03448e+01 290.199 8.95154e+00 290.199 0.5683 
1 1 1 9   77  4  o 19 3.26293e+00 9.61011e-01 4.43415e+01 189.891 -1.98245e+00 -3.45658e-01 0.00000e+00 0.00000e+00 4.13749e+01 189.891 2.96667e+00 9.891   0.6998 
1 1 1 9   77  5  o 19 1.37799e+01 7.59154e-01 2.72890e+02 163.985 -5.54384e+01 1.59125e+01  0.00000e+00 0.00000e+00 2.39939e+02 163.985 3.29514e+01 343.985 0.9913 
1 1 1 9   77  6  o 16 7.28111e+00 1.09362e+00 1.40939e+02 322.124 1.06140e+01  -8.25549e+00 0.00000e+00 0.00000e+00 1.22051e+02 322.124 1.88880e+01 142.124 0.9621 
1 1 1 9   77  7  o 18 3.71239e+00 1.09163e+00 8.87411e+01 263.088 -5.55017e-01 -4.57839e+00 0.00000e+00 0.00000e+00 3.43978e+01 263.088 5.43433e+01 83.088  0.8835 
1 1 1 9   77  8  o 5  6.61706e+00 1.32150e+00 1.87177e+02 51.081  1.02739e+01  1.27239e+01  0.00000e+00 0.00000e+00 5.35005e+01 51.081  1.33677e+02 231.081 0.9689 
1 1 1 9   77  9  o 15 7.53741e+00 1.41969e+00 9.13920e+01 89.437  8.69147e-02  8.84879e+00  0.00000e+00 0.00000e+00 1.75009e+02 89.437  8.36169e+01 89.437  0.9417 
1 1 1 9   77  10 o 2  1.16668e+01 1.70476e+00 2.52210e+02 207.754 -2.85261e+01 -1.50109e+01 0.00000e+00 0.00000e+00 1.78739e+02 207.754 7.34713e+01 27.754  0.9844 
1 1 1 9   77  11 o 17 3.33459e+00 1.14614e+00 3.54350e+01 72.745  6.74525e-01  2.17169e+00  0.00000e+00 0.00000e+00 5.68867e+01 72.745  2.14517e+01 72.745  0.7380 
1 1 1 9   77  12 o 3  4.62951e+00 1.43892e+00 5.27635e+01 78.512  7.61824e-01  3.74862e+00  0.00000e+00 0.00000e+00 9.59275e+01 78.512  4.31640e+01 78.512  0.8564 
1 1 1 9   78  0  o 3  1.12958e+01 6.40461e-01 2.14657e+02 279.956 5.74083e+00  -3.27029e+01 0.00000e+00 0.00000e+00 2.02453e+02 279.956 1.22040e+01 99.957  0.9848 
1 1 1 9   78  1  o 7  2.94974e+00 8.68603e-01 7.39343e+01 289.835 9.62344e-01  -2.66786e+00 0.00000e+00 0.00000e+00 1.42552e+01 289.835 5.96791e+01 109.835 0.7971 
1 1 1 9   78  2  o 19 5.28480e+00 9.97102e-01 5.18004e+01 299.216 1.72483e+00  -3.08414e+00 0.00000e+00 0.00000e+00 1.15314e+02 299.216 6.35134e+01 299.216 0.8428 
1 1 1 9   78  3  o 10 6.52331e+00 9.65290e-01 7.00203e+01 249.846 -2.23495e+00 -6.08959e+00 0.00000e+00 0.00000e+00 1.55020e+02 249.846 8.50002e+01 249.846 0.9193 
1 1 1 9   78  4  o 3  6.67804e+00 9.46722e-01 6.92202e+01 154.559 -5.83437e+00 2.77548e+00  0.00000e+00 0.00000e+00 1.61107e+02 154.559 9.18869e+01 154.559 0.9190 
1 1 1 9   78  5  o 6  5.71561e+00 1.10607e+00 9.90411e+01 156.728 -6.55965e+00 2.82117e+00  0.00000e+00 0.00000e+00 9.98460e+01 156.728 8.04897e-01 156.728 0.9271 
1 1 1 9   78  6  o 1  8.99935e+00 1.02203e+00 1.71053e+02 28.242  1.90532e+01  1.02342e+01  0.00000e+00 0.00000e+00 1.58838e+02 28.242  1.22150e+01 208.242 0.9766 
1 1 1 9   78  7  o 18 3.62834e+00 1.11354e+00 1.04335e+02 237.092 -3.16672e+00 -4.89360e+00 0.00000e+00 0.00000e+00 1.95427e+01 237.092 8.47927e+01 57.092  0.9096 
1 1 1 9   78  8  o 3  3.60860e+00 1.08187e+00 4.12973e+01 49.822  1.53133e+00  1.81347e+00  0.00000e+00 0.00000e+00 6.03470e+01 49.822  1.90496e+01 49.822  0.7505 
1 1 1 9   78  9  o 2  4.33585e+00 1.25397e+00 5.86544e+01 204.675 -3.48427e+00 -1.60071e+00 0.00000e+00 0.00000e+00 8.07550e+01 204.675 2.21006e+01 204.675 0.8568 
1 1 1 9   78  10 o 17 6.07137e+00 1.44969e+00 1.09080e+02 280.520 1.65568e+00  -8.91554e+00 0.00000e+00 0.00000e+00 1.05745e+02 280.520 3.33585e+00 100.520 0.9431 
1 1 1 9   78  11 o 10 2.98117e+00 1.04142e+00 3.11462e+01 222.377 -1.49197e+00 -1.36126e+00 0.00000e+00 0.00000e+00 4.72317e+01 222.377 1.60854e+01 222.377 0.7010 
1 1 1 9   79  0  o 3  6.53269e+00 9.48477e-01 1.30649e+02 204.752 -1.02435e+01 -4.72270e+00 0.00000e+00 0.00000e+00 1.03122e+02 204.752 2.75263e+01 24.752  0.9546 
1 1 1 9   79  1  o 13 4.96904e+00 9.81230e-01 1.27611e+02 284.354 2.00200e+00  -7.82310e+00 0.00000e+00 0.00000e+00 4.67748e+01 284.354 8.08366e+01 104.354 0.9359 
1 1 1 9   79  2  f 0  1.32731e+01 6.86732e-01 1.56320e+02 282.487 6.35223e+00  -2.86836e+01 0.00000e+00 0.00000e+00 3.33002e+02 282.487 1.76683e+02 282.487 0.9828 
1 1 1 9   79  3  o 14 1.09290e+01 7.37500e-01 1.79743e+02 159.342 -2.85549e+01 1.07661e+01  0.00000e+00 0.00000e+00 2.23512e+02 159.342 4.37694e+01 159.342 0.9835 
1 1 1 9   79  4  o 18 9.22178e+00 8.65767e-01 1.53597e+02 46.496  1.42463e+01  1.50106e+01  0.00000e+00 0.00000e+00 1.83967e+02 46.496  3.03698e+01 46.496  0.9755 
1 1 1 9   79  5  o 7  1.25802e+01 7.82982e-01 2.09165e+02 72.847  1.18918e+01  3.85288e+01  0.00000e+00 0.00000e+00 2.57035e+02 72.847  4.78700e+01 72.847  0.9875 
1 1 1 9   79  6  o 13 4.84215e+00 1.15677e+00 8.91576e+01 145.588 -4.93949e+00 3.38369e+00  0.00000e+00 0.00000e+00 7.65949e+01 145.588 1.25627e+01 325.588 0.9122 
1 1 1 9   79  7  o 9  7.55281e+00 1.22967e+00 1.27386e+02 172.453 -1.29633e+01 1.71754e+00  0.00000e+00 0.00000e+00 1.44980e+02 172.453 1.75934e+01 172.453 0.9610 
1 1 1 9   79  8  o 4  7.71046e+00 1.32981e+00 1.35264e+02 245.649 -5.67417e+00 -1.25372e+01 0.00000e+00 0.00000e+00 1.43335e+02 245.649 8.07086e+00 245.649 0.9630 
1 1 1 9   79  9  o 8  6.48405e+00 1.44894e+00 6.53831e+01 286.168 1.53865e+00  -5.30704e+00 0.00000e+00 0.00000e+00 1.54597e+02 286.168 8.92135e+01 286.168 0.9043 
1 1 1 9   79  10 o 17 8.17233e+00 1.46569e+00 1.13830e+02 72.195  3.80960e+00  1.18616e+01  0.00000e+00 0.00000e+00 1.80130e+02 72.195  6.62999e+01 72.195  0.9590 
1 1 1 9   79  11 o 4  5.56070e+00 1.49212e+00 1.30191e+02 174.730 -1.01221e+01 9.33690e-01  0.00000e+00 0.00000e+00 6.77860e+01 174.730 6.24054e+01 354.730 0.9495 
1 1 1 9   80  0  o 14 8.32608e+00 6.64095e-01 7.68900e+01 156.551 -8.38712e+00 3.63796e+00  0.00000e+00 0.00000e+00 2.17567e+02 156.551 1.40677e+02 156.551 0.9436 
1 1 1 9   80  1  o 10 3.66690e+00 9.03734e-01 6.27606e+01 31.529  2.87307e+00  1.76265e+00  0.00000e+00 0.00000e+00 5.19028e+01 31.529  1.08578e+01 211.529 0.8341 
1 1 1 9   80  2  o 19 8.75669e+00 8.07878e-01 2.20079e+02 201.693 -2.67789e+01 -1.06526e+01 0.00000e+00 0.00000e+00 1.02562e+02 201.693 1.17518e+02 21.693  0.9825 
1 1 1 9   80  3  o 11 1.17756e+01 7.15353e-01 2.22079e+02 101.505 -8.15194e+00 4.00496e+01  0.00000e+00 0.00000e+00 2.14182e+02 101.505 7.89645e+00 281.505 0.9877 
1 1 1 9   80  4  o 3  4.57712e+00 1.00871e+00 5.31158e+01 307.852 1.97810e+00  -2.54537e+00 0.00000e+00 0.00000e+00 8.85884e+01 307.852 3.54726e+01 307.852 0.8252 
1 1 1 9   80  5  o 2  2.94006e+00 9.28025e-01 5.77794e+01 285.268 7.00573e-01  -2.56642e+00 0.00000e+00 0.00000e+00 2.84103e+01 285.268 2.93690e+01 105.268 0.7814 
1 1 1 9   80  6  o 9  8.36371e+00 1.05459e+00 1.66231e+02 314.588 1.39450e+01  -1.41471e+01 0.00000e+00 0.00000e+00 1.39567e+02 314.588 2.66637e+01 134.588 0.9745 
1 1 1 9   80  7  o 15 6.92722e+00 1.43390e+00 1.32758e+02 173.178 -1.05057e+01 1.25677e+00  0.00000e+00 0.00000e+00 1.14534e+02 173.178 1.82239e+01 353.178 0.9515 
1 1 1 9   80  8  o 6  3.24784e+00 1.05941e+00 1.03306e+02 75.015  1.38196e+00  5.16311e+00  0.00000e+00 0.00000e+00 6.44911e+00 75.015  9.68574e+01 255.015 0.9008 
1 1 1 9   80  9  o 2  2.81642e+00 9.68279e-01 6.39562e+01 194.776 -3.38971e+00 -8.94101e-01 0.00000e+00 0.00000e+00 2.49289e+01 194.776 3.90273e+01 14.776  0.8414 
1 1 1 9   80  10 f 0  6.08806e+00 1.47393e+00 9.33887e+01 72.467  2.37940e+00  7.53126e+00  0.00000e+00 0.00000e+00 1.19932e+02 72.467  2.65428e+01 72.467  0.9344 
1 1 1 9   80  11 o 13 4.00877e+00 1.28531e+00 6.81794e+01 246.269 -1.90777e+00 -4.33954e+00 0.00000e+00 0.00000e+00 6.51254e+01 246.269 3.05403e+00 66.269  0.8870 
1 1 1 9   81  0  o 8  6.44647e+00 7.77123e-01 1.26702e+02 205.353 -1.11944e+01 -5.30430e+00 0.00000e+00 0.00000e+00 1.04886e+02 205.353 2.18158e+01 25.353  0.9587 
1 1 1 9   81  1  o 16 8.03094e+00 8.86652e-01 1.72996e+02 112.553 -7.67525e+00 1.84816e+01  0.00000e+00 0.00000e+00 1.20409e+02 112.553 5.25870e+01 292.553 0.9747 
1 1 1 9   81  2  o 6  4.35385e+00 1.04247e+00 6.31803e+01 257.414 -7.97297e-01 -3.57108e+00 0.00000e+00 0.00000e+00 7.54101e+01 257.414 1.22298e+01 257.414 0.8490 
1 1 1 9   81  3  f 0  5.40995e+00 1.08734e+00 1.86489e+02 104.441 -3.28032e+00 1.27383e+01  0.00000e+00 0.00000e+00 8.51993e+00 104.441 1.77969e+02 284.441 0.9612 
1 1 1 9   81  4  o 1  4.35865e+00 1.07138e+00 1.04936e+02 315.809 4.65515e+00  -4.52558e+00 0.00000e+00 0.00000e+00 4.53647e+01 315.809 5.95713e+01 135.809 0.9194 
1 1 1 9   81  5  o 3  3.10206e+00 9.52917e-01 6.11076e+01 213.595 -2.47430e+00 -1.64362e+00 0.00000e+00 0.00000e+00 3.28843e+01 213.595 2.82232e+01 33.595  0.8078 
1 1 1 9   81  6  o 14 1.04758e+01 9.79437e-01 1.35144e+02 119.256 -1.15856e+01 2.06825e+01  0.00000e+00 0.00000e+00 2.49434e+02 119.256 1.14290e+02 119.256 0.9787 
1 1 1 9   81  7  o 11 1.04290e+01 1.26388e+00 1.28447e+02 22.509  1.67540e+01  6.94289e+00  0.00000e+00 0.00000e+00 2.51800e+02 22.509  1.23354e+02 22.509  0.9720 
1 1 1 9   81  8  o 13 5.34663e+00 1.24770e+00 8.07404e+01 141.024 -4.84146e+00 3.91711e+00  0.00000e+00 0.00000e+00 1.02898e+02 141.024 2.21575e+01 141.024 0.9158 
1 1 1 9   81  9  o 4  4.83113e+00 1.26893e+00 5.76210e+01 146.745 -3.47662e+00 2.27977e+00  0.00000e+00 0.00000e+00 9.98717e+01 146.745 4.22507e+01 146.745 0.8693 
1 1 1 9   81  10 o 8  3.96212e+00 1.23257e+00 5.85592e+01 28.368  3.58687e+00  1.93684e+00  0.00000e+00 0.00000e+00 7.01428e+01 28.368  1.15836e+01 28.368  0.8664 
1 1 1 9   81  11 o 3  3.37306e+00 1.12376e+00 8.28459e+01 93.730  -3.57695e-01 5.48662e+00  0.00000e+00 0.00000e+00 3.14179e+01 93.730  5.14280e+01 273.730 0.9038 
1 1 1 9   82  0  o 13 8.09088e+00 7.26966e-01 1.11439e+02 209.563 -1.21227e+01 -6.87639e+00 0.00000e+00 0.00000e+00 1.80580e+02 209.563 6.91412e+01 209.563 0.9634 
1 1 1 9   82  1  f 0  4.52522e+00 9.06601e-01 7.33418e+01 55.531  2.67302e+00  3.89376e+00  0.00000e+00 0.00000e+00 7.69982e+01 55.531  3.65639e+00 55.531  0.8865 
1 1 1 9   82  2  o 10 3.67307e+00 9.89593e-01 5.03080e+00 234.329 -1.47937e-01 -2.06097e-01 0.00000e+00 0.00000e+00 1.22952e+01 234.329 7.26439e+00 234.329 0.1258 
1 1 1 9   82  3  o 14 8.44963e+00 8.58950e-01 1.82517e+02 127.891 -1.34740e+01 1.73135e+01  0.00000e+00 0.00000e+00 1.26977e+02 127.891 5.55401e+01 307.891 0.9769 
1 1 1 9   82  4  o 5  7.91891e+00 1.00029e+00 1.09739e+02 42.844  9.58384e+00  8.88852e+00  0.00000e+00 0.00000e+00 1.75612e+02 42.844  6.58736e+01 42.844  0.9610 
1 1 1 9   82  5  o 11 8.72563e+00 9.40695e-01 2.02461e+02 203.234 -2.60330e+01 -1.11763e+01 0.00000e+00 0.00000e+00 1.18937e+02 203.234 8.35239e+01 23.234  0.9822 
1 1 1 9   82  6  o 13 1.27950e+01 8.53508e-01 2.55982e+02 55.434  3.22627e+01  4.68276e+01  0.00000e+00 0.00000e+00 2.19626e+02 55.434  3.63558e+01 235.434 0.9912 
1 1 1 9   82  7  o 3  1.01962e+01 1.29519e+00 2.04564e+02 224.082 -1.93455e+01 -1.87352e+01 0.00000e+00 0.00000e+00 1.70639e+02 224.082 3.39250e+01 44.082  0.9813 
1 1 1 9   82  8  o 10 1.01540e+01 1.13154e+00 1.94402e+02 72.424  9.78302e+00  3.08853e+01  0.00000e+00 0.00000e+00 1.80429e+02 72.424  1.39736e+01 252.424 0.9844 
1 1 1 9   82  9  o 4  5.19635e+00 1.32133e+00 7.18796e+01 173.998 -5.59776e+00 5.88518e-01  0.00000e+00 0.00000e+00 1.04662e+02 173.998 3.27823e+01 173.998 0.9062 
1 1 1 9   82  10 o 1  3.65914e+00 1.17761e+00 6.79869e+01 155.772 -4.38062e+00 1.97129e+00  0.00000e+00 0.00000e+00 5.38951e+01 155.772 1.40918e+01 335.772 0.8886 
1 1 1 9   82  11 o 1  4.16073e+00 1.31142e+00 7.18197e+01 22.945  4.80240e+00  2.03302e+00  0.00000e+00 0.00000e+00 6.82150e+01 22.945  3.60470e+00 202.945 0.8981 
1 1 1 9   83  0  o 12 5.55251e+00 8.58979e-01 1.21496e+02 100.178 -1.74626e+00 9.72690e+00  0.00000e+00 0.00000e+00 7.56461e+01 100.178 4.58503e+01 280.178 0.9480 
1 1 1 9   83  1  o 19 6.59472e+00 7.80366e-01 1.20238e+02 20.997  1.12200e+01  4.30628e+00  0.00000e+00 0.00000e+00 1.16328e+02 20.997  3.91014e+00 200.997 0.9574 
1 1 1 9   83  2  o 4  5.21587e+00 9.09598e-01 8.52118e+01 94.606  -4.96110e-01 6.15821e+00  0.00000e+00 0.00000e+00 9.36534e+01 94.606  8.44166e+00 94.606  0.9150 
1 1 1 9   83  3  o 18 5.03504e+00 1.06059e+00 5.91796e+01 338.319 3.69164e+00  -1.46767e+00 0.00000e+00 0.00000e+00 1.03598e+02 338.319 4.44181e+01 338.319 0.8625 
1 1 1 9   83  4  o 1  3.31322e+00 9.82126e-01 3.73192e+01 126.750 -1.14004e+00 1.52668e+00  0.00000e+00 0.00000e+00 4.73447e+01 126.750 1.00255e+01 126.750 0.6816 
1 1 1 9   83  5  o 15 3.14001e+00 9.50734e-01 2.60305e+01 133.812 -9.24098e-01 9.63240e-01  0.00000e+00 0.00000e+00 3.90236e+01 133.812 1.29931e+01 133.812 0.5526 
1 1 1 9   83  6  o 18 4.38761e+00 1.10656e+00 7.96654e+01 271.090 1.00831e-01  -5.29893e+00 0.00000e+00 0.00000e+00 6.83775e+01 271.090 1.12879e+01 91.090  0.8999 
1 1 1 9   83  7  o 6  7.00132e+00 1.35956e+00 1.33448e+02 20.106  1.14901e+01  4.20617e+00  0.00000e+00 0.00000e+00 1.18086e+02 20.106  1.53621e+01 200.106 0.9582 
1 1 1 9   83  8  o 14 3.33255e+00 1.05145e+00 4.48326e+01 116.514 -1.17064e+00 2.34654e+00  0.00000e+00 0.00000e+00 5.23259e+01 116.514 7.49328e+00 116.514 0.7777 
1 1 1 9   83  9  o 16 6.04790e+00 1.24573e+00 1.20719e+02 268.227 -3.55722e-01 -1.14931e+01 0.00000e+00 0.00000e+00 9.58839e+01 268.227 2.48347e+01 88.227  0.9555 
1 1 1 9   83  10 o 15 5.18435e+00 1.40667e+00 9.17442e+01 88.943  1.31920e-01  7.15042e+00  0.00000e+00 0.00000e+00 8.83946e+01 88.943  3.34966e+00 268.943 0.9272 
1 1 1 9   83  11 o 7  6.63125e+00 1.65923e+00 1.17786e+02 357.205 1.06443e+01  -5.19581e-01 0.00000e+00 0.00000e+00 1.18693e+02 357.205 9.06585e-01 357.205 0.9519 
1 1 1 9   84  0  o 9  5.20686e+00 8.54280e-01 7.93406e+01 82.115  8.63823e-01  6.23728e+00  0.00000e+00 0.00000e+00 9.93978e+01 82.115  2.00572e+01 82.115  0.9167 
1 1 1 9   84  1  o 5  7.25827e+00 7.80476e-01 1.68865e+02 65.082  7.60265e+00  1.63647e+01  0.00000e+00 0.00000e+00 9.53684e+01 65.082  7.34970e+01 245.081 0.9719 
1 1 1 9   84  2  o 13 8.40436e+00 7.60555e-01 1.73278e+02 151.688 -1.98073e+01 1.06705e+01  0.00000e+00 0.00000e+00 1.34536e+02 151.688 3.87425e+01 331.688 0.9775 
1 1 1 9   84  3  o 5  5.10290e+00 9.82711e-01 8.45499e+01 233.718 -3.66074e+00 -4.98673e+00 0.00000e+00 0.00000e+00 9.04603e+01 233.718 5.91041e+00 233.718 0.9152 
1 1 1 9   84  4  o 4  9.83616e+00 8.16328e-01 1.37850e+02 30.231  2.00997e+01  1.17128e+01  0.00000e+00 0.00000e+00 2.22809e+02 30.231  8.49587e+01 30.231  0.9783 
1 1 1 9   84  5  o 18 3.56061e+00 1.01832e+00 7.91747e+01 161.025 -4.12316e+00 1.41772e+00  0.00000e+00 0.00000e+00 3.77527e+01 161.025 4.14220e+01 341.025 0.8761 
1 1 1 9   84  6  o 3  8.07772e+00 1.07540e+00 1.25889e+02 278.419 2.38015e+00  -1.60814e+01 0.00000e+00 0.00000e+00 1.67443e+02 278.419 4.15547e+01 278.419 0.9687 
1 1 1 9   84  7  o 3  6.00388e+00 1.23332e+00 1.28595e+02 139.750 -8.58664e+00 7.26907e+00  0.00000e+00 0.00000e+00 8.62083e+01 139.750 4.23870e+01 319.750 0.9545 
1 1 1 9   84  8  o 6  8.60140e+00 1.29376e+00 1.57843e+02 300.047 1.00376e+01  -1.73528e+01 0.00000e+00 0.00000e+00 1.56398e+02 300.047 1.44503e+00 120.047 0.9747 
1 1 1 9   84  9  o 4  4.04050e+00 1.23272e+00 4.63926e+01 48.246  2.08882e+00  2.33999e+00  0.00000e+00 0.00000e+00 7.77093e+01 48.246  3.13167e+01 48.246  0.8196 
1 1 1 9   84  10 o 10 7.59151e+00 1.44783e+00 1.95636e+02 68.038  8.42567e+00  2.08936e+01  0.00000e+00 0.00000e+00 8.24065e+01 68.038  1.13230e+02 248.037 0.9775 
1 1 1 9   84  11 o 9  3.05774e+00 1.06609e+00 4.37431e+01 90.835  -4.44077e-02 3.04557e+00  0.00000e+00 0.00000e+00 4.94079e+01 90.835  5.66478e+00 90.835  0.8133 
1 1 1 9   85  0  o 2  1.01246e+01 6.47604e-01 1.54934e+02 343.124 2.63990e+01  -8.00836e+00 0.00000e+00 0.00000e+00 2.17162e+02 343.124 6.22279e+01 343.124 0.9817 
1 1 1 9   85  1  o 2  1.86444e+01 6.09066e-01 2.77828e+02 138.861 -6.40307e+01 5.59350e+01  0.00000e+00 0.00000e+00 4.16268e+02 138.861 1.38439e+02 138.861 0.9941 
1 1 1 9   85  2  o 16 9.81578e+00 7.03110e-01 1.94025e+02 304.484 1.77097e+01  -2.57831e+01 0.00000e+00 0.00000e+00 1.67740e+02 304.484 2.62847e+01 124.484 0.9839 
1 1 1 9   85  3  o 3  4.57277e+00 9.47576e-01 3.76809e+01 279.244 4.33108e-01  -2.66122e+00 0.00000e+00 0.00000e+00 9.67700e+01 279.244 5.90891e+01 279.244 0.7848 
1 1 1 9   85  4  o 8  7.28572e+00 9.07396e-01 1.26036e+02 290.902 5.48260e+00  -1.43559e+01 0.00000e+00 0.00000e+00 1.37941e+02 290.902 1.19047e+01 290.902 0.9669 
1 1 1 9   85  5  o 2  6.22513e+00 1.05040e+00 7.12416e+01 278.949 9.99104e-01  -6.34471e+00 0.00000e+00 0.00000e+00 1.43030e+02 278.949 7.17881e+01 278.949 0.9185 
1 1 1 9   85  6  o 6  4.15817e+00 1.00700e+00 9.60786e+01 329.264 5.56662e+00  -3.30999e+00 0.00000e+00 0.00000e+00 4.71617e+01 329.264 4.89169e+01 149.264 0.9192 
1 1 1 9   85  7  o 16 5.85639e+00 1.32769e+00 4.33821e+01 294.768 1.52144e+00  -3.29760e+00 0.00000e+00 0.00000e+00 1.42663e+02 294.768 9.92811e+01 294.768 0.8477 
1 1 1 9   85  8  o 19 4.80076e+00 1.28442e+00 8.26085e+01 143.832 -4.99553e+00 3.65188e+00  0.00000e+00 0.00000e+00 8.20281e+01 143.832 5.80427e-01 323.832 0.9152 
1 1 1 9   85  9  o 12 6.49747e+00 1.55967e+00 9.81992e+01 327.159 7.23966e+00  -4.67297e+00 0.00000e+00 0.00000e+00 1.30641e+02 327.159 3.24422e+01 327.159 0.9400 
1 1 1 9   85  10 o 3  2.92346e+00 9.80167e-01 3.28337e+01 76.443  4.98626e-01  2.06790e+00  0.00000e+00 0.00000e+00 4.57474e+01 76.443  1.29137e+01 76.443  0.7176 
1 1 1 9   85  11 o 9  3.18430e+00 1.05189e+00 7.82323e+01 282.766 1.33020e+00  -5.87092e+00 0.00000e+00 0.00000e+00 3.05978e+01 282.766 4.76345e+01 102.766 0.9127 
1 1 1 9   86  0  o 10 4.91874e+00 8.90644e-01 7.82099e+01 47.965  4.11049e+00  4.55951e+00  0.00000e+00 0.00000e+00 9.01407e+01 47.965  1.19307e+01 47.965  0.9145 
1 1 1 9   86  1  o 17 9.62510e+00 6.90673e-01 1.55513e+02 84.793  2.24027e+00  2.45827e+01  0.00000e+00 0.00000e+00 1.97476e+02 84.793  4.19629e+01 84.793  0.9795 
1 1 1 9   86  2  o 15 5.13786e+00 9.45365e-01 7.29809e+01 266.013 -4.08625e-01 -5.86293e+00 0.00000e+00 0.00000e+00 1.02195e+02 266.013 2.92139e+01 266.013 0.9104 
1 1 1 9   86  3  o 11 4.14056e+00 9.84953e-01 7.72430e+01 166.301 -4.60962e+00 1.12363e+00  0.00000e+00 0.00000e+00 6.03450e+01 166.301 1.68981e+01 346.301 0.8871 
1 1 1 9   86  4  o 18 4.12743e+00 1.02247e+00 1.15570e+02 25.720  6.62688e+00  3.19215e+00  0.00000e+00 0.00000e+00 2.81276e+01 25.720  8.74422e+01 205.720 0.9293 
1 1 1 9   86  5  o 19 3.45344e+00 9.90430e-01 1.07418e+02 196.310 -5.71249e+00 -1.67157e+00 0.00000e+00 0.00000e+00 1.05356e+01 196.310 9.68820e+01 16.310  0.9116 
1 1 1 9   86  6  o 13 6.62398e+00 1.06179e+00 6.43639e+01 116.785 -3.09916e+00 6.13917e+00  0.00000e+00 0.00000e+00 1.64995e+02 116.785 1.00631e+02 116.785 0.9241 
1 1 1 9   86  7  o 18 8.31084e+00 1.08120e+00 1.26020e+02 218.081 -1.41741e+01 -1.11062e+01 0.00000e+00 0.00000e+00 1.76587e+02 218.081 5.05665e+01 218.081 0.9718 
1 1 1 9   86  8  f 0  4.43963e+00 1.17115e+00 8.05996e+01 68.173  2.25089e+00  5.61985e+00  0.00000e+00 0.00000e+00 7.12845e+01 68.173  9.31505e+00 248.173 0.9132 
1 1 1 9   86  9  o 14 4.16090e+00 1.27933e+00 7.49234e+01 289.055 1.80160e+00  -5.21589e+00 0.00000e+00 0.00000e+00 6.59956e+01 289.055 8.92776e+00 109.055 0.9042 
1 1 1 9   86  10 o 18 6.88064e+00 1.45253e+00 8.21876e+01 188.097 -8.67105e+00 -1.23358e+00 0.00000e+00 0.00000e+00 1.60297e+02 188.097 7.81099e+01 188.097 0.9411 
1 1 1 9   87  0  o 16 9.25872e+00 6.97938e-01 1.99923e+02 131.393 -2.17898e+01 2.47221e+01  0.00000e+00 0.00000e+00 1.41231e+02 131.393 5.86915e+01 311.393 0.9847 
1 1 1 9   87  1  o 13 9.87188e+00 6.69502e-01 1.68922e+02 163.541 -2.87966e+01 8.50744e+00  0.00000e+00 0.00000e+00 1.94390e+02 163.541 2.54674e+01 163.541 0.9832 
1 1 1 9   87  2  o 9  4.78291e+00 9.60708e-01 6.06861e+01 239.173 -2.23676e+00 -3.74821e+00 0.00000e+00 0.00000e+00 9.62271e+01 239.173 3.55409e+01 239.173 0.8762 
1 1 1 9   87  3  o 7  1.02935e+01 7.23866e-01 2.27271e+02 191.913 -4.43253e+01 -9.35149e+00 0.00000e+00 0.00000e+00 1.53934e+02 191.913 7.33372e+01 11.913  0.9889 
1 1 1 9   87  4  o 17 8.57218e+00 8.55145e-01 1.27763e+02 215.963 -1.42679e+01 -1.03521e+01 0.00000e+00 0.00000e+00 1.84063e+02 215.963 5.62996e+01 215.963 0.9712 
1 1 1 9   87  5  o 18 3.20322e+00 9.48249e-01 6.82056e+01 80.849  5.52416e-01  3.42944e+00  0.00000e+00 0.00000e+00 3.25493e+01 80.849  3.56563e+01 260.849 0.8397 
1 1 1 9   87  6  o 2  5.02605e+00 1.16113e+00 8.41690e+01 338.898 6.11634e+00  -2.36029e+00 0.00000e+00 0.00000e+00 8.90815e+01 338.898 4.91256e+00 338.898 0.9202 
1 1 1 9   87  7  o 15 5.90194e+00 1.15319e+00 1.01617e+02 165.808 -9.48782e+00 2.39934e+00  0.00000e+00 0.00000e+00 1.07838e+02 165.808 6.22093e+00 165.808 0.9474 
1 1 1 9   87  8  o 15 2.92281e+00 9.49621e-01 4.53746e+01 352.407 2.58372e+00  -3.44432e-01 0.00000e+00 0.00000e+00 3.95876e+01 352.407 5.78699e+00 172.407 0.7761 
1 1 1 9   87  9  o 3  4.46841e+00 1.37256e+00 8.13930e+01 252.726 -1.66743e+00 -5.36209e+00 0.00000e+00 0.00000e+00 7.02020e+01 252.726 1.11910e+01 72.726  0.9059 
1 1 1 9   87  10 f 0  4.00293e+00 1.21683e+00 6.05633e+01 154.758 -4.43579e+00 2.09132e+00  0.00000e+00 0.00000e+00 7.29884e+01 154.758 1.24251e+01 154.758 0.8911 
1 1 1 9   88  0  o 13 5.89692e+00 8.52252e-01 7.56985e+01 215.102 -5.81572e+00 -4.08765e+00 0.00000e+00 0.00000e+00 1.28740e+02 215.102 5.30419e+01 215.102 0.9267 
1 1 1 9   88  1  o 11 3.97212e+00 9.30654e-01 3.86870e+01 5.780   2.33354e+00  2.36196e-01  0.00000e+00 0.00000e+00 7.23647e+01 5.780   3.36777e+01 5.780   0.7471 
1 1 1 9   88  2  o 8  3.90713e+00 9.47169e-01 9.29492e+01 47.282  4.20308e+00  4.55202e+00  0.00000e+00 0.00000e+00 4.09163e+01 47.282  5.20329e+01 227.282 0.9153 
1 1 1 9   88  3  o 8  8.63425e+00 8.18261e-01 1.29834e+02 222.133 -1.46869e+01 -1.32861e+01 0.00000e+00 0.00000e+00 1.85165e+02 222.133 5.53308e+01 222.133 0.9744 
1 1 1 9   88  4  o 11 6.99941e+00 9.38067e-01 1.33567e+02 342.329 1.47292e+01  -4.69251e+00 0.00000e+00 0.00000e+00 1.19908e+02 342.329 1.36596e+01 162.329 0.9671 
1 1 1 9   88  5  o 7  8.91785e+00 8.88043e-01 1.63965e+02 124.523 -1.46559e+01 2.13058e+01  0.00000e+00 0.00000e+00 1.63479e+02 124.523 4.85710e-01 304.523 0.9805 
1 1 1 9   88  6  o 10 8.27337e+00 1.03738e+00 1.41863e+02 270.877 3.12472e-01  -2.04081e+01 0.00000e+00 0.00000e+00 1.60288e+02 270.877 1.84251e+01 270.877 0.9752 
1 1 1 9   88  7  o 3  6.30781e+00 1.19894e+00 1.49406e+02 50.729  9.92270e+00  1.21357e+01  0.00000e+00 0.00000e+00 7.91515e+01 50.729  7.02548e+01 230.729 0.9676 
1 1 1 9   88  8  o 15 4.25384e+00 1.16927e+00 7.86335e+01 118.713 -2.82221e+00 5.15212e+00  0.00000e+00 0.00000e+00 6.63753e+01 118.713 1.22582e+01 298.713 0.9104 
1 1 1 9   88  9  o 5  4.96953e+00 1.44855e+00 6.31129e+01 187.305 -4.71352e+00 -6.04271e-01 0.00000e+00 0.00000e+00 1.01975e+02 187.305 3.88618e+01 187.305 0.8873 
1 1 1 9   88  10 o 8  3.65880e+00 1.11971e+00 6.64640e+01 135.506 -3.76314e+00 3.69730e+00  0.00000e+00 0.00000e+00 5.67127e+01 135.506 9.75128e+00 315.506 0.8994 
1 1 1 9   89  0  o 17 3.93801e+00 8.81139e-01 9.62770e+01 34.339  5.55575e+00  3.79542e+00  0.00000e+00 0.00000e+00 3.95738e+01 34.339  5.67032e+01 214.339 0.9224 
1 1 1 9   89  1  f 0  1.01050e+01 6.75495e-01 1.47712e+02 55.961  1.55375e+01  2.30014e+01  0.00000e+00 0.00000e+00 2.23475e+02 55.961  7.57631e+01 55.961  0.9818 
1 1 1 9   89  2  o 13 9.38799e+00 7.22278e-01 1.81019e+02 135.746 -2.26149e+01 2.20338e+01  0.00000e+00 0.00000e+00 1.64703e+02 135.746 1.63159e+01 315.746 0.9840 
1 1 1 9   89  3  o 7  2.75862e+00 8.04280e-01 2.66243e+01 217.026 -1.06119e+00 -8.00428e-01 0.00000e+00 0.00000e+00 3.02705e+01 217.026 3.64629e+00 217.026 0.5510 
1 1 1 9   89  4  o 13 7.48676e+00 9.21607e-01 1.23516e+02 258.004 -3.27969e+00 -1.54347e+01 0.00000e+00 0.00000e+00 1.47733e+02 258.004 2.42179e+01 258.004 0.9678 
1 1 1 9   89  5  o 15 6.43114e+00 1.02561e+00 9.77175e+01 122.898 -5.69917e+00 8.81024e+00  0.00000e+00 0.00000e+00 1.31288e+02 122.898 3.35700e+01 122.898 0.9511 
1 1 1 9   89  6  o 10 3.31808e+00 9.49735e-01 4.10447e+01 246.178 -1.08464e+00 -2.45662e+00 0.00000e+00 0.00000e+00 5.63222e+01 246.178 1.52775e+01 246.178 0.7837 
1 1 1 9   89  7  o 4  2.89490e+00 9.26186e-01 5.39537e+01 263.246 -3.71057e-01 -3.13302e+00 0.00000e+00 0.00000e+00 3.50102e+01 263.246 1.89435e+01 83.246  0.8208 
1 1 1 9   89  8  o 16 5.43722e+00 1.18995e+00 8.88922e+01 98.487  -1.32240e+00 8.86167e+00  0.00000e+00 0.00000e+00 1.02937e+02 98.487  1.40452e+01 98.487  0.9424 
1 1 1 9   89  9  o 18 4.28786e+00 1.29570e+00 6.41345e+01 293.208 1.84848e+00  -4.31113e+00 0.00000e+00 0.00000e+00 7.80139e+01 293.208 1.38794e+01 293.208 0.8857 
1 1 1 9   89  10 o 14 3.35775e+00 1.09445e+00 2.06480e+01 169.743 -1.58344e+00 2.86529e-01  0.00000e+00 0.00000e+00 5.75069e+01 169.743 3.68589e+01 169.743 0.6220 
1 1 1 9   90  0  o 13 9.37505e+00 7.07359e-01 1.80758e+02 145.930 -2.62789e+01 1.77720e+01  0.00000e+00 0.00000e+00 1.64221e+02 145.930 1.65364e+01 325.930 0.9841 
1 1 1 9   90  1  o 15 7.53831e+00 7.75647e-01 1.16581e+02 8.377   1.45790e+01  2.14696e+00  0.00000e+00 0.00000e+00 1.55641e+02 8.377   3.90598e+01 8.377   0.9655 
1 1 1 9   90  2  o 19 8.37955e+00 7.72253e-01 1.37789e+02 243.178 -9.59502e+00 -1.89766e+01 0.00000e+00 0.00000e+00 1.68263e+02 243.178 3.04742e+01 243.178 0.9762 
1 1 1 9   90  3  o 17 3.63534e+00 9.48483e-01 5.06054e+01 272.030 1.03692e-01  -2.92573e+00 0.00000e+00 0.00000e+00 5.88384e+01 272.030 8.23297e+00 272.030 0.8045 
1 1 1 9   90  4  o 17 1.17252e+01 7.54053e-01 2.22584e+02 221.805 -3.77428e+01 -3.37524e+01 0.00000e+00 0.00000e+00 2.11907e+02 221.805 1.06770e+01 41.805  0.9901 
1 1 1 9   90  5  o 19 3.95445e+00 1.02452e+00 8.41376e+01 43.320  4.24860e+00  4.00641e+00  0.00000e+00 0.00000e+00 5.05292e+01 43.320  3.36084e+01 223.320 0.9098 
1 1 1 9   90  6  o 13 4.78877e+00 1.10911e+00 1.00910e+02 245.250 -3.38052e+00 -7.33275e+00 0.00000e+00 0.00000e+00 6.68454e+01 245.250 3.40647e+01 65.250  0.9359 
1 1 1 9   90  7  o 1  1.01664e+01 9.77075e-01 1.67472e+02 92.044  -1.16992e+00 3.27833e+01  0.00000e+00 0.00000e+00 2.07219e+02 92.044  3.97473e+01 92.044  0.9846 
1 1 1 9   90  8  o 18 6.28834e+00 1.29536e+00 7.31242e+01 346.949 7.36070e+00  -1.70619e+00 0.00000e+00 0.00000e+00 1.46052e+02 346.949 7.29276e+01 346.949 0.9313 
1 1 1 9   90  9  o 19 2.79837e+00 9.71682e-01 4.46905e+01 160.468 -2.75361e+00 9.76849e-01  0.00000e+00 0.00000e+00 3.95063e+01 160.468 5.18418e+00 340.468 0.8040 
1 1 1 9   90  10 o 19 3.50001e+00 1.12293e+00 2.16626e+01 48.220  1.11816e+00  1.25149e+00  0.00000e+00 0.00000e+00 6.17773e+01 48.220  4.01147e+01 48.220  0.6372 
1 1 1 9   91  0  o 7  2.81942e+00 8.40311e-01 3.87008e+01 75.548  4.83327e-01  1.87539e+00  0.00000e+00 0.00000e+00 3.37169e+01 75.548  4.98393e+00 255.548 0.6871 
1 1 1 9   91  1  o 11 8.63617e+00 7.67616e-01 1.29271e+02 286.546 5.77985e+00  -1.94553e+01 0.00000e+00 0.00000e+00 1.85618e+02 286.546 5.63465e+01 286.546 0.9750 
1 1 1 9   91  2  o 6  3.71972e+00 8.45699e-01 5.57958e+01 91.797  -1.19634e-01 3.81305e+00  0.00000e+00 0.00000e+00 6.33060e+01 91.797  7.51019e+00 91.797  0.8560 
1 1 1 9   91  3  o 14 3.99571e+00 1.01640e+00 6.61054e+01 146.437 -3.60409e+00 2.39118e+00  0.00000e+00 0.00000e+00 6.46928e+01 146.437 1.41261e+00 326.437 0.8750 
1 1 1 9   91  4  o 1  4.84769e+00 9.98392e-01 9.00213e+01 321.970 5.93017e+00  -4.63814e+00 0.00000e+00 0.00000e+00 7.88551e+01 321.970 1.11661e+01 141.970 0.9310 
1 1 1 9   91  5  o 1  7.43752e+00 9.92346e-01 1.50131e+02 100.321 -3.82977e+00 2.10295e+01  0.00000e+00 0.00000e+00 1.21603e+02 100.321 2.85272e+01 280.321 0.9763 
1 1 1 9   91  6  o 11 8.57731e+00 9.93908e-01 1.43528e+02 105.197 -6.18366e+00 2.27645e+01  0.00000e+00 0.00000e+00 1.70579e+02 105.197 2.70504e+01 105.197 0.9786 
1 1 1 9   91  7  f 0  4.12363e+00 1.14026e+00 2.82631e+01 353.331 2.19222e+00  -2.56314e-01 0.00000e+00 0.00000e+00 8.42336e+01 353.331 5.59705e+01 353.331 0.7290 
1 1 1 9   91  8  o 14 6.63958e+00 1.19296e+00 8.26224e+01 29.076  8.99195e+00  5.00000e+00  0.00000e+00 0.00000e+00 1.53415e+02 29.076  7.07927e+01 29.076  0.9501 
1 1 1 9   91  9  o 1  3.17494e+00 1.04096e+00 7.46237e+01 107.527 -1.63251e+00 5.16915e+00  0.00000e+00 0.00000e+00 3.25527e+01 107.527 4.20709e+01 287.527 0.9023 
1 1 1 9   91  10 o 19 2.75341e+00 9.43909e-01 4.03899e+01 204.093 -2.78202e+00 -1.24405e+00 0.00000e+00 0.00000e+00 4.33844e+01 204.093 2.99447e+00 204.093 0.8134 
1 1 1 9   92  0  o 18 1.09799e+01 6.68225e-01 1.58853e+02 346.266 3.43129e+01  -8.38626e+00 0.00000e+00 0.00000e+00 2.45646e+02 346.266 8.67936e+01 346.266 0.9857 
1 1 1 9   92  1  o 6  7.10508e+00 8.65655e-01 1.11111e+02 122.048 -6.96883e+00 1.11319e+01  0.00000e+00 0.00000e+00 1.44194e+02 122.048 3.30824e+01 122.048 0.9611 
1 1 1 9   92  2  o 17 4.58973e+00 9.95874e-01 6.53510e+01 346.519 4.83828e+00  -1.15983e+00 0.00000e+00 0.00000e+00 8.78865e+01 346.519 2.25355e+01 346.519 0.8928 
1 1 1 9   92  3  o 19 4.79184e+00 1.00550e+00 7.27927e+01 122.647 -3.18476e+00 4.97086e+00  0.00000e+00 0.00000e+00 9.04573e+01 122.647 1.76647e+01 122.647 0.9108 
1 1 1 9   92  4  f 0  6.21662e+00 9.88702e-01 1.32585e+02 189.970 -1.45778e+01 -2.56265e+00 0.00000e+00 0.00000e+00 9.19738e+01 189.970 4.06112e+01 9.970   0.9656 
1 1 1 9   92  5  o 18 2.67037e+00 8.51675e-01 2.32119e+01 357.643 1.22930e+00  -5.05984e-02 0.00000e+00 0.00000e+00 2.89464e+01 357.643 5.73454e+00 357.643 0.5221 
1 1 1 9   92  6  o 2  7.59455e+00 1.05937e+00 1.22414e+02 81.325  2.52625e+00  1.65579e+01  0.00000e+00 0.00000e+00 1.53106e+02 81.325  3.06920e+01 81.325  0.9697 
1 1 1 9   92  7  o 1  4.85135e+00 1.20206e+00 1.95878e+02 292.765 6.95390e+00  -1.65711e+01 0.00000e+00 0.00000e+00 1.95037e+01 112.765 2.15382e+02 112.765 0.9718 
1 1 1 9   92  8  o 9  9.46333e+00 1.12230e+00 1.57545e+02 121.845 -1.55019e+01 2.49583e+01  0.00000e+00 0.00000e+00 1.90386e+02 121.845 3.28410e+01 121.845 0.9828 
1 1 1 9   92  9  o 8  7.98030e+00 1.24382e+00 1.33005e+02 250.371 -7.32505e+00 -2.05384e+01 0.00000e+00 0.00000e+00 1.58552e+02 250.371 2.55468e+01 250.371 0.9768 
1 1 1 9   93  0  o 19 3.43943e+00 9.08734e-01 6.55600e+01 306.461 2.29819e+00  -3.11024e+00 0.00000e+00 0.00000e+00 4.47286e+01 306.461 2.08314e+01 126.461 0.8582 
1 1 1 9   93  1  o 12 7.35116e+00 8.22838e-01 1.05246e+02 66.497  5.66236e+00  1.30206e+01  0.00000e+00 0.00000e+00 1.59651e+02 66.497  5.44044e+01 66.497  0.9641 
1 1 1 9   93  2  o 17 5.52362e+00 9.73395e-01 1.17812e+02 50.027  7.22183e+00  8.61488e+00  0.00000e+00 0.00000e+00 7.92839e+01 50.027  3.85282e+01 230.027 0.9544 
1 1 1 9   93  3  o 5  7.77004e+00 8.76214e-01 1.04682e+02 31.570  1.34934e+01  8.29155e+00  0.00000e+00 0.00000e+00 1.76543e+02 31.570  7.18609e+01 31.570  0.9679 
1 1 1 9   93  4  o 7  3.34863e+00 9.74786e-01 2.14890e+01 220.936 -1.05243e+00 -9.12817e-01 0.00000e+00 0.00000e+00 4.97189e+01 220.936 2.82299e+01 220.936 0.5686 
1 1 1 9   93  5  o 10 3.66046e+00 1.06670e+00 4.54843e+01 310.726 1.97579e+00  -2.29497e+00 0.00000e+00 0.00000e+00 6.56956e+01 310.726 2.02113e+01 310.726 0.8121 
1 1 1 9   93  6  o 4  9.37875e+00 9.79195e-01 1.04708e+02 207.030 -1.77657e+01 -9.06374e+00 0.00000e+00 0.00000e+00 2.37182e+02 207.030 1.32474e+02 207.030 0.9746 
1 1 1 9   93  7  o 5  3.60129e+00 1.06670e+00 3.96509e+01 116.639 -1.26051e+00 2.51289e+00  0.00000e+00 0.00000e+00 6.74343e+01 116.639 2.77835e+01 116.639 0.7950 
1 1 1 9   93  8  o 11 3.50985e+00 1.05867e+00 2.58198e+01 85.954  1.38745e-01  1.96166e+00  0.00000e+00 0.00000e+00 6.50425e+01 85.954  3.92227e+01 85.954  0.6922 
1 1 1 9   93  9  o 5  5.87302e+00 1.35990e+00 7.86931e+01 343.027 8.30097e+00  -2.53359e+00 0.00000e+00 0.00000e+00 1.27849e+02 343.027 4.91557e+01 343.027 0.9405 
1 1 1 9   94  0  o 14 6.73547e+00 8.45346e-01 1.32121e+02 7.252   1.64911e+01  2.09840e+00  0.00000e+00 0.00000e+00 1.11786e+02 7.252   2.03350e+01 187.252 0.9694 
1 1 1 9   94  1  o 7  3.84952e+00 9.25472e-01 3.65052e+01 197.695 -2.37902e+00 -7.59013e-01 0.00000e+00 0.00000e+00 7.34897e+01 197.695 3.69845e+01 197.695 0.7647 
1 1 1 9   94  2  o 6  5.60180e+00 1.00232e+00 7.44844e+01 353.413 7.43056e+00  -8.58022e-01 0.00000e+00 0.00000e+00 1.20346e+02 353.413 4.58616e+01 353.413 0.9305 
1 1 1 9   94  3  o 5  4.03169e+00 1.01742e+00 2.51060e+01 146.918 -1.52245e+00 9.91792e-01  0.00000e+00 0.00000e+00 7.51717e+01 146.918 5.00657e+01 146.918 0.6653 
1 1 1 9   94  4  o 7  4.13749e+00 1.05388e+00 1.11022e+02 171.743 -7.88417e+00 1.14415e+00  0.00000e+00 0.00000e+00 3.36155e+01 171.743 7.74067e+01 351.743 0.9350 
1 1 1 9   94  5  o 6  3.24058e+00 9.75506e-01 6.42815e+01 69.835  1.37301e+00  3.73883e+00  0.00000e+00 0.00000e+00 4.02768e+01 69.835  2.40047e+01 249.835 0.8629 
1 1 1 9   94  6  o 3  3.50364e+00 1.02598e+00 4.39265e+01 237.573 -1.75213e+00 -2.75800e+00 0.00000e+00 0.00000e+00 6.45506e+01 237.573 2.06241e+01 237.573 0.8280 
1 1 1 9   94  7  o 17 3.05055e+00 9.70197e-01 5.30199e+01 179.361 -3.64663e+00 4.06418e-02  0.00000e+00 0.00000e+00 4.37588e+01 179.361 9.26106e+00 359.361 0.8484 
1 1 1 9   94  8  o 8  4.03777e+00 1.12471e+00 8.48654e+01 296.607 3.37838e+00  -6.74436e+00 0.00000e+00 0.00000e+00 5.57082e+01 296.607 2.91572e+01 116.607 0.9311 
1 1 1 9   94  9  f 0  5.04230e+00 1.27531e+00 1.08530e+02 110.236 -3.87525e+00 1.05124e+01  0.00000e+00 0.00000e+00 7.13495e+01 110.236 3.71801e+01 290.236 0.9543 
1 1 1 9   95  0  o 15 7.28004e+00 8.29347e-01 1.33086e+02 286.026 5.36434e+00  -1.86762e+01 0.00000e+00 0.00000e+00 1.31691e+02 286.026 1.39498e+00 106.026 0.9739 
1 1 1 9   95  1  o 17 8.69415e+00 7.55940e-01 1.41924e+02 76.544  5.97112e+00  2.49565e+01  0.00000e+00 0.00000e+00 1.76468e+02 76.544  3.45434e+01 76.544  0.9803 
1 1 1 9   95  2  o 11 3.56812e+00 9.63849e-01 5.41189e+01 243.889 -1.58200e+00 -3.22771e+00 0.00000e+00 0.00000e+00 5.86637e+01 243.889 4.54475e+00 243.889 0.8459 
1 1 1 9   95  3  o 17 3.35869e+00 9.61948e-01 7.53706e+01 326.052 3.88115e+00  -2.61275e+00 0.00000e+00 0.00000e+00 3.57680e+01 326.052 3.96027e+01 146.052 0.8854 
1 1 1 9   95  4  o 19 5.45495e+00 1.00558e+00 5.48070e+01 4.018   5.69991e+00  4.00370e-01  0.00000e+00 0.00000e+00 1.30274e+02 4.018   7.54669e+01 4.018   0.9077 
1 1 1 9   95  5  o 16 4.30650e+00 1.10595e+00 6.27249e+01 155.332 -4.52383e+00 2.07762e+00  0.00000e+00 0.00000e+00 8.10204e+01 155.332 1.82955e+01 155.332 0.8929 
1 1 1 9   95  6  o 15 2.89561e+00 9.30626e-01 3.87901e+01 278.406 3.91446e-01  -2.64890e+00 0.00000e+00 0.00000e+00 4.59723e+01 278.406 7.18216e+00 278.406 0.7830 
1 1 1 9   95  7  o 14 4.59076e+00 1.14134e+00 7.87964e+01 293.147 2.75570e+00  -6.44613e+00 0.00000e+00 0.00000e+00 8.00611e+01 293.147 1.26466e+00 293.147 0.9256 
1 1 1 9   95  8  o 10 5.22766e+00 1.17604e+00 2.92111e+01 64.351  1.36144e+00  2.83525e+00  0.00000e+00 0.00000e+00 1.31057e+02 64.351  1.01846e+02 64.351  0.8202 
1 1 1 9   95  9  o 17 4.06236e+00 1.20032e+00 9.45782e+01 270.269 3.89327e-02  -8.27819e+00 0.00000e+00 0.00000e+00 4.77581e+01 270.269 4.68201e+01 90.269  0.9375 
1 1 1 9   96  0  o 15 5.96885e+00 9.13163e-01 1.46755e+02 115.188 -7.17688e+00 1.52602e+01  0.00000e+00 0.00000e+00 6.93778e+01 115.188 7.73768e+01 295.188 0.9699 
1 1 1 9   96  1  o 12 5.35562e+00 9.99353e-01 6.27427e+01 170.926 -6.31470e+00 1.00851e+00  0.00000e+00 0.00000e+00 1.20889e+02 170.926 5.81463e+01 170.926 0.9181 
1 1 1 9   96  2  o 8  1.21350e+01 7.30797e-01 2.07493e+02 301.870 2.86047e+01  -4.60090e+01 0.00000e+00 0.00000e+00 2.41630e+02 301.870 3.41372e+01 301.870 0.9907 
1 1 1 9   96  3  o 4  2.94426e+00 9.09372e-01 3.97917e+01 102.412 -5.12212e-01 2.32739e+00  0.00000e+00 0.00000e+00 4.28997e+01 102.412 3.10797e+00 102.412 0.7517 
1 1 1 9   96  4  o 19 3.07416e+00 9.39800e-01 5.09217e+01 112.145 -1.16798e+00 2.86984e+00  0.00000e+00 0.00000e+00 4.29379e+01 112.145 7.98381e+00 292.145 0.8170 
1 1 1 9   96  5  o 19 2.97738e+00 9.44584e-01 7.37193e+01 317.773 3.68546e+00  -3.34499e+00 0.00000e+00 0.00000e+00 2.56332e+01 317.773 4.80860e+01 137.773 0.8928 
1 1 1 9   96  6  o 3  2.79181e+00 9.07945e-01 2.33252e+01 94.852  -1.32022e-01 1.55534e+00  0.00000e+00 0.00000e+00 4.04115e+01 94.852  1.70862e+01 94.852  0.6108 
1 1 1 9   96  7  o 10 4.69640e+00 1.13077e+00 8.63442e+01 213.173 -7.60752e+00 -4.97317e+00 0.00000e+00 0.00000e+00 7.92192e+01 213.173 7.12504e+00 33.173  0.9433 
1 1 1 9   96  8  o 11 4.51700e+00 1.28637e+00 1.13252e+02 2.066   1.03073e+01  3.71817e-01  0.00000e+00 0.00000e+00 4.71433e+01 2.066   6.61086e+01 182.066 0.9502 
1 1 1 9   97  0  o 12 1.07351e+01 6.82261e-01 1.34710e+02 209.713 -2.77858e+01 -1.58570e+01 0.00000e+00 0.00000e+00 2.59662e+02 209.713 1.24952e+02 209.713 0.9842 
1 1 1 9   97  1  o 7  1.16080e+01 7.25413e-01 1.96641e+02 337.306 4.50532e+01  -1.88401e+01 0.00000e+00 0.00000e+00 2.32306e+02 337.306 3.56647e+01 337.306 0.9897 
1 1 1 9   97  2  o 10 3.79632e+00 9.86149e-01 4.53857e+01 124.343 -1.87350e+00 2.74199e+00  0.00000e+00 0.00000e+00 7.24592e+01 124.343 2.70736e+01 124.343 0.8312 
1 1 1 9   97  3  f 0  2.91578e+00 8.97816e-01 2.18316e+01 181.528 -1.28341e+00 -3.42420e-02 0.00000e+00 0.00000e+00 3.67660e+01 181.528 1.49344e+01 181.528 0.5380 
1 1 1 9   97  4  f 0  4.05407e+00 9.87063e-01 8.57176e+01 163.865 -6.73078e+00 1.94718e+00  0.00000e+00 0.00000e+00 5.44772e+01 163.865 3.12403e+01 343.865 0.9256 
1 1 1 9   97  5  o 18 3.51597e+00 1.02284e+00 7.55604e+01 224.099 -4.21035e+00 -4.07991e+00 0.00000e+00 0.00000e+00 4.40091e+01 224.099 3.15513e+01 44.099  0.9102 
1 1 1 9   97  6  o 2  5.26654e+00 1.14804e+00 1.13432e+02 80.889  1.82558e+00  1.13834e+01  0.00000e+00 0.00000e+00 7.46136e+01 80.889  3.88180e+01 260.889 0.9556 
1 1 1 9   97  7  o 2  3.02966e+00 9.37943e-01 6.61063e+01 269.296 -6.16386e-02 -5.01561e+00 0.00000e+00 0.00000e+00 3.50655e+01 269.296 3.10408e+01 89.296  0.8938 
1 1 1 9   97  8  o 5  6.73802e+00 1.37428e+00 1.01102e+02 221.097 -9.55445e+00 -8.33414e+00 0.00000e+00 0.00000e+00 1.40489e+02 221.097 3.93878e+01 221.097 0.9597 
1 1 1 9   98  0  o 4  3.75248e+00 9.38874e-01 3.92830e+01 98.699  -4.44248e-01 2.90343e+00  0.00000e+00 0.00000e+00 7.34680e+01 98.699  3.41850e+01 98.699  0.8052 
1 1 1 9   98  1  o 10 4.81537e+00 1.03038e+00 8.15774e+01 21.443  6.81890e+00  2.67826e+00  0.00000e+00 0.00000e+00 8.54047e+01 21.443  3.82723e+00 21.443  0.9290 
1 1 1 9   98  2  o 13 4.71201e+00 1.03135e+00 9.97158e+01 210.809 -7.41888e+00 -4.42409e+00 0.00000e+00 0.00000e+00 6.56960e+01 210.809 3.40198e+01 30.809  0.9402 
1 1 1 9   98  3  f 0  3.66090e+00 9.37357e-01 3.59041e+01 163.839 -2.63948e+00 7.64887e-01  0.00000e+00 0.00000e+00 7.20319e+01 163.839 3.61278e+01 163.839 0.7895 
1 1 1 9   98  4  o 10 3.93446e+00 9.39311e-01 6.68323e+01 3.622   5.96673e+00  3.77701e-01  0.00000e+00 0.00000e+00 6.71940e+01 3.622   3.61721e-01 3.622   0.9120 
1 1 1 9   98  5  f 0  3.36899e+00 9.87975e-01 7.34232e+01 54.450  3.22769e+00  4.51675e+00  0.00000e+00 0.00000e+00 4.04381e+01 54.450  3.29851e+01 234.450 0.9048 
1 1 1 9   98  6  o 14 2.43566e+00 8.19528e-01 4.37828e+01 1.205   2.82904e+00  5.95300e-02  0.00000e+00 0.00000e+00 2.86909e+01 1.205   1.50918e+01 181.205 0.7966 
1 1 1 9   98  7  o 2  3.00542e+00 9.60784e-01 4.32764e+01 227.325 -2.38036e+00 -2.58180e+00 0.00000e+00 0.00000e+00 5.12166e+01 227.325 7.94016e+00 227.325 0.8417 
1 1 1 9   98  8  o 9  3.14033e+00 1.03028e+00 3.33408e+01 287.230 7.88686e-01  -2.54305e+00 0.00000e+00 0.00000e+00 5.83315e+01 287.230 2.49907e+01 287.230 0.7816 
1 1 1 9   99  0  o 7  8.44042e+00 7.71159e-01 1.36471e+02 108.338 -7.93877e+00 2.39518e+01  0.00000e+00 0.00000e+00 1.72091e+02 108.338 3.56202e+01 108.338 0.9800 
1 1 1 9   99  1  o 3  8.27375e+00 8.09946e-01 1.15354e+02 9.685   2.03219e+01  3.46819e+00  0.00000e+00 0.00000e+00 1.85814e+02 9.685   7.04599e+01 9.685   0.9754 
1 1 1 9   99  2  o 2  7.00479e+00 9.56219e-01 9.74837e+01 157.000 -1.29595e+01 5.50083e+00  0.00000e+00 0.00000e+00 1.54520e+02 157.000 5.70366e+01 157.000 0.9638 
1 1 1 9   99  3  f 0  3.55376e+00 9.45551e-01 1.15728e+01 64.071  4.07369e-01  8.37880e-01  0.00000e+00 0.00000e+00 4.43716e+01 64.071  3.27988e+01 64.071  0.4217 
1 1 1 9   99  4  o 11 3.03275e+00 9.35909e-01 4.73381e+01 133.879 -2.16795e+00 2.25447e+00  0.00000e+00 0.00000e+00 4.54090e+01 133.879 1.92908e+00 313.879 0.8190 
1 1 1 9   99  5  o 15 3.01082e+00 9.31370e-01 5.41250e+01 113.001 -1.46687e+00 3.45560e+00  0.00000e+00 0.00000e+00 4.18216e+01 113.001 1.23035e+01 293.001 0.8534 
1 1 1 9   99  6  o 12 3.71706e+00 1.04927e+00 6.22955e+01 275.785 5.50993e-01  -5.43842e+00 0.00000e+00 0.00000e+00 6.30774e+01 275.785 7.81936e-01 275.785 0.9032 
1 1 1 9   99  7  o 13 6.44786e+00 1.19422e+00 8.53237e+01 355.838 1.13768e+01  -8.27804e-01 0.00000e+00 0.00000e+00 1.44652e+02 355.838 5.93287e+01 355.838 0.9551 
1 1 1 9   99  8  o 11 3.36978e+00 1.05333e+00 5.13675e+01 166.316 -4.55778e+00 1.10972e+00  0.00000e+00 0.00000e+00 6.00759e+01 166.316 8.70840e+00 166.316 0.8857 
1 1 1 9   100 0  o 18 1.14291e+01 6.78596e-01 1.72358e+02 57.997  2.60701e+01  4.17165e+01  0.00000e+00 0.00000e+00 2.49530e+02 57.997  7.71721e+01 57.997  0.9898 
1 1 1 9   100 1  o 8  5.31247e+00 1.00404e+00 5.79651e+01 156.038 -5.60096e+00 2.48926e+00  0.00000e+00 0.00000e+00 1.23245e+02 156.038 6.52801e+01 156.038 0.9143 
1 1 1 9   100 2  o 15 6.50005e+00 9.70025e-01 8.78833e+01 188.964 -1.25325e+01 -1.97697e+00 0.00000e+00 0.00000e+00 1.44914e+02 188.964 5.70305e+01 188.964 0.9597 
1 1 1 9   100 3  o 17 8.82455e+00 8.69420e-01 1.45136e+02 183.474 -3.20354e+01 -1.94474e+00 0.00000e+00 0.00000e+00 1.79065e+02 183.474 3.39286e+01 183.474 0.9843 
1 1 1 9   100 4  f 0  3.11679e+00 9.42863e-01 2.65821e+01 290.014 6.53535e-01  -1.79422e+00 0.00000e+00 0.00000e+00 5.28092e+01 290.014 2.62271e+01 290.014 0.6823 
1 1 1 9   100 5  o 14 4.33855e+00 1.09052e+00 5.83059e+01 346.135 5.18538e+00  -1.27993e+00 0.00000e+00 0.00000e+00 8.75890e+01 346.135 2.92831e+01 346.135 0.9007 
1 1 1 9   100 6  o 3  2.86320e+00 9.26326e-01 1.75056e+01 190.002 -1.37909e+00 -2.43214e-01 0.00000e+00 0.00000e+00 4.34811e+01 190.002 2.59755e+01 190.002 0.5705 
1 1 1 9   100 7  o 16 6.04059e+00 1.22334e+00 5.91549e+01 47.938  5.00909e+00  5.55117e+00  0.00000e+00 0.00000e+00 1.50687e+02 47.938  9.15325e+01 47.938  0.9305 
1 1 1 9   101 0  o 10 5.13657e+00 9.63716e-01 5.86475e+01 140.211 -5.16691e+00 4.30316e+00  0.00000e+00 0.00000e+00 1.17987e+02 140.211 5.93399e+01 140.211 0.9223 
1 1 1 9   101 1  o 3  4.95712e+00 9.95488e-01 1.09113e+02 277.909 1.61705e+00  -1.16399e+01 0.00000e+00 0.00000e+00 6.77203e+01 277.909 4.13925e+01 97.909  0.9565 
1 1 1 9   101 2  f 0  3.70692e+00 1.02549e+00 1.01125e+02 63.589  3.67023e+00  7.39003e+00  0.00000e+00 0.00000e+00 2.84950e+01 63.589  7.26298e+01 243.589 0.9373 
1 1 1 9   101 3  o 18 3.26207e+00 9.58694e-01 6.47140e+01 140.055 -3.71953e+00 3.11500e+00  0.00000e+00 0.00000e+00 4.35975e+01 140.055 2.11164e+01 320.055 0.8898 
1 1 1 9   101 4  o 10 8.15432e+00 9.45437e-01 1.24642e+02 309.314 1.49887e+01  -1.83033e+01 0.00000e+00 0.00000e+00 1.73174e+02 309.314 4.85326e+01 309.314 0.9786 
1 1 1 9   101 5  o 6  3.13662e+00 9.58658e-01 4.76747e+01 39.104  2.97736e+00  2.41997e+00  0.00000e+00 0.00000e+00 5.26464e+01 39.104  4.97172e+00 39.104  0.8569 
1 1 1 9   101 6  f 0  2.43776e+00 8.10361e-01 3.66041e+01 40.169  2.20182e+00  1.85864e+00  0.00000e+00 0.00000e+00 3.62607e+01 40.169  3.43393e-01 220.169 0.8008 
1 1 1 9   101 7  o 15 5.54069e+00 1.23939e+00 1.38567e+02 172.736 -1.66852e+01 2.12681e+00  0.00000e+00 0.00000e+00 6.19830e+01 172.736 7.65844e+01 352.736 0.9698 
1 1 1 9   102 0  o 10 2.54367e+00 7.82132e-01 2.47682e+01 160.331 -1.59328e+00 5.69499e-01  0.00000e+00 0.00000e+00 3.59247e+01 160.331 1.11565e+01 160.331 0.6401 
1 1 1 9   102 1  o 17 2.83437e+00 8.68350e-01 3.96815e+01 274.011 1.80198e-01  -2.56998e+00 0.00000e+00 0.00000e+00 4.20161e+01 274.011 2.33454e+00 274.011 0.7730 
1 1 1 9   102 2  o 15 2.60890e+00 8.12912e-01 4.24605e+01 165.738 -2.77390e+00 7.05088e-01  0.00000e+00 0.00000e+00 3.53082e+01 165.738 7.15238e+00 345.738 0.7993 
1 1 1 9   102 3  o 13 2.82679e+00 8.89328e-01 5.43814e+01 339.419 3.42568e+00  -1.28635e+00 0.00000e+00 0.00000e+00 3.51471e+01 339.419 1.92343e+01 159.419 0.8490 
1 1 1 9   102 4  o 8  4.12430e+00 1.08508e+00 6.76194e+01 133.584 -4.49903e+00 4.72708e+00  0.00000e+00 0.00000e+00 7.39194e+01 133.584 6.30004e+00 133.584 0.9198 
1 1 1 9   102 5  o 18 3.08314e+00 9.36804e-01 3.53840e+01 15.267  2.90993e+00  7.94245e-01  0.00000e+00 0.00000e+00 5.79358e+01 15.267  2.25518e+01 15.267  0.8112 
1 1 1 9   102 6  o 10 3.13572e+00 9.74893e-01 1.67278e+01 75.046  3.73686e-01  1.39906e+00  0.00000e+00 0.00000e+00 5.14914e+01 75.046  3.47635e+01 75.046  0.5830 
1 1 1 9   102 7  o 7  3.21322e+00 1.00369e+00 2.54891e+01 292.431 8.20803e-01  -1.98834e+00 0.00000e+00 0.00000e+00 6.09647e+01 292.431 3.54755e+01 292.431 0.7211 
1 1 1 9   103 0  o 4  1.11134e+01 7.39942e-01 1.76409e+02 270.523 4.88977e-01  -5.35568e+01 0.00000e+00 0.00000e+00 2.33828e+02 270.523 5.74189e+01 270.523 0.9906 
1 1 1 9   103 1  o 13 2.97622e+00 9.09365e-01 5.64651e+01 136.138 -2.86711e+00 2.75541e+00  0.00000e+00 0.00000e+00 3.92335e+01 136.138 1.72317e+01 316.138 0.8626 
1 1 1 9   103 2  o 9  1.30307e+01 7.32001e-01 2.30399e+02 20.863  7.52771e+01  2.86901e+01  0.00000e+00 0.00000e+00 2.52437e+02 20.863  2.20381e+01 20.863  0.9938 
1 1 1 9   103 3  o 10 3.26204e+00 9.15226e-01 4.55040e+01 105.196 -9.52948e-01 3.50830e+00  0.00000e+00 0.00000e+00 5.76428e+01 105.196 1.21388e+01 105.196 0.8479 
1 1 1 9   103 4  o 13 4.48200e+00 1.00130e+00 8.83027e+01 265.585 -7.21002e-01 -9.33770e+00 0.00000e+00 0.00000e+00 6.96777e+01 265.585 1.86250e+01 85.585  0.9450 
1 1 1 9   103 5  o 10 5.33006e+00 1.14624e+00 7.89546e+01 336.728 8.94044e+00  -3.84512e+00 0.00000e+00 0.00000e+00 1.09360e+02 336.728 3.04049e+01 336.728 0.9471 
1 1 1 9   103 6  o 3  2.69545e+00 8.89070e-01 3.10748e+01 230.839 -1.66840e+00 -2.04851e+00 0.00000e+00 0.00000e+00 4.73129e+01 230.839 1.62381e+01 230.839 0.7796 
1 1 1 9   104 0  o 11 2.74464e+00 8.59399e-01 5.21950e+01 55.226  1.98985e+00  2.86584e+00  0.00000e+00 0.00000e+00 3.37445e+01 55.226  1.84505e+01 235.226 0.8405 
1 1 1 9   104 1  o 11 2.60351e+00 8.32710e-01 2.59126e+01 187.901 -1.70202e+00 -2.36213e-01 0.00000e+00 0.00000e+00 3.67292e+01 187.901 1.08166e+01 187.901 0.6457 
1 1 1 9   104 2  o 6  2.74495e+00 8.60055e-01 5.93538e+01 236.912 -2.27956e+00 -3.49844e+00 0.00000e+00 0.00000e+00 2.96579e+01 236.912 2.96959e+01 56.912  0.8699 
1 1 1 9   104 3  o 13 4.60011e+00 1.07499e+00 5.43823e+01 258.924 -1.06629e+00 -5.44718e+00 0.00000e+00 0.00000e+00 1.00789e+02 258.924 4.64066e+01 258.924 0.9048 
1 1 1 9   104 4  o 5  5.90073e+00 1.06230e+00 1.05646e+02 62.638  6.85769e+00  1.32511e+01  0.00000e+00 0.00000e+00 1.06877e+02 62.638  1.23152e+00 62.638  0.9659 
1 1 1 9   104 5  o 7  2.31183e+00 7.77694e-01 4.46914e+01 144.217 -2.69183e+00 1.94022e+00  0.00000e+00 0.00000e+00 2.69519e+01 144.217 1.77395e+01 324.217 0.8310 
1 1 1 9   104 6  o 1  7.01319e+00 1.20600e+00 1.32958e+02 150.457 -1.87124e+01 1.06056e+01  0.00000e+00 0.00000e+00 1.22429e+02 150.457 1.05286e+01 330.457 0.9765 
1 1 1 9   105 0  o 15 6.56847e+00 9.37811e-01 8.60655e+01 277.227 1.70811e+00  -1.34704e+01 0.00000e+00 0.00000e+00 1.49370e+02 277.227 6.33044e+01 277.227 0.9624 
1 1 1 9   105 1  o 6  3.29587e+00 9.66125e-01 4.92401e+01 38.788  3.31118e+00  2.66110e+00  0.00000e+00 0.00000e+00 5.78810e+01 38.788  8.64087e+00 38.788  0.8724 
1 1 1 9   105 2  o 16 9.38194e+00 8.41772e-01 1.59006e+02 335.442 3.69202e+01  -1.68710e+01 0.00000e+00 0.00000e+00 1.86273e+02 335.442 2.72678e+01 335.442 0.9876 
1 1 1 9   105 3  o 17 6.74075e+00 1.03054e+00 1.12725e+02 171.546 -1.89662e+01 2.81905e+00  0.00000e+00 0.00000e+00 1.31876e+02 171.546 1.91510e+01 171.546 0.9736 
1 1 1 9   105 4  o 14 3.89376e+00 1.00493e+00 6.40227e+01 354.002 6.12037e+00  -6.43035e-01 0.00000e+00 0.00000e+00 6.87454e+01 354.002 4.72272e+00 354.002 0.9147 
1 1 1 9   105 5  o 10 2.43912e+00 8.20898e-01 2.46742e+01 258.006 -4.23239e-01 -1.99225e+00 0.00000e+00 0.00000e+00 3.93165e+01 258.006 1.46423e+01 258.006 0.7037 
1 1 1 9   105 6  o 18 3.21398e+00 9.84854e-01 8.35660e+00 169.561 -7.88267e-01 1.45229e-01  0.00000e+00 0.00000e+00 3.61803e+01 169.561 2.78237e+01 169.561 0.3717 
1 1 1 9   106 0  o 8  8.22285e+00 8.40694e-01 1.01860e+02 174.083 -2.26823e+01 2.35075e+00  0.00000e+00 0.00000e+00 1.97497e+02 174.083 9.56370e+01 174.083 0.9778 
1 1 1 9   106 1  o 7  5.86196e+00 1.01536e+00 1.05801e+02 342.098 1.40721e+01  -4.54569e+00 0.00000e+00 0.00000e+00 1.05003e+02 342.098 7.97904e-01 162.098 0.9656 
1 1 1 9   106 2  o 10 3.69673e+00 1.00139e+00 4.81371e+01 257.025 -1.03688e+00 -4.50031e+00 0.00000e+00 0.00000e+00 7.35640e+01 257.025 2.54269e+01 257.025 0.8837 
1 1 1 9   106 3  o 7  2.60395e+00 8.04738e-01 3.09946e+01 54.434  1.39214e+00  1.94697e+00  0.00000e+00 0.00000e+00 4.20567e+01 54.434  1.10620e+01 54.434  0.7529 
1 1 1 9   106 4  o 6  4.63505e+00 1.00927e+00 4.64903e+01 8.108   5.54255e+00  7.89595e-01  0.00000e+00 0.00000e+00 1.09944e+02 8.108   6.34536e+01 8.108   0.9056 
1 1 1 9   106 5  o 16 3.30550e+00 9.97079e-01 5.82748e+01 99.733  -8.60985e-01 5.01967e+00  0.00000e+00 0.00000e+00 5.20477e+01 99.733  6.22716e+00 279.733 0.8955 
1 1 1 9   106 6  o 14 3.58227e+00 1.06452e+00 7.21662e+01 15.655  7.13420e+00  1.99935e+00  0.00000e+00 0.00000e+00 5.19816e+01 15.655  2.01845e+01 195.655 0.9298 
1 1 1 9   107 0  o 7  3.09739e+00 9.11127e-01 2.60555e+01 198.126 -2.17126e+00 -7.10753e-01 0.00000e+00 0.00000e+00 5.91863e+01 198.126 3.31307e+01 198.126 0.7394 
1 1 1 9   107 1  o 8  3.61363e+00 8.21667e-01 7.57788e+01 312.851 5.58129e+00  -6.01642e+00 0.00000e+00 0.00000e+00 5.02807e+01 312.851 2.54981e+01 132.851 0.9369 
1 1 1 9   107 2  o 12 4.24167e+00 1.01642e+00 5.68209e+01 84.746  5.39434e-01  5.86588e+00  0.00000e+00 0.00000e+00 8.70320e+01 84.746  3.02111e+01 84.746  0.9106 
1 1 1 9   107 3  o 18 3.85546e+00 1.03535e+00 3.12703e+01 1.559   3.02210e+00  8.22398e-02  0.00000e+00 0.00000e+00 8.53029e+01 1.559   5.40327e+01 1.559   0.8117 
1 1 1 9   107 4  o 13 3.38660e+00 9.91702e-01 6.59218e+01 157.954 -5.61958e+00 2.27565e+00  0.00000e+00 0.00000e+00 4.93142e+01 157.954 1.66076e+01 337.954 0.9133 
1 1 1 9   107 5  o 13 3.14078e+00 9.60012e-01 2.50308e+01 314.887 1.70060e+00  -1.70731e+00 0.00000e+00 0.00000e+00 6.33003e+01 314.887 3.82695e+01 314.887 0.7548 
1 1 1 9   108 0  o 5  4.57056e+00 1.01742e+00 7.00670e+01 318.835 5.88559e+00  -5.14614e+00 0.00000e+00 0.00000e+00 8.87191e+01 318.835 1.86521e+01 318.835 0.9337 
1 1 1 9   108 1  o 13 2.68132e+00 7.99173e-01 4.19501e+01 342.538 3.53042e+00  -1.11054e+00 0.00000e+00 0.00000e+00 4.29778e+01 342.538 1.02776e+00 342.538 0.8510 
1 1 1 9   108 2  o 4  3.09699e+00 9.47070e-01 5.75092e+01 138.678 -3.65140e+00 3.21037e+00  0.00000e+00 0.00000e+00 4.51232e+01 138.678 1.23861e+01 318.678 0.8901 
1 1 1 9   108 3  o 9  4.21766e+00 1.06921e+00 7.02453e+01 348.106 7.29065e+00  -1.53556e+00 0.00000e+00 0.00000e+00 7.58628e+01 348.106 5.61751e+00 348.106 0.9302 
1 1 1 9   108 4  o 10 3.58147e+00 1.01548e+00 6.01378e+01 67.724  2.23884e+00  5.46531e+00  0.00000e+00 0.00000e+00 6.13660e+01 67.724  1.22826e+00 67.724  0.9109 
1 1 1 9   108 5  o 11 2.51532e+00 8.49276e-01 5.02257e+01 322.862 3.59858e+00  -2.72535e+00 0.00000e+00 0.00000e+00 3.22929e+01 322.862 1.79328e+01 142.862 0.8807 
1 1 1 9   109 0  o 7  2.96811e+00 9.03992e-01 6.68683e+01 58.936  2.91276e+00  4.83541e+00  0.00000e+00 0.00000e+00 3.32131e+01 58.936  3.36552e+01 238.936 0.9065 
1 1 1 9   109 1  o 9  6.52234e+00 9.56667e-01 1.11291e+02 172.108 -1.96438e+01 2.72291e+00  0.00000e+00 0.00000e+00 1.25209e+02 172.108 1.39173e+01 172.108 0.9745 
1 1 1 9   109 2  o 14 5.96211e+00 1.07587e+00 6.13915e+01 37.119  7.28881e+00  5.51631e+00  0.00000e+00 0.00000e+00 1.48008e+02 37.119  8.66161e+01 37.119  0.9436 
1 1 1 9   109 3  o 4  5.07180e+00 1.04792e+00 3.77718e+01 226.554 -3.30972e+00 -3.49427e+00 0.00000e+00 0.00000e+00 1.30058e+02 226.554 9.22862e+01 226.554 0.8889 
1 1 1 9   109 4  o 7  2.84841e+00 8.98781e-01 3.75804e+01 283.692 8.44044e-01  -3.46442e+00 0.00000e+00 0.00000e+00 5.19818e+01 283.692 1.44014e+01 283.692 0.8445 
1 1 1 9   109 5  o 19 5.39368e+00 1.15821e+00 7.63497e+01 155.879 -9.58452e+00 4.29149e+00  0.00000e+00 0.00000e+00 1.14680e+02 155.879 3.83307e+01 155.879 0.9511 
1 1 1 9   110 0  o 14 3.43844e+00 9.50729e-01 6.36870e+01 220.180 -4.73518e+00 -3.99874e+00 0.00000e+00 0.00000e+00 5.33519e+01 220.180 1.03352e+01 40.180  0.9153 
1 1 1 9   110 1  o 12 3.46411e+00 9.84725e-01 8.02100e+01 132.108 -5.43249e+00 6.01061e+00  0.00000e+00 0.00000e+00 4.04165e+01 132.108 3.97935e+01 312.108 0.9361 
1 1 1 9   110 2  o 11 3.56689e+00 9.99735e-01 6.28440e+01 357.510 6.24491e+00  -2.71603e-01 0.00000e+00 0.00000e+00 5.87415e+01 357.510 4.10243e+00 177.510 0.9161 
1 1 1 9   110 3  o 19 2.37014e+00 7.79424e-01 2.52416e+01 270.272 1.07974e-02  -2.27736e+00 0.00000e+00 0.00000e+00 3.98975e+01 270.272 1.46559e+01 270.272 0.7385 
1 1 1 9   110 4  o 17 3.11018e+00 9.40633e-01 1.82572e+01 300.283 8.94976e-01  -1.53258e+00 0.00000e+00 0.00000e+00 5.78146e+01 300.283 3.95574e+01 300.283 0.6571 
1 1 1 9   111 0  o 10 4.77528e+00 1.04136e+00 8.16908e+01 213.331 -8.70349e+00 -5.72398e+00 0.00000e+00 0.00000e+00 8.70855e+01 213.331 5.39471e+00 213.331 0.9507 
1 1 1 9   111 1  o 19 5.45987e+00 1.03354e+00 9.40122e+01 44.090  1.04373e+01  1.01110e+01  0.00000e+00 0.00000e+00 1.01915e+02 44.090  7.90278e+00 44.090  0.9650 
1 1 1 9   111 2  o 16 4.56836e+00 1.02236e+00 6.93140e+01 36.659  7.37892e+00  5.49189e+00  0.00000e+00 0.00000e+00 9.10993e+01 36.659  2.17853e+01 36.659  0.9440 
1 1 1 9   111 3  o 14 2.56857e+00 8.44352e-01 4.50208e+01 175.029 -4.13381e+00 3.59586e-01  0.00000e+00 0.00000e+00 3.80295e+01 175.029 6.99133e+00 355.028 0.8690 
1 1 1 9   111 4  o 3  2.51300e+00 8.36953e-01 3.50581e+01 193.923 -3.28763e+00 -8.15037e-01 0.00000e+00 0.00000e+00 4.30236e+01 193.923 7.96558e+00 193.923 0.8350 
1 1 1 9   112 0  o 12 2.49888e+00 8.05199e-01 3.69840e+01 77.588  7.34193e-01  3.33608e+00  0.00000e+00 0.00000e+00 4.07095e+01 77.588  3.72546e+00 77.588  0.8366 
1 1 1 9   112 1  o 18 3.08500e+00 9.00389e-01 5.72354e+01 317.870 4.53449e+00  -4.10149e+00 0.00000e+00 0.00000e+00 4.76029e+01 317.870 9.63248e+00 137.870 0.9141 
1 1 1 9   112 2  o 6  8.67400e+00 9.26072e-01 1.55982e+02 150.791 -3.75157e+01 2.09748e+01  0.00000e+00 0.00000e+00 1.62803e+02 150.791 6.82057e+00 150.791 0.9883 
1 1 1 9   112 3  o 19 2.82262e+00 8.97755e-01 5.71902e+01 271.952 1.95073e-01  -5.72227e+00 0.00000e+00 0.00000e+00 3.81241e+01 271.952 1.90661e+01 91.952  0.9079 
1 1 1 9   112 4  o 18 2.83071e+00 9.05907e-01 4.95500e+01 295.718 2.06797e+00  -4.29343e+00 0.00000e+00 0.00000e+00 4.39218e+01 295.718 5.62818e+00 115.718 0.8876 
1 1 1 9   113 0  o 10 2.24150e+00 7.47700e-01 7.14900e+01 167.753 -6.03598e+00 1.31025e+00  0.00000e+00 0.00000e+00 4.71114e+00 167.753 6.67789e+01 347.753 0.9150 
1 1 1 9   113 1  o 18 2.29692e+00 7.58040e-01 4.75876e+01 351.121 4.33225e+00  -6.76789e-01 0.00000e+00 0.00000e+00 2.72650e+01 351.121 2.03225e+01 171.121 0.8768 
1 1 1 9   113 2  o 8  2.56853e+00 8.34703e-01 4.17382e+01 250.990 -1.33413e+00 -3.87241e+00 0.00000e+00 0.00000e+00 4.10584e+01 250.990 6.79761e-01 70.990  0.8671 
1 1 1 9   113 3  o 15 4.14177e+00 1.05028e+00 9.18079e+01 66.799  4.32142e+00  1.00822e+01  0.00000e+00 0.00000e+00 5.49996e+01 66.799  3.68083e+01 246.799 0.9533 
1 1 1 9   113 4  o 8  2.83704e+00 9.00420e-01 8.05297e+01 281.245 1.61643e+00  -8.13015e+00 0.00000e+00 0.00000e+00 1.83912e+01 281.245 6.21385e+01 101.245 0.9376 
1 1 1 9   114 0  f 0  2.42810e+00 7.86541e-01 2.05392e+01 336.102 1.86148e+00  -8.24835e-01 0.00000e+00 0.00000e+00 4.29141e+01 336.102 2.23749e+01 336.102 0.7036 
1 1 1 9   114 1  o 1  3.65716e+00 9.92864e-01 7.54858e+01 221.656 -6.63122e+00 -5.89904e+00 0.00000e+00 0.00000e+00 5.24911e+01 221.656 2.29947e+01 41.656  0.9419 
1 1 1 9   114 2  o 7  2.82167e+00 8.71570e-01 3.98401e+01 30.926  3.40833e+00  2.04193e+00  0.00000e+00 0.00000e+00 5.06034e+01 30.926  1.07633e+01 30.926  0.8625 
1 1 1 9   114 3  o 1  3.69101e+00 1.01982e+00 5.83422e+01 133.939 -4.90616e+00 5.09124e+00  0.00000e+00 0.00000e+00 6.87487e+01 133.939 1.04065e+01 133.939 0.9263 
1 1 1 9   115 0  o 6  2.12898e+00 7.18817e-01 4.98116e+01 151.073 -3.90070e+00 2.15573e+00  0.00000e+00 0.00000e+00 1.96758e+01 151.073 3.01358e+01 331.073 0.8790 
1 1 1 9   115 1  f 0  2.30091e+00 7.56797e-01 2.15552e+01 16.460  2.03013e+00  5.99808e-01  0.00000e+00 0.00000e+00 3.96400e+01 16.460  1.80848e+01 16.460  0.7161 
1 1 1 9   115 2  o 6  3.55601e+00 9.85434e-01 7.56706e+01 76.465  2.06243e+00  8.56743e+00  0.00000e+00 0.00000e+00 4.87042e+01 76.465  2.69664e+01 256.465 0.9414 
1 1 1 9   115 3  o 16 3.32446e+00 9.46340e-01 3.74839e+01 245.858 -1.81600e+00 -4.05179e+00 0.00000e+00 0.00000e+00 7.10490e+01 245.858 3.35651e+01 245.858 0.8785 
1 1 1 9   116 0  o 9  4.41246e+00 9.86674e-01 7.27528e+01 156.918 -9.65528e+00 4.11475e+00  0.00000e+00 0.00000e+00 8.30194e+01 156.918 1.02667e+01 156.918 0.9511 
1 1 1 9   116 1  o 1  2.44445e+00 8.00084e-01 3.79249e+01 190.028 -4.10286e+00 -7.25546e-01 0.00000e+00 0.00000e+00 4.10058e+01 190.028 3.08089e+00 190.028 0.8696 
1 1 1 9   116 2  o 10 2.64519e+00 8.58167e-01 4.72679e+01 309.610 3.63179e+00  -4.38851e+00 0.00000e+00 0.00000e+00 4.18750e+01 309.610 5.39290e+00 129.610 0.9074 
1 1 1 9   116 3  o 10 3.27334e+00 9.76087e-01 2.46291e+01 293.008 9.93868e-01  -2.34046e+00 0.00000e+00 0.00000e+00 6.89492e+01 293.008 4.43201e+01 293.008 0.7696 
1 1 1 9   117 1  o 11 3.68399e+00 9.96651e-01 6.14293e+01 43.363  5.27951e+00  4.98621e+00  0.00000e+00 0.00000e+00 6.55166e+01 43.363  4.08731e+00 43.363  0.9283 
1 1 1 9   117 2  o 8  3.26490e+00 9.69259e-01 7.75974e+01 278.712 1.21929e+00  -7.95688e+00 0.00000e+00 0.00000e+00 3.58231e+01 278.712 4.17743e+01 98.712  0.9357 
1 1 1 9   117 3  o 3  5.86959e+00 1.11053e+00 9.29374e+01 81.646  2.18047e+00  1.48491e+01  0.00000e+00 0.00000e+00 1.17646e+02 81.646  2.47086e+01 81.646  0.9661 
1 1 1 9   118 2  o 14 3.01824e+00 9.22070e-01 1.45748e+01 30.569  1.29477e+00  7.64778e-01  0.00000e+00 0.00000e+00 5.23122e+01 30.569  3.77374e+01 30.569  0.5971 
1 1 1 10  0   0  f 0  4.67266e+01 1.40007e+00 6.46738e+02 0.000   3.10408e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.12256e+03 0.000   4.75824e+02 0.000   1.0000 
1 1 1 10  0   1  o 1  4.17311e+01 1.29353e+00 5.47549e+02 0.000   2.35399e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.03319e+03 0.000   4.85636e+02 0.000   1.0000 
1 1 1 10  0   2  o 1  3.49557e+01 1.66880e+00 6.60700e+02 180.000 -2.47307e+01 0.00000e+00  0.00000e+00 0.00000e+00 6.63802e+02 180.000 3.10140e+00 180.000 1.0000 
1 1 1 10  0   3  f 0  9.26782e+00 1.45395e+00 1.47803e+02 0.000   1.60558e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.76230e+02 0.000   2.84266e+01 0.000   0.9225 
1 1 1 10  0   4  o 19 1.47051e+01 1.19048e+00 3.49149e+02 0.000   6.95563e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.08283e+02 0.000   1.40866e+02 180.000 1.0000 
1 1 1 10  0   5  o 3  1.85955e+01 1.14458e+00 1.59653e+02 180.000 -4.72266e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.45234e+02 180.000 3.85581e+02 180.000 0.9998 
1 1 1 10  0   6  f 0  4.82011e+00 2.42307e+00 5.10239e+01 180.000 -3.65775e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.29930e+01 180.000 3.80309e+01 0.000   0.3503 
1 1 1 10  0   7  o 3  3.17536e+01 1.28709e+00 4.35148e+02 0.000   3.06752e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.68793e+02 0.000   3.33644e+02 0.000   1.0000 
1 1 1 10  0   8  o 7  6.47371e+00 2.70858e+00 6.87232e+01 180.000 -9.40678e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.11804e+02 180.000 4.30813e+01 180.000 0.7355 
1 1 1 10  0   9  o 10 1.15023e+01 2.62013e+00 2.46326e+02 180.000 -7.42473e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.89711e+02 180.000 5.66157e+01 0.000   1.0000 
1 1 1 10  0   10 o 9  3.22382e+00 2.17383e+00 2.84188e+01 180.000 -3.12631e-01 0.00000e+00  0.00000e+00 0.00000e+00 8.58357e+00 180.000 1.98352e+01 0.000   0.3028 
1 1 1 10  0   11 f 0  4.50481e+00 3.03094e+00 2.87332e+01 180.000 -3.73783e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.22573e+01 180.000 3.52413e+00 180.000 0.3573 
1 1 1 10  0   12 o 2  3.09724e+01 2.83529e+00 4.01466e+02 0.000   4.29087e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.71814e+02 0.000   3.70348e+02 0.000   1.0000 
1 1 1 10  0   13 o 9  5.20826e+00 3.01439e+00 1.33728e+02 0.000   2.51403e+00  0.00000e+00  0.00000e+00 0.00000e+00 6.09299e+01 0.000   7.27983e+01 180.000 0.9870 
1 1 1 10  1   0  o 17 1.00510e+01 7.95793e-01 2.63377e+02 359.740 5.51214e+00  -2.50111e-02 0.00000e+00 0.00000e+00 8.06828e+01 359.740 1.82695e+02 179.740 0.9040 
1 1 1 10  1   1  o 17 4.07375e+01 9.00236e-01 6.62489e+02 105.505 -1.48789e+01 5.36345e+01  0.00000e+00 0.00000e+00 8.66679e+02 105.505 2.04190e+02 105.505 0.9910 
1 1 1 10  1   2  o 4  2.43303e+01 1.03148e+00 4.95744e+02 243.794 -1.15607e+01 -2.34881e+01 0.00000e+00 0.00000e+00 4.08369e+02 243.794 8.73745e+01 63.794  0.9807 
1 1 1 10  1   3  o 3  1.12228e+01 1.06630e+00 2.62502e+02 280.497 1.25363e+00  -6.76626e+00 0.00000e+00 0.00000e+00 1.30599e+02 280.497 1.31903e+02 100.497 0.9242 
1 1 1 10  1   4  o 11 3.61511e+01 1.01614e+00 5.03701e+02 88.048  1.65283e+00  4.85006e+01  0.00000e+00 0.00000e+00 8.52499e+02 88.048  3.48798e+02 88.048  0.9896 
1 1 1 10  1   5  o 12 4.50947e+01 1.02059e+00 8.45109e+02 173.975 -1.17823e+02 1.24364e+01  0.00000e+00 0.00000e+00 8.57302e+02 173.975 1.21932e+01 173.975 0.9958 
1 1 1 10  1   6  o 14 3.69151e+01 9.40720e-01 6.00081e+02 355.917 7.43144e+01  -5.30490e+00 0.00000e+00 0.00000e+00 7.90123e+02 355.917 1.90042e+02 355.917 0.9933 
1 1 1 10  1   7  o 14 1.09462e+01 1.18934e+00 1.04341e+02 148.508 -4.12067e+00 2.52439e+00  0.00000e+00 0.00000e+00 2.64760e+02 148.508 1.60419e+02 148.508 0.8893 
1 1 1 10  1   8  o 14 2.21138e+01 1.27385e+00 4.46911e+02 25.693  4.50449e+01  2.16717e+01  0.00000e+00 0.00000e+00 3.83058e+02 25.693  6.38527e+01 205.693 0.9899 
1 1 1 10  1   9  o 16 1.00107e+01 1.70733e+00 1.49442e+02 213.575 -6.88644e+00 -4.57097e+00 0.00000e+00 0.00000e+00 2.06291e+02 213.575 5.68482e+01 213.575 0.9374 
1 1 1 10  1   10 o 10 2.56178e+01 1.48251e+00 4.14973e+02 52.056  4.55833e+01  5.84606e+01  0.00000e+00 0.00000e+00 5.49419e+02 52.056  1.34446e+02 52.056  0.9932 
1 1 1 10  1   11 o 2  1.67586e+01 2.45489e+00 2.63383e+02 250.213 -7.45969e+00 -2.07354e+01 0.00000e+00 0.00000e+00 3.57066e+02 250.213 9.36833e+01 250.213 0.9770 
1 1 1 10  1   12 o 17 7.40696e+00 2.29718e+00 1.93661e+02 162.511 -8.10913e+00 2.55509e+00  0.00000e+00 0.00000e+00 6.98673e+01 162.511 1.23794e+02 342.511 0.9392 
1 1 1 10  1   13 o 13 5.42862e+00 1.64910e+00 7.00462e+01 192.715 -3.56691e+00 -8.04836e-01 0.00000e+00 0.00000e+00 1.04458e+02 192.715 3.44122e+01 192.715 0.8489 
1 1 1 10  2   0  o 13 1.61895e+01 6.49503e-01 2.13661e+02 2.971   7.25207e+00  3.76371e-01  0.00000e+00 0.00000e+00 3.55427e+02 2.971   1.41766e+02 2.971   0.9283 
1 1 1 10  2   1  o 10 1.82587e+01 6.85545e-01 4.79901e+02 265.192 -1.53475e+00 -1.82472e+01 0.00000e+00 0.00000e+00 1.92558e+02 265.192 2.87343e+02 85.192  0.9723 
1 1 1 10  2   2  o 14 1.62464e+01 1.05953e+00 2.87095e+02 243.974 -4.43057e+00 -9.07361e+00 0.00000e+00 0.00000e+00 2.97166e+02 243.974 1.00708e+01 243.974 0.9491 
1 1 1 10  2   3  o 9  2.00065e+01 7.20586e-01 2.88623e+02 291.788 5.14648e+00  -1.28747e+01 0.00000e+00 0.00000e+00 4.41748e+02 291.788 1.53125e+02 291.788 0.9632 
1 1 1 10  2   4  o 10 3.19661e+01 9.72851e-01 4.66334e+02 10.481  3.92307e+01  7.25760e+00  0.00000e+00 0.00000e+00 7.30132e+02 10.481  2.63798e+02 10.481  0.9874 
1 1 1 10  2   5  o 16 1.15550e+01 1.02853e+00 1.50705e+02 102.277 -1.14988e+00 5.28402e+00  0.00000e+00 0.00000e+00 2.44462e+02 102.277 9.37572e+01 102.277 0.9021 
1 1 1 10  2   6  o 7  3.44931e+01 9.20874e-01 4.86334e+02 80.389  9.44044e+00  5.57517e+01  0.00000e+00 0.00000e+00 8.09843e+02 80.389  3.23509e+02 80.389  0.9911 
1 1 1 10  2   7  o 4  2.00982e+01 9.17368e-01 3.71545e+02 250.778 -1.09011e+01 -3.12656e+01 0.00000e+00 0.00000e+00 3.78880e+02 250.778 7.33468e+00 250.778 0.9848 
1 1 1 10  2   8  o 1  1.96988e+01 1.18180e+00 3.30091e+02 248.964 -1.20651e+01 -3.13724e+01 0.00000e+00 0.00000e+00 4.05551e+02 248.964 7.54596e+01 248.964 0.9850 
1 1 1 10  2   9  o 3  5.62276e+00 1.60546e+00 1.44614e+02 273.856 3.13120e-01  -4.64617e+00 0.00000e+00 0.00000e+00 4.39731e+01 273.856 1.00641e+02 93.855  0.8848 
1 1 1 10  2   10 o 15 6.20895e+00 1.73829e+00 1.31953e+02 354.694 5.12988e+00  -4.76402e-01 0.00000e+00 0.00000e+00 7.90884e+01 354.694 5.28651e+01 174.694 0.8968 
1 1 1 10  2   11 o 12 1.08439e+01 2.42601e+00 2.10787e+02 325.919 9.57895e+00  -6.48072e+00 0.00000e+00 0.00000e+00 1.81929e+02 325.919 2.88577e+01 145.919 0.9557 
1 1 1 10  2   12 o 11 1.32479e+01 2.79670e+00 3.54534e+02 215.819 -1.75577e+01 -1.26717e+01 0.00000e+00 0.00000e+00 1.35586e+02 215.819 2.18947e+02 35.819  0.9766 
1 1 1 10  2   13 o 13 4.77682e+00 1.56879e+00 7.66741e+01 357.698 3.69284e+00  -1.48450e-01 0.00000e+00 0.00000e+00 7.72088e+01 357.698 5.34655e-01 357.698 0.8507 
1 1 1 10  3   0  o 7  2.44628e+01 6.79936e-01 3.86097e+02 328.893 1.69443e+01  -1.02243e+01 0.00000e+00 0.00000e+00 5.16458e+02 328.893 1.30361e+02 328.893 0.9744 
1 1 1 10  3   1  f 0  6.20537e+01 1.26609e+00 1.10307e+03 141.563 -1.07208e+02 8.50835e+01  0.00000e+00 0.00000e+00 1.23883e+03 141.563 1.35763e+02 141.563 0.9963 
1 1 1 10  3   2  o 17 3.46716e+01 9.84263e-01 7.10786e+02 51.290  3.35681e+01  4.18840e+01  0.00000e+00 0.00000e+00 5.90638e+02 51.290  1.20148e+02 231.289 0.9906 
1 1 1 10  3   3  o 5  3.62034e+01 8.54089e-01 6.44710e+02 322.890 4.42620e+01  -3.34869e+01 0.00000e+00 0.00000e+00 7.14976e+02 322.890 7.02662e+01 322.890 0.9909 
1 1 1 10  3   4  o 16 4.37225e+01 1.14374e+00 7.89566e+02 149.222 -7.79345e+01 4.64180e+01  0.00000e+00 0.00000e+00 8.58662e+02 149.222 6.90957e+01 149.222 0.9945 
1 1 1 10  3   5  o 1  3.87998e+01 9.33073e-01 6.53546e+02 19.707  7.49380e+01  2.68425e+01  0.00000e+00 0.00000e+00 8.08159e+02 19.707  1.54613e+02 19.707  0.9937 
1 1 1 10  3   6  o 12 3.24160e+01 8.99106e-01 5.95217e+02 34.682  5.36058e+01  3.70940e+01  0.00000e+00 0.00000e+00 6.24354e+02 34.682  2.91376e+01 34.682  0.9923 
1 1 1 10  3   7  o 11 1.04945e+01 1.25469e+00 1.45278e+02 276.922 7.67316e-01  -6.32018e+00 0.00000e+00 0.00000e+00 2.19872e+02 276.922 7.45939e+01 276.922 0.9177 
1 1 1 10  3   8  o 19 2.97260e+01 1.10409e+00 4.58971e+02 269.187 -1.02764e+00 -7.24409e+01 0.00000e+00 0.00000e+00 6.60212e+02 269.187 2.01241e+02 269.187 0.9931 
1 1 1 10  3   9  o 6  1.67170e+01 1.41499e+00 2.11746e+02 237.269 -1.16894e+01 -1.81863e+01 0.00000e+00 0.00000e+00 4.07131e+02 237.269 1.95386e+02 237.269 0.9766 
1 1 1 10  3   10 o 17 1.47591e+01 1.53120e+00 3.32969e+02 263.448 -3.83535e+00 -3.33914e+01 0.00000e+00 0.00000e+00 2.18036e+02 263.448 1.14933e+02 83.448  0.9850 
1 1 1 10  3   11 o 5  1.34047e+01 2.49555e+00 2.33038e+02 141.835 -1.20313e+01 9.45595e+00  0.00000e+00 0.00000e+00 2.58009e+02 141.835 2.49706e+01 141.835 0.9668 
1 1 1 10  3   12 o 4  1.01406e+01 2.34225e+00 1.30061e+02 67.379  2.93752e+00  7.04976e+00  0.00000e+00 0.00000e+00 2.27964e+02 67.379  9.79025e+01 67.379  0.9320 
1 1 1 10  3   13 o 18 4.53232e+00 1.49050e+00 9.49085e+01 42.772  3.28574e+00  3.03966e+00  0.00000e+00 0.00000e+00 5.60587e+01 42.772  3.88498e+01 222.772 0.8796 
1 1 1 10  4   0  o 6  9.78921e+00 8.03154e-01 3.13461e+02 337.982 5.91497e+00  -2.39190e+00 0.00000e+00 0.00000e+00 2.67636e+01 337.982 2.86698e+02 157.983 0.9179 
1 1 1 10  4   1  o 3  2.94018e+01 9.00708e-01 4.60971e+02 359.805 2.79266e+01  -9.50356e-02 0.00000e+00 0.00000e+00 6.32592e+02 359.805 1.71621e+02 359.805 0.9819 
1 1 1 10  4   2  o 16 3.98084e+01 8.96539e-01 6.00709e+02 281.421 1.03801e+01  -5.13834e+01 0.00000e+00 0.00000e+00 8.93175e+02 281.421 2.92466e+02 281.421 0.9904 
1 1 1 10  4   3  o 12 3.50909e+01 8.45685e-01 7.07707e+02 147.578 -4.98651e+01 3.16725e+01  0.00000e+00 0.00000e+00 6.10914e+02 147.578 9.67933e+01 327.578 0.9915 
1 1 1 10  4   4  o 17 2.83617e+01 9.30850e-01 3.19865e+02 247.546 -9.53928e+00 -2.30823e+01 0.00000e+00 0.00000e+00 7.33484e+02 247.546 4.13620e+02 247.546 0.9798 
1 1 1 10  4   5  o 2  2.89515e+01 8.30024e-01 4.29088e+02 39.189  3.05438e+01  2.49009e+01  0.00000e+00 0.00000e+00 6.54491e+02 39.189  2.25403e+02 39.189  0.9872 
1 1 1 10  4   6  o 15 1.67772e+01 9.36557e-01 2.65334e+02 80.424  2.49037e+00  1.47610e+01  0.00000e+00 0.00000e+00 3.49130e+02 80.424  8.37960e+01 80.424  0.9660 
1 1 1 10  4   7  o 3  1.72601e+01 9.38320e-01 3.31140e+02 326.671 2.10929e+01  -1.38705e+01 0.00000e+00 0.00000e+00 3.10169e+02 326.671 2.09710e+01 146.671 0.9800 
1 1 1 10  4   8  o 6  8.46575e+00 1.53935e+00 2.10994e+02 248.171 -3.16011e+00 -7.88936e+00 0.00000e+00 0.00000e+00 9.04412e+01 248.171 1.20553e+02 68.171  0.9392 
1 1 1 10  4   9  o 9  1.42190e+01 1.51024e+00 3.46771e+02 246.464 -1.14895e+01 -2.63790e+01 0.00000e+00 0.00000e+00 1.82788e+02 246.464 1.63983e+02 66.464  0.9825 
1 1 1 10  4   10 o 13 7.08572e+00 1.73701e+00 8.60824e+01 74.676  1.01392e+00  3.70022e+00  0.00000e+00 0.00000e+00 1.44052e+02 74.676  5.79698e+01 74.676  0.8569 
1 1 1 10  4   11 o 15 1.04303e+01 2.57239e+00 2.95951e+02 133.112 -1.02239e+01 1.09208e+01  0.00000e+00 0.00000e+00 8.58267e+01 133.112 2.10125e+02 313.112 0.9660 
1 1 1 10  4   12 o 11 7.73423e+00 2.23753e+00 1.63384e+02 341.721 7.33330e+00  -2.42226e+00 0.00000e+00 0.00000e+00 1.09909e+02 341.721 5.34756e+01 161.721 0.9328 
1 1 1 10  4   13 o 12 3.94283e+00 1.35248e+00 8.80428e+01 351.223 3.86868e+00  -5.97325e-01 0.00000e+00 0.00000e+00 4.03807e+01 351.223 4.76621e+01 171.223 0.8602 
1 1 1 10  5   0  o 1  1.49454e+01 6.78994e-01 1.98726e+02 289.568 2.08554e+00  -5.86731e+00 0.00000e+00 0.00000e+00 3.19483e+02 289.568 1.20757e+02 289.568 0.9157 
1 1 1 10  5   1  o 12 1.92459e+01 6.72930e-01 3.67156e+02 321.918 1.16171e+01  -9.10286e+00 0.00000e+00 0.00000e+00 3.36687e+02 321.918 3.04694e+01 141.919 0.9655 
1 1 1 10  5   2  o 5  3.25806e+01 8.00221e-01 5.77471e+02 145.126 -3.40516e+01 2.37320e+01  0.00000e+00 0.00000e+00 6.42030e+02 145.126 6.45589e+01 145.126 0.9879 
1 1 1 10  5   3  o 4  9.50894e+00 1.05667e+00 1.70803e+02 196.910 -4.03734e+00 -1.22741e+00 0.00000e+00 0.00000e+00 1.43258e+02 196.910 2.75446e+01 16.910  0.8715 
1 1 1 10  5   4  o 11 2.91826e+01 9.38836e-01 6.74761e+02 24.633  4.92187e+01  2.25688e+01  0.00000e+00 0.00000e+00 4.21178e+02 24.633  2.53583e+02 204.633 0.9907 
1 1 1 10  5   5  o 11 1.68196e+01 8.44487e-01 1.70905e+02 331.059 7.72340e+00  -4.27076e+00 0.00000e+00 0.00000e+00 4.29453e+02 331.059 2.58548e+02 331.059 0.9415 
1 1 1 10  5   6  o 9  1.34545e+01 1.03892e+00 1.72433e+02 21.511  7.16314e+00  2.82318e+00  0.00000e+00 0.00000e+00 3.03293e+02 21.511  1.30860e+02 21.511  0.9326 
1 1 1 10  5   7  o 6  5.28813e+00 1.35922e+00 1.20222e+02 32.547  2.30159e+00  1.46892e+00  0.00000e+00 0.00000e+00 3.77459e+01 32.547  8.24757e+01 212.547 0.7879 
1 1 1 10  5   8  o 1  3.82838e+01 1.14552e+00 5.66413e+02 249.773 -3.94186e+01 -1.06983e+02 0.00000e+00 0.00000e+00 8.78613e+02 249.773 3.12200e+02 249.773 0.9956 
1 1 1 10  5   9  f 0  1.76656e+01 1.43296e+00 3.38907e+02 145.661 -2.95817e+01 2.02085e+01  0.00000e+00 0.00000e+00 3.21335e+02 145.661 1.75717e+01 325.661 0.9859 
1 1 1 10  5   10 o 10 1.09645e+01 2.10961e+00 1.53236e+02 261.361 -1.35557e+00 -8.92229e+00 0.00000e+00 0.00000e+00 2.38576e+02 261.361 8.53399e+01 261.361 0.9429 
1 1 1 10  5   11 o 16 5.40410e+00 1.81170e+00 1.14036e+02 128.672 -2.68936e+00 3.36025e+00  0.00000e+00 0.00000e+00 6.49882e+01 128.672 4.90477e+01 308.672 0.8743 
1 1 1 10  5   12 o 18 1.11247e+01 2.06908e+00 1.87319e+02 3.902   1.38695e+01  9.46078e-01  0.00000e+00 0.00000e+00 2.18634e+02 3.902   3.13155e+01 3.902   0.9633 
1 1 1 10  5   13 o 2  3.37099e+00 1.18572e+00 1.46086e+02 120.180 -3.06864e+00 5.27667e+00  0.00000e+00 0.00000e+00 2.94226e+01 300.180 1.75508e+02 300.180 0.9139 
1 1 1 10  6   0  o 5  2.35890e+01 6.80567e-01 4.74222e+02 351.337 2.31680e+01  -3.52980e+00 0.00000e+00 0.00000e+00 3.99663e+02 351.337 7.45582e+01 171.337 0.9784 
1 1 1 10  6   1  o 13 2.62820e+01 7.20939e-01 2.97618e+02 181.737 -1.70144e+01 -5.15884e-01 0.00000e+00 0.00000e+00 6.68171e+02 181.737 3.70553e+02 181.737 0.9702 
1 1 1 10  6   2  o 6  2.42031e+01 7.10073e-01 3.67317e+02 119.030 -9.56623e+00 1.72364e+01  0.00000e+00 0.00000e+00 5.26144e+02 119.030 1.58827e+02 119.030 0.9743 
1 1 1 10  6   3  o 5  1.64223e+01 7.51630e-01 3.33163e+02 325.530 1.20400e+01  -8.26569e+00 0.00000e+00 0.00000e+00 2.67515e+02 325.530 6.56479e+01 145.530 0.9651 
1 1 1 10  6   4  o 11 1.88022e+01 8.97391e-01 3.92784e+02 213.081 -1.70745e+01 -1.11227e+01 0.00000e+00 0.00000e+00 3.02214e+02 213.081 9.05696e+01 33.081  0.9751 
1 1 1 10  6   5  o 16 2.23940e+01 8.01083e-01 3.66149e+02 334.796 2.28600e+01  -1.07592e+01 0.00000e+00 0.00000e+00 4.65845e+02 334.796 9.96954e+01 334.796 0.9800 
1 1 1 10  6   6  o 3  2.99042e+01 8.85851e-01 5.23484e+02 199.269 -4.99443e+01 -1.74599e+01 0.00000e+00 0.00000e+00 5.99510e+02 199.269 7.60263e+01 199.269 0.9905 
1 1 1 10  6   7  o 7  1.97686e+01 9.14266e-01 3.81731e+02 53.772  2.08645e+01  2.84785e+01  0.00000e+00 0.00000e+00 3.57070e+02 53.772  2.46618e+01 233.772 0.9857 
1 1 1 10  6   8  o 1  5.27422e+00 1.47631e+00 1.91030e+02 77.845  1.02630e+00  4.76505e+00  0.00000e+00 0.00000e+00 1.29963e+01 257.845 2.04027e+02 257.845 0.8904 
1 1 1 10  6   9  o 6  5.55930e+00 1.59958e+00 4.45602e+01 289.989 4.79073e-01  -1.31702e+00 0.00000e+00 0.00000e+00 7.57294e+01 289.989 3.11692e+01 289.989 0.5708 
1 1 1 10  6   10 o 10 1.69025e+01 1.74602e+00 2.22517e+02 9.249   2.32526e+01  3.78635e+00  0.00000e+00 0.00000e+00 4.04340e+02 9.249   1.81822e+02 9.249   0.9785 
1 1 1 10  6   11 f 0  8.77553e+00 2.40764e+00 1.78080e+02 316.331 5.92292e+00  -5.65387e+00 0.00000e+00 0.00000e+00 1.33414e+02 316.331 4.46659e+01 136.331 0.9368 
1 1 1 10  6   12 o 12 5.19853e+00 1.69522e+00 1.03392e+02 54.277  2.54586e+00  3.53994e+00  0.00000e+00 0.00000e+00 6.91233e+01 54.277  3.42690e+01 234.277 0.8761 
1 1 1 10  6   13 o 15 4.41391e+00 1.46322e+00 8.36906e+01 232.425 -2.38103e+00 -3.09458e+00 0.00000e+00 0.00000e+00 6.00056e+01 232.425 2.36849e+01 52.425  0.8598 
1 1 1 10  7   0  o 11 1.50387e+01 6.71977e-01 4.17726e+02 113.530 -5.25227e+00 1.20624e+01  0.00000e+00 0.00000e+00 1.29586e+02 113.530 2.88140e+02 293.530 0.9612 
1 1 1 10  7   1  o 19 1.67726e+01 6.78602e-01 4.34110e+02 350.969 1.56744e+01  -2.49117e+00 0.00000e+00 0.00000e+00 1.80827e+02 350.969 2.53283e+02 170.969 0.9680 
1 1 1 10  7   2  o 11 2.85600e+01 7.55475e-01 4.59533e+02 124.289 -1.63378e+01 2.39605e+01  0.00000e+00 0.00000e+00 6.03735e+02 124.289 1.44203e+02 124.289 0.9826 
1 1 1 10  7   3  o 9  2.94913e+01 7.85701e-01 4.02464e+02 315.179 2.23986e+01  -2.22593e+01 0.00000e+00 0.00000e+00 6.97350e+02 315.179 2.94886e+02 315.179 0.9840 
1 1 1 10  7   4  o 5  1.03497e+01 9.54663e-01 2.32041e+02 171.390 -6.51171e+00 9.86016e-01  0.00000e+00 0.00000e+00 1.29115e+02 171.390 1.02926e+02 351.389 0.9206 
1 1 1 10  7   5  o 14 1.07760e+01 1.05157e+00 1.58303e+02 246.487 -2.04038e+00 -4.68969e+00 0.00000e+00 0.00000e+00 2.07714e+02 246.487 4.94111e+01 246.487 0.8960 
1 1 1 10  7   6  o 18 3.88832e+01 9.63043e-01 6.21117e+02 69.949  2.77160e+01  7.59404e+01  0.00000e+00 0.00000e+00 8.43890e+02 69.949  2.22773e+02 69.949  0.9938 
1 1 1 10  7   7  o 18 1.37697e+01 1.01696e+00 1.93776e+02 356.932 1.22434e+01  -6.56253e-01 0.00000e+00 0.00000e+00 3.06504e+02 356.932 1.12728e+02 356.932 0.9583 
1 1 1 10  7   8  o 13 1.04397e+01 1.47562e+00 1.09426e+02 28.408  4.85998e+00  2.62871e+00  0.00000e+00 0.00000e+00 2.48468e+02 28.408  1.39042e+02 28.408  0.9043 
1 1 1 10  7   9  o 10 1.05912e+01 1.81554e+00 2.82218e+02 264.870 -1.40056e+00 -1.56011e+01 0.00000e+00 0.00000e+00 1.06218e+02 264.870 1.75999e+02 84.870  0.9675 
1 1 1 10  7   10 o 3  6.32126e+00 2.29159e+00 1.53897e+02 58.494  2.52552e+00  4.12030e+00  0.00000e+00 0.00000e+00 5.91667e+01 58.494  9.47305e+01 238.494 0.8894 
1 1 1 10  7   11 o 4  7.90237e+00 2.30052e+00 1.30441e+02 67.189  2.20391e+00  5.23997e+00  0.00000e+00 0.00000e+00 1.41184e+02 67.189  1.07431e+01 67.189  0.9072 
1 1 1 10  7   12 o 3  4.51822e+00 1.51932e+00 4.37289e+01 27.664  1.55431e+00  8.14785e-01  0.00000e+00 0.00000e+00 6.80520e+01 27.664  2.43231e+01 27.664  0.6531 
1 1 1 10  7   13 o 5  8.19888e+00 2.04741e+00 2.15439e+02 231.795 -8.18603e+00 -1.04008e+01 0.00000e+00 0.00000e+00 8.30457e+01 231.795 1.32393e+02 51.795  0.9614 
1 1 1 10  8   0  o 14 3.11044e+01 7.60725e-01 7.89460e+02 248.659 -1.86044e+01 -4.76162e+01 0.00000e+00 0.00000e+00 3.76628e+02 248.659 4.12833e+02 68.659  0.9902 
1 1 1 10  8   1  o 8  2.72841e+01 7.26985e-01 5.46957e+02 245.537 -1.34205e+01 -2.94986e+01 0.00000e+00 0.00000e+00 4.70379e+02 245.537 7.65781e+01 65.537  0.9844 
1 1 1 10  8   2  o 5  1.58187e+01 7.20740e-01 1.97880e+02 78.919  1.47261e+00  7.51934e+00  0.00000e+00 0.00000e+00 3.60851e+02 78.919  1.62971e+02 78.919  0.9323 
1 1 1 10  8   3  o 10 3.06900e+01 7.93447e-01 5.36121e+02 122.318 -2.33711e+01 3.69443e+01  0.00000e+00 0.00000e+00 6.13557e+02 122.318 7.74359e+01 122.318 0.9885 
1 1 1 10  8   4  o 17 4.04773e+01 9.39470e-01 7.94048e+02 296.592 3.94866e+01  -7.88799e+01 0.00000e+00 0.00000e+00 7.31489e+02 296.592 6.25592e+01 116.592 0.9943 
1 1 1 10  8   5  o 5  1.51321e+01 8.87061e-01 2.99752e+02 185.795 -1.37687e+01 -1.39748e+00 0.00000e+00 0.00000e+00 2.52761e+02 185.795 4.69908e+01 5.795   0.9632 
1 1 1 10  8   6  o 16 3.61540e+01 9.32146e-01 5.87763e+02 58.760  4.19103e+01  6.90939e+01  0.00000e+00 0.00000e+00 7.74385e+02 58.760  1.86622e+02 58.760  0.9938 
1 1 1 10  8   7  o 2  9.76442e+00 1.28749e+00 2.33501e+02 114.361 -4.09687e+00 9.04781e+00  0.00000e+00 0.00000e+00 1.17524e+02 114.361 1.15978e+02 294.361 0.9482 
1 1 1 10  8   8  o 14 1.57868e+01 1.16826e+00 2.75567e+02 235.355 -1.29181e+01 -1.86944e+01 0.00000e+00 0.00000e+00 3.09585e+02 235.355 3.40187e+01 235.355 0.9777 
1 1 1 10  8   9  o 10 1.40458e+01 1.51316e+00 4.32455e+02 108.924 -1.14636e+01 3.34371e+01  0.00000e+00 0.00000e+00 9.23694e+01 108.924 3.40086e+02 288.924 0.9858 
1 1 1 10  8   10 o 18 2.23785e+01 1.67287e+00 3.24140e+02 340.840 4.42452e+01  -1.53727e+01 0.00000e+00 0.00000e+00 5.14871e+02 340.840 1.90731e+02 340.840 0.9893 
1 1 1 10  8   11 o 1  6.34160e+00 1.98659e+00 1.58825e+02 176.436 -6.44921e+00 4.01727e-01  0.00000e+00 0.00000e+00 6.19887e+01 176.436 9.68363e+01 356.436 0.9190 
1 1 1 10  8   12 o 5  9.90348e+00 2.07962e+00 2.94809e+02 268.599 -4.73418e-01 -1.93544e+01 0.00000e+00 0.00000e+00 7.04966e+01 268.599 2.24312e+02 88.599  0.9738 
1 1 1 10  8   13 o 15 5.38076e+00 1.68527e+00 1.10369e+02 311.332 3.63566e+00  -4.13365e+00 0.00000e+00 0.00000e+00 7.37938e+01 311.332 3.65751e+01 131.332 0.9039 
1 1 1 10  9   0  o 11 2.58356e+01 7.06556e-01 6.02456e+02 186.991 -3.22310e+01 -3.95240e+00 0.00000e+00 0.00000e+00 3.60517e+02 186.991 2.41939e+02 6.991   0.9845 
1 1 1 10  9   1  o 10 9.99816e+00 8.57256e-01 1.82441e+02 137.324 -2.88482e+00 2.65980e+00  0.00000e+00 0.00000e+00 1.43423e+02 137.324 3.90179e+01 317.324 0.8605 
1 1 1 10  9   2  o 1  2.25602e+01 7.18581e-01 5.10920e+02 77.328  6.18372e+00  2.75024e+01  0.00000e+00 0.00000e+00 3.28510e+02 77.328  1.82410e+02 257.328 0.9821 
1 1 1 10  9   3  o 14 2.79712e+01 7.80497e-01 3.76034e+02 285.389 7.41777e+00  -2.69497e+01 0.00000e+00 0.00000e+00 6.64830e+02 285.389 2.88795e+02 285.389 0.9819 
1 1 1 10  9   4  o 19 2.98975e+01 8.12424e-01 6.21768e+02 25.415  4.65833e+01  2.21342e+01  0.00000e+00 0.00000e+00 5.00404e+02 25.415  1.21363e+02 205.415 0.9903 
1 1 1 10  9   5  f 0  1.93445e+01 8.25056e-01 4.62734e+02 32.731  2.30970e+01  1.48459e+01  0.00000e+00 0.00000e+00 2.57098e+02 32.731  2.05636e+02 212.731 0.9816 
1 1 1 10  9   6  o 15 2.30755e+01 8.53807e-01 2.82313e+02 311.619 1.66087e+01  -1.86942e+01 0.00000e+00 0.00000e+00 5.74822e+02 311.619 2.92508e+02 311.619 0.9798 
1 1 1 10  9   7  o 4  2.13836e+01 8.89598e-01 4.79434e+02 190.923 -4.71981e+01 -9.10881e+00 0.00000e+00 0.00000e+00 3.22760e+02 190.923 1.56674e+02 10.923  0.9895 
1 1 1 10  9   8  o 15 8.17610e+00 1.59510e+00 1.41271e+02 320.703 4.17854e+00  -3.41975e+00 0.00000e+00 0.00000e+00 1.38267e+02 320.703 3.00424e+00 140.703 0.9019 
1 1 1 10  9   9  o 19 7.18490e+00 1.72573e+00 2.26545e+01 259.321 -1.63046e-01 -8.64612e-01 0.00000e+00 0.00000e+00 8.68812e+01 259.321 6.42267e+01 259.321 0.4022 
1 1 1 10  9   10 o 15 8.13484e+00 2.43041e+00 2.18174e+02 272.932 4.24536e-01  -8.28977e+00 0.00000e+00 0.00000e+00 7.09027e+01 272.932 1.47271e+02 92.932  0.9377 
1 1 1 10  9   11 o 15 6.75065e+00 2.04772e+00 5.02243e+01 277.918 2.90860e-01  -2.09113e+00 0.00000e+00 0.00000e+00 1.32711e+02 277.918 8.24865e+01 277.918 0.7152 
1 1 1 10  9   12 f 0  1.17395e+01 2.04996e+00 2.30121e+02 336.732 1.67101e+01  -7.18535e+00 0.00000e+00 0.00000e+00 2.02139e+02 336.732 2.79820e+01 156.732 0.9721 
1 1 1 10  9   13 o 16 6.21712e+00 1.80736e+00 1.83635e+02 162.134 -9.36979e+00 3.02014e+00  0.00000e+00 0.00000e+00 3.94706e+01 162.134 1.44164e+02 342.134 0.9478 
1 1 1 10  10  0  o 1  3.25335e+01 7.83634e-01 5.25422e+02 263.104 -4.25786e+00 -3.52050e+01 0.00000e+00 0.00000e+00 6.88796e+02 263.104 1.63373e+02 263.104 0.9858 
1 1 1 10  10  1  o 12 1.87095e+01 6.75819e-01 1.04748e+02 194.751 -4.11883e+00 -1.08447e+00 0.00000e+00 0.00000e+00 5.13717e+02 194.751 4.08968e+02 194.751 0.8728 
1 1 1 10  10  2  o 14 1.00518e+01 8.52503e-01 2.40716e+02 84.174  5.94125e-01  5.82327e+00  0.00000e+00 0.00000e+00 1.05837e+02 84.174  1.34879e+02 264.174 0.9100 
1 1 1 10  10  3  o 11 2.48877e+01 8.54678e-01 4.84375e+02 60.678  1.55794e+01  2.77371e+01  0.00000e+00 0.00000e+00 4.43804e+02 60.678  4.05704e+01 240.678 0.9842 
1 1 1 10  10  4  o 14 2.97549e+01 8.20898e-01 4.57161e+02 269.893 -7.60140e-02 -4.07164e+01 0.00000e+00 0.00000e+00 6.56683e+02 269.893 1.99521e+02 269.893 0.9876 
1 1 1 10  10  5  o 4  2.70553e+01 8.35040e-01 4.51399e+02 32.577  3.15063e+01  2.01312e+01  0.00000e+00 0.00000e+00 5.60379e+02 32.577  1.08980e+02 32.577  0.9865 
1 1 1 10  10  6  o 11 1.50107e+01 9.25729e-01 1.99470e+02 268.454 -3.07026e-01 -1.13731e+01 0.00000e+00 0.00000e+00 3.43965e+02 268.454 1.44495e+02 268.454 0.9550 
1 1 1 10  10  7  o 13 1.24294e+01 1.23917e+00 2.70244e+02 312.407 9.95553e+00  -1.09001e+01 0.00000e+00 0.00000e+00 1.84703e+02 312.407 8.55414e+01 132.407 0.9655 
1 1 1 10  10  8  o 19 1.76452e+01 1.15939e+00 3.32020e+02 9.840   3.20212e+01  5.55383e+00  0.00000e+00 0.00000e+00 3.26497e+02 9.840   5.52256e+00 189.840 0.9845 
1 1 1 10  10  9  o 19 7.92685e+00 1.86849e+00 2.56529e+02 170.411 -1.07031e+01 1.80820e+00  0.00000e+00 0.00000e+00 2.97325e+01 170.411 2.26796e+02 350.411 0.9528 
1 1 1 10  10  10 o 7  1.34979e+01 1.85895e+00 2.19529e+02 343.076 1.69319e+01  -5.15200e+00 0.00000e+00 0.00000e+00 2.77327e+02 343.076 5.77978e+01 343.076 0.9713 
1 1 1 10  10  11 o 17 9.56088e+00 2.40513e+00 1.33272e+02 126.418 -3.84902e+00 5.21718e+00  0.00000e+00 0.00000e+00 1.99723e+02 126.418 6.64507e+01 126.418 0.9193 
1 1 1 10  10  12 o 4  6.54301e+00 1.70644e+00 1.15041e+02 35.201  5.17054e+00  3.64758e+00  0.00000e+00 0.00000e+00 1.12256e+02 35.201  2.78527e+00 215.201 0.9172 
1 1 1 10  10  13 o 16 9.45315e+00 2.08377e+00 2.20712e+02 187.945 -1.52085e+01 -2.12252e+00 0.00000e+00 0.00000e+00 1.25351e+02 187.945 9.53614e+01 7.945   0.9669 
1 1 1 10  11  0  o 13 8.18359e+00 9.55498e-01 2.04894e+02 5.799   3.56880e+00  3.62460e-01  0.00000e+00 0.00000e+00 5.70681e+01 5.799   1.47826e+02 185.799 0.8455 
1 1 1 10  11  1  o 18 3.29140e+01 7.95324e-01 6.32574e+02 63.646  2.04346e+01  4.12479e+01  0.00000e+00 0.00000e+00 6.00355e+02 63.646  3.22194e+01 243.646 0.9891 
1 1 1 10  11  2  o 3  1.79399e+01 7.13158e-01 3.33215e+02 334.951 1.32167e+01  -6.17679e+00 0.00000e+00 0.00000e+00 3.22706e+02 334.951 1.05089e+01 154.951 0.9651 
1 1 1 10  11  3  o 5  3.11918e+01 9.45512e-01 4.36209e+02 22.558  3.22077e+01  1.33790e+01  0.00000e+00 0.00000e+00 7.28703e+02 22.558  2.92494e+02 22.558  0.9856 
1 1 1 10  11  4  o 18 2.01990e+01 7.74921e-01 4.42089e+02 231.765 -1.65904e+01 -2.10559e+01 0.00000e+00 0.00000e+00 3.09059e+02 231.765 1.33030e+02 51.765  0.9812 
1 1 1 10  11  5  o 7  3.81683e+01 9.01679e-01 7.26874e+02 153.553 -7.79891e+01 3.87934e+01  0.00000e+00 0.00000e+00 7.11607e+02 153.553 1.52677e+01 333.553 0.9942 
1 1 1 10  11  6  o 15 2.20519e+01 8.38462e-01 4.84460e+02 314.464 2.87251e+01  -2.92678e+01 0.00000e+00 0.00000e+00 3.41240e+02 314.464 1.43220e+02 134.464 0.9877 
1 1 1 10  11  7  o 11 2.90667e+01 8.90639e-01 5.16598e+02 165.884 -6.67991e+01 1.67981e+01  0.00000e+00 0.00000e+00 5.77257e+02 165.884 6.06592e+01 165.884 0.9927 
1 1 1 10  11  8  o 6  1.28534e+01 1.26808e+00 1.99386e+02 333.124 1.23280e+01  -6.24780e+00 0.00000e+00 0.00000e+00 2.69874e+02 333.124 7.04879e+01 333.124 0.9631 
1 1 1 10  11  9  o 12 7.30472e+00 1.59504e+00 1.81068e+02 106.992 -2.28064e+00 7.46335e+00  0.00000e+00 0.00000e+00 7.73974e+01 106.992 1.03670e+02 286.992 0.9335 
1 1 1 10  11  10 o 5  1.10889e+01 2.06392e+00 2.53616e+02 150.590 -1.34075e+01 7.55779e+00  0.00000e+00 0.00000e+00 1.52716e+02 150.590 1.00900e+02 330.590 0.9669 
1 1 1 10  11  11 o 1  1.15496e+01 2.45673e+00 2.19303e+02 30.321  1.08584e+01  6.35045e+00  0.00000e+00 0.00000e+00 2.00502e+02 30.321  1.88017e+01 210.321 0.9594 
1 1 1 10  11  12 o 15 1.00557e+01 2.17752e+00 2.41764e+02 187.179 -1.56988e+01 -1.97740e+00 0.00000e+00 0.00000e+00 1.26860e+02 187.179 1.14904e+02 7.179   0.9679 
1 1 1 10  11  13 o 9  8.00894e+00 2.14440e+00 1.52168e+02 252.934 -2.54101e+00 -8.27708e+00 0.00000e+00 0.00000e+00 1.32974e+02 252.934 1.91938e+01 72.934  0.9403 
1 1 1 10  12  0  o 11 1.82791e+01 6.67523e-01 3.13041e+02 163.502 -1.19470e+01 3.53828e+00  0.00000e+00 0.00000e+00 3.50582e+02 163.502 3.75411e+01 163.502 0.9590 
1 1 1 10  12  1  o 16 2.24559e+01 7.03464e-01 4.26560e+02 255.179 -5.44190e+00 -2.05659e+01 0.00000e+00 0.00000e+00 4.03646e+02 255.179 2.29143e+01 75.179  0.9762 
1 1 1 10  12  2  o 1  2.19990e+01 7.16110e-01 4.64183e+02 157.970 -2.27887e+01 9.22129e+00  0.00000e+00 0.00000e+00 3.52084e+02 157.970 1.12098e+02 337.970 0.9794 
1 1 1 10  12  3  o 10 2.52014e+01 1.05914e+00 6.02909e+02 74.988  9.97021e+00  3.71771e+01  0.00000e+00 0.00000e+00 3.39557e+02 74.988  2.63353e+02 254.988 0.9869 
1 1 1 10  12  4  o 7  3.69704e+01 8.95353e-01 9.33605e+02 244.481 -4.40723e+01 -9.23226e+01 0.00000e+00 0.00000e+00 4.60710e+02 244.481 4.72895e+02 64.481  0.9951 
1 1 1 10  12  5  o 2  9.91322e+00 1.16070e+00 7.95249e+01 47.441  1.62033e+00  1.76464e+00  0.00000e+00 0.00000e+00 2.03482e+02 47.441  1.23957e+02 47.441  0.7532 
1 1 1 10  12  6  f 0  2.55017e+01 8.42304e-01 4.26636e+02 289.497 1.52999e+01  -4.32117e+01 0.00000e+00 0.00000e+00 5.29465e+02 289.497 1.02829e+02 289.497 0.9890 
1 1 1 10  12  7  f 0  1.27226e+01 1.11387e+00 1.11169e+02 161.493 -5.91466e+00 1.97981e+00  0.00000e+00 0.00000e+00 3.30551e+02 161.493 2.19382e+02 161.493 0.9159 
1 1 1 10  12  8  o 1  5.32673e+00 1.50455e+00 5.18678e+01 141.672 -1.09446e+00 8.65205e-01  0.00000e+00 0.00000e+00 6.30450e+01 141.672 1.11772e+01 141.672 0.5691 
1 1 1 10  12  9  o 18 1.32776e+01 1.55676e+00 3.01060e+02 29.007  2.08955e+01  1.15859e+01  0.00000e+00 0.00000e+00 1.91530e+02 29.007  1.09530e+02 209.007 0.9788 
1 1 1 10  12  10 o 14 6.30579e+00 2.29596e+00 1.04909e+02 47.955  2.26090e+00  2.50698e+00  0.00000e+00 0.00000e+00 9.44624e+01 47.955  1.04461e+01 227.955 0.8343 
1 1 1 10  12  11 o 14 6.04734e+00 1.94538e+00 8.65760e+01 235.493 -1.86781e+00 -2.71701e+00 0.00000e+00 0.00000e+00 1.03526e+02 235.493 1.69503e+01 235.493 0.8298 
1 1 1 10  12  12 o 14 4.37702e+00 1.47377e+00 5.01752e+01 311.858 1.39530e+00  -1.55740e+00 0.00000e+00 0.00000e+00 6.78849e+01 311.858 1.77097e+01 311.858 0.7122 
1 1 1 10  12  13 o 6  5.35268e+00 1.73890e+00 3.53100e+01 98.482  -2.51209e-01 1.68442e+00  0.00000e+00 0.00000e+00 9.48892e+01 98.482  5.95792e+01 98.482  0.6425 
1 1 1 10  13  0  o 4  2.01368e+01 7.77065e-01 2.72337e+02 157.535 -1.09471e+01 4.52662e+00  0.00000e+00 0.00000e+00 4.57043e+02 157.535 1.84706e+02 157.535 0.9568 
1 1 1 10  13  1  o 7  9.87118e+00 1.08577e+00 1.56291e+02 116.501 -1.48419e+00 2.97671e+00  0.00000e+00 0.00000e+00 1.54537e+02 116.501 1.75365e+00 296.501 0.8315 
1 1 1 10  13  2  o 17 6.75685e+00 1.09711e+00 1.10736e+02 319.549 1.32741e+00  -1.13174e+00 0.00000e+00 0.00000e+00 5.58968e+01 319.549 5.48395e+01 139.549 0.6510 
1 1 1 10  13  3  o 18 3.39277e+01 1.17627e+00 6.02491e+02 26.905  4.55676e+01  2.31229e+01  0.00000e+00 0.00000e+00 6.70439e+02 26.905  6.79480e+01 26.905  0.9902 
1 1 1 10  13  4  o 14 2.73465e+01 7.78861e-01 3.90931e+02 11.774  3.13166e+01  6.52743e+00  0.00000e+00 0.00000e+00 6.29137e+02 11.774  2.38206e+02 11.774  0.9842 
1 1 1 10  13  5  o 18 3.31286e+01 8.56653e-01 6.05519e+02 22.128  5.84513e+01  2.37684e+01  0.00000e+00 0.00000e+00 6.40181e+02 22.128  3.46623e+01 22.128  0.9920 
1 1 1 10  13  6  o 17 1.09811e+01 1.09322e+00 2.38222e+02 109.287 -3.50009e+00 1.00020e+01  0.00000e+00 0.00000e+00 1.57874e+02 109.287 8.03481e+01 289.287 0.9516 
1 1 1 10  13  7  o 4  9.52137e+00 1.48366e+00 1.39679e+02 160.151 -5.10028e+00 1.84112e+00  0.00000e+00 0.00000e+00 1.85993e+02 160.151 4.63140e+01 160.151 0.9023 
1 1 1 10  13  8  f 0  1.46577e+01 1.33705e+00 1.26567e+02 316.910 7.16046e+00  -6.69824e+00 0.00000e+00 0.00000e+00 3.99880e+02 316.910 2.73314e+02 316.910 0.9475 
1 1 1 10  13  9  o 10 8.56124e+00 1.76939e+00 2.62291e+02 141.113 -9.66605e+00 7.79599e+00  0.00000e+00 0.00000e+00 4.88269e+01 141.113 2.13464e+02 321.113 0.9589 
1 1 1 10  13  10 o 15 9.88838e+00 2.32167e+00 1.70977e+02 265.470 -6.73377e-01 -8.49941e+00 0.00000e+00 0.00000e+00 1.81012e+02 265.470 1.00351e+01 265.470 0.9394 
1 1 1 10  13  11 o 18 1.25728e+01 2.62080e+00 1.80590e+02 10.176  1.02846e+01  1.84599e+00  0.00000e+00 0.00000e+00 2.72321e+02 10.176  9.17308e+01 10.176  0.9509 
1 1 1 10  13  12 o 12 8.12935e+00 2.09203e+00 1.00421e+02 82.903  6.89417e-01  5.53703e+00  0.00000e+00 0.00000e+00 1.78301e+02 82.903  7.78802e+01 82.903  0.9053 
1 1 1 10  13  13 o 8  5.21188e+00 1.70365e+00 1.18131e+02 320.184 4.34980e+00  -3.62618e+00 0.00000e+00 0.00000e+00 6.07925e+01 320.184 5.73387e+01 140.184 0.9068 
1 1 1 10  14  0  o 15 2.23348e+01 6.86956e-01 3.47879e+02 89.462  1.62435e-01  1.72866e+01  0.00000e+00 0.00000e+00 4.72771e+02 89.462  1.24891e+02 89.462  0.9706 
1 1 1 10  14  1  o 9  2.31547e+01 8.00526e-01 4.34416e+02 298.833 1.06783e+01  -1.93970e+01 0.00000e+00 0.00000e+00 4.22393e+02 298.833 1.20234e+01 118.833 0.9772 
1 1 1 10  14  2  o 8  9.73995e+00 8.76000e-01 2.26342e+02 105.233 -1.37526e+00 5.05041e+00  0.00000e+00 0.00000e+00 1.05182e+02 105.233 1.21160e+02 285.233 0.8985 
1 1 1 10  14  3  o 14 3.68976e+01 1.22920e+00 6.84766e+02 214.699 -5.41810e+01 -3.75149e+01 0.00000e+00 0.00000e+00 7.02640e+02 214.699 1.78741e+01 214.699 0.9924 
1 1 1 10  14  4  o 7  7.78601e+00 1.13841e+00 1.40214e+02 244.581 -1.29011e+00 -2.71461e+00 0.00000e+00 0.00000e+00 9.89086e+01 244.581 4.13058e+01 64.581  0.8104 
1 1 1 10  14  5  o 15 1.34433e+01 9.37491e-01 1.93425e+02 331.894 7.38553e+00  -3.94453e+00 0.00000e+00 0.00000e+00 2.84633e+02 331.894 9.12088e+01 331.894 0.9382 
1 1 1 10  14  6  o 19 1.56036e+01 9.21324e-01 1.81443e+02 189.648 -1.15988e+01 -1.97180e+00 0.00000e+00 0.00000e+00 3.84284e+02 189.648 2.02841e+02 189.648 0.9565 
1 1 1 10  14  7  f 0  7.59408e+00 1.54755e+00 1.25027e+02 286.008 1.11837e+00  -3.89824e+00 0.00000e+00 0.00000e+00 1.24145e+02 286.008 8.82763e-01 106.008 0.8656 
1 1 1 10  14  8  o 11 3.95871e+00 1.28781e+00 1.46952e+02 156.407 -2.90842e+00 1.27025e+00  0.00000e+00 0.00000e+00 2.36059e+01 336.407 1.70557e+02 336.407 0.8221 
1 1 1 10  14  9  o 18 1.43032e+01 1.63813e+00 2.01617e+02 324.003 1.43686e+01  -1.04381e+01 0.00000e+00 0.00000e+00 3.24962e+02 324.003 1.23346e+02 324.003 0.9714 
1 1 1 10  14  10 o 7  4.36515e+00 1.94828e+00 4.51820e+01 204.616 -1.06609e+00 -4.88462e-01 0.00000e+00 0.00000e+00 3.82195e+01 204.616 6.96256e+00 24.616  0.5042 
1 1 1 10  14  11 o 17 7.81468e+00 2.03732e+00 9.70979e+01 235.947 -2.68489e+00 -3.97261e+00 0.00000e+00 0.00000e+00 1.65904e+02 235.947 6.88058e+01 235.947 0.8884 
1 1 1 10  14  12 o 14 7.97009e+00 2.03935e+00 1.96741e+02 24.900  1.00006e+01  4.64215e+00  0.00000e+00 0.00000e+00 9.10656e+01 24.900  1.05675e+02 204.900 0.9535 
1 1 1 10  14  13 o 9  6.24023e+00 1.88235e+00 1.01842e+02 44.483  3.73769e+00  3.67081e+00  0.00000e+00 0.00000e+00 1.10453e+02 44.483  8.61085e+00 44.483  0.8986 
1 1 1 10  15  0  o 5  2.33693e+01 6.92369e-01 4.56658e+02 172.519 -2.34971e+01 3.08570e+00  0.00000e+00 0.00000e+00 4.09076e+02 172.519 4.75826e+01 352.518 0.9787 
1 1 1 10  15  1  o 10 3.20328e+01 9.15666e-01 7.22850e+02 227.329 -3.77882e+01 -4.09926e+01 0.00000e+00 0.00000e+00 4.79219e+02 227.329 2.43632e+02 47.329  0.9910 
1 1 1 10  15  2  o 16 1.51181e+01 1.04045e+00 2.41134e+02 335.729 7.77057e+00  -3.50385e+00 0.00000e+00 0.00000e+00 2.96807e+02 335.729 5.56729e+01 335.729 0.9394 
1 1 1 10  15  3  o 13 2.95416e+01 1.03947e+00 5.56624e+02 76.572  1.01644e+01  4.25727e+01  0.00000e+00 0.00000e+00 5.49806e+02 76.572  6.81799e+00 256.572 0.9885 
1 1 1 10  15  4  f 0  3.35114e+01 8.28041e-01 5.28497e+02 32.786  4.22670e+01  2.72251e+01  0.00000e+00 0.00000e+00 7.28750e+02 32.786  2.00253e+02 32.786  0.9900 
1 1 1 10  15  5  o 4  4.59551e+01 1.00607e+00 7.32389e+02 222.666 -7.89317e+01 -7.27501e+01 0.00000e+00 0.00000e+00 1.00121e+03 222.666 2.68817e+02 222.666 0.9953 
1 1 1 10  15  6  o 13 3.14374e+01 8.76578e-01 4.74131e+02 56.278  3.45240e+01  5.17233e+01  0.00000e+00 0.00000e+00 7.07826e+02 56.278  2.33695e+02 56.278  0.9919 
1 1 1 10  15  7  o 1  1.40120e+01 1.19122e+00 2.15852e+02 212.526 -1.18079e+01 -7.53009e+00 0.00000e+00 0.00000e+00 2.95922e+02 212.526 8.00705e+01 212.526 0.9636 
1 1 1 10  15  8  o 9  8.79416e+00 1.66905e+00 2.04218e+02 68.527  3.20900e+00  8.15783e+00  0.00000e+00 0.00000e+00 1.09462e+02 68.527  9.47558e+01 248.527 0.9411 
1 1 1 10  15  9  o 5  1.18983e+01 1.91885e+00 3.74111e+02 205.463 -2.21473e+01 -1.05462e+01 0.00000e+00 0.00000e+00 6.75109e+01 205.463 3.06600e+02 25.463  0.9794 
1 1 1 10  15  10 o 6  1.09116e+01 2.18449e+00 2.43072e+02 223.421 -1.03929e+01 -9.83516e+00 0.00000e+00 0.00000e+00 1.55650e+02 223.421 8.74216e+01 43.421  0.9644 
1 1 1 10  15  11 o 8  7.37199e+00 1.98611e+00 7.96684e+01 228.137 -2.53808e+00 -2.83246e+00 0.00000e+00 0.00000e+00 1.59240e+02 228.137 7.95716e+01 228.137 0.8555 
1 1 1 10  15  12 o 16 9.57336e+00 1.85504e+00 1.98119e+02 94.982  -1.28025e+00 1.46853e+01  0.00000e+00 0.00000e+00 1.51901e+02 94.982  4.62185e+01 274.982 0.9655 
1 1 1 10  15  13 o 17 1.24626e+01 2.28648e+00 2.88564e+02 253.741 -6.57074e+00 -2.25302e+01 0.00000e+00 0.00000e+00 1.73057e+02 253.741 1.15507e+02 73.741  0.9785 
1 1 1 10  16  0  o 8  2.55399e+01 7.07711e-01 4.84818e+02 320.152 2.10569e+01  -1.75736e+01 0.00000e+00 0.00000e+00 4.64120e+02 320.152 2.06977e+01 140.152 0.9816 
1 1 1 10  16  1  o 3  3.15270e+01 9.08653e-01 6.46738e+02 358.886 4.90221e+01  -9.53085e-01 0.00000e+00 0.00000e+00 5.34819e+02 358.886 1.11919e+02 178.886 0.9897 
1 1 1 10  16  2  o 1  2.61466e+01 7.19445e-01 5.00126e+02 137.775 -2.58743e+01 2.34820e+01  0.00000e+00 0.00000e+00 4.75968e+02 137.775 2.41584e+01 317.775 0.9856 
1 1 1 10  16  3  o 1  1.59331e+01 1.08471e+00 1.76601e+02 98.221  -1.06450e+00 7.36789e+00  0.00000e+00 0.00000e+00 3.84911e+02 98.221  2.08310e+02 98.221  0.9302 
1 1 1 10  16  4  o 1  3.63910e+01 8.63788e-01 6.64712e+02 259.707 -1.22084e+01 -6.72219e+01 0.00000e+00 0.00000e+00 7.04167e+02 259.707 3.94546e+01 259.707 0.9927 
1 1 1 10  16  5  o 1  8.13265e+00 1.32727e+00 1.49606e+02 63.744  1.63982e+00  3.32434e+00  0.00000e+00 0.00000e+00 1.12756e+02 63.744  3.68493e+01 243.744 0.8512 
1 1 1 10  16  6  o 8  1.47571e+01 9.58009e-01 2.27159e+02 226.006 -9.58593e+00 -9.92853e+00 0.00000e+00 0.00000e+00 3.11499e+02 226.006 8.43393e+01 226.006 0.9631 
1 1 1 10  16  7  f 0  1.58797e+01 1.12277e+00 1.78931e+02 0.568   1.33184e+01  1.32079e-01  0.00000e+00 0.00000e+00 3.99884e+02 0.568   2.20953e+02 0.568   0.9617 
1 1 1 10  16  8  o 7  1.57982e+01 1.17202e+00 2.83146e+02 113.328 -9.93330e+00 2.30333e+01  0.00000e+00 0.00000e+00 3.03541e+02 113.328 2.03953e+01 113.328 0.9799 
1 1 1 10  16  9  o 8  2.37404e+01 1.47134e+00 4.39828e+02 274.398 5.23723e+00  -6.80922e+01 0.00000e+00 0.00000e+00 4.53212e+02 274.398 1.33844e+01 274.398 0.9927 
1 1 1 10  16  10 o 14 1.81380e+01 1.77913e+00 1.72689e+02 191.741 -1.97856e+01 -4.11237e+00 0.00000e+00 0.00000e+00 4.97310e+02 191.741 3.24621e+02 191.741 0.9749 
1 1 1 10  16  11 o 3  4.90253e+00 1.55240e+00 1.13674e+02 18.192  4.22062e+00  1.38700e+00  0.00000e+00 0.00000e+00 4.94910e+01 18.192  6.41829e+01 198.192 0.8786 
1 1 1 10  16  12 o 15 4.70498e+00 1.54690e+00 1.05942e+02 274.665 3.81982e-01  -4.68096e+00 0.00000e+00 0.00000e+00 5.18860e+01 274.665 5.40563e+01 94.665  0.8858 
1 1 1 10  16  13 o 9  4.57263e+00 1.55492e+00 9.78219e+01 181.324 -4.46802e+00 -1.03241e-01 0.00000e+00 0.00000e+00 5.44011e+01 181.324 4.34207e+01 1.324   0.8794 
1 1 1 10  17  0  o 1  2.56001e+01 7.14093e-01 4.80636e+02 250.527 -1.00291e+01 -2.83641e+01 0.00000e+00 0.00000e+00 4.72084e+02 250.527 8.55188e+00 70.527  0.9832 
1 1 1 10  17  1  o 12 4.37060e+01 1.02943e+00 8.51871e+02 123.149 -4.77862e+01 7.31671e+01  0.00000e+00 0.00000e+00 7.93518e+02 123.149 5.83534e+01 303.149 0.9943 
1 1 1 10  17  2  o 9  2.64824e+01 7.18075e-01 5.73860e+02 322.722 3.22633e+01  -2.45586e+01 0.00000e+00 0.00000e+00 4.16735e+02 322.722 1.57125e+02 142.722 0.9876 
1 1 1 10  17  3  o 19 1.91664e+01 9.55752e-01 4.08255e+02 6.688   2.13257e+01  2.50080e+00  0.00000e+00 0.00000e+00 3.00755e+02 6.688   1.07500e+02 186.688 0.9764 
1 1 1 10  17  4  o 16 2.18741e+01 7.56824e-01 2.55528e+02 29.344  1.56051e+01  8.77286e+00  0.00000e+00 0.00000e+00 5.49844e+02 29.344  2.94315e+02 29.344  0.9717 
1 1 1 10  17  5  o 4  2.63285e+01 9.39916e-01 4.45209e+02 142.185 -3.20679e+01 2.48875e+01  0.00000e+00 0.00000e+00 5.40203e+02 142.185 9.49937e+01 142.185 0.9876 
1 1 1 10  17  6  o 10 1.40686e+01 9.74015e-01 2.52364e+02 265.025 -1.26235e+00 -1.45027e+01 0.00000e+00 0.00000e+00 2.62180e+02 265.025 9.81597e+00 265.025 0.9650 
1 1 1 10  17  7  o 3  1.47431e+01 1.22116e+00 1.88577e+02 249.427 -4.78997e+00 -1.27620e+01 0.00000e+00 0.00000e+00 3.49285e+02 249.427 1.60709e+02 249.427 0.9626 
1 1 1 10  17  8  o 11 8.30435e+00 1.65438e+00 1.18563e+02 155.169 -4.70728e+00 2.17819e+00  0.00000e+00 0.00000e+00 1.63910e+02 155.169 4.53478e+01 155.169 0.8975 
1 1 1 10  17  9  o 1  2.03930e+01 1.56875e+00 2.80207e+02 237.809 -1.84113e+01 -2.92471e+01 0.00000e+00 0.00000e+00 4.81292e+02 237.809 2.01085e+02 237.809 0.9854 
1 1 1 10  17  10 o 10 4.38136e+00 1.97811e+00 1.46572e+02 358.079 3.79240e+00  -1.27198e-01 0.00000e+00 0.00000e+00 4.62456e+00 178.079 1.51197e+02 178.079 0.8551 
1 1 1 10  17  11 o 5  6.93231e+00 1.93948e+00 9.54012e+01 168.040 -4.40712e+00 9.33505e-01  0.00000e+00 0.00000e+00 1.35795e+02 168.040 4.03934e+01 168.040 0.8805 
1 1 1 10  17  12 o 18 5.67113e+00 1.76928e+00 1.39852e+02 34.972  5.40962e+00  3.78394e+00  0.00000e+00 0.00000e+00 5.78854e+01 34.972  8.19662e+01 214.972 0.9208 
1 1 1 10  17  13 o 18 8.69504e+00 2.20591e+00 2.20824e+02 205.532 -1.18643e+01 -5.66705e+00 0.00000e+00 0.00000e+00 9.55331e+01 205.532 1.25291e+02 25.532  0.9612 
1 1 1 10  18  0  o 1  3.61134e+01 9.55276e-01 7.13909e+02 305.600 3.59485e+01  -5.02128e+01 0.00000e+00 0.00000e+00 6.41804e+02 305.600 7.21046e+01 125.600 0.9919 
1 1 1 10  18  1  o 6  2.21816e+01 7.68216e-01 3.75993e+02 302.932 1.08521e+01  -1.67539e+01 0.00000e+00 0.00000e+00 4.42538e+02 302.932 6.65447e+01 302.932 0.9746 
1 1 1 10  18  2  o 14 1.67302e+01 7.03013e-01 4.00144e+02 270.996 3.04114e-01  -1.74877e+01 0.00000e+00 0.00000e+00 2.15106e+02 270.996 1.85038e+02 90.996  0.9710 
1 1 1 10  18  3  o 5  2.29314e+01 7.67722e-01 4.05099e+02 336.606 2.37563e+01  -1.02772e+01 0.00000e+00 0.00000e+00 4.46671e+02 336.606 4.15719e+01 336.606 0.9805 
1 1 1 10  18  4  o 4  6.21571e+00 1.24127e+00 1.29620e+02 46.519  1.67407e+00  1.76527e+00  0.00000e+00 0.00000e+00 4.87814e+01 46.519  8.08390e+01 226.519 0.7575 
1 1 1 10  18  5  o 13 8.00653e+00 1.53110e+00 8.60591e+01 327.056 1.82404e+00  -1.18202e+00 0.00000e+00 0.00000e+00 1.33705e+02 327.056 4.76460e+01 327.056 0.7243 
1 1 1 10  18  6  o 3  1.67045e+01 1.01489e+00 3.21983e+02 18.548  2.13953e+01  7.17862e+00  0.00000e+00 0.00000e+00 2.96895e+02 18.548  2.50885e+01 198.548 0.9776 
1 1 1 10  18  7  o 2  1.06513e+01 1.34104e+00 2.02684e+02 218.788 -8.00957e+00 -6.43718e+00 0.00000e+00 0.00000e+00 1.80807e+02 218.788 2.18771e+01 38.788  0.9500 
1 1 1 10  18  8  o 18 2.17846e+01 1.25923e+00 4.18409e+02 79.102  1.02426e+01  5.32008e+01  0.00000e+00 0.00000e+00 3.99491e+02 79.102  1.89180e+01 259.102 0.9907 
1 1 1 10  18  9  o 9  1.13017e+01 1.98000e+00 1.80962e+02 30.151  9.15414e+00  5.31738e+00  0.00000e+00 0.00000e+00 2.26522e+02 30.151  4.55597e+01 30.151  0.9515 
1 1 1 10  18  10 o 11 2.31098e+01 1.57840e+00 3.98214e+02 141.479 -5.06526e+01 4.03211e+01  0.00000e+00 0.00000e+00 4.70514e+02 141.479 7.23000e+01 141.479 0.9922 
1 1 1 10  18  11 o 4  7.64724e+00 1.95076e+00 7.61050e+01 109.596 -1.32130e+00 3.71143e+00  0.00000e+00 0.00000e+00 1.73327e+02 109.596 9.72223e+01 109.596 0.8612 
1 1 1 10  18  12 o 4  5.22630e+00 1.63068e+00 2.72322e+01 321.393 9.99588e-01  -7.98166e-01 0.00000e+00 0.00000e+00 7.89601e+01 321.393 5.17280e+01 321.393 0.5366 
1 1 1 10  18  13 o 15 5.56257e+00 1.75258e+00 1.38169e+02 52.317  4.19029e+00  5.42493e+00  0.00000e+00 0.00000e+00 5.63519e+01 52.317  8.18166e+01 232.317 0.9239 
1 1 1 10  19  0  o 5  1.11963e+01 7.43056e-01 2.96175e+02 18.023  7.57013e+00  2.46307e+00  0.00000e+00 0.00000e+00 9.99795e+01 18.023  1.96195e+02 198.023 0.9349 
1 1 1 10  19  1  o 2  5.90725e+00 1.10554e+00 8.70816e+01 32.762  1.00494e+00  6.46707e-01  0.00000e+00 0.00000e+00 2.72586e+01 32.762  5.98231e+01 212.762 0.5112 
1 1 1 10  19  2  o 1  6.42815e+00 1.06862e+00 1.24849e+02 152.185 -1.79474e+00 9.46846e-01  0.00000e+00 0.00000e+00 4.61751e+01 152.185 7.86740e+01 332.185 0.7025 
1 1 1 10  19  3  o 1  1.99323e+01 7.35873e-01 4.22712e+02 149.360 -2.02148e+01 1.19741e+01  0.00000e+00 0.00000e+00 3.16108e+02 149.360 1.06604e+02 329.360 0.9785 
1 1 1 10  19  4  o 12 1.27859e+01 8.96103e-01 2.20167e+02 339.619 8.05272e+00  -2.99180e+00 0.00000e+00 0.00000e+00 2.35140e+02 339.619 1.49727e+01 339.619 0.9399 
1 1 1 10  19  5  o 12 1.07748e+01 1.35527e+00 2.29612e+02 129.791 -5.02492e+00 6.03304e+00  0.00000e+00 0.00000e+00 1.51718e+02 129.791 7.78935e+01 309.791 0.9340 
1 1 1 10  19  6  o 10 1.17633e+01 1.01693e+00 3.56016e+02 70.489  5.85742e+00  1.65309e+01  0.00000e+00 0.00000e+00 7.68670e+01 70.489  2.79149e+02 250.489 0.9711 
1 1 1 10  19  7  o 3  1.80143e+01 1.10438e+00 3.70722e+02 118.322 -1.73761e+01 3.22414e+01  0.00000e+00 0.00000e+00 3.02568e+02 118.322 6.81547e+01 298.322 0.9863 
1 1 1 10  19  8  o 6  1.31592e+01 1.52106e+00 2.74098e+02 260.472 -3.36970e+00 -2.00755e+01 0.00000e+00 0.00000e+00 2.12151e+02 260.472 6.19470e+01 80.472  0.9751 
1 1 1 10  19  9  o 6  1.58283e+01 1.59988e+00 2.52584e+02 71.908  7.91633e+00  2.42319e+01  0.00000e+00 0.00000e+00 3.35265e+02 71.908  8.26818e+01 71.908  0.9802 
1 1 1 10  19  10 o 2  4.65026e+00 2.00432e+00 6.91309e+01 172.069 -1.86004e+00 2.59137e-01  0.00000e+00 0.00000e+00 5.00787e+01 172.069 1.90522e+01 352.069 0.6767 
1 1 1 10  19  11 o 17 1.62684e+01 1.81034e+00 2.81165e+02 250.277 -1.15847e+01 -3.23135e+01 0.00000e+00 0.00000e+00 3.25945e+02 250.277 4.47793e+01 250.277 0.9853 
1 1 1 10  19  12 o 9  8.33356e+00 1.93036e+00 2.10882e+02 324.900 1.06338e+01  -7.47361e+00 0.00000e+00 0.00000e+00 9.22577e+01 324.900 1.18624e+02 144.900 0.9607 
1 1 1 10  19  13 o 12 9.84378e+00 2.22148e+00 1.96201e+02 125.501 -7.61439e+00 1.06745e+01  0.00000e+00 0.00000e+00 1.61875e+02 125.501 3.43262e+01 305.501 0.9611 
1 1 1 10  20  0  o 16 2.07546e+01 6.60280e-01 4.96220e+02 320.993 1.92800e+01  -1.56166e+01 0.00000e+00 0.00000e+00 2.73225e+02 320.993 2.22995e+02 140.993 0.9796 
1 1 1 10  20  1  o 2  2.61522e+01 7.04758e-01 5.84983e+02 132.367 -2.75563e+01 3.02133e+01  0.00000e+00 0.00000e+00 3.92911e+02 132.367 1.92072e+02 312.367 0.9877 
1 1 1 10  20  2  o 14 5.72121e+00 1.15171e+00 2.72253e+02 79.093  7.75422e-01  4.02391e+00  0.00000e+00 0.00000e+00 8.43659e+01 259.093 3.56619e+02 259.093 0.8672 
1 1 1 10  20  3  o 17 3.56378e+01 8.33632e-01 5.78695e+02 326.407 5.12295e+01  -3.40276e+01 0.00000e+00 0.00000e+00 7.60230e+02 326.407 1.81535e+02 326.407 0.9918 
1 1 1 10  20  4  o 18 1.37608e+01 8.69449e-01 1.56966e+02 247.356 -2.53963e+00 -6.08803e+00 0.00000e+00 0.00000e+00 3.23059e+02 247.356 1.66093e+02 247.356 0.9207 
1 1 1 10  20  5  o 1  3.04622e+01 1.00722e+00 5.95152e+02 20.985  5.64200e+01  2.16411e+01  0.00000e+00 0.00000e+00 5.49517e+02 20.985  4.56347e+01 200.985 0.9917 
1 1 1 10  20  6  o 12 2.35992e+01 8.40545e-01 3.83336e+02 113.647 -1.63180e+01 3.72676e+01  0.00000e+00 0.00000e+00 4.99875e+02 113.647 1.16539e+02 113.647 0.9876 
1 1 1 10  20  7  o 3  1.49172e+01 1.20347e+00 2.56424e+02 257.314 -4.49285e+00 -1.99584e+01 0.00000e+00 0.00000e+00 2.94861e+02 257.314 3.84370e+01 257.314 0.9752 
1 1 1 10  20  8  o 17 1.37853e+01 1.52693e+00 1.79051e+02 110.331 -4.82495e+00 1.30222e+01  0.00000e+00 0.00000e+00 3.24131e+02 110.331 1.45080e+02 110.331 0.9633 
1 1 1 10  20  9  o 3  6.13254e+00 2.28735e+00 6.38338e+01 293.944 7.65129e-01  -1.72306e+00 0.00000e+00 0.00000e+00 9.37006e+01 293.944 2.98668e+01 293.944 0.6780 
1 1 1 10  20  10 o 11 9.53373e+00 2.30959e+00 1.45935e+02 32.622  6.29852e+00  4.03146e+00  0.00000e+00 0.00000e+00 1.90119e+02 32.622  4.41840e+01 32.622  0.9305 
1 1 1 10  20  11 o 6  1.24414e+01 1.79233e+00 2.79229e+02 325.842 2.17632e+01  -1.47670e+01 0.00000e+00 0.00000e+00 1.82904e+02 325.842 9.63251e+01 145.842 0.9808 
1 1 1 10  20  12 o 1  6.12861e+00 1.75234e+00 1.44298e+02 155.802 -6.56467e+00 2.94994e+00  0.00000e+00 0.00000e+00 7.09525e+01 155.802 7.33454e+01 335.802 0.9277 
1 1 1 10  20  13 o 17 5.64028e+00 1.74633e+00 5.10393e+01 160.992 -2.43677e+00 8.39446e-01  0.00000e+00 0.00000e+00 1.14004e+02 160.992 6.29644e+01 160.992 0.7732 
1 1 1 10  21  0  o 17 1.70684e+01 6.59802e-01 4.48831e+02 197.729 -1.75481e+01 -5.61021e+00 0.00000e+00 0.00000e+00 1.79289e+02 197.729 2.69541e+02 17.729  0.9725 
1 1 1 10  21  1  o 16 1.97465e+01 8.25672e-01 4.53799e+02 56.900  1.29339e+01  1.98402e+01  0.00000e+00 0.00000e+00 2.77773e+02 56.900  1.76025e+02 236.900 0.9787 
1 1 1 10  21  2  o 12 1.58186e+01 7.13361e-01 2.24469e+02 293.268 3.84030e+00  -8.93098e+00 0.00000e+00 0.00000e+00 3.42849e+02 293.268 1.18380e+02 293.268 0.9471 
1 1 1 10  21  3  o 7  2.57105e+01 7.48128e-01 3.48295e+02 328.766 2.29531e+01  -1.39193e+01 0.00000e+00 0.00000e+00 6.07239e+02 328.766 2.58943e+02 328.766 0.9812 
1 1 1 10  21  4  o 17 3.25955e+01 8.31677e-01 5.23904e+02 205.178 -4.88762e+01 -2.29764e+01 0.00000e+00 0.00000e+00 6.99476e+02 205.178 1.75571e+02 205.178 0.9907 
1 1 1 10  21  5  o 17 2.51177e+01 1.29230e+00 4.37934e+02 245.852 -1.43784e+01 -3.20718e+01 0.00000e+00 0.00000e+00 5.00124e+02 245.852 6.21905e+01 245.852 0.9857 
1 1 1 10  21  6  o 11 1.61308e+01 1.08299e+00 3.44666e+02 180.185 -2.39965e+01 -7.72856e-02 0.00000e+00 0.00000e+00 2.53687e+02 180.185 9.09791e+01 0.185   0.9789 
1 1 1 10  21  7  o 17 1.85610e+01 1.07528e+00 3.02275e+02 289.439 9.92111e+00  -2.81105e+01 0.00000e+00 0.00000e+00 3.89142e+02 289.439 8.68674e+01 289.439 0.9831 
1 1 1 10  21  8  o 15 1.58590e+01 1.15548e+00 2.78366e+02 111.945 -1.08959e+01 2.70424e+01  0.00000e+00 0.00000e+00 3.12137e+02 111.945 3.37707e+01 111.945 0.9827 
1 1 1 10  21  9  o 14 2.21783e+01 1.49670e+00 4.31571e+02 22.448  5.92080e+01  2.44618e+01  0.00000e+00 0.00000e+00 4.02084e+02 22.448  2.94866e+01 202.448 0.9922 
1 1 1 10  21  10 o 12 4.54064e+00 1.96725e+00 9.47341e+01 276.373 3.01376e-01  -2.69810e+00 0.00000e+00 0.00000e+00 4.05362e+01 276.373 5.41979e+01 96.373  0.7865 
1 1 1 10  21  11 o 1  1.07678e+01 1.86723e+00 8.99063e+01 119.139 -3.52273e+00 6.31895e+00  0.00000e+00 0.00000e+00 2.88534e+02 119.139 1.98627e+02 119.139 0.9281 
1 1 1 10  21  12 o 2  5.20487e+00 1.66061e+00 9.04727e+01 178.927 -4.11738e+00 7.71086e-02  0.00000e+00 0.00000e+00 8.05491e+01 178.927 9.92361e+00 358.927 0.8679 
1 1 1 10  21  13 o 5  7.82060e+00 2.12082e+00 1.91955e+02 222.807 -8.07407e+00 -7.47850e+00 0.00000e+00 0.00000e+00 9.02306e+01 222.807 1.01724e+02 42.807  0.9534 
1 1 1 10  22  0  o 11 1.48633e+01 6.84394e-01 3.38433e+02 334.561 1.21489e+01  -5.77896e+00 0.00000e+00 0.00000e+00 2.02668e+02 334.561 1.35764e+02 154.561 0.9621 
1 1 1 10  22  1  o 16 2.96239e+01 7.34791e-01 5.23923e+02 191.849 -3.95494e+01 -8.29766e+00 0.00000e+00 0.00000e+00 5.83495e+02 191.849 5.95716e+01 191.849 0.9875 
1 1 1 10  22  2  o 19 3.25255e+01 7.81428e-01 6.48855e+02 27.685  5.20958e+01  2.73330e+01  0.00000e+00 0.00000e+00 5.72232e+02 27.685  7.66231e+01 207.685 0.9915 
1 1 1 10  22  3  o 19 1.87448e+01 7.35156e-01 3.61743e+02 214.421 -1.60020e+01 -1.09654e+01 0.00000e+00 0.00000e+00 3.29669e+02 214.421 3.20740e+01 34.421  0.9739 
1 1 1 10  22  4  o 2  4.26903e+01 9.45157e-01 7.07658e+02 214.575 -7.75327e+01 -5.34361e+01 0.00000e+00 0.00000e+00 9.00941e+02 214.575 1.93283e+02 214.575 0.9947 
1 1 1 10  22  5  o 17 1.17119e+01 1.03602e+00 3.15705e+02 209.291 -1.20642e+01 -6.76759e+00 0.00000e+00 0.00000e+00 1.11675e+02 209.291 2.04030e+02 29.291  0.9631 
1 1 1 10  22  6  o 5  1.68161e+01 1.09251e+00 3.00602e+02 353.024 2.27474e+01  -2.78318e+00 0.00000e+00 0.00000e+00 3.22494e+02 353.024 2.18921e+01 353.024 0.9779 
1 1 1 10  22  7  o 3  1.04530e+01 1.37989e+00 3.13421e+02 38.501  1.26437e+01  1.00578e+01  0.00000e+00 0.00000e+00 7.01824e+01 38.501  2.43238e+02 218.501 0.9685 
1 1 1 10  22  8  o 2  6.97288e+00 2.21379e+00 1.90996e+02 23.497  5.57130e+00  2.42212e+00  0.00000e+00 0.00000e+00 5.03419e+01 23.497  1.40654e+02 203.497 0.9135 
1 1 1 10  22  9  o 15 9.83602e+00 2.14277e+00 1.72852e+02 204.594 -7.96308e+00 -3.64477e+00 0.00000e+00 0.00000e+00 1.77803e+02 204.594 4.95172e+00 204.594 0.9410 
1 1 1 10  22  10 o 1  1.28761e+01 1.44154e+00 2.19703e+02 332.391 1.98778e+01  -1.03957e+01 0.00000e+00 0.00000e+00 2.57003e+02 332.391 3.73003e+01 332.391 0.9775 
1 1 1 10  22  11 o 1  6.77430e+00 1.77391e+00 9.10682e+01 102.840 -1.07564e+00 4.71906e+00  0.00000e+00 0.00000e+00 1.37122e+02 102.840 4.60542e+01 102.840 0.8895 
1 1 1 10  22  12 o 18 7.03198e+00 1.87839e+00 1.56050e+02 280.831 1.59824e+00  -8.35406e+00 0.00000e+00 0.00000e+00 9.39784e+01 280.831 6.20719e+01 100.831 0.9392 
1 1 1 10  22  13 o 14 6.43177e+00 1.98731e+00 1.14042e+02 243.014 -2.63979e+00 -5.18408e+00 0.00000e+00 0.00000e+00 1.07308e+02 243.014 6.73393e+00 63.014  0.9094 
1 1 1 10  23  0  o 4  4.84141e+00 1.11627e+00 1.67735e+02 2.934   2.04182e+00  1.04634e-01  0.00000e+00 0.00000e+00 3.85981e+01 182.934 2.06333e+02 182.934 0.7049 
1 1 1 10  23  1  o 10 1.31398e+01 7.23668e-01 3.26861e+02 227.609 -7.53368e+00 -8.25305e+00 0.00000e+00 0.00000e+00 1.47698e+02 227.609 1.79164e+02 47.609  0.9541 
1 1 1 10  23  2  o 17 1.79966e+01 7.70276e-01 2.16249e+02 45.397  7.60831e+00  7.71440e+00  0.00000e+00 0.00000e+00 4.32914e+02 45.397  2.16665e+02 45.397  0.9527 
1 1 1 10  23  3  o 15 2.50165e+01 7.76131e-01 6.12353e+02 225.846 -3.03449e+01 -3.12548e+01 0.00000e+00 0.00000e+00 3.24155e+02 225.846 2.88197e+02 45.846  0.9885 
1 1 1 10  23  4  o 2  2.05099e+01 8.12545e-01 4.19679e+02 181.601 -2.80604e+01 -7.84303e-01 0.00000e+00 0.00000e+00 3.43269e+02 181.601 7.64104e+01 1.601   0.9820 
1 1 1 10  23  5  o 14 8.70374e+00 1.28748e+00 1.30391e+02 59.666  2.24482e+00  3.83627e+00  0.00000e+00 0.00000e+00 1.59347e+02 59.666  2.89553e+01 59.666  0.8787 
1 1 1 10  23  6  o 16 5.63267e+00 1.46504e+00 2.66809e+01 67.794  2.37659e-01  5.82189e-01  0.00000e+00 0.00000e+00 3.73056e+01 67.794  1.06247e+01 67.794  0.2998 
1 1 1 10  23  7  o 19 1.81681e+01 1.07824e+00 3.28394e+02 336.981 2.93112e+01  -1.24530e+01 0.00000e+00 0.00000e+00 3.49059e+02 336.981 2.06643e+01 336.981 0.9842 
1 1 1 10  23  8  o 19 8.40158e+00 2.13915e+00 2.01367e+02 78.490  1.59039e+00  7.81024e+00  0.00000e+00 0.00000e+00 9.62369e+01 78.490  1.05130e+02 258.490 0.9350 
1 1 1 10  23  9  o 4  1.50961e+01 1.63326e+00 2.47975e+02 324.490 2.00540e+01  -1.43096e+01 0.00000e+00 0.00000e+00 3.12152e+02 324.490 6.41765e+01 324.490 0.9795 
1 1 1 10  23  10 o 14 4.34316e+00 1.38460e+00 1.07443e+02 89.646  2.33786e-02  3.78755e+00  0.00000e+00 0.00000e+00 3.31713e+01 89.646  7.42720e+01 269.646 0.8548 
1 1 1 10  23  11 o 6  1.03851e+01 2.06294e+00 8.07900e+01 50.968  3.55536e+00  4.38551e+00  0.00000e+00 0.00000e+00 2.75667e+02 50.968  1.94877e+02 50.968  0.9065 
1 1 1 10  23  12 o 8  1.05031e+01 1.96342e+00 2.14199e+02 193.492 -1.66758e+01 -4.00110e+00 0.00000e+00 0.00000e+00 1.71615e+02 193.492 4.25838e+01 13.492  0.9704 
1 1 1 10  23  13 o 7  6.06168e+00 1.73735e+00 8.89668e+01 330.165 4.14128e+00  -2.37506e+00 0.00000e+00 0.00000e+00 1.14688e+02 330.165 2.57212e+01 330.165 0.8879 
1 1 1 10  24  0  o 8  2.72241e+01 7.04310e-01 3.99708e+02 2.696   2.83335e+01  1.33404e+00  0.00000e+00 0.00000e+00 6.11993e+02 2.696   2.12285e+02 2.696   0.9822 
1 1 1 10  24  1  o 7  2.28428e+01 6.89228e-01 4.02270e+02 103.369 -5.82547e+00 2.45123e+01  0.00000e+00 0.00000e+00 4.44976e+02 103.369 4.27067e+01 103.369 0.9799 
1 1 1 10  24  2  o 10 1.60030e+01 7.22953e-01 3.41146e+02 346.080 1.59752e+01  -3.95944e+00 0.00000e+00 0.00000e+00 2.46038e+02 346.080 9.51085e+01 166.080 0.9691 
1 1 1 10  24  3  o 12 8.26599e+00 1.08968e+00 1.62390e+02 213.424 -3.45365e+00 -2.27934e+00 0.00000e+00 0.00000e+00 1.09521e+02 213.424 5.28689e+01 33.424  0.8686 
1 1 1 10  24  4  o 12 2.19248e+01 7.95915e-01 4.19139e+02 33.484  2.49762e+01  1.65217e+01  0.00000e+00 0.00000e+00 3.97333e+02 33.484  2.18065e+01 213.484 0.9832 
1 1 1 10  24  5  f 0  1.55695e+01 8.80279e-01 3.28582e+02 197.915 -2.03504e+01 -6.57878e+00 0.00000e+00 0.00000e+00 2.47271e+02 197.915 8.13108e+01 17.915  0.9763 
1 1 1 10  24  6  f 0  1.51871e+01 1.10459e+00 1.59356e+02 99.301  -1.72922e+00 1.05590e+01  0.00000e+00 0.00000e+00 3.88421e+02 99.301  2.29065e+02 99.301  0.9521 
1 1 1 10  24  7  o 1  1.34593e+01 1.28222e+00 2.16259e+02 243.082 -6.69652e+00 -1.31893e+01 0.00000e+00 0.00000e+00 2.76098e+02 243.082 5.98384e+01 243.082 0.9656 
1 1 1 10  24  8  o 1  7.27861e+00 2.24929e+00 7.13957e+01 241.540 -1.11741e+00 -2.06141e+00 0.00000e+00 0.00000e+00 1.34580e+02 241.540 6.31846e+01 241.540 0.7470 
1 1 1 10  24  9  o 1  1.58911e+01 1.61610e+00 2.78903e+02 225.658 -2.04989e+01 -2.09752e+01 0.00000e+00 0.00000e+00 3.12676e+02 225.658 3.37733e+01 225.658 0.9828 
1 1 1 10  24  10 o 2  4.96618e+00 1.44032e+00 5.71208e+01 235.265 -1.32557e+00 -1.91185e+00 0.00000e+00 0.00000e+00 8.29460e+01 235.265 2.58252e+01 235.265 0.7447 
1 1 1 10  24  11 o 8  9.62340e+00 1.84973e+00 1.61944e+02 331.277 1.02849e+01  -5.63606e+00 0.00000e+00 0.00000e+00 1.86527e+02 331.277 2.45828e+01 331.277 0.9564 
1 1 1 10  24  12 o 16 5.70000e+00 1.74029e+00 1.80742e+02 331.608 7.83951e+00  -4.23745e+00 0.00000e+00 0.00000e+00 2.25195e+01 331.608 1.58223e+02 151.608 0.9421 
1 1 1 10  24  13 o 14 1.09837e+01 2.22049e+00 2.09111e+02 110.070 -5.28230e+00 1.44579e+01  0.00000e+00 0.00000e+00 1.92754e+02 110.070 1.63566e+01 290.070 0.9670 
1 1 1 10  25  0  o 5  1.10876e+01 7.84628e-01 1.53003e+02 310.940 3.02787e+00  -3.49054e+00 0.00000e+00 0.00000e+00 2.17718e+02 310.940 6.47146e+01 310.940 0.8838 
1 1 1 10  25  1  o 4  1.85261e+01 6.81332e-01 3.82361e+02 135.811 -1.42613e+01 1.38632e+01  0.00000e+00 0.00000e+00 3.00928e+02 135.811 8.14334e+01 315.811 0.9745 
1 1 1 10  25  2  f 0  1.37314e+01 7.83800e-01 2.09474e+02 221.694 -6.42243e+00 -5.72103e+00 0.00000e+00 0.00000e+00 2.79148e+02 221.694 6.96739e+01 221.694 0.9399 
1 1 1 10  25  3  f 0  5.08974e+00 1.23257e+00 5.56071e+01 179.886 -8.29057e-01 1.64779e-03  0.00000e+00 0.00000e+00 1.81272e+01 179.886 3.74799e+01 359.886 0.3826 
1 1 1 10  25  4  o 4  1.37416e+01 8.99383e-01 2.83765e+02 47.421  9.17341e+00  9.98343e+00  0.00000e+00 0.00000e+00 2.17121e+02 47.421  6.66437e+01 227.421 0.9624 
1 1 1 10  25  5  f 0  3.17326e+01 8.70471e-01 4.30365e+02 192.419 -5.56408e+01 -1.22532e+01 0.00000e+00 0.00000e+00 7.61066e+02 192.419 3.30700e+02 192.419 0.9912 
1 1 1 10  25  6  o 3  1.08222e+01 1.31715e+00 2.29291e+02 57.545  5.62989e+00  8.85250e+00  0.00000e+00 0.00000e+00 1.60624e+02 57.545  6.86669e+01 237.545 0.9511 
1 1 1 10  25  7  o 1  1.38222e+01 1.24919e+00 1.97262e+02 272.330 6.00756e-01  -1.47671e+01 0.00000e+00 0.00000e+00 3.08324e+02 272.330 1.11062e+02 272.330 0.9656 
1 1 1 10  25  8  f 0  1.36702e+01 1.66741e+00 1.59481e+02 249.425 -4.23189e+00 -1.12735e+01 0.00000e+00 0.00000e+00 3.36361e+02 249.425 1.76880e+02 249.425 0.9575 
1 1 1 10  25  9  o 8  9.55055e+00 2.16713e+00 1.08021e+02 251.025 -1.75919e+00 -5.11626e+00 0.00000e+00 0.00000e+00 2.18303e+02 251.025 1.10282e+02 251.025 0.9021 
1 1 1 10  25  10 o 15 1.17252e+01 1.53751e+00 2.67579e+02 142.742 -1.95797e+01 1.48932e+01  0.00000e+00 0.00000e+00 1.67326e+02 142.742 1.00254e+02 322.742 0.9795 
1 1 1 10  25  11 o 4  1.46992e+01 1.58538e+00 2.59237e+02 10.458  3.11539e+01  5.75064e+00  0.00000e+00 0.00000e+00 2.88427e+02 10.458  2.91902e+01 10.458  0.9841 
1 1 1 10  25  12 o 12 7.33706e+00 1.81218e+00 2.09592e+02 211.817 -1.07032e+01 -6.64064e+00 0.00000e+00 0.00000e+00 5.68462e+01 211.817 1.52746e+02 31.817  0.9594 
1 1 1 10  25  13 o 13 8.37672e+00 2.12757e+00 1.12121e+02 140.098 -5.37480e+00 4.49428e+00  0.00000e+00 0.00000e+00 1.81236e+02 140.098 6.91146e+01 140.098 0.9256 
1 1 1 10  26  0  o 15 1.72479e+01 1.01203e+00 1.38242e+02 54.074  3.72438e+00  5.14016e+00  0.00000e+00 0.00000e+00 4.60377e+02 54.074  3.22134e+02 54.074  0.9174 
1 1 1 10  26  1  o 2  2.93688e+01 7.40736e-01 3.56372e+02 305.506 1.69490e+01  -2.37567e+01 0.00000e+00 0.00000e+00 7.35848e+02 305.506 3.79476e+02 305.506 0.9827 
1 1 1 10  26  2  o 13 1.58790e+01 7.89204e-01 3.39470e+02 205.974 -1.38037e+01 -6.72481e+00 0.00000e+00 0.00000e+00 2.41726e+02 205.974 9.77446e+01 25.974  0.9669 
1 1 1 10  26  3  o 4  1.91498e+01 7.50786e-01 3.70298e+02 93.947  -1.50603e+00 2.18255e+01  0.00000e+00 0.00000e+00 3.38042e+02 93.947  3.22558e+01 273.947 0.9769 
1 1 1 10  26  4  o 7  2.66374e+01 8.17058e-01 5.03648e+02 161.570 -4.45411e+01 1.48429e+01  0.00000e+00 0.00000e+00 4.94372e+02 161.570 9.27509e+00 341.570 0.9893 
1 1 1 10  26  5  o 16 2.34207e+01 8.33020e-01 3.27753e+02 53.899  1.89152e+01  2.59382e+01  0.00000e+00 0.00000e+00 5.45431e+02 53.899  2.17678e+02 53.899  0.9843 
1 1 1 10  26  6  o 13 1.22407e+01 1.23045e+00 2.02762e+02 324.384 9.26380e+00  -6.63605e+00 0.00000e+00 0.00000e+00 2.40074e+02 324.384 3.73118e+01 324.384 0.9551 
1 1 1 10  26  7  o 6  6.32970e+00 1.58519e+00 1.38176e+02 164.629 -4.15598e+00 1.14246e+00  0.00000e+00 0.00000e+00 7.14949e+01 164.629 6.66813e+01 344.629 0.8745 
1 1 1 10  26  8  o 19 4.65758e+00 2.02001e+00 1.66333e+02 262.083 -5.18007e-01 -3.72494e+00 0.00000e+00 0.00000e+00 1.57329e+01 82.083  1.82066e+02 82.083  0.8536 
1 1 1 10  26  9  f 0  1.84584e+01 1.66829e+00 3.48189e+02 136.183 -2.99909e+01 2.87772e+01  0.00000e+00 0.00000e+00 3.42432e+02 136.183 5.75635e+00 316.183 0.9879 
1 1 1 10  26  10 o 13 1.07704e+01 1.56830e+00 9.53033e+01 54.270  4.51877e+00  6.28156e+00  0.00000e+00 0.00000e+00 2.85192e+02 54.270  1.89888e+02 54.270  0.9329 
1 1 1 10  26  11 o 7  4.10380e+00 1.31470e+00 8.35914e+01 234.077 -1.90722e+00 -2.63248e+00 0.00000e+00 0.00000e+00 4.48825e+01 234.077 3.87089e+01 54.077  0.8269 
1 1 1 10  26  12 o 11 7.79844e+00 1.92809e+00 2.04800e+02 3.411   1.21255e+01  7.22653e-01  0.00000e+00 0.00000e+00 7.79202e+01 3.411   1.26880e+02 183.411 0.9579 
1 1 1 10  26  13 o 19 5.30583e+00 1.68185e+00 1.80843e+02 262.211 -1.27491e+00 -9.32059e+00 0.00000e+00 0.00000e+00 8.90220e+00 262.211 1.71940e+02 82.211  0.9453 
1 1 1 10  27  0  o 14 1.94812e+01 7.81298e-01 3.66554e+02 186.536 -1.97300e+01 -2.26054e+00 0.00000e+00 0.00000e+00 3.51561e+02 186.536 1.49932e+01 6.536   0.9745 
1 1 1 10  27  1  o 4  2.06389e+01 6.84097e-01 4.55710e+02 165.892 -2.75492e+01 6.92389e+00  0.00000e+00 0.00000e+00 3.11418e+02 165.892 1.44292e+02 345.892 0.9822 
1 1 1 10  27  2  o 15 7.32094e+00 1.17610e+00 8.76901e+01 198.493 -1.66094e+00 -5.55513e-01 0.00000e+00 0.00000e+00 9.31082e+01 198.493 5.41807e+00 198.493 0.6524 
1 1 1 10  27  3  o 14 9.63278e+00 9.99438e-01 1.28889e+02 245.230 -1.61251e+00 -3.49468e+00 0.00000e+00 0.00000e+00 1.83839e+02 245.230 5.49496e+01 245.230 0.8574 
1 1 1 10  27  4  o 15 1.60916e+01 8.81905e-01 2.76376e+02 290.008 5.14620e+00  -1.41332e+01 0.00000e+00 0.00000e+00 3.12389e+02 290.008 3.60126e+01 290.008 0.9662 
1 1 1 10  27  5  o 6  3.01276e+01 8.55017e-01 5.02160e+02 61.757  3.07373e+01  5.72214e+01  0.00000e+00 0.00000e+00 6.30090e+02 61.757  1.27930e+02 61.757  0.9923 
1 1 1 10  27  6  o 2  2.01336e+01 1.02544e+00 3.54514e+02 282.020 7.60022e+00  -3.56957e+01 0.00000e+00 0.00000e+00 3.97566e+02 282.020 4.30517e+01 282.020 0.9862 
1 1 1 10  27  7  o 5  1.22600e+01 1.46360e+00 1.34784e+02 289.243 2.82717e+00  -8.09902e+00 0.00000e+00 0.00000e+00 3.01620e+02 289.243 1.66836e+02 289.243 0.9398 
1 1 1 10  27  8  o 15 1.30915e+01 1.75407e+00 1.99071e+02 127.453 -8.81743e+00 1.15107e+01  0.00000e+00 0.00000e+00 2.79357e+02 127.453 8.02864e+01 127.453 0.9649 
1 1 1 10  27  9  o 15 1.68765e+01 1.62308e+00 2.73921e+02 128.873 -1.91066e+01 2.37019e+01  0.00000e+00 0.00000e+00 3.54618e+02 128.873 8.06970e+01 128.873 0.9834 
1 1 1 10  27  10 o 7  4.21690e+00 1.34684e+00 7.91626e+01 239.141 -1.48395e+00 -2.48352e+00 0.00000e+00 0.00000e+00 4.88533e+01 239.141 3.03093e+01 59.141  0.8018 
1 1 1 10  27  11 o 6  9.23302e+00 1.77123e+00 1.83523e+02 22.372  1.25402e+01  5.16156e+00  0.00000e+00 0.00000e+00 1.52848e+02 22.372  3.06748e+01 202.372 0.9624 
1 1 1 10  27  12 o 19 6.09654e+00 1.72282e+00 1.05851e+02 307.894 3.37677e+00  -4.33863e+00 0.00000e+00 0.00000e+00 1.02665e+02 307.894 3.18602e+00 127.894 0.9038 
1 1 1 10  27  13 o 6  4.94244e+00 1.62646e+00 9.27919e+01 11.549  4.34439e+00  8.87756e-01  0.00000e+00 0.00000e+00 7.14379e+01 11.549  2.13540e+01 191.549 0.8784 
1 1 1 10  28  0  o 9  2.05375e+01 6.56652e-01 4.65261e+02 292.664 1.11525e+01  -2.67080e+01 0.00000e+00 0.00000e+00 2.98013e+02 292.664 1.67248e+02 112.664 0.9826 
1 1 1 10  28  1  o 9  3.51138e+01 8.04272e-01 5.62687e+02 291.877 2.19387e+01  -5.46364e+01 0.00000e+00 0.00000e+00 7.54630e+02 291.877 1.91943e+02 291.877 0.9915 
1 1 1 10  28  2  o 5  8.98763e+00 1.03147e+00 2.54992e+02 289.363 2.35765e+00  -6.70865e+00 0.00000e+00 0.00000e+00 6.02725e+01 289.363 1.94719e+02 109.363 0.9268 
1 1 1 10  28  3  o 9  1.29710e+01 8.67217e-01 2.94434e+02 261.730 -1.72222e+00 -1.18495e+01 0.00000e+00 0.00000e+00 1.75668e+02 261.730 1.18766e+02 81.730  0.9573 
1 1 1 10  28  4  o 6  3.96871e+01 9.15985e-01 6.07762e+02 65.965  3.74060e+01  8.38769e+01  0.00000e+00 0.00000e+00 8.86857e+02 65.965  2.79095e+02 65.965  0.9945 
1 1 1 10  28  5  o 17 1.18347e+01 1.26347e+00 2.77916e+02 204.632 -1.24979e+01 -5.73046e+00 0.00000e+00 0.00000e+00 1.53662e+02 204.632 1.24255e+02 24.632  0.9629 
1 1 1 10  28  6  o 15 1.78715e+01 1.05481e+00 2.90832e+02 236.210 -1.46565e+01 -2.19018e+01 0.00000e+00 0.00000e+00 3.73067e+02 236.210 8.22355e+01 236.210 0.9808 
1 1 1 10  28  7  o 9  5.74217e+00 1.55446e+00 1.89626e+02 53.524  3.52479e+00  4.76767e+00  0.00000e+00 0.00000e+00 8.55262e+00 53.524  1.81073e+02 233.524 0.9112 
1 1 1 10  28  8  o 16 1.94741e+01 1.40995e+00 4.01497e+02 56.866  2.86298e+01  4.38619e+01  0.00000e+00 0.00000e+00 3.28955e+02 56.866  7.25426e+01 236.866 0.9904 
1 1 1 10  28  9  o 6  4.53814e+00 1.39691e+00 8.99949e+01 163.414 -2.94147e+00 8.76093e-01  0.00000e+00 0.00000e+00 5.00576e+01 163.414 3.99372e+01 343.414 0.8150 
1 1 1 10  28  10 o 2  1.16139e+01 1.89019e+00 1.79802e+02 328.368 1.19465e+01  -7.35871e+00 0.00000e+00 0.00000e+00 2.43944e+02 328.368 6.41427e+01 328.368 0.9637 
1 1 1 10  28  11 o 9  9.62665e+00 1.65044e+00 1.89868e+02 71.170  4.90019e+00  1.43697e+01  0.00000e+00 0.00000e+00 1.62308e+02 71.170  2.75602e+01 251.170 0.9665 
1 1 1 10  28  12 o 16 6.84781e+00 1.84377e+00 1.23083e+02 232.663 -4.37615e+00 -5.73688e+00 0.00000e+00 0.00000e+00 1.17351e+02 232.663 5.73140e+00 52.663  0.9279 
1 1 1 10  28  13 o 18 7.85718e+00 2.00677e+00 7.94291e+01 286.046 1.39802e+00  -4.86078e+00 0.00000e+00 0.00000e+00 1.86491e+02 286.046 1.07062e+02 286.046 0.8947 
1 1 1 10  29  0  o 19 1.45413e+01 6.97534e-01 3.69693e+02 14.714  1.56456e+01  4.10854e+00  0.00000e+00 0.00000e+00 1.62997e+02 14.714  2.06696e+02 194.714 0.9686 
1 1 1 10  29  1  o 15 3.92318e+01 8.52724e-01 6.49937e+02 138.819 -5.42517e+01 4.74614e+01  0.00000e+00 0.00000e+00 8.24081e+02 138.819 1.74144e+02 138.819 0.9930 
1 1 1 10  29  2  o 6  2.09735e+01 8.04869e-01 2.66054e+02 338.985 1.60145e+01  -6.15220e+00 0.00000e+00 0.00000e+00 5.04237e+02 338.985 2.38183e+02 338.985 0.9704 
1 1 1 10  29  3  o 6  1.26423e+01 8.60093e-01 2.70767e+02 95.251  -1.01379e+00 1.10309e+01  0.00000e+00 0.00000e+00 1.85686e+02 95.251  8.50809e+01 275.251 0.9537 
1 1 1 10  29  4  o 16 3.00304e+01 9.66921e-01 5.95232e+02 159.458 -6.31292e+01 2.36551e+01  0.00000e+00 0.00000e+00 5.33369e+02 159.458 6.18624e+01 339.458 0.9926 
1 1 1 10  29  5  o 1  1.43170e+01 1.13836e+00 3.45091e+02 2.968   2.10664e+01  1.09235e+00  0.00000e+00 0.00000e+00 1.84065e+02 2.968   1.61026e+02 182.968 0.9760 
1 1 1 10  29  6  o 7  2.26234e+01 9.96018e-01 3.49159e+02 344.643 4.27212e+01  -1.17325e+01 0.00000e+00 0.00000e+00 4.97889e+02 344.643 1.48730e+02 344.643 0.9886 
1 1 1 10  29  7  o 17 6.83180e+00 2.13188e+00 1.80698e+02 145.735 -4.54797e+00 3.09837e+00  0.00000e+00 0.00000e+00 5.31615e+01 145.735 1.27537e+02 325.735 0.9039 
1 1 1 10  29  8  o 6  1.23292e+01 1.95235e+00 1.94711e+02 263.409 -1.49656e+00 -1.29512e+01 0.00000e+00 0.00000e+00 2.53907e+02 263.409 5.91955e+01 263.409 0.9608 
1 1 1 10  29  9  o 2  1.67489e+01 1.17921e+00 2.65358e+02 352.549 3.59278e+01  -4.69867e+00 0.00000e+00 0.00000e+00 3.60023e+02 352.549 9.46653e+01 352.549 0.9861 
1 1 1 10  29  10 o 7  5.45397e+00 1.58388e+00 2.87966e+01 275.232 1.06391e-01  -1.16190e+00 0.00000e+00 0.00000e+00 7.49307e+01 275.232 4.61341e+01 275.232 0.5024 
1 1 1 10  29  11 o 8  7.59417e+00 1.84409e+00 1.44788e+02 178.478 -8.24492e+00 2.19108e-01  0.00000e+00 0.00000e+00 1.24611e+02 178.478 2.01770e+01 358.478 0.9373 
1 1 1 10  29  12 o 12 7.55360e+00 1.72867e+00 7.59927e+01 19.514  4.96013e+00  1.75785e+00  0.00000e+00 0.00000e+00 1.80990e+02 19.514  1.04997e+02 19.514  0.8991 
1 1 1 10  29  13 o 10 5.38264e+00 1.68438e+00 1.56295e+02 342.899 7.96451e+00  -2.45033e+00 0.00000e+00 0.00000e+00 3.46608e+01 342.899 1.21634e+02 162.899 0.9379 
1 1 1 10  30  0  o 13 2.57937e+01 7.67319e-01 5.95939e+02 81.445  6.51567e+00  4.33148e+01  0.00000e+00 0.00000e+00 3.68333e+02 81.445  2.27607e+02 261.445 0.9885 
1 1 1 10  30  1  o 3  1.15630e+01 8.87317e-01 1.76019e+02 141.435 -5.02345e+00 4.00510e+00  0.00000e+00 0.00000e+00 2.25779e+02 141.435 4.97599e+01 141.435 0.9185 
1 1 1 10  30  2  o 5  1.75182e+01 8.13032e-01 2.08800e+02 205.537 -1.01091e+01 -4.82976e+00 0.00000e+00 0.00000e+00 4.23844e+02 205.537 2.15044e+02 205.537 0.9543 
1 1 1 10  30  3  o 6  8.37072e+00 1.08580e+00 1.73809e+02 331.682 4.34318e+00  -2.34034e+00 0.00000e+00 0.00000e+00 1.08775e+02 331.682 6.50339e+01 151.682 0.8918 
1 1 1 10  30  4  o 10 2.12525e+01 9.55911e-01 4.15831e+02 40.476  2.77921e+01  2.37170e+01  0.00000e+00 0.00000e+00 3.77716e+02 40.476  3.81148e+01 220.476 0.9862 
1 1 1 10  30  5  o 15 2.78804e+01 9.73413e-01 4.38063e+02 99.937  -9.74830e+00 5.56407e+01  0.00000e+00 0.00000e+00 6.08260e+02 99.937  1.70197e+02 99.937  0.9911 
1 1 1 10  30  6  o 16 9.16137e+00 1.52313e+00 2.26768e+02 207.813 -8.73512e+00 -4.60804e+00 0.00000e+00 0.00000e+00 1.02093e+02 207.813 1.24675e+02 27.813  0.9479 
1 1 1 10  30  7  o 14 1.26918e+01 1.65231e+00 3.01833e+02 352.807 2.05181e+01  -2.58950e+00 0.00000e+00 0.00000e+00 1.67017e+02 352.807 1.34816e+02 172.807 0.9755 
1 1 1 10  30  8  o 2  7.11999e+00 2.31051e+00 1.17399e+02 335.861 3.46680e+00  -1.55358e+00 0.00000e+00 0.00000e+00 1.13203e+02 335.861 4.19624e+00 155.861 0.8553 
1 1 1 10  30  9  o 16 4.76419e+00 1.40686e+00 9.69424e+01 53.373  2.07861e+00  2.79607e+00  0.00000e+00 0.00000e+00 5.46259e+01 53.373  4.23166e+01 233.373 0.8403 
1 1 1 10  30  10 o 11 4.41809e+00 1.39755e+00 1.27507e+02 110.890 -1.72212e+00 4.51214e+00  0.00000e+00 0.00000e+00 2.12215e+01 110.890 1.06286e+02 290.890 0.8893 
1 1 1 10  30  11 o 2  6.64688e+00 1.85672e+00 1.39895e+02 275.933 7.44270e-01  -7.16156e+00 0.00000e+00 0.00000e+00 9.34761e+01 275.933 4.64192e+01 95.933  0.9277 
1 1 1 10  30  12 o 10 6.23060e+00 1.75649e+00 5.69520e+01 161.487 -2.99059e+00 1.00141e+00  0.00000e+00 0.00000e+00 1.36524e+02 161.487 7.95723e+01 161.487 0.8207 
1 1 1 10  30  13 o 18 5.39571e+00 1.69318e+00 1.10041e+02 91.358  -1.33516e-01 5.63369e+00  0.00000e+00 0.00000e+00 7.49072e+01 91.358  3.51342e+01 271.358 0.9063 
1 1 1 10  31  0  o 3  3.38208e+01 8.64111e-01 4.70654e+02 227.330 -3.41512e+01 -3.70481e+01 0.00000e+00 0.00000e+00 7.95526e+02 227.330 3.24873e+02 227.330 0.9900 
1 1 1 10  31  1  o 7  3.50037e+01 8.08132e-01 5.15371e+02 328.391 4.72439e+01  -2.90752e+01 0.00000e+00 0.00000e+00 7.96801e+02 328.391 2.81430e+02 328.391 0.9909 
1 1 1 10  31  2  o 2  2.71857e+01 7.44285e-01 4.27227e+02 214.120 -3.05368e+01 -2.06905e+01 0.00000e+00 0.00000e+00 5.87465e+02 214.120 1.60238e+02 214.120 0.9864 
1 1 1 10  31  3  o 8  2.66938e+01 7.69854e-01 5.57492e+02 349.804 5.01789e+01  -9.02519e+00 0.00000e+00 0.00000e+00 4.42922e+02 349.804 1.14571e+02 169.804 0.9901 
1 1 1 10  31  4  o 1  7.48205e+00 1.49735e+00 5.79326e+01 266.391 -1.01808e-01 -1.61418e+00 0.00000e+00 0.00000e+00 1.18771e+02 266.391 6.08388e+01 266.391 0.6238 
1 1 1 10  31  5  o 1  9.23688e+00 1.53378e+00 8.92236e+01 231.232 -2.08392e+00 -2.59480e+00 0.00000e+00 0.00000e+00 2.01609e+02 231.232 1.12385e+02 231.232 0.8316 
1 1 1 10  31  6  o 8  1.27844e+01 1.30581e+00 2.98487e+02 273.230 1.07875e+00  -1.91174e+01 0.00000e+00 0.00000e+00 1.72777e+02 273.230 1.25711e+02 93.230  0.9735 
1 1 1 10  31  7  o 14 9.69923e+00 2.10440e+00 1.88197e+02 274.586 6.94852e-01  -8.66224e+00 0.00000e+00 0.00000e+00 1.57240e+02 274.586 3.09562e+01 94.586  0.9406 
1 1 1 10  31  8  o 7  3.25269e+00 1.57333e+00 1.59137e+02 181.366 -3.33092e+00 -7.94081e-02 0.00000e+00 0.00000e+00 5.66932e+01 1.366   2.15830e+02 1.366   0.8318 
1 1 1 10  31  9  o 14 6.53422e+00 1.62280e+00 1.15941e+02 274.599 4.19400e-01  -5.21391e+00 0.00000e+00 0.00000e+00 1.06320e+02 274.599 9.62127e+00 94.599  0.8985 
1 1 1 10  31  10 o 4  5.05474e+00 1.44472e+00 1.99858e+01 139.261 -6.41377e-01 5.52436e-01  0.00000e+00 0.00000e+00 5.45127e+01 139.261 3.45269e+01 139.261 0.3894 
1 1 1 10  31  11 o 3  7.90126e+00 1.76478e+00 1.64316e+02 201.518 -9.86512e+00 -3.88955e+00 0.00000e+00 0.00000e+00 1.20223e+02 201.518 4.40932e+01 21.518  0.9516 
1 1 1 10  31  12 o 11 4.17121e+00 1.40506e+00 6.11670e+01 24.473  2.54925e+00  1.16034e+00  0.00000e+00 0.00000e+00 6.41474e+01 24.473  2.98045e+00 24.473  0.7941 
1 1 1 10  31  13 o 16 4.80855e+00 1.58316e+00 1.96056e+02 28.933  8.80197e+00  4.86564e+00  0.00000e+00 0.00000e+00 2.34985e+01 208.933 2.19554e+02 208.933 0.9489 
1 1 1 10  32  0  o 16 1.52474e+01 7.47379e-01 2.32645e+02 340.320 1.06558e+01  -3.81107e+00 0.00000e+00 0.00000e+00 3.17791e+02 340.320 8.51457e+01 340.320 0.9547 
1 1 1 10  32  1  o 10 1.43955e+01 7.33683e-01 1.37228e+02 339.781 5.72027e+00  -2.10677e+00 0.00000e+00 0.00000e+00 3.60371e+02 339.781 2.23143e+02 339.781 0.9138 
1 1 1 10  32  2  o 6  3.29472e+01 7.97114e-01 6.54253e+02 187.761 -6.95976e+01 -9.48564e+00 0.00000e+00 0.00000e+00 5.83487e+02 187.761 7.07664e+01 7.761   0.9929 
1 1 1 10  32  3  o 15 2.59976e+01 7.62632e-01 5.24219e+02 300.054 2.33355e+01  -4.03301e+01 0.00000e+00 0.00000e+00 4.49101e+02 300.054 7.51178e+01 120.054 0.9892 
1 1 1 10  32  4  o 10 1.27279e+01 1.21314e+00 1.44157e+02 34.414  5.95500e+00  4.07961e+00  0.00000e+00 0.00000e+00 3.02908e+02 34.414  1.58751e+02 34.414  0.9279 
1 1 1 10  32  5  o 17 1.15454e+01 1.34278e+00 2.57830e+02 298.048 5.88127e+00  -1.10386e+01 0.00000e+00 0.00000e+00 1.61412e+02 298.048 9.64184e+01 118.048 0.9592 
1 1 1 10  32  6  o 16 1.89557e+01 1.19852e+00 3.37416e+02 232.657 -2.01154e+01 -2.63639e+01 0.00000e+00 0.00000e+00 3.69374e+02 232.657 3.19586e+01 232.657 0.9848 
1 1 1 10  32  7  o 11 1.38993e+01 1.57576e+00 2.96936e+02 81.927  3.33893e+00  2.35396e+01  0.00000e+00 0.00000e+00 2.18127e+02 81.927  7.88091e+01 261.927 0.9787 
1 1 1 10  32  8  o 5  8.43222e+00 2.18585e+00 1.77754e+02 276.230 8.23673e-01  -7.54463e+00 0.00000e+00 0.00000e+00 1.19645e+02 276.230 5.81081e+01 96.230  0.9316 
1 1 1 10  32  9  o 3  7.98178e+00 1.57793e+00 2.02422e+02 193.914 -1.10179e+01 -2.72958e+00 0.00000e+00 0.00000e+00 8.60985e+01 193.914 1.16324e+02 13.914  0.9549 
1 1 1 10  32  10 o 9  6.46664e+00 1.70090e+00 1.47745e+02 13.423  7.12458e+00  1.70029e+00  0.00000e+00 0.00000e+00 7.96283e+01 13.423  6.81168e+01 193.423 0.9290 
1 1 1 10  32  11 o 9  9.88524e+00 1.71512e+00 1.03936e+02 70.471  2.88022e+00  8.12035e+00  0.00000e+00 0.00000e+00 2.47690e+02 70.471  1.43754e+02 70.471  0.9400 
1 1 1 10  32  12 o 4  5.80069e+00 1.57378e+00 6.82714e+01 338.599 3.64646e+00  -1.42907e+00 0.00000e+00 0.00000e+00 1.20490e+02 338.599 5.22187e+01 338.599 0.8602 
1 1 1 10  32  13 o 3  6.37714e+00 1.87169e+00 1.57425e+02 179.453 -8.89992e+00 8.49668e-02  0.00000e+00 0.00000e+00 6.97442e+01 179.453 8.76804e+01 359.453 0.9420 
1 1 1 10  33  0  o 16 2.34207e+01 8.68086e-01 3.26583e+02 154.687 -2.10737e+01 9.96752e+00  0.00000e+00 0.00000e+00 5.39711e+02 154.687 2.13128e+02 154.687 0.9783 
1 1 1 10  33  1  o 19 6.87788e+00 1.10511e+00 1.29988e+02 66.946  1.06926e+00  2.51240e+00  0.00000e+00 0.00000e+00 7.49765e+01 66.946  5.50110e+01 246.946 0.7879 
1 1 1 10  33  2  o 19 1.03294e+01 8.83207e-01 1.67098e+02 283.745 1.42768e+00  -5.83644e+00 0.00000e+00 0.00000e+00 1.89510e+02 283.745 2.24124e+01 283.745 0.9125 
1 1 1 10  33  3  o 3  2.20113e+01 7.67825e-01 3.71393e+02 162.498 -3.01579e+01 9.51013e+00  0.00000e+00 0.00000e+00 4.48318e+02 162.498 7.69249e+01 162.498 0.9841 
1 1 1 10  33  4  o 9  1.50598e+01 1.15165e+00 2.64037e+02 292.832 6.30771e+00  -1.49818e+01 0.00000e+00 0.00000e+00 2.88167e+02 292.832 2.41295e+01 292.832 0.9687 
1 1 1 10  33  5  o 6  8.55656e+00 1.43908e+00 1.07655e+02 222.475 -2.97109e+00 -2.72010e+00 0.00000e+00 0.00000e+00 1.72401e+02 222.475 6.47459e+01 222.475 0.8646 
1 1 1 10  33  6  o 2  2.54639e+01 1.16633e+00 4.29571e+02 148.159 -5.13862e+01 3.19112e+01  0.00000e+00 0.00000e+00 5.26445e+02 148.159 9.68742e+01 148.159 0.9917 
1 1 1 10  33  7  o 5  9.39853e+00 2.09350e+00 1.42823e+02 62.399  2.97843e+00  5.69696e+00  0.00000e+00 0.00000e+00 1.84008e+02 62.399  4.11849e+01 62.399  0.9185 
1 1 1 10  33  8  o 1  1.15194e+01 1.86441e+00 3.01709e+02 297.011 9.11702e+00  -1.78846e+01 0.00000e+00 0.00000e+00 1.23369e+02 297.011 1.78340e+02 117.011 0.9748 
1 1 1 10  33  9  o 1  1.19685e+01 1.38380e+00 1.40030e+02 105.130 -3.60172e+00 1.33210e+01  0.00000e+00 0.00000e+00 2.96266e+02 105.130 1.56236e+02 105.130 0.9631 
1 1 1 10  33  10 o 6  3.81459e+00 1.24781e+00 5.79711e+01 348.409 2.15045e+00  -4.41082e-01 0.00000e+00 0.00000e+00 4.70343e+01 348.409 1.09367e+01 168.409 0.7274 
1 1 1 10  33  11 o 3  8.69825e+00 1.78072e+00 1.68811e+02 346.975 1.18286e+01  -2.73634e+00 0.00000e+00 0.00000e+00 1.46439e+02 346.975 2.23726e+01 166.975 0.9579 
1 1 1 10  33  12 o 15 6.62360e+00 1.78120e+00 9.46697e+01 158.221 -5.09164e+00 2.03434e+00  0.00000e+00 0.00000e+00 1.31690e+02 158.221 3.70203e+01 158.221 0.9035 
1 1 1 10  33  13 o 15 6.11881e+00 1.85602e+00 8.75502e+01 203.886 -4.38178e+00 -1.94045e+00 0.00000e+00 0.00000e+00 1.17974e+02 203.886 3.04239e+01 203.886 0.8883 
1 1 1 10  34  0  o 1  1.51057e+01 7.05020e-01 3.42566e+02 215.462 -1.34353e+01 -9.56982e+00 0.00000e+00 0.00000e+00 2.10913e+02 215.462 1.31653e+02 35.462  0.9692 
1 1 1 10  34  1  o 9  1.62814e+01 1.31874e+00 1.71757e+02 303.621 4.72377e+00  -7.10429e+00 0.00000e+00 0.00000e+00 4.06692e+02 303.621 2.34936e+02 303.621 0.9394 
1 1 1 10  34  2  o 11 3.49737e+01 8.28321e-01 5.53688e+02 157.817 -6.25726e+01 2.55131e+01  0.00000e+00 0.00000e+00 7.59569e+02 157.817 2.05881e+02 157.817 0.9926 
1 1 1 10  34  3  o 13 5.73397e+00 1.24784e+00 1.84081e+02 6.122   4.13121e+00  4.43105e-01  0.00000e+00 0.00000e+00 4.51906e+00 6.122   1.79562e+02 186.122 0.8692 
1 1 1 10  34  4  o 12 2.56167e+01 9.30539e-01 4.93214e+02 61.672  2.65264e+01  4.92081e+01  0.00000e+00 0.00000e+00 4.67603e+02 61.672  2.56108e+01 241.672 0.9910 
1 1 1 10  34  5  o 14 2.70896e+01 9.84621e-01 3.73002e+02 196.206 -4.99065e+01 -1.45053e+01 0.00000e+00 0.00000e+00 6.42487e+02 196.206 2.69485e+02 196.206 0.9903 
1 1 1 10  34  6  o 3  2.76089e+01 2.01057e+00 4.52736e+02 103.229 -1.25206e+01 5.32604e+01  0.00000e+00 0.00000e+00 5.82798e+02 103.229 1.30062e+02 103.229 0.9908 
1 1 1 10  34  7  o 7  3.68375e+00 1.70365e+00 1.27553e+02 317.695 1.89396e+00  -1.72365e+00 0.00000e+00 0.00000e+00 1.99737e+01 137.695 1.47526e+02 137.695 0.7715 
1 1 1 10  34  8  o 8  1.11394e+01 1.40376e+00 2.21254e+02 144.029 -1.43502e+01 1.04147e+01  0.00000e+00 0.00000e+00 1.88339e+02 144.029 3.29155e+01 324.029 0.9714 
1 1 1 10  34  9  o 3  1.31931e+01 1.20904e+00 2.94151e+02 231.280 -2.11897e+01 -2.64300e+01 0.00000e+00 0.00000e+00 1.97760e+02 231.280 9.63910e+01 51.280  0.9851 
1 1 1 10  34  10 o 17 5.94515e+00 1.54439e+00 1.45674e+02 27.453  6.80202e+00  3.53388e+00  0.00000e+00 0.00000e+00 6.40667e+01 27.453  8.16074e+01 207.453 0.9323 
1 1 1 10  34  11 o 7  1.87920e+01 1.41868e+00 2.90371e+02 309.198 3.35366e+01  -4.11228e+01 0.00000e+00 0.00000e+00 4.13853e+02 309.198 1.23482e+02 309.198 0.9905 
1 1 1 10  34  12 o 12 4.85242e+00 1.55409e+00 8.78328e+01 211.827 -3.63216e+00 -2.25441e+00 0.00000e+00 0.00000e+00 7.24438e+01 211.827 1.53890e+01 31.827  0.8733 
1 1 1 10  34  13 o 18 7.26699e+00 1.83812e+00 8.62144e+01 32.094  4.85863e+00  3.04706e+00  0.00000e+00 0.00000e+00 1.63267e+02 32.094  7.70530e+01 32.094  0.9080 
1 1 1 10  35  0  o 19 1.35112e+01 7.35877e-01 2.58409e+02 299.600 5.65124e+00  -9.94784e+00 0.00000e+00 0.00000e+00 2.29473e+02 299.600 2.89359e+01 119.600 0.9552 
1 1 1 10  35  1  f 0  2.25361e+01 7.15838e-01 4.20879e+02 61.268  1.61523e+01  2.94642e+01  0.00000e+00 0.00000e+00 4.18555e+02 61.268  2.32345e+00 241.268 0.9850 
1 1 1 10  35  2  o 3  1.20725e+01 1.13585e+00 1.76963e+02 208.200 -6.15270e+00 -3.29910e+00 0.00000e+00 0.00000e+00 2.45604e+02 208.200 6.86410e+01 208.200 0.9253 
1 1 1 10  35  3  o 9  2.47116e+01 8.83519e-01 3.62529e+02 104.534 -9.35132e+00 3.60693e+01  0.00000e+00 0.00000e+00 5.59842e+02 104.534 1.97313e+02 104.534 0.9865 
1 1 1 10  35  4  o 14 7.12878e+00 1.38535e+00 4.17724e+01 77.105  2.83201e-01  1.23698e+00  0.00000e+00 0.00000e+00 1.02191e+02 77.105  6.04182e+01 77.105  0.5336 
1 1 1 10  35  5  o 14 3.84641e+00 1.24872e+00 5.94867e+01 205.736 -1.09026e+00 -5.25563e-01 0.00000e+00 0.00000e+00 1.56289e+01 205.736 4.38578e+01 25.737  0.5160 
1 1 1 10  35  6  o 11 6.82647e+00 2.70882e+00 8.38490e+01 223.264 -1.43084e+00 -1.34664e+00 0.00000e+00 0.00000e+00 9.49368e+01 223.264 1.10878e+01 223.264 0.6919 
1 1 1 10  35  7  f 0  1.07900e+01 1.74374e+00 8.51226e+01 80.408  8.55059e-01  5.05995e+00  0.00000e+00 0.00000e+00 2.80961e+02 80.408  1.95839e+02 80.408  0.8963 
1 1 1 10  35  8  o 11 7.57444e+00 1.50036e+00 1.05809e+02 57.256  3.00048e+00  4.66590e+00  0.00000e+00 0.00000e+00 1.53557e+02 57.256  4.77471e+01 57.256  0.9047 
1 1 1 10  35  9  o 19 9.50080e+00 1.54607e+00 1.38985e+02 25.298  9.33075e+00  4.41019e+00  0.00000e+00 0.00000e+00 2.02682e+02 25.298  6.36974e+01 25.298  0.9502 
1 1 1 10  35  10 o 6  5.37257e+00 1.51978e+00 5.83810e+01 257.135 -6.25280e-01 -2.73779e+00 0.00000e+00 0.00000e+00 1.03182e+02 257.135 4.48015e+01 257.135 0.7947 
1 1 1 10  35  11 o 4  1.25271e+01 1.68611e+00 1.47224e+02 100.197 -2.81500e+00 1.56495e+01  0.00000e+00 0.00000e+00 3.11514e+02 100.197 1.64290e+02 100.197 0.9680 
1 1 1 10  35  12 o 7  1.28418e+01 1.93267e+00 2.47959e+02 315.055 1.80834e+01  -1.80486e+01 0.00000e+00 0.00000e+00 2.28089e+02 315.055 1.98706e+01 135.055 0.9802 
1 1 1 10  35  13 o 16 5.45715e+00 1.71826e+00 1.86691e+02 150.405 -8.47400e+00 4.81300e+00  0.00000e+00 0.00000e+00 8.72295e+00 150.405 1.77968e+02 330.405 0.9472 
1 1 1 10  36  0  f 0  1.24629e+01 7.54943e-01 2.62158e+02 140.876 -8.94326e+00 7.27417e+00  0.00000e+00 0.00000e+00 1.87990e+02 140.876 7.41684e+01 320.876 0.9556 
1 1 1 10  36  1  o 9  4.11320e+01 8.85457e-01 6.48948e+02 15.404  8.91786e+01  2.45707e+01  0.00000e+00 0.00000e+00 8.97897e+02 15.404  2.48948e+02 15.404  0.9946 
1 1 1 10  36  2  f 0  2.17564e+01 7.39001e-01 3.69418e+02 147.715 -2.63485e+01 1.66475e+01  0.00000e+00 0.00000e+00 4.40175e+02 147.715 7.07576e+01 147.715 0.9838 
1 1 1 10  36  3  o 3  2.39025e+01 7.51985e-01 3.57746e+02 19.285  3.51352e+01  1.22935e+01  0.00000e+00 0.00000e+00 5.34326e+02 19.285  1.76580e+02 19.285  0.9865 
1 1 1 10  36  4  o 10 6.01185e+00 1.45996e+00 1.40287e+02 275.386 3.24971e-01  -3.44667e+00 0.00000e+00 0.00000e+00 5.05973e+01 275.386 8.96899e+01 95.386  0.8391 
1 1 1 10  36  5  o 17 9.21753e+00 1.56592e+00 1.37572e+02 316.909 4.34839e+00  -4.06781e+00 0.00000e+00 0.00000e+00 1.80444e+02 316.909 4.28723e+01 316.909 0.9116 
1 1 1 10  36  6  o 19 9.10052e+00 2.36713e+00 1.09106e+02 19.710  3.82497e+00  1.37031e+00  0.00000e+00 0.00000e+00 1.89139e+02 19.710  8.00337e+01 19.710  0.8659 
1 1 1 10  36  7  o 14 1.59399e+01 1.49899e+00 2.85370e+02 58.443  1.54404e+01  2.51402e+01  0.00000e+00 0.00000e+00 3.07605e+02 58.443  2.22351e+01 58.443  0.9829 
1 1 1 10  36  8  o 11 6.91358e+00 1.60099e+00 2.03395e+02 165.147 -9.03215e+00 2.39533e+00  0.00000e+00 0.00000e+00 4.38305e+01 165.147 1.59564e+02 345.147 0.9449 
1 1 1 10  36  9  o 2  1.16007e+01 1.39802e+00 2.14337e+02 260.348 -3.38793e+00 -1.99214e+01 0.00000e+00 0.00000e+00 2.13645e+02 260.348 6.91734e-01 80.348  0.9749 
1 1 1 10  36  10 o 6  1.09899e+01 1.63193e+00 1.73547e+02 108.900 -5.21097e+00 1.52201e+01  0.00000e+00 0.00000e+00 2.29112e+02 108.900 5.55644e+01 108.900 0.9684 
1 1 1 10  36  11 o 13 6.81538e+00 1.71348e+00 1.84080e+02 257.282 -2.42723e+00 -1.07551e+01 0.00000e+00 0.00000e+00 6.17317e+01 257.282 1.22348e+02 77.282  0.9535 
1 1 1 10  36  12 o 8  6.91366e+00 1.84677e+00 1.05317e+02 174.238 -6.25361e+00 6.31033e-01  0.00000e+00 0.00000e+00 1.34308e+02 174.238 2.89908e+01 174.238 0.9166 
1 1 1 10  37  0  o 15 1.85107e+01 7.82112e-01 2.21090e+02 227.927 -9.60906e+00 -1.06447e+01 0.00000e+00 0.00000e+00 4.53651e+02 227.927 2.32562e+02 227.927 0.9645 
1 1 1 10  37  1  o 15 1.44400e+01 7.70225e-01 3.10411e+02 266.227 -1.00645e+00 -1.52634e+01 0.00000e+00 0.00000e+00 2.17379e+02 266.227 9.30318e+01 86.227  0.9667 
1 1 1 10  37  2  o 10 1.24539e+01 8.25507e-01 1.29554e+02 216.768 -5.43709e+00 -4.06273e+00 0.00000e+00 0.00000e+00 3.05219e+02 216.768 1.75664e+02 216.768 0.9231 
1 1 1 10  37  3  o 4  1.54164e+01 7.81323e-01 3.64016e+02 260.646 -3.94302e+00 -2.39366e+01 0.00000e+00 0.00000e+00 2.07025e+02 260.646 1.56990e+02 80.646  0.9792 
1 1 1 10  37  4  o 1  1.03103e+01 1.39388e+00 6.87886e+01 188.788 -3.10469e+00 -4.79992e-01 0.00000e+00 0.00000e+00 2.51070e+02 188.788 1.82281e+02 188.788 0.8199 
1 1 1 10  37  5  o 7  2.17500e+01 1.12672e+00 4.56788e+02 16.142  4.98949e+01  1.44414e+01  0.00000e+00 0.00000e+00 3.58298e+02 16.142  9.84899e+01 196.142 0.9903 
1 1 1 10  37  6  o 16 1.38764e+01 2.18401e+00 1.98430e+02 250.150 -4.17495e+00 -1.15646e+01 0.00000e+00 0.00000e+00 3.04874e+02 250.150 1.06443e+02 250.150 0.9584 
1 1 1 10  37  7  o 3  1.54778e+01 1.47175e+00 3.13334e+02 134.408 -2.21710e+01 2.26336e+01  0.00000e+00 0.00000e+00 2.63089e+02 134.408 5.02446e+01 314.408 0.9841 
1 1 1 10  37  8  f 0  4.51429e+00 1.32712e+00 5.98296e+01 309.584 1.32881e+00  -1.60714e+00 0.00000e+00 0.00000e+00 6.16816e+01 309.584 1.85196e+00 309.584 0.7113 
1 1 1 10  37  9  o 18 1.48963e+01 1.28279e+00 2.13133e+02 321.152 2.20349e+01  -1.77472e+01 0.00000e+00 0.00000e+00 3.40453e+02 321.152 1.27320e+02 321.152 0.9822 
1 1 1 10  37  10 o 10 8.92251e+00 1.71704e+00 9.20127e+01 272.216 2.46910e-01  -6.37958e+00 0.00000e+00 0.00000e+00 2.17836e+02 272.216 1.25823e+02 272.216 0.9179 
1 1 1 10  37  11 o 9  1.29263e+01 1.64233e+00 2.06343e+02 16.783  2.30165e+01  6.94174e+00  0.00000e+00 0.00000e+00 2.72275e+02 16.783  6.59317e+01 16.783  0.9790 
1 1 1 10  37  12 o 16 7.07234e+00 1.84549e+00 1.14974e+02 197.934 -6.43124e+00 -2.08142e+00 0.00000e+00 0.00000e+00 1.31776e+02 197.934 1.68026e+01 197.934 0.9227 
1 1 1 10  38  0  o 6  7.95600e+00 9.85815e-01 2.34760e+02 303.435 3.42694e+00  -5.19026e+00 0.00000e+00 0.00000e+00 4.05346e+01 303.435 1.94225e+02 123.435 0.9156 
1 1 1 10  38  1  o 6  2.88575e+01 7.24044e-01 4.39642e+02 185.631 -4.89961e+01 -4.83115e+00 0.00000e+00 0.00000e+00 6.40154e+02 185.631 2.00512e+02 185.631 0.9898 
1 1 1 10  38  2  o 8  2.52948e+01 8.08346e-01 4.01344e+02 57.230  2.30556e+01  3.58166e+01  0.00000e+00 0.00000e+00 5.43904e+02 57.230  1.42560e+02 57.230  0.9882 
1 1 1 10  38  3  o 13 1.35312e+01 8.39014e-01 2.10447e+02 349.853 1.25519e+01  -2.24635e+00 0.00000e+00 0.00000e+00 2.80876e+02 349.853 7.04282e+01 349.853 0.9600 
1 1 1 10  38  4  o 7  2.27827e+01 1.07048e+00 3.80673e+02 0.297   4.09922e+01  2.12157e-01  0.00000e+00 0.00000e+00 4.70676e+02 0.297   9.00029e+01 0.297   0.9877 
1 1 1 10  38  5  o 11 1.38738e+01 1.25549e+00 2.44687e+02 161.759 -1.64682e+01 5.42736e+00  0.00000e+00 0.00000e+00 2.64891e+02 161.759 2.02037e+01 161.759 0.9707 
1 1 1 10  38  6  o 16 1.68157e+01 1.46410e+00 4.78332e+02 39.634  3.70927e+01  3.07223e+01  0.00000e+00 0.00000e+00 1.51332e+02 39.634  3.27000e+02 219.634 0.9896 
1 1 1 10  38  7  o 15 1.09308e+01 1.69326e+00 2.58964e+02 142.769 -1.29967e+01 9.87620e+00  0.00000e+00 0.00000e+00 1.41783e+02 142.769 1.17180e+02 322.769 0.9689 
1 1 1 10  38  8  o 14 4.75542e+00 1.40019e+00 1.43041e+02 41.253  3.86980e+00  3.39403e+00  0.00000e+00 0.00000e+00 1.83061e+01 41.253  1.24734e+02 221.252 0.8967 
1 1 1 10  38  9  o 6  1.65119e+01 1.17390e+00 1.72679e+02 183.534 -2.65088e+01 -1.63709e+00 0.00000e+00 0.00000e+00 4.40152e+02 183.534 2.67473e+02 183.534 0.9810 
1 1 1 10  38  10 o 11 5.53956e+00 1.56121e+00 6.79142e+01 178.291 -3.36571e+00 1.00412e-01  0.00000e+00 0.00000e+00 1.06815e+02 178.291 3.89010e+01 178.291 0.8339 
1 1 1 10  38  11 o 3  8.02475e+00 1.77055e+00 6.92617e+01 271.300 1.05699e-01  -4.65668e+00 0.00000e+00 0.00000e+00 1.99254e+02 271.300 1.29993e+02 271.300 0.8848 
1 1 1 10  38  12 o 12 3.90547e+00 1.30993e+00 9.61775e+01 35.500  3.78124e+00  2.69712e+00  0.00000e+00 0.00000e+00 3.44109e+01 35.500  6.17666e+01 215.500 0.8844 
1 1 1 10  39  0  o 7  1.92410e+01 7.73966e-01 1.27915e+02 151.446 -8.33945e+00 4.53810e+00  0.00000e+00 0.00000e+00 5.59700e+02 151.446 4.31785e+02 151.446 0.9458 
1 1 1 10  39  1  o 8  1.55295e+01 7.05485e-01 2.57344e+02 180.877 -1.70395e+01 -2.60946e-01 0.00000e+00 0.00000e+00 3.12182e+02 180.877 5.48386e+01 180.877 0.9702 
1 1 1 10  39  2  o 10 2.10510e+01 7.20169e-01 2.32795e+02 352.611 2.12059e+01  -2.74999e+00 0.00000e+00 0.00000e+00 5.44342e+02 352.611 3.11547e+02 352.611 0.9763 
1 1 1 10  39  3  o 7  1.23190e+01 1.19200e+00 2.14887e+02 214.346 -9.68930e+00 -6.62097e+00 0.00000e+00 0.00000e+00 2.30719e+02 214.346 1.58318e+01 214.346 0.9564 
1 1 1 10  39  4  f 0  1.08201e+01 1.39863e+00 1.71351e+02 15.874  8.35291e+00  2.37536e+00  0.00000e+00 0.00000e+00 2.13614e+02 15.874  4.22629e+01 15.874  0.9405 
1 1 1 10  39  5  o 17 1.28949e+01 1.34967e+00 2.08014e+02 99.429  -2.31339e+00 1.39310e+01  0.00000e+00 0.00000e+00 2.62242e+02 99.429  5.42278e+01 99.429  0.9639 
1 1 1 10  39  6  o 7  6.63251e+00 1.74855e+00 4.06926e+01 343.616 1.40993e+00  -4.14530e-01 0.00000e+00 0.00000e+00 1.06997e+02 343.616 6.63046e+01 343.616 0.5885 
1 1 1 10  39  7  o 1  6.16895e+00 1.46396e+00 3.55156e+01 263.970 -1.54160e-01 -1.45934e+00 0.00000e+00 0.00000e+00 1.01726e+02 263.970 6.62103e+01 263.970 0.5880 
1 1 1 10  39  8  o 1  5.38518e+00 1.25994e+00 6.34942e+01 9.069   2.69514e+00  4.30206e-01  0.00000e+00 0.00000e+00 9.70129e+01 9.069   3.35187e+01 9.069   0.7878 
1 1 1 10  39  9  o 13 1.15005e+01 1.41196e+00 2.03888e+02 269.915 -2.77513e-02 -1.87572e+01 0.00000e+00 0.00000e+00 2.19410e+02 269.915 1.55216e+01 269.915 0.9730 
1 1 1 10  39  10 o 7  6.47493e+00 1.63251e+00 1.97623e+02 102.879 -2.38987e+00 1.04521e+01  0.00000e+00 0.00000e+00 3.55614e+01 102.879 1.62061e+02 282.879 0.9522 
1 1 1 10  39  11 o 11 1.37878e+01 1.53422e+00 2.39536e+02 259.586 -5.64278e+00 -3.07040e+01 0.00000e+00 0.00000e+00 2.73416e+02 259.586 3.38801e+01 259.586 0.9839 
1 1 1 10  39  12 o 10 5.06231e+00 1.57201e+00 9.32803e+01 54.222  2.89852e+00  4.02223e+00  0.00000e+00 0.00000e+00 7.74958e+01 54.222  1.57844e+01 234.223 0.8924 
1 1 1 10  40  0  o 11 1.87695e+01 6.73000e-01 3.89853e+02 2.836   3.12578e+01  1.54861e+00  0.00000e+00 0.00000e+00 3.07873e+02 2.836   8.19802e+01 182.836 0.9839 
1 1 1 10  40  1  o 2  2.04549e+01 6.99877e-01 3.02033e+02 101.469 -5.21490e+00 2.57041e+01  0.00000e+00 0.00000e+00 4.56197e+02 101.469 1.54164e+02 101.469 0.9807 
1 1 1 10  40  2  f 0  1.09349e+01 9.02491e-01 1.97583e+02 270.255 4.28010e-02  -9.60448e+00 0.00000e+00 0.00000e+00 1.93688e+02 270.255 3.89497e+00 90.255  0.9464 
1 1 1 10  40  3  o 19 5.38963e+00 1.36031e+00 5.39494e+01 265.398 -9.76814e-02 -1.21345e+00 0.00000e+00 0.00000e+00 5.16566e+01 265.398 2.29285e+00 85.398  0.5181 
1 1 1 10  40  4  o 13 1.41211e+01 1.19054e+00 1.14497e+02 258.066 -1.78987e+00 -8.46849e+00 0.00000e+00 0.00000e+00 3.87750e+02 258.066 2.73254e+02 258.066 0.9403 
1 1 1 10  40  5  o 19 1.00391e+01 1.52162e+00 2.35793e+02 200.029 -1.13354e+01 -4.13232e+00 0.00000e+00 0.00000e+00 1.27884e+02 200.029 1.07909e+02 20.029  0.9576 
1 1 1 10  40  6  o 9  1.60651e+01 1.52671e+00 2.10154e+02 263.759 -2.12611e+00 -1.94404e+01 0.00000e+00 0.00000e+00 3.81868e+02 263.759 1.71714e+02 263.759 0.9741 
1 1 1 10  40  7  o 7  2.18321e+01 9.61654e-01 3.52858e+02 327.197 5.18593e+01  -3.34250e+01 0.00000e+00 0.00000e+00 4.66374e+02 327.197 1.13516e+02 327.197 0.9919 
1 1 1 10  40  8  o 6  7.68376e+00 1.46843e+00 1.68837e+02 189.536 -9.40471e+00 -1.57991e+00 0.00000e+00 0.00000e+00 1.06148e+02 189.536 6.26892e+01 9.536   0.9460 
1 1 1 10  40  9  o 9  8.11198e+00 1.62506e+00 1.78342e+02 72.324  3.38375e+00  1.06178e+01  0.00000e+00 0.00000e+00 1.14389e+02 72.324  6.39534e+01 252.324 0.9540 
1 1 1 10  40  10 o 11 6.70577e+00 1.56099e+00 1.03804e+02 279.360 1.02904e+00  -6.24307e+00 0.00000e+00 0.00000e+00 1.28792e+02 279.360 2.49878e+01 279.360 0.9172 
1 1 1 10  40  11 o 18 9.31660e+00 1.79462e+00 7.90454e+01 226.956 -4.43041e+00 -4.74378e+00 0.00000e+00 0.00000e+00 2.44810e+02 226.956 1.65765e+02 226.956 0.9194 
1 1 1 10  40  12 o 6  5.64232e+00 1.67651e+00 5.20676e+01 113.153 -1.08345e+00 2.53362e+00  0.00000e+00 0.00000e+00 1.16449e+02 113.153 6.43816e+01 113.153 0.7902 
1 1 1 10  41  0  o 9  1.21930e+01 7.55256e-01 1.53813e+02 248.140 -2.94336e+00 -7.33665e+00 0.00000e+00 0.00000e+00 2.76604e+02 248.140 1.22790e+02 248.140 0.9344 
1 1 1 10  41  1  o 7  1.19349e+01 7.97290e-01 1.44667e+02 304.501 4.22066e+00  -6.14092e+00 0.00000e+00 0.00000e+00 2.74916e+02 304.501 1.30249e+02 304.501 0.9303 
1 1 1 10  41  2  o 10 1.57203e+01 8.53206e-01 2.20706e+02 235.831 -9.18214e+00 -1.35268e+01 0.00000e+00 0.00000e+00 3.55105e+02 235.831 1.34398e+02 235.831 0.9689 
1 1 1 10  41  3  o 8  1.06735e+01 1.27875e+00 1.79933e+02 193.439 -8.46873e+00 -2.02364e+00 0.00000e+00 0.00000e+00 1.99727e+02 193.439 1.97943e+01 193.439 0.9407 
1 1 1 10  41  4  o 12 1.33320e+01 1.18080e+00 2.24726e+02 141.764 -1.21586e+01 9.58042e+00  0.00000e+00 0.00000e+00 2.62925e+02 141.764 3.81992e+01 141.764 0.9671 
1 1 1 10  41  5  o 5  8.23141e+00 1.67205e+00 1.12449e+02 349.897 4.76479e+00  -8.48989e-01 0.00000e+00 0.00000e+00 1.64510e+02 349.897 5.20614e+01 349.897 0.8895 
1 1 1 10  41  6  o 18 8.96668e+00 1.81924e+00 1.30802e+02 118.523 -3.04204e+00 5.59732e+00  0.00000e+00 0.00000e+00 1.80490e+02 118.523 4.96885e+01 118.523 0.9178 
1 1 1 10  41  7  o 9  1.46430e+01 1.15987e+00 2.22072e+02 232.946 -1.53993e+01 -2.03956e+01 0.00000e+00 0.00000e+00 3.20894e+02 232.946 9.88213e+01 232.946 0.9802 
1 1 1 10  41  8  o 16 4.96656e+00 1.40539e+00 8.69000e+01 133.120 -2.40526e+00 2.56850e+00  0.00000e+00 0.00000e+00 7.12970e+01 133.120 1.56030e+01 313.120 0.8421 
1 1 1 10  41  9  o 12 1.88729e+01 1.15851e+00 2.99400e+02 28.641  4.90274e+01  2.67760e+01  0.00000e+00 0.00000e+00 4.07978e+02 28.641  1.08579e+02 28.641  0.9910 
1 1 1 10  41  10 o 2  1.71417e+01 1.31800e+00 2.95484e+02 288.059 1.62869e+01  -4.99503e+01 0.00000e+00 0.00000e+00 3.46525e+02 288.059 5.10409e+01 288.059 0.9904 
1 1 1 10  41  11 o 9  6.52445e+00 1.72601e+00 1.38928e+02 185.425 -8.16531e+00 -7.75454e-01 0.00000e+00 0.00000e+00 9.21666e+01 185.425 4.67619e+01 5.425   0.9369 
1 1 1 10  41  12 o 4  8.63940e+00 1.82809e+00 2.21545e+02 336.733 1.59133e+01  -6.84242e+00 0.00000e+00 0.00000e+00 9.54050e+01 336.733 1.26140e+02 156.733 0.9707 
1 1 1 10  42  0  o 17 9.23392e+00 9.46798e-01 9.40413e+01 277.299 4.65897e-01  -3.63725e+00 0.00000e+00 0.00000e+00 2.02217e+02 277.299 1.08176e+02 277.299 0.8494 
1 1 1 10  42  1  o 9  1.54745e+01 7.89830e-01 2.41256e+02 178.134 -1.68272e+01 5.48238e-01  0.00000e+00 0.00000e+00 3.25847e+02 178.134 8.45911e+01 178.134 0.9698 
1 1 1 10  42  2  o 14 2.59824e+01 8.27483e-01 4.52121e+02 113.759 -2.18667e+01 4.96748e+01  0.00000e+00 0.00000e+00 5.20906e+02 113.759 6.87846e+01 113.759 0.9907 
1 1 1 10  42  3  o 12 7.97725e+00 1.43508e+00 1.54797e+02 0.187   5.73499e+00  1.87162e-02  0.00000e+00 0.00000e+00 1.19075e+02 0.187   3.57216e+01 180.187 0.9080 
1 1 1 10  42  4  o 4  3.80208e+01 1.22599e+00 6.87540e+02 101.309 -2.63669e+01 1.31850e+02  0.00000e+00 0.00000e+00 7.44893e+02 101.309 5.73532e+01 101.309 0.9963 
1 1 1 10  42  5  o 7  1.28258e+01 1.44074e+00 2.28903e+02 336.310 1.55367e+01  -6.81679e+00 0.00000e+00 0.00000e+00 2.41658e+02 336.310 1.27550e+01 336.310 0.9701 
1 1 1 10  42  6  o 19 1.39169e+01 1.38859e+00 3.32638e+02 221.698 -2.33140e+01 -2.07705e+01 0.00000e+00 0.00000e+00 1.85246e+02 221.698 1.47391e+02 41.698  0.9839 
1 1 1 10  42  7  o 4  7.83280e+00 1.34738e+00 1.02865e+02 113.722 -2.37744e+00 5.41038e+00  0.00000e+00 0.00000e+00 1.67011e+02 113.722 6.41457e+01 113.722 0.9109 
1 1 1 10  42  8  o 2  8.49349e+00 1.41449e+00 1.11410e+02 133.594 -5.22535e+00 5.48830e+00  0.00000e+00 0.00000e+00 1.87811e+02 133.594 7.64008e+01 133.594 0.9315 
1 1 1 10  42  9  o 10 5.03639e+00 1.43706e+00 9.75097e+01 55.765  2.50206e+00  3.67682e+00  0.00000e+00 0.00000e+00 6.98607e+01 55.765  2.76489e+01 235.765 0.8788 
1 1 1 10  42  10 o 12 1.25960e+01 1.43919e+00 2.63992e+02 244.279 -1.44157e+01 -2.99257e+01 0.00000e+00 0.00000e+00 2.05044e+02 244.279 5.89478e+01 64.279  0.9848 
1 1 1 10  42  11 o 12 8.72950e+00 1.68656e+00 1.18939e+02 142.500 -7.65551e+00 5.87422e+00  0.00000e+00 0.00000e+00 1.93450e+02 142.500 7.45107e+01 142.500 0.9467 
1 1 1 10  42  12 o 2  4.72781e+00 1.50290e+00 5.06854e+01 228.231 -1.69976e+00 -1.90316e+00 0.00000e+00 0.00000e+00 8.69760e+01 228.231 3.62906e+01 228.231 0.7705 
1 1 1 10  43  0  o 13 3.65591e+01 8.95317e-01 6.21852e+02 36.118  8.15102e+01  5.94774e+01  0.00000e+00 0.00000e+00 7.52090e+02 36.118  1.30239e+02 36.118  0.9950 
1 1 1 10  43  1  o 19 1.17213e+01 8.28239e-01 2.63190e+02 339.832 1.36750e+01  -5.02280e+00 0.00000e+00 0.00000e+00 1.64195e+02 339.832 9.89952e+01 159.832 0.9650 
1 1 1 10  43  2  o 4  1.48740e+01 9.30728e-01 3.03317e+02 39.275  1.69776e+01  1.38838e+01  0.00000e+00 0.00000e+00 2.45875e+02 39.275  5.74429e+01 219.275 0.9769 
1 1 1 10  43  3  o 2  1.17613e+01 1.25553e+00 2.33645e+02 100.186 -2.56115e+00 1.42545e+01  0.00000e+00 0.00000e+00 1.95347e+02 100.186 3.82976e+01 280.186 0.9648 
1 1 1 10  43  4  o 10 1.06401e+01 1.15449e+00 1.67518e+02 273.849 6.61996e-01  -9.83830e+00 0.00000e+00 0.00000e+00 2.13818e+02 273.849 4.63000e+01 273.849 0.9479 
1 1 1 10  43  5  o 18 2.39653e+01 1.26047e+00 4.24238e+02 59.897  3.25554e+01  5.61535e+01  0.00000e+00 0.00000e+00 4.75034e+02 59.897  5.07958e+01 59.897  0.9923 
1 1 1 10  43  6  o 3  1.56862e+01 1.46329e+00 3.09545e+02 183.560 -3.03949e+01 -1.89109e+00 0.00000e+00 0.00000e+00 2.73865e+02 183.560 3.56804e+01 3.560   0.9834 
1 1 1 10  43  7  o 12 1.12274e+01 1.20403e+00 1.99202e+02 137.765 -1.27805e+01 1.16029e+01  0.00000e+00 0.00000e+00 2.12919e+02 137.765 1.37172e+01 137.765 0.9706 
1 1 1 10  43  8  o 3  8.53802e+00 1.35144e+00 1.50595e+02 359.384 1.09506e+01  -1.17683e-01 0.00000e+00 0.00000e+00 1.57173e+02 359.384 6.57849e+00 359.384 0.9532 
1 1 1 10  43  9  o 12 8.84302e+00 1.51441e+00 1.48181e+02 233.438 -7.00981e+00 -9.45185e+00 0.00000e+00 0.00000e+00 1.71657e+02 233.438 2.34761e+01 233.438 0.9565 
1 1 1 10  43  10 o 18 1.16333e+01 1.51597e+00 2.28608e+02 218.585 -1.92106e+01 -1.53276e+01 0.00000e+00 0.00000e+00 2.02157e+02 218.585 2.64512e+01 38.585  0.9794 
1 1 1 10  43  11 o 12 4.08271e+00 1.32132e+00 6.02618e+01 151.563 -2.47601e+00 1.34083e+00  0.00000e+00 0.00000e+00 6.24768e+01 151.563 2.21496e+00 151.563 0.7954 
1 1 1 10  43  12 o 13 4.10897e+00 1.34707e+00 7.82088e+01 213.399 -3.32337e+00 -2.19126e+00 0.00000e+00 0.00000e+00 5.57458e+01 213.399 2.24630e+01 33.399  0.8628 
1 1 1 10  44  0  o 12 1.29722e+01 8.27272e-01 2.07343e+02 162.422 -1.21001e+01 3.83332e+00  0.00000e+00 0.00000e+00 2.62833e+02 162.422 5.54898e+01 162.422 0.9598 
1 1 1 10  44  1  o 16 1.80037e+01 7.82152e-01 2.60460e+02 13.542  2.11496e+01  5.09385e+00  0.00000e+00 0.00000e+00 4.03874e+02 13.542  1.43415e+02 13.542  0.9767 
1 1 1 10  44  2  o 6  1.05139e+01 1.20479e+00 2.02734e+02 295.463 4.50034e+00  -9.45091e+00 0.00000e+00 0.00000e+00 1.75106e+02 295.463 2.76273e+01 115.463 0.9510 
1 1 1 10  44  3  o 9  1.85524e+01 1.01590e+00 2.83056e+02 7.222   2.79078e+01  3.53623e+00  0.00000e+00 0.00000e+00 4.05642e+02 7.222   1.22586e+02 7.222   0.9821 
1 1 1 10  44  4  o 10 1.55063e+01 1.29378e+00 2.34693e+02 317.506 1.45693e+01  -1.33473e+01 0.00000e+00 0.00000e+00 3.36522e+02 317.506 1.01829e+02 317.506 0.9744 
1 1 1 10  44  5  o 2  1.84613e+01 1.21771e+00 4.20772e+02 138.859 -3.79820e+01 3.31811e+01  0.00000e+00 0.00000e+00 2.70326e+02 138.859 1.50446e+02 318.859 0.9900 
1 1 1 10  44  6  o 13 9.98165e+00 1.08971e+00 2.25474e+02 247.813 -6.48376e+00 -1.58987e+01 0.00000e+00 0.00000e+00 1.40814e+02 247.813 8.46594e+01 67.813  0.9704 
1 1 1 10  44  7  o 19 3.78192e+00 1.16069e+00 6.38971e+01 130.970 -1.29975e+00 1.49676e+00  0.00000e+00 0.00000e+00 3.54748e+01 130.970 2.84223e+01 310.970 0.6949 
1 1 1 10  44  8  o 13 1.39925e+01 1.21807e+00 2.06243e+02 287.933 7.77121e+00  -2.40131e+01 0.00000e+00 0.00000e+00 3.12259e+02 287.933 1.06016e+02 287.933 0.9800 
1 1 1 10  44  9  o 7  5.95048e+00 1.54457e+00 7.84397e+01 156.311 -3.77209e+00 1.65494e+00  0.00000e+00 0.00000e+00 1.16829e+02 156.311 3.83895e+01 156.311 0.8680 
1 1 1 10  44  10 o 2  7.33773e+00 1.58152e+00 1.34794e+02 309.822 5.78264e+00  -6.93523e+00 0.00000e+00 0.00000e+00 1.26740e+02 309.822 8.05444e+00 129.822 0.9429 
1 1 1 10  44  11 o 10 3.37069e+00 1.14664e+00 7.42988e+01 160.843 -2.99757e+00 1.04136e+00  0.00000e+00 0.00000e+00 3.04156e+01 160.843 4.38831e+01 340.843 0.8220 
1 1 1 10  44  12 o 8  5.59253e+00 1.61650e+00 8.05693e+01 66.073  1.90216e+00  4.28695e+00  0.00000e+00 0.00000e+00 1.06563e+02 66.073  2.59939e+01 66.073  0.8857 
1 1 1 10  45  0  o 12 4.05960e+01 9.43904e-01 6.01062e+02 41.867  8.21930e+01  7.36630e+01  0.00000e+00 0.00000e+00 9.24879e+02 41.867  3.23817e+02 41.867  0.9955 
1 1 1 10  45  1  o 18 2.55842e+01 7.90736e-01 4.25861e+02 351.635 5.34474e+01  -7.85940e+00 0.00000e+00 0.00000e+00 5.31568e+02 351.635 1.05706e+02 351.635 0.9907 
1 1 1 10  45  2  o 12 1.55926e+01 1.05994e+00 2.38071e+02 231.534 -1.27545e+01 -1.60542e+01 0.00000e+00 0.00000e+00 3.36557e+02 231.534 9.84857e+01 231.534 0.9753 
1 1 1 10  45  3  o 6  1.66092e+01 1.05821e+00 2.73398e+02 124.947 -1.38940e+01 1.98817e+01  0.00000e+00 0.00000e+00 3.41269e+02 124.947 6.78711e+01 124.947 0.9792 
1 1 1 10  45  4  o 7  2.65572e+01 1.63230e+00 4.50727e+02 271.181 1.30586e+00  -6.33501e+01 0.00000e+00 0.00000e+00 5.45244e+02 271.181 9.45166e+01 271.181 0.9921 
1 1 1 10  45  5  o 19 1.75519e+01 1.59336e+00 2.46563e+02 133.564 -1.68671e+01 1.77342e+01  0.00000e+00 0.00000e+00 4.03325e+02 133.564 1.56763e+02 133.564 0.9794 
1 1 1 10  45  6  o 12 2.61045e+01 9.19636e-01 4.61279e+02 74.384  2.62928e+01  9.40682e+01  0.00000e+00 0.00000e+00 5.20660e+02 74.384  5.93805e+01 74.384  0.9949 
1 1 1 10  45  7  o 2  8.10123e+00 1.37513e+00 1.51947e+02 310.748 6.13233e+00  -7.11753e+00 0.00000e+00 0.00000e+00 1.37568e+02 310.748 1.43796e+01 130.748 0.9452 
1 1 1 10  45  8  o 19 8.78927e+00 1.44891e+00 1.10817e+02 21.695  7.47809e+00  2.97510e+00  0.00000e+00 0.00000e+00 2.00099e+02 21.695  8.92829e+01 21.695  0.9356 
1 1 1 10  45  9  o 15 3.88118e+00 1.23346e+00 6.09487e+01 280.707 4.32346e-01  -2.28650e+00 0.00000e+00 0.00000e+00 4.83294e+01 280.707 1.26193e+01 100.707 0.7448 
1 1 1 10  45  10 o 2  3.53650e+00 1.16485e+00 4.75102e+01 116.852 -9.03800e-01 1.78520e+00  0.00000e+00 0.00000e+00 4.57809e+01 116.852 1.72935e+00 296.852 0.6979 
1 1 1 10  45  11 o 15 4.51104e+00 1.36882e+00 4.13772e+01 134.565 -1.46347e+00 1.48585e+00  0.00000e+00 0.00000e+00 7.98783e+01 134.565 3.85011e+01 134.565 0.7113 
1 1 1 10  45  12 o 2  7.30069e+00 1.81854e+00 1.50426e+02 73.614  2.87092e+00  9.76352e+00  0.00000e+00 0.00000e+00 1.11445e+02 73.614  3.89811e+01 253.614 0.9495 
1 1 1 10  46  0  o 15 1.24173e+01 8.20608e-01 2.44413e+02 227.372 -1.01320e+01 -1.10079e+01 0.00000e+00 0.00000e+00 2.08455e+02 227.372 3.59581e+01 47.372  0.9660 
1 1 1 10  46  1  o 7  2.12390e+01 7.83556e-01 2.40354e+02 188.303 -2.68327e+01 -3.91575e+00 0.00000e+00 0.00000e+00 5.46895e+02 188.303 3.06541e+02 188.303 0.9814 
1 1 1 10  46  2  o 18 2.83274e+01 1.03760e+00 4.52270e+02 36.854  5.47086e+01  4.10083e+01  0.00000e+00 0.00000e+00 6.10112e+02 36.854  1.57841e+02 36.854  0.9927 
1 1 1 10  46  3  f 0  2.57425e+01 1.04974e+00 4.02141e+02 304.927 3.35847e+01  -4.80940e+01 0.00000e+00 0.00000e+00 5.62352e+02 304.927 1.60210e+02 304.927 0.9914 
1 1 1 10  46  4  o 11 1.29229e+01 1.30778e+00 1.95444e+02 162.443 -1.44793e+01 4.58111e+00  0.00000e+00 0.00000e+00 2.76646e+02 162.443 8.12025e+01 162.443 0.9665 
1 1 1 10  46  5  o 10 1.94464e+01 1.22871e+00 3.19963e+02 56.810  2.26591e+01  3.46394e+01  0.00000e+00 0.00000e+00 4.06223e+02 56.810  8.62592e+01 56.810  0.9878 
1 1 1 10  46  6  f 0  9.93984e+00 1.17395e+00 1.88378e+02 328.941 1.25501e+01  -7.55855e+00 0.00000e+00 0.00000e+00 1.74338e+02 328.941 1.40398e+01 148.941 0.9652 
1 1 1 10  46  7  o 17 1.55533e+01 1.05012e+00 2.59420e+02 123.141 -1.89924e+01 2.90889e+01  0.00000e+00 0.00000e+00 3.20049e+02 123.141 6.06283e+01 123.141 0.9855 
1 1 1 10  46  8  o 11 3.45482e+00 1.14018e+00 5.18841e+01 254.383 -4.30966e-01 -1.54175e+00 0.00000e+00 0.00000e+00 2.91021e+01 254.383 2.27820e+01 74.383  0.6201 
1 1 1 10  46  9  o 13 1.89681e+01 1.08578e+00 3.77212e+02 150.175 -7.05322e+01 4.04345e+01  0.00000e+00 0.00000e+00 3.35334e+02 150.175 4.18772e+01 330.175 0.9938 
1 1 1 10  46  10 o 4  3.47920e+00 1.14430e+00 3.05698e+01 13.664  1.21901e+00  2.96350e-01  0.00000e+00 0.00000e+00 3.90314e+01 13.664  8.46158e+00 13.664  0.5293 
1 1 1 10  46  11 o 17 4.20932e+00 1.31629e+00 7.36595e+01 178.781 -3.68162e+00 7.83394e-02  0.00000e+00 0.00000e+00 6.15405e+01 178.781 1.21190e+01 358.781 0.8501 
1 1 1 10  46  12 o 5  9.02172e+00 1.77709e+00 2.00499e+02 359.252 1.74720e+01  -2.28204e-01 0.00000e+00 0.00000e+00 1.30368e+02 359.252 7.01308e+01 179.252 0.9710 
1 1 1 10  47  0  o 10 1.46716e+01 7.72170e-01 2.43609e+02 329.168 1.63111e+01  -9.73554e+00 0.00000e+00 0.00000e+00 2.95466e+02 329.168 5.18570e+01 329.168 0.9733 
1 1 1 10  47  1  o 5  1.72248e+01 7.75899e-01 3.02528e+02 286.237 8.49006e+00  -2.91525e+01 0.00000e+00 0.00000e+00 3.37154e+02 286.237 3.46256e+01 286.237 0.9834 
1 1 1 10  47  2  o 11 4.99472e+00 1.26369e+00 9.38592e+01 87.178  1.17636e-01  2.38678e+00  0.00000e+00 0.00000e+00 4.81133e+01 87.178  4.57460e+01 267.178 0.7524 
1 1 1 10  47  3  f 0  2.51706e+01 1.05052e+00 4.29853e+02 69.477  2.18600e+01  5.83953e+01  0.00000e+00 0.00000e+00 5.13579e+02 69.477  8.37261e+01 69.477  0.9919 
1 1 1 10  47  4  o 19 1.12764e+01 1.15092e+00 2.02539e+02 266.600 -8.91933e-01 -1.50109e+01 0.00000e+00 0.00000e+00 2.09205e+02 266.600 6.66558e+00 266.600 0.9662 
1 1 1 10  47  6  o 12 1.01022e+01 1.10904e+00 2.21321e+02 108.778 -5.74506e+00 1.68972e+01  0.00000e+00 0.00000e+00 1.49688e+02 108.778 7.16330e+01 288.778 0.9716 
1 1 1 10  47  7  o 15 4.36525e+00 1.26961e+00 3.94911e+01 209.503 -1.29514e+00 -7.32857e-01 0.00000e+00 0.00000e+00 5.83884e+01 209.503 1.88974e+01 209.503 0.5932 
1 1 1 10  47  8  o 3  6.72271e+00 1.47100e+00 9.45221e+01 141.094 -4.24207e+00 3.42367e+00  0.00000e+00 0.00000e+00 1.34910e+02 141.094 4.03875e+01 141.094 0.9029 
1 1 1 10  47  9  o 13 5.03940e+00 1.34782e+00 8.81809e+01 270.389 2.91805e-02  -4.29721e+00 0.00000e+00 0.00000e+00 7.82905e+01 270.389 9.89045e+00 90.389  0.8741 
1 1 1 10  47  10 o 11 1.22797e+01 1.38433e+00 2.09244e+02 28.596  2.31370e+01  1.26124e+01  0.00000e+00 0.00000e+00 2.45881e+02 28.596  3.66361e+01 28.596  0.9808 
1 1 1 10  47  11 o 3  6.73826e+00 1.45742e+00 9.48155e+01 356.513 6.63043e+00  -4.04052e-01 0.00000e+00 0.00000e+00 1.39713e+02 356.513 4.48976e+01 356.513 0.9213 
1 1 1 10  47  12 o 2  4.55421e+00 1.41821e+00 2.30061e+01 14.230  1.27912e+00  3.24391e-01  0.00000e+00 0.00000e+00 7.12966e+01 14.230  4.82905e+01 14.230  0.5483 
1 1 1 10  48  0  o 15 2.45779e+01 7.61488e-01 4.32494e+02 272.516 2.62294e+00  -5.96949e+01 0.00000e+00 0.00000e+00 4.87416e+02 272.516 5.49220e+01 272.516 0.9916 
1 1 1 10  48  1  f 0  3.54265e+01 1.12557e+00 6.25320e+02 73.445  3.29601e+01  1.10880e+02  0.00000e+00 0.00000e+00 7.06573e+02 73.445  8.12530e+01 73.445  0.9957 
1 1 1 10  48  2  o 17 1.90020e+01 1.02105e+00 3.98774e+02 53.946  2.54388e+01  3.49439e+01  0.00000e+00 0.00000e+00 3.10606e+02 53.946  8.81679e+01 233.946 0.9884 
1 1 1 10  48  3  o 16 3.55617e+00 1.07242e+00 5.09904e+01 317.018 8.26832e-01  -7.70537e-01 0.00000e+00 0.00000e+00 1.49279e+01 317.018 3.60625e+01 137.018 0.4906 
1 1 1 10  48  4  o 5  1.08684e+01 1.33058e+00 1.81607e+02 317.026 8.91266e+00  -8.30369e+00 0.00000e+00 0.00000e+00 2.11850e+02 317.026 3.02430e+01 317.026 0.9580 
1 1 1 10  48  5  o 2  1.50355e+01 1.17686e+00 2.16669e+02 254.616 -5.93807e+00 -2.15809e+01 0.00000e+00 0.00000e+00 3.38722e+02 254.616 1.22053e+02 254.616 0.9774 
1 1 1 10  48  6  o 19 1.27878e+01 9.81705e-01 2.72934e+02 87.734  1.14587e+00  2.89598e+01  0.00000e+00 0.00000e+00 2.01971e+02 87.734  7.09624e+01 267.734 0.9826 
1 1 1 10  48  7  o 15 6.03326e+00 1.42681e+00 7.17929e+01 341.164 3.38139e+00  -1.15352e+00 0.00000e+00 0.00000e+00 1.20850e+02 341.164 4.90571e+01 341.164 0.8448 
1 1 1 10  48  8  o 7  6.99189e+00 1.44602e+00 9.03850e+01 7.501   5.65196e+00  7.44177e-01  0.00000e+00 0.00000e+00 1.49404e+02 7.501   5.90193e+01 7.501   0.9074 
1 1 1 10  48  9  o 15 8.69388e+00 1.47915e+00 1.67275e+02 61.074  6.70462e+00  1.21322e+01  0.00000e+00 0.00000e+00 1.49177e+02 61.074  1.80976e+01 241.074 0.9632 
1 1 1 10  48  10 o 14 7.75417e+00 1.57670e+00 1.42761e+02 344.820 1.07303e+01  -2.91138e+00 0.00000e+00 0.00000e+00 1.36706e+02 344.820 6.05528e+00 164.820 0.9539 
1 1 1 10  48  11 o 1  6.13205e+00 1.65312e+00 9.74737e+01 267.260 -2.72059e-01 -5.68482e+00 0.00000e+00 0.00000e+00 1.12677e+02 267.260 1.52037e+01 267.260 0.9073 
1 1 1 10  48  12 o 10 8.96996e+00 1.85556e+00 8.49889e+01 127.831 -4.25647e+00 5.48129e+00  0.00000e+00 0.00000e+00 2.28281e+02 127.831 1.43292e+02 127.831 0.9249 
1 1 1 10  49  0  o 1  1.56419e+01 7.61191e-01 2.95952e+02 203.147 -2.40543e+01 -1.02835e+01 0.00000e+00 0.00000e+00 2.82986e+02 203.147 1.29662e+01 23.147  0.9807 
1 1 1 10  49  1  o 17 1.21420e+01 1.06547e+00 2.21372e+02 139.188 -1.15064e+01 9.93621e+00  0.00000e+00 0.00000e+00 2.21700e+02 139.188 3.28058e-01 139.188 0.9665 
1 1 1 10  49  2  o 2  8.37174e+00 1.21149e+00 1.51456e+02 232.277 -4.30054e+00 -5.55965e+00 0.00000e+00 0.00000e+00 1.41270e+02 232.277 1.01853e+01 52.277  0.9259 
1 1 1 10  49  3  o 17 1.42663e+01 1.09768e+00 2.53243e+02 205.532 -2.18450e+01 -1.04343e+01 0.00000e+00 0.00000e+00 2.74428e+02 205.532 2.11850e+01 205.532 0.9791 
1 1 1 10  49  4  o 7  1.31209e+01 1.24091e+00 2.80055e+02 13.378  2.37168e+01  5.64070e+00  0.00000e+00 0.00000e+00 2.05413e+02 13.378  7.46417e+01 193.378 0.9793 
1 1 1 10  49  5  o 5  1.33776e+01 9.73720e-01 2.69823e+02 123.517 -1.59203e+01 2.40370e+01  0.00000e+00 0.00000e+00 2.26840e+02 123.517 4.29825e+01 303.517 0.9825 
1 1 1 10  49  6  o 10 1.14290e+01 1.03700e+00 2.61236e+02 295.979 1.11930e+01  -2.29707e+01 0.00000e+00 0.00000e+00 1.62132e+02 295.979 9.91038e+01 115.979 0.9802 
1 1 1 10  49  7  o 8  9.84452e+00 1.34296e+00 1.53459e+02 127.407 -7.63088e+00 9.97817e+00  0.00000e+00 0.00000e+00 2.03440e+02 127.407 4.99813e+01 127.407 0.9593 
1 1 1 10  49  8  o 15 4.30416e+00 1.23672e+00 1.17228e+02 306.612 3.10619e+00  -4.18070e+00 0.00000e+00 0.00000e+00 2.88294e+01 306.612 8.83984e+01 126.612 0.8980 
1 1 1 10  49  9  o 3  4.63106e+00 1.35962e+00 8.06608e+01 247.284 -1.50412e+00 -3.59291e+00 0.00000e+00 0.00000e+00 6.97103e+01 247.284 1.09505e+01 67.284  0.8594 
1 1 1 10  49  10 o 2  1.50034e+01 1.20236e+00 2.34921e+02 316.943 3.15770e+01  -2.95042e+01 0.00000e+00 0.00000e+00 3.25270e+02 316.943 9.03493e+01 316.943 0.9884 
1 1 1 10  49  11 o 15 4.16897e+00 1.32702e+00 6.24781e+01 239.728 -1.62988e+00 -2.79237e+00 0.00000e+00 0.00000e+00 6.75562e+01 239.728 5.07804e+00 239.728 0.8259 
1 1 1 10  49  12 o 15 5.91846e+00 1.66739e+00 1.04859e+02 219.003 -5.01697e+00 -4.06313e+00 0.00000e+00 0.00000e+00 1.00482e+02 219.003 4.37717e+00 39.003  0.9189 
1 1 1 10  50  0  o 19 9.53447e+00 8.36930e-01 8.75143e+01 240.314 -2.44744e+00 -4.29322e+00 0.00000e+00 0.00000e+00 2.33421e+02 240.314 1.45907e+02 240.314 0.8920 
1 1 1 10  50  1  o 13 9.73063e+00 1.03820e+00 1.20198e+02 339.577 6.34270e+00  -2.36177e+00 0.00000e+00 0.00000e+00 2.18787e+02 339.577 9.85882e+01 339.577 0.9228 
1 1 1 10  50  2  o 9  9.39981e+00 1.32838e+00 2.11828e+02 331.360 1.01566e+01  -5.54666e+00 0.00000e+00 0.00000e+00 1.27419e+02 331.360 8.44099e+01 151.360 0.9558 
1 1 1 10  50  3  o 11 1.68355e+01 1.06046e+00 2.42643e+02 161.190 -2.62654e+01 8.94658e+00  0.00000e+00 0.00000e+00 3.81678e+02 161.190 1.39035e+02 161.190 0.9818 
1 1 1 10  50  4  o 18 1.75572e+01 1.11866e+00 2.87918e+02 271.611 1.04753e+00  -3.72526e+01 0.00000e+00 0.00000e+00 3.66394e+02 271.611 7.84764e+01 271.611 0.9865 
1 1 1 10  50  5  o 16 1.87893e+01 1.06390e+00 2.98512e+02 290.688 1.60894e+01  -4.26049e+01 0.00000e+00 0.00000e+00 4.03558e+02 290.688 1.05046e+02 290.688 0.9890 
1 1 1 10  50  6  o 16 5.25277e+00 1.93795e+00 7.59307e+01 243.163 -1.08250e+00 -2.13958e+00 0.00000e+00 0.00000e+00 7.36039e+01 243.163 2.32683e+00 63.163  0.7534 
1 1 1 10  50  7  o 7  4.83125e+00 1.73452e+00 9.01155e+01 18.721  2.98567e+00  1.01179e+00  0.00000e+00 0.00000e+00 5.96950e+01 18.721  3.04205e+01 198.721 0.8207 
1 1 1 10  50  8  o 2  4.13558e+00 1.20502e+00 8.19639e+01 104.933 -9.13120e-01 3.42370e+00  0.00000e+00 0.00000e+00 4.98124e+01 104.933 3.21515e+01 284.933 0.8433 
1 1 1 10  50  9  o 5  1.45776e+01 1.08398e+00 2.05592e+02 356.656 3.43816e+01  -2.00911e+00 0.00000e+00 0.00000e+00 3.37077e+02 356.656 1.31484e+02 356.656 0.9854 
1 1 1 10  50  10 o 12 4.60567e+00 1.34794e+00 5.63151e+01 108.673 -9.36689e-01 2.77161e+00  0.00000e+00 0.00000e+00 8.36114e+01 108.673 2.72962e+01 108.673 0.8043 
1 1 1 10  50  11 o 8  6.48086e+00 1.58473e+00 5.65689e+01 214.627 -3.05864e+00 -2.11218e+00 0.00000e+00 0.00000e+00 1.51871e+02 214.627 9.53019e+01 214.627 0.8517 
1 1 1 10  50  12 o 7  6.15061e+00 1.73002e+00 9.63738e+01 75.424  1.42756e+00  5.49005e+00  0.00000e+00 0.00000e+00 1.14218e+02 75.424  1.78437e+01 75.424  0.9070 
1 1 1 10  51  0  o 5  2.27824e+01 7.32911e-01 3.07521e+02 275.906 4.42645e+00  -4.27923e+01 0.00000e+00 0.00000e+00 5.42013e+02 275.906 2.34493e+02 275.906 0.9883 
1 1 1 10  51  1  o 17 1.34222e+01 1.02364e+00 2.91769e+02 283.592 5.81257e+00  -2.40413e+01 0.00000e+00 0.00000e+00 2.04492e+02 283.592 8.72773e+01 103.592 0.9796 
1 1 1 10  51  2  o 4  6.66421e+00 1.33907e+00 1.22596e+02 138.497 -3.81516e+00 3.37571e+00  0.00000e+00 0.00000e+00 1.02730e+02 138.497 1.98658e+01 318.497 0.8955 
1 1 1 10  51  3  o 19 1.56325e+01 1.08882e+00 2.45408e+02 109.590 -8.50522e+00 2.38981e+01  0.00000e+00 0.00000e+00 3.33202e+02 109.590 8.77941e+01 109.590 0.9801 
1 1 1 10  51  4  o 8  2.86794e+01 1.12480e+00 4.99508e+02 15.374  9.64910e+01  2.65309e+01  0.00000e+00 0.00000e+00 5.78360e+02 15.374  7.88517e+01 15.374  0.9950 
1 1 1 10  51  5  f 0  6.72189e+00 1.13904e+00 9.15803e+01 165.021 -4.69747e+00 1.25685e+00  0.00000e+00 0.00000e+00 1.34447e+02 165.021 4.28669e+01 165.021 0.8901 
1 1 1 10  51  6  f 0  5.91910e+00 1.30092e+00 2.22100e+02 201.315 -1.04503e+01 -4.07763e+00 0.00000e+00 0.00000e+00 8.69024e+00 21.315  2.30790e+02 21.315  0.9543 
1 1 1 10  51  7  o 5  6.74324e+00 1.81614e+00 1.23602e+02 319.524 4.23688e+00  -3.61555e+00 0.00000e+00 0.00000e+00 1.06985e+02 319.524 1.66171e+01 139.524 0.9051 
1 1 1 10  51  8  o 2  6.07628e+00 1.37335e+00 7.71636e+01 109.673 -1.45403e+00 4.06693e+00  0.00000e+00 0.00000e+00 1.23637e+02 109.673 4.64735e+01 109.673 0.8748 
1 1 1 10  51  9  o 7  4.43649e+00 1.32260e+00 1.02245e+02 249.888 -1.63533e+00 -4.46589e+00 0.00000e+00 0.00000e+00 4.64664e+01 249.888 5.57788e+01 69.888  0.8874 
1 1 1 10  51  10 o 17 5.32299e+00 1.32784e+00 5.70217e+01 170.295 -3.42559e+00 5.85830e-01  0.00000e+00 0.00000e+00 1.11807e+02 170.295 5.47848e+01 170.295 0.8398 
1 1 1 10  51  11 o 8  4.72711e+00 1.41623e+00 8.14494e+01 202.026 -4.23303e+00 -1.71245e+00 0.00000e+00 0.00000e+00 7.60192e+01 202.026 5.43023e+00 22.026  0.8822 
1 1 1 10  51  12 o 2  6.40147e+00 1.74533e+00 1.56790e+02 95.293  -9.23515e-01 9.96892e+00  0.00000e+00 0.00000e+00 7.24386e+01 95.293  8.43513e+01 275.293 0.9487 
1 1 1 10  52  0  o 6  1.31226e+01 1.18105e+00 2.21208e+02 325.647 1.45140e+01  -9.92052e+00 0.00000e+00 0.00000e+00 2.59545e+02 325.647 3.83361e+01 325.647 0.9711 
1 1 1 10  52  1  o 3  6.81845e+00 1.24840e+00 1.94589e+02 103.325 -1.87026e+00 7.89654e+00  0.00000e+00 0.00000e+00 4.63120e+01 103.325 1.48277e+02 283.325 0.9362 
1 1 1 10  52  2  o 9  6.08605e+00 1.11352e+00 4.49878e+01 281.352 3.60578e-01  -1.79606e+00 0.00000e+00 0.00000e+00 1.08520e+02 281.352 6.35320e+01 281.352 0.6681 
1 1 1 10  52  3  o 3  1.76598e+01 1.10353e+00 3.01291e+02 125.700 -2.14312e+01 2.98243e+01  0.00000e+00 0.00000e+00 3.56403e+02 125.700 5.51114e+01 125.700 0.9863 
1 1 1 10  52  4  o 6  1.40723e+01 1.12576e+00 2.44925e+02 150.546 -2.25814e+01 1.27521e+01  0.00000e+00 0.00000e+00 2.76198e+02 150.546 3.12733e+01 150.546 0.9805 
1 1 1 10  52  5  o 1  1.15222e+01 9.11532e-01 1.64898e+02 276.836 1.91666e+00  -1.59886e+01 0.00000e+00 0.00000e+00 2.56579e+02 276.836 9.16813e+01 276.836 0.9684 
1 1 1 10  52  6  o 1  8.85204e+00 1.21417e+00 1.93299e+02 80.548  2.44603e+00  1.46931e+01  0.00000e+00 0.00000e+00 1.29656e+02 80.548  6.36424e+01 260.548 0.9658 
1 1 1 10  52  7  o 13 1.50166e+01 1.25520e+00 2.49818e+02 259.183 -6.41555e+00 -3.35768e+01 0.00000e+00 0.00000e+00 3.09073e+02 259.183 5.92547e+01 259.183 0.9853 
1 1 1 10  52  8  f 0  5.39321e+00 1.37361e+00 2.03413e+01 284.189 2.65164e-01  -1.04874e+00 0.00000e+00 0.00000e+00 7.63434e+01 284.189 5.60021e+01 284.189 0.4746 
1 1 1 10  52  9  o 19 1.16683e+01 1.28461e+00 1.67729e+02 314.218 1.52369e+01  -1.56586e+01 0.00000e+00 0.00000e+00 2.62755e+02 314.218 9.50257e+01 314.218 0.9768 
1 1 1 10  52  10 o 5  4.39866e+00 1.29873e+00 6.96854e+01 11.838  3.49170e+00  7.31877e-01  0.00000e+00 0.00000e+00 7.05959e+01 11.838  9.10486e-01 11.838  0.8446 
1 1 1 10  52  11 o 7  3.78387e+00 1.19390e+00 8.53225e+01 76.611  1.01513e+00  4.26477e+00  0.00000e+00 0.00000e+00 3.99317e+01 76.611  4.53908e+01 256.611 0.8768 
1 1 1 10  52  12 o 19 4.50748e+00 1.43212e+00 7.99985e+01 260.496 -7.22953e-01 -4.31820e+00 0.00000e+00 0.00000e+00 6.91340e+01 260.496 1.08645e+01 80.496  0.8766 
1 1 1 10  53  0  o 9  1.49900e+01 1.10461e+00 2.62060e+02 130.193 -1.61140e+01 1.90730e+01  0.00000e+00 0.00000e+00 2.91910e+02 130.193 2.98501e+01 130.193 0.9798 
1 1 1 10  53  1  o 2  1.75569e+01 9.01754e-01 2.87941e+02 325.725 2.93470e+01  -2.00000e+01 0.00000e+00 0.00000e+00 3.65144e+02 325.725 7.72034e+01 325.725 0.9858 
1 1 1 10  53  2  o 1  1.51138e+01 1.03742e+00 2.79915e+02 293.195 1.11633e+01  -2.60519e+01 0.00000e+00 0.00000e+00 2.80401e+02 293.195 4.85516e-01 293.195 0.9822 
1 1 1 10  53  3  o 13 1.16296e+01 1.19289e+00 1.88248e+02 61.541  7.49544e+00  1.38287e+01  0.00000e+00 0.00000e+00 2.36627e+02 61.541  4.83798e+01 61.541  0.9677 
1 1 1 10  53  4  f 0  1.63816e+01 8.03598e-01 2.51008e+02 57.519  1.93819e+01  3.04463e+01  0.00000e+00 0.00000e+00 3.58960e+02 57.519  1.07952e+02 57.519  0.9860 
1 1 1 10  53  5  o 16 4.35443e+00 1.08101e+00 6.31555e+01 115.278 -9.89242e-01 2.09486e+00  0.00000e+00 0.00000e+00 5.91141e+01 115.278 4.04142e+00 295.278 0.7435 
1 1 1 10  53  6  o 14 1.73471e+01 8.96226e-01 2.85536e+02 290.424 1.76185e+01  -4.73136e+01 0.00000e+00 0.00000e+00 3.63128e+02 290.424 7.75923e+01 290.424 0.9900 
1 1 1 10  53  7  o 6  6.74936e+00 1.35486e+00 1.51686e+02 34.681  7.61185e+00  5.26696e+00  0.00000e+00 0.00000e+00 8.90413e+01 34.681  6.26452e+01 214.681 0.9443 
1 1 1 10  53  8  o 15 3.29246e+00 1.08247e+00 2.14802e+01 202.824 -7.56995e-01 -3.18586e-01 0.00000e+00 0.00000e+00 2.57115e+01 202.824 4.23129e+00 202.824 0.3795 
1 1 1 10  53  9  o 12 6.31125e+00 1.36407e+00 1.49104e+02 26.261  8.75373e+00  4.31890e+00  0.00000e+00 0.00000e+00 7.66671e+01 26.261  7.24371e+01 206.261 0.9473 
1 1 1 10  53  10 o 17 3.52596e+00 1.16063e+00 3.46841e+01 181.218 -1.58976e+00 -3.38083e-02 0.00000e+00 0.00000e+00 4.75394e+01 181.218 1.28553e+01 181.218 0.6176 
1 1 1 10  53  11 o 5  6.43544e+00 1.51946e+00 1.38247e+02 251.273 -3.09334e+00 -9.12500e+00 0.00000e+00 0.00000e+00 9.16980e+01 251.273 4.65493e+01 71.274  0.9466 
1 1 1 10  53  12 o 2  7.86494e+00 1.87385e+00 1.34123e+02 27.585  8.35598e+00  4.36553e+00  0.00000e+00 0.00000e+00 1.46455e+02 27.585  1.23324e+01 27.585  0.9454 
1 1 1 10  54  0  o 16 8.38131e+00 1.04902e+00 8.22159e+01 350.781 4.62962e+00  -7.51383e-01 0.00000e+00 0.00000e+00 1.97735e+02 350.781 1.15519e+02 350.781 0.8857 
1 1 1 10  54  1  o 17 8.23285e+00 1.30646e+00 4.43252e+01 23.251  2.08242e+00  8.94702e-01  0.00000e+00 0.00000e+00 1.84600e+02 23.251  1.40275e+02 23.251  0.7370 
1 1 1 10  54  2  o 16 7.25755e+00 1.31327e+00 1.58158e+02 220.002 -5.68957e+00 -4.77445e+00 0.00000e+00 0.00000e+00 9.65712e+01 220.002 6.15864e+01 40.002  0.9300 
1 1 1 10  54  3  o 13 1.53505e+01 1.07892e+00 2.59333e+02 137.574 -2.24750e+01 2.05415e+01  0.00000e+00 0.00000e+00 3.10538e+02 137.574 5.12051e+01 137.574 0.9834 
1 1 1 10  54  4  o 13 1.18484e+01 9.09098e-01 2.64078e+02 14.686  2.57157e+01  6.73945e+00  0.00000e+00 0.00000e+00 1.74777e+02 14.686  8.93012e+01 194.686 0.9810 
1 1 1 10  54  5  o 12 1.58256e+01 8.46882e-01 2.52304e+02 218.281 -2.88142e+01 -2.27405e+01 0.00000e+00 0.00000e+00 3.37089e+02 218.281 8.47851e+01 218.281 0.9863 
1 1 1 10  54  6  o 13 6.22523e+00 1.20979e+00 8.58502e+01 73.159  1.35767e+00  4.48518e+00  0.00000e+00 0.00000e+00 1.22333e+02 73.159  3.64823e+01 73.159  0.8856 
1 1 1 10  54  7  o 19 4.94640e+00 1.28806e+00 2.68017e+01 285.937 3.66427e-01  -1.28323e+00 0.00000e+00 0.00000e+00 7.63994e+01 285.937 4.95977e+01 285.937 0.5525 
1 1 1 10  54  8  o 16 5.46347e+00 1.42021e+00 1.04057e+02 298.492 2.66561e+00  -4.91104e+00 0.00000e+00 0.00000e+00 8.27441e+01 298.492 2.13127e+01 118.492 0.9054 
1 1 1 10  54  9  o 4  9.95981e+00 1.30140e+00 2.06833e+02 255.658 -6.03306e+00 -2.35963e+01 0.00000e+00 0.00000e+00 1.61419e+02 255.658 4.54141e+01 75.658  0.9793 
1 1 1 10  54  10 o 17 5.86396e+00 1.33227e+00 5.46399e+01 275.718 3.56290e-01  -3.55835e+00 0.00000e+00 0.00000e+00 1.32413e+02 275.718 7.77728e+01 275.718 0.8450 
1 1 1 10  54  11 o 17 7.02800e+00 1.57857e+00 2.20553e+02 176.650 -1.70095e+01 9.95638e-01  0.00000e+00 0.00000e+00 3.67893e+01 176.650 1.83764e+02 356.650 0.9702 
1 1 1 10  54  12 o 12 4.70029e+00 1.49006e+00 7.22793e+01 260.553 -6.61412e-01 -3.97501e+00 0.00000e+00 0.00000e+00 8.10613e+01 260.553 8.78207e+00 260.553 0.8647 
1 1 1 10  55  0  o 11 6.25107e+00 1.17469e+00 7.84527e+01 277.058 3.88499e-01  -3.13789e+00 0.00000e+00 0.00000e+00 1.15135e+02 277.058 3.66823e+01 277.058 0.8213 
1 1 1 10  55  1  o 3  1.39897e+01 9.40180e-01 2.96143e+02 313.830 2.07031e+01  -2.15661e+01 0.00000e+00 0.00000e+00 2.22675e+02 313.830 7.34682e+01 133.830 0.9831 
1 1 1 10  55  2  o 6  1.75892e+01 1.01683e+00 3.07156e+02 112.692 -1.50325e+01 3.59513e+01  0.00000e+00 0.00000e+00 3.47983e+02 112.692 4.08267e+01 112.692 0.9871 
1 1 1 10  55  3  o 5  1.37800e+01 1.07265e+00 2.39863e+02 303.054 1.39487e+01  -2.14349e+01 0.00000e+00 0.00000e+00 2.69968e+02 303.054 3.01057e+01 303.054 0.9802 
1 1 1 10  55  4  o 7  9.59808e+00 9.40205e-01 1.16757e+02 168.139 -9.21497e+00 1.93531e+00  0.00000e+00 0.00000e+00 2.25759e+02 168.139 1.09002e+02 168.139 0.9453 
1 1 1 10  55  5  o 19 5.74291e+00 1.17810e+00 6.22324e+01 345.541 3.10170e+00  -7.99770e-01 0.00000e+00 0.00000e+00 1.16421e+02 345.541 5.41889e+01 345.541 0.8239 
1 1 1 10  55  6  o 9  1.77017e+01 8.34389e-01 3.05584e+02 212.976 -4.51894e+01 -2.93193e+01 0.00000e+00 0.00000e+00 3.56561e+02 212.976 5.09764e+01 212.976 0.9907 
1 1 1 10  55  7  o 5  1.04236e+01 1.09165e+00 1.26810e+02 334.481 1.31400e+01  -6.27274e+00 0.00000e+00 0.00000e+00 2.52999e+02 334.481 1.26188e+02 334.481 0.9650 
1 1 1 10  55  8  o 6  9.32949e+00 1.31859e+00 1.61071e+02 275.447 1.51902e+00  -1.59310e+01 0.00000e+00 0.00000e+00 1.79985e+02 275.447 1.89139e+01 275.447 0.9682 
1 1 1 10  55  9  o 12 4.00526e+00 1.22136e+00 6.04336e+01 299.957 1.46655e+00  -2.54451e+00 0.00000e+00 0.00000e+00 6.13180e+01 299.957 8.84376e-01 299.957 0.8052 
1 1 1 10  55  10 o 8  4.25900e+00 1.32813e+00 9.25663e+01 133.500 -3.12802e+00 3.29625e+00  0.00000e+00 0.00000e+00 4.91586e+01 133.500 4.34078e+01 313.500 0.8816 
1 1 1 10  55  11 o 1  6.51417e+00 1.64782e+00 6.79379e+01 240.701 -2.33558e+00 -4.16218e+00 0.00000e+00 0.00000e+00 1.50307e+02 240.701 8.23694e+01 240.701 0.8878 
1 1 1 10  55  12 o 6  5.47138e+00 1.63524e+00 8.06976e+01 266.873 -2.62030e-01 -4.79714e+00 0.00000e+00 0.00000e+00 1.02722e+02 266.873 2.20248e+01 266.873 0.8886 
1 1 1 10  56  0  o 1  5.07863e+00 1.17536e+00 9.80027e+01 333.277 3.00005e+00  -1.51040e+00 0.00000e+00 0.00000e+00 6.15690e+01 333.277 3.64337e+01 153.277 0.8334 
1 1 1 10  56  1  o 4  1.31797e+01 8.29433e-01 2.34874e+02 85.954  1.74300e+00  2.46394e+01  0.00000e+00 0.00000e+00 2.52049e+02 85.954  1.71758e+01 85.954  0.9795 
1 1 1 10  56  2  o 7  1.55963e+01 9.81115e-01 3.31214e+02 106.619 -1.16267e+01 3.89536e+01  0.00000e+00 0.00000e+00 2.49926e+02 106.619 8.12881e+01 286.619 0.9876 
1 1 1 10  56  3  o 11 6.76942e+00 1.38326e+00 3.50320e+01 287.738 5.22850e-01  -1.63451e+00 0.00000e+00 0.00000e+00 1.29791e+02 287.738 9.47588e+01 287.738 0.6452 
1 1 1 10  56  4  o 8  6.97554e+00 1.09241e+00 1.56368e+02 243.997 -4.01159e+00 -8.22374e+00 0.00000e+00 0.00000e+00 9.20889e+01 243.997 6.42794e+01 63.997  0.9437 
1 1 1 10  56  5  o 11 9.26403e+00 9.82359e-01 1.39194e+02 73.216  3.53215e+00  1.17107e+01  0.00000e+00 0.00000e+00 1.95905e+02 73.216  5.67110e+01 73.216  0.9582 
1 1 1 10  56  6  o 3  6.33675e+00 1.17138e+00 1.77948e+02 11.301  1.04446e+01  2.08725e+00  0.00000e+00 0.00000e+00 4.97553e+01 11.301  1.28192e+02 191.301 0.9518 
1 1 1 10  56  7  o 4  4.28940e+00 1.13040e+00 4.74703e+01 332.800 1.86451e+00  -9.58237e-01 0.00000e+00 0.00000e+00 6.79857e+01 332.800 2.05154e+01 332.800 0.7130 
1 1 1 10  56  8  o 7  5.58603e+00 1.29579e+00 9.26046e+01 243.304 -2.40398e+00 -4.78060e+00 0.00000e+00 0.00000e+00 9.73789e+01 243.304 4.77432e+00 243.304 0.9009 
1 1 1 10  56  9  o 7  5.01961e+00 1.36348e+00 1.44786e+02 79.270  1.51988e+00  8.02098e+00  0.00000e+00 0.00000e+00 3.26691e+01 79.270  1.12117e+02 259.270 0.9366 
1 1 1 10  56  10 o 14 6.79365e+00 1.56713e+00 9.85783e+01 255.528 -1.78591e+00 -6.91941e+00 0.00000e+00 0.00000e+00 1.39126e+02 255.528 4.05475e+01 255.528 0.9271 
1 1 1 10  56  11 o 17 5.87385e+00 1.60544e+00 7.97756e+01 333.927 4.49796e+00  -2.20090e+00 0.00000e+00 0.00000e+00 1.18256e+02 333.927 3.84806e+01 333.927 0.8936 
1 1 1 10  56  12 o 16 3.76436e+00 1.28307e+00 6.76253e+01 259.194 -6.73651e-01 -3.52932e+00 0.00000e+00 0.00000e+00 5.24703e+01 259.194 1.51550e+01 79.194  0.8458 
1 1 1 10  57  0  o 5  1.77222e+01 1.19067e+00 3.88390e+02 119.369 -2.31176e+01 4.10781e+01  0.00000e+00 0.00000e+00 2.72552e+02 119.369 1.15838e+02 299.370 0.9893 
1 1 1 10  57  1  o 5  8.36644e+00 1.27317e+00 1.77024e+02 259.277 -1.97675e+00 -1.04385e+01 0.00000e+00 0.00000e+00 1.23242e+02 259.277 5.37819e+01 79.277  0.9517 
1 1 1 10  57  2  o 9  1.16886e+01 1.04725e+00 2.07770e+02 70.249  6.39320e+00  1.78052e+01  0.00000e+00 0.00000e+00 2.21337e+02 70.249  1.35675e+01 70.249  0.9732 
1 1 1 10  57  3  o 5  1.60216e+01 7.39725e-01 2.34351e+02 343.121 3.19153e+01  -9.68380e+00 0.00000e+00 0.00000e+00 3.61041e+02 343.121 1.26690e+02 343.121 0.9849 
1 1 1 10  57  4  o 19 1.52767e+01 7.68549e-01 2.08015e+02 205.658 -2.69090e+01 -1.29263e+01 0.00000e+00 0.00000e+00 3.58772e+02 205.658 1.50757e+02 205.658 0.9831 
1 1 1 10  57  5  o 5  4.90760e+00 1.15061e+00 6.53398e+01 322.340 2.28132e+00  -1.76065e+00 0.00000e+00 0.00000e+00 8.30021e+01 322.340 1.76623e+01 322.340 0.8008 
1 1 1 10  57  6  o 6  1.10300e+01 1.02385e+00 1.31772e+02 76.802  3.46667e+00  1.47824e+01  0.00000e+00 0.00000e+00 2.70617e+02 76.802  1.38845e+02 76.802  0.9665 
1 1 1 10  57  7  o 10 6.02236e+00 1.14636e+00 6.61618e+01 233.656 -2.51635e+00 -3.42011e+00 0.00000e+00 0.00000e+00 1.32146e+02 233.656 6.59840e+01 233.656 0.8724 
1 1 1 10  57  8  o 16 5.97602e+00 1.35769e+00 4.47923e+01 80.596  4.69369e-01  2.83387e+00  0.00000e+00 0.00000e+00 1.35679e+02 80.596  9.08866e+01 80.596  0.8001 
1 1 1 10  57  9  o 13 3.96369e+00 1.22864e+00 1.52241e+02 229.048 -4.79011e+00 -5.51965e+00 0.00000e+00 0.00000e+00 1.32989e+01 49.048  1.65540e+02 49.048  0.9288 
1 1 1 10  57  10 o 11 8.29044e+00 1.39068e+00 1.79194e+02 315.552 1.20794e+01  -1.18487e+01 0.00000e+00 0.00000e+00 1.24243e+02 315.552 5.49506e+01 135.552 0.9700 
1 1 1 10  57  11 o 3  1.13432e+01 1.59866e+00 1.97916e+02 105.915 -6.39932e+00 2.24432e+01  0.00000e+00 0.00000e+00 2.20727e+02 105.915 2.28109e+01 105.915 0.9783 
1 1 1 10  57  12 f 0  7.66580e+00 1.81279e+00 2.16368e+02 231.180 -1.02963e+01 -1.27968e+01 0.00000e+00 0.00000e+00 6.37893e+01 231.180 1.52578e+02 51.180  0.9691 
1 1 1 10  58  0  o 7  1.86087e+01 9.31513e-01 3.54887e+02 350.779 5.19676e+01  -8.43612e+00 0.00000e+00 0.00000e+00 3.39794e+02 350.779 1.50930e+01 170.779 0.9905 
1 1 1 10  58  1  o 9  2.01000e+01 8.87862e-01 3.66118e+02 139.058 -4.53808e+01 3.93683e+01  0.00000e+00 0.00000e+00 3.85410e+02 139.058 1.92915e+01 139.058 0.9916 
1 1 1 10  58  2  o 19 2.13800e+01 9.09729e-01 3.91742e+02 299.503 3.50310e+01  -6.19105e+01 0.00000e+00 0.00000e+00 4.08947e+02 299.503 1.72043e+01 299.503 0.9929 
1 1 1 10  58  3  o 10 6.31860e+00 1.10562e+00 1.39031e+02 150.985 -6.42036e+00 3.56105e+00  0.00000e+00 0.00000e+00 8.24576e+01 150.985 5.65736e+01 330.985 0.9292 
1 1 1 10  58  4  o 10 7.40796e+00 1.04495e+00 6.82433e+01 320.694 3.68838e+00  -3.01956e+00 0.00000e+00 0.00000e+00 1.79884e+02 320.694 1.11641e+02 320.694 0.8877 
1 1 1 10  58  5  o 5  4.99990e+00 1.11609e+00 7.99366e+01 320.577 2.94292e+00  -2.41929e+00 0.00000e+00 0.00000e+00 8.15374e+01 320.577 1.60074e+00 320.577 0.8558 
1 1 1 10  58  6  o 6  1.09087e+01 1.06299e+00 2.46453e+02 153.885 -2.70137e+01 1.32425e+01  0.00000e+00 0.00000e+00 1.58344e+02 153.885 8.81093e+01 333.885 0.9832 
1 1 1 10  58  7  f 0  8.19539e+00 1.20803e+00 1.60366e+02 188.733 -1.41763e+01 -2.17769e+00 0.00000e+00 0.00000e+00 1.37947e+02 188.733 2.24190e+01 8.733   0.9645 
1 1 1 10  58  8  o 14 3.53437e+00 1.12864e+00 7.59030e+01 352.315 3.15809e+00  -4.26171e-01 0.00000e+00 0.00000e+00 3.38562e+01 352.315 4.20468e+01 172.315 0.8229 
1 1 1 10  58  9  o 11 3.95104e+00 1.23149e+00 6.88160e+01 240.722 -1.60685e+00 -2.86595e+00 0.00000e+00 0.00000e+00 5.47893e+01 240.722 1.40267e+01 60.722  0.8291 
1 1 1 10  58  10 o 14 8.87559e+00 1.53124e+00 1.62615e+02 312.549 1.07343e+01  -1.16942e+01 0.00000e+00 0.00000e+00 1.61513e+02 312.549 1.10293e+00 132.549 0.9680 
1 1 1 10  58  11 o 15 7.50394e+00 1.68445e+00 1.55526e+02 215.671 -9.84639e+00 -7.06774e+00 0.00000e+00 0.00000e+00 1.15571e+02 215.671 3.99552e+01 35.671  0.9578 
1 1 1 10  58  12 o 2  4.38167e+00 1.43492e+00 4.31314e+01 182.215 -2.50013e+00 -9.66871e-02 0.00000e+00 0.00000e+00 8.32975e+01 182.215 4.01661e+01 182.215 0.7652 
1 1 1 10  59  0  o 1  1.33811e+01 9.58693e-01 2.42665e+02 334.299 2.33723e+01  -1.12489e+01 0.00000e+00 0.00000e+00 2.51780e+02 334.299 9.11479e+00 334.299 0.9805 
1 1 1 10  59  1  o 13 1.02584e+01 1.06475e+00 2.86857e+02 152.767 -2.11733e+01 1.08971e+01  0.00000e+00 0.00000e+00 9.16633e+01 152.767 1.95194e+02 332.767 0.9788 
1 1 1 10  59  2  o 15 1.98091e+01 9.11203e-01 3.58813e+02 87.440  2.68936e+00  6.01471e+01  0.00000e+00 0.00000e+00 3.81964e+02 87.440  2.31509e+01 87.440  0.9917 
1 1 1 10  59  3  o 2  8.26419e+00 9.36863e-01 1.09259e+02 274.643 6.52124e-01  -8.02956e+00 0.00000e+00 0.00000e+00 1.82422e+02 274.643 7.31634e+01 274.643 0.9357 
1 1 1 10  59  4  o 10 1.16369e+01 8.74869e-01 2.22076e+02 37.918  2.00375e+01  1.56088e+01  0.00000e+00 0.00000e+00 2.08217e+02 37.918  1.38587e+01 217.918 0.9801 
1 1 1 10  59  5  o 14 1.34274e+01 8.46913e-01 2.57736e+02 208.367 -3.01259e+01 -1.62667e+01 0.00000e+00 0.00000e+00 2.41450e+02 208.367 1.62859e+01 28.367  0.9853 
1 1 1 10  59  6  o 11 4.46962e+00 1.19923e+00 6.22432e+01 207.515 -2.58473e+00 -1.34637e+00 0.00000e+00 0.00000e+00 7.32649e+01 207.515 1.10217e+01 207.515 0.8034 
1 1 1 10  59  7  o 12 4.48873e+00 1.25323e+00 9.70926e+01 7.881   4.62229e+00  6.39866e-01  0.00000e+00 0.00000e+00 5.28127e+01 7.881   4.42799e+01 187.881 0.8850 
1 1 1 10  59  8  o 8  6.55467e+00 1.37120e+00 1.07159e+02 219.089 -6.18811e+00 -5.02706e+00 0.00000e+00 0.00000e+00 1.24089e+02 219.089 1.69302e+01 219.089 0.9350 
1 1 1 10  59  9  o 9  6.89980e+00 1.45162e+00 1.47642e+02 9.735   1.09967e+01  1.88665e+00  0.00000e+00 0.00000e+00 1.00720e+02 9.735   4.69218e+01 189.735 0.9541 
1 1 1 10  59  10 f 0  4.60157e+00 1.37436e+00 6.74351e+01 191.021 -3.75535e+00 -7.31406e-01 0.00000e+00 0.00000e+00 8.12303e+01 191.021 1.37953e+01 191.021 0.8565 
1 1 1 10  59  11 o 10 1.44507e+01 1.39280e+00 1.57319e+02 21.258  2.63936e+01  1.02682e+01  0.00000e+00 0.00000e+00 3.77940e+02 21.258  2.20621e+02 21.258  0.9822 
1 1 1 10  59  12 o 5  5.28343e+00 1.61109e+00 5.99632e+01 193.666 -3.62520e+00 -8.81424e-01 0.00000e+00 0.00000e+00 1.09809e+02 193.666 4.98460e+01 193.666 0.8523 
1 1 1 10  60  0  o 16 1.71842e+01 8.30480e-01 2.67776e+02 44.000  2.87078e+01  2.77227e+01  0.00000e+00 0.00000e+00 3.71534e+02 44.000  1.03758e+02 44.000  0.9874 
1 1 1 10  60  1  o 7  8.96026e+00 1.09433e+00 1.30028e+02 213.794 -7.74858e+00 -5.18598e+00 0.00000e+00 0.00000e+00 1.89046e+02 213.794 5.90173e+01 213.794 0.9447 
1 1 1 10  60  2  o 18 5.06270e+00 1.10148e+00 2.38114e+01 350.021 9.92315e-01  -1.74601e-01 0.00000e+00 0.00000e+00 6.19078e+01 350.021 3.80964e+01 350.021 0.4491 
1 1 1 10  60  3  o 19 6.69568e+00 1.04188e+00 1.26613e+02 334.001 7.19684e+00  -3.51000e+00 0.00000e+00 0.00000e+00 1.09567e+02 334.001 1.70461e+01 154.001 0.9353 
1 1 1 10  60  4  o 13 3.53407e+00 1.03943e+00 8.26440e+01 99.090  -4.32137e-01 2.70094e+00  0.00000e+00 0.00000e+00 2.24479e+01 99.090  6.01961e+01 279.090 0.7883 
1 1 1 10  60  5  o 9  3.16466e+00 9.97462e-01 1.34077e+02 271.360 1.06446e-01  -4.48208e+00 0.00000e+00 0.00000e+00 2.90341e+01 91.360  1.63111e+02 91.360  0.8798 
1 1 1 10  60  6  o 15 1.23327e+01 1.16629e+00 2.80994e+02 272.104 1.28844e+00  -3.50751e+01 0.00000e+00 0.00000e+00 1.77618e+02 272.104 1.03376e+02 92.104  0.9857 
1 1 1 10  60  7  o 15 3.75873e+00 1.15046e+00 8.29173e+01 100.384 -6.25021e-01 3.41099e+00  0.00000e+00 0.00000e+00 3.61191e+01 100.384 4.67981e+01 280.384 0.8394 
1 1 1 10  60  8  o 13 9.14741e+00 1.24166e+00 1.11054e+02 319.906 9.32157e+00  -7.84774e+00 0.00000e+00 0.00000e+00 2.19565e+02 319.906 1.08511e+02 319.906 0.9580 
1 1 1 10  60  9  o 14 1.08214e+01 1.34057e+00 1.88272e+02 179.893 -2.47040e+01 4.60286e-02  0.00000e+00 0.00000e+00 2.11583e+02 179.893 2.33115e+01 179.893 0.9795 
1 1 1 10  60  10 o 1  5.40885e+00 1.50829e+00 5.60150e+01 108.501 -1.10708e+00 3.30852e+00  0.00000e+00 0.00000e+00 1.15447e+02 108.501 5.94324e+01 108.501 0.8405 
1 1 1 10  60  11 o 12 4.34042e+00 1.38530e+00 1.24260e+01 197.792 -6.27160e-01 -2.01260e-01 0.00000e+00 0.00000e+00 3.87463e+01 197.792 2.63203e+01 197.792 0.3127 
1 1 1 10  60  12 o 3  7.84326e+00 1.86232e+00 1.38569e+02 16.167  1.05469e+01  3.05752e+00  0.00000e+00 0.00000e+00 1.43280e+02 16.167  4.71107e+00 16.167  0.9533 
1 1 1 10  61  0  o 13 6.38231e+00 1.42361e+00 1.27713e+02 79.790  1.02651e+00  5.69931e+00  0.00000e+00 0.00000e+00 9.08388e+01 79.790  3.68746e+01 259.790 0.9090 
1 1 1 10  61  1  o 19 4.56991e+00 1.36515e+00 9.80009e+01 84.396  3.31651e-01  3.37996e+00  0.00000e+00 0.00000e+00 4.58896e+01 84.396  5.21114e+01 264.396 0.8355 
1 1 1 10  61  2  o 19 1.00274e+01 8.47964e-01 1.84943e+02 95.978  -1.77247e+00 1.69256e+01  0.00000e+00 0.00000e+00 1.81791e+02 95.978  3.15243e+00 275.978 0.9702 
1 1 1 10  61  3  o 12 1.27736e+01 7.86298e-01 1.60385e+02 74.578  5.50694e+00  1.99632e+01  0.00000e+00 0.00000e+00 3.09495e+02 74.578  1.49110e+02 74.578  0.9755 
1 1 1 10  61  4  o 12 1.14427e+01 8.58559e-01 2.06894e+02 235.918 -1.39020e+01 -2.05473e+01 0.00000e+00 0.00000e+00 2.15873e+02 235.918 8.97913e+00 235.918 0.9796 
1 1 1 10  61  5  o 2  6.84716e+00 1.09913e+00 6.79712e+01 41.043  3.72035e+00  3.23901e+00  0.00000e+00 0.00000e+00 1.62354e+02 41.043  9.43833e+01 41.043  0.8918 
1 1 1 10  61  6  f 0  4.78600e+00 1.33712e+00 3.40571e+01 146.420 -1.32052e+00 8.76673e-01  0.00000e+00 0.00000e+00 7.72368e+01 146.420 4.31797e+01 146.420 0.6165 
1 1 1 10  61  7  o 7  8.10760e+00 1.21477e+00 1.74878e+02 106.064 -4.34520e+00 1.50903e+01  0.00000e+00 0.00000e+00 1.21054e+02 106.064 5.38233e+01 286.064 0.9676 
1 1 1 10  61  8  o 12 5.77556e+00 1.42660e+00 5.72153e+01 233.087 -2.14885e+00 -2.86063e+00 0.00000e+00 0.00000e+00 1.26886e+02 233.087 6.96709e+01 233.087 0.8451 
1 1 1 10  61  9  o 2  9.15863e+00 1.41409e+00 1.00202e+02 122.740 -5.43599e+00 8.45446e+00  0.00000e+00 0.00000e+00 2.27560e+02 122.740 1.27357e+02 122.740 0.9489 
1 1 1 10  61  10 o 16 5.84761e+00 1.51083e+00 1.03349e+02 66.291  2.87415e+00  6.54478e+00  0.00000e+00 0.00000e+00 1.01094e+02 66.291  2.25524e+00 246.291 0.9272 
1 1 1 10  61  11 o 6  8.87418e+00 1.74743e+00 1.25611e+02 333.368 9.95821e+00  -4.99358e+00 0.00000e+00 0.00000e+00 1.93557e+02 333.368 6.79464e+01 333.368 0.9540 
1 1 1 10  61  12 f 0  4.33084e+00 1.40502e+00 1.49167e+01 144.778 -7.19153e-01 5.07724e-01  0.00000e+00 0.00000e+00 5.07614e+01 144.778 3.58447e+01 144.778 0.4024 
1 1 1 10  62  0  o 8  8.66199e+00 1.08331e+00 1.68257e+02 268.645 -2.93009e-01 -1.23859e+01 0.00000e+00 0.00000e+00 1.44547e+02 268.645 2.37104e+01 88.645  0.9588 
1 1 1 10  62  1  o 18 9.67837e+00 1.00943e+00 1.31528e+02 135.684 -7.94737e+00 7.75991e+00  0.00000e+00 0.00000e+00 2.16327e+02 135.684 8.47987e+01 135.684 0.9539 
1 1 1 10  62  2  o 6  1.09944e+01 7.81441e-01 1.61428e+02 15.191  1.76405e+01  4.79000e+00  0.00000e+00 0.00000e+00 2.41467e+02 15.191  8.00394e+01 15.191  0.9723 
1 1 1 10  62  3  o 1  5.51044e+00 1.06048e+00 6.55287e+01 59.836  1.68647e+00  2.90185e+00  0.00000e+00 0.00000e+00 1.07574e+02 59.836  4.20458e+01 59.836  0.8332 
1 1 1 10  62  4  o 7  1.69890e+01 7.85892e-01 3.06560e+02 304.383 3.20853e+01  -4.68885e+01 0.00000e+00 0.00000e+00 3.28401e+02 304.383 2.18408e+01 304.383 0.9912 
1 1 1 10  62  5  o 12 5.56876e+00 1.17959e+00 9.26989e+01 199.256 -5.15380e+00 -1.80041e+00 0.00000e+00 0.00000e+00 9.69537e+01 199.256 4.25483e+00 199.256 0.9030 
1 1 1 10  62  6  o 10 1.18908e+01 1.16116e+00 2.01828e+02 148.951 -2.29444e+01 1.38131e+01  0.00000e+00 0.00000e+00 2.38185e+02 148.951 3.63574e+01 148.951 0.9811 
1 1 1 10  62  7  o 8  3.78272e+00 1.14203e+00 8.36438e+01 207.064 -3.32556e+00 -1.69917e+00 0.00000e+00 0.00000e+00 3.79773e+01 207.064 4.56666e+01 27.064  0.8525 
1 1 1 10  62  8  o 12 5.26486e+00 1.41759e+00 1.61123e+02 113.809 -3.72087e+00 8.43288e+00  0.00000e+00 0.00000e+00 2.63322e+01 113.809 1.34791e+02 293.809 0.9441 
1 1 1 10  62  9  o 2  3.71786e+00 1.18781e+00 6.79260e+01 279.616 5.41783e-01  -3.19763e+00 0.00000e+00 0.00000e+00 4.79436e+01 279.616 1.99825e+01 99.616  0.8265 
1 1 1 10  62  10 f 0  6.40469e+00 1.58102e+00 5.16767e+01 35.589  2.92228e+00  2.09127e+00  0.00000e+00 0.00000e+00 1.52572e+02 35.589  1.00895e+02 35.589  0.8458 
1 1 1 10  62  11 o 10 3.57300e+00 1.21019e+00 6.73996e+01 310.882 2.31008e+00  -2.66848e+00 0.00000e+00 0.00000e+00 4.60852e+01 310.882 2.13144e+01 130.882 0.8426 
1 1 1 10  62  12 o 3  4.15939e+00 1.37410e+00 9.57547e+01 227.298 -3.94060e+00 -4.27010e+00 0.00000e+00 0.00000e+00 4.67664e+01 227.298 4.89883e+01 47.298  0.9093 
1 1 1 10  63  0  o 19 9.17615e+00 9.97932e-01 1.18404e+02 315.872 6.81797e+00  -6.61343e+00 0.00000e+00 0.00000e+00 2.08433e+02 315.872 9.00295e+01 315.872 0.9458 
1 1 1 10  63  1  o 8  7.94786e+00 1.21212e+00 1.87775e+02 111.547 -4.83942e+00 1.22563e+01  0.00000e+00 0.00000e+00 1.00053e+02 111.547 8.77219e+01 291.547 0.9613 
1 1 1 10  63  2  o 16 1.09526e+01 7.68869e-01 2.11418e+02 103.012 -5.53555e+00 2.39535e+01  0.00000e+00 0.00000e+00 1.92848e+02 103.012 1.85697e+01 283.012 0.9794 
1 1 1 10  63  3  o 5  9.03089e+00 9.13433e-01 1.47274e+02 275.570 1.32748e+00  -1.36117e+01 0.00000e+00 0.00000e+00 1.80450e+02 275.570 3.31763e+01 275.570 0.9627 
1 1 1 10  63  4  o 19 6.94438e+00 1.08981e+00 1.27457e+02 143.919 -7.26861e+00 5.29676e+00  0.00000e+00 0.00000e+00 1.19343e+02 143.919 8.11349e+00 323.919 0.9426 
1 1 1 10  63  5  o 10 1.69301e+01 8.03757e-01 2.75247e+02 6.838   5.42757e+01  6.50836e+00  0.00000e+00 0.00000e+00 3.57263e+02 6.838   8.20163e+01 6.838   0.9908 
1 1 1 10  63  6  o 17 7.44094e+00 1.48988e+00 1.53043e+02 87.346  5.12034e-01  1.10482e+01  0.00000e+00 0.00000e+00 1.14546e+02 87.346  3.84976e+01 267.346 0.9537 
1 1 1 10  63  7  o 3  9.82912e+00 1.18861e+00 1.41091e+02 319.301 1.19369e+01  -1.02671e+01 0.00000e+00 0.00000e+00 2.17587e+02 319.301 7.64960e+01 319.301 0.9677 
1 1 1 10  63  8  o 10 8.07968e+00 1.39289e+00 1.41117e+02 147.046 -1.05369e+01 6.83059e+00  0.00000e+00 0.00000e+00 1.51151e+02 147.046 1.00343e+01 147.046 0.9593 
1 1 1 10  63  9  o 18 4.18940e+00 1.27673e+00 7.78024e+01 75.695  1.04238e+00  4.08789e+00  0.00000e+00 0.00000e+00 5.98424e+01 75.695  1.79600e+01 255.695 0.8714 
1 1 1 10  63  10 o 6  3.80638e+00 1.22092e+00 6.16564e+01 329.952 2.66812e+00  -1.54339e+00 0.00000e+00 0.00000e+00 5.54127e+01 329.952 6.24364e+00 149.952 0.8159 
1 1 1 10  63  11 o 4  5.13562e+00 1.50160e+00 1.47048e+02 356.797 9.14966e+00  -5.12065e-01 0.00000e+00 0.00000e+00 3.56118e+01 356.797 1.11436e+02 176.797 0.9438 
1 1 1 10  63  12 f 0  5.30467e+00 1.59383e+00 1.12676e+02 118.903 -3.55144e+00 6.43255e+00  0.00000e+00 0.00000e+00 7.30365e+01 118.903 3.96395e+01 298.903 0.9292 
1 1 1 10  64  0  o 5  1.34406e+01 8.23472e-01 2.45120e+02 117.795 -1.53572e+01 2.91341e+01  0.00000e+00 0.00000e+00 2.53211e+02 117.795 8.09092e+00 117.795 0.9847 
1 1 1 10  64  1  o 16 5.26600e+00 9.67727e-01 1.39176e+02 44.798  5.16460e+00  5.12839e+00  0.00000e+00 0.00000e+00 4.49988e+01 44.798  9.41768e+01 224.798 0.9285 
1 1 1 10  64  2  o 7  8.12704e+00 9.50844e-01 1.47816e+02 338.157 1.07625e+01  -4.31411e+00 0.00000e+00 0.00000e+00 1.44881e+02 338.157 2.93572e+00 158.157 0.9559 
1 1 1 10  64  3  o 18 9.70240e+00 8.37604e-01 1.34471e+02 210.988 -1.19945e+01 -7.20354e+00 0.00000e+00 0.00000e+00 2.17873e+02 210.988 8.34017e+01 210.988 0.9636 
1 1 1 10  64  4  f 0  4.78236e+00 1.18314e+00 1.17420e+02 251.099 -1.92447e+00 -5.62051e+00 0.00000e+00 0.00000e+00 4.68851e+01 251.099 7.05349e+01 71.099  0.9114 
1 1 1 10  64  5  o 8  4.39613e+00 1.12393e+00 5.64868e+01 95.533  -2.57665e-01 2.65972e+00  0.00000e+00 0.00000e+00 7.31993e+01 95.533  1.67125e+01 95.533  0.7825 
1 1 1 10  64  6  f 0  7.68059e+00 1.41178e+00 2.21827e+02 126.401 -9.85435e+00 1.33656e+01  0.00000e+00 0.00000e+00 5.88904e+01 126.401 1.62937e+02 306.401 0.9694 
1 1 1 10  64  7  o 15 3.35220e+00 1.02422e+00 6.70940e+01 41.660  2.26868e+00  2.01845e+00  0.00000e+00 0.00000e+00 3.56153e+01 41.660  3.14787e+01 221.660 0.8127 
1 1 1 10  64  8  o 4  3.13876e+00 1.04643e+00 1.10383e+02 220.226 -3.44762e+00 -2.91615e+00 0.00000e+00 0.00000e+00 6.15670e+00 40.226  1.16540e+02 40.226  0.8808 
1 1 1 10  64  9  o 8  8.56958e+00 1.50545e+00 1.81384e+02 186.277 -1.75194e+01 -1.92693e+00 0.00000e+00 0.00000e+00 1.32355e+02 186.277 4.90291e+01 6.277   0.9712 
1 1 1 10  64  10 f 0  4.90187e+00 1.44247e+00 8.28382e+01 54.675  2.86153e+00  4.03769e+00  0.00000e+00 0.00000e+00 8.19920e+01 54.675  8.46200e-01 234.675 0.8922 
1 1 1 10  64  11 o 5  4.04561e+00 1.32361e+00 4.74187e+01 181.121 -2.75190e+00 -5.38466e-02 0.00000e+00 0.00000e+00 7.29908e+01 181.121 2.55722e+01 181.121 0.7899 
1 1 1 10  64  12 o 13 5.07719e+00 1.54431e+00 8.11370e+01 115.104 -2.20837e+00 4.71355e+00  0.00000e+00 0.00000e+00 9.05965e+01 115.104 9.45949e+00 115.104 0.8979 
1 1 1 10  65  0  o 15 1.03462e+01 9.15244e-01 1.73011e+02 48.135  1.20665e+01  1.34649e+01  0.00000e+00 0.00000e+00 2.05555e+02 48.135  3.25443e+01 48.135  0.9719 
1 1 1 10  65  1  o 10 1.13619e+01 7.28721e-01 2.67507e+02 97.888  -4.31860e+00 3.11702e+01  0.00000e+00 0.00000e+00 1.53531e+02 97.888  1.13976e+02 277.888 0.9840 
1 1 1 10  65  2  f 0  5.27290e+00 1.08270e+00 9.31452e+01 252.574 -1.34221e+00 -4.27618e+00 0.00000e+00 0.00000e+00 8.16175e+01 252.574 1.15277e+01 72.574  0.8798 
1 1 1 10  65  3  o 9  1.24889e+01 7.72561e-01 2.37958e+02 204.597 -3.09583e+01 -1.41718e+01 0.00000e+00 0.00000e+00 2.25678e+02 204.597 1.22797e+01 24.597  0.9852 
1 1 1 10  65  4  o 5  9.18239e+00 9.56955e-01 1.25555e+02 47.153  9.14871e+00  9.86358e+00  0.00000e+00 0.00000e+00 2.07394e+02 47.153  8.18390e+01 47.153  0.9621 
1 1 1 10  65  5  f 0  7.89836e+00 1.10480e+00 1.05165e+02 173.312 -9.46052e+00 1.10942e+00  0.00000e+00 0.00000e+00 1.76460e+02 173.312 7.12945e+01 173.312 0.9460 
1 1 1 10  65  6  o 3  4.44267e+00 1.18874e+00 1.20604e+02 316.429 4.56122e+00  -4.33918e+00 0.00000e+00 0.00000e+00 3.29186e+01 316.429 8.76857e+01 136.429 0.9167 
1 1 1 10  65  7  o 1  1.17616e+01 1.02996e+00 1.33155e+02 302.172 1.12717e+01  -1.79185e+01 0.00000e+00 0.00000e+00 2.99609e+02 302.172 1.66454e+02 302.172 0.9761 
1 1 1 10  65  8  o 2  3.81110e+00 1.23958e+00 5.78708e+01 221.312 -2.13414e+00 -1.87571e+00 0.00000e+00 0.00000e+00 5.66988e+01 221.312 1.17195e+00 41.312  0.7975 
1 1 1 10  65  9  o 1  7.50760e+00 1.44988e+00 1.24073e+02 92.272  -4.17084e-01 1.05112e+01  0.00000e+00 0.00000e+00 1.45080e+02 92.272  2.10073e+01 92.272  0.9512 
1 1 1 10  65  10 o 5  4.79194e+00 1.41477e+00 3.60281e+01 269.986 -5.24231e-04 -2.20246e+00 0.00000e+00 0.00000e+00 9.54969e+01 269.986 5.94688e+01 269.986 0.7284 
1 1 1 10  65  11 o 6  3.43448e+00 1.15247e+00 7.34573e+01 134.753 -2.85611e+00 2.88081e+00  0.00000e+00 0.00000e+00 3.85514e+01 134.753 3.49058e+01 314.753 0.8657 
1 1 1 10  65  12 o 9  3.90190e+00 1.30637e+00 3.73628e+01 183.101 -2.20699e+00 -1.19546e-01 0.00000e+00 0.00000e+00 6.98335e+01 183.101 3.24706e+01 183.101 0.7294 
1 1 1 10  66  0  f 0  1.15984e+01 8.70213e-01 1.08949e+02 259.932 -2.30550e+00 -1.29852e+01 0.00000e+00 0.00000e+00 3.10716e+02 259.932 2.01767e+02 259.932 0.9613 
1 1 1 10  66  1  o 15 7.84391e+00 8.96739e-01 1.83899e+02 352.500 1.39310e+01  -1.83396e+00 0.00000e+00 0.00000e+00 1.00740e+02 352.500 8.31588e+01 172.500 0.9637 
1 1 1 10  66  2  o 11 1.61845e+01 7.17858e-01 3.49787e+02 131.588 -4.17832e+01 4.70813e+01  0.00000e+00 0.00000e+00 2.54942e+02 131.588 9.48444e+01 311.588 0.9920 
1 1 1 10  66  3  o 13 7.30286e+00 1.04769e+00 1.98724e+02 203.202 -1.50140e+01 -6.43559e+00 0.00000e+00 0.00000e+00 6.78488e+01 203.202 1.30875e+02 23.202  0.9689 
1 1 1 10  66  4  o 6  9.44583e+00 9.20817e-01 1.23211e+02 45.077  1.00439e+01  1.00709e+01  0.00000e+00 0.00000e+00 2.19974e+02 45.077  9.67628e+01 45.077  0.9642 
1 1 1 10  66  5  o 8  5.78432e+00 1.15020e+00 7.91890e+01 163.832 -5.11149e+00 1.48194e+00  0.00000e+00 0.00000e+00 1.17079e+02 163.832 3.78901e+01 163.832 0.9004 
1 1 1 10  66  6  o 16 9.75104e+00 1.06528e+00 1.32849e+02 42.452  1.17087e+01  1.07109e+01  0.00000e+00 0.00000e+00 2.22884e+02 42.452  9.00348e+01 42.452  0.9680 
1 1 1 10  66  7  o 13 6.87867e+00 1.33145e+00 1.74987e+02 109.760 -4.64711e+00 1.29362e+01  0.00000e+00 0.00000e+00 7.46488e+01 109.760 1.00339e+02 289.760 0.9629 
1 1 1 10  66  8  o 6  4.79597e+00 1.45783e+00 8.99910e+01 147.857 -4.17775e+00 2.62503e+00  0.00000e+00 0.00000e+00 7.12042e+01 147.857 1.87868e+01 327.857 0.8918 
1 1 1 10  66  9  o 6  7.64491e+00 1.42209e+00 1.07501e+02 135.155 -7.31758e+00 7.27801e+00  0.00000e+00 0.00000e+00 1.66247e+02 135.155 5.87470e+01 135.155 0.9502 
1 1 1 10  66  10 o 1  3.63706e+00 1.20820e+00 9.06915e+01 169.938 -4.42993e+00 7.86054e-01  0.00000e+00 0.00000e+00 2.99372e+01 169.938 6.07542e+01 349.938 0.8803 
1 1 1 10  66  11 f 0  5.18417e+00 1.52585e+00 1.25048e+02 296.754 3.76755e+00  -7.47334e+00 0.00000e+00 0.00000e+00 5.81576e+01 296.754 6.68906e+01 116.754 0.9382 
1 1 1 10  66  12 o 18 4.29178e+00 1.34210e+00 5.08549e+01 290.560 1.17838e+00  -3.14168e+00 0.00000e+00 0.00000e+00 8.37956e+01 290.560 3.29406e+01 290.560 0.8332 
1 1 1 10  67  0  o 11 5.13215e+00 1.16691e+00 6.98143e+01 188.566 -3.12476e+00 -4.70704e-01 0.00000e+00 0.00000e+00 8.87797e+01 188.566 1.89654e+01 188.566 0.8212 
1 1 1 10  67  1  o 5  2.07809e+01 6.70659e-01 3.94228e+02 84.088  9.51184e+00  9.18511e+01  0.00000e+00 0.00000e+00 3.83852e+02 84.088  1.03764e+01 264.088 0.9946 
1 1 1 10  67  2  o 15 5.31471e+00 1.06887e+00 7.82218e+01 158.445 -4.15123e+00 1.63985e+00  0.00000e+00 0.00000e+00 9.77529e+01 158.445 1.95311e+01 158.445 0.8792 
1 1 1 10  67  3  o 4  1.04697e+01 8.39715e-01 1.09555e+02 203.693 -1.28474e+01 -5.63770e+00 0.00000e+00 0.00000e+00 2.70491e+02 203.693 1.60937e+02 203.693 0.9637 
1 1 1 10  67  4  o 11 8.00184e+00 1.01969e+00 1.35460e+02 255.968 -2.95688e+00 -1.18315e+01 0.00000e+00 0.00000e+00 1.53371e+02 255.968 1.79117e+01 255.968 0.9581 
1 1 1 10  67  5  o 3  3.86294e+00 1.08388e+00 7.01966e+01 323.843 2.51074e+00  -1.83469e+00 0.00000e+00 0.00000e+00 4.88341e+01 323.843 2.13625e+01 143.843 0.8178 
1 1 1 10  67  6  o 1  3.52903e+00 1.07257e+00 6.37923e+01 304.153 1.69876e+00  -2.50407e+00 0.00000e+00 0.00000e+00 4.41731e+01 304.153 1.96192e+01 124.153 0.8119 
1 1 1 10  67  7  o 12 4.81115e+00 1.21228e+00 9.79403e+01 27.997  5.07729e+00  2.69927e+00  0.00000e+00 0.00000e+00 6.67293e+01 27.997  3.12110e+01 207.997 0.9083 
1 1 1 10  67  8  o 7  4.12654e+00 1.32639e+00 4.56630e+01 73.389  6.37141e-01  2.13581e+00  0.00000e+00 0.00000e+00 6.81535e+01 73.389  2.24906e+01 73.389  0.7320 
1 1 1 10  67  9  o 12 4.54155e+00 1.32639e+00 6.21728e+01 28.457  3.17636e+00  1.72151e+00  0.00000e+00 0.00000e+00 8.27189e+01 28.457  2.05461e+01 28.457  0.8468 
1 1 1 10  67  10 o 6  8.04245e+00 1.64332e+00 8.87861e+01 147.523 -6.52216e+00 4.15146e+00  0.00000e+00 0.00000e+00 1.93835e+02 147.523 1.05049e+02 147.523 0.9329 
1 1 1 10  67  11 o 17 1.28630e+01 1.42739e+00 1.62119e+02 26.294  2.50714e+01  1.23878e+01  0.00000e+00 0.00000e+00 3.13562e+02 26.294  1.51443e+02 26.294  0.9820 
1 1 1 10  67  12 o 8  3.96225e+00 1.29777e+00 8.39519e+01 203.835 -5.16429e+00 -2.28146e+00 0.00000e+00 0.00000e+00 5.12719e+01 203.835 3.26801e+01 23.835  0.9065 
1 1 1 10  68  0  o 3  1.74462e+01 7.17268e-01 2.40094e+02 107.080 -1.43419e+01 4.66759e+01  0.00000e+00 0.00000e+00 4.09572e+02 107.080 1.69478e+02 107.080 0.9897 
1 1 1 10  68  1  o 16 6.30076e+00 9.40233e-01 1.08944e+02 257.121 -1.73281e+00 -7.57868e+00 0.00000e+00 0.00000e+00 1.12390e+02 257.121 3.44573e+00 257.121 0.9333 
1 1 1 10  68  2  o 4  8.98622e+00 8.11552e-01 1.65734e+02 218.895 -1.43583e+01 -1.15836e+01 0.00000e+00 0.00000e+00 1.63307e+02 218.895 2.42747e+00 38.895  0.9725 
1 1 1 10  68  3  o 12 4.18758e+00 9.85963e-01 6.67015e+01 47.812  2.22790e+00  2.45806e+00  0.00000e+00 0.00000e+00 6.43486e+01 47.812  2.35289e+00 227.812 0.8310 
1 1 1 10  68  4  o 18 5.76237e+00 1.07941e+00 1.30035e+02 234.734 -5.04386e+00 -7.13280e+00 0.00000e+00 0.00000e+00 7.41922e+01 234.734 5.58425e+01 54.735  0.9409 
1 1 1 10  68  5  o 4  9.73370e+00 9.86924e-01 1.91663e+02 155.028 -2.20018e+01 1.02464e+01  0.00000e+00 0.00000e+00 1.67396e+02 155.028 2.42662e+01 335.028 0.9792 
1 1 1 10  68  6  o 2  5.23923e+00 1.24906e+00 1.05691e+02 346.116 6.45181e+00  -1.59479e+00 0.00000e+00 0.00000e+00 7.61741e+01 346.116 2.95169e+01 166.116 0.9214 
1 1 1 10  68  7  o 9  5.53763e+00 1.26983e+00 8.12437e+01 72.425  1.57030e+00  4.95766e+00  0.00000e+00 0.00000e+00 1.06073e+02 72.425  2.48296e+01 72.425  0.8978 
1 1 1 10  68  8  o 16 1.10354e+01 1.45390e+00 2.27239e+02 290.694 1.02300e+01  -2.70816e+01 0.00000e+00 0.00000e+00 1.81256e+02 290.694 4.59834e+01 110.694 0.9826 
1 1 1 10  68  9  o 1  1.29374e+01 1.18704e+00 1.66104e+02 114.162 -1.17861e+01 2.62714e+01  0.00000e+00 0.00000e+00 3.12697e+02 114.162 1.46593e+02 114.162 0.9825 
1 1 1 10  68  10 o 10 4.44830e+00 1.33669e+00 6.18876e+01 141.078 -2.91348e+00 2.35270e+00  0.00000e+00 0.00000e+00 8.10077e+01 141.078 1.91201e+01 141.078 0.8529 
1 1 1 10  68  11 o 17 6.33182e+00 1.64975e+00 1.07100e+02 238.135 -4.24972e+00 -6.83671e+00 0.00000e+00 0.00000e+00 1.15973e+02 238.135 8.87256e+00 238.135 0.9357 
1 1 1 10  68  12 o 14 1.27795e+01 1.70672e+00 2.26510e+02 60.882  1.74885e+01  3.13977e+01  0.00000e+00 0.00000e+00 2.47796e+02 60.882  2.12858e+01 60.882  0.9860 
1 1 1 10  69  0  o 19 2.82771e+00 8.58006e-01 8.01431e+01 45.576  1.93234e+00  1.97157e+00  0.00000e+00 0.00000e+00 3.95658e+00 45.576  7.61865e+01 225.576 0.7906 
1 1 1 10  69  1  o 2  6.19933e+00 1.02612e+00 1.00417e+02 178.362 -7.05728e+00 2.01793e-01  0.00000e+00 0.00000e+00 1.15662e+02 178.362 1.52454e+01 178.362 0.9262 
1 1 1 10  69  2  o 8  1.01131e+01 7.56575e-01 2.04400e+02 346.284 2.39213e+01  -5.83830e+00 0.00000e+00 0.00000e+00 1.68489e+02 346.284 3.59107e+01 166.284 0.9795 
1 1 1 10  69  3  f 0  3.54273e+00 1.01921e+00 3.83559e+01 80.217  2.59716e-01  1.50626e+00  0.00000e+00 0.00000e+00 4.20951e+01 80.217  3.73920e+00 80.217  0.6031 
1 1 1 10  69  4  o 1  1.36236e+01 8.25518e-01 2.82796e+02 156.519 -4.54082e+01 1.97266e+01  0.00000e+00 0.00000e+00 2.25070e+02 156.519 5.77258e+01 336.519 0.9898 
1 1 1 10  69  5  o 14 1.81478e+01 8.05063e-01 2.88930e+02 244.381 -3.07886e+01 -6.42073e+01 0.00000e+00 0.00000e+00 3.89801e+02 244.381 1.00871e+02 244.381 0.9930 
1 1 1 10  69  6  o 9  5.75595e+00 1.30443e+00 1.18712e+02 71.980  2.44060e+00  7.50252e+00  0.00000e+00 0.00000e+00 8.38573e+01 71.980  3.48542e+01 251.980 0.9343 
1 1 1 10  69  7  o 6  4.53453e+00 1.24413e+00 9.44743e+01 250.520 -1.72739e+00 -4.88339e+00 0.00000e+00 0.00000e+00 5.88082e+01 250.520 3.56661e+01 70.520  0.8974 
1 1 1 10  69  8  o 7  4.84912e+00 1.35763e+00 1.33748e+02 259.030 -1.47625e+00 -7.61623e+00 0.00000e+00 0.00000e+00 3.66861e+01 259.030 9.70620e+01 79.030  0.9331 
1 1 1 10  69  9  o 18 6.13282e+00 1.43866e+00 7.88845e+01 161.319 -5.54628e+00 1.87524e+00  0.00000e+00 0.00000e+00 1.31311e+02 161.319 5.24266e+01 161.319 0.9100 
1 1 1 10  69  10 o 10 3.92529e+00 1.24553e+00 3.85006e+01 160.552 -2.08580e+00 7.36490e-01  0.00000e+00 0.00000e+00 6.93533e+01 160.552 3.08527e+01 160.552 0.7297 
1 1 1 10  69  11 o 18 4.68638e+00 1.44562e+00 8.73140e+01 302.433 3.02586e+00  -4.76195e+00 0.00000e+00 0.00000e+00 7.25992e+01 302.433 1.47147e+01 122.433 0.9064 
1 1 1 10  69  12 o 19 4.64724e+00 1.42793e+00 5.00233e+01 217.356 -2.73017e+00 -2.08404e+00 0.00000e+00 0.00000e+00 9.64748e+01 217.356 4.64515e+01 217.356 0.8376 
1 1 1 10  70  0  o 4  2.90886e+00 8.70742e-01 4.25656e+01 87.143  7.45044e-02  1.49306e+00  0.00000e+00 0.00000e+00 2.25172e+01 87.143  2.00485e+01 267.143 0.5949 
1 1 1 10  70  1  o 4  2.35618e+00 7.58059e-01 5.47744e+01 357.585 1.53463e+00  -6.47240e-02 0.00000e+00 0.00000e+00 1.14812e+00 177.585 5.59226e+01 177.585 0.6049 
1 1 1 10  70  2  o 9  8.32481e+00 8.31443e-01 1.49303e+02 85.237  1.25478e+00  1.50585e+01  0.00000e+00 0.00000e+00 1.53466e+02 85.237  4.16321e+00 85.237  0.9663 
1 1 1 10  70  3  o 12 4.15044e+00 1.06949e+00 1.04178e+02 190.050 -4.98488e+00 -8.83466e-01 0.00000e+00 0.00000e+00 3.56359e+01 190.050 6.85424e+01 10.050  0.8948 
1 1 1 10  70  4  o 1  9.32434e+00 9.77310e-01 1.48084e+02 220.889 -1.29588e+01 -1.12209e+01 0.00000e+00 0.00000e+00 1.92611e+02 220.889 4.45270e+01 220.889 0.9704 
1 1 1 10  70  5  o 3  7.92869e+00 1.07836e+00 1.56418e+02 59.129  8.52242e+00  1.42561e+01  0.00000e+00 0.00000e+00 1.33031e+02 59.129  2.33869e+01 239.129 0.9694 
1 1 1 10  70  6  o 6  4.68289e+00 1.19253e+00 8.46810e+01 75.042  1.26402e+00  4.73124e+00  0.00000e+00 0.00000e+00 7.24473e+01 75.042  1.22336e+01 255.042 0.8909 
1 1 1 10  70  7  o 18 1.36168e+01 9.84225e-01 2.28134e+02 277.386 6.07571e+00  -4.68675e+01 0.00000e+00 0.00000e+00 2.79235e+02 277.386 5.11012e+01 277.386 0.9894 
1 1 1 10  70  8  o 19 7.91450e+00 1.43975e+00 1.07787e+02 134.232 -7.15772e+00 7.35215e+00  0.00000e+00 0.00000e+00 1.75347e+02 134.232 6.75596e+01 134.232 0.9499 
1 1 1 10  70  9  o 3  4.55035e+00 1.27050e+00 9.62916e+01 23.907  5.63154e+00  2.49634e+00  0.00000e+00 0.00000e+00 6.04480e+01 23.907  3.58436e+01 203.907 0.9148 
1 1 1 10  70  10 o 5  5.74527e+00 1.51259e+00 4.17738e+01 40.793  2.26499e+00  1.95462e+00  0.00000e+00 0.00000e+00 1.33293e+02 40.793  9.15188e+01 40.793  0.8094 
1 1 1 10  70  11 o 15 5.64672e+00 1.56399e+00 1.10964e+02 45.659  5.45232e+00  5.57914e+00  0.00000e+00 0.00000e+00 8.74424e+01 45.659  2.35213e+01 225.659 0.9335 
1 1 1 10  70  12 o 2  9.71169e+00 1.87841e+00 1.16668e+02 328.746 1.04683e+01  -6.35332e+00 0.00000e+00 0.00000e+00 2.33507e+02 328.746 1.16840e+02 328.746 0.9583 
1 1 1 10  71  0  o 9  3.11159e+00 8.87028e-01 5.95333e+01 10.793  2.25253e+00  4.29428e-01  0.00000e+00 0.00000e+00 2.71101e+01 10.793  3.24233e+01 190.793 0.7405 
1 1 1 10  71  1  o 13 7.09766e+00 9.01769e-01 1.22190e+02 229.906 -6.60393e+00 -7.84417e+00 0.00000e+00 0.00000e+00 1.31436e+02 229.906 9.24567e+00 229.906 0.9499 
1 1 1 10  71  2  o 13 5.72371e+00 9.91527e-01 1.13137e+02 272.176 2.96884e-01  -7.81155e+00 0.00000e+00 0.00000e+00 8.79553e+01 272.176 2.51821e+01 92.176  0.9337 
1 1 1 10  71  3  o 12 6.11248e+00 1.01117e+00 1.37493e+02 353.618 9.90833e+00  -1.10827e+00 0.00000e+00 0.00000e+00 8.07137e+01 353.618 5.67795e+01 173.618 0.9484 
1 1 1 10  71  4  o 3  6.65169e+00 1.12413e+00 9.59955e+01 281.314 1.49046e+00  -7.44938e+00 0.00000e+00 0.00000e+00 1.37300e+02 281.314 4.13047e+01 281.314 0.9316 
1 1 1 10  71  5  f 0  5.50627e+00 1.13490e+00 5.67610e+01 148.609 -3.40960e+00 2.08053e+00  0.00000e+00 0.00000e+00 1.22216e+02 148.609 6.54552e+01 148.609 0.8633 
1 1 1 10  71  6  o 5  2.61776e+00 8.78988e-01 4.67219e+01 238.183 -9.74027e-01 -1.56992e+00 0.00000e+00 0.00000e+00 1.94250e+01 238.183 2.72969e+01 58.183  0.6711 
1 1 1 10  71  7  o 3  3.18271e+00 1.04401e+00 5.58627e+01 207.623 -2.34853e+00 -1.22897e+00 0.00000e+00 0.00000e+00 3.76659e+01 207.623 1.81968e+01 27.623  0.7804 
1 1 1 10  71  8  o 8  5.31155e+00 1.29323e+00 5.25143e+01 342.559 3.47920e+00  -1.09304e+00 0.00000e+00 0.00000e+00 1.17161e+02 342.559 6.46469e+01 342.559 0.8484 
1 1 1 10  71  9  o 17 3.60509e+00 1.15399e+00 8.24259e+01 183.893 -4.38728e+00 -2.98569e-01 0.00000e+00 0.00000e+00 3.66347e+01 183.893 4.57912e+01 3.893   0.8772 
1 1 1 10  71  10 o 15 6.37687e+00 1.59938e+00 8.56555e+01 121.022 -3.44365e+00 5.72615e+00  0.00000e+00 0.00000e+00 1.35604e+02 121.022 4.99482e+01 121.022 0.9218 
1 1 1 10  71  11 o 19 1.13902e+01 1.53751e+00 1.89151e+02 308.216 1.76240e+01  -2.23832e+01 0.00000e+00 0.00000e+00 2.31892e+02 308.216 4.27411e+01 308.216 0.9823 
1 1 1 10  72  0  o 7  3.79358e+00 8.61199e-01 5.05527e+01 136.182 -1.76947e+00 1.69793e+00  0.00000e+00 0.00000e+00 5.78017e+01 136.182 7.24896e+00 136.182 0.7597 
1 1 1 10  72  1  o 11 3.81485e+00 9.92996e-01 4.60908e+01 226.739 -1.45313e+00 -1.54414e+00 0.00000e+00 0.00000e+00 5.67239e+01 226.739 1.06331e+01 226.739 0.7166 
1 1 1 10  72  2  o 11 9.12192e+00 8.39770e-01 1.17134e+02 11.469  1.40466e+01  2.84991e+00  0.00000e+00 0.00000e+00 2.13857e+02 11.469  9.67224e+01 11.469  0.9645 
1 1 1 10  72  3  o 12 7.17653e+00 9.78958e-01 9.08395e+01 53.771  4.77603e+00  6.51881e+00  0.00000e+00 0.00000e+00 1.61918e+02 53.771  7.10788e+01 53.771  0.9359 
1 1 1 10  72  4  o 12 1.39837e+01 7.73088e-01 2.63763e+02 178.997 -5.76136e+01 1.00839e+00  0.00000e+00 0.00000e+00 2.57980e+02 178.997 5.78354e+00 358.997 0.9913 
1 1 1 10  72  5  o 11 7.65112e+00 1.11187e+00 1.66251e+02 353.197 1.63052e+01  -1.94498e+00 0.00000e+00 0.00000e+00 1.12854e+02 353.197 5.33966e+01 173.198 0.9691 
1 1 1 10  72  6  o 8  8.28973e+00 1.14704e+00 1.56336e+02 209.843 -1.53006e+01 -8.77796e+00 0.00000e+00 0.00000e+00 1.46762e+02 209.843 9.57457e+00 29.843  0.9712 
1 1 1 10  72  7  o 8  1.10515e+01 1.07559e+00 1.99012e+02 247.487 -1.25143e+01 -3.01926e+01 0.00000e+00 0.00000e+00 2.10623e+02 247.487 1.16113e+01 247.487 0.9846 
1 1 1 10  72  8  o 18 5.08764e+00 1.33932e+00 1.35085e+02 62.467  3.88168e+00  7.44614e+00  0.00000e+00 0.00000e+00 4.46424e+01 62.467  9.04422e+01 242.467 0.9384 
1 1 1 10  72  9  o 17 5.34945e+00 1.41844e+00 1.95985e+01 101.483 -2.65803e-01 1.30841e+00  0.00000e+00 0.00000e+00 9.16811e+01 101.483 7.20825e+01 101.483 0.5527 
1 1 1 10  72  10 o 19 8.90166e+00 1.57358e+00 2.24509e+02 351.993 2.39001e+01  -3.36192e+00 0.00000e+00 0.00000e+00 1.03475e+02 351.993 1.21034e+02 171.993 0.9791 
1 1 1 10  72  11 o 13 4.10145e+00 1.32822e+00 1.26884e+02 127.633 -5.16579e+00 6.69997e+00  0.00000e+00 0.00000e+00 1.80013e+01 127.633 1.08883e+02 307.633 0.9389 
1 1 1 10  73  0  o 7  4.03867e+00 9.96209e-01 6.07925e+01 205.860 -2.67335e+00 -1.29583e+00 0.00000e+00 0.00000e+00 6.18408e+01 205.860 1.04822e+00 205.860 0.8078 
1 1 1 10  73  1  o 8  1.29856e+01 6.93948e-01 2.28409e+02 72.342  1.27844e+01  4.01597e+01  0.00000e+00 0.00000e+00 2.54063e+02 72.342  2.56539e+01 72.342  0.9881 
1 1 1 10  73  2  o 5  1.35858e+01 7.03682e-01 2.28405e+02 236.100 -2.40797e+01 -3.58347e+01 0.00000e+00 0.00000e+00 2.76669e+02 236.100 4.82639e+01 236.100 0.9884 
1 1 1 10  73  3  o 13 4.44663e+00 1.11449e+00 5.33437e+01 147.008 -2.37706e+00 1.54321e+00  0.00000e+00 0.00000e+00 7.99835e+01 147.008 2.66398e+01 147.008 0.7969 
1 1 1 10  73  4  o 6  8.39288e+00 1.00040e+00 1.45189e+02 219.411 -1.28457e+01 -1.05557e+01 0.00000e+00 0.00000e+00 1.60996e+02 219.411 1.58069e+01 219.411 0.9694 
1 1 1 10  73  5  o 12 3.84111e+00 1.04183e+00 5.44279e+01 193.840 -2.71641e+00 -6.69217e-01 0.00000e+00 0.00000e+00 6.03328e+01 193.840 5.90497e+00 193.840 0.7938 
1 1 1 10  73  6  o 3  3.89317e+00 1.13113e+00 8.04328e+01 74.000  1.20613e+00  4.20634e+00  0.00000e+00 0.00000e+00 4.80140e+01 74.000  3.24188e+01 254.000 0.8766 
1 1 1 10  73  7  o 17 4.84584e+00 1.19428e+00 1.17130e+02 342.383 7.13277e+00  -2.26493e+00 0.00000e+00 0.00000e+00 5.25987e+01 342.383 6.45312e+01 162.383 0.9306 
1 1 1 10  73  8  o 9  8.82776e+00 1.31656e+00 1.56464e+02 117.155 -8.34687e+00 1.62730e+01  0.00000e+00 0.00000e+00 1.66571e+02 117.155 1.01067e+01 117.155 0.9723 
1 1 1 10  73  9  o 17 4.64764e+00 1.31368e+00 1.00562e+02 54.920  3.70739e+00  5.27891e+00  0.00000e+00 0.00000e+00 6.01447e+01 54.920  4.04177e+01 234.920 0.9188 
1 1 1 10  73  10 o 18 4.73746e+00 1.40182e+00 1.12214e+02 87.998  2.65360e-01  7.59096e+00  0.00000e+00 0.00000e+00 5.38507e+01 87.998  5.83637e+01 267.998 0.9316 
1 1 1 10  73  11 f 0  1.11074e+01 1.67994e+00 1.97926e+02 256.840 -6.22670e+00 -2.66322e+01 0.00000e+00 0.00000e+00 2.12191e+02 256.840 1.42653e+01 256.840 0.9815 
1 1 1 10  74  0  o 16 8.39605e+00 8.06125e-01 1.49162e+02 22.304  1.49705e+01  6.14098e+00  0.00000e+00 0.00000e+00 1.56464e+02 22.304  7.30269e+00 22.304  0.9686 
1 1 1 10  74  1  o 8  5.78492e+00 1.05612e+00 8.89079e+01 134.839 -4.33933e+00 4.36386e+00  0.00000e+00 0.00000e+00 1.10026e+02 134.839 2.11179e+01 134.839 0.9147 
1 1 1 10  74  2  o 4  7.64692e+00 9.06518e-01 1.29821e+02 268.679 -3.02219e-01 -1.31048e+01 0.00000e+00 0.00000e+00 1.46562e+02 268.679 1.67413e+01 268.679 0.9611 
1 1 1 10  74  3  o 18 8.34881e+00 9.26678e-01 1.21980e+02 92.034  -5.24069e-01 1.47573e+01  0.00000e+00 0.00000e+00 1.81247e+02 92.034  5.92667e+01 92.034  0.9655 
1 1 1 10  74  4  o 11 5.83671e+00 1.12665e+00 7.03066e+01 35.977  4.23068e+00  3.07121e+00  0.00000e+00 0.00000e+00 1.26984e+02 35.977  5.66778e+01 35.977  0.8984 
1 1 1 10  74  5  o 11 3.02696e+00 9.54560e-01 3.00206e+01 129.822 -7.93342e-01 9.51448e-01  0.00000e+00 0.00000e+00 2.97360e+01 129.822 2.84655e-01 309.822 0.5246 
1 1 1 10  74  6  o 15 7.33324e+00 1.22732e+00 1.45831e+02 197.698 -1.36022e+01 -4.34061e+00 0.00000e+00 0.00000e+00 1.20281e+02 197.698 2.55503e+01 17.698  0.9643 
1 1 1 10  74  7  o 12 9.20551e+00 1.21095e+00 1.90349e+02 29.618  2.20159e+01  1.25161e+01  0.00000e+00 0.00000e+00 1.49158e+02 29.618  4.11906e+01 209.618 0.9801 
1 1 1 10  74  8  o 13 3.17270e+00 1.01124e+00 9.92030e+00 230.832 -3.31328e-01 -4.06718e-01 0.00000e+00 0.00000e+00 2.03643e+01 230.832 1.04440e+01 230.832 0.2537 
1 1 1 10  74  9  o 6  5.01362e+00 1.43219e+00 4.66493e+01 266.793 -1.73645e-01 -3.09867e+00 0.00000e+00 0.00000e+00 1.07535e+02 266.793 6.08854e+01 266.793 0.8174 
1 1 1 10  74  10 o 13 4.27696e+00 1.35002e+00 5.49872e+01 151.512 -3.06227e+00 1.66182e+00  0.00000e+00 0.00000e+00 8.02056e+01 151.512 2.52184e+01 151.512 0.8403 
1 1 1 10  74  11 o 16 3.94826e+00 1.29870e+00 6.12469e+01 312.182 2.83269e+00  -3.12598e+00 0.00000e+00 0.00000e+00 6.81526e+01 312.182 6.90570e+00 312.182 0.8714 
1 1 1 10  75  0  o 11 8.35372e+00 7.87216e-01 1.65441e+02 152.010 -1.73598e+01 9.22667e+00  0.00000e+00 0.00000e+00 1.40351e+02 152.010 2.50901e+01 332.009 0.9742 
1 1 1 10  75  1  o 12 3.29762e+00 9.56098e-01 6.23851e+01 329.964 2.29787e+00  -1.32858e+00 0.00000e+00 0.00000e+00 3.43943e+01 329.964 2.79908e+01 149.964 0.7808 
1 1 1 10  75  2  o 7  9.28481e+00 8.52406e-01 1.66014e+02 94.571  -1.63157e+00 2.04072e+01  0.00000e+00 0.00000e+00 1.74456e+02 94.571  8.44139e+00 94.571  0.9753 
1 1 1 10  75  3  o 10 9.15027e+00 8.71255e-01 1.54108e+02 291.482 7.55880e+00  -1.92069e+01 0.00000e+00 0.00000e+00 1.81583e+02 291.482 2.74754e+01 291.482 0.9755 
1 1 1 10  75  4  o 11 1.03342e+01 8.67592e-01 1.79386e+02 171.210 -2.67754e+01 4.14013e+00  0.00000e+00 0.00000e+00 2.02104e+02 171.210 2.27183e+01 171.210 0.9814 
1 1 1 10  75  5  o 17 5.51426e+00 1.18508e+00 9.52507e+01 304.985 3.76151e+00  -5.37500e+00 0.00000e+00 0.00000e+00 9.56613e+01 304.985 4.10578e-01 304.985 0.9203 
1 1 1 10  75  6  o 19 2.86659e+00 9.49575e-01 5.28368e+01 207.528 -2.10305e+00 -1.09608e+00 0.00000e+00 0.00000e+00 2.80809e+01 207.528 2.47559e+01 27.528  0.7503 
1 1 1 10  75  7  o 4  5.00496e+00 1.29498e+00 8.52634e+01 34.596  4.66314e+00  3.21641e+00  0.00000e+00 0.00000e+00 8.54946e+01 34.596  2.31194e-01 34.596  0.9068 
1 1 1 10  75  8  o 16 3.38671e+00 1.10832e+00 8.59532e+01 14.401  4.29519e+00  1.10290e+00  0.00000e+00 0.00000e+00 2.59639e+01 14.401  5.99893e+01 194.401 0.8784 
1 1 1 10  75  9  o 19 3.48784e+00 1.14006e+00 2.02210e+01 185.826 -1.15915e+00 -1.18280e-01 0.00000e+00 0.00000e+00 4.56245e+01 185.826 2.54035e+01 185.826 0.5019 
1 1 1 10  75  10 o 13 1.16321e+01 1.45361e+00 1.77857e+02 302.089 1.48385e+01  -2.36647e+01 0.00000e+00 0.00000e+00 2.51728e+02 302.089 7.38713e+01 302.089 0.9819 
1 1 1 10  75  11 o 7  3.27611e+00 1.11467e+00 9.97339e+01 98.471  -9.72783e-01 6.53139e+00  0.00000e+00 0.00000e+00 1.36989e+01 98.471  8.60350e+01 278.471 0.9208 
1 1 1 10  76  0  o 4  6.62728e+00 9.04353e-01 8.97906e+01 265.679 -5.82615e-01 -7.71046e+00 0.00000e+00 0.00000e+00 1.42465e+02 265.679 5.26746e+01 265.679 0.9329 
1 1 1 10  76  1  f 0  9.66639e+00 8.04251e-01 1.51185e+02 18.694  1.87486e+01  6.34374e+00  0.00000e+00 0.00000e+00 2.02781e+02 18.694  5.15962e+01 18.694  0.9744 
1 1 1 10  76  2  o 17 5.38116e+00 1.00984e+00 5.72040e+01 134.195 -2.91324e+00 2.99626e+00  0.00000e+00 0.00000e+00 1.18801e+02 134.195 6.15969e+01 134.195 0.8701 
1 1 1 10  76  3  o 17 1.00839e+01 8.33609e-01 1.69379e+02 204.456 -2.29458e+01 -1.04356e+01 0.00000e+00 0.00000e+00 2.02190e+02 204.456 3.28107e+01 204.456 0.9800 
1 1 1 10  76  4  o 7  5.32027e+00 1.14782e+00 6.52362e+01 10.602  4.21339e+00  7.88659e-01  0.00000e+00 0.00000e+00 1.09580e+02 10.602  4.43439e+01 10.602  0.8737 
1 1 1 10  76  5  f 0  3.43024e+00 1.03428e+00 1.94145e+01 37.043  7.43615e-01  5.61230e-01  0.00000e+00 0.00000e+00 3.49867e+01 37.043  1.55722e+01 37.043  0.4216 
1 1 1 10  76  6  o 1  3.89142e+00 1.12494e+00 4.71626e+01 179.176 -2.52015e+00 3.62358e-02  0.00000e+00 0.00000e+00 6.51390e+01 179.176 1.79764e+01 179.176 0.7672 
1 1 1 10  76  7  o 2  1.18300e+01 1.27737e+00 2.47056e+02 299.964 1.98566e+01  -3.44421e+01 0.00000e+00 0.00000e+00 1.92306e+02 299.964 5.47500e+01 119.964 0.9873 
1 1 1 10  76  8  o 15 8.20687e+00 1.31671e+00 9.80091e+01 193.276 -1.06791e+01 -2.51975e+00 0.00000e+00 0.00000e+00 1.96261e+02 193.276 9.82522e+01 193.276 0.9533 
1 1 1 10  76  9  o 18 3.93384e+00 1.24274e+00 4.41601e+01 74.914  6.93381e-01  2.57235e+00  0.00000e+00 0.00000e+00 7.14970e+01 74.914  2.73369e+01 74.914  0.7817 
1 1 1 10  76  10 o 9  3.66435e+00 1.18451e+00 8.49822e+01 267.781 -2.09376e-01 -5.40455e+00 0.00000e+00 0.00000e+00 3.93136e+01 267.781 4.56686e+01 87.781  0.9021 
1 1 1 10  76  11 o 9  4.30624e+00 1.36175e+00 2.12698e+01 23.940  1.38714e+00  6.15841e-01  0.00000e+00 0.00000e+00 7.59406e+01 23.940  5.46708e+01 23.940  0.6005 
1 1 1 10  77  0  o 6  3.06775e+00 9.09644e-01 6.43934e+01 206.753 -2.57643e+00 -1.29878e+00 0.00000e+00 0.00000e+00 2.79126e+01 206.753 3.64808e+01 26.753  0.8011 
1 1 1 10  77  1  o 2  7.49898e+00 8.71085e-01 9.59232e+01 195.128 -1.00943e+01 -2.72891e+00 0.00000e+00 0.00000e+00 1.71999e+02 195.128 7.60762e+01 195.128 0.9509 
1 1 1 10  77  2  o 10 2.83295e+00 8.90832e-01 4.43236e+01 254.137 -4.93388e-01 -1.73626e+00 0.00000e+00 0.00000e+00 2.62691e+01 254.137 1.80545e+01 74.137  0.6630 
1 1 1 10  77  3  o 19 2.78092e+00 8.65338e-01 6.23095e+01 30.366  2.18420e+00  1.27971e+00  0.00000e+00 0.00000e+00 1.80201e+01 30.366  4.42893e+01 210.366 0.7684 
1 1 1 10  77  4  o 7  7.93576e+00 9.90681e-01 1.43840e+02 282.856 3.77706e+00  -1.65499e+01 0.00000e+00 0.00000e+00 1.45622e+02 282.856 1.78178e+00 282.856 0.9701 
1 1 1 10  77  5  o 11 3.18849e+00 9.76094e-01 2.86722e+01 126.471 -8.41499e-01 1.13844e+00  0.00000e+00 0.00000e+00 4.02234e+01 126.471 1.15512e+01 126.471 0.5746 
1 1 1 10  77  6  o 9  1.46886e+01 8.85356e-01 2.71356e+02 74.019  1.94705e+01  6.79858e+01  0.00000e+00 0.00000e+00 2.77132e+02 74.019  5.77639e+00 74.019  0.9929 
1 1 1 10  77  7  o 3  6.22151e+00 1.49318e+00 1.02538e+02 355.009 7.41362e+00  -6.47442e-01 0.00000e+00 0.00000e+00 1.15099e+02 355.009 1.25609e+01 355.009 0.9302 
1 1 1 10  77  8  o 8  6.02083e+00 1.40222e+00 1.25824e+02 232.832 -5.94371e+00 -7.83954e+00 0.00000e+00 0.00000e+00 8.87594e+01 232.832 3.70647e+01 52.832  0.9477 
1 1 1 10  77  9  o 2  3.71399e+00 1.20683e+00 4.67814e+01 164.106 -2.60812e+00 7.42650e-01  0.00000e+00 0.00000e+00 6.30125e+01 164.106 1.62310e+01 164.106 0.7862 
1 1 1 10  77  10 f 0  6.25232e+00 1.53379e+00 4.93857e+01 241.209 -2.04840e+00 -3.72736e+00 0.00000e+00 0.00000e+00 1.55723e+02 241.209 1.06337e+02 241.209 0.8726 
1 1 1 10  78  0  f 0  5.83194e+00 9.56342e-01 1.10459e+02 169.233 -8.86806e+00 1.68640e+00  0.00000e+00 0.00000e+00 9.60205e+01 169.233 1.44384e+01 349.233 0.9429 
1 1 1 10  78  1  o 12 8.34497e+00 8.50158e-01 1.68440e+02 7.274   2.04212e+01  2.60664e+00  0.00000e+00 0.00000e+00 1.37322e+02 7.274   3.11173e+01 187.274 0.9754 
1 1 1 10  78  2  o 11 6.63990e+00 1.03245e+00 8.11279e+01 157.005 -6.67119e+00 2.83105e+00  0.00000e+00 0.00000e+00 1.50457e+02 157.005 6.93290e+01 157.005 0.9282 
1 1 1 10  78  3  o 10 9.02571e+00 9.08831e-01 1.29574e+02 356.518 1.62543e+01  -9.88939e-01 0.00000e+00 0.00000e+00 1.99074e+02 356.518 6.94998e+01 356.518 0.9688 
1 1 1 10  78  4  o 14 6.22429e+00 1.16754e+00 1.02826e+02 166.085 -8.48615e+00 2.10248e+00  0.00000e+00 0.00000e+00 1.17342e+02 166.085 1.45155e+01 166.085 0.9409 
1 1 1 10  78  5  o 11 4.47491e+00 1.11248e+00 9.72947e+01 212.985 -5.30045e+00 -3.44025e+00 0.00000e+00 0.00000e+00 5.69936e+01 212.985 4.03010e+01 32.986  0.9170 
1 1 1 10  78  6  o 16 6.99981e+00 1.25004e+00 1.13653e+02 189.733 -1.07128e+01 -1.83749e+00 0.00000e+00 0.00000e+00 1.37123e+02 189.733 2.34707e+01 189.733 0.9528 
1 1 1 10  78  7  o 9  5.53754e+00 1.47838e+00 1.11437e+02 9.207   7.00474e+00  1.13542e+00  0.00000e+00 0.00000e+00 8.14898e+01 9.207   2.99477e+01 189.207 0.9266 
1 1 1 10  78  8  o 12 3.04474e+00 1.01639e+00 4.00493e+01 242.675 -9.95144e-01 -1.92597e+00 0.00000e+00 0.00000e+00 4.27744e+01 242.675 2.72512e+00 242.675 0.7235 
1 1 1 10  78  9  o 17 6.01179e+00 1.47382e+00 6.77392e+01 187.356 -5.43021e+00 -7.01025e-01 0.00000e+00 0.00000e+00 1.36422e+02 187.356 6.86830e+01 187.356 0.9034 
1 1 1 10  78  10 o 10 3.36086e+00 1.13727e+00 3.03251e+01 325.215 1.67267e+00  -1.16189e+00 0.00000e+00 0.00000e+00 5.85688e+01 325.215 2.82437e+01 325.215 0.7037 
1 1 1 10  79  0  o 6  2.98934e+00 8.98260e-01 7.06391e+01 111.544 -1.11487e+00 2.82387e+00  0.00000e+00 0.00000e+00 2.05574e+01 111.544 5.00817e+01 291.544 0.8126 
1 1 1 10  79  1  o 13 3.07232e+00 9.20010e-01 5.89854e+01 261.682 -3.73116e-01 -2.55209e+00 0.00000e+00 0.00000e+00 3.02468e+01 261.682 2.87386e+01 81.682  0.7733 
1 1 1 10  79  2  o 18 8.94651e+00 9.11228e-01 1.37070e+02 94.826  -1.43611e+00 1.70081e+01  0.00000e+00 0.00000e+00 1.89032e+02 94.826  5.19622e+01 94.826  0.9702 
1 1 1 10  79  3  o 2  9.37378e+00 9.52182e-01 1.61421e+02 271.949 7.27184e-01  -2.13666e+01 0.00000e+00 0.00000e+00 1.82481e+02 271.949 2.10593e+01 271.949 0.9763 
1 1 1 10  79  4  o 9  1.38247e+01 7.79534e-01 2.23104e+02 160.872 -5.01670e+01 1.73998e+01  0.00000e+00 0.00000e+00 2.91571e+02 160.872 6.84669e+01 160.872 0.9905 
1 1 1 10  79  5  o 12 6.90454e+00 1.16142e+00 2.04441e+02 22.890  1.87109e+01  7.89978e+00  0.00000e+00 0.00000e+00 4.86234e+01 22.890  1.55817e+02 202.889 0.9751 
1 1 1 10  79  6  o 12 6.92092e+00 1.22069e+00 9.95007e+01 54.863  5.59206e+00  7.94591e+00  0.00000e+00 0.00000e+00 1.46893e+02 54.863  4.73923e+01 54.863  0.9471 
1 1 1 10  79  7  o 10 4.60432e+00 1.39511e+00 5.62785e+01 3.762   3.30786e+00  2.17478e-01  0.00000e+00 0.00000e+00 8.75250e+01 3.762   3.12465e+01 3.762   0.8308 
1 1 1 10  79  8  o 5  3.11639e+00 1.03566e+00 9.95985e+01 84.122  5.64479e-01  5.48339e+00  0.00000e+00 0.00000e+00 6.30612e+00 84.122  9.32924e+01 264.122 0.9040 
1 1 1 10  79  9  o 17 5.91194e+00 1.49792e+00 8.37590e+01 144.578 -5.27603e+00 3.75250e+00  0.00000e+00 0.00000e+00 1.20480e+02 144.578 3.67206e+01 144.578 0.9192 
1 1 1 10  79  10 o 11 2.94216e+00 1.01270e+00 5.18928e+01 20.669  2.93790e+00  1.10830e+00  0.00000e+00 0.00000e+00 3.87494e+01 20.669  1.31434e+01 200.669 0.8198 
1 1 1 10  80  0  o 18 7.84111e+00 8.60481e-01 8.68687e+01 288.751 3.33521e+00  -9.82490e+00 0.00000e+00 0.00000e+00 1.92876e+02 288.751 1.06007e+02 288.751 0.9505 
1 1 1 10  80  1  o 18 5.17621e+00 9.86296e-01 9.54753e+01 14.907  6.40405e+00  1.70484e+00  0.00000e+00 0.00000e+00 8.35495e+01 14.907  1.19258e+01 194.907 0.9211 
1 1 1 10  80  2  o 13 8.11720e+00 9.31136e-01 1.30467e+02 140.903 -1.26193e+01 1.02543e+01  0.00000e+00 0.00000e+00 1.64883e+02 140.903 3.44159e+01 140.903 0.9687 
1 1 1 10  80  3  o 17 9.58705e+00 9.18860e-01 1.41436e+02 219.100 -1.56293e+01 -1.27017e+01 0.00000e+00 0.00000e+00 2.09681e+02 219.100 6.82451e+01 219.100 0.9748 
1 1 1 10  80  4  o 16 4.06882e+00 9.77421e-01 6.97662e+01 8.673   4.41267e+00  6.73120e-01  0.00000e+00 0.00000e+00 6.46639e+01 8.673   5.10231e+00 188.673 0.8793 
1 1 1 10  80  5  o 10 9.94731e+00 9.53454e-01 1.49234e+02 119.070 -1.16047e+01 2.08751e+01  0.00000e+00 0.00000e+00 2.16684e+02 119.070 6.74494e+01 119.070 0.9788 
1 1 1 10  80  6  o 11 9.90948e+00 1.01136e+00 1.33770e+02 221.052 -1.66704e+01 -1.45179e+01 0.00000e+00 0.00000e+00 2.30140e+02 221.052 9.63701e+01 221.052 0.9771 
1 1 1 10  80  7  o 1  7.09039e+00 1.34268e+00 1.42882e+02 344.652 1.32262e+01  -3.63020e+00 0.00000e+00 0.00000e+00 1.13695e+02 344.652 2.91864e+01 164.652 0.9628 
1 1 1 10  80  8  o 2  5.26287e+00 1.19273e+00 8.04131e+01 79.630  1.20969e+00  6.61049e+00  0.00000e+00 0.00000e+00 1.02000e+02 79.630  2.15871e+01 79.630  0.9223 
1 1 1 10  80  9  f 0  3.65255e+00 1.16426e+00 7.81343e+01 187.645 -4.99204e+00 -6.70082e-01 0.00000e+00 0.00000e+00 4.46015e+01 187.645 3.35328e+01 7.645   0.8942 
1 1 1 10  80  10 o 18 4.78201e+00 1.44534e+00 8.11986e+01 356.250 5.88674e+00  -3.85791e-01 0.00000e+00 0.00000e+00 8.24325e+01 356.250 1.23389e+00 356.250 0.9108 
1 1 1 10  81  0  o 13 8.56131e+00 8.22836e-01 1.24526e+02 150.019 -1.50089e+01 8.65866e+00  0.00000e+00 0.00000e+00 1.87331e+02 150.019 6.28052e+01 150.019 0.9707 
1 1 1 10  81  1  f 0  5.28076e+00 1.01909e+00 1.05193e+02 83.622  8.42456e-01  7.53661e+00  0.00000e+00 0.00000e+00 7.94700e+01 83.622  2.57232e+01 263.622 0.9315 
1 1 1 10  81  2  o 16 9.46668e+00 8.20364e-01 1.85822e+02 83.997  3.05165e+00  2.90211e+01  0.00000e+00 0.00000e+00 1.63520e+02 83.997  2.23026e+01 263.997 0.9827 
1 1 1 10  81  3  o 10 1.03881e+01 8.27816e-01 1.74427e+02 241.707 -1.43680e+01 -2.66925e+01 0.00000e+00 0.00000e+00 2.09266e+02 241.707 3.48390e+01 241.707 0.9834 
1 1 1 10  81  4  o 4  1.01373e+01 9.05188e-01 1.54928e+02 127.242 -1.59606e+01 2.09957e+01  0.00000e+00 0.00000e+00 2.18620e+02 127.242 6.36920e+01 127.242 0.9809 
1 1 1 10  81  5  o 1  7.40893e+00 1.15264e+00 1.19931e+02 338.594 1.13098e+01  -4.43367e+00 0.00000e+00 0.00000e+00 1.46726e+02 338.594 2.67946e+01 338.594 0.9579 
1 1 1 10  81  6  o 18 6.92624e+00 1.20751e+00 1.41867e+02 122.832 -7.26518e+00 1.12593e+01  0.00000e+00 0.00000e+00 1.08480e+02 122.832 3.33867e+01 302.832 0.9619 
1 1 1 10  81  7  o 3  4.52715e+00 1.10496e+00 6.02716e+01 251.665 -1.43685e+00 -4.33579e+00 0.00000e+00 0.00000e+00 8.98138e+01 251.665 2.95422e+01 251.665 0.8823 
1 1 1 10  81  8  o 10 4.29650e+00 1.27066e+00 5.73841e+01 343.190 3.72259e+00  -1.12464e+00 0.00000e+00 0.00000e+00 8.13046e+01 343.190 2.39204e+01 343.190 0.8591 
1 1 1 10  81  9  o 8  8.43689e+00 1.44363e+00 1.16320e+02 44.649  1.03386e+01  1.02125e+01  0.00000e+00 0.00000e+00 1.89538e+02 44.649  7.32177e+01 44.649  0.9650 
1 1 1 10  81  10 o 16 4.79534e+00 1.42122e+00 3.63066e+01 176.885 -2.73656e+00 1.48925e-01  0.00000e+00 0.00000e+00 1.05779e+02 176.885 6.94722e+01 176.885 0.7888 
1 1 1 10  82  0  o 13 5.50979e+00 1.02872e+00 1.39939e+02 44.781  8.11121e+00  8.04943e+00  0.00000e+00 0.00000e+00 5.75104e+01 44.781  8.24290e+01 224.781 0.9552 
1 1 1 10  82  1  o 12 5.53015e+00 1.05423e+00 1.03101e+02 178.966 -7.87943e+00 1.42189e-01  0.00000e+00 0.00000e+00 9.07991e+01 178.966 1.23015e+01 358.966 0.9342 
1 1 1 10  82  2  o 10 5.33223e+00 1.05842e+00 1.52444e+02 322.631 9.53329e+00  -7.28045e+00 0.00000e+00 0.00000e+00 3.92089e+01 322.631 1.13235e+02 142.632 0.9574 
1 1 1 10  82  3  o 12 4.94642e+00 1.08356e+00 1.28844e+02 36.155  7.23986e+00  5.28999e+00  0.00000e+00 0.00000e+00 4.62200e+01 36.155  8.26237e+01 216.155 0.9425 
1 1 1 10  82  4  o 17 1.11703e+01 9.05988e-01 1.97186e+02 187.881 -3.60600e+01 -4.99126e+00 0.00000e+00 0.00000e+00 2.16564e+02 187.881 1.93780e+01 187.881 0.9862 
1 1 1 10  82  5  o 16 7.87440e+00 1.11929e+00 1.17597e+02 304.903 7.87158e+00  -1.12822e+01 0.00000e+00 0.00000e+00 1.67236e+02 304.903 4.96391e+01 304.903 0.9629 
1 1 1 10  82  6  o 8  3.35384e+00 1.06028e+00 6.82700e+01 146.813 -3.05290e+00 1.99673e+00  0.00000e+00 0.00000e+00 3.86315e+01 146.813 2.96385e+01 326.813 0.8485 
1 1 1 10  82  7  o 15 5.80080e+00 1.31722e+00 9.48977e+01 69.945  2.74712e+00  7.52502e+00  0.00000e+00 0.00000e+00 1.08928e+02 69.945  1.40299e+01 69.945  0.9353 
1 1 1 10  82  8  o 15 3.52435e+00 1.09965e+00 1.06690e+02 329.711 5.79780e+00  -3.38650e+00 0.00000e+00 0.00000e+00 1.54021e+01 329.711 9.12874e+01 149.711 0.9222 
1 1 1 10  82  9  o 1  3.87971e+00 1.28127e+00 5.19104e+01 83.802  3.84289e-01  3.53878e+00  0.00000e+00 0.00000e+00 7.11038e+01 83.802  1.91934e+01 83.802  0.8442 
1 1 1 10  82  10 o 7  4.97702e+00 1.42303e+00 5.27276e+01 75.095  1.05113e+00  3.94903e+00  0.00000e+00 0.00000e+00 1.09277e+02 75.095  5.65495e+01 75.095  0.8668 
1 1 1 10  83  0  o 17 5.52505e+00 1.04382e+00 7.75124e+01 101.032 -1.22042e+00 6.25961e+00  0.00000e+00 0.00000e+00 1.12702e+02 101.032 3.51896e+01 101.032 0.9179 
1 1 1 10  83  1  o 4  6.92779e+00 9.64313e-01 7.84095e+01 79.120  1.59273e+00  8.28620e+00  0.00000e+00 0.00000e+00 1.65613e+02 79.120  8.72032e+01 79.120  0.9387 
1 1 1 10  83  2  o 3  7.89161e+00 9.36644e-01 1.34659e+02 34.408  1.40993e+01  9.65675e+00  0.00000e+00 0.00000e+00 1.52747e+02 34.408  1.80883e+01 34.408  0.9703 
1 1 1 10  83  3  o 15 7.41616e+00 1.02136e+00 1.51981e+02 207.496 -1.63244e+01 -8.49656e+00 0.00000e+00 0.00000e+00 1.18777e+02 207.496 3.32041e+01 27.496  0.9724 
1 1 1 10  83  4  o 1  6.80505e+00 1.13066e+00 9.90845e+01 168.329 -9.14405e+00 1.88884e+00  0.00000e+00 0.00000e+00 1.42354e+02 168.329 4.32694e+01 168.329 0.9448 
1 1 1 10  83  5  o 5  3.70803e+00 1.08599e+00 2.81049e+01 118.486 -7.30971e-01 1.34704e+00  0.00000e+00 0.00000e+00 5.60192e+01 118.486 2.79142e+01 118.486 0.6041 
1 1 1 10  83  6  o 11 7.10511e+00 1.25176e+00 1.57198e+02 55.582  9.08555e+00  1.32600e+01  0.00000e+00 0.00000e+00 1.01219e+02 55.582  5.59797e+01 235.582 0.9684 
1 1 1 10  83  7  f 0  4.23951e+00 1.23069e+00 5.28206e+01 335.181 3.14297e+00  -1.45354e+00 0.00000e+00 0.00000e+00 8.07950e+01 335.181 2.79744e+01 335.181 0.8391 
1 1 1 10  83  8  o 5  6.58440e+00 1.44992e+00 2.21095e+02 259.692 -3.55261e+00 -1.95335e+01 0.00000e+00 0.00000e+00 1.98812e+01 259.692 2.01214e+02 79.692  0.9745 
1 1 1 10  83  9  o 15 4.61612e+00 1.43686e+00 9.40697e+01 63.665  2.82705e+00  5.71135e+00  0.00000e+00 0.00000e+00 6.50244e+01 63.665  2.90453e+01 243.665 0.9178 
1 1 1 10  83  10 o 17 3.13118e+00 1.06704e+00 3.85465e+01 85.362  2.32166e-01  2.86173e+00  0.00000e+00 0.00000e+00 5.55013e+01 85.362  1.69548e+01 85.362  0.8000 
1 1 1 10  84  0  o 7  7.27297e+00 9.21721e-01 8.50659e+01 27.597  8.89582e+00  4.64999e+00  0.00000e+00 0.00000e+00 1.73708e+02 27.597  8.86423e+01 27.597  0.9488 
1 1 1 10  84  1  o 4  1.57015e+01 6.93348e-01 2.70977e+02 154.702 -6.62281e+01 3.13034e+01  0.00000e+00 0.00000e+00 3.14020e+02 154.702 4.30425e+01 154.702 0.9932 
1 1 1 10  84  2  o 6  5.59893e+00 1.01121e+00 9.89957e+01 268.432 -2.39035e-01 -8.73459e+00 0.00000e+00 0.00000e+00 9.86938e+01 268.432 3.01861e-01 88.432  0.9409 
1 1 1 10  84  3  o 13 6.14853e+00 1.08871e+00 1.25324e+02 164.110 -1.12096e+01 3.19108e+00  0.00000e+00 0.00000e+00 9.53281e+01 164.110 2.99963e+01 344.110 0.9561 
1 1 1 10  84  4  o 9  4.19152e+00 1.09179e+00 7.80328e+01 327.872 4.18498e+00  -2.62812e+00 0.00000e+00 0.00000e+00 6.23346e+01 327.872 1.56982e+01 147.872 0.8920 
1 1 1 10  84  5  o 1  5.02270e+00 1.22521e+00 8.04114e+01 101.229 -1.12734e+00 5.67836e+00  0.00000e+00 0.00000e+00 9.10066e+01 101.229 1.05953e+01 101.229 0.9090 
1 1 1 10  84  6  o 9  6.60870e+00 1.27307e+00 1.47843e+02 333.126 1.29502e+01  -6.56248e+00 0.00000e+00 0.00000e+00 9.16067e+01 333.126 5.62366e+01 153.127 0.9649 
1 1 1 10  84  7  o 18 4.01930e+00 1.19071e+00 4.17370e+01 252.099 -8.63938e-01 -2.67472e+00 0.00000e+00 0.00000e+00 7.82422e+01 252.099 3.65052e+01 252.099 0.7950 
1 1 1 10  84  8  o 17 8.51602e+00 1.32018e+00 1.03899e+02 178.959 -1.38385e+01 2.51429e-01  0.00000e+00 0.00000e+00 2.04083e+02 178.959 1.00184e+02 178.959 0.9632 
1 1 1 10  84  9  o 10 3.94815e+00 1.30313e+00 5.22898e+01 229.627 -2.28664e+00 -2.68940e+00 0.00000e+00 0.00000e+00 7.26156e+01 229.627 2.03258e+01 229.627 0.8427 
1 1 1 10  85  0  o 8  1.32367e+01 6.59704e-01 2.77776e+02 146.929 -5.88234e+01 3.83048e+01  0.00000e+00 0.00000e+00 2.14941e+02 146.929 6.28351e+01 326.928 0.9929 
1 1 1 10  85  1  o 10 4.03712e+00 1.03845e+00 8.42200e+01 59.695  2.77067e+00  4.74051e+00  0.00000e+00 0.00000e+00 5.26049e+01 59.695  3.16152e+01 239.695 0.9036 
1 1 1 10  85  2  o 19 6.14222e+00 9.93046e-01 1.01911e+02 278.436 1.44197e+00  -9.72318e+00 0.00000e+00 0.00000e+00 1.16472e+02 278.436 1.45610e+01 278.436 0.9477 
1 1 1 10  85  3  o 3  3.68421e+00 9.76136e-01 7.98717e+01 325.768 4.00063e+00  -2.72210e+00 0.00000e+00 0.00000e+00 4.31080e+01 325.768 3.67637e+01 145.768 0.8895 
1 1 1 10  85  4  o 15 8.30433e+00 1.04122e+00 9.57049e+01 91.188  -2.48742e-01 1.19965e+01  0.00000e+00 0.00000e+00 2.02702e+02 91.188  1.06997e+02 91.188  0.9574 
1 1 1 10  85  5  o 9  1.17619e+01 9.01749e-01 1.98666e+02 289.383 1.40333e+01  -3.98870e+01 0.00000e+00 0.00000e+00 2.37607e+02 289.383 3.89412e+01 289.383 0.9881 
1 1 1 10  85  6  o 19 3.53742e+00 1.08225e+00 5.96144e+01 88.529  9.30399e-02  3.62283e+00  0.00000e+00 0.00000e+00 5.29094e+01 88.529  6.70493e+00 268.529 0.8473 
1 1 1 10  85  7  o 16 1.35199e+01 1.00871e+00 1.86481e+02 251.256 -1.54659e+01 -4.55762e+01 0.00000e+00 0.00000e+00 3.15774e+02 251.256 1.29293e+02 251.256 0.9896 
1 1 1 10  85  8  o 19 5.69538e+00 1.33281e+00 8.71068e+01 204.797 -7.42491e+00 -3.43034e+00 0.00000e+00 0.00000e+00 1.13162e+02 204.797 2.60549e+01 204.797 0.9367 
1 1 1 10  85  9  o 3  4.02080e+00 1.28511e+00 9.16286e+01 44.579  4.51863e+00  4.45270e+00  0.00000e+00 0.00000e+00 4.68240e+01 44.579  4.48046e+01 224.579 0.9174 
1 1 1 10  86  0  o 1  1.23391e+01 6.71552e-01 1.97065e+02 84.032  4.71522e+00  4.51025e+01  0.00000e+00 0.00000e+00 2.60310e+02 84.032  6.32449e+01 84.032  0.9889 
1 1 1 10  86  1  o 15 8.05155e+00 9.57042e-01 1.18917e+02 300.445 7.94243e+00  -1.35135e+01 0.00000e+00 0.00000e+00 1.73195e+02 300.445 5.42772e+01 300.445 0.9676 
1 1 1 10  86  2  o 9  7.34617e+00 9.77934e-01 1.25032e+02 57.049  7.53865e+00  1.16302e+01  0.00000e+00 0.00000e+00 1.40377e+02 57.049  1.53443e+01 57.049  0.9632 
1 1 1 10  86  3  o 17 3.08273e+00 9.63074e-01 7.68141e+01 324.165 3.29719e+00  -2.38105e+00 0.00000e+00 0.00000e+00 2.33511e+01 324.165 5.34631e+01 144.165 0.8661 
1 1 1 10  86  4  o 11 3.19772e+00 9.76673e-01 6.06982e+01 232.782 -1.97240e+00 -2.59687e+00 0.00000e+00 0.00000e+00 3.86055e+01 232.782 2.20928e+01 52.782  0.8276 
1 1 1 10  86  5  o 16 6.18726e+00 1.25365e+00 9.03858e+01 71.274  2.70729e+00  7.98645e+00  0.00000e+00 0.00000e+00 1.27583e+02 71.274  3.71976e+01 71.274  0.9387 
1 1 1 10  86  6  f 0  5.68343e+00 1.27588e+00 7.80091e+01 223.138 -4.83852e+00 -4.53385e+00 0.00000e+00 0.00000e+00 1.18486e+02 223.138 4.04768e+01 223.138 0.9212 
1 1 1 10  86  7  o 8  4.19626e+00 1.16024e+00 7.83279e+01 41.370  4.17270e+00  3.67484e+00  0.00000e+00 0.00000e+00 6.41957e+01 41.370  1.41322e+01 221.370 0.9049 
1 1 1 10  86  8  f 0  8.31109e+00 1.33894e+00 6.08287e+01 177.570 -8.51998e+00 3.61562e-01  0.00000e+00 0.00000e+00 2.32186e+02 177.570 1.71357e+02 177.570 0.9394 
1 1 1 10  86  9  o 18 3.42746e+00 1.14596e+00 9.61954e+01 69.294  2.34769e+00  6.21113e+00  0.00000e+00 0.00000e+00 2.22984e+01 69.294  7.38970e+01 249.294 0.9213 
1 1 1 10  87  0  o 18 4.36079e+00 9.49453e-01 6.59806e+01 30.854  3.78873e+00  2.26335e+00  0.00000e+00 0.00000e+00 7.74537e+01 30.854  1.14731e+01 30.854  0.8777 
1 1 1 10  87  1  o 13 3.47904e+00 9.37474e-01 6.23189e+01 90.046  -2.93912e-03 3.64664e+00  0.00000e+00 0.00000e+00 4.83325e+01 90.046  1.39864e+01 270.046 0.8484 
1 1 1 10  87  2  o 2  3.10722e+00 8.63317e-01 4.74113e+01 172.366 -2.52222e+00 3.38062e-01  0.00000e+00 0.00000e+00 4.22829e+01 172.366 5.12838e+00 352.366 0.7698 
1 1 1 10  87  3  o 4  5.62152e+00 1.11348e+00 1.00706e+02 297.295 3.94023e+00  -7.63570e+00 0.00000e+00 0.00000e+00 9.74726e+01 297.295 3.23310e+00 117.295 0.9399 
1 1 1 10  87  4  o 4  4.82929e+00 1.15712e+00 6.28936e+01 173.870 -4.63462e+00 4.97756e-01  0.00000e+00 0.00000e+00 9.74262e+01 173.870 3.45326e+01 173.870 0.8849 
1 1 1 10  87  5  o 8  7.04099e+00 1.17363e+00 1.16668e+02 236.056 -7.39731e+00 -1.09903e+01 0.00000e+00 0.00000e+00 1.37341e+02 236.056 2.06726e+01 236.056 0.9615 
1 1 1 10  87  6  o 15 3.57739e+00 1.07361e+00 5.43857e+01 326.367 2.95762e+00  -1.96747e+00 0.00000e+00 0.00000e+00 5.88805e+01 326.367 4.49484e+00 326.367 0.8438 
1 1 1 10  87  7  f 0  3.35601e+00 1.06398e+00 6.63004e+01 231.446 -2.64353e+00 -3.31700e+00 0.00000e+00 0.00000e+00 4.35362e+01 231.446 2.27642e+01 51.446  0.8722 
1 1 1 10  87  8  o 8  3.20500e+00 1.05438e+00 2.86134e+01 155.297 -1.77128e+00 8.14823e-01  0.00000e+00 0.00000e+00 5.42844e+01 155.297 2.56710e+01 155.297 0.6893 
1 1 1 10  87  9  f 0  5.31277e+00 1.39676e+00 7.03753e+01 234.605 -3.71640e+00 -5.23039e+00 0.00000e+00 0.00000e+00 1.12676e+02 234.605 4.23002e+01 234.605 0.9184 
1 1 1 10  88  0  f 0  1.04805e+01 7.27727e-01 1.34959e+02 32.266  2.22196e+01  1.40280e+01  0.00000e+00 0.00000e+00 2.50146e+02 32.266  1.15186e+02 32.266  0.9808 
1 1 1 10  88  1  o 5  6.03247e+00 9.40487e-01 9.05034e+01 149.796 -8.21312e+00 4.78091e+00  0.00000e+00 0.00000e+00 1.23338e+02 149.796 3.28351e+01 149.796 0.9458 
1 1 1 10  88  2  o 6  3.18741e+00 9.06287e-01 4.65715e+01 278.842 3.71472e-01  -2.38804e+00 0.00000e+00 0.00000e+00 4.37246e+01 278.842 2.84696e+00 98.842  0.7556 
1 1 1 10  88  3  o 5  3.48854e+00 1.02622e+00 4.22076e+01 316.545 1.76452e+00  -1.67183e+00 0.00000e+00 0.00000e+00 5.68555e+01 316.545 1.46479e+01 316.545 0.7572 
1 1 1 10  88  4  o 3  5.08237e+00 1.20831e+00 1.12788e+02 87.033  4.61874e-01  8.90987e+00  0.00000e+00 0.00000e+00 6.68123e+01 87.033  4.59760e+01 267.033 0.9422 
1 1 1 10  88  5  o 17 5.63893e+00 1.22534e+00 9.60203e+01 326.615 7.01612e+00  -4.62361e+00 0.00000e+00 0.00000e+00 1.02489e+02 326.615 6.46849e+00 326.615 0.9385 
1 1 1 10  88  6  o 2  6.46392e+00 1.33656e+00 1.21017e+02 86.566  7.00383e-01  1.16724e+01  0.00000e+00 0.00000e+00 1.10860e+02 86.566  1.01568e+01 266.566 0.9562 
1 1 1 10  88  7  o 3  5.30406e+00 1.35962e+00 1.63453e+02 26.228  1.25427e+01  6.17935e+00  0.00000e+00 0.00000e+00 2.82738e+01 26.228  1.35179e+02 206.228 0.9635 
1 1 1 10  88  8  o 12 3.86856e+00 1.20072e+00 1.01986e+02 225.601 -5.24610e+00 -5.35735e+00 0.00000e+00 0.00000e+00 3.30776e+01 225.601 6.89085e+01 45.601  0.9307 
1 1 1 10  88  9  o 8  4.24271e+00 1.27433e+00 7.40589e+01 93.842  -3.96966e-01 5.91039e+00  0.00000e+00 0.00000e+00 7.09391e+01 93.842  3.11980e+00 273.842 0.9112 
1 1 1 10  89  0  o 13 3.96138e+00 9.79266e-01 5.78195e+01 165.566 -3.46776e+00 8.92546e-01  0.00000e+00 0.00000e+00 6.75907e+01 165.566 9.77121e+00 165.566 0.8452 
1 1 1 10  89  1  o 18 4.40832e+00 8.97953e-01 7.85823e+01 289.215 1.97247e+00  -5.65951e+00 0.00000e+00 0.00000e+00 7.21031e+01 289.215 6.47918e+00 109.215 0.9123 
1 1 1 10  89  2  o 6  4.54699e+00 9.99377e-01 7.56638e+01 123.529 -3.14258e+00 4.74269e+00  0.00000e+00 0.00000e+00 7.89557e+01 123.529 3.29195e+00 123.529 0.9072 
1 1 1 10  89  3  o 13 6.20244e+00 1.06391e+00 9.06476e+01 272.181 3.54000e-01  -9.29297e+00 0.00000e+00 0.00000e+00 1.29004e+02 272.181 3.83566e+01 272.181 0.9446 
1 1 1 10  89  4  o 4  3.39203e+00 1.04851e+00 5.68699e+01 56.545  1.87137e+00  2.83221e+00  0.00000e+00 0.00000e+00 4.93886e+01 56.545  7.48133e+00 236.545 0.8354 
1 1 1 10  89  5  o 6  3.73429e+00 1.10618e+00 7.02298e+01 44.345  3.34523e+00  3.26964e+00  0.00000e+00 0.00000e+00 5.37571e+01 44.345  1.64727e+01 224.345 0.8853 
1 1 1 10  89  6  o 15 3.79360e+00 1.13245e+00 4.69911e+01 75.366  7.76243e-01  2.97279e+00  0.00000e+00 0.00000e+00 6.89957e+01 75.366  2.20046e+01 75.366  0.8152 
1 1 1 10  89  7  o 4  4.99972e+00 1.25362e+00 8.83773e+01 248.629 -2.92042e+00 -7.46316e+00 0.00000e+00 0.00000e+00 8.70173e+01 248.629 1.36006e+00 68.629  0.9354 
1 1 1 10  89  8  o 9  5.09927e+00 1.29061e+00 8.38920e+01 180.952 -7.44771e+00 -1.23709e-01 0.00000e+00 0.00000e+00 9.40043e+01 180.952 1.01124e+01 180.952 0.9302 
1 1 1 10  89  9  o 14 5.85183e+00 1.48202e+00 7.66533e+01 117.045 -3.29951e+00 6.46304e+00  0.00000e+00 0.00000e+00 1.27049e+02 117.045 5.03955e+01 117.045 0.9283 
1 1 1 10  90  0  f 0  4.17315e+00 9.92315e-01 3.89399e+01 169.131 -2.65198e+00 5.09190e-01  0.00000e+00 0.00000e+00 8.37550e+01 169.131 4.48151e+01 169.131 0.7851 
1 1 1 10  90  1  o 12 4.01996e+00 9.97987e-01 7.88598e+01 40.125  4.07058e+00  3.43084e+00  0.00000e+00 0.00000e+00 5.67288e+01 40.125  2.21311e+01 220.125 0.9004 
1 1 1 10  90  2  o 9  6.51376e+00 9.84960e-01 7.37555e+01 173.382 -8.31325e+00 9.64499e-01  0.00000e+00 0.00000e+00 1.55246e+02 173.382 8.14901e+01 173.382 0.9382 
1 1 1 10  90  3  o 14 8.04785e+00 9.45190e-01 1.46751e+02 311.488 1.44710e+01  -1.63634e+01 0.00000e+00 0.00000e+00 1.47908e+02 311.488 1.15677e+00 311.488 0.9768 
1 1 1 10  90  4  o 10 3.37527e+00 9.81378e-01 4.13159e+01 25.475  2.31481e+00  1.10287e+00  0.00000e+00 0.00000e+00 5.63427e+01 25.475  1.50268e+01 25.475  0.7718 
1 1 1 10  90  5  o 17 2.92855e+00 9.10987e-01 3.15592e+01 245.466 -7.84499e-01 -1.71876e+00 0.00000e+00 0.00000e+00 4.29671e+01 245.466 1.14079e+01 245.466 0.6787 
1 1 1 10  90  6  o 17 4.32021e+00 1.21802e+00 1.47073e+02 305.297 6.52870e+00  -9.22174e+00 0.00000e+00 0.00000e+00 7.57439e+00 305.297 1.39498e+02 125.297 0.9547 
1 1 1 10  90  7  o 18 3.89755e+00 1.17767e+00 1.07639e+02 128.792 -5.03435e+00 6.26328e+00  0.00000e+00 0.00000e+00 2.90830e+01 128.792 7.85563e+01 308.792 0.9355 
1 1 1 10  90  8  o 2  4.34289e+00 1.25214e+00 5.94003e+01 125.861 -3.01804e+00 4.17524e+00  0.00000e+00 0.00000e+00 8.66264e+01 125.861 2.72261e+01 125.861 0.8968 
1 1 1 10  91  0  o 1  5.33679e+00 9.87348e-01 9.64030e+01 319.124 6.65915e+00  -5.76355e+00 0.00000e+00 0.00000e+00 9.16820e+01 319.124 4.72100e+00 139.124 0.9414 
1 1 1 10  91  1  o 1  3.86720e+00 9.71319e-01 2.44554e+01 56.183  9.23889e-01  1.37919e+00  0.00000e+00 0.00000e+00 6.72634e+01 56.183  4.28079e+01 56.183  0.6333 
1 1 1 10  91  2  o 3  4.24365e+00 9.41271e-01 8.97099e+01 209.192 -6.16474e+00 -3.44425e+00 0.00000e+00 0.00000e+00 5.75392e+01 209.192 3.21707e+01 29.192  0.9262 
1 1 1 10  91  3  o 13 6.26691e+00 1.00578e+00 7.80966e+01 179.432 -9.27586e+00 9.19634e-02  0.00000e+00 0.00000e+00 1.43695e+02 179.432 6.55983e+01 179.432 0.9445 
1 1 1 10  91  4  o 14 6.04212e+00 1.12062e+00 1.35565e+02 356.214 1.44131e+01  -9.53838e-01 0.00000e+00 0.00000e+00 8.29052e+01 356.214 5.26595e+01 176.214 0.9647 
1 1 1 10  91  5  o 15 4.68812e+00 1.11199e+00 9.31756e+01 298.196 3.61333e+00  -6.74004e+00 0.00000e+00 0.00000e+00 7.06262e+01 298.196 2.25494e+01 118.196 0.9321 
1 1 1 10  91  6  o 8  4.35015e+00 1.17768e+00 5.44989e+01 108.033 -1.41705e+00 4.35266e+00  0.00000e+00 0.00000e+00 8.94237e+01 108.033 3.49248e+01 108.033 0.8826 
1 1 1 10  91  7  o 14 3.87281e+00 1.15032e+00 3.10897e+01 17.224  2.28122e+00  7.07184e-01  0.00000e+00 0.00000e+00 7.81264e+01 17.224  4.70367e+01 17.224  0.7523 
1 1 1 10  91  8  o 14 3.33968e+00 1.07739e+00 2.91652e+01 161.710 -2.04620e+00 6.76319e-01  0.00000e+00 0.00000e+00 6.11783e+01 161.710 3.20131e+01 161.710 0.7217 
1 1 1 10  92  0  f 0  1.24457e+01 6.94419e-01 1.02228e+02 262.918 -3.40882e+00 -2.74374e+01 0.00000e+00 0.00000e+00 3.55085e+02 262.918 2.52858e+02 262.918 0.9817 
1 1 1 10  92  1  o 11 5.75174e+00 9.48671e-01 8.95723e+01 70.550  3.16288e+00  8.95646e+00  0.00000e+00 0.00000e+00 1.14111e+02 70.550  2.45386e+01 70.550  0.9458 
1 1 1 10  92  2  f 0  2.36973e+00 7.89658e-01 6.26246e+01 173.135 -3.23981e+00 3.90029e-01  0.00000e+00 0.00000e+00 1.08383e+01 173.135 5.17863e+01 353.135 0.8277 
1 1 1 10  92  3  o 6  5.66449e+00 1.09137e+00 1.00913e+02 6.798   9.60132e+00  1.14460e+00  0.00000e+00 0.00000e+00 1.00003e+02 6.798   9.09640e-01 186.798 0.9468 
1 1 1 10  92  4  o 5  2.58545e+00 8.48415e-01 4.70954e+01 51.669  1.60982e+00  2.03614e+00  0.00000e+00 0.00000e+00 2.79854e+01 51.669  1.91099e+01 231.669 0.7750 
1 1 1 10  92  5  o 16 4.29441e+00 1.15802e+00 7.77652e+01 4.460   5.89929e+00  4.60116e-01  0.00000e+00 0.00000e+00 6.88525e+01 4.460   8.91268e+00 184.460 0.9111 
1 1 1 10  92  6  o 3  6.45954e+00 1.16522e+00 9.97571e+01 167.965 -1.14809e+01 2.44763e+00  0.00000e+00 0.00000e+00 1.31776e+02 167.965 3.20192e+01 167.965 0.9564 
1 1 1 10  92  7  o 8  7.40545e+00 1.28404e+00 1.08368e+02 23.630  1.28687e+01  5.63019e+00  0.00000e+00 0.00000e+00 1.59100e+02 23.630  5.07321e+01 23.630  0.9637 
1 1 1 10  92  8  o 11 2.86195e+00 9.80610e-01 3.39714e+01 193.802 -2.50036e+00 -6.14219e-01 0.00000e+00 0.00000e+00 4.89225e+01 193.802 1.49511e+01 193.802 0.7729 
1 1 1 10  93  0  o 4  4.39380e+00 9.83280e-01 6.81026e+01 36.597  4.41340e+00  3.27737e+00  0.00000e+00 0.00000e+00 8.04846e+01 36.597  1.23819e+01 36.597  0.9038 
1 1 1 10  93  1  f 0  4.21840e+00 1.02563e+00 3.25339e+01 56.019  1.43208e+00  2.12469e+00  0.00000e+00 0.00000e+00 8.93058e+01 56.019  5.67718e+01 56.019  0.7716 
1 1 1 10  93  2  o 7  6.38902e+00 9.99523e-01 1.26743e+02 126.512 -8.68025e+00 1.17255e+01  0.00000e+00 0.00000e+00 1.04138e+02 126.512 2.26050e+01 306.512 0.9651 
1 1 1 10  93  3  o 1  3.52770e+00 9.92715e-01 4.53445e+01 337.967 2.84357e+00  -1.15078e+00 0.00000e+00 0.00000e+00 6.23186e+01 337.967 1.69741e+01 337.967 0.8149 
1 1 1 10  93  4  o 5  3.48620e+00 1.03463e+00 6.04997e+01 294.381 1.69706e+00  -3.74442e+00 0.00000e+00 0.00000e+00 5.28121e+01 294.381 7.68767e+00 114.381 0.8677 
1 1 1 10  93  5  o 3  2.24200e+00 7.70464e-01 3.85217e+01 228.104 -1.49648e+00 -1.66808e+00 0.00000e+00 0.00000e+00 2.31014e+01 228.104 1.54203e+01 48.104  0.7336 
1 1 1 10  93  6  f 0  4.98838e+00 1.22197e+00 1.12429e+02 296.265 4.54002e+00  -9.20001e+00 0.00000e+00 0.00000e+00 6.51182e+01 296.265 4.73104e+01 116.265 0.9499 
1 1 1 10  93  7  o 9  3.89562e+00 1.11983e+00 7.85633e+01 20.125  6.50077e+00  2.38216e+00  0.00000e+00 0.00000e+00 5.64022e+01 20.125  2.21610e+01 200.125 0.9247 
1 1 1 10  93  8  o 18 3.77927e+00 1.19659e+00 8.58430e+01 118.387 -3.18956e+00 5.90205e+00  0.00000e+00 0.00000e+00 4.47249e+01 118.387 4.11182e+01 298.387 0.9221 
1 1 1 10  94  0  o 2  7.10182e+00 8.93125e-01 1.13850e+02 27.899  1.38162e+01  7.31501e+00  0.00000e+00 0.00000e+00 1.43178e+02 27.899  2.93273e+01 27.899  0.9675 
1 1 1 10  94  1  o 8  2.88122e+00 8.79137e-01 5.55710e+01 65.452  1.39658e+00  3.05776e+00  0.00000e+00 0.00000e+00 3.43033e+01 65.452  2.12677e+01 245.452 0.8335 
1 1 1 10  94  2  o 18 3.00488e+00 9.18177e-01 4.58285e+01 0.390   2.78360e+00  1.89444e-02  0.00000e+00 0.00000e+00 4.33310e+01 0.390   2.49748e+00 180.390 0.7926 
1 1 1 10  94  3  o 8  4.31539e+00 1.07059e+00 9.45082e+01 142.743 -5.86128e+00 4.45809e+00  0.00000e+00 0.00000e+00 5.56665e+01 142.743 3.88417e+01 322.743 0.9294 
1 1 1 10  94  4  o 17 7.61017e+00 1.03341e+00 9.74554e+01 264.597 -1.44089e+00 -1.52350e+01 0.00000e+00 0.00000e+00 1.78077e+02 264.597 8.06212e+01 264.597 0.9668 
1 1 1 10  94  5  o 11 3.46075e+00 9.94584e-01 3.63513e+01 13.273  2.55246e+00  6.02125e-01  0.00000e+00 0.00000e+00 6.44569e+01 13.273  2.81056e+01 13.273  0.7777 
1 1 1 10  94  6  o 9  3.75305e+00 1.11531e+00 7.67836e+01 171.090 -5.63907e+00 8.84020e-01  0.00000e+00 0.00000e+00 5.08046e+01 171.090 2.59790e+01 351.090 0.9076 
1 1 1 10  94  7  o 10 3.48780e+00 1.08347e+00 6.37714e+01 310.463 3.23664e+00  -3.79459e+00 0.00000e+00 0.00000e+00 5.29087e+01 310.463 1.08627e+01 130.463 0.8931 
1 1 1 10  94  8  o 5  3.08496e+00 1.02092e+00 2.57150e+01 225.175 -1.42279e+00 -1.43149e+00 0.00000e+00 0.00000e+00 5.52582e+01 225.175 2.95432e+01 225.175 0.7008 
1 1 1 10  95  0  o 2  3.84065e+00 1.00910e+00 3.72504e+01 164.929 -2.61953e+00 7.05385e-01  0.00000e+00 0.00000e+00 7.56904e+01 164.929 3.84401e+01 164.929 0.7863 
1 1 1 10  95  1  o 9  5.80164e+00 1.05587e+00 4.97682e+01 181.887 -5.31739e+00 -1.75198e-01 0.00000e+00 0.00000e+00 1.45652e+02 181.887 9.58837e+01 181.887 0.9003 
1 1 1 10  95  2  o 7  4.10633e+00 1.03955e+00 7.86801e+01 358.612 5.90189e+00  -1.43035e-01 0.00000e+00 0.00000e+00 6.12954e+01 358.612 1.73848e+01 178.612 0.9108 
1 1 1 10  95  3  o 19 4.16135e+00 1.07776e+00 7.95933e+01 210.944 -5.35510e+00 -3.21061e+00 0.00000e+00 0.00000e+00 6.30961e+01 210.944 1.64972e+01 30.944  0.9160 
1 1 1 10  95  4  o 5  3.29837e+00 9.89160e-01 5.84487e+01 25.110  3.95272e+00  1.85244e+00  0.00000e+00 0.00000e+00 4.97617e+01 25.110  8.68702e+00 205.110 0.8762 
1 1 1 10  95  5  o 1  4.88310e+00 1.18662e+00 1.16195e+02 205.541 -9.64943e+00 -4.61095e+00 0.00000e+00 0.00000e+00 5.78866e+01 205.541 5.83082e+01 25.541  0.9520 
1 1 1 10  95  6  o 12 3.53613e+00 1.06783e+00 4.30611e+01 21.434  3.37264e+00  1.32404e+00  0.00000e+00 0.00000e+00 6.91393e+01 21.434  2.60782e+01 21.434  0.8473 
1 1 1 10  95  7  o 5  7.22719e+00 1.30356e+00 1.11224e+02 237.239 -8.28865e+00 -1.28807e+01 0.00000e+00 0.00000e+00 1.50436e+02 237.239 3.92120e+01 237.239 0.9668 
1 1 1 10  96  0  o 9  6.26564e+00 9.97504e-01 9.01706e+01 8.748   1.05143e+01  1.61793e+00  0.00000e+00 0.00000e+00 1.32799e+02 8.748   4.26285e+01 8.748   0.9518 
1 1 1 10  96  1  o 2  1.53393e+01 7.02944e-01 2.53587e+02 303.024 4.90096e+01  -7.53994e+01 0.00000e+00 0.00000e+00 3.16956e+02 303.024 6.33692e+01 303.024 0.9944 
1 1 1 10  96  2  o 16 7.39529e+00 9.50217e-01 1.27195e+02 130.129 -1.25780e+01 1.49213e+01  0.00000e+00 0.00000e+00 1.42314e+02 130.129 1.51189e+01 130.129 0.9740 
1 1 1 10  96  3  o 10 8.34249e+00 9.52924e-01 9.64514e+01 331.210 1.58775e+01  -8.72515e+00 0.00000e+00 0.00000e+00 2.07018e+02 331.210 1.10566e+02 331.210 0.9720 
1 1 1 10  96  4  o 14 1.20742e+01 8.10518e-01 1.36613e+02 151.254 -3.45859e+01 1.89714e+01  0.00000e+00 0.00000e+00 3.09575e+02 151.254 1.72962e+02 151.254 0.9872 
1 1 1 10  96  5  o 1  9.26301e+00 1.03805e+00 1.27384e+02 350.689 2.45858e+01  -4.03095e+00 0.00000e+00 0.00000e+00 2.12356e+02 350.689 8.49718e+01 350.689 0.9797 
1 1 1 10  96  6  o 12 4.92625e+00 1.21067e+00 8.72657e+01 187.570 -8.37638e+00 -1.11319e+00 0.00000e+00 0.00000e+00 8.58826e+01 187.570 1.38315e+00 7.570   0.9388 
1 1 1 10  96  7  o 15 3.09082e+00 1.00382e+00 8.24398e+01 27.754  5.57451e+00  2.93335e+00  0.00000e+00 0.00000e+00 2.36460e+01 27.754  5.87938e+01 207.754 0.9168 
1 1 1 10  97  0  o 10 1.24054e+01 7.44686e-01 2.11631e+02 54.589  3.64210e+01  5.12277e+01  0.00000e+00 0.00000e+00 2.48372e+02 54.589  3.67402e+01 54.589  0.9920 
1 1 1 10  97  1  o 5  9.57885e+00 7.93013e-01 1.20619e+02 203.301 -2.45950e+01 -1.05927e+01 0.00000e+00 0.00000e+00 2.30813e+02 203.301 1.10194e+02 203.301 0.9811 
1 1 1 10  97  2  o 8  3.73308e+00 9.37491e-01 5.78956e+01 185.399 -4.90532e+00 -4.63636e-01 0.00000e+00 0.00000e+00 6.66129e+01 185.399 8.71728e+00 185.399 0.8917 
1 1 1 10  97  3  o 12 3.49552e+00 9.78155e-01 4.92509e+01 28.619  3.46119e+00  1.88857e+00  0.00000e+00 0.00000e+00 6.33911e+01 28.619  1.41402e+01 28.619  0.8613 
1 1 1 10  97  4  o 13 5.75875e+00 1.13433e+00 5.07323e+01 15.546  5.66568e+00  1.57614e+00  0.00000e+00 0.00000e+00 1.45474e+02 15.546  9.47418e+01 15.546  0.9105 
1 1 1 10  97  5  o 13 3.86670e+00 1.05187e+00 4.92596e+01 94.778  -3.46121e-01 4.14053e+00  0.00000e+00 0.00000e+00 7.65316e+01 94.778  2.72721e+01 94.778  0.8692 
1 1 1 10  97  6  o 2  3.25200e+00 1.02416e+00 6.03370e+01 268.215 -1.55230e-01 -4.98031e+00 0.00000e+00 0.00000e+00 4.83551e+01 268.215 1.19818e+01 88.215  0.8930 
1 1 1 10  97  7  o 16 2.74850e+00 9.16189e-01 5.24927e+01 109.073 -1.32639e+00 3.83615e+00  0.00000e+00 0.00000e+00 3.65703e+01 109.073 1.59224e+01 289.073 0.8658 
1 1 1 10  98  0  o 14 6.09710e+00 9.64698e-01 1.10023e+02 224.939 -1.05938e+01 -1.05713e+01 0.00000e+00 0.00000e+00 1.10073e+02 224.939 4.96722e-02 224.939 0.9660 
1 1 1 10  98  1  o 10 3.03372e+00 9.19858e-01 3.92291e+01 304.209 1.60543e+00  -2.36150e+00 0.00000e+00 0.00000e+00 5.13532e+01 304.209 1.21242e+01 304.209 0.7987 
1 1 1 10  98  2  o 19 5.00756e+00 1.06631e+00 1.07251e+02 230.688 -7.23493e+00 -8.83546e+00 0.00000e+00 0.00000e+00 7.16099e+01 230.688 3.56413e+01 50.688  0.9552 
1 1 1 10  98  3  o 17 3.57725e+00 1.01177e+00 6.20029e+01 116.753 -2.17768e+00 4.31978e+00  0.00000e+00 0.00000e+00 5.70134e+01 116.753 4.98950e+00 296.753 0.8895 
1 1 1 10  98  4  o 17 3.61948e+00 1.02668e+00 6.13722e+01 262.101 -6.64133e-01 -4.78707e+00 0.00000e+00 0.00000e+00 5.90560e+01 262.101 2.31624e+00 82.101  0.8894 
1 1 1 10  98  5  o 5  2.80312e+00 9.15914e-01 3.03126e+01 315.911 1.55923e+00  -1.51039e+00 0.00000e+00 0.00000e+00 4.56142e+01 315.911 1.53016e+01 315.911 0.7239 
1 1 1 10  98  6  f 0  3.14674e+00 1.00105e+00 9.08265e+01 138.942 -5.75658e+00 5.01437e+00  0.00000e+00 0.00000e+00 1.89134e+01 138.942 7.19131e+01 318.942 0.9320 
1 1 1 10  99  0  o 13 4.02374e+00 1.00219e+00 5.43074e+01 26.280  4.39890e+00  2.17219e+00  0.00000e+00 0.00000e+00 7.96550e+01 26.280  2.53477e+01 26.280  0.8912 
1 1 1 10  99  1  o 15 3.01344e+00 8.68465e-01 3.79997e+01 169.055 -2.57658e+00 4.98250e-01  0.00000e+00 0.00000e+00 4.96056e+01 169.055 1.16058e+01 169.055 0.7779 
1 1 1 10  99  2  o 9  3.81576e+00 1.04650e+00 7.96340e+01 15.992  6.19090e+00  1.77428e+00  0.00000e+00 0.00000e+00 5.14199e+01 15.992  2.82141e+01 195.992 0.9187 
1 1 1 10  99  3  o 3  2.16494e+00 7.47659e-01 2.32748e+01 287.978 4.12948e-01  -1.27258e+00 0.00000e+00 0.00000e+00 2.15292e+01 287.978 1.74562e+00 107.978 0.5534 
1 1 1 10  99  4  o 2  4.06566e+00 1.08610e+00 3.25661e+01 169.866 -3.04578e+00 5.44424e-01  0.00000e+00 0.00000e+00 9.16229e+01 169.866 5.90569e+01 169.866 0.8167 
1 1 1 10  99  5  o 12 3.19128e+00 9.95331e-01 5.76878e+01 39.143  3.72897e+00  3.03514e+00  0.00000e+00 0.00000e+00 4.84033e+01 39.143  9.28446e+00 219.143 0.8887 
1 1 1 10  99  6  o 10 3.32079e+00 1.00479e+00 3.45693e+01 91.993  -1.03199e-01 2.96556e+00  0.00000e+00 0.00000e+00 6.57486e+01 91.993  3.11793e+01 91.993  0.8075 
1 1 1 10  100 0  o 7  9.41399e+00 8.36159e-01 1.44670e+02 225.922 -2.40471e+01 -2.48335e+01 0.00000e+00 0.00000e+00 2.01811e+02 225.922 5.71409e+01 225.922 0.9854 
1 1 1 10  100 1  o 7  4.08279e+00 1.05009e+00 4.55524e+01 36.241  3.16530e+00  2.32011e+00  0.00000e+00 0.00000e+00 8.57216e+01 36.241  4.01692e+01 36.241  0.8606 
1 1 1 10  100 2  o 17 3.79852e+00 9.69105e-01 8.03179e+01 118.436 -3.24485e+00 5.99216e+00  0.00000e+00 0.00000e+00 5.07757e+01 118.436 2.95422e+01 298.436 0.9234 
1 1 1 10  100 3  o 14 8.45986e+00 9.29806e-01 1.27638e+02 188.404 -2.58512e+01 -3.81927e+00 0.00000e+00 0.00000e+00 1.82515e+02 188.404 5.48767e+01 188.404 0.9807 
1 1 1 10  100 4  f 0  6.23550e+00 1.11972e+00 9.45143e+01 299.590 6.31535e+00  -1.11214e+01 0.00000e+00 0.00000e+00 1.29329e+02 299.590 3.48145e+01 299.590 0.9601 
1 1 1 10  100 5  o 6  3.32458e+00 1.01219e+00 3.87699e+01 317.354 2.50426e+00  -2.30652e+00 0.00000e+00 0.00000e+00 6.51616e+01 317.354 2.63917e+01 317.354 0.8360 
1 1 1 10  100 6  o 15 4.78686e+00 1.23354e+00 1.12356e+02 53.587  7.03427e+00  9.53650e+00  0.00000e+00 0.00000e+00 5.89365e+01 53.587  5.34195e+01 233.587 0.9568 
1 1 1 10  101 0  o 8  4.46251e+00 1.02451e+00 8.21009e+01 134.816 -5.51438e+00 5.54997e+00  0.00000e+00 0.00000e+00 7.34793e+01 134.816 8.62165e+00 314.816 0.9337 
1 1 1 10  101 1  o 16 2.73868e+00 8.59994e-01 4.00758e+01 66.957  1.07163e+00  2.51930e+00  0.00000e+00 0.00000e+00 4.05919e+01 66.957  5.16105e-01 66.957  0.7886 
1 1 1 10  101 2  o 11 7.92557e+00 9.51780e-01 1.14195e+02 224.235 -1.54042e+01 -1.49980e+01 0.00000e+00 0.00000e+00 1.74968e+02 224.235 6.07725e+01 224.235 0.9765 
1 1 1 10  101 3  o 17 3.34520e+00 1.00018e+00 6.31002e+01 350.629 4.93886e+00  -8.15009e-01 0.00000e+00 0.00000e+00 4.86095e+01 350.629 1.44907e+01 170.630 0.8935 
1 1 1 10  101 4  o 1  4.83312e+00 1.11696e+00 4.69898e+01 263.396 -5.93421e-01 -5.12549e+00 0.00000e+00 0.00000e+00 1.15060e+02 263.396 6.80707e+01 263.396 0.8970 
1 1 1 10  101 5  o 11 3.93239e+00 1.08523e+00 6.60992e+01 104.892 -1.59676e+00 6.00447e+00  0.00000e+00 0.00000e+00 6.85002e+01 104.892 2.40098e+00 104.892 0.9155 
1 1 1 10  101 6  o 14 2.90420e+00 9.50516e-01 4.80561e+01 28.256  3.71503e+00  1.99666e+00  0.00000e+00 0.00000e+00 4.65624e+01 28.256  1.49375e+00 208.256 0.8714 
1 1 1 10  102 0  o 1  5.51249e+00 1.06404e+00 9.39831e+01 135.317 -7.95296e+00 7.86549e+00  0.00000e+00 0.00000e+00 1.02364e+02 135.317 8.38115e+00 135.317 0.9542 
1 1 1 10  102 1  o 15 3.70923e+00 9.88346e-01 5.86358e+01 212.585 -4.69874e+00 -3.00328e+00 0.00000e+00 0.00000e+00 6.67493e+01 212.585 8.11353e+00 212.585 0.9052 
1 1 1 10  102 2  o 16 2.68420e+00 8.64473e-01 7.64078e+01 42.660  4.02779e+00  3.71155e+00  0.00000e+00 0.00000e+00 1.41705e+01 42.660  6.22373e+01 222.660 0.9034 
1 1 1 10  102 3  o 7  7.29593e+00 1.03891e+00 1.33999e+02 209.196 -2.13621e+01 -1.19367e+01 0.00000e+00 0.00000e+00 1.32972e+02 209.196 1.02736e+00 29.196  0.9793 
1 1 1 10  102 4  o 7  7.06872e+00 1.06427e+00 1.12092e+02 81.049  2.88055e+00  1.82880e+01  0.00000e+00 0.00000e+00 1.44832e+02 81.049  3.27399e+01 81.049  0.9726 
1 1 1 10  102 5  o 17 2.72527e+00 9.02899e-01 7.52110e+01 225.960 -4.42709e+00 -4.57803e+00 0.00000e+00 0.00000e+00 1.82668e+01 225.960 5.69442e+01 45.960  0.9177 
1 1 1 10  103 0  o 19 4.76561e+00 1.02867e+00 1.33949e+02 61.317  7.08450e+00  1.29492e+01  0.00000e+00 0.00000e+00 3.77593e+01 61.317  9.61901e+01 241.317 0.9655 
1 1 1 10  103 1  o 3  3.10183e+00 8.68562e-01 1.44835e+01 72.595  3.65580e-01  1.16622e+00  0.00000e+00 0.00000e+00 4.56843e+01 72.595  3.12008e+01 72.595  0.5196 
1 1 1 10  103 2  o 14 3.59777e+00 1.01424e+00 8.69398e+01 275.585 7.80456e-01  -7.98073e+00 0.00000e+00 0.00000e+00 3.87334e+01 275.585 4.82064e+01 95.585  0.9354 
1 1 1 10  103 3  o 3  3.91853e+00 1.05901e+00 2.11369e+01 65.670  8.02105e-01  1.77397e+00  0.00000e+00 0.00000e+00 7.96898e+01 65.670  5.85529e+01 65.670  0.6889 
1 1 1 10  103 4  f 0  5.21099e+00 1.18143e+00 1.20178e+02 315.591 9.82518e+00  -9.62469e+00 0.00000e+00 0.00000e+00 6.72870e+01 315.591 5.28913e+01 135.591 0.9629 
1 1 1 10  103 5  o 16 6.15277e+00 1.16598e+00 7.40136e+01 122.817 -5.52767e+00 8.57182e+00  0.00000e+00 0.00000e+00 1.44304e+02 122.817 7.02908e+01 122.817 0.9496 
1 1 1 10  104 0  o 4  2.47806e+00 7.82712e-01 7.35525e+01 174.678 -5.80888e+00 5.41160e-01  0.00000e+00 0.00000e+00 1.05492e+01 174.678 6.30033e+01 354.678 0.9097 
1 1 1 10  104 1  f 0  8.80786e+00 8.78167e-01 1.42548e+02 2.548   3.57088e+01  1.58919e+00  0.00000e+00 0.00000e+00 1.81541e+02 2.548   3.89938e+01 2.548   0.9859 
1 1 1 10  104 2  f 0  4.06556e+00 1.01432e+00 3.45921e+01 87.728  1.36564e-01  3.44286e+00  0.00000e+00 0.00000e+00 9.26305e+01 87.728  5.80384e+01 87.728  0.8382 
1 1 1 10  104 3  o 5  2.74105e+00 8.46084e-01 6.48794e+01 88.560  1.34475e-01  5.35133e+00  0.00000e+00 0.00000e+00 2.73415e+01 88.560  3.75379e+01 268.561 0.9010 
1 1 1 10  104 4  o 17 3.24675e+00 9.64769e-01 4.94280e+01 211.871 -3.80337e+00 -2.36473e+00 0.00000e+00 0.00000e+00 5.72475e+01 211.871 7.81951e+00 211.871 0.8797 
1 1 1 10  104 5  o 8  3.39583e+00 1.03395e+00 2.93515e+01 143.930 -2.27710e+00 1.65867e+00  0.00000e+00 0.00000e+00 7.15566e+01 143.930 4.22052e+01 143.930 0.7955 
1 1 1 10  105 0  o 8  4.92938e+00 1.05873e+00 8.25315e+01 13.777  9.29019e+00  2.27795e+00  0.00000e+00 0.00000e+00 9.14248e+01 13.777  8.89332e+00 13.777  0.9462 
1 1 1 10  105 1  o 10 3.02390e+00 9.01355e-01 4.21766e+01 67.373  1.33204e+00  3.19584e+00  0.00000e+00 0.00000e+00 5.24949e+01 67.373  1.03183e+01 67.373  0.8391 
1 1 1 10  105 2  o 9  2.81533e+00 8.71387e-01 2.22470e+01 314.371 1.28667e+00  -1.31523e+00 0.00000e+00 0.00000e+00 4.81168e+01 314.371 2.58698e+01 314.371 0.6697 
1 1 1 10  105 3  o 14 3.28429e+00 9.29212e-01 2.92954e+01 231.611 -1.80495e+00 -2.27816e+00 0.00000e+00 0.00000e+00 6.91375e+01 231.611 3.98422e+01 231.611 0.8028 
1 1 1 10  105 4  o 13 3.51086e+00 9.76464e-01 4.57345e+01 179.548 -4.58578e+00 3.61823e-02  0.00000e+00 0.00000e+00 6.99928e+01 179.548 2.42583e+01 179.548 0.8828 
1 1 1 10  105 5  o 19 4.00401e+00 1.12665e+00 8.02706e+01 318.072 6.25763e+00  -5.62025e+00 0.00000e+00 0.00000e+00 6.00604e+01 318.072 2.02102e+01 138.072 0.9385 
1 1 1 10  106 0  o 17 2.48505e+00 8.02087e-01 5.81691e+01 299.529 2.23467e+00  -3.94512e+00 0.00000e+00 0.00000e+00 2.34920e+01 299.529 3.46771e+01 119.529 0.8813 
1 1 1 10  106 1  o 15 4.08286e+00 1.03797e+00 6.72993e+01 273.562 4.31112e-01  -6.92576e+00 0.00000e+00 0.00000e+00 7.35453e+01 273.562 6.24603e+00 273.562 0.9248 
1 1 1 10  106 2  o 7  2.82920e+00 8.98730e-01 4.87252e+01 326.557 3.43322e+00  -2.26752e+00 0.00000e+00 0.00000e+00 4.28792e+01 326.557 5.84599e+00 146.557 0.8678 
1 1 1 10  106 3  o 15 3.67259e+00 9.94869e-01 3.85693e+01 60.757  1.83230e+00  3.27278e+00  0.00000e+00 0.00000e+00 7.83742e+01 60.757  3.98049e+01 60.757  0.8532 
1 1 1 10  106 4  o 13 4.52484e+00 1.12278e+00 6.60820e+01 159.648 -7.28896e+00 2.70385e+00  0.00000e+00 0.00000e+00 9.15502e+01 159.648 2.54682e+01 159.648 0.9333 
1 1 1 10  106 5  o 7  6.31073e+00 1.15076e+00 9.41856e+01 210.509 -1.31597e+01 -7.75437e+00 0.00000e+00 0.00000e+00 1.33563e+02 210.509 3.93769e+01 210.509 0.9667 
1 1 1 10  107 0  o 1  5.67062e+00 1.04481e+00 8.13423e+01 336.308 1.08868e+01  -4.77710e+00 0.00000e+00 0.00000e+00 1.20935e+02 336.308 3.95930e+01 336.308 0.9570 
1 1 1 10  107 1  o 19 3.65744e+00 9.88712e-01 7.84086e+01 141.653 -6.12425e+00 4.84478e+00  0.00000e+00 0.00000e+00 4.89151e+01 141.653 2.94934e+01 321.653 0.9336 
1 1 1 10  107 2  o 3  4.15529e+00 1.03776e+00 3.56732e+01 348.204 3.68283e+00  -7.69134e-01 0.00000e+00 0.00000e+00 9.66480e+01 348.204 6.09748e+01 348.204 0.8537 
1 1 1 10  107 3  o 5  3.52677e+00 1.01674e+00 2.49415e+01 196.468 -2.42850e+00 -7.17884e-01 0.00000e+00 0.00000e+00 7.61768e+01 196.468 5.12353e+01 196.468 0.7685 
1 1 1 10  107 4  o 5  3.45049e+00 1.01585e+00 7.98426e+01 353.016 7.87424e+00  -9.64658e-01 0.00000e+00 0.00000e+00 4.05066e+01 353.016 3.93360e+01 173.016 0.9347 
1 1 1 10  108 0  f 0  7.12829e+00 9.56033e-01 8.26197e+01 154.569 -1.46267e+01 6.95493e+00  0.00000e+00 0.00000e+00 1.74673e+02 154.569 9.20536e+01 154.569 0.9686 
1 1 1 10  108 1  o 1  3.46490e+00 9.95126e-01 6.91362e+01 345.703 6.49907e+00  -1.65620e+00 0.00000e+00 0.00000e+00 4.99665e+01 345.703 1.91697e+01 165.703 0.9221 
1 1 1 10  108 2  o 6  3.79328e+00 1.02280e+00 3.39114e+01 46.185  2.58658e+00  2.69586e+00  0.00000e+00 0.00000e+00 8.66808e+01 46.185  5.27694e+01 46.185  0.8525 
1 1 1 10  108 3  o 5  2.16409e+00 7.49744e-01 1.33046e+01 206.849 -1.02613e+00 -5.19445e-01 0.00000e+00 0.00000e+00 2.68170e+01 206.849 1.35124e+01 206.849 0.4971 
1 1 1 10  108 4  o 8  3.19487e+00 9.83504e-01 7.11178e+01 225.487 -5.10361e+00 -5.19119e+00 0.00000e+00 0.00000e+00 3.95516e+01 225.487 3.15662e+01 45.487  0.9285 
1 1 1 10  109 0  o 2  2.88098e+00 8.79064e-01 4.29234e+01 154.350 -3.79999e+00 1.82471e+00  0.00000e+00 0.00000e+00 5.05913e+01 154.350 7.66794e+00 154.350 0.8713 
1 1 1 10  109 1  o 6  4.02672e+00 9.86589e-01 8.16566e+01 95.595  -1.00521e+00 1.02615e+01  0.00000e+00 0.00000e+00 6.09323e+01 95.595  2.07243e+01 275.595 0.9502 
1 1 1 10  109 2  o 18 3.44424e+00 1.00461e+00 3.86803e+01 210.496 -3.43924e+00 -2.02552e+00 0.00000e+00 0.00000e+00 7.21498e+01 210.496 3.34695e+01 210.496 0.8632 
1 1 1 10  109 3  o 9  2.60062e+00 8.50772e-01 2.80275e+01 261.317 -4.12952e-01 -2.70393e+00 0.00000e+00 0.00000e+00 4.84187e+01 261.317 2.03912e+01 261.317 0.7883 
1 1 1 10  109 4  o 12 2.64659e+00 8.81719e-01 4.98855e+01 252.650 -1.37609e+00 -4.40463e+00 0.00000e+00 0.00000e+00 3.73297e+01 252.650 1.25559e+01 72.650  0.8836 
1 1 1 10  110 0  o 5  3.65715e+00 9.56737e-01 2.99994e+01 117.239 -1.58772e+00 3.08420e+00  0.00000e+00 0.00000e+00 8.43341e+01 117.239 5.43347e+01 117.239 0.8395 
1 1 1 10  110 1  o 17 2.88313e+00 9.11319e-01 5.43600e+01 209.828 -4.38660e+00 -2.51509e+00 0.00000e+00 0.00000e+00 4.17396e+01 209.828 1.26204e+01 29.828  0.8947 
1 1 1 10  110 2  o 4  2.52773e+00 8.30337e-01 1.16796e+01 36.969  9.06706e-01  6.82481e-01  0.00000e+00 0.00000e+00 3.46804e+01 36.969  2.30007e+01 36.969  0.4921 
1 1 1 10  110 3  o 13 2.62811e+00 8.58983e-01 2.60946e+01 270.139 6.29260e-03  -2.58516e+00 0.00000e+00 0.00000e+00 4.97271e+01 270.139 2.36326e+01 270.139 0.7740 
1 1 1 10  111 0  o 14 1.98571e+00 6.72496e-01 2.19632e+00 62.942  9.18372e-02  1.79792e-01  0.00000e+00 0.00000e+00 5.22865e+00 62.942  3.03234e+00 62.942  0.1004 
1 1 1 10  111 1  o 9  2.48707e+00 8.15366e-01 4.22521e+01 313.958 2.87697e+00  -2.98360e+00 0.00000e+00 0.00000e+00 3.82301e+01 313.958 4.02206e+00 133.958 0.8689 
1 1 1 10  111 2  o 5  2.56383e+00 8.45672e-01 5.75246e+01 119.275 -2.76180e+00 4.92653e+00  0.00000e+00 0.00000e+00 2.90637e+01 119.275 2.84609e+01 299.275 0.9065 
1 1 1 10  111 3  o 2  2.21180e+00 7.55368e-01 4.12773e+01 354.645 4.18626e+00  -3.92411e-01 0.00000e+00 0.00000e+00 3.05096e+01 354.645 1.07677e+01 174.645 0.8710 
1 1 1 10  112 0  o 15 2.28573e+00 7.70361e-01 5.26929e+01 334.378 4.31355e+00  -2.06871e+00 0.00000e+00 0.00000e+00 2.28619e+01 334.378 2.98311e+01 154.378 0.8881 
1 1 1 10  112 1  f 0  2.46582e+00 8.11143e-01 3.18098e+01 103.184 -6.77317e-01 2.89136e+00  0.00000e+00 0.00000e+00 4.23464e+01 103.184 1.05366e+01 103.184 0.8077 
1 1 1 10  112 2  o 2  3.11060e+00 9.30999e-01 5.54017e+01 76.637  1.46238e+00  6.15615e+00  0.00000e+00 0.00000e+00 5.08543e+01 76.637  4.54745e+00 256.637 0.9172 
1 1 1 10  112 3  o 5  5.38510e+00 1.07830e+00 1.30102e+02 185.454 -2.17923e+01 -2.08086e+00 0.00000e+00 0.00000e+00 6.58770e+01 185.454 6.42247e+01 5.454   0.9769 
1 1 1 10  113 0  o 9  2.61209e+00 8.52038e-01 2.66902e+01 354.228 2.81799e+00  -2.84861e-01 0.00000e+00 0.00000e+00 5.07488e+01 354.228 2.40586e+01 354.228 0.7968 
1 1 1 10  113 1  o 3  2.33846e+00 7.91803e-01 4.86408e+01 135.788 -3.37587e+00 3.28424e+00  0.00000e+00 0.00000e+00 2.84938e+01 135.788 2.01470e+01 315.788 0.8862 
1 1 1 10  113 2  o 19 3.68026e+00 1.02745e+00 4.48396e+01 338.421 4.94326e+00  -1.95510e+00 0.00000e+00 0.00000e+00 7.85160e+01 338.421 3.36765e+01 338.421 0.9002 
1 1 1 10  114 0  o 1  2.68699e+00 8.61673e-01 4.39097e+01 239.184 -2.39705e+00 -4.01857e+00 0.00000e+00 0.00000e+00 4.45787e+01 239.184 6.68973e-01 239.184 0.8854 
1 1 1 11  0   0  o 17 1.42173e+01 1.19038e+00 2.07544e+02 180.000 -4.00124e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.31308e+02 180.000 1.23764e+02 180.000 0.9993 
1 1 1 11  0   2  o 10 2.45859e+01 1.12443e+00 4.89980e+02 0.000   1.71864e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.43189e+02 0.000   4.67908e+01 180.000 1.0000 
1 1 1 11  0   3  o 5  1.19548e+01 1.52134e+00 1.50888e+02 180.000 -2.69444e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.98866e+02 180.000 1.47978e+02 180.000 0.9909 
1 1 1 11  0   4  o 6  3.81111e+00 2.33488e+00 1.55297e+02 0.000   8.92870e-01  0.00000e+00  0.00000e+00 0.00000e+00 5.21345e+01 180.000 2.07432e+02 180.000 0.7128 
1 1 1 11  0   5  o 3  2.07963e+01 1.28972e+00 3.41952e+02 0.000   1.47320e+01  0.00000e+00  0.00000e+00 0.00000e+00 4.47924e+02 0.000   1.05972e+02 0.000   1.0000 
1 1 1 11  0   6  o 8  1.56131e+01 1.96642e+00 2.64878e+02 0.000   9.16668e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.28195e+02 0.000   6.33170e+01 0.000   1.0000 
1 1 1 11  0   7  o 12 1.96714e+01 1.83644e+00 2.88231e+02 180.000 -1.54522e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.59035e+02 180.000 1.70804e+02 180.000 1.0000 
1 1 1 11  0   8  o 13 2.99749e+01 2.27154e+00 5.21541e+02 180.000 -4.59767e+01 0.00000e+00  0.00000e+00 0.00000e+00 6.17110e+02 180.000 9.55692e+01 180.000 1.0000 
1 1 1 11  0   9  o 6  1.33038e+01 3.50700e+00 2.01667e+02 0.000   6.14230e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.03658e+02 0.000   1.01991e+02 0.000   1.0000 
1 1 1 11  0   10 f 0  4.29625e+00 2.91294e+00 1.20623e+01 0.000   1.55621e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.31268e+01 0.000   1.06444e+00 0.000   0.1544 
1 1 1 11  0   11 o 14 1.50402e+01 2.54732e+00 2.23909e+02 0.000   1.32633e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.47184e+02 0.000   1.23275e+02 0.000   1.0000 
1 1 1 11  0   12 o 1  4.21913e+00 2.75989e+00 2.04833e+02 180.000 -3.24147e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.51585e+01 0.000   2.49992e+02 0.000   0.9969 
1 1 1 11  1   0  o 12 1.90945e+01 7.69225e-01 3.80760e+02 215.991 -1.60494e+01 -1.16568e+01 0.00000e+00 0.00000e+00 3.24928e+02 215.991 5.58321e+01 35.991  0.9745 
1 1 1 11  1   1  f 0  1.26206e+01 8.64866e-01 3.39148e+02 2.005   1.18309e+01  4.14175e-01  0.00000e+00 0.00000e+00 1.19009e+02 2.005   2.20139e+02 182.005 0.9568 
1 1 1 11  1   2  o 15 1.46605e+01 8.76198e-01 3.36908e+02 265.773 -1.03125e+00 -1.39516e+01 0.00000e+00 0.00000e+00 1.99264e+02 265.773 1.37644e+02 85.773  0.9636 
1 1 1 11  1   3  o 18 1.88719e+01 8.48823e-01 3.38129e+02 191.793 -1.91340e+01 -3.99476e+00 0.00000e+00 0.00000e+00 3.59793e+02 191.793 2.16639e+01 191.793 0.9741 
1 1 1 11  1   4  o 10 2.53942e+01 1.15801e+00 5.04699e+02 113.810 -1.69554e+01 3.84255e+01  0.00000e+00 0.00000e+00 4.48100e+02 113.810 5.65988e+01 293.810 0.9880 
1 1 1 11  1   5  o 4  2.56677e+01 8.97399e-01 3.63858e+02 296.245 1.71463e+01  -3.47768e+01 0.00000e+00 0.00000e+00 5.98386e+02 296.245 2.34527e+02 296.245 0.9870 
1 1 1 11  1   6  o 6  1.53146e+01 1.34143e+00 2.87164e+02 246.831 -7.75753e+00 -1.81271e+01 0.00000e+00 0.00000e+00 2.79621e+02 246.831 7.54374e+00 66.831  0.9743 
1 1 1 11  1   7  o 3  7.34999e+00 1.73511e+00 2.49183e+02 196.585 -8.41356e+00 -2.50579e+00 0.00000e+00 0.00000e+00 1.36046e+01 196.585 2.35578e+02 16.585  0.9412 
1 1 1 11  1   8  o 3  7.46403e+00 2.09263e+00 1.47085e+02 57.067  2.92306e+00  4.51262e+00  0.00000e+00 0.00000e+00 1.08505e+02 57.067  3.85800e+01 237.067 0.9014 
1 1 1 11  1   9  o 19 5.79284e+00 1.82855e+00 7.62285e+01 246.348 -1.07291e+00 -2.44979e+00 0.00000e+00 0.00000e+00 9.59947e+01 246.348 1.97662e+01 246.348 0.7827 
1 1 1 11  1   10 o 2  9.84444e+00 2.48201e+00 1.56511e+02 203.796 -6.94737e+00 -3.06353e+00 0.00000e+00 0.00000e+00 1.91798e+02 203.796 3.52875e+01 203.796 0.9316 
1 1 1 11  1   11 o 17 7.51883e+00 1.87770e+00 1.45124e+02 22.313  7.63029e+00  3.13146e+00  0.00000e+00 0.00000e+00 1.22463e+02 22.313  2.26610e+01 202.313 0.9373 
1 1 1 11  1   12 o 16 7.62867e+00 1.71567e+00 1.29670e+02 232.195 -5.18747e+00 -6.68635e+00 0.00000e+00 0.00000e+00 1.42234e+02 232.195 1.25640e+01 232.195 0.9389 
1 1 1 11  2   0  o 2  2.61544e+01 7.64524e-01 4.55419e+02 98.534  -4.82359e+00 3.21458e+01  0.00000e+00 0.00000e+00 5.21140e+02 98.534  6.57210e+01 98.534  0.9845 
1 1 1 11  2   1  f 0  1.83981e+01 7.75154e-01 3.18800e+02 115.241 -6.97035e+00 1.47852e+01  0.00000e+00 0.00000e+00 3.57557e+02 115.241 3.87568e+01 115.241 0.9689 
1 1 1 11  2   2  o 5  1.79876e+01 1.26812e+00 1.44434e+02 48.813  4.63552e+00  5.29751e+00  0.00000e+00 0.00000e+00 4.87745e+02 48.813  3.43310e+02 48.813  0.9260 
1 1 1 11  2   3  o 19 9.87669e+00 1.20493e+00 2.77621e+02 255.261 -2.04947e+00 -7.79030e+00 0.00000e+00 0.00000e+00 7.32479e+01 255.261 2.04373e+02 75.261  0.9357 
1 1 1 11  2   4  o 8  2.65300e+01 9.94498e-01 4.21371e+02 273.445 2.25034e+00  -3.73818e+01 0.00000e+00 0.00000e+00 5.72560e+02 273.445 1.51189e+02 273.445 0.9866 
1 1 1 11  2   5  o 17 1.23389e+01 1.19863e+00 2.65374e+02 53.696  7.89942e+00  1.07520e+01  0.00000e+00 0.00000e+00 1.85354e+02 53.696  8.00201e+01 233.695 0.9618 
1 1 1 11  2   6  o 16 2.07440e+01 1.25524e+00 3.57733e+02 295.501 1.45998e+01  -3.06080e+01 0.00000e+00 0.00000e+00 4.18531e+02 295.501 6.07976e+01 295.501 0.9851 
1 1 1 11  2   7  o 18 2.61035e+01 1.32369e+00 4.11637e+02 129.600 -3.70740e+01 4.48145e+01  0.00000e+00 0.00000e+00 5.71399e+02 129.600 1.59762e+02 129.600 0.9914 
1 1 1 11  2   8  o 11 7.93350e+00 1.98247e+00 7.27701e+01 177.521 -2.94763e+00 1.27623e-01  0.00000e+00 0.00000e+00 1.70207e+02 177.521 9.74369e+01 177.521 0.8063 
1 1 1 11  2   9  f 0  9.52844e+00 2.20009e+00 1.43087e+02 211.619 -5.99854e+00 -3.69314e+00 0.00000e+00 0.00000e+00 1.92064e+02 211.619 4.89771e+01 211.619 0.9260 
1 1 1 11  2   10 o 12 6.48111e+00 1.88926e+00 9.65082e+01 161.354 -3.85518e+00 1.30087e+00  0.00000e+00 0.00000e+00 1.16680e+02 161.354 2.01717e+01 161.354 0.8661 
1 1 1 11  2   11 f 0  9.54590e+00 1.83657e+00 7.75942e+01 263.860 -6.12276e-01 -5.69129e+00 0.00000e+00 0.00000e+00 2.51471e+02 263.860 1.73876e+02 263.860 0.9078 
1 1 1 11  2   12 o 16 7.62021e+00 1.89653e+00 1.76982e+02 344.078 1.00306e+01  -2.86153e+00 0.00000e+00 0.00000e+00 9.80533e+01 344.078 7.89288e+01 164.078 0.9508 
1 1 1 11  3   0  o 11 1.80279e+01 7.60247e-01 3.11380e+02 226.952 -1.04585e+01 -1.11965e+01 0.00000e+00 0.00000e+00 3.49640e+02 226.952 3.82604e+01 226.952 0.9668 
1 1 1 11  3   1  o 4  2.13863e+01 7.63565e-01 2.40743e+02 293.273 5.67326e+00  -1.31902e+01 0.00000e+00 0.00000e+00 5.41900e+02 293.273 3.01157e+02 293.273 0.9645 
1 1 1 11  3   2  o 8  2.57210e+01 9.52590e-01 4.74360e+02 92.290  -1.36978e+00 3.42566e+01  0.00000e+00 0.00000e+00 4.87534e+02 92.290  1.31734e+01 92.290  0.9853 
1 1 1 11  3   3  o 9  1.33050e+01 9.85092e-01 2.21444e+02 271.189 1.84478e-01  -8.89042e+00 0.00000e+00 0.00000e+00 2.54381e+02 271.189 3.29365e+01 271.189 0.9420 
1 1 1 11  3   4  o 6  2.13868e+01 1.01122e+00 3.77557e+02 278.247 3.87120e+00  -2.67078e+01 0.00000e+00 0.00000e+00 4.19409e+02 278.247 4.18527e+01 278.247 0.9813 
1 1 1 11  3   5  o 6  4.07469e+01 1.01531e+00 6.39678e+02 182.612 -1.09509e+02 -4.99533e+00 0.00000e+00 0.00000e+00 9.00858e+02 182.612 2.61180e+02 182.612 0.9954 
1 1 1 11  3   6  o 17 1.52903e+01 1.37867e+00 3.47195e+02 102.723 -5.19479e+00 2.30088e+01  0.00000e+00 0.00000e+00 2.21162e+02 102.723 1.26034e+02 282.723 0.9786 
1 1 1 11  3   7  o 17 8.95883e+00 1.68283e+00 8.75713e+01 253.055 -1.11380e+00 -3.65571e+00 0.00000e+00 0.00000e+00 2.03842e+02 253.055 1.16270e+02 253.055 0.8563 
1 1 1 11  3   8  o 4  4.85327e+00 1.56675e+00 1.21410e+02 68.548  1.28520e+00  3.27070e+00  0.00000e+00 0.00000e+00 3.37897e+01 68.548  8.76204e+01 248.548 0.8418 
1 1 1 11  3   9  o 9  9.12806e+00 2.06569e+00 1.00117e+02 146.917 -4.19172e+00 2.73073e+00  0.00000e+00 0.00000e+00 2.09655e+02 146.917 1.09538e+02 146.917 0.8934 
1 1 1 11  3   10 o 5  5.44038e+00 1.71676e+00 1.13947e+02 318.167 3.37756e+00  -3.02342e+00 0.00000e+00 0.00000e+00 6.81426e+01 318.167 4.58049e+01 138.167 0.8813 
1 1 1 11  3   11 o 8  7.32347e+00 1.90077e+00 1.45975e+02 162.638 -7.61643e+00 2.38127e+00  0.00000e+00 0.00000e+00 1.14046e+02 162.638 3.19290e+01 342.638 0.9351 
1 1 1 11  3   12 o 13 6.49848e+00 1.84077e+00 1.33356e+02 173.453 -6.86863e+00 7.88304e-01  0.00000e+00 0.00000e+00 9.47209e+01 173.453 3.86349e+01 353.453 0.9246 
1 1 1 11  4   0  o 15 5.12987e+01 1.09540e+00 9.20174e+02 58.323  6.55272e+01  1.06194e+02  0.00000e+00 0.00000e+00 1.01755e+03 58.323  9.73729e+01 58.323  0.9960 
1 1 1 11  4   1  o 3  8.05029e+00 1.20964e+00 2.18136e+02 308.481 2.91087e+00  -3.66199e+00 0.00000e+00 0.00000e+00 5.22794e+01 308.481 1.65857e+02 128.481 0.8853 
1 1 1 11  4   2  o 14 2.02667e+01 9.81235e-01 4.67607e+02 205.122 -2.40295e+01 -1.12676e+01 0.00000e+00 0.00000e+00 2.86973e+02 205.122 1.80634e+02 25.122  0.9810 
1 1 1 11  4   3  o 6  2.04646e+01 8.41544e-01 3.18220e+02 253.412 -5.88773e+00 -1.97647e+01 0.00000e+00 0.00000e+00 4.39654e+02 253.412 1.21434e+02 253.412 0.9754 
1 1 1 11  4   4  o 15 6.33306e+00 1.46985e+00 2.75906e+02 347.098 5.30755e+00  -1.21579e+00 0.00000e+00 0.00000e+00 5.87951e+01 167.098 3.34702e+02 167.098 0.9028 
1 1 1 11  4   5  f 0  3.19948e+01 9.35018e-01 6.28438e+02 133.066 -5.84579e+01 6.25432e+01  0.00000e+00 0.00000e+00 5.79630e+02 133.066 4.88078e+01 313.066 0.9941 
1 1 1 11  4   6  o 4  2.23179e+01 1.25427e+00 3.33798e+02 212.638 -2.86554e+01 -1.83524e+01 0.00000e+00 0.00000e+00 5.01391e+02 212.638 1.67593e+02 212.638 0.9852 
1 1 1 11  4   7  o 17 1.83468e+01 1.31715e+00 2.86977e+02 69.541  9.97469e+00  2.67367e+01  0.00000e+00 0.00000e+00 3.97631e+02 69.541  1.10653e+02 69.541  0.9823 
1 1 1 11  4   8  o 2  1.47326e+01 1.60180e+00 2.38334e+02 237.755 -1.10317e+01 -1.74879e+01 0.00000e+00 0.00000e+00 3.07595e+02 237.755 6.92615e+01 237.755 0.9755 
1 1 1 11  4   9  o 18 5.34381e+00 1.77794e+00 2.31119e+02 94.192  -5.58374e-01 7.61796e+00  0.00000e+00 0.00000e+00 4.19394e+01 274.192 2.73058e+02 274.192 0.9320 
1 1 1 11  4   10 o 15 8.84442e+00 1.86656e+00 1.41733e+02 97.882  -1.16964e+00 8.44895e+00  0.00000e+00 0.00000e+00 1.73808e+02 97.882  3.20748e+01 97.882  0.9394 
1 1 1 11  4   11 o 3  1.14981e+01 1.86895e+00 2.16524e+02 266.738 -1.07569e+00 -1.88730e+01 0.00000e+00 0.00000e+00 2.08354e+02 266.738 8.16997e+00 86.738  0.9732 
1 1 1 11  4   12 o 9  6.69385e+00 1.81198e+00 1.19082e+02 268.563 -1.62025e-01 -6.45964e+00 0.00000e+00 0.00000e+00 1.14434e+02 268.563 4.64803e+00 88.563  0.9190 
1 1 1 11  5   0  o 14 7.54458e+00 1.19831e+00 1.35349e+02 15.082  2.63761e+00  7.10779e-01  0.00000e+00 0.00000e+00 9.01245e+01 15.082  4.52247e+01 195.082 0.7880 
1 1 1 11  5   1  o 9  2.19370e+01 7.61056e-01 4.26331e+02 67.039  1.01692e+01  2.40024e+01  0.00000e+00 0.00000e+00 3.89851e+02 67.039  3.64792e+01 247.039 0.9806 
1 1 1 11  5   2  o 2  3.24448e+01 9.96660e-01 6.31624e+02 40.871  4.33056e+01  3.74735e+01  0.00000e+00 0.00000e+00 5.88991e+02 40.871  4.26329e+01 220.870 0.9912 
1 1 1 11  5   3  o 8  2.29064e+01 8.36589e-01 3.57634e+02 194.607 -2.51034e+01 -6.54231e+00 0.00000e+00 0.00000e+00 4.95082e+02 194.607 1.37448e+02 194.607 0.9805 
1 1 1 11  5   4  o 7  1.90729e+01 8.99906e-01 3.27342e+02 220.729 -1.60176e+01 -1.37916e+01 0.00000e+00 0.00000e+00 3.79583e+02 220.729 5.22406e+01 220.729 0.9761 
1 1 1 11  5   5  o 9  1.30383e+01 1.12275e+00 2.74354e+02 1.552   1.47581e+01  3.99816e-01  0.00000e+00 0.00000e+00 2.03769e+02 1.552   7.05855e+01 181.552 0.9655 
1 1 1 11  5   6  o 14 1.21638e+01 1.50402e+00 2.76647e+02 304.057 8.11905e+00  -1.20110e+01 0.00000e+00 0.00000e+00 1.69157e+02 304.057 1.07490e+02 124.057 0.9649 
1 1 1 11  5   7  o 6  1.33248e+01 1.57571e+00 3.14084e+02 282.976 4.72765e+00  -2.05171e+01 0.00000e+00 0.00000e+00 1.79904e+02 282.976 1.34180e+02 102.976 0.9760 
1 1 1 11  5   8  o 6  6.72433e+00 1.85687e+00 1.08798e+02 120.322 -1.97919e+00 3.38404e+00  0.00000e+00 0.00000e+00 1.10968e+02 120.322 2.16989e+00 120.322 0.8604 
1 1 1 11  5   9  o 2  6.93295e+00 1.99284e+00 7.97351e+01 225.728 -2.17886e+00 -2.23493e+00 0.00000e+00 0.00000e+00 1.35819e+02 225.728 5.60840e+01 225.728 0.8186 
1 1 1 11  5   10 o 16 1.24648e+01 1.87992e+00 1.70561e+02 98.178  -2.04434e+00 1.42247e+01  0.00000e+00 0.00000e+00 2.86042e+02 98.178  1.15482e+02 98.178  0.9646 
1 1 1 11  5   11 o 17 5.11789e+00 1.57100e+00 6.65002e+01 98.055  -4.24837e-01 3.00181e+00  0.00000e+00 0.00000e+00 9.13513e+01 98.055  2.48512e+01 98.055  0.8123 
1 1 1 11  5   12 o 9  5.30533e+00 1.67862e+00 1.62574e+02 235.151 -4.30296e+00 -6.17984e+00 0.00000e+00 0.00000e+00 2.49238e+01 235.151 1.37650e+02 55.151  0.9310 
1 1 1 11  6   0  o 10 8.50635e+00 1.12694e+00 1.49825e+02 110.848 -1.22303e+00 3.21150e+00  0.00000e+00 0.00000e+00 1.20422e+02 110.848 2.94032e+01 290.848 0.8377 
1 1 1 11  6   1  o 16 1.50013e+01 8.20329e-01 2.29192e+02 194.915 -9.95180e+00 -2.65071e+00 0.00000e+00 0.00000e+00 3.11579e+02 194.915 8.23868e+01 194.915 0.9501 
1 1 1 11  6   2  o 8  2.79775e+01 9.50435e-01 6.19044e+02 280.776 9.08692e+00  -4.77434e+01 0.00000e+00 0.00000e+00 4.31821e+02 280.776 1.87224e+02 100.776 0.9897 
1 1 1 11  6   3  o 18 1.50561e+01 9.38353e-01 3.07088e+02 269.282 -1.81451e-01 -1.44735e+01 0.00000e+00 0.00000e+00 2.44396e+02 269.282 6.26919e+01 89.282  0.9648 
1 1 1 11  6   4  o 16 1.17780e+01 1.17754e+00 2.59589e+02 216.629 -8.00622e+00 -5.95219e+00 0.00000e+00 0.00000e+00 1.64615e+02 216.629 9.49741e+01 36.629  0.9485 
1 1 1 11  6   5  o 10 1.31761e+01 1.09159e+00 2.02014e+02 119.595 -5.45243e+00 9.59979e+00  0.00000e+00 0.00000e+00 2.75178e+02 119.595 7.31634e+01 119.595 0.9536 
1 1 1 11  6   6  o 18 8.16553e+00 1.65565e+00 1.33315e+02 267.274 -2.27813e-01 -4.78441e+00 0.00000e+00 0.00000e+00 1.42189e+02 267.274 8.87406e+00 267.274 0.8883 
1 1 1 11  6   7  o 8  6.97561e+00 1.76342e+00 7.28936e+01 263.499 -2.73146e-01 -2.39714e+00 0.00000e+00 0.00000e+00 1.27201e+02 263.499 5.43070e+01 263.499 0.7552 
1 1 1 11  6   8  o 12 2.01939e+01 1.42703e+00 3.74044e+02 217.913 -3.72781e+01 -2.90335e+01 0.00000e+00 0.00000e+00 3.84860e+02 217.913 1.08164e+01 217.913 0.9894 
1 1 1 11  6   9  o 7  1.31137e+01 2.24821e+00 3.42625e+02 55.284  1.29425e+01  1.86804e+01  0.00000e+00 0.00000e+00 1.44377e+02 55.284  1.98248e+02 235.284 0.9777 
1 1 1 11  6   10 f 0  1.91597e+01 1.57298e+00 3.27406e+02 278.570 7.31240e+00  -4.85200e+01 0.00000e+00 0.00000e+00 3.92767e+02 278.570 6.53607e+01 278.570 0.9898 
1 1 1 11  6   11 o 8  5.19606e+00 1.58868e+00 6.12397e+01 315.331 1.99663e+00  -1.97371e+00 0.00000e+00 0.00000e+00 9.55437e+01 315.331 3.43039e+01 315.331 0.7947 
1 1 1 11  6   12 o 7  7.12393e+00 1.85686e+00 7.00346e+01 258.491 -7.86820e-01 -3.86430e+00 0.00000e+00 0.00000e+00 1.62883e+02 258.491 9.28489e+01 258.491 0.8613 
1 1 1 11  7   0  o 14 3.29542e+01 8.37961e-01 6.20412e+02 56.402  3.13990e+01  4.72626e+01  0.00000e+00 0.00000e+00 6.18277e+02 56.402  2.13529e+00 236.402 0.9911 
1 1 1 11  7   1  o 13 3.80018e+01 9.02342e-01 6.40655e+02 114.476 -2.99504e+01 6.57936e+01  0.00000e+00 0.00000e+00 7.91107e+02 114.476 1.50453e+02 114.476 0.9931 
1 1 1 11  7   2  o 15 2.49246e+01 9.25280e-01 4.11840e+02 341.154 2.73087e+01  -9.32131e+00 0.00000e+00 0.00000e+00 5.17582e+02 341.154 1.05741e+02 341.154 0.9825 
1 1 1 11  7   3  o 5  1.69676e+01 8.93437e-01 3.36053e+02 126.912 -1.07655e+01 1.43320e+01  0.00000e+00 0.00000e+00 2.89870e+02 126.912 4.61825e+01 306.912 0.9717 
1 1 1 11  7   4  o 12 2.06747e+01 8.93516e-01 2.11700e+02 172.154 -1.46746e+01 2.02217e+00  0.00000e+00 0.00000e+00 5.46391e+02 172.154 3.34691e+02 172.154 0.9656 
1 1 1 11  7   5  o 12 3.56683e+01 9.69922e-01 6.94806e+02 95.594  -1.02164e+01 1.04303e+02  0.00000e+00 0.00000e+00 6.53362e+02 95.594  4.14439e+01 275.594 0.9952 
1 1 1 11  7   6  o 19 1.68703e+01 1.29938e+00 1.66720e+02 223.300 -9.86985e+00 -9.30096e+00 0.00000e+00 0.00000e+00 4.49970e+02 223.300 2.83251e+02 223.300 0.9624 
1 1 1 11  7   7  o 19 3.03041e+01 1.34568e+00 5.53317e+02 271.205 1.89409e+00  -9.00427e+01 0.00000e+00 0.00000e+00 5.91370e+02 271.205 3.80523e+01 271.205 0.9944 
1 1 1 11  7   8  f 0  7.20564e+00 1.92316e+00 8.59785e+01 166.975 -3.15209e+00 7.29185e-01  0.00000e+00 0.00000e+00 1.40094e+02 166.975 5.41153e+01 166.975 0.8260 
1 1 1 11  7   9  o 2  5.17855e+00 1.71869e+00 8.20489e+01 349.652 2.64787e+00  -4.83474e-01 0.00000e+00 0.00000e+00 7.22196e+01 349.652 9.82930e+00 169.652 0.7843 
1 1 1 11  7   10 o 4  1.14590e+01 1.91187e+00 1.91213e+02 37.618  1.15472e+01  8.89829e+00  0.00000e+00 0.00000e+00 2.28755e+02 37.618  3.75420e+01 37.618  0.9651 
1 1 1 11  7   11 o 9  1.07911e+01 1.85183e+00 1.45301e+02 252.833 -3.54490e+00 -1.14751e+01 0.00000e+00 0.00000e+00 2.46977e+02 252.833 1.01676e+02 252.833 0.9574 
1 1 1 11  7   12 o 5  8.59559e+00 1.91768e+00 1.15210e+02 148.213 -6.89312e+00 4.27178e+00  0.00000e+00 0.00000e+00 1.90234e+02 148.213 7.50248e+01 148.213 0.9361 
1 1 1 11  8   0  o 2  3.80886e+01 8.95518e-01 5.82153e+02 140.816 -4.74166e+01 3.86501e+01  0.00000e+00 0.00000e+00 8.50430e+02 140.816 2.68277e+02 140.816 0.9918 
1 1 1 11  8   1  o 19 3.30574e+01 1.00206e+00 4.66522e+02 263.012 -5.50767e+00 -4.49312e+01 0.00000e+00 0.00000e+00 7.73703e+02 263.012 3.07181e+02 263.012 0.9889 
1 1 1 11  8   2  o 12 8.36326e+00 1.17754e+00 1.32640e+02 246.833 -1.33464e+00 -3.11895e+00 0.00000e+00 0.00000e+00 1.32482e+02 246.833 1.58279e-01 66.833  0.8353 
1 1 1 11  8   3  o 10 2.35025e+01 8.44790e-01 4.13123e+02 207.944 -2.70763e+01 -1.43630e+01 0.00000e+00 0.00000e+00 4.64426e+02 207.944 5.13030e+01 207.944 0.9835 
1 1 1 11  8   4  o 13 1.45934e+01 1.23645e+00 2.22899e+02 166.874 -1.02346e+01 2.38649e+00  0.00000e+00 0.00000e+00 3.04175e+02 166.874 8.12758e+01 166.874 0.9512 
1 1 1 11  8   5  o 15 1.37904e+01 1.12717e+00 2.40108e+02 275.793 1.37603e+00  -1.35631e+01 0.00000e+00 0.00000e+00 2.64037e+02 275.793 2.39285e+01 275.793 0.9626 
1 1 1 11  8   6  o 13 2.06581e+01 1.24958e+00 3.41633e+02 329.081 2.95179e+01  -1.76792e+01 0.00000e+00 0.00000e+00 4.31522e+02 329.081 8.98887e+01 329.081 0.9854 
1 1 1 11  8   7  o 4  9.82222e+00 1.65933e+00 1.76578e+02 194.624 -8.21893e+00 -2.14460e+00 0.00000e+00 0.00000e+00 1.73807e+02 194.624 2.77105e+00 14.624  0.9391 
1 1 1 11  8   8  o 18 2.71958e+01 1.37165e+00 4.86205e+02 136.094 -6.48252e+01 6.23960e+01  0.00000e+00 0.00000e+00 5.41031e+02 136.094 5.48259e+01 136.094 0.9944 
1 1 1 11  8   9  o 2  1.73143e+01 2.09769e+00 1.95198e+02 297.562 8.43639e+00  -1.61631e+01 0.00000e+00 0.00000e+00 4.44113e+02 297.562 2.48915e+02 297.562 0.9722 
1 1 1 11  8   10 o 1  9.79252e+00 1.84656e+00 2.09284e+02 264.539 -1.33871e+00 -1.40040e+01 0.00000e+00 0.00000e+00 1.49120e+02 264.539 6.01635e+01 84.539  0.9638 
1 1 1 11  8   11 o 6  5.79262e+00 1.68914e+00 1.13091e+02 24.354  4.86030e+00  2.20001e+00  0.00000e+00 0.00000e+00 8.49837e+01 24.354  2.81076e+01 204.354 0.9006 
1 1 1 11  8   12 o 1  5.80456e+00 1.74852e+00 6.66656e+01 182.580 -3.50289e+00 -1.57842e-01 0.00000e+00 0.00000e+00 1.18729e+02 182.580 5.20629e+01 182.580 0.8414 
1 1 1 11  9   0  f 0  2.32148e+01 7.54716e-01 2.70544e+02 328.050 1.48712e+01  -9.27448e+00 0.00000e+00 0.00000e+00 5.84315e+02 328.050 3.13771e+02 328.050 0.9710 
1 1 1 11  9   1  o 18 1.85152e+01 7.90149e-01 3.86206e+02 55.279  1.22008e+01  1.76066e+01  0.00000e+00 0.00000e+00 2.99624e+02 55.279  8.65819e+01 235.279 0.9764 
1 1 1 11  9   2  o 4  1.89942e+01 8.00703e-01 3.33034e+02 247.326 -7.78739e+00 -1.86399e+01 0.00000e+00 0.00000e+00 3.69745e+02 247.326 3.67106e+01 247.326 0.9749 
1 1 1 11  9   3  o 7  2.66945e+01 1.07621e+00 4.68618e+02 218.868 -2.99188e+01 -2.41142e+01 0.00000e+00 0.00000e+00 5.31492e+02 218.868 6.28743e+01 218.868 0.9869 
1 1 1 11  9   4  o 15 2.68045e+01 8.83855e-01 4.24873e+02 74.893  1.00428e+01  3.72015e+01  0.00000e+00 0.00000e+00 5.79624e+02 74.893  1.54751e+02 74.893  0.9869 
1 1 1 11  9   5  o 6  1.69416e+01 1.00078e+00 2.99740e+02 57.612  1.14311e+01  1.80208e+01  0.00000e+00 0.00000e+00 3.28396e+02 57.612  2.86560e+01 57.612  0.9763 
1 1 1 11  9   6  o 14 1.89801e+01 1.25281e+00 3.00481e+02 195.878 -2.67036e+01 -7.59582e+00 0.00000e+00 0.00000e+00 4.07305e+02 195.878 1.06824e+02 195.878 0.9818 
1 1 1 11  9   7  o 16 2.64434e+01 1.24153e+00 5.96837e+02 193.491 -9.20290e+01 -2.20792e+01 0.00000e+00 0.00000e+00 4.02247e+02 193.491 1.94589e+02 13.491  0.9947 
1 1 1 11  9   8  o 7  1.30534e+01 1.75403e+00 2.21023e+02 299.235 8.30060e+00  -1.48306e+01 0.00000e+00 0.00000e+00 2.59964e+02 299.235 3.89410e+01 299.235 0.9701 
1 1 1 11  9   9  o 18 5.36682e+00 1.78047e+00 1.40221e+02 160.742 -4.55208e+00 1.59040e+00  0.00000e+00 0.00000e+00 4.10008e+01 160.742 9.92203e+01 340.742 0.8891 
1 1 1 11  9   10 o 15 8.83941e+00 2.00086e+00 2.26183e+02 105.219 -3.34303e+00 1.22881e+01  0.00000e+00 0.00000e+00 9.60274e+01 105.219 1.30156e+02 285.219 0.9599 
1 1 1 11  9   11 o 6  7.47312e+00 1.72751e+00 1.47712e+02 198.852 -8.33620e+00 -2.84637e+00 0.00000e+00 0.00000e+00 1.19394e+02 198.852 2.83178e+01 18.852  0.9414 
1 1 1 11  9   12 o 17 7.89485e+00 1.96629e+00 8.40353e+01 184.858 -5.25799e+00 -4.46879e-01 0.00000e+00 0.00000e+00 1.85494e+02 184.858 1.01459e+02 184.858 0.8994 
1 1 1 11  10  0  o 15 3.77012e+01 8.91178e-01 7.30701e+02 307.377 4.60774e+01  -6.03176e+01 0.00000e+00 0.00000e+00 6.89526e+02 307.377 4.11746e+01 127.377 0.9934 
1 1 1 11  10  1  o 13 1.16923e+01 9.43469e-01 2.32619e+02 157.541 -7.40945e+00 3.06283e+00  0.00000e+00 0.00000e+00 1.82288e+02 157.541 5.03316e+01 337.541 0.9354 
1 1 1 11  10  2  o 2  1.81618e+01 8.44359e-01 2.66020e+02 325.265 1.26115e+01  -8.74395e+00 0.00000e+00 0.00000e+00 4.00377e+02 325.265 1.34357e+02 325.265 0.9668 
1 1 1 11  10  3  o 15 1.49763e+01 1.18408e+00 3.28093e+02 3.865   1.48324e+01  1.00206e+00  0.00000e+00 0.00000e+00 2.20960e+02 3.865   1.07133e+02 183.865 0.9658 
1 1 1 11  10  4  o 10 1.28584e+01 1.07898e+00 1.76427e+02 237.758 -4.51182e+00 -7.15307e+00 0.00000e+00 0.00000e+00 2.81959e+02 237.758 1.05532e+02 237.758 0.9389 
1 1 1 11  10  5  o 6  1.62220e+01 1.18342e+00 1.73075e+02 252.139 -3.66248e+00 -1.13656e+01 0.00000e+00 0.00000e+00 4.16589e+02 252.139 2.43514e+02 252.139 0.9572 
1 1 1 11  10  6  o 19 1.17525e+01 1.51060e+00 1.86834e+02 73.918  2.77590e+00  9.62860e+00  0.00000e+00 0.00000e+00 2.36636e+02 73.918  4.98022e+01 73.918  0.9487 
1 1 1 11  10  7  o 15 1.14800e+01 1.59533e+00 1.41180e+02 213.708 -7.25074e+00 -4.83710e+00 0.00000e+00 0.00000e+00 2.69022e+02 213.708 1.27842e+02 213.708 0.9408 
1 1 1 11  10  8  o 16 1.08230e+01 1.74264e+00 3.04216e+02 251.413 -6.20604e+00 -1.84544e+01 0.00000e+00 0.00000e+00 9.61593e+01 251.413 2.08057e+02 71.413  0.9740 
1 1 1 11  10  9  o 14 7.32846e+00 2.01187e+00 1.07584e+02 159.504 -4.27380e+00 1.59758e+00  0.00000e+00 0.00000e+00 1.37939e+02 159.504 3.03553e+01 159.504 0.8821 
1 1 1 11  10  10 o 17 8.50880e+00 1.99057e+00 1.82388e+02 308.460 5.95806e+00  -7.50107e+00 0.00000e+00 0.00000e+00 1.23361e+02 308.460 5.90269e+01 128.460 0.9463 
1 1 1 11  10  11 o 8  4.20975e+00 1.40055e+00 1.64085e+02 10.999  6.40058e+00  1.24399e+00  0.00000e+00 0.00000e+00 1.70829e+01 190.999 1.81167e+02 190.999 0.9198 
1 1 1 11  10  12 o 14 5.09184e+00 1.56033e+00 1.28044e+02 262.512 -8.61920e-01 -6.55799e+00 0.00000e+00 0.00000e+00 4.99456e+01 262.512 7.80988e+01 82.512  0.9210 
1 1 1 11  11  0  o 2  3.35581e+01 8.39732e-01 5.58363e+02 274.860 4.74264e+00  -5.57798e+01 0.00000e+00 0.00000e+00 7.02746e+02 274.860 1.44383e+02 274.860 0.9910 
1 1 1 11  11  1  o 16 2.48405e+01 7.82257e-01 4.94421e+02 150.182 -3.04627e+01 1.74589e+01  0.00000e+00 0.00000e+00 4.34406e+02 150.182 6.00153e+01 330.182 0.9857 
1 1 1 11  11  2  o 2  1.64777e+01 8.51226e-01 2.92037e+02 133.183 -1.04407e+01 1.11246e+01  0.00000e+00 0.00000e+00 3.12424e+02 133.183 2.03873e+01 133.183 0.9667 
1 1 1 11  11  3  o 9  8.39259e+00 1.63280e+00 5.53975e+01 102.741 -2.97838e-01 1.31721e+00  0.00000e+00 0.00000e+00 1.22033e+02 102.741 6.66357e+01 102.741 0.5569 
1 1 1 11  11  4  o 3  6.36142e+00 1.40871e+00 6.46961e+01 335.097 1.31408e+00  -6.10065e-01 0.00000e+00 0.00000e+00 7.61713e+01 335.097 1.14752e+01 335.097 0.5832 
1 1 1 11  11  5  o 13 1.45541e+01 1.23428e+00 1.76057e+02 249.315 -3.80756e+00 -1.00846e+01 0.00000e+00 0.00000e+00 3.50342e+02 249.315 1.74285e+02 249.315 0.9524 
1 1 1 11  11  6  o 14 2.36918e+01 1.21187e+00 4.00522e+02 149.922 -4.39621e+01 2.54618e+01  0.00000e+00 0.00000e+00 4.90377e+02 149.922 8.98548e+01 149.922 0.9901 
1 1 1 11  11  7  o 8  4.44810e+00 1.38302e+00 1.70748e+02 265.668 -3.29590e-01 -4.35056e+00 0.00000e+00 0.00000e+00 2.27259e+01 85.668  1.93474e+02 85.668  0.8762 
1 1 1 11  11  8  o 10 1.29014e+01 1.68930e+00 3.20826e+02 325.304 2.05314e+01  -1.42143e+01 0.00000e+00 0.00000e+00 1.59263e+02 325.304 1.61563e+02 145.304 0.9798 
1 1 1 11  11  9  f 0  6.68241e+00 2.01990e+00 2.37915e+02 140.117 -7.03191e+00 5.87611e+00  0.00000e+00 0.00000e+00 1.59200e+00 140.117 2.36323e+02 320.117 0.9438 
1 1 1 11  11  10 o 1  2.32372e+01 1.39342e+00 3.09204e+02 40.919  4.38878e+01  3.80419e+01  0.00000e+00 0.00000e+00 5.65539e+02 40.919  2.56335e+02 40.919  0.9914 
1 1 1 11  11  11 o 1  5.13843e+00 1.58204e+00 7.35215e+01 219.563 -2.50516e+00 -2.06976e+00 0.00000e+00 0.00000e+00 8.77838e+01 219.563 1.42624e+01 219.563 0.8269 
1 1 1 11  11  12 o 6  4.82285e+00 1.54595e+00 1.01179e+02 299.116 2.39189e+00  -4.29461e+00 0.00000e+00 0.00000e+00 6.19913e+01 299.116 3.91879e+01 119.116 0.8914 
1 1 1 11  12  0  o 2  1.89272e+01 7.84869e-01 2.82941e+02 286.332 4.51571e+00  -1.54106e+01 0.00000e+00 0.00000e+00 4.12038e+02 286.332 1.29096e+02 286.332 0.9683 
1 1 1 11  12  1  o 13 1.39268e+01 8.49933e-01 3.23100e+02 287.536 3.84767e+00  -1.21765e+01 0.00000e+00 0.00000e+00 1.84082e+02 287.536 1.39017e+02 107.536 0.9600 
1 1 1 11  12  2  o 14 2.58346e+01 8.10488e-01 4.80845e+02 306.647 2.28591e+01  -3.07268e+01 0.00000e+00 0.00000e+00 4.86640e+02 306.647 5.79506e+00 306.647 0.9869 
1 1 1 11  12  3  o 15 1.60787e+01 1.11867e+00 3.15173e+02 249.607 -5.55657e+00 -1.49471e+01 0.00000e+00 0.00000e+00 2.75699e+02 249.607 3.94745e+01 69.607  0.9681 
1 1 1 11  12  4  o 15 2.02749e+01 9.05906e-01 3.97679e+02 42.613  2.26261e+01  2.08151e+01  0.00000e+00 0.00000e+00 3.59486e+02 42.613  3.81928e+01 222.613 0.9836 
1 1 1 11  12  5  o 3  1.59305e+01 1.17687e+00 3.48832e+02 242.594 -1.08683e+01 -2.09614e+01 0.00000e+00 0.00000e+00 2.43160e+02 242.594 1.05672e+02 62.594  0.9786 
1 1 1 11  12  6  o 7  6.50405e+00 1.52593e+00 1.57160e+02 164.735 -4.85083e+00 1.32388e+00  0.00000e+00 0.00000e+00 6.36767e+01 164.735 9.34835e+01 344.735 0.8940 
1 1 1 11  12  7  o 6  7.29608e+00 1.68363e+00 2.42634e+02 359.288 9.23219e+00  -1.14747e-01 0.00000e+00 0.00000e+00 1.90040e+01 359.288 2.23630e+02 179.288 0.9442 
1 1 1 11  12  8  f 0  1.77534e+01 1.53323e+00 3.86354e+02 220.949 -3.31384e+01 -2.87546e+01 0.00000e+00 0.00000e+00 2.80181e+02 220.949 1.06173e+02 40.949  0.9885 
1 1 1 11  12  9  o 18 9.42985e+00 2.30710e+00 2.94149e+02 181.971 -1.40596e+01 -4.83952e-01 0.00000e+00 0.00000e+00 5.09907e+01 181.971 2.43158e+02 1.971   0.9638 
1 1 1 11  12  10 o 14 1.40923e+01 1.73624e+00 2.11236e+02 282.007 4.29583e+00  -2.01979e+01 0.00000e+00 0.00000e+00 3.10743e+02 282.007 9.95072e+01 282.007 0.9755 
1 1 1 11  12  11 o 4  6.22036e+00 1.63171e+00 1.57020e+02 199.248 -8.07590e+00 -2.81985e+00 0.00000e+00 0.00000e+00 6.48619e+01 199.248 9.21585e+01 19.248  0.9396 
1 1 1 11  12  12 o 12 5.26528e+00 1.67643e+00 8.99078e+01 32.340  3.72841e+00  2.36066e+00  0.00000e+00 0.00000e+00 8.54924e+01 32.340  4.41546e+00 212.340 0.8777 
1 1 1 11  13  0  o 1  1.37189e+01 8.25055e-01 1.97679e+02 157.968 -7.49954e+00 3.03485e+00  0.00000e+00 0.00000e+00 2.89210e+02 157.968 9.15311e+01 157.968 0.9360 
1 1 1 11  13  1  o 9  1.18804e+01 9.30080e-01 2.48582e+02 301.882 4.38660e+00  -7.05219e+00 0.00000e+00 0.00000e+00 1.74010e+02 301.882 7.45717e+01 121.882 0.9377 
1 1 1 11  13  2  o 13 2.22570e+01 8.27136e-01 5.00507e+02 314.189 2.38696e+01  -2.45548e+01 0.00000e+00 0.00000e+00 3.31646e+02 314.189 1.68861e+02 134.189 0.9853 
1 1 1 11  13  3  o 1  3.99756e+01 1.15105e+00 6.14311e+02 138.969 -5.79681e+01 5.04452e+01  0.00000e+00 0.00000e+00 8.93162e+02 138.969 2.78851e+02 138.969 0.9935 
1 1 1 11  13  4  o 13 1.41899e+01 1.01408e+00 1.26128e+02 285.372 1.95263e+00  -7.10264e+00 0.00000e+00 0.00000e+00 3.74582e+02 285.372 2.48455e+02 285.372 0.9294 
1 1 1 11  13  5  o 10 1.74075e+01 1.13132e+00 3.15007e+02 147.987 -1.98994e+01 1.24406e+01  0.00000e+00 0.00000e+00 3.31763e+02 147.987 1.67555e+01 147.987 0.9785 
1 1 1 11  13  6  o 17 6.98360e+00 1.64806e+00 6.76295e+01 212.269 -1.89407e+00 -1.19596e+00 0.00000e+00 0.00000e+00 1.26908e+02 212.269 5.92783e+01 212.269 0.7335 
1 1 1 11  13  7  o 3  1.83635e+01 1.42582e+00 3.05718e+02 96.104  -3.47885e+00 3.25284e+01  0.00000e+00 0.00000e+00 3.80957e+02 96.104  7.52389e+01 96.104  0.9846 
1 1 1 11  13  8  o 19 2.51304e+01 1.29651e+00 3.91842e+02 260.397 -1.09228e+01 -6.45595e+01 0.00000e+00 0.00000e+00 5.55246e+02 260.397 1.63404e+02 260.397 0.9923 
1 1 1 11  13  9  o 12 1.02609e+01 2.28999e+00 2.09186e+02 107.841 -3.38406e+00 1.05139e+01  0.00000e+00 0.00000e+00 1.62394e+02 107.841 4.67918e+01 287.841 0.9536 
1 1 1 11  13  10 o 18 2.25758e+01 1.45273e+00 4.41316e+02 357.303 7.83144e+01  -3.68854e+00 0.00000e+00 0.00000e+00 4.10402e+02 357.303 3.09135e+01 177.303 0.9936 
1 1 1 11  13  11 o 1  7.53610e+00 1.74668e+00 1.46545e+02 240.084 -4.52941e+00 -7.87175e+00 0.00000e+00 0.00000e+00 1.23300e+02 240.084 2.32451e+01 60.084  0.9432 
1 1 1 11  13  12 o 18 7.43421e+00 1.93753e+00 1.85707e+02 348.365 1.07996e+01  -2.22362e+00 0.00000e+00 0.00000e+00 8.33243e+01 348.365 1.02383e+02 168.365 0.9535 
1 1 1 11  14  0  o 3  1.61770e+01 7.83709e-01 1.04629e+02 166.743 -4.70839e+00 1.10927e+00  0.00000e+00 0.00000e+00 4.40946e+02 166.743 3.36317e+02 166.743 0.8895 
1 1 1 11  14  1  o 13 3.56464e+01 8.83373e-01 6.95811e+02 252.562 -2.09643e+01 -6.67426e+01 0.00000e+00 0.00000e+00 6.46623e+02 252.562 4.91881e+01 72.562  0.9928 
1 1 1 11  14  2  o 13 1.44791e+01 8.98549e-01 3.52776e+02 358.337 1.55623e+01  -4.51844e-01 0.00000e+00 0.00000e+00 1.78687e+02 358.337 1.74088e+02 178.337 0.9673 
1 1 1 11  14  3  o 1  2.16027e+01 8.55069e-01 3.88550e+02 348.482 2.88163e+01  -5.87238e+00 0.00000e+00 0.00000e+00 4.17344e+02 348.482 2.87941e+01 348.482 0.9828 
1 1 1 11  14  4  o 11 1.75265e+01 9.34395e-01 2.83388e+02 278.466 3.04224e+00  -2.04389e+01 0.00000e+00 0.00000e+00 3.65701e+02 278.466 8.23126e+01 278.466 0.9755 
1 1 1 11  14  5  o 5  1.13950e+01 1.39870e+00 1.88797e+02 117.899 -4.28760e+00 8.09822e+00  0.00000e+00 0.00000e+00 2.19547e+02 117.899 3.07495e+01 117.899 0.9437 
1 1 1 11  14  6  o 2  9.11781e+00 1.64664e+00 1.25864e+02 44.631  3.87122e+00  3.82174e+00  0.00000e+00 0.00000e+00 1.86689e+02 44.631  6.08246e+01 44.631  0.9027 
1 1 1 11  14  7  f 0  1.78058e+01 1.47644e+00 2.99157e+02 197.350 -2.91294e+01 -9.10051e+00 0.00000e+00 0.00000e+00 3.65883e+02 197.350 6.67262e+01 197.350 0.9835 
1 1 1 11  14  8  o 8  5.41517e+00 1.68608e+00 7.67413e+01 1.787   2.40647e+00  7.50902e-02  0.00000e+00 0.00000e+00 7.84349e+01 1.787   1.69354e+00 1.787   0.7546 
1 1 1 11  14  9  o 17 5.51494e+00 1.61401e+00 6.41967e+01 140.737 -1.89973e+00 1.55288e+00  0.00000e+00 0.00000e+00 9.49352e+01 140.737 3.07385e+01 140.737 0.7599 
1 1 1 11  14  10 o 17 4.35830e+00 1.45503e+00 2.01881e+01 320.991 5.71368e-01  -4.62840e-01 0.00000e+00 0.00000e+00 3.68780e+01 320.991 1.66899e+01 320.991 0.3449 
1 1 1 11  14  11 o 3  4.67393e+00 1.47565e+00 1.53937e+02 179.990 -6.84713e+00 1.21506e-03  0.00000e+00 0.00000e+00 9.96742e+00 179.990 1.43969e+02 359.990 0.9238 
1 1 1 11  14  12 o 6  5.30861e+00 1.68841e+00 1.57559e+02 174.715 -7.70447e+00 7.12651e-01  0.00000e+00 0.00000e+00 3.03985e+01 174.715 1.27161e+02 354.715 0.9329 
1 1 1 11  15  0  o 18 1.26230e+01 8.61016e-01 2.26174e+02 1.801   8.08568e+00  2.54289e-01  0.00000e+00 0.00000e+00 2.21785e+02 1.801   4.38870e+00 181.801 0.9360 
1 1 1 11  15  1  o 19 9.86754e+00 1.08274e+00 2.66617e+02 92.384  -3.38390e-01 8.12853e+00  0.00000e+00 0.00000e+00 8.38429e+01 92.384  1.82774e+02 272.384 0.9364 
1 1 1 11  15  2  o 1  2.72808e+01 8.26216e-01 4.40297e+02 291.513 1.39617e+01  -3.54202e+01 0.00000e+00 0.00000e+00 5.81150e+02 291.513 1.40853e+02 291.513 0.9868 
1 1 1 11  15  3  o 15 2.38929e+01 9.44674e-01 3.82318e+02 73.187  9.14405e+00  3.02624e+01  0.00000e+00 0.00000e+00 5.10069e+02 73.187  1.27750e+02 73.187  0.9841 
1 1 1 11  15  4  o 5  6.61172e+00 1.38628e+00 1.72100e+02 150.070 -3.78364e+00 2.17834e+00  0.00000e+00 0.00000e+00 4.78428e+01 150.070 1.24257e+02 330.070 0.8763 
1 1 1 11  15  5  o 19 1.71762e+01 1.20667e+00 3.16594e+02 36.783  1.93124e+01  1.44384e+01  0.00000e+00 0.00000e+00 3.21913e+02 36.783  5.31868e+00 36.783  0.9790 
1 1 1 11  15  6  o 1  2.01139e+01 1.22773e+00 3.74068e+02 286.946 1.12579e+01  -3.69470e+01 0.00000e+00 0.00000e+00 3.79781e+02 286.946 5.71255e+00 286.946 0.9870 
1 1 1 11  15  7  o 14 1.76189e+01 1.58447e+00 3.19191e+02 38.568  2.42960e+01  1.93731e+01  0.00000e+00 0.00000e+00 3.39043e+02 38.568  1.98513e+01 38.568  0.9838 
1 1 1 11  15  8  o 17 1.55020e+01 1.75814e+00 3.44042e+02 127.721 -1.83856e+01 2.37702e+01  0.00000e+00 0.00000e+00 2.34767e+02 127.721 1.09274e+02 307.721 0.9832 
1 1 1 11  15  9  o 6  1.16369e+01 1.74723e+00 2.52472e+02 339.366 1.79867e+01  -6.77310e+00 0.00000e+00 0.00000e+00 1.77753e+02 339.366 7.47184e+01 159.366 0.9736 
1 1 1 11  15  10 o 8  1.57209e+01 1.60895e+00 2.08139e+02 261.053 -3.95460e+00 -2.51174e+01 0.00000e+00 0.00000e+00 3.76877e+02 261.053 1.68738e+02 261.053 0.9801 
1 1 1 11  15  11 o 13 5.63382e+00 1.56838e+00 1.66420e+02 112.590 -3.27495e+00 7.87137e+00  0.00000e+00 0.00000e+00 3.44727e+01 112.590 1.31947e+02 292.590 0.9394 
1 1 1 11  15  12 o 16 6.77499e+00 1.84971e+00 1.02584e+02 289.225 1.93145e+00  -5.53862e+00 0.00000e+00 0.00000e+00 1.31441e+02 289.225 2.88576e+01 289.225 0.9102 
1 1 1 11  16  0  o 19 2.07381e+01 7.75122e-01 3.89244e+02 315.550 1.64219e+01  -1.61098e+01 0.00000e+00 0.00000e+00 3.79716e+02 315.550 9.52804e+00 135.550 0.9780 
1 1 1 11  16  1  f 0  3.08120e+01 1.00873e+00 5.84967e+02 27.934  4.96110e+01  2.63055e+01  0.00000e+00 0.00000e+00 5.73242e+02 27.934  1.17255e+01 207.934 0.9911 
1 1 1 11  16  2  o 8  1.84367e+01 8.35617e-01 3.13288e+02 246.563 -7.26136e+00 -1.67506e+01 0.00000e+00 0.00000e+00 3.66803e+02 246.563 5.35152e+01 246.563 0.9722 
1 1 1 11  16  3  o 2  2.10795e+01 1.14885e+00 2.51191e+02 320.077 1.36470e+01  -1.14199e+01 0.00000e+00 0.00000e+00 5.26026e+02 320.077 2.74835e+02 320.077 0.9715 
1 1 1 11  16  4  o 1  2.73172e+01 8.66668e-01 4.57833e+02 129.217 -3.30851e+01 4.05411e+01  0.00000e+00 0.00000e+00 5.69220e+02 129.217 1.11387e+02 129.217 0.9904 
1 1 1 11  16  5  o 11 7.08393e+00 1.68365e+00 1.88615e+02 87.981  1.86854e-01  5.30007e+00  0.00000e+00 0.00000e+00 5.34455e+01 87.981  1.35170e+02 267.981 0.9000 
1 1 1 11  16  6  o 10 9.50468e+00 1.75746e+00 3.06023e+02 108.628 -4.12724e+00 1.22439e+01  0.00000e+00 0.00000e+00 4.06307e+01 108.628 2.65393e+02 288.628 0.9605 
1 1 1 11  16  7  o 2  6.50271e+00 2.34308e+00 1.07279e+02 63.690  1.34392e+00  2.71802e+00  0.00000e+00 0.00000e+00 9.33134e+01 63.690  1.39657e+01 243.690 0.8123 
1 1 1 11  16  8  o 15 9.28579e+00 2.27019e+00 8.13008e+01 260.883 -5.80590e-01 -3.61779e+00 0.00000e+00 0.00000e+00 2.18152e+02 260.883 1.36851e+02 260.883 0.8492 
1 1 1 11  16  9  f 0  5.51507e+00 1.61391e+00 1.19936e+02 237.327 -2.47674e+00 -3.86187e+00 0.00000e+00 0.00000e+00 6.49436e+01 237.327 5.49923e+01 57.327  0.8829 
1 1 1 11  16  10 o 3  6.68463e+00 1.78496e+00 8.06423e+01 349.566 3.78382e+00  -6.96773e-01 0.00000e+00 0.00000e+00 1.36950e+02 349.566 5.63075e+01 349.566 0.8574 
1 1 1 11  16  11 o 18 6.93226e+00 1.79043e+00 1.71935e+02 55.795  5.39615e+00  7.93859e+00  0.00000e+00 0.00000e+00 7.70906e+01 55.795  9.48441e+01 235.795 0.9464 
1 1 1 11  16  12 o 2  6.79507e+00 1.88432e+00 1.07456e+02 125.560 -3.50985e+00 4.90970e+00  0.00000e+00 0.00000e+00 1.27945e+02 125.560 2.04896e+01 125.560 0.9129 
1 1 1 11  17  0  o 3  2.99517e+01 8.11605e-01 5.14439e+02 31.606  4.18581e+01  2.57575e+01  0.00000e+00 0.00000e+00 6.09460e+02 31.606  9.50209e+01 31.606  0.9898 
1 1 1 11  17  1  o 4  4.44960e+00 1.22705e+00 1.76305e+02 31.919  1.95468e+00  1.21759e+00  0.00000e+00 0.00000e+00 5.11283e+01 211.919 2.27434e+02 211.919 0.7417 
1 1 1 11  17  2  o 10 1.10854e+01 1.08125e+00 2.70307e+02 354.505 9.15144e+00  -8.80336e-01 0.00000e+00 0.00000e+00 1.26700e+02 354.505 1.43608e+02 174.505 0.9439 
1 1 1 11  17  3  o 12 1.79363e+01 9.63323e-01 3.79945e+02 346.966 2.23022e+01  -5.16298e+00 0.00000e+00 0.00000e+00 2.85726e+02 346.966 9.42186e+01 166.966 0.9779 
1 1 1 11  17  4  o 13 2.80061e+01 8.66758e-01 4.09559e+02 66.325  1.92381e+01  4.38773e+01  0.00000e+00 0.00000e+00 6.42403e+02 66.325  2.32844e+02 66.325  0.9895 
1 1 1 11  17  5  o 18 1.83089e+01 1.27812e+00 3.77339e+02 333.118 2.63549e+01  -1.33604e+01 0.00000e+00 0.00000e+00 3.05919e+02 333.118 7.14201e+01 153.118 0.9829 
1 1 1 11  17  6  o 14 1.02329e+01 1.70864e+00 2.65189e+02 117.843 -5.75058e+00 1.08873e+01  0.00000e+00 0.00000e+00 1.07231e+02 117.843 1.57958e+02 297.843 0.9585 
1 1 1 11  17  7  o 8  1.29977e+01 1.68680e+00 2.58924e+02 306.605 1.11456e+01  -1.50050e+01 0.00000e+00 0.00000e+00 2.21240e+02 306.605 3.76838e+01 126.605 0.9729 
1 1 1 11  17  8  o 8  9.51697e+00 2.18032e+00 7.42271e+01 14.302  3.44676e+00  8.78719e-01  0.00000e+00 0.00000e+00 2.30784e+02 14.302  1.56557e+02 14.302  0.8440 
1 1 1 11  17  9  f 0  8.20002e+00 1.79538e+00 1.74121e+02 59.062  4.70427e+00  7.84839e+00  0.00000e+00 0.00000e+00 1.19685e+02 59.062  5.44359e+01 239.062 0.9437 
1 1 1 11  17  10 o 5  2.17691e+01 1.38373e+00 4.30066e+02 277.268 1.05982e+01  -8.31014e+01 0.00000e+00 0.00000e+00 3.91420e+02 277.268 3.86463e+01 97.268  0.9940 
1 1 1 11  17  11 o 5  1.00007e+01 1.95592e+00 2.42675e+02 137.597 -1.31791e+01 1.20355e+01  0.00000e+00 0.00000e+00 1.26123e+02 137.597 1.16552e+02 317.597 0.9716 
1 1 1 11  17  12 f 0  6.94108e+00 1.66321e+00 7.01367e+01 261.086 -7.10655e-01 -4.53078e+00 0.00000e+00 0.00000e+00 1.62385e+02 261.086 9.22486e+01 261.086 0.8828 
1 1 1 11  18  0  o 8  2.95723e+01 8.12599e-01 4.81667e+02 356.600 4.52624e+01  -2.68885e+00 0.00000e+00 0.00000e+00 6.26976e+02 356.600 1.45309e+02 356.600 0.9889 
1 1 1 11  18  1  f 0  2.13113e+01 8.53633e-01 1.78716e+02 295.270 4.97973e+00  -1.05489e+01 0.00000e+00 0.00000e+00 5.94059e+02 295.270 4.15343e+02 295.270 0.9561 
1 1 1 11  18  2  o 8  3.34896e+01 8.47574e-01 6.68440e+02 249.709 -2.52542e+01 -6.83028e+01 0.00000e+00 0.00000e+00 5.93352e+02 249.709 7.50884e+01 69.709  0.9931 
1 1 1 11  18  3  o 8  2.70204e+01 9.38205e-01 4.46327e+02 3.660   4.04908e+01  2.58983e+00  0.00000e+00 0.00000e+00 5.66371e+02 3.660   1.20044e+02 3.660   0.9876 
1 1 1 11  18  4  o 19 1.74706e+01 9.28439e-01 3.07814e+02 53.102  1.33451e+01  1.77751e+01  0.00000e+00 0.00000e+00 3.40245e+02 53.102  3.24312e+01 53.102  0.9772 
1 1 1 11  18  5  o 6  3.40868e+01 1.33028e+00 5.92467e+02 66.758  3.36526e+01  7.83584e+01  0.00000e+00 0.00000e+00 6.94018e+02 66.758  1.01551e+02 66.758  0.9941 
1 1 1 11  18  6  o 12 2.18740e+01 1.20426e+00 3.01624e+02 293.915 1.38773e+01  -3.12937e+01 0.00000e+00 0.00000e+00 5.16684e+02 293.915 2.15061e+02 293.915 0.9853 
1 1 1 11  18  7  o 9  1.71597e+01 1.53371e+00 3.28454e+02 101.478 -6.56271e+00 3.23206e+01  0.00000e+00 0.00000e+00 3.13154e+02 101.478 1.53007e+01 281.478 0.9847 
1 1 1 11  18  8  o 15 2.44660e+01 1.68410e+00 4.42049e+02 215.269 -5.49783e+01 -3.88817e+01 0.00000e+00 0.00000e+00 4.79998e+02 215.269 3.79486e+01 215.269 0.9925 
1 1 1 11  18  9  o 16 4.31628e+00 1.40953e+00 1.10619e+02 1.515   3.89626e+00  1.03038e-01  0.00000e+00 0.00000e+00 3.02270e+01 1.515   8.03924e+01 181.515 0.8595 
1 1 1 11  18  10 o 4  4.55273e+00 1.48735e+00 4.09904e+01 255.899 -3.86963e-01 -1.54048e+00 0.00000e+00 0.00000e+00 6.56844e+01 255.899 2.46940e+01 255.899 0.6172 
1 1 1 11  18  11 o 19 7.12068e+00 1.74788e+00 1.00088e+02 66.131  2.42993e+00  5.49144e+00  0.00000e+00 0.00000e+00 1.46508e+02 66.131  4.64197e+01 66.131  0.9124 
1 1 1 11  18  12 o 1  1.28975e+01 1.84470e+00 1.72430e+02 91.315  -4.30077e-01 1.87313e+01  0.00000e+00 0.00000e+00 3.03716e+02 91.315  1.31286e+02 91.315  0.9729 
1 1 1 11  19  0  o 3  1.71158e+01 9.97732e-01 1.23362e+02 97.535  -8.62206e-01 6.51819e+00  0.00000e+00 0.00000e+00 4.73849e+02 97.535  3.50487e+02 97.535  0.9205 
1 1 1 11  19  1  o 14 1.88338e+01 8.80265e-01 4.41296e+02 10.643  2.49050e+01  4.68032e+00  0.00000e+00 0.00000e+00 2.58707e+02 10.643  1.82589e+02 190.643 0.9801 
1 1 1 11  19  2  o 18 2.06208e+01 7.94516e-01 3.50601e+02 271.029 4.23878e-01  -2.35966e+01 0.00000e+00 0.00000e+00 4.14924e+02 271.029 6.43229e+01 271.029 0.9786 
1 1 1 11  19  3  o 9  8.04440e+00 1.45252e+00 1.56291e+02 53.072  2.63928e+00  3.51168e+00  0.00000e+00 0.00000e+00 1.11457e+02 53.072  4.48340e+01 233.072 0.8771 
1 1 1 11  19  4  o 11 2.63579e+01 8.80211e-01 4.70137e+02 206.038 -4.77410e+01 -2.33240e+01 0.00000e+00 0.00000e+00 5.20854e+02 206.038 5.07168e+01 206.038 0.9905 
1 1 1 11  19  5  o 17 3.55479e+01 1.28023e+00 5.87285e+02 309.878 6.09374e+01  -7.29364e+01 0.00000e+00 0.00000e+00 7.55093e+02 309.878 1.67808e+02 309.878 0.9947 
1 1 1 11  19  6  o 13 1.58310e+01 1.37761e+00 3.13816e+02 203.867 -2.25499e+01 -9.97716e+00 0.00000e+00 0.00000e+00 2.74922e+02 203.867 3.88940e+01 23.867  0.9795 
1 1 1 11  19  7  o 4  4.79398e+00 2.04514e+00 1.54765e+02 57.916  1.92454e+00  3.06994e+00  0.00000e+00 0.00000e+00 5.40420e-01 237.916 1.55306e+02 237.916 0.8473 
1 1 1 11  19  8  o 3  6.37095e+00 1.86829e+00 1.35268e+02 33.440  4.15215e+00  2.74202e+00  0.00000e+00 0.00000e+00 8.06985e+01 33.440  5.45695e+01 213.440 0.8928 
1 1 1 11  19  9  o 2  9.29154e+00 1.81344e+00 1.92433e+02 14.814  1.17327e+01  3.10292e+00  0.00000e+00 0.00000e+00 1.45460e+02 14.814  4.69735e+01 194.814 0.9579 
1 1 1 11  19  10 o 17 2.74797e+01 1.38406e+00 4.87722e+02 177.543 -1.24683e+02 5.35066e+00  0.00000e+00 0.00000e+00 5.51217e+02 177.543 6.34949e+01 177.543 0.9960 
1 1 1 11  19  11 o 18 4.02589e+00 1.33562e+00 9.02230e+01 59.141  1.96928e+00  3.29574e+00  0.00000e+00 0.00000e+00 4.07267e+01 59.141  4.94963e+01 239.141 0.8570 
1 1 1 11  19  12 o 1  6.34074e+00 1.82124e+00 1.09105e+02 117.537 -2.73100e+00 5.23797e+00  0.00000e+00 0.00000e+00 1.10041e+02 117.537 9.35170e-01 117.537 0.9109 
1 1 1 11  20  0  o 14 9.38700e+00 1.04317e+00 3.23036e+02 71.696  2.85639e+00  8.63504e+00  0.00000e+00 0.00000e+00 1.26122e+01 71.696  3.10424e+02 251.696 0.9433 
1 1 1 11  20  1  o 8  2.28304e+01 8.69806e-01 3.26814e+02 229.165 -1.53592e+01 -1.77718e+01 0.00000e+00 0.00000e+00 5.20307e+02 229.165 1.93493e+02 229.165 0.9785 
1 1 1 11  20  2  o 8  2.90498e+01 1.06691e+00 4.94222e+02 147.978 -4.15106e+01 2.59606e+01  0.00000e+00 0.00000e+00 5.96458e+02 147.978 1.02236e+02 147.978 0.9897 
1 1 1 11  20  3  o 11 1.79461e+01 8.74484e-01 3.06524e+02 306.204 1.24414e+01  -1.69965e+01 0.00000e+00 0.00000e+00 3.58084e+02 306.204 5.15597e+01 306.204 0.9760 
1 1 1 11  20  4  o 8  6.58606e+00 1.62613e+00 1.00784e+02 298.801 1.18836e+00  -2.16149e+00 0.00000e+00 0.00000e+00 8.95223e+01 298.801 1.12617e+01 118.801 0.7613 
1 1 1 11  20  5  o 1  3.14727e+01 1.62831e+00 4.23315e+02 349.747 5.47777e+01  -9.90815e+00 0.00000e+00 0.00000e+00 7.60630e+02 349.747 3.37315e+02 349.747 0.9910 
1 1 1 11  20  6  o 13 5.30825e+00 1.56733e+00 1.41867e+02 39.255  2.89610e+00  2.36660e+00  0.00000e+00 0.00000e+00 2.99799e+01 39.255  1.11887e+02 219.255 0.8527 
1 1 1 11  20  7  o 8  1.93134e+01 1.48421e+00 4.00838e+02 34.422  3.81565e+01  2.61477e+01  0.00000e+00 0.00000e+00 3.24456e+02 34.422  7.63821e+01 214.422 0.9891 
1 1 1 11  20  8  f 0  6.91841e+00 1.99732e+00 1.33449e+02 90.442  -4.02428e-02 5.21885e+00  0.00000e+00 0.00000e+00 1.02482e+02 90.442  3.09665e+01 270.442 0.8982 
1 1 1 11  20  9  o 11 2.34246e+01 1.26843e+00 3.54526e+02 142.262 -5.68267e+01 4.39807e+01  0.00000e+00 0.00000e+00 5.28534e+02 142.262 1.74008e+02 142.262 0.9930 
1 1 1 11  20  10 o 6  5.12075e+00 1.59959e+00 1.99544e+02 325.013 6.99563e+00  -4.89602e+00 0.00000e+00 0.00000e+00 1.69348e+01 145.013 2.16478e+02 145.013 0.9395 
1 1 1 11  20  11 o 1  7.40629e+00 1.75196e+00 1.17108e+02 356.869 7.05643e+00  -3.85954e-01 0.00000e+00 0.00000e+00 1.43241e+02 356.869 2.61333e+01 356.869 0.9263 
1 1 1 11  20  12 f 0  5.97208e+00 1.72463e+00 7.19406e+01 184.613 -3.88494e+00 -3.13477e-01 0.00000e+00 0.00000e+00 1.22800e+02 184.613 5.08596e+01 184.613 0.8595 
1 1 1 11  21  0  o 19 2.07054e+01 7.51704e-01 4.31744e+02 304.837 1.57535e+01  -2.26349e+01 0.00000e+00 0.00000e+00 3.38699e+02 304.837 9.30450e+01 124.837 0.9817 
1 1 1 11  21  1  o 14 1.75687e+01 8.69371e-01 4.53372e+02 281.495 4.98519e+00  -2.45142e+01 0.00000e+00 0.00000e+00 1.99364e+02 281.495 2.54009e+02 101.495 0.9798 
1 1 1 11  21  2  o 1  3.61596e+01 8.79041e-01 6.51518e+02 148.046 -6.96554e+01 4.34475e+01  0.00000e+00 0.00000e+00 7.11725e+02 148.046 6.02079e+01 148.046 0.9939 
1 1 1 11  21  3  o 2  2.54810e+01 8.46558e-01 4.68457e+02 304.193 2.82812e+01  -4.16259e+01 0.00000e+00 0.00000e+00 4.88728e+02 304.193 2.02714e+01 304.193 0.9900 
1 1 1 11  21  4  o 13 2.98742e+01 1.01658e+00 4.65297e+02 30.693  5.23447e+01  3.10713e+01  0.00000e+00 0.00000e+00 6.59142e+02 30.693  1.93845e+02 30.693  0.9918 
1 1 1 11  21  5  o 16 1.86262e+01 1.22848e+00 2.35022e+02 198.387 -2.03594e+01 -6.76775e+00 0.00000e+00 0.00000e+00 4.55323e+02 198.387 2.20301e+02 198.387 0.9764 
1 1 1 11  21  6  o 16 8.32260e+00 1.55950e+00 2.69092e+02 130.162 -7.17879e+00 8.50647e+00  0.00000e+00 0.00000e+00 3.23114e+01 130.162 2.36780e+02 310.162 0.9540 
1 1 1 11  21  7  o 12 1.09530e+01 2.05887e+00 2.06475e+02 343.452 1.03943e+01  -3.08833e+00 0.00000e+00 0.00000e+00 1.89685e+02 343.452 1.67903e+01 163.452 0.9527 
1 1 1 11  21  8  o 6  1.73049e+01 1.83267e+00 3.73679e+02 103.589 -9.20093e+00 3.80652e+01  0.00000e+00 0.00000e+00 2.74839e+02 103.589 9.88398e+01 283.589 0.9871 
1 1 1 11  21  9  o 14 4.72488e+00 1.48512e+00 6.54478e+01 185.626 -2.39507e+00 -2.35932e-01 0.00000e+00 0.00000e+00 6.98712e+01 185.626 4.42337e+00 185.626 0.7545 
1 1 1 11  21  10 o 1  5.33334e+00 1.65874e+00 8.40954e+01 282.549 8.12999e-01  -3.65226e+00 0.00000e+00 0.00000e+00 8.85372e+01 282.549 4.44178e+00 282.549 0.8528 
1 1 1 11  21  11 o 19 7.89794e+00 1.84001e+00 1.78386e+02 181.917 -1.09314e+01 -3.65802e-01 0.00000e+00 0.00000e+00 1.07278e+02 181.917 7.11076e+01 1.917   0.9531 
1 1 1 11  21  12 o 2  5.17323e+00 1.55789e+00 1.65973e+02 115.789 -3.73887e+00 7.73785e+00  0.00000e+00 0.00000e+00 1.84912e+01 115.789 1.47482e+02 295.789 0.9399 
1 1 1 11  22  0  f 0  2.26778e+01 7.46428e-01 2.15823e+02 55.702  8.78060e+00  1.28731e+01  0.00000e+00 0.00000e+00 6.15640e+02 55.702  3.99817e+02 55.702  0.9674 
1 1 1 11  22  1  o 1  2.35440e+01 8.53898e-01 4.70952e+02 184.427 -3.58904e+01 -2.77885e+00 0.00000e+00 0.00000e+00 4.09276e+02 184.427 6.16765e+01 4.427   0.9860 
1 1 1 11  22  2  o 13 7.94951e+00 1.29969e+00 9.52233e+01 159.242 -2.26780e+00 8.59568e-01  0.00000e+00 0.00000e+00 1.32916e+02 159.242 3.76926e+01 159.242 0.7566 
1 1 1 11  22  3  o 12 5.83387e+00 1.42147e+00 1.15740e+02 192.519 -2.51134e+00 -5.57605e-01 0.00000e+00 0.00000e+00 5.52840e+01 192.519 6.04555e+01 12.519  0.7727 
1 1 1 11  22  4  o 10 1.81132e+01 1.12618e+00 3.90939e+02 139.318 -2.30150e+01 1.97831e+01  0.00000e+00 0.00000e+00 2.85036e+02 139.318 1.05903e+02 319.318 0.9834 
1 1 1 11  22  5  o 3  9.54641e+00 1.64969e+00 1.41507e+02 265.948 -4.19729e-01 -5.92492e+00 0.00000e+00 0.00000e+00 1.88741e+02 265.948 4.72345e+01 265.948 0.9114 
1 1 1 11  22  6  o 10 4.08708e+00 1.83112e+00 1.43184e+02 266.106 -1.84566e-01 -2.71125e+00 0.00000e+00 0.00000e+00 2.11264e+01 86.106  1.64311e+02 86.106  0.7867 
1 1 1 11  22  7  o 19 2.37715e+01 1.42561e+00 4.52335e+02 190.481 -6.33324e+01 -1.17164e+01 0.00000e+00 0.00000e+00 4.43051e+02 190.481 9.28470e+00 10.481  0.9922 
1 1 1 11  22  8  o 13 5.36682e+00 1.50640e+00 9.45556e+01 246.410 -1.40514e+00 -3.21774e+00 0.00000e+00 0.00000e+00 7.69234e+01 246.410 1.76323e+01 66.410  0.8417 
1 1 1 11  22  9  o 1  1.55871e+01 1.45415e+00 2.05892e+02 357.900 2.52735e+01  -9.26881e-01 0.00000e+00 0.00000e+00 3.73957e+02 357.900 1.68066e+02 357.900 0.9800 
1 1 1 11  22  10 o 1  9.04002e+00 1.81363e+00 1.98523e+02 12.811  1.34452e+01  3.05732e+00  0.00000e+00 0.00000e+00 1.31891e+02 12.811  6.66316e+01 192.811 0.9630 
1 1 1 11  22  11 o 8  6.50182e+00 1.61458e+00 9.82070e+01 312.693 3.88501e+00  -4.21111e+00 0.00000e+00 0.00000e+00 1.25798e+02 312.693 2.75909e+01 312.693 0.9079 
1 1 1 11  22  12 o 11 5.21482e+00 1.60760e+00 1.57982e+02 84.855  7.18549e-01  7.98004e+00  0.00000e+00 0.00000e+00 2.70566e+01 84.855  1.30925e+02 264.855 0.9353 
1 1 1 11  23  0  o 2  2.26130e+01 7.42718e-01 3.50962e+02 184.636 -2.51254e+01 -2.03761e+00 0.00000e+00 0.00000e+00 4.88873e+02 184.636 1.37911e+02 184.636 0.9800 
1 1 1 11  23  1  o 15 2.63024e+01 7.99366e-01 5.43968e+02 359.210 4.65970e+01  -6.42208e-01 0.00000e+00 0.00000e+00 4.42515e+02 359.210 1.01453e+02 179.210 0.9892 
1 1 1 11  23  2  o 12 4.15985e+01 9.43490e-01 8.23426e+02 166.353 -1.11867e+02 2.71610e+01  0.00000e+00 0.00000e+00 7.47451e+02 166.353 7.59755e+01 346.353 0.9956 
1 1 1 11  23  3  o 5  2.15434e+01 8.54643e-01 3.88159e+02 176.498 -3.49567e+01 2.13946e+00  0.00000e+00 0.00000e+00 4.17419e+02 176.498 2.92595e+01 176.498 0.9856 
1 1 1 11  23  4  o 14 2.20832e+01 1.17553e+00 3.86964e+02 300.326 1.92648e+01  -3.29327e+01 0.00000e+00 0.00000e+00 4.39985e+02 300.326 5.30214e+01 300.326 0.9868 
1 1 1 11  23  5  o 9  1.67499e+01 1.26490e+00 1.76200e+02 13.873  1.51246e+01  3.73547e+00  0.00000e+00 0.00000e+00 4.38771e+02 13.873  2.62571e+02 13.873  0.9674 
1 1 1 11  23  6  o 18 5.47940e+00 2.12831e+00 6.64258e+01 257.097 -3.41504e-01 -1.49071e+00 0.00000e+00 0.00000e+00 5.90529e+01 257.097 7.37285e+00 77.097  0.6033 
1 1 1 11  23  7  o 14 9.54437e+00 2.06145e+00 9.53122e+01 311.065 2.96169e+00  -3.39923e+00 0.00000e+00 0.00000e+00 2.23724e+02 311.065 1.28412e+02 311.065 0.8806 
1 1 1 11  23  8  o 1  2.72388e+01 1.19915e+00 4.01616e+02 78.774  1.65219e+01  8.32411e+01  0.00000e+00 0.00000e+00 6.26240e+02 78.774  2.24625e+02 78.774  0.9941 
1 1 1 11  23  9  o 12 5.91492e+00 1.58952e+00 1.35895e+02 303.783 3.42605e+00  -5.12104e+00 0.00000e+00 0.00000e+00 6.94852e+01 303.783 6.64096e+01 123.783 0.9148 
1 1 1 11  23  10 o 6  2.35932e+01 1.42356e+00 4.15138e+02 135.806 -6.60334e+01 6.42011e+01  0.00000e+00 0.00000e+00 4.75379e+02 135.806 6.02410e+01 135.806 0.9946 
1 1 1 11  23  11 o 3  7.56717e+00 1.86460e+00 1.93971e+02 308.760 7.17757e+00  -8.93973e+00 0.00000e+00 0.00000e+00 8.03320e+01 308.760 1.13639e+02 128.760 0.9553 
1 1 1 11  23  12 o 1  6.84104e+00 1.78257e+00 1.30255e+02 172.929 -7.74596e+00 9.60866e-01  0.00000e+00 0.00000e+00 1.12008e+02 172.929 1.82464e+01 352.929 0.9336 
1 1 1 11  24  0  o 14 1.91609e+01 7.64266e-01 4.13471e+02 253.218 -7.48494e+00 -2.48196e+01 0.00000e+00 0.00000e+00 2.98514e+02 253.218 1.14957e+02 73.218  0.9805 
1 1 1 11  24  1  o 4  9.50226e+00 1.13851e+00 2.15692e+02 161.990 -6.56510e+00 2.13434e+00  0.00000e+00 0.00000e+00 1.17337e+02 161.990 9.83556e+01 341.990 0.9244 
1 1 1 11  24  2  o 15 2.05872e+01 8.13997e-01 3.17682e+02 110.762 -8.95208e+00 2.36140e+01  0.00000e+00 0.00000e+00 4.47478e+02 110.762 1.29797e+02 110.762 0.9800 
1 1 1 11  24  3  o 17 2.99935e+01 1.02940e+00 4.47016e+02 226.248 -3.77532e+01 -3.94347e+01 0.00000e+00 0.00000e+00 6.80362e+02 226.248 2.33347e+02 226.248 0.9908 
1 1 1 11  24  4  o 11 2.96797e+01 1.20719e+00 5.71057e+02 339.025 7.00915e+01  -2.68705e+01 0.00000e+00 0.00000e+00 5.47616e+02 339.025 2.34406e+01 159.025 0.9933 
1 1 1 11  24  5  o 15 3.87742e+00 1.25914e+00 1.16611e+02 331.794 2.10235e+00  -1.12754e+00 0.00000e+00 0.00000e+00 5.95708e+00 151.794 1.22568e+02 151.794 0.7520 
1 1 1 11  24  7  o 6  1.57826e+01 1.60217e+00 3.57076e+02 140.948 -2.57345e+01 2.08784e+01  0.00000e+00 0.00000e+00 2.32882e+02 140.948 1.24194e+02 320.948 0.9848 
1 1 1 11  24  8  f 0  1.51167e+01 1.29318e+00 3.97082e+02 38.896  3.50251e+01  2.82576e+01  0.00000e+00 0.00000e+00 1.70289e+02 38.896  2.26792e+02 218.896 0.9888 
1 1 1 11  24  9  o 18 8.12970e+00 1.61518e+00 1.52368e+02 215.698 -7.43525e+00 -5.34246e+00 0.00000e+00 0.00000e+00 1.38814e+02 215.698 1.35536e+01 35.698  0.9437 
1 1 1 11  24  10 o 8  4.24725e+00 1.35255e+00 1.31734e+02 320.359 4.19623e+00  -3.47648e+00 0.00000e+00 0.00000e+00 1.37864e+01 320.359 1.17947e+02 140.359 0.9029 
1 1 1 11  24  11 f 0  4.68160e+00 1.51137e+00 6.41570e+01 15.105  2.85933e+00  7.71785e-01  0.00000e+00 0.00000e+00 7.92065e+01 15.105  1.50495e+01 15.105  0.8071 
1 1 1 11  24  12 o 13 6.90942e+00 1.81742e+00 1.83188e+02 247.707 -4.21717e+00 -1.02864e+01 0.00000e+00 0.00000e+00 6.68151e+01 247.707 1.16373e+02 67.708  0.9539 
1 1 1 11  25  0  o 12 2.54204e+01 7.72502e-01 4.22230e+02 317.878 2.81040e+01  -2.54135e+01 0.00000e+00 0.00000e+00 5.28250e+02 317.878 1.06020e+02 317.878 0.9867 
1 1 1 11  25  1  o 9  3.01553e+00 1.01350e+00 4.79775e+01 29.421  4.20511e-01  2.37146e-01  0.00000e+00 0.00000e+00 2.11569e+01 209.421 6.91344e+01 209.421 0.2346 
1 1 1 11  25  2  o 8  1.22620e+01 1.04318e+00 1.99946e+02 276.570 1.04810e+00  -9.10024e+00 0.00000e+00 0.00000e+00 2.38896e+02 276.570 3.89493e+01 276.570 0.9437 
1 1 1 11  25  3  o 17 3.29027e+01 8.86200e-01 3.84382e+02 93.693  -3.48941e+00 5.40569e+01  0.00000e+00 0.00000e+00 8.52170e+02 93.693  4.67789e+02 93.693  0.9907 
1 1 1 11  25  4  o 7  1.01271e+01 2.55940e+00 2.34663e+02 224.021 -5.22234e+00 -5.04682e+00 0.00000e+00 0.00000e+00 1.22055e+02 224.021 1.12608e+02 44.021  0.9284 
1 1 1 11  25  5  o 8  1.54211e+01 1.28078e+00 2.98436e+02 272.704 1.09980e+00  -2.32836e+01 0.00000e+00 0.00000e+00 2.74087e+02 272.704 2.43488e+01 92.704  0.9783 
1 1 1 11  25  6  o 13 8.90917e+00 2.15299e+00 2.22928e+02 356.842 8.97190e+00  -4.94985e-01 0.00000e+00 0.00000e+00 9.57920e+01 356.842 1.27136e+02 176.842 0.9426 
1 1 1 11  25  7  o 11 4.87399e+00 1.57400e+00 2.42182e+01 109.873 -2.53107e-01 7.00221e-01  0.00000e+00 0.00000e+00 4.02808e+01 109.873 1.60626e+01 109.873 0.3487 
1 1 1 11  25  8  o 14 9.66706e+00 1.64763e+00 1.48673e+02 117.414 -4.31612e+00 8.32174e+00  0.00000e+00 0.00000e+00 1.98073e+02 117.414 4.94000e+01 117.414 0.9451 
1 1 1 11  25  9  o 14 1.34903e+01 1.57785e+00 2.98883e+02 278.718 4.58923e+00  -2.99276e+01 0.00000e+00 0.00000e+00 2.04566e+02 278.718 9.43172e+01 98.718  0.9833 
1 1 1 11  25  10 o 4  5.95090e+00 1.69160e+00 1.00798e+02 105.467 -1.26112e+00 4.55779e+00  0.00000e+00 0.00000e+00 9.94306e+01 105.467 1.36693e+00 285.467 0.8867 
1 1 1 11  25  11 o 15 7.62666e+00 1.90580e+00 1.49953e+02 145.318 -7.40236e+00 5.12218e+00  0.00000e+00 0.00000e+00 1.22813e+02 145.318 2.71402e+01 325.318 0.9427 
1 1 1 11  25  12 o 6  5.42991e+00 1.66249e+00 1.09490e+02 354.413 5.70618e+00  -5.58165e-01 0.00000e+00 0.00000e+00 7.75145e+01 354.413 3.19750e+01 174.413 0.9080 
1 1 1 11  26  0  o 4  2.50368e+01 7.78675e-01 5.43505e+02 78.388  9.63470e+00  4.68881e+01  0.00000e+00 0.00000e+00 3.95206e+02 78.388  1.48299e+02 258.388 0.9895 
1 1 1 11  26  1  o 14 2.72262e+01 7.89280e-01 3.76024e+02 335.067 3.17196e+01  -1.47458e+01 0.00000e+00 0.00000e+00 6.41175e+02 335.067 2.65151e+02 335.067 0.9856 
1 1 1 11  26  2  o 6  4.29536e+01 9.57291e-01 7.12269e+02 47.414  8.57427e+01  9.32915e+01  0.00000e+00 0.00000e+00 9.10102e+02 47.414  1.97832e+02 47.414  0.9960 
1 1 1 11  26  3  o 12 2.10690e+01 8.45003e-01 5.03698e+02 221.837 -3.39856e+01 -3.04265e+01 0.00000e+00 0.00000e+00 2.86668e+02 221.837 2.17030e+02 41.837  0.9890 
1 1 1 11  26  4  o 18 4.73958e+00 2.16688e+00 1.73873e+02 171.320 -2.78381e+00 4.24978e-01  0.00000e+00 0.00000e+00 3.08427e+01 351.320 2.04716e+02 351.320 0.7954 
1 1 1 11  26  5  o 13 1.70937e+01 1.22658e+00 3.25462e+02 194.914 -2.75210e+01 -7.33012e+00 0.00000e+00 0.00000e+00 3.11688e+02 194.914 1.37739e+01 14.914  0.9823 
1 1 1 11  26  6  o 7  2.11556e+01 1.38377e+00 2.93152e+02 63.196  1.64818e+01  3.26229e+01  0.00000e+00 0.00000e+00 4.98652e+02 63.196  2.05501e+02 63.196  0.9862 
1 1 1 11  26  7  o 13 6.96975e+00 1.86719e+00 1.40304e+02 238.894 -2.73651e+00 -4.53521e+00 0.00000e+00 0.00000e+00 9.77192e+01 238.894 4.25847e+01 58.894  0.8998 
1 1 1 11  26  8  o 7  5.23355e+00 1.45174e+00 1.08655e+02 36.796  3.34926e+00  2.50524e+00  0.00000e+00 0.00000e+00 6.41844e+01 36.796  4.44701e+01 216.796 0.8702 
1 1 1 11  26  9  o 7  1.35739e+01 1.52627e+00 2.48493e+02 98.340  -3.91117e+00 2.66792e+01  0.00000e+00 0.00000e+00 2.56977e+02 98.340  8.48471e+00 98.340  0.9813 
1 1 1 11  26  10 o 7  7.81681e+00 1.73519e+00 1.91356e+02 51.972  7.10045e+00  9.07906e+00  0.00000e+00 0.00000e+00 9.20677e+01 51.972  9.92878e+01 231.972 0.9556 
1 1 1 11  26  11 o 10 7.87380e+00 1.84592e+00 1.70781e+02 100.139 -1.90237e+00 1.06382e+01  0.00000e+00 0.00000e+00 1.13745e+02 100.139 5.70352e+01 280.139 0.9525 
1 1 1 11  26  12 o 19 4.23983e+00 1.42661e+00 1.80949e+01 37.291  6.46714e-01  4.92512e-01  0.00000e+00 0.00000e+00 4.23978e+01 37.291  2.43030e+01 37.291  0.3762 
1 1 1 11  27  0  o 18 3.02706e+01 8.00612e-01 5.31862e+02 136.572 -3.99312e+01 3.77985e+01  0.00000e+00 0.00000e+00 6.04569e+02 136.572 7.27066e+01 136.572 0.9909 
1 1 1 11  27  1  o 17 2.69802e+01 7.87437e-01 4.47038e+02 15.416  4.49945e+01  1.24071e+01  0.00000e+00 0.00000e+00 5.64609e+02 15.416  1.17571e+02 15.416  0.9892 
1 1 1 11  27  2  o 18 1.06758e+01 1.03952e+00 1.73162e+02 65.845  3.08468e+00  6.87829e+00  0.00000e+00 0.00000e+00 2.03742e+02 65.845  3.05795e+01 65.845  0.9311 
1 1 1 11  27  3  o 5  1.22365e+01 1.11519e+00 3.07432e+02 340.832 1.52724e+01  -5.30874e+00 0.00000e+00 0.00000e+00 1.42092e+02 340.832 1.65340e+02 160.832 0.9686 
1 1 1 11  27  4  o 19 4.08249e+01 1.79460e+00 6.95432e+02 120.191 -5.70733e+01 9.80969e+01  0.00000e+00 0.00000e+00 8.46512e+02 120.191 1.51080e+02 120.191 0.9956 
1 1 1 11  27  5  o 13 1.63156e+01 1.30114e+00 2.73475e+02 118.140 -1.06562e+01 1.99239e+01  0.00000e+00 0.00000e+00 3.31738e+02 118.140 5.82633e+01 118.140 0.9776 
1 1 1 11  27  6  o 3  1.25710e+01 1.83240e+00 2.26618e+02 189.109 -1.48283e+01 -2.37754e+00 0.00000e+00 0.00000e+00 2.34256e+02 189.109 7.63766e+00 189.109 0.9661 
1 1 1 11  27  7  o 6  4.16431e+00 1.42424e+00 8.39378e+01 160.620 -2.09698e+00 7.37654e-01  0.00000e+00 0.00000e+00 3.16144e+01 160.620 5.23234e+01 340.620 0.7312 
1 1 1 11  27  8  o 12 2.06032e+01 1.17469e+00 2.76496e+02 240.890 -2.26519e+01 -4.06813e+01 0.00000e+00 0.00000e+00 4.96930e+02 240.890 2.20434e+02 240.890 0.9892 
1 1 1 11  27  9  o 9  6.14953e+00 1.67361e+00 1.88198e+02 172.742 -8.55618e+00 1.08970e+00  0.00000e+00 0.00000e+00 3.11763e+01 172.742 1.57022e+02 352.742 0.9401 
1 1 1 11  27  10 o 6  7.33683e+00 1.78767e+00 1.33469e+02 264.272 -7.75296e-01 -7.72929e+00 0.00000e+00 0.00000e+00 1.26307e+02 264.272 7.16169e+00 84.272  0.9332 
1 1 1 11  27  11 o 7  4.09923e+00 1.34507e+00 7.03492e+01 28.754  2.68417e+00  1.47285e+00  0.00000e+00 0.00000e+00 5.62949e+01 28.754  1.40543e+01 208.754 0.8144 
1 1 1 11  27  12 o 13 1.09772e+01 1.91599e+00 1.60414e+02 321.933 1.17579e+01  -9.20828e+00 0.00000e+00 0.00000e+00 2.41689e+02 321.933 8.12757e+01 321.933 0.9659 
1 1 1 11  28  0  o 7  2.81390e+01 7.72767e-01 4.10060e+02 272.850 1.96050e+00  -3.93746e+01 0.00000e+00 0.00000e+00 6.42395e+02 272.850 2.32335e+02 272.850 0.9872 
1 1 1 11  28  1  o 14 2.96848e+01 9.17063e-01 3.63279e+02 328.383 3.48813e+01  -2.14731e+01 0.00000e+00 0.00000e+00 7.47993e+02 328.383 3.84713e+02 328.383 0.9877 
1 1 1 11  28  2  o 17 3.92087e+01 9.05156e-01 7.09378e+02 291.874 4.29680e+01  -1.07028e+02 0.00000e+00 0.00000e+00 7.70745e+02 291.874 6.13663e+01 291.874 0.9957 
1 1 1 11  28  3  o 18 1.39297e+01 1.25020e+00 3.80009e+02 134.779 -1.63973e+01 1.65245e+01  0.00000e+00 0.00000e+00 1.36809e+02 134.779 2.43200e+02 314.778 0.9783 
1 1 1 11  28  4  o 19 1.82110e+01 1.82864e+00 1.71558e+02 162.072 -1.24369e+01 4.02378e+00  0.00000e+00 0.00000e+00 4.92291e+02 162.072 3.20732e+02 162.072 0.9610 
1 1 1 11  28  5  o 4  6.58938e+00 1.54301e+00 6.27839e+01 100.751 -3.86100e-01 2.03342e+00  0.00000e+00 0.00000e+00 1.14446e+02 100.751 5.16621e+01 100.751 0.7089 
1 1 1 11  28  6  o 6  2.13672e+01 2.13350e+00 3.50137e+02 288.382 1.10935e+01  -3.33823e+01 0.00000e+00 0.00000e+00 4.49028e+02 288.382 9.88913e+01 288.382 0.9857 
1 1 1 11  28  7  o 12 1.52238e+01 1.76703e+00 2.38969e+02 26.711  1.93994e+01  9.76136e+00  0.00000e+00 0.00000e+00 3.25262e+02 26.711  8.62921e+01 26.711  0.9767 
1 1 1 11  28  8  o 17 8.16214e+00 1.51860e+00 1.56349e+02 227.125 -6.26220e+00 -6.74495e+00 0.00000e+00 0.00000e+00 1.36028e+02 227.125 2.03209e+01 47.126  0.9440 
1 1 1 11  28  9  o 9  1.96764e+01 1.30043e+00 3.99155e+02 7.924   6.53505e+01  9.09615e+00  0.00000e+00 0.00000e+00 3.41749e+02 7.924   5.74051e+01 187.924 0.9924 
1 1 1 11  28  10 o 9  5.90713e+00 1.59371e+00 9.24790e+01 52.879  2.82091e+00  3.72711e+00  0.00000e+00 0.00000e+00 1.05906e+02 52.879  1.34274e+01 52.879  0.8852 
1 1 1 11  28  11 o 5  7.60279e+00 1.65693e+00 2.06933e+02 55.376  7.90069e+00  1.14423e+01  0.00000e+00 0.00000e+00 7.08728e+01 55.376  1.36060e+02 235.376 0.9633 
1 1 1 11  28  12 o 9  6.12959e+00 1.71666e+00 1.02916e+02 73.066  1.76265e+00  5.78905e+00  0.00000e+00 0.00000e+00 1.09334e+02 73.066  6.41815e+00 73.066  0.9132 
1 1 1 11  29  0  o 8  1.86314e+01 7.72871e-01 3.02914e+02 22.464  2.01762e+01  8.34240e+00  0.00000e+00 0.00000e+00 3.86537e+02 22.464  8.36234e+01 22.464  0.9768 
1 1 1 11  29  1  o 3  2.00092e+01 7.95517e-01 3.88960e+02 238.190 -1.73487e+01 -2.79695e+01 0.00000e+00 0.00000e+00 3.57744e+02 238.190 3.12154e+01 58.190  0.9847 
1 1 1 11  29  2  o 1  1.84316e+01 8.24301e-01 3.42764e+02 146.109 -2.26362e+01 1.52058e+01  0.00000e+00 0.00000e+00 3.43074e+02 146.109 3.09705e-01 146.109 0.9815 
1 1 1 11  29  3  o 1  1.68693e+01 1.17755e+00 2.44974e+02 41.364  1.38152e+01  1.21644e+01  0.00000e+00 0.00000e+00 3.77127e+02 41.364  1.32153e+02 41.364  0.9724 
1 1 1 11  29  4  o 17 7.79833e+00 1.63126e+00 8.73096e+01 71.802  9.38513e-01  2.85485e+00  0.00000e+00 0.00000e+00 1.52398e+02 71.802  6.50881e+01 71.802  0.8104 
1 1 1 11  29  5  o 3  7.94912e+00 2.19942e+00 8.70939e+01 202.220 -2.59559e+00 -1.06032e+00 0.00000e+00 0.00000e+00 1.52465e+02 202.220 6.53707e+01 202.220 0.7944 
1 1 1 11  29  6  o 14 1.90323e+01 2.38379e+00 4.38436e+02 288.964 1.16215e+01  -3.38199e+01 0.00000e+00 0.00000e+00 2.73516e+02 288.964 1.64920e+02 108.964 0.9859 
1 1 1 11  29  7  o 14 1.17320e+01 1.34262e+00 1.79743e+02 232.503 -9.10333e+00 -1.18651e+01 0.00000e+00 0.00000e+00 2.50262e+02 232.503 7.05191e+01 232.503 0.9660 
1 1 1 11  29  8  o 19 1.51714e+01 1.34184e+00 3.18709e+02 128.696 -2.34442e+01 2.92674e+01  0.00000e+00 0.00000e+00 2.49213e+02 128.696 6.94956e+01 308.696 0.9866 
1 1 1 11  29  9  o 11 8.11287e+00 1.75504e+00 2.48066e+02 161.249 -1.38155e+01 4.68989e+00  0.00000e+00 0.00000e+00 4.89942e+01 161.249 1.99072e+02 341.249 0.9651 
1 1 1 11  29  10 o 8  4.62232e+00 1.43433e+00 1.25814e+02 5.908   5.36439e+00  5.55070e-01  0.00000e+00 0.00000e+00 3.23082e+01 5.908   9.35057e+01 185.908 0.9018 
1 1 1 11  29  11 o 3  8.67841e+00 1.78733e+00 1.96982e+02 207.626 -1.34089e+01 -7.01773e+00 0.00000e+00 0.00000e+00 1.21101e+02 207.626 7.58813e+01 27.626  0.9664 
1 1 1 11  29  12 o 15 8.03463e+00 1.95499e+00 5.82430e+01 318.537 2.78924e+00  -2.46451e+00 0.00000e+00 0.00000e+00 2.01295e+02 318.537 1.43052e+02 318.537 0.8519 
1 1 1 11  30  0  o 17 4.14697e+01 9.15288e-01 7.55919e+02 241.819 -6.16346e+01 -1.15040e+02 0.00000e+00 0.00000e+00 8.08907e+02 241.819 5.29888e+01 241.819 0.9962 
1 1 1 11  30  1  f 0  1.28753e+01 8.99669e-01 3.17934e+02 78.894  3.27506e+00  1.66843e+01  0.00000e+00 0.00000e+00 1.55407e+02 78.894  1.62527e+02 258.894 0.9701 
1 1 1 11  30  2  o 14 1.38070e+01 1.00099e+00 2.52008e+02 237.840 -8.13178e+00 -1.29330e+01 0.00000e+00 0.00000e+00 2.53966e+02 237.840 1.95842e+00 237.840 0.9667 
1 1 1 11  30  3  o 7  3.12568e+01 1.16329e+00 5.94348e+02 68.186  3.01730e+01  7.53858e+01  0.00000e+00 0.00000e+00 5.83579e+02 68.186  1.07690e+01 248.186 0.9938 
1 1 1 11  30  4  o 13 1.83481e+01 1.18525e+00 2.85543e+02 10.569  2.76734e+01  5.16367e+00  0.00000e+00 0.00000e+00 3.97896e+02 10.569  1.12353e+02 10.569  0.9821 
1 1 1 11  30  5  o 5  2.29581e+01 1.28806e+00 3.23092e+02 248.094 -1.50890e+01 -3.75236e+01 0.00000e+00 0.00000e+00 5.36983e+02 248.094 2.13891e+02 248.094 0.9876 
1 1 1 11  30  6  o 18 6.66433e+00 2.00564e+00 1.63060e+02 159.096 -4.96464e+00 1.89624e+00  0.00000e+00 0.00000e+00 6.45426e+01 159.096 9.85177e+01 339.096 0.9002 
1 1 1 11  30  7  o 12 1.45171e+01 1.23303e+00 2.07891e+02 157.165 -2.04650e+01 8.61738e+00  0.00000e+00 0.00000e+00 3.30348e+02 157.165 1.22457e+02 157.165 0.9772 
1 1 1 11  30  8  o 8  1.30871e+01 1.43094e+00 2.54661e+02 270.019 8.15528e-03  -2.49012e+01 0.00000e+00 0.00000e+00 2.31790e+02 270.019 2.28708e+01 90.019  0.9797 
1 1 1 11  30  9  o 2  1.84100e+01 1.27353e+00 2.56006e+02 293.199 1.68118e+01  -3.92267e+01 0.00000e+00 0.00000e+00 4.34182e+02 293.199 1.78176e+02 293.199 0.9882 
1 1 1 11  30  10 o 2  1.01259e+01 1.72943e+00 2.24842e+02 295.064 8.00385e+00  -1.71147e+01 0.00000e+00 0.00000e+00 1.48947e+02 295.064 7.58944e+01 115.064 0.9732 
1 1 1 11  30  11 o 14 4.71127e+00 1.49005e+00 1.17514e+02 222.107 -4.27601e+00 -3.86469e+00 0.00000e+00 0.00000e+00 4.48134e+01 222.107 7.27007e+01 42.108  0.9085 
1 1 1 11  30  12 o 18 6.61998e+00 1.78441e+00 9.38794e+01 211.502 -4.93004e+00 -3.02137e+00 0.00000e+00 0.00000e+00 1.34233e+02 211.502 4.03531e+01 211.502 0.9088 
1 1 1 11  31  0  o 1  1.83756e+01 7.65373e-01 3.33827e+02 244.880 -1.10158e+01 -2.34949e+01 0.00000e+00 0.00000e+00 3.48631e+02 244.880 1.48043e+01 244.880 0.9805 
1 1 1 11  31  1  o 9  2.10844e+01 7.66624e-01 4.08421e+02 163.874 -3.59973e+01 1.04077e+01  0.00000e+00 0.00000e+00 3.79777e+02 163.874 2.86437e+01 343.874 0.9866 
1 1 1 11  31  2  o 3  2.07009e+01 8.83059e-01 3.17094e+02 50.472  1.86275e+01  2.25747e+01  0.00000e+00 0.00000e+00 4.54059e+02 50.472  1.36965e+02 50.472  0.9828 
1 1 1 11  31  3  o 2  1.48759e+01 1.24207e+00 2.55247e+02 11.189  1.70886e+01  3.38028e+00  0.00000e+00 0.00000e+00 2.92357e+02 11.189  3.71098e+01 11.189  0.9709 
1 1 1 11  31  4  o 5  1.21321e+01 1.40044e+00 2.29347e+02 345.621 1.32364e+01  -3.39328e+00 0.00000e+00 0.00000e+00 2.13594e+02 345.621 1.57528e+01 165.621 0.9627 
1 1 1 11  31  5  o 12 1.62137e+01 1.46733e+00 2.83295e+02 151.059 -2.25002e+01 1.24418e+01  0.00000e+00 0.00000e+00 3.19633e+02 151.059 3.63373e+01 151.059 0.9804 
1 1 1 11  31  6  o 1  1.04425e+01 2.33089e+00 1.77805e+02 250.831 -2.72038e+00 -7.82544e+00 0.00000e+00 0.00000e+00 1.93599e+02 250.831 1.57941e+01 250.831 0.9376 
1 1 1 11  31  7  f 0  5.55677e+00 1.48762e+00 4.54346e+01 182.835 -1.75846e+00 -8.70813e-02 0.00000e+00 0.00000e+00 9.24928e+01 182.835 4.70582e+01 182.835 0.6543 
1 1 1 11  31  8  o 15 6.57508e+00 1.62362e+00 1.05487e+02 50.736  3.25140e+00  3.97750e+00  0.00000e+00 0.00000e+00 1.18127e+02 50.736  1.26396e+01 50.736  0.8965 
1 1 1 11  31  9  o 19 6.21440e+00 1.59151e+00 9.34152e+01 37.454  3.72961e+00  2.85704e+00  0.00000e+00 0.00000e+00 1.15419e+02 37.454  2.20034e+01 37.454  0.8859 
1 1 1 11  31  10 o 3  5.26067e+00 1.52677e+00 1.39281e+02 218.288 -5.34627e+00 -4.22035e+00 0.00000e+00 0.00000e+00 4.49581e+01 218.288 9.43225e+01 38.288  0.9234 
1 1 1 11  31  11 o 9  5.27932e+00 1.57798e+00 1.22509e+02 51.767  3.95331e+00  5.01779e+00  0.00000e+00 0.00000e+00 6.12717e+01 51.767  6.12374e+01 231.767 0.9180 
1 1 1 11  31  12 o 12 4.50145e+00 1.47059e+00 1.61944e+02 18.214  7.85119e+00  2.58351e+00  0.00000e+00 0.00000e+00 1.97123e+00 198.214 1.63915e+02 198.214 0.9374 
1 1 1 11  32  0  o 9  1.67887e+01 8.12995e-01 2.34702e+02 222.907 -1.20966e+01 -1.12436e+01 0.00000e+00 0.00000e+00 3.81578e+02 222.907 1.46876e+02 222.907 0.9692 
1 1 1 11  32  1  o 5  6.00186e+00 1.33475e+00 1.28352e+02 172.475 -3.01772e+00 3.98621e-01  0.00000e+00 0.00000e+00 5.65684e+01 172.475 7.17834e+01 352.475 0.8132 
1 1 1 11  32  2  o 2  2.52225e+01 8.95876e-01 4.33005e+02 133.630 -3.53230e+01 3.70541e+01  0.00000e+00 0.00000e+00 5.13600e+02 133.630 8.05956e+01 133.630 0.9902 
1 1 1 11  32  3  f 0  1.55540e+01 1.19497e+00 1.96108e+02 321.674 1.10506e+01  -8.73529e+00 0.00000e+00 0.00000e+00 3.72260e+02 321.674 1.76152e+02 321.674 0.9638 
1 1 1 11  32  4  o 8  7.43481e+00 1.58932e+00 9.50803e+01 316.799 2.41814e+00  -2.27088e+00 0.00000e+00 0.00000e+00 1.39201e+02 316.799 4.41209e+01 316.799 0.8310 
1 1 1 11  32  5  o 5  8.88073e+00 1.82073e+00 1.67539e+02 349.974 7.47399e+00  -1.32132e+00 0.00000e+00 0.00000e+00 1.46247e+02 349.974 2.12921e+01 169.974 0.9316 
1 1 1 11  32  6  o 1  2.86337e+01 2.25447e+00 3.85137e+02 155.096 -4.59329e+01 2.13255e+01  0.00000e+00 0.00000e+00 6.90229e+02 155.096 3.05092e+02 155.096 0.9901 
1 1 1 11  32  7  o 15 6.11849e+00 1.57186e+00 1.58196e+02 140.220 -5.01095e+00 4.17204e+00  0.00000e+00 0.00000e+00 5.52784e+01 140.220 1.02917e+02 320.220 0.9198 
1 1 1 11  32  8  f 0  9.02620e+00 1.61922e+00 3.17058e+02 213.224 -1.75509e+01 -1.14957e+01 0.00000e+00 0.00000e+00 1.70751e+01 213.224 2.99983e+02 33.224  0.9759 
1 1 1 11  32  9  o 3  4.94091e+00 1.43715e+00 9.51602e+01 186.658 -4.23467e+00 -4.94319e-01 0.00000e+00 0.00000e+00 6.84387e+01 186.658 2.67215e+01 6.658   0.8729 
1 1 1 11  32  10 o 9  4.87632e+00 1.42833e+00 5.61498e+01 10.866  2.70465e+00  5.19168e-01  0.00000e+00 0.00000e+00 8.99533e+01 10.866  3.38035e+01 10.866  0.7900 
1 1 1 11  32  11 o 16 5.54406e+00 1.66479e+00 1.61092e+02 254.510 -2.24633e+00 -8.10526e+00 0.00000e+00 0.00000e+00 3.62037e+01 254.510 1.24888e+02 74.510  0.9385 
1 1 1 11  32  12 o 13 1.06895e+01 2.02282e+00 1.85861e+02 139.263 -1.17055e+01 1.00816e+01  0.00000e+00 0.00000e+00 2.06016e+02 139.263 2.01554e+01 139.263 0.9671 
1 1 1 11  33  0  o 18 8.29749e+00 1.12346e+00 8.08175e+01 358.521 2.75659e+00  -7.11754e-02 0.00000e+00 0.00000e+00 1.67523e+02 358.521 8.67052e+01 358.521 0.7903 
1 1 1 11  33  1  o 3  1.63694e+01 8.79675e-01 3.42548e+02 160.783 -2.36287e+01 8.23637e+00  0.00000e+00 0.00000e+00 2.65093e+02 160.783 7.74556e+01 340.783 0.9798 
1 1 1 11  33  2  o 5  1.57467e+01 9.32733e-01 1.46091e+02 83.261  1.22981e+00  1.04073e+01  0.00000e+00 0.00000e+00 4.21462e+02 83.261  2.75372e+02 83.261  0.9510 
1 1 1 11  33  3  o 9  1.60224e+01 1.18021e+00 2.00922e+02 25.985  1.42972e+01  6.96858e+00  0.00000e+00 0.00000e+00 3.87067e+02 25.985  1.86145e+02 25.985  0.9680 
1 1 1 11  33  4  o 17 6.81056e+00 1.61460e+00 8.47998e+01 283.646 6.33560e-01  -2.60964e+00 0.00000e+00 0.00000e+00 1.17600e+02 283.646 3.28004e+01 283.646 0.7837 
1 1 1 11  33  5  o 5  1.83744e+01 1.32933e+00 2.88490e+02 153.181 -2.83230e+01 1.43186e+01  0.00000e+00 0.00000e+00 3.97290e+02 153.181 1.08799e+02 153.181 0.9841 
1 1 1 11  33  6  o 18 8.45547e+00 1.94546e+00 1.51631e+02 305.055 4.01551e+00  -5.72292e+00 0.00000e+00 0.00000e+00 1.45162e+02 305.055 6.46839e+00 125.056 0.9254 
1 1 1 11  33  7  o 6  9.84144e+00 1.45428e+00 1.77503e+02 20.537  1.15266e+01  4.31805e+00  0.00000e+00 0.00000e+00 1.80289e+02 20.537  2.78602e+00 20.537  0.9585 
1 1 1 11  33  8  o 3  1.32105e+01 1.34785e+00 2.01947e+02 12.099  2.23044e+01  4.78127e+00  0.00000e+00 0.00000e+00 2.88019e+02 12.099  8.60712e+01 12.099  0.9778 
1 1 1 11  33  9  o 7  7.67366e+00 1.58776e+00 1.63338e+02 215.528 -8.83129e+00 -6.30587e+00 0.00000e+00 0.00000e+00 1.13950e+02 215.528 4.93888e+01 35.528  0.9527 
1 1 1 11  33  10 o 3  9.86539e+00 1.66577e+00 1.90425e+02 330.633 1.44329e+01  -8.12161e+00 0.00000e+00 0.00000e+00 1.72213e+02 330.633 1.82124e+01 150.633 0.9693 
1 1 1 11  33  11 o 2  4.46076e+00 1.43316e+00 1.50031e+02 349.799 7.07503e+00  -1.27316e+00 0.00000e+00 0.00000e+00 6.84861e+00 349.799 1.43182e+02 169.799 0.9276 
1 1 1 11  33  12 o 18 7.91058e+00 1.91093e+00 1.39787e+02 176.901 -9.56306e+00 5.17745e-01  0.00000e+00 0.00000e+00 1.43946e+02 176.901 4.15905e+00 176.901 0.9463 
1 1 1 11  34  0  o 7  1.44349e+01 9.73309e-01 2.16384e+02 189.745 -1.35424e+01 -2.32589e+00 0.00000e+00 0.00000e+00 3.09931e+02 189.745 9.35470e+01 189.745 0.9629 
1 1 1 11  34  1  o 12 1.81290e+01 8.66621e-01 2.40894e+02 92.465  -8.84388e-01 2.05451e+01  0.00000e+00 0.00000e+00 4.28958e+02 92.465  1.88064e+02 92.465  0.9754 
1 1 1 11  34  2  o 11 1.53433e+01 1.19575e+00 1.67489e+02 203.520 -1.09198e+01 -4.75271e+00 0.00000e+00 0.00000e+00 3.88975e+02 203.520 2.21486e+02 203.520 0.9570 
1 1 1 11  34  3  o 14 9.75579e+00 1.43066e+00 9.82169e+01 144.661 -3.94280e+00 2.79564e+00  0.00000e+00 0.00000e+00 2.30677e+02 144.661 1.32460e+02 144.661 0.8894 
1 1 1 11  34  4  o 5  1.20228e+01 1.18256e+00 2.24162e+02 14.206  1.43852e+01  3.64155e+00  0.00000e+00 0.00000e+00 2.16044e+02 14.206  8.11795e+00 194.206 0.9657 
1 1 1 11  34  5  o 7  7.92261e+00 1.69049e+00 1.26201e+02 175.770 -5.52625e+00 4.08721e-01  0.00000e+00 0.00000e+00 1.45570e+02 175.770 1.93684e+01 175.770 0.9046 
1 1 1 11  34  6  o 10 1.31575e+01 1.68788e+00 2.45145e+02 81.797  2.66539e+00  1.84892e+01  0.00000e+00 0.00000e+00 2.40314e+02 81.797  4.83106e+00 261.797 0.9729 
1 1 1 11  34  7  o 11 4.64708e+00 1.38059e+00 6.52241e+01 342.898 2.09873e+00  -6.45744e-01 0.00000e+00 0.00000e+00 6.29893e+01 342.898 2.23476e+00 162.898 0.7274 
1 1 1 11  34  8  o 14 1.35348e+01 1.29199e+00 1.39171e+02 278.675 2.48517e+00  -1.62880e+01 0.00000e+00 0.00000e+00 3.58327e+02 278.675 2.19156e+02 278.675 0.9692 
1 1 1 11  34  9  o 9  9.30734e+00 1.52292e+00 1.72322e+02 305.008 8.22955e+00  -1.17495e+01 0.00000e+00 0.00000e+00 1.68113e+02 305.008 4.20903e+00 125.008 0.9645 
1 1 1 11  34  10 o 7  4.35995e+00 1.40968e+00 1.41425e+02 180.700 -6.02703e+00 -7.35937e-02 0.00000e+00 0.00000e+00 9.47870e+00 180.700 1.31947e+02 0.700   0.9128 
1 1 1 11  34  11 o 11 8.63220e+00 1.87067e+00 8.41658e+01 233.807 -3.57075e+00 -4.88014e+00 0.00000e+00 0.00000e+00 2.14646e+02 233.807 1.30480e+02 233.807 0.9131 
1 1 1 11  34  12 o 18 5.99392e+00 1.69608e+00 1.67702e+02 158.418 -9.25501e+00 3.66099e+00  0.00000e+00 0.00000e+00 4.77403e+01 158.418 1.19962e+02 338.418 0.9483 
1 1 1 11  35  0  o 9  1.86026e+01 9.19187e-01 2.81328e+02 352.608 2.42349e+01  -3.14388e+00 0.00000e+00 0.00000e+00 4.08452e+02 352.608 1.27124e+02 352.608 0.9793 
1 1 1 11  35  1  o 6  2.04888e+01 8.66845e-01 3.22616e+02 295.003 1.28581e+01  -2.75708e+01 0.00000e+00 0.00000e+00 4.40604e+02 295.003 1.17987e+02 295.003 0.9834 
1 1 1 11  35  2  o 3  3.32237e+01 1.15481e+00 5.05080e+02 27.206  6.94871e+01  3.57208e+01  0.00000e+00 0.00000e+00 7.45741e+02 27.206  2.40661e+02 27.206  0.9936 
1 1 1 11  35  3  o 12 1.45387e+01 1.19173e+00 2.37592e+02 184.922 -1.77958e+01 -1.53259e+00 0.00000e+00 0.00000e+00 2.97808e+02 184.922 6.02157e+01 184.922 0.9716 
1 1 1 11  35  4  o 9  2.95880e+01 1.29220e+00 4.85293e+02 2.788   7.81064e+01  3.80304e+00  0.00000e+00 0.00000e+00 6.29234e+02 2.788   1.43941e+02 2.788   0.9936 
1 1 1 11  35  5  o 16 2.01506e+01 1.29561e+00 3.47392e+02 79.903  7.79794e+00  4.37896e+01  0.00000e+00 0.00000e+00 4.08036e+02 79.903  6.06434e+01 79.903  0.9887 
1 1 1 11  35  6  o 7  1.25741e+01 1.23238e+00 2.67120e+02 358.864 2.45022e+01  -4.85620e-01 0.00000e+00 0.00000e+00 1.99882e+02 358.864 6.72386e+01 178.865 0.9794 
1 1 1 11  35  7  o 14 7.09224e+00 1.52745e+00 1.15115e+02 271.417 1.43868e-01  -5.81470e+00 0.00000e+00 0.00000e+00 1.29483e+02 271.417 1.43681e+01 271.417 0.9094 
1 1 1 11  35  8  o 2  5.91702e+00 1.53019e+00 1.46666e+02 141.079 -5.17685e+00 4.18028e+00  0.00000e+00 0.00000e+00 6.00997e+01 141.079 8.65665e+01 321.079 0.9215 
1 1 1 11  35  9  o 10 8.17179e+00 1.67165e+00 1.47854e+02 195.563 -9.61971e+00 -2.67926e+00 0.00000e+00 0.00000e+00 1.46070e+02 195.563 1.78413e+00 15.563  0.9485 
1 1 1 11  35  10 o 4  8.04435e+00 1.67761e+00 1.83238e+02 263.652 -1.41184e+00 -1.26908e+01 0.00000e+00 0.00000e+00 1.09566e+02 263.652 7.36721e+01 83.652  0.9600 
1 1 1 11  35  11 o 13 4.99753e+00 1.51196e+00 6.39174e+01 110.965 -1.17518e+00 3.06703e+00  0.00000e+00 0.00000e+00 9.31313e+01 110.965 2.92139e+01 110.965 0.8290 
1 1 1 11  35  12 o 13 6.15680e+00 1.76386e+00 1.54464e+02 169.692 -8.98211e+00 1.63362e+00  0.00000e+00 0.00000e+00 6.56879e+01 169.692 8.87765e+01 349.692 0.9435 
1 1 1 11  36  0  f 0  5.67807e+00 1.32376e+00 1.03745e+02 110.040 -8.54540e-01 2.34278e+00  0.00000e+00 0.00000e+00 6.05578e+01 110.040 4.31868e+01 290.040 0.7643 
1 1 1 11  36  1  o 9  1.25562e+01 9.63017e-01 1.96749e+02 183.690 -1.11317e+01 -7.17897e-01 0.00000e+00 0.00000e+00 2.56969e+02 183.690 6.02201e+01 183.690 0.9541 
1 1 1 11  36  2  o 19 1.06246e+01 1.41451e+00 6.57439e+01 119.157 -1.59022e+00 2.85034e+00  0.00000e+00 0.00000e+00 2.67463e+02 119.157 2.01719e+02 119.157 0.8278 
1 1 1 11  36  3  o 17 1.92653e+01 1.14210e+00 3.67753e+02 27.833  3.29697e+01  1.74072e+01  0.00000e+00 0.00000e+00 3.52524e+02 27.833  1.52285e+01 207.833 0.9865 
1 1 1 11  36  4  o 2  7.24916e+00 2.16780e+00 8.10556e+01 209.830 -2.24573e+00 -1.28769e+00 0.00000e+00 0.00000e+00 1.31725e+02 209.830 5.06691e+01 209.830 0.7743 
1 1 1 11  36  5  o 9  4.83696e+00 1.46222e+00 1.47386e+02 240.549 -2.07678e+00 -3.67805e+00 0.00000e+00 0.00000e+00 1.24581e+01 240.549 1.34928e+02 60.549  0.8716 
1 1 1 11  36  6  o 4  1.40189e+01 1.09161e+00 1.60292e+02 151.730 -1.50857e+01 8.11254e+00  0.00000e+00 0.00000e+00 3.55521e+02 151.730 1.95229e+02 151.730 0.9704 
1 1 1 11  36  7  f 0  3.53909e+00 1.14976e+00 1.02149e+02 131.253 -1.98648e+00 2.26494e+00  0.00000e+00 0.00000e+00 6.67722e+00 131.253 9.54720e+01 311.253 0.8109 
1 1 1 11  36  8  o 6  2.13768e+01 1.13720e+00 4.00778e+02 218.492 -6.35263e+01 -5.05163e+01 0.00000e+00 0.00000e+00 4.04809e+02 218.492 4.03131e+00 218.492 0.9938 
1 1 1 11  36  9  o 2  8.83797e+00 1.60737e+00 1.53024e+02 189.399 -1.09702e+01 -1.81593e+00 0.00000e+00 0.00000e+00 1.66638e+02 189.399 1.36142e+01 189.399 0.9539 
1 1 1 11  36  10 o 13 1.21144e+01 1.49757e+00 1.40482e+02 165.092 -1.63401e+01 4.35033e+00  0.00000e+00 0.00000e+00 3.04996e+02 165.092 1.64513e+02 165.092 0.9700 
1 1 1 11  36  11 o 12 5.48133e+00 1.56248e+00 6.18856e+01 327.521 2.85637e+00  -1.81822e+00 0.00000e+00 0.00000e+00 1.11580e+02 327.521 4.96940e+01 327.521 0.8349 
1 1 1 11  36  12 o 13 5.15624e+00 1.64732e+00 7.63552e+01 165.601 -3.94282e+00 1.01225e+00  0.00000e+00 0.00000e+00 9.28890e+01 165.601 1.65337e+01 165.601 0.8662 
1 1 1 11  37  0  o 11 1.39313e+01 9.50368e-01 1.43478e+02 73.502  2.56816e+00  8.67133e+00  0.00000e+00 0.00000e+00 3.53823e+02 73.502  2.10346e+02 73.502  0.9430 
1 1 1 11  37  1  o 10 1.19087e+01 1.01359e+00 1.34875e+02 21.192  7.16292e+00  2.77718e+00  0.00000e+00 0.00000e+00 2.85651e+02 21.192  1.50775e+02 21.192  0.9324 
1 1 1 11  37  2  o 2  1.79491e+01 1.13121e+00 3.61336e+02 119.296 -1.72635e+01 3.07688e+01  0.00000e+00 0.00000e+00 3.08945e+02 119.296 5.23902e+01 299.295 0.9857 
1 1 1 11  37  3  o 1  3.07442e+01 1.15938e+00 5.04956e+02 302.528 4.36441e+01  -6.84337e+01 0.00000e+00 0.00000e+00 6.52901e+02 302.528 1.47946e+02 302.528 0.9938 
1 1 1 11  37  4  o 4  1.59379e+01 1.16376e+00 3.32632e+02 303.470 1.83912e+01  -2.78179e+01 0.00000e+00 0.00000e+00 2.62350e+02 303.470 7.02820e+01 123.470 0.9849 
1 1 1 11  37  5  o 9  1.86578e+01 1.33445e+00 3.05771e+02 234.159 -2.15595e+01 -2.98475e+01 0.00000e+00 0.00000e+00 3.91880e+02 234.159 8.61087e+01 234.159 0.9863 
1 1 1 11  37  6  o 11 1.35705e+01 1.07894e+00 1.98148e+02 24.116  1.89886e+01  8.50057e+00  0.00000e+00 0.00000e+00 3.03846e+02 24.116  1.05698e+02 24.116  0.9757 
1 1 1 11  37  7  o 7  9.84233e+00 1.40935e+00 9.42357e+01 280.393 1.26258e+00  -6.88416e+00 0.00000e+00 0.00000e+00 2.51153e+02 280.393 1.56917e+02 280.393 0.9255 
1 1 1 11  37  8  o 7  1.70386e+01 1.21921e+00 2.91986e+02 161.891 -4.10526e+01 1.34248e+01  0.00000e+00 0.00000e+00 3.46520e+02 161.891 5.45339e+01 161.891 0.9884 
1 1 1 11  37  9  o 12 5.99361e+00 1.55537e+00 1.59725e+02 301.153 4.44889e+00  -7.35958e+00 0.00000e+00 0.00000e+00 5.38572e+01 301.153 1.05868e+02 121.153 0.9399 
1 1 1 11  37  10 o 9  1.42066e+01 1.37092e+00 1.99292e+02 132.991 -2.02296e+01 2.17003e+01  0.00000e+00 0.00000e+00 3.30088e+02 132.991 1.30796e+02 132.991 0.9830 
1 1 1 11  37  11 o 6  6.71843e+00 1.75514e+00 1.42882e+02 340.067 8.23046e+00  -2.98465e+00 0.00000e+00 0.00000e+00 9.67298e+01 340.067 4.61524e+01 160.068 0.9410 
1 1 1 11  37  12 o 6  5.45785e+00 1.67947e+00 8.42893e+01 193.032 -4.38923e+00 -1.01589e+00 0.00000e+00 0.00000e+00 9.77941e+01 193.032 1.35048e+01 193.032 0.8805 
1 1 1 11  38  0  o 6  1.84835e+01 9.20106e-01 3.58112e+02 215.944 -2.60540e+01 -1.88906e+01 0.00000e+00 0.00000e+00 3.30558e+02 215.944 2.75537e+01 35.944  0.9843 
1 1 1 11  38  1  o 2  1.79295e+01 8.47193e-01 3.17469e+02 245.401 -1.24817e+01 -2.72638e+01 0.00000e+00 0.00000e+00 3.50047e+02 245.401 3.25779e+01 245.401 0.9832 
1 1 1 11  38  2  o 11 3.12259e+01 1.14473e+00 6.12589e+02 340.465 9.41372e+01  -3.34000e+01 0.00000e+00 0.00000e+00 5.64321e+02 340.465 4.82687e+01 160.465 0.9950 
1 1 1 11  38  3  o 11 9.28211e+00 1.53814e+00 1.97984e+02 196.490 -8.80349e+00 -2.60603e+00 0.00000e+00 0.00000e+00 1.33982e+02 196.490 6.40023e+01 16.490  0.9439 
1 1 1 11  38  4  o 7  1.56833e+01 1.33322e+00 2.48086e+02 180.862 -2.43551e+01 -3.66267e-01 0.00000e+00 0.00000e+00 3.33980e+02 180.862 8.58933e+01 180.862 0.9793 
1 1 1 11  38  6  o 7  8.11680e+00 1.44818e+00 1.72092e+02 303.990 5.52465e+00  -8.19368e+00 0.00000e+00 0.00000e+00 1.19609e+02 303.990 5.24834e+01 123.990 0.9480 
1 1 1 11  38  7  o 11 1.04644e+01 1.33927e+00 1.82430e+02 267.127 -8.04430e-01 -1.60311e+01 0.00000e+00 0.00000e+00 2.01734e+02 267.127 1.93037e+01 267.127 0.9683 
1 1 1 11  38  8  o 11 2.05316e+01 1.05068e+00 3.41597e+02 137.951 -5.18041e+01 4.67244e+01  0.00000e+00 0.00000e+00 4.31192e+02 137.951 8.95945e+01 137.951 0.9928 
1 1 1 11  38  9  o 3  7.12955e+00 1.59414e+00 1.65586e+02 57.815  5.37783e+00  8.54473e+00  0.00000e+00 0.00000e+00 9.09309e+01 57.815  7.46548e+01 237.815 0.9491 
1 1 1 11  38  10 o 3  4.15177e+00 1.34334e+00 5.80329e+01 94.444  -1.98348e-01 2.55220e+00  0.00000e+00 0.00000e+00 6.33535e+01 94.444  5.32059e+00 94.444  0.7714 
1 1 1 11  38  11 o 13 6.59408e+00 1.65359e+00 8.25190e+01 242.817 -2.30978e+00 -4.49757e+00 0.00000e+00 0.00000e+00 1.41049e+02 242.817 5.85298e+01 242.817 0.8947 
1 1 1 11  38  12 o 16 6.18062e+00 1.81958e+00 8.43199e+01 151.961 -4.31759e+00 2.29946e+00  0.00000e+00 0.00000e+00 1.24273e+02 151.961 3.99527e+01 151.961 0.8908 
1 1 1 11  39  0  o 11 1.49545e+01 8.92676e-01 2.76139e+02 231.246 -1.35067e+01 -1.68269e+01 0.00000e+00 0.00000e+00 2.76575e+02 231.246 4.36465e-01 231.246 0.9765 
1 1 1 11  39  1  o 4  1.82623e+01 8.96494e-01 3.66854e+02 56.923  2.08990e+01  3.20866e+01  0.00000e+00 0.00000e+00 3.15523e+02 56.923  5.13305e+01 236.923 0.9869 
1 1 1 11  39  2  o 3  1.83069e+01 1.10229e+00 3.60649e+02 259.930 -6.12307e+00 -3.44793e+01 0.00000e+00 0.00000e+00 3.22776e+02 259.930 3.78723e+01 79.930  0.9856 
1 1 1 11  39  3  o 19 1.80173e+01 1.40663e+00 1.77518e+02 199.387 -1.59023e+01 -5.59611e+00 0.00000e+00 0.00000e+00 4.84545e+02 199.387 3.07027e+02 199.387 0.9699 
1 1 1 11  39  4  f 0  8.01833e+00 1.68120e+00 1.62027e+02 305.705 4.21076e+00  -5.85875e+00 0.00000e+00 0.00000e+00 1.19914e+02 305.705 4.21134e+01 125.705 0.9279 
1 1 1 11  39  5  o 12 1.33869e+01 1.46772e+00 2.62598e+02 288.098 7.15094e+00  -2.18807e+01 0.00000e+00 0.00000e+00 2.33653e+02 288.098 2.89457e+01 108.098 0.9780 
1 1 1 11  39  6  o 10 1.73966e+01 1.02868e+00 2.83020e+02 180.731 -4.04091e+01 -5.15332e-01 0.00000e+00 0.00000e+00 3.68215e+02 180.731 8.51956e+01 180.731 0.9875 
1 1 1 11  39  7  o 11 6.12905e+00 1.46724e+00 1.13060e+02 170.525 -5.36264e+00 8.94964e-01  0.00000e+00 0.00000e+00 9.66550e+01 170.525 1.64048e+01 350.525 0.9026 
1 1 1 11  39  8  o 19 1.67635e+01 1.13891e+00 2.85880e+02 85.068  4.11614e+00  4.77041e+01  0.00000e+00 0.00000e+00 3.42913e+02 85.068  5.70328e+01 85.068  0.9895 
1 1 1 11  39  9  o 17 4.58081e+00 1.35036e+00 7.63879e+01 71.896  1.10588e+00  3.38270e+00  0.00000e+00 0.00000e+00 7.01808e+01 71.896  6.20716e+00 251.896 0.8441 
1 1 1 11  39  10 o 11 4.05301e+00 1.33234e+00 5.74314e+01 220.172 -1.87625e+00 -1.58397e+00 0.00000e+00 0.00000e+00 5.93198e+01 220.172 1.88839e+00 220.172 0.7601 
1 1 1 11  39  11 o 19 5.78868e+00 1.70187e+00 1.06370e+02 263.070 -7.19691e-01 -5.92120e+00 0.00000e+00 0.00000e+00 9.36304e+01 263.070 1.27397e+01 83.070  0.9118 
1 1 1 11  39  12 o 6  6.17918e+00 1.74564e+00 1.19058e+02 280.540 1.35865e+00  -7.30229e+00 0.00000e+00 0.00000e+00 9.86418e+01 280.540 2.04161e+01 100.540 0.9300 
1 1 1 11  40  0  o 2  1.99065e+01 8.32632e-01 2.81795e+02 216.484 -2.60801e+01 -1.92872e+01 0.00000e+00 0.00000e+00 4.59827e+02 216.484 1.78032e+02 216.484 0.9845 
1 1 1 11  40  1  f 0  2.81388e+01 1.07088e+00 3.71167e+02 315.726 3.96507e+01  -3.86584e+01 0.00000e+00 0.00000e+00 6.84474e+02 315.726 3.13307e+02 315.726 0.9909 
1 1 1 11  40  2  o 19 8.77348e+00 1.43939e+00 6.61334e+01 247.058 -1.16423e+00 -2.75052e+00 0.00000e+00 0.00000e+00 2.02675e+02 247.058 1.36542e+02 247.058 0.8090 
1 1 1 11  40  3  o 10 3.34795e+01 1.32027e+00 5.22606e+02 121.594 -5.35322e+01 8.70358e+01  0.00000e+00 0.00000e+00 7.39484e+02 121.594 2.16878e+02 121.594 0.9951 
1 1 1 11  40  4  o 8  1.09844e+01 1.49974e+00 3.32037e+02 322.886 1.72668e+01  -1.30655e+01 0.00000e+00 0.00000e+00 7.44560e+01 322.886 2.57581e+02 142.886 0.9766 
1 1 1 11  40  5  o 10 1.14882e+01 2.21980e+00 1.55816e+02 165.503 -8.16113e+00 2.11010e+00  0.00000e+00 0.00000e+00 2.52863e+02 165.503 9.70469e+01 165.503 0.9387 
1 1 1 11  40  6  f 0  1.39702e+01 1.09045e+00 2.11104e+02 193.404 -2.30539e+01 -5.49404e+00 0.00000e+00 0.00000e+00 3.07107e+02 193.404 9.60033e+01 193.404 0.9787 
1 1 1 11  40  7  o 12 7.56212e+00 1.52972e+00 1.51570e+02 38.312  7.08864e+00  5.60077e+00  0.00000e+00 0.00000e+00 1.18703e+02 38.312  3.28672e+01 218.312 0.9429 
1 1 1 11  40  8  o 6  7.16802e+00 1.56934e+00 1.37217e+02 289.894 2.84085e+00  -7.85015e+00 0.00000e+00 0.00000e+00 1.17644e+02 289.894 1.95730e+01 109.894 0.9380 
1 1 1 11  40  9  o 8  3.80224e+00 1.24057e+00 1.13345e+02 279.621 7.78149e-01  -4.59048e+00 0.00000e+00 0.00000e+00 1.41526e+01 279.621 9.91926e+01 99.621  0.8847 
1 1 1 11  40  10 o 18 1.30707e+01 1.42002e+00 2.35988e+02 192.252 -3.32469e+01 -7.22000e+00 0.00000e+00 0.00000e+00 2.51997e+02 192.252 1.60093e+01 192.252 0.9852 
1 1 1 11  40  11 o 6  8.92526e+00 1.84051e+00 1.83351e+02 352.636 1.38187e+01  -1.78581e+00 0.00000e+00 0.00000e+00 1.42438e+02 352.636 4.09133e+01 172.636 0.9634 
1 1 1 11  40  12 o 13 1.01257e+01 2.06234e+00 1.75858e+02 89.342  1.63134e-01  1.42126e+01  0.00000e+00 0.00000e+00 1.93937e+02 89.342  1.80793e+01 89.342  0.9642 
1 1 1 11  41  0  o 9  1.33845e+01 8.75767e-01 1.73998e+02 31.630  1.09252e+01  6.72924e+00  0.00000e+00 0.00000e+00 3.12307e+02 31.630  1.38309e+02 31.630  0.9602 
1 1 1 11  41  1  o 16 1.59379e+01 1.07254e+00 2.01348e+02 156.248 -1.56653e+01 6.89366e+00  0.00000e+00 0.00000e+00 3.84077e+02 156.248 1.82729e+02 156.248 0.9703 
1 1 1 11  41  2  o 4  1.24756e+01 1.08750e+00 1.58090e+02 287.780 3.45364e+00  -1.07696e+01 0.00000e+00 0.00000e+00 2.92941e+02 287.780 1.34852e+02 287.780 0.9547 
1 1 1 11  41  4  o 14 9.84939e+00 1.60090e+00 1.72723e+02 149.752 -8.29323e+00 4.83599e+00  0.00000e+00 0.00000e+00 1.80442e+02 149.752 7.71949e+00 149.752 0.9464 
1 1 1 11  41  5  f 0  9.81740e+00 1.59098e+00 9.25940e+01 272.318 2.34854e-01  -5.80121e+00 0.00000e+00 0.00000e+00 2.45661e+02 272.318 1.53067e+02 272.318 0.9092 
1 1 1 11  41  6  o 9  7.66472e+00 1.40900e+00 1.88585e+02 213.661 -8.99241e+00 -5.98836e+00 0.00000e+00 0.00000e+00 8.81048e+01 213.661 1.00481e+02 33.661  0.9525 
1 1 1 11  41  7  o 19 1.32896e+01 1.25229e+00 2.77524e+02 13.745  3.18601e+01  7.79327e+00  0.00000e+00 0.00000e+00 2.18412e+02 13.745  5.91124e+01 193.745 0.9846 
1 1 1 11  41  8  o 2  1.26057e+01 1.28257e+00 1.46973e+02 297.056 8.51869e+00  -1.66781e+01 0.00000e+00 0.00000e+00 3.17839e+02 297.056 1.70867e+02 297.056 0.9729 
1 1 1 11  41  9  o 16 7.33993e+00 1.60783e+00 1.68662e+02 160.779 -1.06491e+01 3.71269e+00  0.00000e+00 0.00000e+00 9.68617e+01 160.779 7.18002e+01 340.779 0.9546 
1 1 1 11  41  10 o 9  4.98781e+00 1.45536e+00 8.99118e+01 102.822 -1.05635e+00 4.64148e+00  0.00000e+00 0.00000e+00 7.78219e+01 102.822 1.20899e+01 282.821 0.8875 
1 1 1 11  41  11 o 5  4.92539e+00 1.46586e+00 8.00421e+01 60.233  2.22771e+00  3.89495e+00  0.00000e+00 0.00000e+00 8.41494e+01 60.233  4.10726e+00 60.233  0.8799 
1 1 1 11  41  12 o 15 5.59671e+00 1.65371e+00 5.53349e+01 233.000 -1.95566e+00 -2.59522e+00 0.00000e+00 0.00000e+00 1.19936e+02 233.000 6.46009e+01 233.000 0.8269 
1 1 1 11  42  0  o 8  1.51256e+01 8.66690e-01 2.69077e+02 292.765 8.74723e+00  -2.08445e+01 0.00000e+00 0.00000e+00 2.90394e+02 292.765 2.13168e+01 292.765 0.9776 
1 1 1 11  42  1  o 15 2.11611e+01 9.50646e-01 4.46189e+02 257.016 -1.23070e+01 -5.33736e+01 0.00000e+00 0.00000e+00 3.47420e+02 257.016 9.87691e+01 77.016  0.9908 
1 1 1 11  42  2  o 12 5.65538e+00 1.35323e+00 6.97871e+01 45.112  1.61303e+00  1.61933e+00  0.00000e+00 0.00000e+00 8.85698e+01 45.112  1.87827e+01 45.112  0.7395 
1 1 1 11  42  3  o 10 8.08251e+00 1.61177e+00 1.70217e+02 143.863 -6.32669e+00 4.61972e+00  0.00000e+00 0.00000e+00 1.15642e+02 143.863 5.45751e+01 323.863 0.9338 
1 1 1 11  42  4  o 7  9.36089e+00 1.55496e+00 1.45511e+02 256.915 -1.84254e+00 -7.92752e+00 0.00000e+00 0.00000e+00 1.86552e+02 256.915 4.10406e+01 256.915 0.9364 
1 1 1 11  42  5  o 1  9.65689e+00 1.53024e+00 2.20794e+02 284.541 3.53119e+00  -1.36139e+01 0.00000e+00 0.00000e+00 1.31845e+02 284.541 8.89493e+01 104.541 0.9638 
1 1 1 11  42  6  o 5  6.17900e+00 1.27616e+00 1.26450e+02 138.949 -4.68109e+00 4.07647e+00  0.00000e+00 0.00000e+00 8.79024e+01 138.949 3.85476e+01 318.949 0.9155 
1 1 1 11  42  7  o 12 1.81627e+01 9.62628e-01 3.10373e+02 307.381 3.30075e+01  -4.32015e+01 0.00000e+00 0.00000e+00 3.71554e+02 307.381 6.11806e+01 307.381 0.9908 
1 1 1 11  42  8  o 7  1.38221e+01 1.15052e+00 1.72669e+02 221.779 -1.91233e+01 -1.70856e+01 0.00000e+00 0.00000e+00 3.40805e+02 221.779 1.68136e+02 221.779 0.9803 
1 1 1 11  42  9  o 17 8.75157e+00 1.59374e+00 1.62813e+02 189.035 -1.24853e+01 -1.98535e+00 0.00000e+00 0.00000e+00 1.55404e+02 189.035 7.40869e+00 9.035   0.9596 
1 1 1 11  42  10 o 12 3.88961e+00 1.26909e+00 6.99445e+01 78.524  6.42599e-01  3.16526e+00  0.00000e+00 0.00000e+00 5.17262e+01 78.524  1.82183e+01 258.524 0.8256 
1 1 1 11  42  11 o 9  4.37211e+00 1.40602e+00 7.10547e+01 56.533  1.93635e+00  2.92918e+00  0.00000e+00 0.00000e+00 6.83409e+01 56.533  2.71379e+00 236.533 0.8417 
1 1 1 11  42  12 o 11 4.34373e+00 1.45042e+00 3.82986e+01 288.702 6.08505e-01  -1.79750e+00 0.00000e+00 0.00000e+00 7.35978e+01 288.702 3.52992e+01 288.702 0.6802 
1 1 1 11  43  0  o 8  5.83005e+00 1.17790e+00 9.06337e+01 17.621  2.77259e+00  8.80612e-01  0.00000e+00 0.00000e+00 8.64773e+01 17.621  4.15638e+00 197.621 0.8030 
1 1 1 11  43  1  o 14 6.48120e+00 1.30164e+00 1.70350e+02 354.876 5.96631e+00  -5.35026e-01 0.00000e+00 0.00000e+00 5.34028e+01 354.876 1.16947e+02 174.876 0.9122 
1 1 1 11  43  2  o 1  1.19339e+01 1.21126e+00 2.56271e+02 244.249 -8.23993e+00 -1.70827e+01 0.00000e+00 0.00000e+00 1.83461e+02 244.249 7.28097e+01 64.249  0.9733 
1 1 1 11  43  3  o 7  2.03885e+01 1.56869e+00 2.71942e+02 310.870 2.10443e+01  -2.43200e+01 0.00000e+00 0.00000e+00 4.88075e+02 310.870 2.16132e+02 310.870 0.9843 
1 1 1 11  43  4  o 15 1.72646e+01 1.59617e+00 3.25992e+02 187.256 -3.48557e+01 -4.43816e+00 0.00000e+00 0.00000e+00 3.18600e+02 187.256 7.39193e+00 7.256   0.9857 
1 1 1 11  43  5  o 15 1.73758e+01 1.23639e+00 3.12327e+02 127.745 -2.54263e+01 3.28445e+01  0.00000e+00 0.00000e+00 3.37988e+02 127.745 2.56617e+01 127.745 0.9879 
1 1 1 11  43  6  o 10 8.99901e+00 1.38174e+00 1.96520e+02 76.948  3.04485e+00  1.31345e+01  0.00000e+00 0.00000e+00 1.31548e+02 76.948  6.49717e+01 256.948 0.9622 
1 1 1 11  43  7  o 8  1.46960e+01 1.00407e+00 3.24981e+02 313.220 3.26162e+01  -3.47087e+01 0.00000e+00 0.00000e+00 2.25989e+02 313.220 9.89918e+01 133.220 0.9894 
1 1 1 11  43  8  o 11 3.15885e+00 1.05524e+00 8.44595e+01 165.973 -2.76177e+00 6.89990e-01  0.00000e+00 0.00000e+00 1.10508e+01 165.973 7.34086e+01 345.972 0.7980 
1 1 1 11  43  9  o 3  5.32568e+00 1.50291e+00 8.24630e+01 240.740 -2.04691e+00 -3.65349e+00 0.00000e+00 0.00000e+00 9.31594e+01 240.740 1.06963e+01 240.740 0.8704 
1 1 1 11  43  10 o 12 5.09470e+00 1.42440e+00 5.48237e+01 86.436  1.87325e-01  3.00734e+00  0.00000e+00 0.00000e+00 1.01691e+02 86.436  4.68669e+01 86.436  0.8110 
1 1 1 11  43  11 o 18 5.17899e+00 1.45648e+00 5.08217e+01 282.446 6.56240e-01  -2.97327e+00 0.00000e+00 0.00000e+00 1.08700e+02 282.446 5.78780e+01 282.446 0.8132 
1 1 1 11  44  0  o 19 2.82851e+01 1.17938e+00 4.50274e+02 132.143 -4.78247e+01 5.28489e+01  0.00000e+00 0.00000e+00 6.12100e+02 132.143 1.61826e+02 132.143 0.9930 
1 1 1 11  44  1  o 10 1.83999e+01 1.05341e+00 2.53464e+02 311.070 1.92378e+01  -2.20761e+01 0.00000e+00 0.00000e+00 4.30822e+02 311.070 1.77358e+02 311.070 0.9828 
1 1 1 11  44  2  o 11 2.97934e+01 1.11060e+00 5.33424e+02 66.348  4.26094e+01  9.72878e+01  0.00000e+00 0.00000e+00 5.89077e+02 66.348  5.56530e+01 66.348  0.9953 
1 1 1 11  44  3  o 2  2.16763e+01 1.63837e+00 3.50803e+02 190.949 -4.16026e+01 -8.04812e+00 0.00000e+00 0.00000e+00 4.60244e+02 190.949 1.09441e+02 190.949 0.9881 
1 1 1 11  44  4  o 12 1.23087e+01 1.44057e+00 2.34483e+02 81.313  2.75238e+00  1.80152e+01  0.00000e+00 0.00000e+00 2.18725e+02 81.313  1.57572e+01 261.313 0.9722 
1 1 1 11  44  5  o 4  1.91822e+01 1.24331e+00 3.34936e+02 273.621 3.09349e+00  -4.88775e+01 0.00000e+00 0.00000e+00 3.84244e+02 273.621 4.93078e+01 273.621 0.9897 
1 1 1 11  44  6  o 19 6.44331e+00 1.35961e+00 1.05754e+02 138.625 -4.25728e+00 3.75004e+00  0.00000e+00 0.00000e+00 1.15640e+02 138.625 9.88583e+00 138.625 0.9070 
1 1 1 11  44  7  o 15 1.10230e+01 1.38950e+00 2.18024e+02 180.545 -1.94134e+01 -1.84548e-01 0.00000e+00 0.00000e+00 1.88699e+02 180.545 2.93246e+01 0.545   0.9739 
1 1 1 11  44  8  o 15 8.26965e+00 1.41563e+00 8.51828e+01 175.495 -6.78960e+00 5.34908e-01  0.00000e+00 0.00000e+00 2.04108e+02 175.495 1.18925e+02 175.495 0.9234 
1 1 1 11  44  9  o 14 1.00258e+01 1.44798e+00 1.41298e+02 91.637  -4.13474e-01 1.44678e+01  0.00000e+00 0.00000e+00 2.25148e+02 91.637  8.38496e+01 91.637  0.9648 
1 1 1 11  44  10 o 10 5.52701e+00 1.47657e+00 7.50824e+01 74.486  1.16526e+00  4.19785e+00  0.00000e+00 0.00000e+00 1.08301e+02 74.486  3.32189e+01 74.486  0.8760 
1 1 1 11  44  11 o 19 5.12637e+00 1.56758e+00 5.11078e+01 297.580 1.30362e+00  -2.49568e+00 0.00000e+00 0.00000e+00 1.03305e+02 297.580 5.21967e+01 297.580 0.7954 
1 1 1 11  45  0  o 6  2.01012e+01 1.02984e+00 3.38679e+02 11.141  4.21529e+01  8.30139e+00  0.00000e+00 0.00000e+00 4.12674e+02 11.141  7.39954e+01 11.141  0.9883 
1 1 1 11  45  1  o 15 9.52695e+00 1.21843e+00 1.89119e+02 46.829  7.61796e+00  8.12067e+00  0.00000e+00 0.00000e+00 1.54762e+02 46.829  3.43574e+01 226.829 0.9540 
1 1 1 11  45  2  f 0  1.47317e+01 1.10945e+00 2.54982e+02 59.713  1.27120e+01  2.17652e+01  0.00000e+00 0.00000e+00 2.91439e+02 59.713  3.64570e+01 59.713  0.9800 
1 1 1 11  45  3  o 10 2.59040e+01 1.16241e+00 3.75402e+02 283.656 1.56007e+01  -6.42093e+01 0.00000e+00 0.00000e+00 5.97903e+02 283.656 2.22501e+02 283.656 0.9924 
1 1 1 11  45  4  o 17 1.36274e+01 9.79162e-01 3.37045e+02 94.317  -2.72519e+00 3.60972e+01  0.00000e+00 0.00000e+00 1.71842e+02 94.317  1.65204e+02 274.317 0.9861 
1 1 1 11  45  5  o 12 1.18779e+01 1.09628e+00 1.85549e+02 44.661  1.25591e+01  1.24112e+01  0.00000e+00 0.00000e+00 2.51407e+02 44.661  6.58579e+01 44.661  0.9713 
1 1 1 11  45  6  o 17 1.63509e+01 8.91531e-01 2.73986e+02 82.713  5.57670e+00  4.36091e+01  0.00000e+00 0.00000e+00 3.38305e+02 82.713  6.43190e+01 82.713  0.9886 
1 1 1 11  45  7  o 19 1.25601e+01 1.26825e+00 2.57374e+02 188.906 -3.01381e+01 -4.72262e+00 0.00000e+00 0.00000e+00 2.10564e+02 188.906 4.68101e+01 8.906   0.9835 
1 1 1 11  45  8  o 15 6.62514e+00 1.48180e+00 8.58397e+01 270.684 6.14727e-02  -5.15156e+00 0.00000e+00 0.00000e+00 1.39228e+02 270.684 5.33881e+01 270.684 0.8968 
1 1 1 11  45  9  o 8  6.06316e+00 1.50904e+00 1.30115e+02 267.205 -3.73473e-01 -7.65073e+00 0.00000e+00 0.00000e+00 8.39856e+01 267.205 4.61293e+01 87.205  0.9322 
1 1 1 11  45  10 o 15 4.59924e+00 1.40297e+00 1.13117e+02 270.809 8.04703e-02  -5.70022e+00 0.00000e+00 0.00000e+00 4.49499e+01 270.809 6.81668e+01 90.809  0.9074 
1 1 1 11  45  11 o 3  7.36669e+00 1.75871e+00 1.22037e+02 186.441 -8.60306e+00 -9.71280e-01 0.00000e+00 0.00000e+00 1.40267e+02 186.441 1.82301e+01 186.441 0.9403 
1 1 1 11  46  0  o 18 1.76739e+01 1.09108e+00 3.47605e+02 57.575  2.10666e+01  3.31638e+01  0.00000e+00 0.00000e+00 3.12196e+02 57.575  3.54090e+01 237.575 0.9872 
1 1 1 11  46  1  o 11 1.29815e+01 1.35007e+00 1.96437e+02 206.535 -1.41657e+01 -7.07363e+00 0.00000e+00 0.00000e+00 2.78911e+02 206.535 8.24738e+01 206.535 0.9679 
1 1 1 11  46  2  o 5  1.68751e+01 1.10288e+00 3.34841e+02 305.422 2.16102e+01  -3.03833e+01 0.00000e+00 0.00000e+00 2.95179e+02 305.422 3.96621e+01 125.422 0.9865 
1 1 1 11  46  3  o 11 1.28774e+01 1.31243e+00 2.32025e+02 137.326 -1.51947e+01 1.40087e+01  0.00000e+00 0.00000e+00 2.43525e+02 137.326 1.14995e+01 137.326 0.9755 
1 1 1 11  46  4  o 4  1.54653e+01 9.10720e-01 2.95252e+02 256.727 -8.94918e+00 -3.79379e+01 0.00000e+00 0.00000e+00 2.82781e+02 256.727 1.24712e+01 76.727  0.9871 
1 1 1 11  46  5  o 7  1.68140e+01 8.92367e-01 3.15259e+02 178.345 -4.75406e+01 1.37381e+00  0.00000e+00 0.00000e+00 3.14782e+02 178.345 4.77537e-01 358.345 0.9894 
1 1 1 11  46  6  o 13 8.60534e+00 1.24711e+00 1.85198e+02 114.332 -5.85372e+00 1.29456e+01  0.00000e+00 0.00000e+00 1.29046e+02 114.332 5.61521e+01 294.331 0.9641 
1 1 1 11  46  7  o 2  5.35320e+00 1.56596e+00 1.41969e+02 276.775 7.62299e-01  -6.41638e+00 0.00000e+00 0.00000e+00 4.43682e+01 276.775 9.76006e+01 96.775  0.9190 
1 1 1 11  46  8  o 4  4.36225e+00 1.30422e+00 6.50043e+01 357.676 2.95019e+00  -1.19729e-01 0.00000e+00 0.00000e+00 6.82387e+01 357.676 3.23435e+00 357.676 0.8064 
1 1 1 11  46  9  f 0  1.19824e+01 1.27444e+00 2.69330e+02 284.848 9.00141e+00  -3.39525e+01 0.00000e+00 0.00000e+00 1.77980e+02 284.848 9.13505e+01 104.849 0.9857 
1 1 1 11  46  10 o 17 4.33975e+00 1.37871e+00 8.78964e+01 166.009 -4.23743e+00 1.05580e+00  0.00000e+00 0.00000e+00 5.61129e+01 166.009 3.17835e+01 346.009 0.8763 
1 1 1 11  46  11 o 9  4.65618e+00 1.44750e+00 3.60958e+01 8.906   1.87990e+00  2.94583e-01  0.00000e+00 0.00000e+00 8.39840e+01 8.906   4.78882e+01 8.906   0.6812 
1 1 1 11  47  0  o 13 9.13930e+00 1.07706e+00 2.57311e+02 146.152 -1.31388e+01 8.81146e+00  0.00000e+00 0.00000e+00 7.71541e+01 146.152 1.80157e+02 326.152 0.9679 
1 1 1 11  47  1  o 1  2.20537e+01 1.27124e+00 3.45544e+02 299.249 2.37838e+01  -4.24707e+01 0.00000e+00 0.00000e+00 4.80075e+02 299.249 1.34531e+02 299.249 0.9897 
1 1 1 11  47  2  o 4  1.24854e+01 1.26825e+00 2.42187e+02 158.550 -1.85180e+01 7.27566e+00  0.00000e+00 0.00000e+00 2.18237e+02 158.550 2.39499e+01 338.550 0.9745 
1 1 1 11  47  3  o 2  2.09437e+01 1.12531e+00 3.86059e+02 15.876  5.43390e+01  1.54539e+01  0.00000e+00 0.00000e+00 3.99644e+02 15.876  1.35852e+01 15.876  0.9911 
1 1 1 11  47  4  o 7  1.66068e+01 8.98472e-01 3.46538e+02 147.912 -4.16594e+01 2.61210e+01  0.00000e+00 0.00000e+00 2.75773e+02 147.912 7.07651e+01 327.912 0.9898 
1 1 1 11  47  5  o 7  1.40027e+01 9.48764e-01 2.25700e+02 326.217 2.34603e+01  -1.56954e+01 0.00000e+00 0.00000e+00 2.95057e+02 326.217 6.93575e+01 326.217 0.9821 
1 1 1 11  47  6  o 6  7.61460e+00 1.28567e+00 1.77955e+02 106.370 -3.25189e+00 1.10705e+01  0.00000e+00 0.00000e+00 9.76208e+01 106.370 8.03345e+01 286.370 0.9556 
1 1 1 11  47  7  o 9  4.94086e+00 1.50455e+00 5.36070e+01 354.899 2.38369e+00  -2.12779e-01 0.00000e+00 0.00000e+00 8.72696e+01 354.899 3.36626e+01 354.899 0.7529 
1 1 1 11  47  8  o 8  4.25394e+00 1.29038e+00 3.99044e+01 218.883 -1.39091e+00 -1.12163e+00 0.00000e+00 0.00000e+00 6.63390e+01 218.883 2.64345e+01 218.883 0.6595 
1 1 1 11  47  9  o 3  4.46851e+00 1.36202e+00 7.35142e+01 117.023 -1.70413e+00 3.34129e+00  0.00000e+00 0.00000e+00 7.08634e+01 117.023 2.65086e+00 297.023 0.8532 
1 1 1 11  47  10 o 3  8.86437e+00 1.62646e+00 2.19018e+02 207.822 -1.74425e+01 -9.20476e+00 0.00000e+00 0.00000e+00 1.07998e+02 207.822 1.11020e+02 27.822  0.9743 
1 1 1 11  47  11 o 11 5.14359e+00 1.54818e+00 8.72001e+01 53.648  2.98041e+00  4.04958e+00  0.00000e+00 0.00000e+00 8.68833e+01 53.648  3.16799e-01 233.648 0.8940 
1 1 1 11  48  0  o 6  1.72427e+01 1.14960e+00 2.62106e+02 307.920 1.83808e+01  -2.35942e+01 0.00000e+00 0.00000e+00 3.78792e+02 307.920 1.16686e+02 307.920 0.9831 
1 1 1 11  48  1  o 18 2.17809e+01 1.25402e+00 3.78810e+02 86.357  3.30485e+00  5.19084e+01  0.00000e+00 0.00000e+00 4.37037e+02 86.357  5.82272e+01 86.357  0.9903 
1 1 1 11  48  2  o 13 1.85380e+01 1.41976e+00 2.55649e+02 18.428  2.99634e+01  9.98398e+00  0.00000e+00 0.00000e+00 4.34554e+02 18.428  1.78906e+02 18.428  0.9840 
1 1 1 11  48  3  o 9  9.12819e+00 1.38859e+00 1.16653e+02 10.398  7.29501e+00  1.33861e+00  0.00000e+00 0.00000e+00 2.04605e+02 10.398  8.79513e+01 10.398  0.9299 
1 1 1 11  48  4  o 6  1.10868e+01 9.70224e-01 2.28562e+02 329.192 1.81722e+01  -1.08361e+01 0.00000e+00 0.00000e+00 1.81092e+02 329.192 4.74694e+01 149.192 0.9761 
1 1 1 11  48  5  o 19 1.10948e+01 1.05953e+00 1.75728e+02 159.565 -1.71865e+01 6.40354e+00  0.00000e+00 0.00000e+00 2.32723e+02 159.565 5.69951e+01 159.565 0.9723 
1 1 1 11  48  6  o 3  6.14084e+00 1.32875e+00 1.17916e+02 183.065 -6.30731e+00 -3.37766e-01 0.00000e+00 0.00000e+00 9.53140e+01 183.065 2.26021e+01 3.065   0.9170 
1 1 1 11  48  7  o 18 4.64520e+00 1.39999e+00 3.19863e+01 127.757 -8.65071e-01 1.11698e+00  0.00000e+00 0.00000e+00 6.89509e+01 127.757 3.69646e+01 127.757 0.5738 
1 1 1 11  48  8  o 12 7.14881e+00 1.48542e+00 1.69843e+02 156.017 -1.08065e+01 4.80742e+00  0.00000e+00 0.00000e+00 8.91510e+01 156.017 8.06922e+01 336.017 0.9567 
1 1 1 11  48  9  o 6  5.63185e+00 1.48648e+00 8.27828e+01 188.767 -4.80371e+00 -7.40839e-01 0.00000e+00 0.00000e+00 1.07014e+02 188.767 2.42316e+01 188.767 0.8900 
1 1 1 11  48  10 o 1  7.55710e+00 1.72589e+00 1.08051e+02 156.053 -6.80392e+00 3.02176e+00  0.00000e+00 0.00000e+00 1.58078e+02 156.053 5.00269e+01 156.053 0.9302 
1 1 1 11  48  11 o 19 6.85582e+00 1.45938e+00 1.88279e+02 280.705 2.93564e+00  -1.55292e+01 0.00000e+00 0.00000e+00 6.28738e+01 280.705 1.25406e+02 100.705 0.9678 
1 1 1 11  49  0  o 14 6.90967e+00 1.42798e+00 8.27924e+01 107.074 -1.04935e+00 3.41643e+00  0.00000e+00 0.00000e+00 1.37887e+02 107.074 5.50944e+01 107.074 0.8449 
1 1 1 11  49  1  o 15 1.13771e+01 1.12177e+00 2.39576e+02 216.213 -1.62290e+01 -1.18836e+01 0.00000e+00 0.00000e+00 1.79842e+02 216.213 5.97337e+01 36.213  0.9748 
1 1 1 11  49  2  o 6  1.16191e+01 1.51229e+00 9.42202e+01 315.279 4.78991e+00  -4.74340e+00 0.00000e+00 0.00000e+00 3.11283e+02 315.279 2.17063e+02 315.279 0.9225 
1 1 1 11  49  3  o 12 1.16243e+01 1.19519e+00 2.24824e+02 51.667  1.26046e+01  1.59412e+01  0.00000e+00 0.00000e+00 2.04096e+02 51.667  2.07280e+01 231.667 0.9751 
1 1 1 11  49  4  o 4  1.19246e+01 9.01158e-01 1.65917e+02 339.044 1.65528e+01  -6.33936e+00 0.00000e+00 0.00000e+00 2.72511e+02 339.044 1.06594e+02 339.044 0.9714 
1 1 1 11  49  5  o 16 9.18573e+00 1.14678e+00 2.26554e+02 56.299  1.03351e+01  1.54959e+01  0.00000e+00 0.00000e+00 1.11720e+02 56.299  1.14834e+02 236.299 0.9728 
1 1 1 11  49  6  o 6  8.64664e+00 1.22341e+00 1.66030e+02 337.592 1.22917e+01  -5.06820e+00 0.00000e+00 0.00000e+00 1.48775e+02 337.592 1.72550e+01 157.592 0.9616 
1 1 1 11  49  7  o 12 1.00998e+01 1.34711e+00 1.98197e+02 300.926 9.60657e+00  -1.60350e+01 0.00000e+00 0.00000e+00 1.73834e+02 300.926 2.43632e+01 120.926 0.9729 
1 1 1 11  49  8  o 16 3.34488e+00 1.11589e+00 7.24555e+01 238.325 -1.44113e+00 -2.33571e+00 0.00000e+00 0.00000e+00 2.74876e+01 238.325 4.49678e+01 58.326  0.7892 
1 1 1 11  49  9  o 9  6.89251e+00 1.51210e+00 1.10834e+02 33.919  6.53384e+00  4.39375e+00  0.00000e+00 0.00000e+00 1.32927e+02 33.919  2.20933e+01 33.919  0.9342 
1 1 1 11  49  10 o 15 3.74196e+00 1.23334e+00 1.51359e+01 297.374 3.42681e-01  -6.61830e-01 0.00000e+00 0.00000e+00 3.42929e+01 297.374 1.91570e+01 297.374 0.3490 
1 1 1 11  49  11 f 0  4.15603e+00 1.34960e+00 2.20909e+01 15.925  1.11385e+00  3.17804e-01  0.00000e+00 0.00000e+00 5.65033e+01 15.925  3.44124e+01 15.925  0.4997 
1 1 1 11  50  0  f 0  5.12609e+00 1.33792e+00 1.34248e+01 119.928 -2.35630e-01 4.09307e-01  0.00000e+00 0.00000e+00 3.10975e+01 119.928 1.76727e+01 119.928 0.2298 
1 1 1 11  50  1  o 2  2.30433e+01 2.27823e+00 4.31766e+02 304.397 2.58915e+01  -3.78176e+01 0.00000e+00 0.00000e+00 4.29993e+02 304.397 1.77206e+00 124.397 0.9890 
1 1 1 11  50  2  o 18 9.37998e+00 1.23962e+00 2.14111e+02 310.867 9.52897e+00  -1.10133e+01 0.00000e+00 0.00000e+00 1.28285e+02 310.867 8.58263e+01 130.867 0.9650 
1 1 1 11  50  3  o 8  5.50065e+00 1.16528e+00 1.32983e+02 243.907 -2.52183e+00 -5.14932e+00 0.00000e+00 0.00000e+00 5.59975e+01 243.907 7.69852e+01 63.907  0.9080 
1 1 1 11  50  4  o 3  3.67882e+00 1.03356e+00 4.95842e+01 303.737 8.78149e-01  -1.31490e+00 0.00000e+00 0.00000e+00 3.61188e+01 303.737 1.34655e+01 123.737 0.6156 
1 1 1 11  50  5  o 19 5.14708e+00 1.17007e+00 6.30018e+01 10.625  2.93344e+00  5.50314e-01  0.00000e+00 0.00000e+00 9.45805e+01 10.625  3.15787e+01 10.625  0.8088 
1 1 1 11  50  6  o 2  1.58134e+01 9.29082e-01 2.78098e+02 13.394  4.65368e+01  1.10811e+01  0.00000e+00 0.00000e+00 3.14237e+02 13.394  3.61391e+01 13.394  0.9895 
1 1 1 11  50  7  o 6  7.34202e+00 1.38877e+00 2.21635e+02 171.947 -1.57806e+01 2.23277e+00  0.00000e+00 0.00000e+00 4.74478e+01 171.947 1.74188e+02 351.947 0.9681 
1 1 1 11  50  8  o 5  4.75018e+00 1.31553e+00 6.55935e+01 24.392  2.98699e+00  1.35447e+00  0.00000e+00 0.00000e+00 8.34313e+01 24.392  1.78377e+01 24.392  0.8287 
1 1 1 11  50  9  o 10 5.50387e+00 1.44862e+00 6.54452e+01 320.511 2.95650e+00  -2.43619e+00 0.00000e+00 0.00000e+00 1.13040e+02 320.511 4.75951e+01 320.511 0.8567 
1 1 1 11  50  10 o 8  4.30704e+00 1.36311e+00 3.49647e+01 269.453 -1.66772e-02 -1.74561e+00 0.00000e+00 0.00000e+00 7.12026e+01 269.453 3.62380e+01 269.453 0.6513 
1 1 1 11  50  11 o 12 5.95786e+00 1.71186e+00 7.94859e+01 218.808 -3.72554e+00 -2.99631e+00 0.00000e+00 0.00000e+00 1.20726e+02 218.808 4.12396e+01 218.808 0.8880 
1 1 1 11  51  0  o 4  1.57602e+01 9.14843e-01 2.24338e+02 272.723 1.24481e+00  -2.61702e+01 0.00000e+00 0.00000e+00 3.59783e+02 272.723 1.35444e+02 272.723 0.9807 
1 1 1 11  51  1  o 9  1.74290e+01 9.54848e-01 2.76973e+02 48.640  2.53301e+01  2.87720e+01  0.00000e+00 0.00000e+00 3.73311e+02 48.640  9.63382e+01 48.640  0.9869 
1 1 1 11  51  2  o 15 1.28359e+01 1.06691e+00 2.15013e+02 153.436 -2.00496e+01 1.00245e+01  0.00000e+00 0.00000e+00 2.59488e+02 153.436 4.44747e+01 153.436 0.9774 
1 1 1 11  51  3  o 18 5.15475e+00 1.16126e+00 1.01593e+02 81.370  6.15838e-01  4.05753e+00  0.00000e+00 0.00000e+00 6.75606e+01 81.370  3.40319e+01 261.370 0.8674 
1 1 1 11  51  4  o 18 1.22959e+01 9.22384e-01 8.99252e+01 51.926  6.12693e+00  7.82122e+00  0.00000e+00 0.00000e+00 3.51275e+02 51.926  2.61350e+02 51.926  0.9483 
1 1 1 11  51  5  o 15 6.15887e+00 1.29757e+00 1.12537e+02 331.357 5.15308e+00  -2.81461e+00 0.00000e+00 0.00000e+00 9.96489e+01 331.357 1.28884e+01 151.357 0.9103 
1 1 1 11  51  6  f 0  8.42309e+00 1.26403e+00 1.08269e+02 239.045 -4.62113e+00 -7.70464e+00 0.00000e+00 0.00000e+00 1.92244e+02 239.045 8.39752e+01 239.045 0.9426 
1 1 1 11  51  7  o 16 1.43678e+01 1.01161e+00 2.38986e+02 145.061 -3.18696e+01 2.22645e+01  0.00000e+00 0.00000e+00 2.97826e+02 145.061 5.88406e+01 145.061 0.9871 
1 1 1 11  51  8  o 8  3.82157e+00 1.19140e+00 1.02016e+02 29.529  3.91011e+00  2.21488e+00  0.00000e+00 0.00000e+00 2.52991e+01 29.529  7.67174e+01 209.529 0.8802 
1 1 1 11  51  9  o 6  1.03672e+01 1.43452e+00 2.20642e+02 326.009 2.04004e+01  -1.37554e+01 0.00000e+00 0.00000e+00 1.63686e+02 326.009 5.69559e+01 146.009 0.9795 
1 1 1 11  51  10 o 8  5.85005e+00 1.57978e+00 1.09151e+02 240.385 -3.37204e+00 -5.93227e+00 0.00000e+00 0.00000e+00 9.53007e+01 240.385 1.38505e+01 60.385  0.9235 
1 1 1 11  51  11 f 0  3.85848e+00 1.30583e+00 8.03385e+01 84.342  4.08354e-01  4.12156e+00  0.00000e+00 0.00000e+00 4.64910e+01 84.342  3.38475e+01 264.342 0.8688 
1 1 1 11  52  0  o 18 3.79593e+01 1.01015e+00 6.67182e+02 63.834  8.71530e+01  1.77384e+02  0.00000e+00 0.00000e+00 7.63514e+02 63.834  9.63321e+01 63.834  0.9975 
1 1 1 11  52  1  o 5  6.12453e+00 1.64781e+00 2.48858e+02 276.635 1.10933e+00  -9.53687e+00 0.00000e+00 0.00000e+00 2.97506e+01 96.635  2.78608e+02 96.635  0.9464 
1 1 1 11  52  2  o 9  9.85355e+00 1.21999e+00 1.35524e+02 259.891 -1.80190e+00 -1.01066e+01 0.00000e+00 0.00000e+00 2.18447e+02 259.891 8.29230e+01 259.891 0.9500 
1 1 1 11  52  3  o 13 1.48062e+01 7.92236e-01 3.17808e+02 129.969 -2.79103e+01 3.32984e+01  0.00000e+00 0.00000e+00 2.35767e+02 129.969 8.20415e+01 309.969 0.9884 
1 1 1 11  52  4  o 19 1.89582e+01 8.15129e-01 3.17810e+02 331.467 5.40756e+01  -2.94012e+01 0.00000e+00 0.00000e+00 3.93615e+02 331.467 7.58049e+01 331.467 0.9918 
1 1 1 11  52  5  o 17 1.00848e+01 1.04686e+00 1.86409e+02 162.800 -1.76049e+01 5.44958e+00  0.00000e+00 0.00000e+00 1.84707e+02 162.800 1.70190e+00 342.800 0.9725 
1 1 1 11  52  6  o 3  1.15967e+01 1.04409e+00 2.06265e+02 256.687 -6.22024e+00 -2.62866e+01 0.00000e+00 0.00000e+00 2.24409e+02 256.687 1.81432e+01 256.687 0.9813 
1 1 1 11  52  7  o 13 5.48835e+00 1.35757e+00 1.31985e+02 310.665 4.79936e+00  -5.58674e+00 0.00000e+00 0.00000e+00 6.10661e+01 310.665 7.09190e+01 130.665 0.9294 
1 1 1 11  52  8  o 15 4.52295e+00 1.32312e+00 5.68637e+01 136.172 -1.96776e+00 1.88886e+00  0.00000e+00 0.00000e+00 7.79622e+01 136.172 2.10985e+01 136.172 0.7876 
1 1 1 11  52  9  o 6  7.38884e+00 1.53453e+00 1.28914e+02 255.506 -2.48694e+00 -9.62026e+00 0.00000e+00 0.00000e+00 1.36237e+02 255.506 7.32265e+00 255.506 0.9483 
1 1 1 11  52  10 o 7  7.70474e+00 1.62903e+00 1.55077e+02 168.188 -1.20762e+01 2.52556e+00  0.00000e+00 0.00000e+00 1.24379e+02 168.188 3.06987e+01 348.188 0.9586 
1 1 1 11  52  11 o 14 4.47120e+00 1.43905e+00 8.95603e+01 16.689  4.64054e+00  1.39127e+00  0.00000e+00 0.00000e+00 6.09227e+01 16.689  2.86376e+01 196.689 0.8897 
1 1 1 11  53  0  o 9  1.10973e+01 9.54497e-01 1.54362e+02 72.539  4.11841e+00  1.30931e+01  0.00000e+00 0.00000e+00 2.49325e+02 72.539  9.49631e+01 72.539  0.9629 
1 1 1 11  53  1  o 1  5.10265e+00 1.12128e+00 1.31600e+02 28.555  4.69150e+00  2.55313e+00  0.00000e+00 0.00000e+00 4.21173e+01 28.555  8.94824e+01 208.555 0.9007 
1 1 1 11  53  2  o 9  1.11737e+01 1.12630e+00 1.63168e+02 196.150 -1.38835e+01 -4.02026e+00 0.00000e+00 0.00000e+00 2.44416e+02 196.150 8.12489e+01 196.150 0.9648 
1 1 1 11  53  3  o 2  6.16656e+00 1.15744e+00 1.10149e+02 51.913  3.48125e+00  4.44188e+00  0.00000e+00 0.00000e+00 1.01252e+02 51.913  8.89703e+00 231.913 0.9064 
1 1 1 11  53  4  o 15 4.33829e+00 1.13256e+00 4.12308e+01 263.442 -1.90939e-01 -1.66093e+00 0.00000e+00 0.00000e+00 6.31191e+01 263.442 2.18884e+01 263.442 0.6358 
1 1 1 11  53  5  o 9  1.63867e+01 8.67747e-01 2.55836e+02 213.428 -3.72340e+01 -2.45778e+01 0.00000e+00 0.00000e+00 3.57174e+02 213.428 1.01338e+02 213.428 0.9887 
1 1 1 11  53  6  o 12 5.53151e+00 1.26998e+00 5.79061e+01 312.794 2.20500e+00  -2.38167e+00 0.00000e+00 0.00000e+00 1.15115e+02 312.794 5.72087e+01 312.794 0.8266 
1 1 1 11  53  7  o 9  5.88170e+00 1.39891e+00 1.29134e+02 32.221  6.56192e+00  4.13556e+00  0.00000e+00 0.00000e+00 7.85501e+01 32.221  5.05841e+01 212.221 0.9331 
1 1 1 11  53  8  o 15 3.28702e+00 1.09623e+00 2.68238e+01 170.040 -1.15414e+00 2.02682e-01  0.00000e+00 0.00000e+00 3.58607e+01 170.040 9.03684e+00 170.040 0.5040 
1 1 1 11  53  9  o 17 5.55051e+00 1.49351e+00 7.21291e+01 127.313 -2.47391e+00 3.24599e+00  0.00000e+00 0.00000e+00 1.09869e+02 127.313 3.77396e+01 127.313 0.8666 
1 1 1 11  53  10 o 5  3.48558e+00 1.17949e+00 1.25232e+02 95.204  -5.28059e-01 5.79774e+00  0.00000e+00 0.00000e+00 5.29746e+00 275.204 1.30529e+02 275.204 0.9095 
1 1 1 11  53  11 o 6  4.63280e+00 1.46053e+00 7.47986e+01 61.883  2.01911e+00  3.77872e+00  0.00000e+00 0.00000e+00 7.82930e+01 61.883  3.49442e+00 61.883  0.8736 
1 1 1 11  54  0  o 13 7.57439e+00 1.09134e+00 1.62836e+02 89.571  7.41886e-02  9.90634e+00  0.00000e+00 0.00000e+00 1.08437e+02 89.571  5.43985e+01 269.571 0.9481 
1 1 1 11  54  1  o 14 5.39167e+00 1.31182e+00 1.96640e+02 293.992 3.20237e+00  -7.19548e+00 0.00000e+00 0.00000e+00 6.29775e+00 113.992 2.02937e+02 113.992 0.9342 
1 1 1 11  54  2  o 8  6.35139e+00 1.15979e+00 1.13564e+02 261.617 -8.62382e-01 -5.85241e+00 0.00000e+00 0.00000e+00 1.05180e+02 261.617 8.38441e+00 81.618  0.9110 
1 1 1 11  54  3  o 8  5.67797e+00 1.20141e+00 4.66346e+01 281.781 4.80672e-01  -2.30472e+00 0.00000e+00 0.00000e+00 1.14008e+02 281.781 6.73731e+01 281.781 0.7482 
1 1 1 11  54  4  o 9  1.43484e+01 8.38975e-01 3.51211e+02 203.648 -4.63968e+01 -2.03167e+01 0.00000e+00 0.00000e+00 1.86111e+02 203.648 1.65100e+02 23.648  0.9901 
1 1 1 11  54  5  o 16 9.75070e+00 1.05066e+00 1.57924e+02 58.780  8.26511e+00  1.36364e+01  0.00000e+00 0.00000e+00 1.99185e+02 58.780  4.12612e+01 58.780  0.9681 
1 1 1 11  54  6  o 12 9.03143e+00 1.17666e+00 1.28010e+02 12.294  1.23131e+01  2.68324e+00  0.00000e+00 0.00000e+00 1.99834e+02 12.294  7.18238e+01 12.294  0.9595 
1 1 1 11  54  7  o 1  1.21427e+01 1.08566e+00 2.47295e+02 253.041 -1.00610e+01 -3.29930e+01 0.00000e+00 0.00000e+00 2.05424e+02 253.041 4.18708e+01 73.041  0.9854 
1 1 1 11  54  8  o 8  8.63530e+00 1.49330e+00 1.20197e+02 175.940 -1.07463e+01 7.62713e-01  0.00000e+00 0.00000e+00 1.90967e+02 175.940 7.07707e+01 175.940 0.9524 
1 1 1 11  54  9  o 11 5.48124e+00 1.49561e+00 9.74405e+01 1.428   5.88151e+00  1.46586e-01  0.00000e+00 0.00000e+00 9.13695e+01 1.428   6.07096e+00 181.428 0.9105 
1 1 1 11  54  10 o 17 6.85759e+00 1.65559e+00 1.54652e+02 204.939 -1.00487e+01 -4.67285e+00 0.00000e+00 0.00000e+00 9.27556e+01 204.939 6.18959e+01 24.939  0.9538 
1 1 1 11  54  11 o 16 3.66301e+00 1.24168e+00 8.22200e+01 284.800 1.02879e+00  -3.89380e+00 0.00000e+00 0.00000e+00 3.75519e+01 284.800 4.46681e+01 104.800 0.8646 
1 1 1 11  55  0  o 9  1.64658e+01 9.10831e-01 3.04300e+02 280.748 7.92471e+00  -4.17495e+01 0.00000e+00 0.00000e+00 3.10240e+02 280.748 5.94004e+00 280.748 0.9882 
1 1 1 11  55  1  o 1  1.60956e+01 9.54491e-01 2.68717e+02 82.617  4.89086e+00  3.77445e+01  0.00000e+00 0.00000e+00 3.31411e+02 82.617  6.26940e+01 82.617  0.9868 
1 1 1 11  55  2  o 19 2.21211e+01 7.49670e-01 3.80351e+02 293.186 3.13305e+01  -7.31487e+01 0.00000e+00 0.00000e+00 4.50517e+02 293.186 7.01654e+01 293.186 0.9937 
1 1 1 11  55  3  o 7  1.21496e+01 8.31197e-01 2.39212e+02 225.843 -2.02334e+01 -2.08375e+01 0.00000e+00 0.00000e+00 2.12176e+02 225.843 2.70357e+01 45.843  0.9826 
1 1 1 11  55  4  o 8  1.29664e+01 8.56907e-01 1.77117e+02 134.226 -1.68309e+01 1.72917e+01  0.00000e+00 0.00000e+00 3.02974e+02 134.226 1.25857e+02 134.226 0.9791 
1 1 1 11  55  5  o 12 3.75876e+00 1.11455e+00 1.34366e+02 196.396 -5.10778e+00 -1.50296e+00 0.00000e+00 0.00000e+00 6.35450e+00 16.396  1.40721e+02 16.396  0.9004 
1 1 1 11  55  6  o 15 8.54267e+00 1.20427e+00 2.30668e+02 207.447 -1.81488e+01 -9.42623e+00 0.00000e+00 0.00000e+00 8.44847e+01 207.447 1.46183e+02 27.447  0.9752 
1 1 1 11  55  7  o 9  1.72444e+01 9.62255e-01 3.38697e+02 241.911 -3.44601e+01 -6.45676e+01 0.00000e+00 0.00000e+00 3.09188e+02 241.911 2.95090e+01 61.911  0.9931 
1 1 1 11  55  8  o 10 9.13938e+00 1.37957e+00 1.45141e+02 167.867 -1.43684e+01 3.08888e+00  0.00000e+00 0.00000e+00 1.88619e+02 167.867 4.34778e+01 167.867 0.9654 
1 1 1 11  55  9  o 12 3.84211e+00 1.21384e+00 8.79298e+01 53.815  2.45238e+00  3.35263e+00  0.00000e+00 0.00000e+00 3.83928e+01 53.815  4.95370e+01 233.815 0.8692 
1 1 1 11  55  10 o 1  3.95817e+00 1.27121e+00 6.68875e+01 154.901 -3.33152e+00 1.56051e+00  0.00000e+00 0.00000e+00 6.03503e+01 154.901 6.53721e+00 334.901 0.8499 
1 1 1 11  55  11 o 5  6.23787e+00 1.58163e+00 8.83884e+01 335.332 5.65596e+00  -2.59767e+00 0.00000e+00 0.00000e+00 1.27607e+02 335.332 3.92186e+01 335.332 0.9157 
1 1 1 11  56  0  o 9  9.43842e+00 1.10054e+00 1.08957e+02 246.219 -3.47116e+00 -7.87738e+00 0.00000e+00 0.00000e+00 2.26081e+02 246.219 1.17124e+02 246.219 0.9400 
1 1 1 11  56  1  o 14 1.39815e+01 1.00188e+00 2.25735e+02 22.290  2.55462e+01  1.04721e+01  0.00000e+00 0.00000e+00 2.92821e+02 22.290  6.70860e+01 22.290  0.9817 
1 1 1 11  56  2  o 7  1.30668e+01 8.07894e-01 2.73638e+02 231.791 -2.26588e+01 -2.87851e+01 0.00000e+00 0.00000e+00 2.13401e+02 231.791 6.02370e+01 51.791  0.9863 
1 1 1 11  56  3  o 12 3.88816e+00 1.05214e+00 3.11910e+01 72.420  3.52737e-01  1.11331e+00  0.00000e+00 0.00000e+00 4.27005e+01 72.420  1.15094e+01 72.420  0.5027 
1 1 1 11  56  4  o 12 6.88856e+00 1.12249e+00 7.55843e+01 62.632  2.31087e+00  4.46429e+00  0.00000e+00 0.00000e+00 1.57278e+02 62.632  8.16939e+01 62.632  0.8940 
1 1 1 11  56  5  o 14 6.10483e+00 1.20621e+00 8.90943e+01 340.659 5.36707e+00  -1.88381e+00 0.00000e+00 0.00000e+00 1.20361e+02 340.659 3.12672e+01 340.659 0.9072 
1 1 1 11  56  6  o 8  6.91899e+00 1.39356e+00 7.97757e+01 158.798 -5.10982e+00 1.98219e+00  0.00000e+00 0.00000e+00 1.56653e+02 158.798 7.68776e+01 158.798 0.9035 
1 1 1 11  56  7  o 5  6.22006e+00 1.42182e+00 4.64157e+01 168.086 -2.87723e+00 6.07050e-01  0.00000e+00 0.00000e+00 1.43093e+02 168.086 9.66770e+01 168.086 0.8055 
1 1 1 11  56  8  f 0  7.17570e+00 1.53086e+00 1.28146e+02 192.510 -9.13233e+00 -2.02628e+00 0.00000e+00 0.00000e+00 1.28320e+02 192.510 1.73591e-01 192.510 0.9449 
1 1 1 11  56  9  o 12 3.80482e+00 1.24256e+00 6.57504e+01 80.180  5.31236e-01  3.06918e+00  0.00000e+00 0.00000e+00 5.19795e+01 80.180  1.37709e+01 260.180 0.8181 
1 1 1 11  56  10 o 17 7.97238e+00 1.75136e+00 1.24944e+02 333.324 8.65389e+00  -4.34788e+00 0.00000e+00 0.00000e+00 1.60520e+02 333.324 3.55757e+01 333.324 0.9469 
1 1 1 11  56  11 o 12 6.67471e+00 1.80641e+00 2.00403e+02 107.936 -4.03015e+00 1.24511e+01  0.00000e+00 0.00000e+00 4.21139e+01 107.936 1.58289e+02 287.936 0.9610 
1 1 1 11  57  0  o 16 6.45591e+00 1.25191e+00 7.75503e+01 35.736  3.25625e+00  2.34299e+00  0.00000e+00 0.00000e+00 1.33051e+02 35.736  5.55006e+01 35.736  0.8640 
1 1 1 11  57  1  o 4  6.70357e+00 1.33254e+00 1.00499e+02 177.573 -5.66795e+00 2.40273e-01  0.00000e+00 0.00000e+00 1.29158e+02 177.573 2.86591e+01 177.573 0.9070 
1 1 1 11  57  2  o 18 1.53238e+01 7.46907e-01 2.95023e+02 256.837 -1.05432e+01 -4.50818e+01 0.00000e+00 0.00000e+00 2.77724e+02 256.837 1.72989e+01 76.837  0.9891 
1 1 1 11  57  3  o 8  8.99080e+00 9.95561e-01 2.28416e+02 143.026 -1.64163e+01 1.23591e+01  0.00000e+00 0.00000e+00 1.03040e+02 143.026 1.25377e+02 323.026 0.9754 
1 1 1 11  57  4  o 4  8.97617e+00 1.05651e+00 2.03228e+02 54.723  1.08798e+01  1.53792e+01  0.00000e+00 0.00000e+00 1.26995e+02 54.723  7.62332e+01 234.723 0.9731 
1 1 1 11  57  5  o 1  3.54659e+00 1.07709e+00 1.35250e+02 193.162 -4.92991e+00 -1.15281e+00 0.00000e+00 0.00000e+00 1.52489e+01 13.162  1.50499e+02 13.162  0.8948 
1 1 1 11  57  6  o 5  4.54029e+00 1.34442e+00 1.09282e+02 167.074 -5.08597e+00 1.16731e+00  0.00000e+00 0.00000e+00 4.49393e+01 167.074 6.43430e+01 347.074 0.8982 
1 1 1 11  57  7  f 0  4.19396e+00 1.25304e+00 3.99773e+01 205.402 -1.66565e+00 -7.90966e-01 0.00000e+00 0.00000e+00 6.63546e+01 205.402 2.63773e+01 205.402 0.6704 
1 1 1 11  57  8  o 13 1.36645e+01 1.20004e+00 1.78997e+02 140.258 -2.31432e+01 1.92423e+01  0.00000e+00 0.00000e+00 3.29108e+02 140.258 1.50110e+02 140.258 0.9832 
1 1 1 11  57  9  o 14 4.71914e+00 1.32325e+00 1.37483e+02 35.656  6.63176e+00  4.75773e+00  0.00000e+00 0.00000e+00 2.96530e+01 35.656  1.07830e+02 215.656 0.9366 
1 1 1 11  57  10 o 3  4.60516e+00 1.43927e+00 2.79806e+01 297.261 6.78001e-01  -1.31579e+00 0.00000e+00 0.00000e+00 7.49595e+01 297.261 4.69789e+01 297.261 0.5912 
1 1 1 11  57  11 o 10 6.34372e+00 1.66741e+00 1.07665e+02 274.206 5.42439e-01  -7.37598e+00 0.00000e+00 0.00000e+00 1.15286e+02 274.206 7.62110e+00 274.206 0.9297 
1 1 1 11  58  0  o 16 8.36661e+00 1.15215e+00 1.50132e+02 287.175 3.35870e+00  -1.08671e+01 0.00000e+00 0.00000e+00 1.51502e+02 287.175 1.36980e+00 287.175 0.9550 
1 1 1 11  58  1  o 1  8.23738e+00 9.94601e-01 1.43626e+02 53.235  6.69654e+00  8.96300e+00  0.00000e+00 0.00000e+00 1.53232e+02 53.235  9.60596e+00 53.235  0.9542 
1 1 1 11  58  2  o 5  7.59782e+00 1.05242e+00 1.68017e+02 62.117  5.57322e+00  1.05336e+01  0.00000e+00 0.00000e+00 1.06713e+02 62.117  6.13041e+01 242.117 0.9571 
1 1 1 11  58  3  o 16 7.66359e+00 1.12696e+00 1.12004e+02 340.386 7.26362e+00  -2.58838e+00 0.00000e+00 0.00000e+00 1.58126e+02 340.386 4.61215e+01 340.386 0.9327 
1 1 1 11  58  4  o 5  1.49986e+01 8.52641e-01 2.32093e+02 94.288  -3.05642e+00 4.07632e+01  0.00000e+00 0.00000e+00 3.27882e+02 94.288  9.57892e+01 94.288  0.9877 
1 1 1 11  58  5  o 4  1.51659e+01 8.93861e-01 2.75775e+02 352.379 5.13084e+01  -6.86492e+00 0.00000e+00 0.00000e+00 2.92033e+02 352.379 1.62575e+01 352.379 0.9903 
1 1 1 11  58  6  o 17 4.34046e+00 1.27988e+00 3.95719e+01 295.789 7.80456e-01  -1.61527e+00 0.00000e+00 0.00000e+00 6.88861e+01 295.789 2.93142e+01 295.789 0.6609 
1 1 1 11  58  7  o 12 8.69151e+00 1.32142e+00 1.37262e+02 211.336 -1.19063e+01 -7.24939e+00 0.00000e+00 0.00000e+00 1.79369e+02 211.336 4.21072e+01 211.336 0.9634 
1 1 1 11  58  8  o 2  4.36855e+00 1.32664e+00 3.97587e+01 301.664 1.02265e+00  -1.65815e+00 0.00000e+00 0.00000e+00 7.40646e+01 301.664 3.43059e+01 301.664 0.6891 
1 1 1 11  58  9  o 8  3.29315e+00 1.10682e+00 5.18089e+01 208.656 -2.14347e+00 -1.17136e+00 0.00000e+00 0.00000e+00 4.26466e+01 208.656 9.16227e+00 28.656  0.7586 
1 1 1 11  58  10 o 15 7.06802e+00 1.67131e+00 1.05590e+02 193.317 -7.60570e+00 -1.80029e+00 0.00000e+00 0.00000e+00 1.43878e+02 193.317 3.82881e+01 193.317 0.9336 
1 1 1 11  58  11 o 13 4.27273e+00 1.38819e+00 5.41897e+01 318.444 2.37404e+00  -2.10453e+00 0.00000e+00 0.00000e+00 7.85542e+01 318.444 2.43645e+01 318.444 0.8220 
1 1 1 11  59  0  o 12 1.11837e+01 1.01356e+00 2.33890e+02 78.576  4.85966e+00  2.40486e+01  0.00000e+00 0.00000e+00 1.79554e+02 78.576  5.43354e+01 258.576 0.9794 
1 1 1 11  59  1  o 15 1.01282e+01 8.77539e-01 9.53104e+01 7.196   9.81886e+00  1.23970e+00  0.00000e+00 0.00000e+00 2.67276e+02 7.196   1.71966e+02 7.196   0.9480 
1 1 1 11  59  2  o 4  7.61290e+00 1.05497e+00 1.23011e+02 252.453 -2.75871e+00 -8.72433e+00 0.00000e+00 0.00000e+00 1.48362e+02 252.453 2.53509e+01 252.453 0.9437 
1 1 1 11  59  3  o 19 3.65173e+00 1.07606e+00 1.06257e+02 37.988  3.00170e+00  2.34414e+00  0.00000e+00 0.00000e+00 1.18203e+01 37.988  9.44363e+01 217.988 0.8557 
1 1 1 11  59  4  o 2  1.13534e+01 9.40591e-01 2.44372e+02 265.894 -2.34046e+00 -3.25998e+01 0.00000e+00 0.00000e+00 1.78105e+02 265.894 6.62679e+01 85.894  0.9846 
1 1 1 11  59  5  o 13 7.90683e+00 1.14471e+00 1.29624e+02 112.548 -4.43158e+00 1.06733e+01  0.00000e+00 0.00000e+00 1.56020e+02 112.548 2.63954e+01 112.548 0.9557 
1 1 1 11  59  6  o 5  7.81937e+00 1.49363e+00 1.15471e+02 236.913 -4.71722e+00 -7.23976e+00 0.00000e+00 0.00000e+00 1.62466e+02 236.913 4.69953e+01 236.913 0.9402 
1 1 1 11  59  7  o 2  5.88581e+00 1.40461e+00 5.86491e+01 10.258  3.73023e+00  6.75060e-01  0.00000e+00 0.00000e+00 1.31600e+02 10.258  7.29505e+01 10.258  0.8550 
1 1 1 11  59  8  o 18 4.69266e+00 1.36019e+00 7.09735e+01 357.480 3.98741e+00  -1.75491e-01 0.00000e+00 0.00000e+00 8.21644e+01 357.480 1.11908e+01 357.480 0.8632 
1 1 1 11  59  9  o 18 1.10634e+01 1.45419e+00 2.65455e+02 210.925 -2.84011e+01 -1.70149e+01 0.00000e+00 0.00000e+00 1.46409e+02 210.925 1.19046e+02 30.926  0.9848 
1 1 1 11  59  10 o 10 5.72329e+00 1.61694e+00 1.26365e+02 18.520  7.62573e+00  2.55453e+00  0.00000e+00 0.00000e+00 7.60294e+01 18.520  5.03354e+01 198.520 0.9356 
1 1 1 11  59  11 o 5  7.26437e+00 1.63137e+00 9.58278e+01 211.389 -6.80586e+00 -4.15256e+00 0.00000e+00 0.00000e+00 1.60852e+02 211.389 6.50245e+01 211.389 0.9350 
1 1 1 11  60  0  o 16 7.44526e+00 1.24334e+00 6.77469e+01 229.611 -2.82981e+00 -3.32634e+00 0.00000e+00 0.00000e+00 1.78475e+02 229.611 1.10728e+02 229.611 0.8763 
1 1 1 11  60  1  o 16 9.75731e+00 8.42637e-01 1.95040e+02 12.822  1.95934e+01  4.45942e+00  0.00000e+00 0.00000e+00 1.64062e+02 12.822  3.09784e+01 192.822 0.9748 
1 1 1 11  60  2  o 16 1.62703e+01 8.87343e-01 2.43270e+02 271.728 1.16599e+00  -3.86591e+01 0.00000e+00 0.00000e+00 3.63238e+02 271.728 1.19968e+02 271.728 0.9870 
1 1 1 11  60  3  o 18 1.45736e+01 8.12469e-01 2.97413e+02 342.327 4.92428e+01  -1.56901e+01 0.00000e+00 0.00000e+00 2.47816e+02 342.327 4.95974e+01 162.327 0.9903 
1 1 1 11  60  4  o 1  3.96941e+00 1.13985e+00 3.95902e+01 223.109 -1.17743e+00 -1.10218e+00 0.00000e+00 0.00000e+00 5.38285e+01 223.109 1.42383e+01 223.109 0.6228 
1 1 1 11  60  5  o 17 5.51472e+00 1.26887e+00 3.01040e+01 280.148 3.11055e-01  -1.73777e+00 0.00000e+00 0.00000e+00 1.06463e+02 280.148 7.63592e+01 280.148 0.6552 
1 1 1 11  60  6  o 17 5.60377e+00 1.19560e+00 9.05946e+01 127.380 -3.54226e+00 4.63636e+00  0.00000e+00 0.00000e+00 1.02095e+02 127.380 1.15007e+01 127.380 0.9097 
1 1 1 11  60  7  o 19 3.69872e+00 1.18625e+00 6.10876e+01 218.742 -2.17668e+00 -1.74645e+00 0.00000e+00 0.00000e+00 4.98171e+01 218.742 1.12704e+01 38.742  0.7932 
1 1 1 11  60  8  o 1  7.59495e+00 1.61342e+00 1.55330e+02 344.246 1.10580e+01  -3.11941e+00 0.00000e+00 0.00000e+00 1.18964e+02 344.246 3.63659e+01 164.246 0.9554 
1 1 1 11  60  9  o 2  8.01615e+00 1.38833e+00 9.06692e+01 230.080 -5.80361e+00 -6.93622e+00 0.00000e+00 0.00000e+00 1.95039e+02 230.080 1.04370e+02 230.080 0.9430 
1 1 1 11  60  10 o 12 5.82294e+00 1.62612e+00 1.14042e+02 67.201  2.69233e+00  6.40521e+00  0.00000e+00 0.00000e+00 8.95009e+01 67.201  2.45409e+01 247.201 0.9249 
1 1 1 11  60  11 o 10 6.08770e+00 1.68030e+00 1.08806e+02 66.413  2.96718e+00  6.79579e+00  0.00000e+00 0.00000e+00 1.05087e+02 66.413  3.71911e+00 246.413 0.9299 
1 1 1 11  61  0  o 18 6.88651e+00 1.17410e+00 1.25302e+02 42.732  5.89804e+00  5.44862e+00  0.00000e+00 0.00000e+00 1.17784e+02 42.732  7.51799e+00 222.732 0.9355 
1 1 1 11  61  1  o 19 5.90709e+00 1.15114e+00 1.15534e+02 91.136  -1.20335e-01 6.06802e+00  0.00000e+00 0.00000e+00 8.81463e+01 91.136  2.73878e+01 271.136 0.9134 
1 1 1 11  61  2  o 9  3.84204e+00 1.05147e+00 5.35296e+01 29.487  1.85164e+00  1.04706e+00  0.00000e+00 0.00000e+00 5.05815e+01 29.487  2.94817e+00 209.487 0.7176 
1 1 1 11  61  3  o 15 8.29607e+00 1.01795e+00 1.52678e+02 166.866 -1.40727e+01 3.28372e+00  0.00000e+00 0.00000e+00 1.49646e+02 166.866 3.03295e+00 346.866 0.9648 
1 1 1 11  61  4  o 17 7.06493e+00 1.14258e+00 1.19562e+02 105.656 -2.52051e+00 8.99342e+00  0.00000e+00 0.00000e+00 1.32642e+02 105.656 1.30796e+01 105.656 0.9448 
1 1 1 11  61  5  o 7  9.35727e+00 1.06037e+00 1.31401e+02 326.132 1.24056e+01  -8.32611e+00 0.00000e+00 0.00000e+00 2.10147e+02 326.132 7.87458e+01 326.132 0.9659 
1 1 1 11  61  6  o 1  9.70903e+00 1.19456e+00 1.99189e+02 29.769  1.90199e+01  1.08791e+01  0.00000e+00 0.00000e+00 1.59264e+02 29.769  3.99242e+01 209.769 0.9769 
1 1 1 11  61  7  o 2  1.63715e+01 9.69949e-01 2.79771e+02 275.723 6.36657e+00  -6.35239e+01 0.00000e+00 0.00000e+00 3.34110e+02 275.723 5.43391e+01 275.723 0.9921 
1 1 1 11  61  8  o 7  7.58455e+00 1.53266e+00 1.62644e+02 151.582 -1.13557e+01 6.14459e+00  0.00000e+00 0.00000e+00 1.12668e+02 151.582 4.99764e+01 331.582 0.9605 
1 1 1 11  61  9  o 18 3.67368e+00 1.20231e+00 9.11119e+01 302.647 2.50379e+00  -3.90800e+00 0.00000e+00 0.00000e+00 3.16614e+01 302.647 5.94506e+01 122.647 0.8843 
1 1 1 11  61  10 o 6  6.48151e+00 1.63389e+00 1.93281e+02 156.966 -1.24165e+01 5.27923e+00  0.00000e+00 0.00000e+00 4.23670e+01 156.966 1.50914e+02 336.966 0.9622 
1 1 1 11  61  11 o 4  5.44260e+00 1.52239e+00 5.97255e+01 59.503  2.06701e+00  3.50951e+00  0.00000e+00 0.00000e+00 1.18389e+02 59.503  5.86631e+01 59.503  0.8663 
1 1 1 11  62  0  o 19 6.63059e+00 1.15913e+00 9.51310e+01 143.305 -4.80331e+00 3.57959e+00  0.00000e+00 0.00000e+00 1.33060e+02 143.305 3.79292e+01 143.305 0.9122 
1 1 1 11  62  1  o 12 2.47433e+01 7.53273e-01 4.17699e+02 8.675   1.18112e+02  1.80204e+01  0.00000e+00 0.00000e+00 5.12260e+02 8.675   9.45604e+01 8.675   0.9958 
1 1 1 11  62  2  o 19 1.11880e+01 8.30465e-01 2.56491e+02 243.017 -1.54038e+01 -3.02536e+01 0.00000e+00 0.00000e+00 1.59651e+02 243.017 9.68399e+01 63.017  0.9852 
1 1 1 11  62  3  o 12 6.87319e+00 1.11296e+00 1.03761e+02 197.032 -7.08315e+00 -2.16981e+00 0.00000e+00 0.00000e+00 1.37601e+02 197.032 3.38401e+01 197.032 0.9298 
1 1 1 11  62  4  o 6  4.43160e+00 1.16152e+00 5.32456e+01 129.688 -1.68368e+00 2.02884e+00  0.00000e+00 0.00000e+00 7.71737e+01 129.688 2.39280e+01 129.688 0.7791 
1 1 1 11  62  5  o 1  4.13177e+00 1.17228e+00 9.03986e+01 138.877 -3.18794e+00 2.78328e+00  0.00000e+00 0.00000e+00 4.57077e+01 138.877 4.46909e+01 318.877 0.8719 
1 1 1 11  62  6  o 9  1.34817e+01 9.97156e-01 1.90816e+02 252.291 -1.07275e+01 -3.35956e+01 0.00000e+00 0.00000e+00 3.11327e+02 252.291 1.20510e+02 252.291 0.9857 
1 1 1 11  62  7  o 7  4.11978e+00 1.22801e+00 7.92169e+01 247.308 -1.57549e+00 -3.76789e+00 0.00000e+00 0.00000e+00 5.57045e+01 247.308 2.35124e+01 67.309  0.8667 
1 1 1 11  62  8  o 9  8.42698e+00 1.75988e+00 1.84689e+02 196.386 -1.42281e+01 -4.18373e+00 0.00000e+00 0.00000e+00 1.22812e+02 196.386 6.18772e+01 16.386  0.9657 
1 1 1 11  62  9  o 2  4.35301e+00 1.34730e+00 4.87714e+01 176.324 -2.71844e+00 1.74672e-01  0.00000e+00 0.00000e+00 8.07227e+01 176.324 3.19514e+01 176.324 0.7873 
1 1 1 11  62  10 o 10 5.05049e+00 1.50603e+00 1.31327e+02 80.474  1.31629e+00  7.84423e+00  0.00000e+00 0.00000e+00 4.70439e+01 80.474  8.42829e+01 260.474 0.9348 
1 1 1 11  62  11 o 15 5.95392e+00 1.69301e+00 1.08394e+02 331.896 6.28031e+00  -3.35389e+00 0.00000e+00 0.00000e+00 1.00044e+02 331.896 8.35003e+00 151.896 0.9268 
1 1 1 11  63  0  o 19 1.73863e+01 8.43322e-01 2.38474e+02 12.038  4.53741e+01  9.67627e+00  0.00000e+00 0.00000e+00 4.10240e+02 12.038  1.71766e+02 12.038  0.9892 
1 1 1 11  63  1  o 18 8.57045e+00 9.65317e-01 2.22306e+02 284.440 5.33282e+00  -2.07094e+01 0.00000e+00 0.00000e+00 9.34549e+01 284.440 1.28851e+02 104.440 0.9763 
1 1 1 11  63  2  f 0  5.66426e+00 1.12325e+00 2.52739e+01 67.779  5.87960e-01  1.43926e+00  0.00000e+00 0.00000e+00 1.05024e+02 67.779  7.97496e+01 67.779  0.6094 
1 1 1 11  63  3  o 10 7.28160e+00 1.13642e+00 7.71862e+01 8.454   6.16636e+00  9.16510e-01  0.00000e+00 0.00000e+00 1.74632e+02 8.454   9.74458e+01 8.454   0.9159 
1 1 1 11  63  4  o 2  1.63839e+01 8.85251e-01 2.69968e+02 305.508 3.27253e+01  -4.58657e+01 0.00000e+00 0.00000e+00 3.43319e+02 305.508 7.33512e+01 305.508 0.9911 
1 1 1 11  63  5  o 10 4.69480e+00 1.20325e+00 3.17743e+01 70.788  5.72431e-01  1.64265e+00  0.00000e+00 0.00000e+00 8.35048e+01 70.788  5.17305e+01 70.788  0.6500 
1 1 1 11  63  6  o 3  1.11376e+01 1.11020e+00 1.73464e+02 306.771 1.49946e+01  -2.00650e+01 0.00000e+00 0.00000e+00 2.38819e+02 306.771 6.53548e+01 306.771 0.9798 
1 1 1 11  63  7  o 18 1.02084e+01 1.19901e+00 2.29080e+02 106.802 -8.12380e+00 2.69033e+01  0.00000e+00 0.00000e+00 1.49681e+02 106.802 7.93987e+01 286.802 0.9820 
1 1 1 11  63  8  o 5  6.61157e+00 1.67091e+00 1.34703e+02 0.185   9.07753e+00  2.92946e-02  0.00000e+00 0.00000e+00 1.00897e+02 0.185   3.38060e+01 180.185 0.9432 
1 1 1 11  63  9  o 1  5.26566e+00 1.50880e+00 6.56314e+01 172.165 -3.99711e+00 5.50014e-01  0.00000e+00 0.00000e+00 1.06408e+02 172.165 4.07764e+01 172.165 0.8648 
1 1 1 11  63  10 o 4  4.01359e+00 1.29364e+00 4.08666e+01 21.940  2.12956e+00  8.57824e-01  0.00000e+00 0.00000e+00 7.14475e+01 21.940  3.05809e+01 21.940  0.7408 
1 1 1 11  63  11 o 5  5.08062e+00 1.52295e+00 4.65242e+01 307.179 1.85146e+00  -2.44107e+00 0.00000e+00 0.00000e+00 1.09771e+02 307.179 6.32473e+01 307.179 0.8146 
1 1 1 11  64  0  o 18 6.03733e+00 1.17700e+00 7.43662e+01 307.021 2.86953e+00  -3.80513e+00 0.00000e+00 0.00000e+00 1.27745e+02 307.021 5.33788e+01 307.021 0.8877 
1 1 1 11  64  1  o 9  6.70584e+00 1.06215e+00 1.14933e+02 168.556 -8.43454e+00 1.70740e+00  0.00000e+00 0.00000e+00 1.22886e+02 168.556 7.95300e+00 168.556 0.9400 
1 1 1 11  64  2  o 19 1.07395e+01 8.67263e-01 1.88034e+02 169.982 -2.28027e+01 4.02811e+00  0.00000e+00 0.00000e+00 2.08454e+02 169.982 2.04205e+01 169.982 0.9782 
1 1 1 11  64  3  o 11 1.02670e+01 9.65296e-01 1.34168e+02 279.169 2.68974e+00  -1.66638e+01 0.00000e+00 0.00000e+00 2.41788e+02 279.169 1.07620e+02 279.169 0.9699 
1 1 1 11  64  4  o 6  1.08089e+01 9.55199e-01 2.28588e+02 204.295 -2.74338e+01 -1.23840e+01 0.00000e+00 0.00000e+00 1.72742e+02 204.295 5.58460e+01 24.295  0.9832 
1 1 1 11  64  5  f 0  6.39144e+00 1.20812e+00 1.18488e+02 111.088 -3.06621e+00 7.95124e+00  0.00000e+00 0.00000e+00 1.08269e+02 111.088 1.02194e+01 291.088 0.9394 
1 1 1 11  64  6  o 9  4.67508e+00 1.25156e+00 1.21095e+02 316.019 4.87297e+00  -4.70270e+00 0.00000e+00 0.00000e+00 4.18797e+01 316.019 7.92155e+01 136.019 0.9229 
1 1 1 11  64  7  o 15 8.46375e+00 1.27669e+00 1.45026e+02 213.169 -1.21953e+01 -7.97084e+00 0.00000e+00 0.00000e+00 1.63514e+02 213.169 1.84881e+01 213.169 0.9650 
1 1 1 11  64  8  o 6  7.96533e+00 1.57280e+00 1.59119e+02 66.892  5.20669e+00  1.22021e+01  0.00000e+00 0.00000e+00 1.30192e+02 66.892  2.89276e+01 246.892 0.9615 
1 1 1 11  64  9  o 7  5.19147e+00 1.48789e+00 1.03233e+02 234.709 -3.62569e+00 -5.12251e+00 0.00000e+00 0.00000e+00 7.64704e+01 234.709 2.67623e+01 54.709  0.9164 
1 1 1 11  64  10 o 5  6.84958e+00 1.63346e+00 1.02247e+02 11.323  7.89358e+00  1.58058e+00  0.00000e+00 0.00000e+00 1.39789e+02 11.323  3.75421e+01 11.323  0.9357 
1 1 1 11  64  11 o 17 4.29976e+00 1.40247e+00 5.68284e+01 144.709 -2.83732e+00 2.00828e+00  0.00000e+00 0.00000e+00 7.95230e+01 144.709 2.26946e+01 144.709 0.8398 
1 1 1 11  65  0  o 4  5.77737e+00 1.15137e+00 1.01331e+02 15.922  6.02865e+00  1.71985e+00  0.00000e+00 0.00000e+00 9.82951e+01 15.922  3.03552e+00 195.922 0.9163 
1 1 1 11  65  1  f 0  3.29792e+00 9.85057e-01 7.88094e+01 111.318 -1.03460e+00 2.65119e+00  0.00000e+00 0.00000e+00 2.04567e+01 111.318 5.83527e+01 291.318 0.7979 
1 1 1 11  65  2  o 14 7.23023e+00 1.05788e+00 9.40735e+01 226.456 -5.19553e+00 -5.46644e+00 0.00000e+00 0.00000e+00 1.59975e+02 226.456 6.59014e+01 226.456 0.9311 
1 1 1 11  65  3  o 12 1.41627e+01 8.43023e-01 2.47357e+02 249.034 -1.62512e+01 -4.24106e+01 0.00000e+00 0.00000e+00 2.81324e+02 249.034 3.39669e+01 249.034 0.9889 
1 1 1 11  65  4  o 15 1.72112e+01 8.13188e-01 3.06235e+02 61.709  3.33471e+01  6.19564e+01  0.00000e+00 0.00000e+00 3.38952e+02 61.709  3.27171e+01 61.709  0.9929 
1 1 1 11  65  5  o 3  8.79490e+00 1.14103e+00 1.46534e+02 270.055 1.61603e-02  -1.66881e+01 0.00000e+00 0.00000e+00 1.75470e+02 270.055 2.89358e+01 270.055 0.9696 
1 1 1 11  65  6  o 19 3.60867e+00 1.07901e+00 9.17664e+01 165.699 -4.21808e+00 1.07523e+00  0.00000e+00 0.00000e+00 2.75985e+01 165.699 6.41679e+01 345.699 0.8758 
1 1 1 11  65  7  o 14 3.38039e+00 1.10015e+00 6.02067e+01 90.741  -3.55805e-02 2.74963e+00  0.00000e+00 0.00000e+00 4.06076e+01 90.741  1.95991e+01 270.741 0.7896 
1 1 1 11  65  8  o 10 4.73623e+00 1.35373e+00 8.32467e+01 113.397 -2.05926e+00 4.75934e+00  0.00000e+00 0.00000e+00 7.72967e+01 113.397 5.95004e+00 293.397 0.8975 
1 1 1 11  65  9  o 15 8.62489e+00 1.56405e+00 1.39934e+02 304.300 7.40966e+00  -1.08621e+01 0.00000e+00 0.00000e+00 1.73138e+02 304.300 3.32038e+01 304.300 0.9612 
1 1 1 11  65  10 o 6  4.89286e+00 1.49794e+00 8.17147e+01 132.826 -3.42053e+00 3.69053e+00  0.00000e+00 0.00000e+00 8.34744e+01 132.826 1.75968e+00 132.826 0.8941 
1 1 1 11  65  11 o 15 6.58029e+00 1.76534e+00 1.27638e+02 17.212  8.67397e+00  2.68705e+00  0.00000e+00 0.00000e+00 1.06673e+02 17.212  2.09652e+01 197.212 0.9432 
1 1 1 11  66  0  o 18 8.37175e+00 9.04713e-01 1.79739e+02 351.343 1.83145e+01  -2.78837e+00 0.00000e+00 0.00000e+00 1.27240e+02 351.343 5.24990e+01 171.343 0.9726 
1 1 1 11  66  1  o 3  6.03835e+00 1.14204e+00 1.01833e+02 265.084 -5.62449e-01 -6.53966e+00 0.00000e+00 0.00000e+00 1.07761e+02 265.084 5.92803e+00 265.084 0.9203 
1 1 1 11  66  2  o 3  5.33204e+00 1.13569e+00 1.01812e+02 314.268 4.28199e+00  -4.39278e+00 0.00000e+00 0.00000e+00 8.21418e+01 314.268 1.96703e+01 134.268 0.9144 
1 1 1 11  66  3  o 2  8.65713e+00 9.98160e-01 2.14587e+02 156.744 -2.03968e+01 8.76576e+00  0.00000e+00 0.00000e+00 1.04690e+02 156.744 1.09896e+02 336.744 0.9772 
1 1 1 11  66  4  o 1  3.83773e+00 1.06640e+00 3.63796e+01 73.660  4.81532e-01  1.64246e+00  0.00000e+00 0.00000e+00 5.69541e+01 73.660  2.05744e+01 73.660  0.6443 
1 1 1 11  66  5  o 16 6.35964e+00 1.26991e+00 9.17010e+01 199.815 -6.50779e+00 -2.34486e+00 0.00000e+00 0.00000e+00 1.30304e+02 199.815 3.86033e+01 199.815 0.9246 
1 1 1 11  66  6  o 17 5.52007e+00 1.32198e+00 5.83314e+01 249.351 -1.27632e+00 -3.38684e+00 0.00000e+00 0.00000e+00 1.18234e+02 249.351 5.99027e+01 249.351 0.8471 
1 1 1 11  66  7  o 17 5.08068e+00 1.30888e+00 1.08196e+02 36.272  5.62492e+00  4.12763e+00  0.00000e+00 0.00000e+00 6.93191e+01 36.272  3.88773e+01 216.272 0.9253 
1 1 1 11  66  8  o 5  3.49404e+00 1.15791e+00 4.66020e+01 268.595 -5.68649e-02 -2.31838e+00 0.00000e+00 0.00000e+00 5.15326e+01 268.595 4.93058e+00 268.595 0.7438 
1 1 1 11  66  9  o 16 5.78285e+00 1.52881e+00 1.40975e+02 1.266   9.41742e+00  2.08143e-01  0.00000e+00 0.00000e+00 6.54348e+01 1.266   7.55400e+01 181.266 0.9453 
1 1 1 11  66  10 f 0  3.91774e+00 1.28431e+00 3.57361e+01 307.911 1.33009e+00  -1.70790e+00 0.00000e+00 0.00000e+00 7.12068e+01 307.911 3.54707e+01 307.911 0.7231 
1 1 1 11  66  11 o 12 7.84018e+00 1.81137e+00 9.53713e+01 171.635 -7.95359e+00 1.16950e+00  0.00000e+00 0.00000e+00 1.81488e+02 171.635 8.61165e+01 171.635 0.9356 
1 1 1 11  67  0  o 17 1.42054e+01 7.07045e-01 2.47342e+02 55.829  2.50900e+01  3.69586e+01  0.00000e+00 0.00000e+00 2.82085e+02 55.829  3.47435e+01 55.829  0.9887 
1 1 1 11  67  1  o 19 7.99183e+00 9.82488e-01 1.19119e+02 334.522 1.04326e+01  -4.97112e+00 0.00000e+00 0.00000e+00 1.68897e+02 334.522 4.97779e+01 334.522 0.9557 
1 1 1 11  67  2  o 17 3.80308e+00 1.04633e+00 9.26976e+01 97.428  -5.57474e-01 4.27614e+00  0.00000e+00 0.00000e+00 3.27654e+01 97.428  5.99321e+01 277.428 0.8745 
1 1 1 11  67  3  o 18 1.23995e+01 8.56597e-01 1.90514e+02 206.779 -2.76419e+01 -1.39504e+01 0.00000e+00 0.00000e+00 2.69744e+02 206.779 7.92305e+01 206.779 0.9837 
1 1 1 11  67  4  o 3  6.97865e+00 1.13729e+00 1.28213e+02 68.950  4.17254e+00  1.08418e+01  0.00000e+00 0.00000e+00 1.23571e+02 68.950  4.64128e+00 248.950 0.9559 
1 1 1 11  67  5  o 2  1.00129e+01 1.08441e+00 2.19921e+02 268.310 -8.46995e-01 -2.87056e+01 0.00000e+00 0.00000e+00 1.51411e+02 268.310 6.85100e+01 88.310  0.9824 
1 1 1 11  67  6  o 19 4.35963e+00 1.21466e+00 9.65181e+01 110.981 -1.97153e+00 5.14110e+00  0.00000e+00 0.00000e+00 5.22575e+01 110.981 4.42606e+01 290.981 0.9039 
1 1 1 11  67  7  o 2  3.81815e+00 1.17072e+00 4.94787e+01 137.565 -1.95638e+00 1.78864e+00  0.00000e+00 0.00000e+00 6.30242e+01 137.565 1.35455e+01 137.565 0.7804 
1 1 1 11  67  8  o 10 1.23259e+01 1.45543e+00 2.19500e+02 333.251 2.74701e+01  -1.38458e+01 0.00000e+00 0.00000e+00 2.38221e+02 333.251 1.87217e+01 333.251 0.9836 
1 1 1 11  67  9  o 13 9.76766e+00 1.49683e+00 1.55715e+02 238.009 -9.72512e+00 -1.55690e+01 0.00000e+00 0.00000e+00 2.02833e+02 238.009 4.71186e+01 238.009 0.9724 
1 1 1 11  67  10 o 17 3.55817e+00 1.19504e+00 6.84045e+01 268.149 -1.24652e-01 -3.85637e+00 0.00000e+00 0.00000e+00 4.68090e+01 268.149 2.15955e+01 88.149  0.8578 
1 1 1 11  67  11 o 12 5.07482e+00 1.53653e+00 4.30453e+01 170.021 -2.95484e+00 5.19903e-01  0.00000e+00 0.00000e+00 1.12082e+02 170.021 6.90364e+01 170.021 0.8100 
1 1 1 11  68  0  o 15 1.51077e+01 6.85659e-01 2.63089e+02 292.446 2.08916e+01  -5.05720e+01 0.00000e+00 0.00000e+00 3.01043e+02 292.446 3.79545e+01 292.446 0.9908 
1 1 1 11  68  1  o 7  4.46171e+00 1.08863e+00 1.33194e+02 253.874 -1.97763e+00 -6.84001e+00 0.00000e+00 0.00000e+00 2.27170e+01 253.874 1.10477e+02 73.874  0.9269 
1 1 1 11  68  2  o 5  4.63241e+00 1.06343e+00 1.31044e+02 215.354 -5.91691e+00 -4.19776e+00 0.00000e+00 0.00000e+00 3.11374e+01 215.354 9.99066e+01 35.354  0.9283 
1 1 1 11  68  3  o 8  7.14142e+00 1.10797e+00 1.02811e+02 12.729  8.59799e+00  1.94225e+00  0.00000e+00 0.00000e+00 1.50833e+02 12.729  4.80223e+01 12.729  0.9414 
1 1 1 11  68  4  o 10 6.45890e+00 1.11799e+00 1.41257e+02 249.724 -4.06004e+00 -1.09900e+01 0.00000e+00 0.00000e+00 9.18244e+01 249.724 4.94326e+01 69.724  0.9563 
1 1 1 11  68  5  o 12 3.06836e+00 9.43325e-01 4.37052e+01 163.785 -1.81565e+00 5.28000e-01  0.00000e+00 0.00000e+00 3.49273e+01 163.785 8.77786e+00 343.785 0.6790 
1 1 1 11  68  6  o 19 5.71926e+00 1.27237e+00 7.44880e+01 338.204 5.07830e+00  -2.03075e+00 0.00000e+00 0.00000e+00 1.20499e+02 338.204 4.60114e+01 338.204 0.9032 
1 1 1 11  68  7  o 1  4.62358e+00 1.30217e+00 7.93416e+01 337.069 4.17827e+00  -1.76759e+00 0.00000e+00 0.00000e+00 7.44871e+01 337.069 4.85459e+00 157.069 0.8814 
1 1 1 11  68  8  o 12 1.35294e+01 1.15372e+00 2.27627e+02 7.008   4.50145e+01  5.53353e+00  0.00000e+00 0.00000e+00 2.77402e+02 7.008   4.97744e+01 7.008   0.9889 
1 1 1 11  68  9  o 8  4.52613e+00 1.33304e+00 1.42831e+02 226.889 -6.01857e+00 -6.42907e+00 0.00000e+00 0.00000e+00 1.79888e+01 226.889 1.24842e+02 46.889  0.9414 
1 1 1 11  68  10 o 17 4.84744e+00 1.43270e+00 5.18061e+01 258.381 -7.05779e-01 -3.43240e+00 0.00000e+00 0.00000e+00 1.02102e+02 258.381 5.02958e+01 258.381 0.8413 
1 1 1 11  69  0  o 14 3.07545e+00 9.18659e-01 1.27026e+02 272.439 2.15556e-01  -5.06009e+00 0.00000e+00 0.00000e+00 2.33276e+01 92.439  1.50353e+02 92.439  0.8949 
1 1 1 11  69  1  o 4  5.35982e+00 1.10042e+00 6.95113e+01 27.009  3.77689e+00  1.92518e+00  0.00000e+00 0.00000e+00 1.06693e+02 27.009  3.71818e+01 27.009  0.8721 
1 1 1 11  69  2  o 14 4.72438e+00 1.10884e+00 4.53144e+01 10.412  2.57814e+00  4.73753e-01  0.00000e+00 0.00000e+00 9.32091e+01 10.412  4.78948e+01 10.412  0.7776 
1 1 1 11  69  3  f 0  9.97062e+00 9.53179e-01 1.27486e+02 158.284 -1.69231e+01 6.73990e+00  0.00000e+00 0.00000e+00 2.38126e+02 158.284 1.10639e+02 158.284 0.9722 
1 1 1 11  69  4  o 8  4.00026e+00 1.13525e+00 5.49504e+01 10.359  2.74608e+00  5.01985e-01  0.00000e+00 0.00000e+00 6.47779e+01 10.359  9.82747e+00 10.359  0.7933 
1 1 1 11  69  5  o 15 5.69361e+00 1.29153e+00 9.96862e+01 88.707  1.46409e-01  6.48564e+00  0.00000e+00 0.00000e+00 9.78249e+01 88.707  1.86123e+00 268.707 0.9193 
1 1 1 11  69  6  o 11 4.78613e+00 1.24244e+00 6.10823e+01 167.108 -3.54294e+00 8.10917e-01  0.00000e+00 0.00000e+00 9.20544e+01 167.108 3.09721e+01 167.108 0.8478 
1 1 1 11  69  7  o 4  5.36669e+00 1.37056e+00 7.74226e+01 142.942 -4.31115e+00 3.25551e+00  0.00000e+00 0.00000e+00 1.05257e+02 142.942 2.78345e+01 142.942 0.9019 
1 1 1 11  69  8  o 16 3.29875e+00 1.10142e+00 3.48684e+01 82.205  2.45584e-01  1.79408e+00  0.00000e+00 0.00000e+00 4.78108e+01 82.205  1.29424e+01 82.205  0.6641 
1 1 1 11  69  9  o 14 6.61781e+00 1.56229e+00 1.40246e+02 184.533 -1.11861e+01 -8.86909e-01 0.00000e+00 0.00000e+00 9.80863e+01 184.533 4.21601e+01 4.533   0.9543 
1 1 1 11  69  10 o 18 5.11394e+00 1.54690e+00 1.02103e+02 30.653  5.73943e+00  3.40141e+00  0.00000e+00 0.00000e+00 7.57402e+01 30.653  2.63624e+01 210.653 0.9217 
1 1 1 11  70  0  o 6  3.56910e+00 9.79309e-01 7.06378e+01 242.578 -1.44088e+00 -2.77716e+00 0.00000e+00 0.00000e+00 3.94910e+01 242.578 3.11468e+01 62.578  0.8191 
1 1 1 11  70  1  o 2  6.14460e+00 1.02577e+00 1.63412e+02 225.065 -9.05259e+00 -9.07329e+00 0.00000e+00 0.00000e+00 5.89392e+01 225.065 1.04473e+02 45.065  0.9602 
1 1 1 11  70  2  o 7  1.15892e+01 8.23835e-01 1.91023e+02 74.933  7.75627e+00  2.88114e+01  0.00000e+00 0.00000e+00 2.38518e+02 74.933  4.74944e+01 74.933  0.9831 
1 1 1 11  70  3  f 0  9.37011e+00 1.02923e+00 1.84305e+02 196.145 -2.23247e+01 -6.46272e+00 0.00000e+00 0.00000e+00 1.61374e+02 196.145 2.29306e+01 16.145  0.9782 
1 1 1 11  70  4  o 5  1.54246e+01 8.55656e-01 2.88142e+02 103.546 -1.53067e+01 6.35342e+01  0.00000e+00 0.00000e+00 2.89217e+02 103.546 1.07505e+00 103.546 0.9923 
1 1 1 11  70  5  o 1  1.02535e+01 1.06273e+00 1.79853e+02 315.664 1.88632e+01  -1.84312e+01 0.00000e+00 0.00000e+00 1.99575e+02 315.664 1.97214e+01 315.664 0.9809 
1 1 1 11  70  6  o 3  6.52004e+00 1.44565e+00 1.53986e+02 261.525 -1.71737e+00 -1.15258e+01 0.00000e+00 0.00000e+00 8.12179e+01 261.525 7.27685e+01 81.525  0.9561 
1 1 1 11  70  7  o 1  8.97180e+00 1.36556e+00 1.21213e+02 81.058  2.10940e+00  1.34053e+01  0.00000e+00 0.00000e+00 2.04597e+02 81.058  8.33843e+01 81.058  0.9624 
1 1 1 11  70  8  o 15 5.98420e+00 1.50963e+00 1.10204e+02 24.085  7.05152e+00  3.15210e+00  0.00000e+00 0.00000e+00 1.00426e+02 24.085  9.77814e+00 204.085 0.9328 
1 1 1 11  70  9  o 5  4.71387e+00 1.42223e+00 4.59456e+01 210.546 -2.51657e+00 -1.48510e+00 0.00000e+00 0.00000e+00 9.70576e+01 210.546 5.11120e+01 210.546 0.8041 
1 1 1 11  70  10 o 15 8.65758e+00 1.68481e+00 1.36843e+02 207.009 -1.20275e+01 -6.13069e+00 0.00000e+00 0.00000e+00 1.77419e+02 207.009 4.05760e+01 207.009 0.9622 
1 1 1 11  71  0  o 7  4.65827e+00 1.07601e+00 1.71529e+02 15.703  9.37811e+00  2.63656e+00  0.00000e+00 0.00000e+00 5.34018e+00 195.703 1.76870e+02 195.703 0.9472 
1 1 1 11  71  1  o 5  7.06892e+00 9.85115e-01 1.33956e+02 250.236 -4.01672e+00 -1.11791e+01 0.00000e+00 0.00000e+00 1.20934e+02 250.236 1.30218e+01 70.236  0.9569 
1 1 1 11  71  2  o 1  7.50933e+00 1.00384e+00 1.60207e+02 4.168   1.67264e+01  1.21905e+00  0.00000e+00 0.00000e+00 1.14276e+02 4.168   4.59317e+01 184.168 0.9697 
1 1 1 11  71  3  o 6  1.25167e+01 8.75889e-01 2.38394e+02 171.292 -4.27838e+01 6.55308e+00  0.00000e+00 0.00000e+00 2.28062e+02 171.292 1.03324e+01 351.292 0.9884 
1 1 1 11  71  4  o 9  1.01355e+01 1.01481e+00 1.68154e+02 64.547  1.03246e+01  2.16914e+01  0.00000e+00 0.00000e+00 2.06050e+02 64.547  3.78956e+01 64.547  0.9790 
1 1 1 11  71  5  o 2  5.35383e+00 1.22743e+00 8.28813e+01 317.905 4.34326e+00  -3.92373e+00 0.00000e+00 0.00000e+00 1.00892e+02 317.905 1.80111e+01 317.905 0.9100 
1 1 1 11  71  6  o 3  6.05534e+00 1.34032e+00 1.08646e+02 101.313 -1.56049e+00 7.80061e+00  0.00000e+00 0.00000e+00 1.04904e+02 101.313 3.74244e+00 281.312 0.9349 
1 1 1 11  71  7  o 8  3.68854e+00 1.23352e+00 5.93589e+01 74.081  7.82447e-01  2.74332e+00  0.00000e+00 0.00000e+00 5.17513e+01 74.081  7.60757e+00 254.081 0.7985 
1 1 1 11  71  8  o 1  5.38230e+00 1.46541e+00 1.38048e+02 123.968 -5.06386e+00 7.51650e+00  0.00000e+00 0.00000e+00 5.34470e+01 123.968 8.46009e+01 303.968 0.9431 
1 1 1 11  71  9  o 18 5.64273e+00 1.50869e+00 4.53036e+01 19.960  3.13938e+00  1.14019e+00  0.00000e+00 0.00000e+00 1.31855e+02 19.960  8.65509e+01 19.960  0.8323 
1 1 1 11  71  10 o 19 8.69255e+00 1.49652e+00 1.86951e+02 320.136 1.70135e+01  -1.42074e+01 0.00000e+00 0.00000e+00 1.33423e+02 320.136 5.35288e+01 140.136 0.9772 
1 1 1 11  72  0  o 19 4.63732e+00 1.01410e+00 6.89929e+01 271.865 1.28671e-01  -3.95152e+00 0.00000e+00 0.00000e+00 8.14891e+01 271.865 1.24962e+01 271.865 0.8617 
1 1 1 11  72  1  o 13 1.25449e+01 7.50585e-01 2.25814e+02 81.421  6.66726e+00  4.41931e+01  0.00000e+00 0.00000e+00 2.41474e+02 81.421  1.56599e+01 81.421  0.9887 
1 1 1 11  72  2  f 0  8.03271e+00 9.91660e-01 1.19067e+02 232.521 -8.02500e+00 -1.04664e+01 0.00000e+00 0.00000e+00 1.71945e+02 232.521 5.28776e+01 232.521 0.9613 
1 1 1 11  72  3  o 13 1.29323e+01 8.70901e-01 2.68519e+02 99.492  -8.37232e+00 5.00730e+01  0.00000e+00 0.00000e+00 2.14170e+02 99.492  5.43490e+01 279.492 0.9901 
1 1 1 11  72  4  o 19 4.31906e+00 1.17970e+00 8.44360e+01 10.359  4.79458e+00  8.76386e-01  0.00000e+00 0.00000e+00 6.05662e+01 10.359  2.38698e+01 190.359 0.8904 
1 1 1 11  72  5  o 15 7.78166e+00 1.22767e+00 1.19928e+02 265.600 -9.56015e-01 -1.24251e+01 0.00000e+00 0.00000e+00 1.61505e+02 265.600 4.15776e+01 265.600 0.9590 
1 1 1 11  72  6  o 7  5.56590e+00 1.32879e+00 1.84098e+02 211.961 -1.12396e+01 -7.01276e+00 0.00000e+00 0.00000e+00 1.77431e+01 211.961 1.66355e+02 31.961  0.9615 
1 1 1 11  72  7  o 3  4.63535e+00 1.38645e+00 1.37653e+02 332.894 7.11141e+00  -3.63995e+00 0.00000e+00 0.00000e+00 2.58449e+01 332.894 1.11808e+02 152.894 0.9351 
1 1 1 11  72  8  o 8  5.35083e+00 1.43988e+00 8.57549e+01 22.360  5.37440e+00  2.21081e+00  0.00000e+00 0.00000e+00 9.77659e+01 22.360  1.20110e+01 22.360  0.9093 
1 1 1 11  72  9  o 7  4.31817e+00 1.34879e+00 8.97184e+01 66.885  2.14700e+00  5.02988e+00  0.00000e+00 0.00000e+00 5.73809e+01 66.885  3.23375e+01 246.885 0.9032 
1 1 1 11  72  10 o 13 5.41318e+00 1.54712e+00 8.17373e+01 6.127   5.99395e+00  6.43477e-01  0.00000e+00 0.00000e+00 1.04592e+02 6.127   2.28542e+01 6.127   0.9128 
1 1 1 11  73  0  o 19 3.79678e+00 1.02247e+00 6.80959e+01 176.826 -3.48383e+00 1.93192e-01  0.00000e+00 0.00000e+00 5.20583e+01 176.826 1.60376e+01 356.826 0.8405 
1 1 1 11  73  1  o 9  7.51929e+00 9.71723e-01 1.70775e+02 238.418 -9.36610e+00 -1.52351e+01 0.00000e+00 0.00000e+00 1.04408e+02 238.418 6.63670e+01 58.418  0.9716 
1 1 1 11  73  2  o 16 3.71876e+00 9.91186e-01 8.64490e+01 268.442 -1.20236e-01 -4.42079e+00 0.00000e+00 0.00000e+00 3.65764e+01 268.442 4.98726e+01 88.442  0.8780 
1 1 1 11  73  3  o 9  6.67225e+00 1.12701e+00 9.67626e+01 118.633 -4.09671e+00 7.50374e+00  0.00000e+00 0.00000e+00 1.39514e+02 118.633 4.27512e+01 118.633 0.9396 
1 1 1 11  73  4  o 19 1.05331e+01 9.92036e-01 2.44258e+02 0.447   3.56355e+01  2.77845e-01  0.00000e+00 0.00000e+00 1.47212e+02 0.447   9.70468e+01 180.447 0.9859 
1 1 1 11  73  5  o 6  6.77741e+00 1.28059e+00 1.32998e+02 117.729 -5.39603e+00 1.02651e+01  0.00000e+00 0.00000e+00 1.11264e+02 117.729 2.17340e+01 297.729 0.9559 
1 1 1 11  73  6  o 3  7.46790e+00 1.23980e+00 1.08248e+02 276.235 1.18766e+00  -1.08704e+01 0.00000e+00 0.00000e+00 1.60157e+02 276.235 5.19088e+01 276.235 0.9531 
1 1 1 11  73  7  o 2  4.70360e+00 1.42747e+00 3.67970e+01 88.431  5.63669e-02  2.05792e+00  0.00000e+00 0.00000e+00 8.86402e+01 88.431  5.18432e+01 88.431  0.7072 
1 1 1 11  73  8  o 2  5.38261e+00 1.43505e+00 1.06105e+02 52.797  4.57443e+00  6.02597e+00  0.00000e+00 0.00000e+00 8.29398e+01 52.797  2.31655e+01 232.797 0.9314 
1 1 1 11  73  9  o 5  5.77314e+00 1.42418e+00 6.71874e+01 346.954 5.27455e+00  -1.22217e+00 0.00000e+00 0.00000e+00 1.29208e+02 346.954 6.20201e+01 346.954 0.9022 
1 1 1 11  73  10 f 0  4.52996e+00 1.42665e+00 9.94369e+01 243.351 -3.07924e+00 -6.13611e+00 0.00000e+00 0.00000e+00 5.83718e+01 243.351 4.10652e+01 63.351  0.9240 
1 1 1 11  74  0  o 8  4.75066e+00 1.03577e+00 1.07024e+02 132.447 -4.58972e+00 5.01813e+00  0.00000e+00 0.00000e+00 5.80750e+01 132.447 4.89494e+01 312.447 0.9232 
1 1 1 11  74  1  o 9  3.61828e+00 1.02529e+00 8.58663e+01 4.218   4.18633e+00  3.08762e-01  0.00000e+00 0.00000e+00 3.27753e+01 4.218   5.30910e+01 184.218 0.8707 
1 1 1 11  74  2  o 6  2.11732e+01 7.39263e-01 3.30706e+02 121.670 -5.94685e+01 9.63997e+01  0.00000e+00 0.00000e+00 4.63389e+02 121.670 1.32682e+02 121.670 0.9956 
1 1 1 11  74  3  o 11 4.33984e+00 1.15540e+00 1.19394e+02 197.650 -6.69106e+00 -2.12898e+00 0.00000e+00 0.00000e+00 3.20023e+01 197.650 8.73920e+01 17.650  0.9258 
1 1 1 11  74  4  o 11 5.05581e+00 1.24571e+00 7.93352e+01 5.309   4.95558e+00  4.60476e-01  0.00000e+00 0.00000e+00 9.08040e+01 5.309   1.14689e+01 5.309   0.8928 
1 1 1 11  74  5  o 4  5.48061e+00 1.30359e+00 1.08510e+02 44.689  5.22342e+00  5.16707e+00  0.00000e+00 0.00000e+00 8.34705e+01 44.689  2.50396e+01 224.689 0.9292 
1 1 1 11  74  6  o 15 4.49804e+00 1.22067e+00 8.99588e+01 279.953 9.18752e-01  -5.23569e+00 0.00000e+00 0.00000e+00 6.27034e+01 279.953 2.72554e+01 99.953  0.9002 
1 1 1 11  74  7  o 7  6.12910e+00 1.62354e+00 1.22387e+02 212.009 -6.90010e+00 -4.31311e+00 0.00000e+00 0.00000e+00 9.39954e+01 212.009 2.83920e+01 32.009  0.9364 
1 1 1 11  74  8  o 3  1.12430e+01 1.27124e+00 2.24376e+02 355.001 3.71588e+01  -3.25008e+00 0.00000e+00 0.00000e+00 1.93793e+02 355.001 3.05829e+01 175.001 0.9865 
1 1 1 11  74  9  o 11 3.22171e+00 1.08221e+00 3.24173e+01 184.596 -1.88236e+00 -1.51330e-01 0.00000e+00 0.00000e+00 5.00006e+01 184.596 1.75833e+01 184.596 0.6786 
1 1 1 11  74  10 o 16 4.56755e+00 1.41308e+00 7.87450e+01 183.007 -5.68430e+00 -2.98634e-01 0.00000e+00 0.00000e+00 7.74652e+01 183.007 1.27983e+00 3.007   0.9073 
1 1 1 11  75  0  o 13 1.21514e+01 7.55677e-01 2.34750e+02 263.264 -5.15036e+00 -4.36090e+01 0.00000e+00 0.00000e+00 2.17330e+02 263.264 1.74201e+01 83.264  0.9885 
1 1 1 11  75  1  o 1  1.03327e+01 8.23427e-01 1.42482e+02 123.061 -1.24856e+01 1.91813e+01  0.00000e+00 0.00000e+00 2.37954e+02 123.061 9.54721e+01 123.061 0.9779 
1 1 1 11  75  2  o 17 1.39666e+01 7.72554e-01 2.77380e+02 202.689 -5.29928e+01 -2.21553e+01 0.00000e+00 0.00000e+00 2.44054e+02 202.689 3.33264e+01 22.689  0.9913 
1 1 1 11  75  3  o 1  6.62691e+00 1.10390e+00 1.37634e+02 0.149   1.29591e+01  3.36146e-02  0.00000e+00 0.00000e+00 1.02198e+02 0.149   3.54361e+01 180.149 0.9606 
1 1 1 11  75  4  o 6  3.42936e+00 1.04192e+00 2.72366e+01 319.859 1.06202e+00  -8.95604e-01 0.00000e+00 0.00000e+00 4.61057e+01 319.859 1.88691e+01 319.859 0.5675 
1 1 1 11  75  5  o 6  5.24774e+00 1.25559e+00 1.15738e+02 137.878 -6.32384e+00 5.71838e+00  0.00000e+00 0.00000e+00 7.00585e+01 137.878 4.56795e+01 317.878 0.9394 
1 1 1 11  75  6  o 19 8.15375e+00 1.32358e+00 1.26218e+02 11.253  1.31703e+01  2.62057e+00  0.00000e+00 0.00000e+00 1.69452e+02 11.253  4.32334e+01 11.253  0.9620 
1 1 1 11  75  7  o 17 5.08865e+00 1.36762e+00 1.00528e+02 222.303 -4.98381e+00 -4.53537e+00 0.00000e+00 0.00000e+00 7.64235e+01 222.303 2.41043e+01 42.303  0.9225 
1 1 1 11  75  8  o 4  4.37830e+00 1.29508e+00 5.18457e+01 139.160 -2.63240e+00 2.27540e+00  0.00000e+00 0.00000e+00 8.67917e+01 139.160 3.49460e+01 139.160 0.8400 
1 1 1 11  75  9  o 8  3.86056e+00 1.24402e+00 7.39477e+01 115.076 -1.92250e+00 4.10864e+00  0.00000e+00 0.00000e+00 5.43047e+01 115.076 1.96430e+01 295.076 0.8814 
1 1 1 11  75  10 o 7  3.46967e+00 1.18680e+00 7.63457e+01 287.953 1.55208e+00  -4.79022e+00 0.00000e+00 0.00000e+00 4.05805e+01 287.953 3.57651e+01 107.953 0.8942 
1 1 1 11  76  0  o 11 1.00411e+01 8.34149e-01 1.59675e+02 57.866  1.31643e+01  2.09581e+01  0.00000e+00 0.00000e+00 2.10431e+02 57.866  5.07559e+01 57.866  0.9796 
1 1 1 11  76  1  o 12 7.58971e+00 9.71785e-01 1.56924e+02 142.894 -1.28313e+01 9.70650e+00  0.00000e+00 0.00000e+00 1.19747e+02 142.894 3.71769e+01 322.894 0.9684 
1 1 1 11  76  2  o 7  7.46602e+00 1.04363e+00 1.48294e+02 311.891 9.96884e+00  -1.11139e+01 0.00000e+00 0.00000e+00 1.23261e+02 311.891 2.50334e+01 131.891 0.9659 
1 1 1 11  76  3  o 7  6.28158e+00 1.15295e+00 9.50609e+01 99.306  -1.34973e+00 8.23650e+00  0.00000e+00 0.00000e+00 1.26884e+02 99.306  3.18229e+01 99.306  0.9380 
1 1 1 11  76  4  o 8  4.54909e+00 1.14962e+00 6.33588e+01 89.328  4.57932e-02  3.90627e+00  0.00000e+00 0.00000e+00 8.40068e+01 89.328  2.06480e+01 89.328  0.8598 
1 1 1 11  76  5  f 0  4.58731e+00 1.24616e+00 1.75291e+02 311.467 7.29724e+00  -8.25768e+00 0.00000e+00 0.00000e+00 1.04722e+01 131.467 1.85763e+02 131.467 0.9535 
1 1 1 11  76  6  f 0  6.92190e+00 1.27174e+00 1.38137e+02 109.630 -4.51158e+00 1.26493e+01  0.00000e+00 0.00000e+00 1.12813e+02 109.630 2.53232e+01 289.630 0.9620 
1 1 1 11  76  7  o 2  5.29766e+00 1.40345e+00 9.09762e+01 59.752  3.18813e+00  5.46713e+00  0.00000e+00 0.00000e+00 9.21453e+01 59.752  1.16905e+00 59.752  0.9172 
1 1 1 11  76  8  o 12 1.28724e+01 1.24789e+00 2.26768e+02 239.304 -2.26085e+01 -3.80829e+01 0.00000e+00 0.00000e+00 2.52845e+02 239.304 2.60774e+01 239.304 0.9886 
1 1 1 11  76  9  o 6  4.28604e+00 1.38075e+00 5.29948e+01 173.023 -3.36341e+00 4.11629e-01  0.00000e+00 0.00000e+00 8.18810e+01 173.023 2.88862e+01 173.023 0.8351 
1 1 1 11  77  0  o 16 8.87907e+00 9.21983e-01 9.51504e+01 156.401 -1.19583e+01 5.22408e+00  0.00000e+00 0.00000e+00 2.25808e+02 156.401 1.30658e+02 156.401 0.9609 
1 1 1 11  77  1  o 14 6.72051e+00 1.06207e+00 9.97142e+01 83.420  1.02495e+00  8.88516e+00  0.00000e+00 0.00000e+00 1.38622e+02 83.420  3.89077e+01 83.420  0.9423 
1 1 1 11  77  2  o 14 6.25549e+00 1.13959e+00 1.33869e+02 307.745 6.76151e+00  -8.73402e+00 0.00000e+00 0.00000e+00 9.07096e+01 307.745 4.31598e+01 127.746 0.9536 
1 1 1 11  77  3  o 10 3.90370e+00 1.01828e+00 1.16111e+02 169.595 -6.71557e+00 1.23312e+00  0.00000e+00 0.00000e+00 1.96610e+01 169.595 9.64496e+01 349.595 0.9236 
1 1 1 11  77  4  o 4  2.89839e+00 9.48482e-01 3.20149e+01 348.474 1.55512e+00  -3.17126e-01 0.00000e+00 0.00000e+00 3.53404e+01 348.474 3.32549e+00 348.474 0.6169 
1 1 1 11  77  5  o 3  9.92934e+00 1.05149e+00 1.59107e+02 22.545  2.29476e+01  9.52653e+00  0.00000e+00 0.00000e+00 2.07363e+02 22.545  4.82562e+01 22.545  0.9797 
1 1 1 11  77  6  o 2  5.05056e+00 1.34446e+00 1.31587e+02 241.946 -4.08225e+00 -7.66033e+00 0.00000e+00 0.00000e+00 4.73857e+01 241.946 8.42012e+01 61.946  0.9405 
1 1 1 11  77  7  o 8  7.98699e+00 1.40726e+00 1.46862e+02 129.465 -1.00200e+01 1.21703e+01  0.00000e+00 0.00000e+00 1.44378e+02 129.465 2.48471e+00 309.465 0.9677 
1 1 1 11  77  8  o 15 4.82016e+00 1.36343e+00 7.58701e+01 334.139 4.80703e+00  -2.33007e+00 0.00000e+00 0.00000e+00 8.77243e+01 334.139 1.18541e+01 334.139 0.9008 
1 1 1 11  77  9  o 17 5.04807e+00 1.54799e+00 5.84476e+01 310.862 2.66789e+00  -3.08397e+00 0.00000e+00 0.00000e+00 1.06344e+02 310.862 4.78969e+01 310.862 0.8664 
1 1 1 11  78  0  o 8  1.30790e+01 7.44922e-01 2.37666e+02 2.798   5.35486e+01  2.61755e+00  0.00000e+00 0.00000e+00 2.49641e+02 2.798   1.19745e+01 2.798   0.9906 
1 1 1 11  78  1  o 11 5.86044e+00 1.07866e+00 6.88132e+01 165.143 -5.31737e+00 1.41061e+00  0.00000e+00 0.00000e+00 1.30493e+02 165.143 6.16793e+01 165.143 0.9038 
1 1 1 11  78  2  o 2  1.13930e+01 8.42183e-01 2.29057e+02 193.244 -4.22282e+01 -9.93903e+00 0.00000e+00 0.00000e+00 1.94803e+02 193.244 3.42539e+01 13.244  0.9884 
1 1 1 11  78  3  o 1  1.11537e+01 9.16588e-01 2.31017e+02 276.611 4.57818e+00  -3.95037e+01 0.00000e+00 0.00000e+00 1.83615e+02 276.611 4.74026e+01 96.611  0.9873 
1 1 1 11  78  4  o 9  1.89322e+01 8.59698e-01 2.68743e+02 39.424  6.66697e+01  5.48106e+01  0.00000e+00 0.00000e+00 4.40095e+02 39.424  1.71352e+02 39.424  0.9942 
1 1 1 11  78  5  o 12 4.69915e+00 1.18279e+00 1.25951e+02 249.331 -2.98111e+00 -7.90228e+00 0.00000e+00 0.00000e+00 4.02118e+01 249.331 8.57396e+01 69.331  0.9388 
1 1 1 11  78  6  o 10 3.61949e+00 1.13077e+00 6.53895e+01 109.973 -1.24818e+00 3.43435e+00  0.00000e+00 0.00000e+00 5.03365e+01 109.973 1.50529e+01 289.973 0.8488 
1 1 1 11  78  7  o 8  6.61518e+00 1.42875e+00 6.10803e+01 336.233 4.96029e+00  -2.18433e+00 0.00000e+00 0.00000e+00 1.63775e+02 336.233 1.02695e+02 336.233 0.9023 
1 1 1 11  78  8  o 9  3.62438e+00 1.17478e+00 3.22013e+01 150.853 -1.69346e+00 9.44384e-01  0.00000e+00 0.00000e+00 6.16656e+01 150.853 2.94643e+01 150.853 0.6875 
1 1 1 11  78  9  o 10 4.19434e+00 1.38498e+00 7.53957e+01 358.530 5.12693e+00  -1.31559e-01 0.00000e+00 0.00000e+00 6.62113e+01 358.530 9.18440e+00 178.530 0.8963 
1 1 1 11  79  0  o 7  8.85831e+00 8.79017e-01 1.02201e+02 57.508  7.95217e+00  1.24860e+01  0.00000e+00 0.00000e+00 2.19444e+02 57.508  1.17243e+02 57.508  0.9656 
1 1 1 11  79  1  o 5  9.89077e+00 8.20085e-01 2.50674e+02 354.780 4.14952e+01  -3.79071e+00 0.00000e+00 0.00000e+00 1.16912e+02 354.780 1.33762e+02 174.780 0.9879 
1 1 1 11  79  2  o 13 7.04621e+00 1.10142e+00 9.95168e+01 201.261 -9.10840e+00 -3.54416e+00 0.00000e+00 0.00000e+00 1.51691e+02 201.261 5.21739e+01 201.261 0.9474 
1 1 1 11  79  3  o 19 5.77108e+00 1.18770e+00 6.72108e+01 137.712 -4.21096e+00 3.83003e+00  0.00000e+00 0.00000e+00 1.29890e+02 137.712 6.26789e+01 137.712 0.9073 
1 1 1 11  79  4  o 15 5.67750e+00 1.07443e+00 7.74071e+01 103.954 -1.51631e+00 6.10259e+00  0.00000e+00 0.00000e+00 1.18535e+02 103.954 4.11274e+01 103.954 0.9166 
1 1 1 11  79  5  o 8  5.85074e+00 1.29365e+00 1.15514e+02 65.280  3.65554e+00  7.94049e+00  0.00000e+00 0.00000e+00 9.17986e+01 65.280  2.37150e+01 245.280 0.9409 
1 1 1 11  79  6  o 18 2.71018e+00 9.35011e-01 3.06966e+01 140.765 -1.16038e+00 9.47552e-01  0.00000e+00 0.00000e+00 3.01033e+01 140.765 5.93333e-01 320.765 0.5957 
1 1 1 11  79  7  o 16 2.97285e+00 1.00209e+00 5.14073e+01 336.029 2.53422e+00  -1.12678e+00 0.00000e+00 0.00000e+00 3.72415e+01 336.029 1.41658e+01 156.029 0.7917 
1 1 1 11  79  8  o 2  6.68842e+00 1.38100e+00 1.17077e+02 51.620  7.25669e+00  9.16211e+00  0.00000e+00 0.00000e+00 1.23799e+02 51.620  6.72122e+00 51.620  0.9562 
1 1 1 11  79  9  o 4  6.78058e+00 1.93428e+00 1.48222e+02 256.852 -2.29046e+00 -9.80515e+00 0.00000e+00 0.00000e+00 9.41037e+01 256.852 5.41180e+01 76.852  0.9490 
1 1 1 11  80  0  o 9  2.91663e+00 9.00167e-01 3.42862e+01 166.559 -1.59863e+00 3.82066e-01  0.00000e+00 0.00000e+00 3.47597e+01 166.559 4.73524e-01 166.559 0.6297 
1 1 1 11  80  1  o 11 1.39764e+01 7.73736e-01 2.21349e+02 17.787  4.89082e+01  1.56905e+01  0.00000e+00 0.00000e+00 2.99169e+02 17.787  7.78206e+01 17.787  0.9902 
1 1 1 11  80  2  o 11 1.30125e+01 8.24242e-01 2.31171e+02 169.301 -5.19041e+01 9.80644e+00  0.00000e+00 0.00000e+00 2.53751e+02 169.301 2.25809e+01 169.301 0.9905 
1 1 1 11  80  3  o 1  9.06888e+00 9.99546e-01 1.37051e+02 204.563 -1.80603e+01 -8.25460e+00 0.00000e+00 0.00000e+00 1.95545e+02 204.563 5.84943e+01 204.563 0.9745 
1 1 1 11  80  4  o 10 1.02726e+01 9.83820e-01 1.61510e+02 234.935 -1.53858e+01 -2.19205e+01 0.00000e+00 0.00000e+00 2.17896e+02 234.935 5.63851e+01 234.935 0.9811 
1 1 1 11  80  5  o 11 6.21166e+00 1.22647e+00 1.06232e+02 341.963 8.98383e+00  -2.92545e+00 0.00000e+00 0.00000e+00 1.14889e+02 341.963 8.65730e+00 341.963 0.9455 
1 1 1 11  80  6  o 15 5.20111e+00 1.33833e+00 1.18499e+02 81.129  1.34136e+00  8.59407e+00  0.00000e+00 0.00000e+00 6.57145e+01 81.129  5.27842e+01 261.129 0.9406 
1 1 1 11  80  7  o 5  4.43790e+00 1.29733e+00 8.70168e+01 104.579 -1.50224e+00 5.77586e+00  0.00000e+00 0.00000e+00 6.53647e+01 104.579 2.16521e+01 284.579 0.9119 
1 1 1 11  80  8  o 9  1.14868e+01 1.33555e+00 2.06839e+02 286.921 1.06786e+01  -3.51015e+01 0.00000e+00 0.00000e+00 2.19760e+02 286.921 1.29202e+01 286.921 0.9863 
1 1 1 11  80  9  o 13 5.52964e+00 1.46344e+00 4.11964e+01 283.428 7.90716e-01  -3.31181e+00 0.00000e+00 0.00000e+00 1.32856e+02 283.428 9.16591e+01 283.428 0.8360 
1 1 1 11  81  0  o 18 2.78853e+00 8.98757e-01 5.83221e+01 205.527 -2.47478e+00 -1.18184e+00 0.00000e+00 0.00000e+00 2.43729e+01 205.527 3.39493e+01 25.527  0.7890 
1 1 1 11  81  1  o 15 4.67219e+00 1.08814e+00 4.32571e+01 232.988 -1.90496e+00 -2.52688e+00 0.00000e+00 0.00000e+00 1.01058e+02 232.988 5.78013e+01 232.988 0.8214 
1 1 1 11  81  2  o 4  3.00376e+00 9.25954e-01 8.96281e+01 194.461 -4.25885e+00 -1.09833e+00 0.00000e+00 0.00000e+00 9.49157e+00 194.461 8.01365e+01 14.461  0.8773 
1 1 1 11  81  3  o 13 5.51785e+00 1.19531e+00 1.44833e+02 67.507  4.38471e+00  1.05892e+01  0.00000e+00 0.00000e+00 5.35085e+01 67.507  9.13243e+01 247.507 0.9553 
1 1 1 11  81  4  o 5  3.90504e+00 1.12409e+00 9.50441e+01 307.376 3.23783e+00  -4.23856e+00 0.00000e+00 0.00000e+00 3.73118e+01 307.376 5.77323e+01 127.376 0.9006 
1 1 1 11  81  5  o 7  9.88410e+00 1.05541e+00 1.58146e+02 24.399  2.33758e+01  1.06034e+01  0.00000e+00 0.00000e+00 2.06584e+02 24.399  4.84383e+01 24.399  0.9803 
1 1 1 11  81  6  o 17 1.49229e+01 9.56509e-01 2.36615e+02 314.648 4.88142e+01  -4.94185e+01 0.00000e+00 0.00000e+00 3.21104e+02 314.648 8.44887e+01 314.648 0.9928 
1 1 1 11  81  7  o 5  5.40806e+00 1.32961e+00 5.08425e+01 199.605 -3.89397e+00 -1.38699e+00 0.00000e+00 0.00000e+00 1.25976e+02 199.605 7.51335e+01 199.605 0.8685 
1 1 1 11  81  8  o 4  3.50709e+00 1.14460e+00 3.30348e+01 113.873 -9.02799e-01 2.03985e+00  0.00000e+00 0.00000e+00 6.36434e+01 113.873 3.06087e+01 113.873 0.7322 
1 1 1 11  81  9  o 3  6.57682e+00 1.62790e+00 8.89021e+01 128.157 -4.69568e+00 5.97631e+00  0.00000e+00 0.00000e+00 1.41759e+02 128.157 5.28573e+01 128.157 0.9317 
1 1 1 11  82  0  o 9  1.24536e+01 7.56247e-01 1.48461e+02 327.920 2.80751e+01  -1.75977e+01 0.00000e+00 0.00000e+00 3.12406e+02 327.920 1.63945e+02 327.920 0.9848 
1 1 1 11  82  1  o 13 3.24014e+00 9.57450e-01 8.28513e+01 182.949 -4.39247e+00 -2.26272e-01 0.00000e+00 0.00000e+00 2.40073e+01 182.949 5.88440e+01 2.949   0.8773 
1 1 1 11  82  2  o 14 3.72210e+00 1.05281e+00 9.40057e+01 169.506 -4.98137e+00 9.22700e-01  0.00000e+00 0.00000e+00 3.12589e+01 169.506 6.27469e+01 349.506 0.8949 
1 1 1 11  82  3  o 17 5.41314e+00 1.18600e+00 8.28831e+01 85.495  5.24523e-01  6.65706e+00  0.00000e+00 0.00000e+00 1.04813e+02 85.495  2.19299e+01 85.495  0.9217 
1 1 1 11  82  4  f 0  5.35638e+00 1.14804e+00 3.30115e+01 253.435 -7.59992e-01 -2.55509e+00 0.00000e+00 0.00000e+00 1.24571e+02 253.435 9.15592e+01 253.435 0.7819 
1 1 1 11  82  5  o 15 4.30032e+00 1.13654e+00 5.65157e+01 269.429 -3.96762e-02 -3.98032e+00 0.00000e+00 0.00000e+00 8.31091e+01 269.429 2.65934e+01 269.429 0.8628 
1 1 1 11  82  6  o 11 8.86539e+00 1.27562e+00 1.32215e+02 12.782  1.70134e+01  3.85967e+00  0.00000e+00 0.00000e+00 1.91742e+02 12.782  5.95267e+01 12.782  0.9709 
1 1 1 11  82  7  o 9  3.65191e+00 1.15509e+00 7.45157e+01 157.518 -4.26847e+00 1.76649e+00  0.00000e+00 0.00000e+00 4.69572e+01 157.518 2.75585e+01 337.518 0.8837 
1 1 1 11  82  8  o 2  9.98503e+00 1.37679e+00 1.64022e+02 168.602 -2.62023e+01 5.28257e+00  0.00000e+00 0.00000e+00 2.04697e+02 168.602 4.06759e+01 168.602 0.9811 
1 1 1 11  82  9  o 1  6.15671e+00 1.35896e+00 8.66501e+01 343.973 8.58438e+00  -2.46590e+00 0.00000e+00 0.00000e+00 1.31674e+02 343.973 4.50243e+01 343.973 0.9422 
1 1 1 11  83  0  o 16 5.99295e+00 1.04866e+00 1.53932e+02 153.263 -1.19707e+01 6.03040e+00  0.00000e+00 0.00000e+00 6.26524e+01 153.263 9.12799e+01 333.263 0.9619 
1 1 1 11  83  1  o 9  3.82070e+00 1.05764e+00 5.87935e+01 5.969   3.49709e+00  3.65650e-01  0.00000e+00 0.00000e+00 6.21113e+01 5.969   3.31777e+00 5.969   0.8419 
1 1 1 11  83  2  o 4  3.97100e+00 1.09682e+00 5.75530e+01 171.394 -3.40233e+00 5.14887e-01  0.00000e+00 0.00000e+00 6.75583e+01 171.394 1.00053e+01 171.394 0.8380 
1 1 1 11  83  3  o 3  5.86903e+00 1.22154e+00 1.03009e+02 219.052 -6.65127e+00 -5.39602e+00 0.00000e+00 0.00000e+00 1.04405e+02 219.052 1.39661e+00 219.052 0.9397 
1 1 1 11  83  4  o 14 9.00741e+00 1.09946e+00 1.33092e+02 315.125 1.35523e+01  -1.34933e+01 0.00000e+00 0.00000e+00 1.96768e+02 315.125 6.36754e+01 315.125 0.9735 
1 1 1 11  83  5  o 8  6.95712e+00 1.25652e+00 1.20694e+02 87.303  6.00529e-01  1.27501e+01  0.00000e+00 0.00000e+00 1.30591e+02 87.303  9.89707e+00 87.303  0.9600 
1 1 1 11  83  6  o 13 1.08659e+01 1.14668e+00 2.22317e+02 254.709 -1.09475e+01 -4.00411e+01 0.00000e+00 0.00000e+00 1.81596e+02 254.709 4.07210e+01 74.709  0.9879 
1 1 1 11  83  7  o 15 5.13286e+00 1.36518e+00 7.36872e+01 272.832 2.82171e-01  -5.70455e+00 0.00000e+00 0.00000e+00 1.01622e+02 272.832 2.79346e+01 272.832 0.9076 
1 1 1 11  83  8  o 4  1.10572e+01 1.32532e+00 1.85256e+02 88.688  7.92466e-01  3.46076e+01  0.00000e+00 0.00000e+00 2.24766e+02 88.688  3.95097e+01 88.688  0.9854 
1 1 1 11  83  9  o 7  6.77275e+00 1.57733e+00 1.14815e+02 324.698 9.27238e+00  -6.56575e+00 0.00000e+00 0.00000e+00 1.28535e+02 324.698 1.37200e+01 324.698 0.9549 
1 1 1 11  84  0  o 15 4.57094e+00 1.04039e+00 6.29948e+01 212.843 -3.77396e+00 -2.43613e+00 0.00000e+00 0.00000e+00 8.81081e+01 212.843 2.51133e+01 212.843 0.8801 
1 1 1 11  84  1  o 12 9.59354e+00 9.09503e-01 1.18854e+02 261.584 -2.96440e+00 -2.00363e+01 0.00000e+00 0.00000e+00 2.32625e+02 261.584 1.13771e+02 261.584 0.9750 
1 1 1 11  84  2  f 0  1.03787e+01 8.87407e-01 1.29877e+02 109.908 -7.56274e+00 2.08824e+01  0.00000e+00 0.00000e+00 2.51372e+02 109.908 1.21495e+02 109.908 0.9772 
1 1 1 11  84  3  o 15 3.54800e+00 1.01708e+00 8.50347e+01 133.053 -3.42346e+00 3.66436e+00  0.00000e+00 0.00000e+00 3.41948e+01 133.053 5.08399e+01 313.053 0.8937 
1 1 1 11  84  4  f 0  3.54663e+00 1.07713e+00 7.09931e+01 284.269 1.05921e+00  -4.16496e+00 0.00000e+00 0.00000e+00 4.55950e+01 284.269 2.53981e+01 104.269 0.8741 
1 1 1 11  84  5  o 2  3.01830e+00 9.66191e-01 2.42066e+01 356.535 1.35703e+00  -8.21585e-02 0.00000e+00 0.00000e+00 3.93097e+01 356.535 1.51030e+01 356.535 0.5594 
1 1 1 11  84  6  o 15 4.65452e+00 1.16889e+00 8.28842e+01 356.876 6.42813e+00  -3.50871e-01 0.00000e+00 0.00000e+00 7.79760e+01 356.876 4.90820e+00 176.876 0.9187 
1 1 1 11  84  7  o 8  3.80324e+00 1.20619e+00 4.61667e+01 241.280 -1.54432e+00 -2.81844e+00 0.00000e+00 0.00000e+00 7.18241e+01 241.280 2.56574e+01 241.280 0.8246 
1 1 1 11  84  8  o 1  8.47379e+00 1.38761e+00 1.58300e+02 57.418  1.16997e+01  1.83070e+01  0.00000e+00 0.00000e+00 1.53067e+02 57.418  5.23373e+00 237.418 0.9767 
1 1 1 11  84  9  o 9  3.21047e+00 1.08619e+00 4.32534e+01 57.776  1.65546e+00  2.62639e+00  0.00000e+00 0.00000e+00 5.54691e+01 57.776  1.22156e+01 57.776  0.8174 
1 1 1 11  85  0  f 0  1.16063e+01 7.90608e-01 2.50419e+02 67.910  1.89811e+01  4.67679e+01  0.00000e+00 0.00000e+00 1.81085e+02 67.910  6.93338e+01 247.910 0.9900 
1 1 1 11  85  1  o 5  1.25357e+01 8.15965e-01 1.79712e+02 273.445 2.45858e+00  -4.08426e+01 0.00000e+00 0.00000e+00 2.85439e+02 273.445 1.05727e+02 273.445 0.9877 
1 1 1 11  85  2  o 9  8.71726e+00 9.95714e-01 1.75909e+02 142.963 -2.03165e+01 1.53302e+01  0.00000e+00 0.00000e+00 1.45194e+02 142.963 3.07150e+01 322.963 0.9802 
1 1 1 11  85  3  o 3  3.43198e+00 1.01291e+00 3.05988e+01 177.744 -1.79668e+00 7.07894e-02  0.00000e+00 0.00000e+00 5.47661e+01 177.744 2.41673e+01 177.744 0.6617 
1 1 1 11  85  4  o 18 3.76267e+00 1.11175e+00 9.71671e+01 244.096 -2.69138e+00 -5.54177e+00 0.00000e+00 0.00000e+00 3.22560e+01 244.096 6.49111e+01 64.096  0.9148 
1 1 1 11  85  5  o 5  4.07524e+00 1.19496e+00 6.96995e+01 50.382  3.02500e+00  3.65420e+00  0.00000e+00 0.00000e+00 6.62526e+01 50.382  3.44684e+00 230.382 0.8871 
1 1 1 11  85  6  o 10 5.62785e+00 1.35530e+00 1.08760e+02 203.969 -8.51709e+00 -3.78661e+00 0.00000e+00 0.00000e+00 9.12106e+01 203.969 1.75493e+01 23.969  0.9447 
1 1 1 11  85  7  o 11 3.38302e+00 1.09806e+00 4.85824e+01 250.910 -1.11355e+00 -3.21754e+00 0.00000e+00 0.00000e+00 5.77908e+01 250.910 9.20844e+00 250.910 0.8360 
1 1 1 11  85  8  o 4  6.47309e+00 1.43656e+00 1.52654e+02 16.518  1.45879e+01  4.32622e+00  0.00000e+00 0.00000e+00 8.26714e+01 16.518  6.99830e+01 196.518 0.9666 
1 1 1 11  86  0  o 4  8.85515e+00 9.11539e-01 1.55630e+02 169.938 -2.37297e+01 4.21047e+00  0.00000e+00 0.00000e+00 1.69853e+02 169.938 1.42230e+01 169.938 0.9790 
1 1 1 11  86  1  o 2  4.22064e+00 1.12954e+00 1.14909e+02 294.146 3.06612e+00  -6.83976e+00 0.00000e+00 0.00000e+00 3.26259e+01 294.146 8.22832e+01 114.146 0.9307 
1 1 1 11  86  2  o 1  2.85108e+00 9.21693e-01 4.72375e+01 59.781  1.21046e+00  2.07817e+00  0.00000e+00 0.00000e+00 3.35596e+01 59.781  1.36779e+01 239.781 0.7543 
1 1 1 11  86  3  o 3  1.51729e+01 8.37761e-01 2.64501e+02 79.668  1.42851e+01  7.83570e+01  0.00000e+00 0.00000e+00 3.02155e+02 79.668  3.76535e+01 79.668  0.9937 
1 1 1 11  86  4  f 0  5.61325e+00 1.26298e+00 1.37404e+02 260.692 -1.88454e+00 -1.14980e+01 0.00000e+00 0.00000e+00 6.43398e+01 260.692 7.30643e+01 80.692  0.9561 
1 1 1 11  86  5  o 4  3.09668e+00 9.72512e-01 2.79923e+01 44.858  1.20402e+00  1.19807e+00  0.00000e+00 0.00000e+00 4.66997e+01 44.858  1.87074e+01 44.858  0.6415 
1 1 1 11  86  6  o 16 3.65666e+00 1.14448e+00 7.57059e+01 136.710 -3.80472e+00 3.58413e+00  0.00000e+00 0.00000e+00 4.78221e+01 136.710 2.78839e+01 316.710 0.8984 
1 1 1 11  86  7  o 17 7.18357e+00 1.41965e+00 9.52141e+01 234.469 -6.20847e+00 -8.69404e+00 0.00000e+00 0.00000e+00 1.61945e+02 234.469 6.67311e+01 234.469 0.9520 
1 1 1 11  86  8  o 2  3.82694e+00 1.26415e+00 3.51189e+01 38.336  2.08057e+00  1.64529e+00  0.00000e+00 0.00000e+00 7.72163e+01 38.336  4.20974e+01 38.336  0.7806 
1 1 1 11  87  0  o 6  7.63385e+00 9.90724e-01 7.10546e+01 169.628 -9.13175e+00 1.67139e+00  0.00000e+00 0.00000e+00 1.99577e+02 169.628 1.28523e+02 169.628 0.9445 
1 1 1 11  87  1  o 4  1.31500e+01 7.87663e-01 2.09241e+02 321.335 4.22891e+01  -3.38380e+01 0.00000e+00 0.00000e+00 2.79965e+02 321.335 7.07245e+01 321.335 0.9907 
1 1 1 11  87  2  o 6  6.19782e+00 1.13590e+00 1.09017e+02 207.921 -9.77227e+00 -5.17877e+00 0.00000e+00 0.00000e+00 1.13006e+02 207.921 3.98814e+00 207.921 0.9537 
1 1 1 11  87  3  o 12 3.69508e+00 1.10189e+00 4.43450e+01 301.994 1.53674e+00  -2.45990e+00 0.00000e+00 0.00000e+00 6.70531e+01 301.994 2.27081e+01 301.994 0.8023 
1 1 1 11  87  4  o 16 7.81085e+00 1.14582e+00 1.21607e+02 132.936 -1.12078e+01 1.20459e+01  0.00000e+00 0.00000e+00 1.62883e+02 132.936 4.12759e+01 132.936 0.9691 
1 1 1 11  87  5  o 19 3.64954e+00 1.09476e+00 1.74587e+01 81.552  1.66129e-01  1.11847e+00  0.00000e+00 0.00000e+00 4.98714e+01 81.552  3.24127e+01 81.552  0.4908 
1 1 1 11  87  6  o 5  8.01018e+00 1.31724e+00 1.45098e+02 197.253 -1.90305e+01 -5.91013e+00 0.00000e+00 0.00000e+00 1.48376e+02 197.253 3.27800e+00 197.253 0.9746 
1 1 1 11  87  7  o 19 4.84222e+00 1.12541e+00 1.15708e+02 332.403 1.00644e+01  -5.26080e+00 0.00000e+00 0.00000e+00 5.81258e+01 332.403 5.75822e+01 152.403 0.9549 
1 1 1 11  87  8  f 0  3.78029e+00 1.23522e+00 3.17428e+01 112.048 -8.65425e-01 2.13687e+00  0.00000e+00 0.00000e+00 7.37194e+01 112.048 4.19766e+01 112.048 0.7421 
1 1 1 11  88  0  o 16 4.32931e+00 1.06745e+00 8.29100e+01 158.145 -5.72251e+00 2.29525e+00  0.00000e+00 0.00000e+00 6.57185e+01 158.145 1.71915e+01 338.145 0.9149 
1 1 1 11  88  1  o 3  8.55991e+00 9.77848e-01 1.08795e+02 8.495   1.66905e+01  2.49284e+00  0.00000e+00 0.00000e+00 2.02883e+02 8.495   9.40874e+01 8.495   0.9699 
1 1 1 11  88  2  o 19 4.48338e+00 1.14624e+00 5.31294e+01 304.714 2.22845e+00  -3.21661e+00 0.00000e+00 0.00000e+00 9.16857e+01 304.714 3.85563e+01 304.714 0.8601 
1 1 1 11  88  3  o 12 2.77377e+00 9.12754e-01 6.71151e+01 3.306   3.55304e+00  2.05222e-01  0.00000e+00 0.00000e+00 2.08406e+01 3.306   4.62745e+01 183.306 0.8441 
1 1 1 11  88  4  o 7  3.19785e+00 1.02366e+00 6.26034e+01 120.077 -1.89378e+00 3.26992e+00  0.00000e+00 0.00000e+00 4.00624e+01 120.077 2.25410e+01 300.077 0.8544 
1 1 1 11  88  5  o 9  3.68387e+00 1.13062e+00 9.21203e+01 114.227 -2.52218e+00 5.60508e+00  0.00000e+00 0.00000e+00 3.44945e+01 114.227 5.76257e+01 294.227 0.9146 
1 1 1 11  88  6  o 18 3.88720e+00 1.17179e+00 7.00913e+01 347.895 4.83082e+00  -1.03612e+00 0.00000e+00 0.00000e+00 6.02264e+01 347.895 9.86481e+00 167.895 0.8920 
1 1 1 11  88  7  o 10 3.65986e+00 1.10028e+00 6.72133e+01 96.758  -5.91986e-01 4.99598e+00  0.00000e+00 0.00000e+00 5.57782e+01 96.758  1.14351e+01 276.758 0.8941 
1 1 1 11  88  8  o 13 3.77840e+00 1.22224e+00 6.17078e+01 125.143 -2.81059e+00 3.99267e+00  0.00000e+00 0.00000e+00 6.47676e+01 125.143 3.05983e+00 125.143 0.8906 
1 1 1 11  89  0  o 17 5.53749e+00 1.07374e+00 6.00775e+01 328.267 4.89449e+00  -3.02678e+00 0.00000e+00 0.00000e+00 1.28635e+02 328.267 6.85574e+01 328.267 0.9084 
1 1 1 11  89  1  o 9  3.91866e+00 1.00393e+00 1.24822e+02 215.928 -7.52482e+00 -5.45266e+00 0.00000e+00 0.00000e+00 1.40993e+01 215.928 1.10722e+02 35.928  0.9446 
1 1 1 11  89  2  o 17 7.30549e+00 1.10880e+00 1.23956e+02 277.068 1.87575e+00  -1.51292e+01 0.00000e+00 0.00000e+00 1.41176e+02 277.068 1.72199e+01 277.068 0.9666 
1 1 1 11  89  3  o 9  4.96563e+00 1.06098e+00 1.38306e+02 25.996  1.12870e+01  5.50401e+00  0.00000e+00 0.00000e+00 4.05979e+01 25.996  9.77077e+01 205.996 0.9593 
1 1 1 11  89  4  o 18 7.19202e+00 1.23276e+00 1.30529e+02 88.145  4.86810e-01  1.50331e+01  0.00000e+00 0.00000e+00 1.30496e+02 88.145  3.30031e-02 268.145 0.9662 
1 1 1 11  89  5  o 5  3.26776e+00 1.04400e+00 8.04363e+01 258.060 -1.13803e+00 -5.38166e+00 0.00000e+00 0.00000e+00 3.05301e+01 258.060 4.99062e+01 78.060  0.9038 
1 1 1 11  89  6  o 19 3.88725e+00 1.15482e+00 9.27886e+01 49.917  4.49731e+00  5.34400e+00  0.00000e+00 0.00000e+00 4.23733e+01 49.917  5.04154e+01 229.917 0.9254 
1 1 1 11  89  7  o 7  4.54137e+00 1.32112e+00 5.79026e+01 187.653 -4.87772e+00 -6.55451e-01 0.00000e+00 0.00000e+00 9.42379e+01 187.653 3.63352e+01 187.653 0.8915 
1 1 1 11  89  8  o 8  3.44441e+00 1.15253e+00 6.00053e+01 116.234 -2.09701e+00 4.25536e+00  0.00000e+00 0.00000e+00 5.48088e+01 116.234 5.19653e+00 296.234 0.8871 
1 1 1 11  90  0  o 7  9.64692e+00 9.05220e-01 8.69736e+01 133.720 -1.12234e+01 1.17363e+01  0.00000e+00 0.00000e+00 2.63533e+02 133.720 1.76560e+02 133.720 0.9687 
1 1 1 11  90  1  o 6  3.54112e+00 1.04613e+00 8.83890e+01 330.109 4.74069e+00  -2.72501e+00 0.00000e+00 0.00000e+00 3.16237e+01 330.109 5.67653e+01 150.109 0.9032 
1 1 1 11  90  2  f 0  2.77434e+00 9.07500e-01 8.50873e+01 287.277 1.43086e+00  -4.60051e+00 0.00000e+00 0.00000e+00 7.48934e+00 287.277 7.75979e+01 107.277 0.8890 
1 1 1 11  90  3  o 6  6.64890e+00 1.20373e+00 7.88306e+01 27.159  7.57704e+00  3.88727e+00  0.00000e+00 0.00000e+00 1.55664e+02 27.159  7.68338e+01 27.159  0.9393 
1 1 1 11  90  4  o 7  8.14388e+00 1.18362e+00 1.20075e+02 316.054 1.22350e+01  -1.17928e+01 0.00000e+00 0.00000e+00 1.76633e+02 316.054 5.65576e+01 316.054 0.9701 
1 1 1 11  90  5  o 15 5.43094e+00 1.28568e+00 9.23813e+01 70.773  2.91445e+00  8.35654e+00  0.00000e+00 0.00000e+00 9.97191e+01 70.773  7.33772e+00 70.773  0.9417 
1 1 1 11  90  6  o 4  4.49839e+00 1.22615e+00 5.83801e+01 91.478  -1.22479e-01 4.74645e+00  0.00000e+00 0.00000e+00 9.15431e+01 91.478  3.31629e+01 91.478  0.8872 
1 1 1 11  90  7  o 3  3.78658e+00 1.17805e+00 8.50324e+01 198.894 -6.15934e+00 -2.10812e+00 0.00000e+00 0.00000e+00 4.57864e+01 198.894 3.92460e+01 18.894  0.9196 
1 1 1 11  91  0  o 8  5.60486e+00 1.05343e+00 5.33517e+01 108.840 -1.78987e+00 5.24573e+00  0.00000e+00 0.00000e+00 1.36772e+02 108.840 8.34202e+01 108.840 0.9046 
1 1 1 11  91  1  o 2  8.20286e+00 1.03415e+00 1.63039e+02 177.677 -2.49029e+01 1.01027e+00  0.00000e+00 0.00000e+00 1.38442e+02 177.677 2.45976e+01 357.677 0.9797 
1 1 1 11  91  2  o 10 4.99173e+00 1.18118e+00 1.05007e+02 193.960 -8.40670e+00 -2.08974e+00 0.00000e+00 0.00000e+00 7.11472e+01 193.960 3.38597e+01 13.960  0.9404 
1 1 1 11  91  3  o 7  7.62474e+00 1.19613e+00 1.39477e+02 350.734 1.80661e+01  -2.94752e+00 0.00000e+00 0.00000e+00 1.38807e+02 350.734 6.69263e-01 170.734 0.9723 
1 1 1 11  91  4  o 10 3.18263e+00 1.00970e+00 3.45404e+01 95.740  -2.36479e-01 2.35264e+00  0.00000e+00 0.00000e+00 5.50120e+01 95.740  2.04716e+01 95.740  0.7494 
1 1 1 11  91  5  o 18 3.75243e+00 1.13431e+00 3.97927e+01 54.936  1.70384e+00  2.42754e+00  0.00000e+00 0.00000e+00 7.39846e+01 54.936  3.41920e+01 54.936  0.8074 
1 1 1 11  91  6  o 8  3.28120e+00 1.05120e+00 3.67885e+01 59.843  1.32505e+00  2.28058e+00  0.00000e+00 0.00000e+00 5.92292e+01 59.843  2.24407e+01 59.843  0.7792 
1 1 1 11  91  7  o 16 5.51982e+00 1.36076e+00 9.04109e+01 124.306 -5.16355e+00 7.56785e+00  0.00000e+00 0.00000e+00 1.05240e+02 124.306 1.48292e+01 124.306 0.9437 
1 1 1 11  92  0  o 6  4.21800e+00 1.03494e+00 6.90726e+01 154.064 -4.90001e+00 2.38312e+00  0.00000e+00 0.00000e+00 7.36920e+01 154.064 4.61938e+00 154.064 0.9028 
1 1 1 11  92  1  o 2  6.64509e+00 1.02564e+00 1.14813e+02 216.943 -1.12654e+01 -8.47154e+00 0.00000e+00 0.00000e+00 1.25396e+02 216.943 1.05825e+01 216.943 0.9638 
1 1 1 11  92  2  o 15 4.60489e+00 1.13433e+00 8.38005e+01 278.238 9.98555e-01  -6.89714e+00 0.00000e+00 0.00000e+00 7.60375e+01 278.238 7.76295e+00 98.238  0.9252 
1 1 1 11  92  3  o 14 6.57084e+00 1.26338e+00 1.22220e+02 322.615 1.09265e+01  -8.34932e+00 0.00000e+00 0.00000e+00 1.15230e+02 322.615 6.99019e+00 142.615 0.9629 
1 1 1 11  92  4  o 8  4.47837e+00 1.17813e+00 9.69957e+01 212.966 -6.57635e+00 -4.26511e+00 0.00000e+00 0.00000e+00 5.99872e+01 212.966 3.70085e+01 32.966  0.9338 
1 1 1 11  92  5  o 12 4.23957e+00 1.21936e+00 8.71365e+01 354.901 6.87628e+00  -6.13579e-01 0.00000e+00 0.00000e+00 6.00038e+01 354.901 2.71327e+01 174.901 0.9244 
1 1 1 11  92  6  o 19 3.56448e+00 1.09751e+00 5.97103e+01 160.191 -4.52063e+00 1.62828e+00  0.00000e+00 0.00000e+00 5.92237e+01 160.191 4.86626e-01 340.191 0.8887 
1 1 1 11  92  7  o 5  2.98896e+00 9.96101e-01 2.72355e+01 50.238  1.29798e+00  1.55996e+00  0.00000e+00 0.00000e+00 5.16115e+01 50.238  2.43760e+01 50.238  0.7025 
1 1 1 11  93  0  o 10 3.83143e+00 1.01622e+00 5.18428e+01 274.643 3.01438e-01  -3.71180e+00 0.00000e+00 0.00000e+00 7.05038e+01 274.643 1.86610e+01 274.643 0.8520 
1 1 1 11  93  1  o 5  2.92376e+00 8.79022e-01 5.25193e+01 108.245 -1.05002e+00 3.18524e+00  0.00000e+00 0.00000e+00 3.88084e+01 108.245 1.37109e+01 288.245 0.8331 
1 1 1 11  93  2  o 7  2.22167e+00 7.68361e-01 2.70926e+01 290.142 5.24491e-01  -1.42997e+00 0.00000e+00 0.00000e+00 2.30551e+01 290.142 4.03746e+00 110.142 0.6018 
1 1 1 11  93  3  o 4  3.31033e+00 1.02500e+00 4.64246e+01 94.590  -2.71294e-01 3.37896e+00  0.00000e+00 0.00000e+00 5.72988e+01 94.590  1.08741e+01 94.590  0.8351 
1 1 1 11  93  4  o 19 3.16577e+00 1.01085e+00 8.15840e+01 317.432 4.15411e+00  -3.81562e+00 0.00000e+00 0.00000e+00 2.60972e+01 317.432 5.54868e+01 137.432 0.9064 
1 1 1 11  93  5  o 10 2.18363e+00 7.71911e-01 1.28325e+01 308.526 4.82345e-01  -6.05816e-01 0.00000e+00 0.00000e+00 1.67384e+01 308.526 3.90581e+00 308.526 0.3608 
1 1 1 11  93  6  o 14 3.65108e+00 1.12772e+00 4.52107e+01 73.534  1.00691e+00  3.40658e+00  0.00000e+00 0.00000e+00 7.04332e+01 73.534  2.52225e+01 73.534  0.8438 
1 1 1 11  93  7  f 0  5.81971e+00 1.39390e+00 7.68978e+01 354.094 7.91971e+00  -8.19299e-01 0.00000e+00 0.00000e+00 1.27351e+02 354.094 5.04537e+01 354.094 0.9349 
1 1 1 11  94  0  o 17 4.62531e+00 1.04452e+00 2.98442e+01 179.521 -2.82382e+00 2.35958e-02  0.00000e+00 0.00000e+00 1.08122e+02 179.521 7.82779e+01 179.521 0.7961 
1 1 1 11  94  1  o 15 7.08418e+00 9.88543e-01 1.29878e+02 187.633 -1.99766e+01 -2.67730e+00 0.00000e+00 0.00000e+00 1.28999e+02 187.633 8.79696e-01 7.633   0.9749 
1 1 1 11  94  2  o 1  2.55922e+00 8.45159e-01 3.29499e+01 203.775 -1.96763e+00 -8.66794e-01 0.00000e+00 0.00000e+00 3.62364e+01 203.775 3.28650e+00 203.775 0.7209 
1 1 1 11  94  3  o 5  3.95800e+00 1.08399e+00 5.84174e+01 277.743 6.46163e-01  -4.75191e+00 0.00000e+00 0.00000e+00 7.34782e+01 277.743 1.50608e+01 277.743 0.8884 
1 1 1 11  94  4  o 15 1.10643e+01 1.11118e+00 2.32072e+02 33.230  4.27230e+01  2.79893e+01  0.00000e+00 0.00000e+00 1.78949e+02 33.230  5.31228e+01 213.230 0.9902 
1 1 1 11  94  5  o 16 8.43535e+00 1.23951e+00 1.42610e+02 247.046 -9.28956e+00 -2.19337e+01 0.00000e+00 0.00000e+00 1.67202e+02 247.046 2.45918e+01 247.046 0.9788 
1 1 1 11  94  6  o 6  4.43678e+00 1.24928e+00 7.91373e+01 22.567  6.77228e+00  2.81441e+00  0.00000e+00 0.00000e+00 7.55584e+01 22.567  3.57885e+00 202.567 0.9291 
1 1 1 11  95  0  o 15 2.72706e+00 8.75018e-01 2.80294e+01 84.770  1.73480e-01  1.89523e+00  0.00000e+00 0.00000e+00 4.15599e+01 84.770  1.35305e+01 84.770  0.6812 
1 1 1 11  95  1  o 5  3.56297e+00 1.00888e+00 6.86855e+01 80.350  9.16699e-01  5.39128e+00  0.00000e+00 0.00000e+00 5.19162e+01 80.350  1.67693e+01 260.350 0.9032 
1 1 1 11  95  2  o 14 2.83101e+00 8.83937e-01 2.02491e+01 106.765 -4.05065e-01 1.34462e+00  0.00000e+00 0.00000e+00 4.04119e+01 106.765 2.01627e+01 106.765 0.5716 
1 1 1 11  95  3  o 11 3.69883e+00 1.04046e+00 5.97392e+01 325.639 3.97534e+00  -2.71804e+00 0.00000e+00 0.00000e+00 6.35582e+01 325.639 3.81904e+00 325.639 0.8889 
1 1 1 11  95  4  f 0  4.38176e+00 1.11498e+00 6.22708e+01 164.749 -5.44188e+00 1.48373e+00  0.00000e+00 0.00000e+00 8.66946e+01 164.749 2.44239e+01 164.749 0.9064 
1 1 1 11  95  5  o 4  2.86001e+00 9.08253e-01 7.39084e+01 234.762 -3.20345e+00 -4.53473e+00 0.00000e+00 0.00000e+00 2.31673e+01 234.762 5.07412e+01 54.762  0.9048 
1 1 1 11  95  6  o 12 4.16319e+00 1.24020e+00 5.69306e+01 297.719 2.33492e+00  -4.44388e+00 0.00000e+00 0.00000e+00 8.26840e+01 297.719 2.57534e+01 297.719 0.8938 
1 1 1 11  96  0  o 9  6.59469e+00 1.01180e+00 8.37062e+01 58.810  5.87484e+00  9.70433e+00  0.00000e+00 0.00000e+00 1.52115e+02 58.810  6.84088e+01 58.810  0.9549 
1 1 1 11  96  1  o 11 5.84263e+00 1.11069e+00 1.48563e+02 186.838 -1.74666e+01 -2.09449e+00 0.00000e+00 0.00000e+00 6.40181e+01 186.838 8.45452e+01 6.838   0.9711 
1 1 1 11  96  2  o 13 4.84206e+00 1.14474e+00 6.24335e+01 73.232  1.73936e+00  5.77284e+00  0.00000e+00 0.00000e+00 1.03218e+02 73.232  4.07844e+01 73.232  0.9128 
1 1 1 11  96  3  o 2  5.81998e+00 1.17074e+00 1.43638e+02 242.300 -7.48558e+00 -1.42577e+01 0.00000e+00 0.00000e+00 6.76638e+01 242.300 7.59739e+01 62.300  0.9684 
1 1 1 11  96  4  o 6  2.49989e+00 8.38707e-01 5.68295e+01 354.087 4.04741e+00  -4.19173e-01 0.00000e+00 0.00000e+00 2.43623e+01 354.087 3.24673e+01 174.087 0.8661 
1 1 1 11  96  5  o 9  3.14349e+00 1.00739e+00 4.75724e+01 267.353 -1.73999e-01 -3.76414e+00 0.00000e+00 0.00000e+00 5.31071e+01 267.353 5.53473e+00 267.353 0.8540 
1 1 1 11  96  6  o 12 3.30719e+00 1.03481e+00 2.41002e+01 40.787  1.52840e+00  1.31865e+00  0.00000e+00 0.00000e+00 6.28336e+01 40.787  3.87334e+01 40.787  0.7008 
1 1 1 11  97  0  o 4  5.84453e+00 1.03922e+00 1.09227e+02 282.574 2.95970e+00  -1.32690e+01 0.00000e+00 0.00000e+00 1.01385e+02 282.574 7.84119e+00 102.574 0.9625 
1 1 1 11  97  1  o 19 5.60485e+00 1.08151e+00 6.96954e+01 89.244  1.08430e-01  8.21344e+00  0.00000e+00 0.00000e+00 1.27010e+02 89.244  5.73147e+01 89.244  0.9370 
1 1 1 11  97  2  o 8  8.11999e+00 9.91548e-01 1.01412e+02 293.933 7.48330e+00  -1.68604e+01 0.00000e+00 0.00000e+00 1.94468e+02 293.933 9.30558e+01 293.933 0.9725 
1 1 1 11  97  3  o 7  7.73554e+00 1.05658e+00 1.20213e+02 156.679 -2.05145e+01 8.84382e+00  0.00000e+00 0.00000e+00 1.63148e+02 156.679 4.29349e+01 156.679 0.9774 
1 1 1 11  97  4  o 8  3.20341e+00 9.89384e-01 5.09525e+01 261.867 -6.06915e-01 -4.24689e+00 0.00000e+00 0.00000e+00 5.39844e+01 261.867 3.03190e+00 261.867 0.8738 
1 1 1 11  97  5  o 10 3.45552e+00 1.03687e+00 2.82519e+01 153.679 -2.27166e+00 1.12378e+00  0.00000e+00 0.00000e+00 7.13421e+01 153.679 4.30902e+01 153.679 0.7687 
1 1 1 11  98  0  o 4  2.65698e+00 8.54638e-01 2.38890e+01 298.377 7.56232e-01  -1.39996e+00 0.00000e+00 0.00000e+00 3.75590e+01 298.377 1.36700e+01 298.377 0.6179 
1 1 1 11  98  1  o 3  3.84431e+00 9.92900e-01 3.71704e+01 171.612 -3.24829e+00 4.78979e-01  0.00000e+00 0.00000e+00 8.21570e+01 171.612 4.49866e+01 171.612 0.8289 
1 1 1 11  98  2  o 14 2.96437e+00 9.26972e-01 2.09405e+01 99.441  -2.76678e-01 1.66381e+00  0.00000e+00 0.00000e+00 5.00155e+01 99.441  2.90750e+01 99.441  0.6390 
1 1 1 11  98  3  o 13 2.83364e+00 9.15958e-01 6.49600e+01 153.587 -4.30142e+00 2.13644e+00  0.00000e+00 0.00000e+00 2.93873e+01 153.587 3.55727e+01 333.587 0.8886 
1 1 1 11  98  4  o 2  2.95731e+00 9.45149e-01 3.06614e+01 273.828 1.71106e-01  -2.55731e+00 0.00000e+00 0.00000e+00 5.48679e+01 273.828 2.42065e+01 273.828 0.7717 
1 1 1 11  98  5  o 5  3.64122e+00 1.01756e+00 3.38595e+01 93.118  -1.72771e-01 3.17173e+00  0.00000e+00 0.00000e+00 7.83657e+01 93.118  4.45062e+01 93.118  0.8222 
1 1 1 11  99  0  o 19 3.04522e+00 9.00239e-01 2.17690e+01 244.281 -8.01814e-01 -1.66460e+00 0.00000e+00 0.00000e+00 5.47040e+01 244.281 3.29350e+01 244.281 0.6711 
1 1 1 11  99  1  o 8  4.61826e+00 1.02979e+00 4.11055e+01 339.959 4.28861e+00  -1.56437e+00 0.00000e+00 0.00000e+00 1.11417e+02 339.959 7.03116e+01 339.959 0.8822 
1 1 1 11  99  2  f 0  6.60024e+00 1.08102e+00 4.27436e+01 135.858 -4.54995e+00 4.41571e+00  0.00000e+00 0.00000e+00 1.83996e+02 135.858 1.41252e+02 135.858 0.9173 
1 1 1 11  99  3  o 16 3.83642e+00 1.07629e+00 5.58533e+01 236.358 -2.80219e+00 -4.21094e+00 0.00000e+00 0.00000e+00 7.27263e+01 236.358 1.68730e+01 236.358 0.8947 
1 1 1 11  99  4  o 8  4.69114e+00 1.18176e+00 7.65297e+01 120.925 -4.13910e+00 6.90898e+00  0.00000e+00 0.00000e+00 8.79343e+01 120.925 1.14046e+01 120.925 0.9357 
1 1 1 11  99  5  o 11 3.88214e+00 1.13157e+00 7.06725e+01 31.349  5.52782e+00  3.36747e+00  0.00000e+00 0.00000e+00 6.30434e+01 31.349  7.62907e+00 211.349 0.9191 
1 1 1 11  100 0  f 0  3.11796e+00 9.15834e-01 4.12224e+01 304.415 1.85394e+00  -2.70608e+00 0.00000e+00 0.00000e+00 5.54440e+01 304.415 1.42216e+01 304.415 0.8287 
1 1 1 11  100 1  o 17 3.49929e+00 9.95096e-01 3.42001e+01 166.639 -2.82644e+00 6.71321e-01  0.00000e+00 0.00000e+00 7.09249e+01 166.639 3.67249e+01 166.639 0.8027 
1 1 1 11  100 2  o 9  6.33413e+00 1.04809e+00 9.03146e+01 259.997 -2.40974e+00 -1.36621e+01 0.00000e+00 0.00000e+00 1.38112e+02 259.997 4.77969e+01 259.997 0.9633 
1 1 1 11  100 3  o 19 3.87358e+00 9.78866e-01 3.09854e+01 63.976  1.33178e+00  2.72759e+00  0.00000e+00 0.00000e+00 8.68877e+01 63.976  5.59023e+01 63.976  0.8126 
1 1 1 11  100 4  o 4  5.89715e+00 1.19147e+00 8.57868e+01 51.093  7.30869e+00  9.05547e+00  0.00000e+00 0.00000e+00 1.25393e+02 51.093  3.96057e+01 51.093  0.9560 
1 1 1 11  100 5  o 15 3.97997e+00 1.14225e+00 7.88332e+01 148.334 -6.42027e+00 3.95997e+00  0.00000e+00 0.00000e+00 6.00055e+01 148.334 1.88277e+01 328.334 0.9311 
1 1 1 11  101 0  o 6  2.89519e+00 9.09226e-01 4.41179e+01 24.948  3.20476e+00  1.49087e+00  0.00000e+00 0.00000e+00 4.71491e+01 24.948  3.03114e+00 24.948  0.8429 
1 1 1 11  101 1  o 10 6.82301e+00 1.04776e+00 7.39497e+01 239.150 -6.60164e+00 -1.10525e+01 0.00000e+00 0.00000e+00 1.71208e+02 239.150 9.72586e+01 239.150 0.9603 
1 1 1 11  101 2  o 16 3.04085e+00 9.54366e-01 1.99214e+01 91.403  -3.83636e-02 1.56675e+00  0.00000e+00 0.00000e+00 4.97681e+01 91.403  2.98467e+01 91.403  0.6123 
1 1 1 11  101 3  o 18 3.93624e+00 1.08428e+00 6.80321e+01 177.996 -6.45915e+00 2.26031e-01  0.00000e+00 0.00000e+00 6.74001e+01 177.996 6.31978e-01 357.996 0.9190 
1 1 1 11  101 4  o 18 5.95563e+00 1.05292e+00 9.17142e+01 33.330  1.23627e+01  8.13002e+00  0.00000e+00 0.00000e+00 1.23636e+02 33.330  3.19216e+01 33.330  0.9656 
1 1 1 11  102 0  o 4  4.02225e+00 9.53017e-01 3.67516e+01 82.712  4.85902e-01  3.79933e+00  0.00000e+00 0.00000e+00 9.20806e+01 82.712  5.53290e+01 82.712  0.8567 
1 1 1 11  102 1  o 10 4.46362e+00 1.05652e+00 7.90392e+01 187.723 -8.89363e+00 -1.20613e+00 0.00000e+00 0.00000e+00 7.83244e+01 187.723 7.14827e-01 7.723   0.9425 
1 1 1 11  102 2  o 19 4.91918e+00 1.08841e+00 6.74202e+01 211.293 -6.81304e+00 -4.14128e+00 0.00000e+00 0.00000e+00 1.04681e+02 211.293 3.72608e+01 211.293 0.9350 
1 1 1 11  102 3  o 4  3.75598e+00 1.02245e+00 5.85377e+01 354.404 5.76132e+00  -5.64474e-01 0.00000e+00 0.00000e+00 6.92430e+01 354.404 1.07053e+01 354.404 0.9089 
1 1 1 11  102 4  o 1  4.26307e+00 1.08486e+00 6.59420e+01 204.197 -6.53457e+00 -2.93637e+00 0.00000e+00 0.00000e+00 8.20555e+01 204.197 1.61135e+01 204.197 0.9273 
1 1 1 11  103 0  o 13 3.63165e+00 9.70497e-01 8.08402e+01 250.258 -2.67698e+00 -7.45944e+00 0.00000e+00 0.00000e+00 4.60278e+01 250.258 3.48123e+01 70.258  0.9346 
1 1 1 11  103 1  o 7  4.96971e+00 1.13711e+00 7.12191e+01 282.400 1.84996e+00  -8.41430e+00 0.00000e+00 0.00000e+00 1.03474e+02 282.400 3.22553e+01 282.400 0.9400 
1 1 1 11  103 2  o 18 3.34359e+00 1.00299e+00 7.22200e+01 132.837 -4.40860e+00 4.75468e+00  0.00000e+00 0.00000e+00 4.27579e+01 132.837 2.94621e+01 312.837 0.9193 
1 1 1 11  103 3  o 6  3.29874e+00 9.49758e-01 6.31218e+01 334.772 5.53133e+00  -2.60610e+00 0.00000e+00 0.00000e+00 4.97079e+01 334.772 1.34138e+01 154.772 0.9141 
1 1 1 11  103 4  o 18 3.29074e+00 1.00284e+00 4.65423e+01 170.809 -4.64845e+00 7.52112e-01  0.00000e+00 0.00000e+00 6.25988e+01 170.809 1.60565e+01 170.809 0.8862 
1 1 1 11  104 0  o 5  3.85437e+00 1.02569e+00 1.01028e+02 29.902  8.86219e+00  5.09650e+00  0.00000e+00 0.00000e+00 3.57650e+01 29.902  6.52632e+01 209.902 0.9498 
1 1 1 11  104 1  o 11 3.38127e+00 9.56507e-01 4.47544e+01 115.112 -1.92957e+00 4.11690e+00  0.00000e+00 0.00000e+00 6.66936e+01 115.112 2.19392e+01 115.112 0.8817 
1 1 1 11  104 2  o 15 2.95314e+00 9.29345e-01 3.67687e+01 249.927 -1.11789e+00 -3.05933e+00 0.00000e+00 0.00000e+00 5.46001e+01 249.927 1.78314e+01 249.927 0.8273 
1 1 1 11  104 3  o 5  4.23330e+00 1.12518e+00 9.78465e+01 78.641  2.11456e+00  1.05262e+01  0.00000e+00 0.00000e+00 5.29449e+01 78.641  4.49016e+01 258.641 0.9522 
1 1 1 11  104 4  o 13 3.98197e+00 1.09995e+00 6.33663e+01 125.379 -3.83429e+00 5.39954e+00  0.00000e+00 0.00000e+00 7.38615e+01 125.379 1.04952e+01 125.379 0.9211 
1 1 1 11  105 0  o 14 3.63477e+00 1.02352e+00 7.84042e+01 80.868  1.16340e+00  7.23728e+00  0.00000e+00 0.00000e+00 4.77462e+01 80.868  3.06580e+01 260.868 0.9290 
1 1 1 11  105 1  o 5  2.84105e+00 8.86932e-01 5.48918e+01 247.143 -1.89664e+00 -4.49936e+00 0.00000e+00 0.00000e+00 3.96692e+01 247.143 1.52227e+01 67.143  0.8906 
1 1 1 11  105 2  o 19 2.16148e+00 7.38106e-01 2.07943e+01 97.784  -2.42578e-01 1.77462e+00  0.00000e+00 0.00000e+00 3.25647e+01 97.784  1.17704e+01 97.784  0.6603 
1 1 1 11  105 3  o 2  2.68333e+00 8.73155e-01 3.98481e+01 75.625  8.94064e-01  3.48840e+00  0.00000e+00 0.00000e+00 4.50676e+01 75.625  5.21951e+00 75.625  0.8462 
1 1 1 11  106 0  o 1  2.89179e+00 9.08267e-01 6.74689e+01 340.279 6.05677e+00  -2.17118e+00 0.00000e+00 0.00000e+00 3.17400e+01 340.279 3.57288e+01 160.279 0.9186 
1 1 1 11  106 1  o 6  2.50427e+00 8.31489e-01 3.42631e+01 16.834  3.08198e+00  9.32512e-01  0.00000e+00 0.00000e+00 4.29289e+01 16.834  8.66582e+00 16.834  0.8250 
1 1 1 11  106 2  o 13 2.98361e+00 9.38763e-01 7.11769e+01 111.447 -2.43290e+00 6.19297e+00  0.00000e+00 0.00000e+00 3.15762e+01 111.447 3.96007e+01 291.447 0.9214 
1 1 1 11  106 3  o 19 2.89044e+00 9.29660e-01 6.46355e+01 281.129 1.23107e+00  -6.25805e+00 0.00000e+00 0.00000e+00 3.45497e+01 281.129 3.00858e+01 101.129 0.9179 
1 1 1 11  107 0  o 2  3.85310e+00 1.02308e+00 6.60068e+01 77.264  1.64443e+00  7.27567e+00  0.00000e+00 0.00000e+00 6.78278e+01 77.264  1.82099e+00 77.264  0.9303 
1 1 1 11  107 1  o 4  2.96890e+00 8.71915e-01 2.57964e+01 295.908 1.12675e+00  -2.31965e+00 0.00000e+00 0.00000e+00 5.99564e+01 295.908 3.41599e+01 295.908 0.7733 
1 1 1 11  107 2  o 17 2.45551e+00 8.19737e-01 1.98901e+01 359.068 1.90011e+00  -3.09172e-02 0.00000e+00 0.00000e+00 4.25641e+01 359.068 2.26740e+01 359.068 0.6807 
1 1 1 11  108 0  o 2  3.24640e+00 9.62101e-01 8.47167e+01 331.768 7.96240e+00  -4.27517e+00 0.00000e+00 0.00000e+00 2.95390e+01 331.768 5.51778e+01 151.768 0.9429 
1 1 1 11  108 1  o 3  2.37497e+00 7.94663e-01 3.78682e+01 88.888  7.05836e-02  3.63485e+00  0.00000e+00 0.00000e+00 3.73231e+01 88.888  5.45085e-01 268.888 0.8479 
1 1 1 11  109 0  f 0  2.93991e+00 8.77926e-01 3.51477e+01 264.386 -3.54947e-01 -3.61073e+00 0.00000e+00 0.00000e+00 5.78242e+01 264.386 2.26765e+01 264.386 0.8475 
1 1 1 11  109 1  o 1  2.77017e+00 8.69617e-01 3.38304e+01 134.539 -2.45054e+00 2.49030e+00  0.00000e+00 0.00000e+00 5.31122e+01 134.539 1.92818e+01 134.539 0.8408 
1 1 1 11  110 0  o 11 2.54935e+00 8.36834e-01 5.96753e+01 351.002 6.22389e+00  -9.85490e-01 0.00000e+00 0.00000e+00 2.75093e+01 351.002 3.21660e+01 171.002 0.9168 
1 1 1 11  111 0  o 14 5.12037e+00 1.07003e+00 9.63553e+01 146.070 -1.25094e+01 8.41540e+00  0.00000e+00 0.00000e+00 8.81427e+01 146.070 8.21266e+00 326.070 0.9662 
1 1 1 12  0   0  o 16 1.49877e+01 1.39399e+00 3.14480e+02 0.000   7.89696e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.54962e+02 0.000   5.95178e+01 180.000 1.0000 
1 1 1 12  0   1  o 3  2.21678e+01 1.24891e+00 4.28116e+02 180.000 -1.81863e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.14504e+02 180.000 1.36122e+01 0.000   1.0000 
1 1 1 12  0   2  o 14 2.22765e+01 1.28878e+00 4.15855e+02 180.000 -1.92763e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.31231e+02 180.000 1.53757e+01 180.000 1.0000 
1 1 1 12  0   3  o 19 3.23981e+01 1.86565e+00 5.00309e+02 0.000   3.35167e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.32069e+02 0.000   2.31761e+02 0.000   1.0000 
1 1 1 12  0   4  o 5  4.64351e+00 2.70986e+00 2.95805e+01 180.000 -2.65533e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.62616e+01 180.000 1.33190e+01 0.000   0.2595 
1 1 1 12  0   5  o 4  4.23771e+00 2.53510e+00 7.58390e+01 180.000 -7.10414e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.26889e+01 180.000 5.31501e+01 0.000   0.6109 
1 1 1 12  0   6  o 19 1.37601e+01 3.56764e+00 9.01309e+01 180.000 -2.51140e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.26756e+02 180.000 3.36625e+02 180.000 0.9869 
1 1 1 12  0   7  o 4  7.46580e+00 3.64097e+00 1.70686e+02 180.000 -2.72270e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.11062e+02 180.000 5.96230e+01 0.000   0.9914 
1 1 1 12  0   8  o 19 1.78524e+01 1.77324e+00 3.17310e+02 0.000   2.27517e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.62271e+02 0.000   4.49603e+01 0.000   1.0000 
1 1 1 12  0   9  f 0  3.42600e+00 2.26993e+00 2.18113e+01 180.000 -2.75382e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.32206e+01 180.000 8.59074e+00 0.000   0.2686 
1 1 1 12  0   10 o 2  4.14876e+00 2.66236e+00 6.55756e+01 0.000   1.00090e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.47463e+01 0.000   1.08293e+01 180.000 0.7620 
1 1 1 12  0   11 o 1  1.66129e+01 2.12394e+00 2.61066e+02 180.000 -2.08925e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.71147e+02 180.000 1.10082e+02 180.000 1.0000 
1 1 1 12  0   12 o 1  7.62121e+00 3.60794e+00 1.71960e+02 0.000   3.80899e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.17721e+02 0.000   5.42385e+01 180.000 0.9990 
1 1 1 12  1   0  o 9  2.22272e+01 8.51383e-01 4.47950e+02 271.866 1.10380e+00  -3.38768e+01 0.00000e+00 0.00000e+00 3.83994e+02 271.866 6.39565e+01 91.866  0.9851 
1 1 1 12  1   1  o 11 2.58403e+01 8.74697e-01 5.08401e+02 141.939 -3.96836e+01 3.10727e+01  0.00000e+00 0.00000e+00 4.64022e+02 141.939 4.43783e+01 321.939 0.9900 
1 1 1 12  1   2  o 7  1.26403e+01 1.16023e+00 2.28418e+02 305.307 6.67204e+00  -9.42080e+00 0.00000e+00 0.00000e+00 2.30926e+02 305.307 2.50735e+00 305.307 0.9557 
1 1 1 12  1   3  o 16 1.65274e+01 1.38300e+00 2.21503e+02 10.270  1.46972e+01  2.66291e+00  0.00000e+00 0.00000e+00 3.85752e+02 10.270  1.64249e+02 10.270  0.9659 
1 1 1 12  1   4  o 4  1.42257e+01 1.48622e+00 3.05123e+02 245.394 -7.82980e+00 -1.70969e+01 0.00000e+00 0.00000e+00 2.21553e+02 245.394 8.35698e+01 65.394  0.9730 
1 1 1 12  1   5  o 6  1.70653e+01 1.40955e+00 3.32367e+02 149.225 -2.40223e+01 1.43060e+01  0.00000e+00 0.00000e+00 3.05359e+02 149.225 2.70082e+01 329.225 0.9820 
1 1 1 12  1   6  o 7  1.84533e+01 1.75581e+00 3.83627e+02 332.286 3.39719e+01  -1.78463e+01 0.00000e+00 0.00000e+00 3.09536e+02 332.286 7.40911e+01 152.286 0.9869 
1 1 1 12  1   7  o 14 6.55063e+00 1.93230e+00 1.62880e+02 102.389 -1.27936e+00 5.82422e+00  0.00000e+00 0.00000e+00 6.44764e+01 102.389 9.84031e+01 282.389 0.9118 
1 1 1 12  1   8  o 6  5.78265e+00 1.52679e+00 1.04144e+02 342.860 4.14201e+00  -1.27744e+00 0.00000e+00 0.00000e+00 8.85223e+01 342.860 1.56220e+01 162.860 0.8753 
1 1 1 12  1   9  o 12 1.32787e+01 1.54067e+00 1.84708e+02 334.985 1.68607e+01  -7.86763e+00 0.00000e+00 0.00000e+00 3.06974e+02 334.985 1.22265e+02 334.985 0.9727 
1 1 1 12  1   10 o 17 1.81393e+01 1.43371e+00 3.24101e+02 238.663 -2.84210e+01 -4.66758e+01 0.00000e+00 0.00000e+00 3.59964e+02 238.663 3.58623e+01 238.663 0.9908 
1 1 1 12  1   11 o 16 7.13209e+00 1.71906e+00 2.63864e+01 338.121 1.49124e+00  -5.98847e-01 0.00000e+00 0.00000e+00 1.42295e+02 338.121 1.15909e+02 338.121 0.6215 
1 1 1 12  1   12 o 14 4.23624e+00 1.44763e+00 1.09710e+02 4.295   5.26154e+00  3.95151e-01  0.00000e+00 0.00000e+00 3.52556e+01 4.295   7.44547e+01 184.295 0.8994 
1 1 1 12  2   0  o 11 1.34768e+01 1.36728e+00 1.38306e+02 122.571 -3.18010e+00 4.97814e+00  0.00000e+00 0.00000e+00 3.28101e+02 122.571 1.89795e+02 122.571 0.9109 
1 1 1 12  2   1  o 14 1.55335e+01 1.00813e+00 1.84904e+02 206.510 -9.68195e+00 -4.82934e+00 0.00000e+00 0.00000e+00 3.77553e+02 206.510 1.92649e+02 206.510 0.9526 
1 1 1 12  2   2  o 9  3.12638e+01 9.14910e-01 4.60635e+02 91.218  -1.27275e+00 5.98756e+01  0.00000e+00 0.00000e+00 7.18226e+02 91.218  2.57591e+02 91.218  0.9916 
1 1 1 12  2   3  f 0  1.23570e+01 1.63497e+00 1.50523e+02 301.754 3.77083e+00  -6.09258e+00 0.00000e+00 0.00000e+00 2.85360e+02 301.754 1.34836e+02 301.754 0.9273 
1 1 1 12  2   4  o 1  2.05464e+01 1.32474e+00 4.68541e+02 273.459 2.61396e+00  -4.32407e+01 0.00000e+00 0.00000e+00 3.04144e+02 273.459 1.64397e+02 93.459  0.9884 
1 1 1 12  2   5  o 12 1.84851e+01 1.42964e+00 4.05867e+02 109.250 -1.21271e+01 3.47262e+01  0.00000e+00 0.00000e+00 2.87983e+02 109.250 1.17884e+02 289.250 0.9863 
1 1 1 12  2   6  o 10 9.36802e+00 2.21619e+00 1.75155e+02 134.053 -5.20270e+00 5.37757e+00  0.00000e+00 0.00000e+00 1.56650e+02 134.053 1.85058e+01 314.053 0.9306 
1 1 1 12  2   7  o 15 5.72081e+00 1.78754e+00 9.85630e+01 72.442  1.00835e+00  3.18678e+00  0.00000e+00 0.00000e+00 8.27121e+01 72.442  1.58509e+01 252.442 0.8324 
1 1 1 12  2   8  o 2  1.17244e+01 1.57578e+00 2.76478e+02 267.763 -8.92233e-01 -2.28364e+01 0.00000e+00 0.00000e+00 1.59952e+02 267.763 1.16526e+02 87.763  0.9779 
1 1 1 12  2   9  f 0  8.23584e+00 1.73641e+00 1.13920e+02 5.782   6.48046e+00  6.56152e-01  0.00000e+00 0.00000e+00 1.74393e+02 5.782   6.04736e+01 5.782   0.9197 
1 1 1 12  2   10 o 11 5.72254e+00 1.69084e+00 1.01856e+02 334.042 4.26512e+00  -2.07631e+00 0.00000e+00 0.00000e+00 9.13561e+01 334.042 1.05003e+01 154.043 0.8871 
1 1 1 12  2   11 o 16 8.04158e+00 1.96081e+00 1.58557e+02 132.190 -6.38856e+00 7.04803e+00  0.00000e+00 0.00000e+00 1.30906e+02 132.190 2.76515e+01 312.190 0.9459 
1 1 1 12  2   12 o 14 6.35190e+00 1.83685e+00 7.37235e+01 276.598 4.78701e-01  -4.13840e+00 0.00000e+00 0.00000e+00 1.36437e+02 276.598 6.27136e+01 276.598 0.8696 
1 1 1 12  3   0  o 15 1.91501e+01 8.85926e-01 2.52552e+02 96.616  -1.88895e+00 1.62856e+01  0.00000e+00 0.00000e+00 4.52477e+02 96.616  1.99925e+02 96.616  0.9690 
1 1 1 12  3   1  o 9  1.77129e+01 9.03748e-01 3.61953e+02 254.753 -6.44160e+00 -2.36332e+01 0.00000e+00 0.00000e+00 2.97436e+02 254.753 6.45170e+01 74.754  0.9794 
1 1 1 12  3   2  o 1  1.13228e+01 1.23012e+00 2.51359e+02 129.826 -7.19384e+00 8.62649e+00  0.00000e+00 0.00000e+00 1.59558e+02 129.826 9.18003e+01 309.826 0.9544 
1 1 1 12  3   3  o 8  2.26828e+01 1.28254e+00 3.83786e+02 355.355 3.61382e+01  -2.93637e+00 0.00000e+00 0.00000e+00 4.67040e+02 355.355 8.32545e+01 355.355 0.9861 
1 1 1 12  3   4  o 7  3.45267e+01 1.37411e+00 6.79350e+02 103.360 -2.57115e+01 1.08265e+02  0.00000e+00 0.00000e+00 6.28417e+02 103.360 5.09332e+01 283.359 0.9955 
1 1 1 12  3   5  o 4  3.73451e+01 1.44812e+00 7.50613e+02 230.912 -9.10960e+01 -1.12142e+02 0.00000e+00 0.00000e+00 6.65676e+02 230.912 8.49365e+01 50.912  0.9965 
1 1 1 12  3   6  o 13 1.28316e+01 2.15344e+00 2.01588e+02 17.301  1.15347e+01  3.59289e+00  0.00000e+00 0.00000e+00 2.66136e+02 17.301  6.45482e+01 17.301  0.9577 
1 1 1 12  3   7  o 5  1.03745e+01 2.16523e+00 2.93402e+02 69.428  5.42584e+00  1.44564e+01  0.00000e+00 0.00000e+00 8.84963e+01 69.428  2.04906e+02 249.428 0.9671 
1 1 1 12  3   8  o 6  6.86345e+00 1.68195e+00 1.26141e+02 154.483 -5.26378e+00 2.51256e+00  0.00000e+00 0.00000e+00 1.11526e+02 154.483 1.46152e+01 334.483 0.9097 
1 1 1 12  3   9  o 3  1.07351e+01 1.77424e+00 1.78442e+02 295.425 5.61046e+00  -1.18024e+01 0.00000e+00 0.00000e+00 2.14230e+02 295.425 3.57879e+01 295.425 0.9609 
1 1 1 12  3   10 o 4  1.36489e+01 1.64365e+00 2.53418e+02 157.246 -2.66050e+01 1.11584e+01  0.00000e+00 0.00000e+00 2.56990e+02 157.246 3.57175e+00 157.246 0.9825 
1 1 1 12  3   11 o 13 1.10838e+01 1.90202e+00 1.92142e+02 296.541 7.33555e+00  -1.46868e+01 0.00000e+00 0.00000e+00 2.16598e+02 296.541 2.44559e+01 296.541 0.9690 
1 1 1 12  3   12 o 10 6.08811e+00 1.87258e+00 1.74462e+02 190.617 -9.08314e+00 -1.70269e+00 0.00000e+00 0.00000e+00 4.42543e+01 190.617 1.30208e+02 10.617  0.9442 
1 1 1 12  4   0  o 15 2.28324e+01 1.02951e+00 3.28415e+02 39.995  1.91290e+01  1.60480e+01  0.00000e+00 0.00000e+00 5.21504e+02 39.995  1.93090e+02 39.995  0.9798 
1 1 1 12  4   1  o 2  2.56095e+01 8.74629e-01 4.94718e+02 44.344  3.47377e+01  3.39508e+01  0.00000e+00 0.00000e+00 4.68633e+02 44.344  2.60851e+01 224.344 0.9897 
1 1 1 12  4   2  o 3  1.52041e+01 1.04310e+00 3.53982e+02 212.778 -1.84407e+01 -1.18742e+01 0.00000e+00 0.00000e+00 2.10820e+02 212.778 1.43162e+02 32.778  0.9769 
1 1 1 12  4   3  o 1  7.43004e+00 1.75572e+00 3.15230e+02 184.679 -8.72580e+00 -7.14154e-01 0.00000e+00 0.00000e+00 4.92746e+01 4.679   3.64504e+02 4.679   0.9410 
1 1 1 12  4   4  o 14 2.60983e+01 1.28875e+00 5.10415e+02 332.944 5.74410e+01  -2.93388e+01 0.00000e+00 0.00000e+00 4.74847e+02 332.944 3.55680e+01 152.944 0.9922 
1 1 1 12  4   5  o 19 1.89203e+01 1.34297e+00 4.27763e+02 268.409 -1.19231e+00 -4.29220e+01 0.00000e+00 0.00000e+00 2.83832e+02 268.409 1.43931e+02 88.409  0.9883 
1 1 1 12  4   6  f 0  3.29108e+01 1.59227e+00 4.60383e+02 80.748  1.39881e+01  8.58736e+01  0.00000e+00 0.00000e+00 7.85033e+02 80.748  3.24650e+02 80.748  0.9942 
1 1 1 12  4   7  o 11 7.36211e+00 2.11426e+00 1.16490e+02 151.098 -3.88989e+00 2.14754e+00  0.00000e+00 0.00000e+00 1.29738e+02 151.098 1.32475e+01 151.098 0.8786 
1 1 1 12  4   8  o 8  4.16767e+00 1.33369e+00 8.24463e+01 28.938  2.34084e+00  1.29422e+00  0.00000e+00 0.00000e+00 4.17327e+01 28.938  4.07135e+01 208.938 0.7827 
1 1 1 12  4   9  o 10 1.08137e+01 1.68169e+00 2.40905e+02 206.613 -1.65743e+01 -8.30469e+00 0.00000e+00 0.00000e+00 1.59452e+02 206.613 8.14531e+01 26.614  0.9726 
1 1 1 12  4   10 o 11 5.81908e+00 1.66806e+00 1.65915e+02 27.360  7.06070e+00  3.65370e+00  0.00000e+00 0.00000e+00 4.11253e+01 27.360  1.24790e+02 207.360 0.9348 
1 1 1 12  4   11 o 9  8.33583e+00 1.94777e+00 1.30761e+02 144.534 -6.67054e+00 4.75212e+00  0.00000e+00 0.00000e+00 1.66409e+02 144.534 3.56481e+01 144.534 0.9368 
1 1 1 12  4   12 o 19 3.74216e+00 1.31025e+00 1.17088e+02 25.171  4.62828e+00  2.17505e+00  0.00000e+00 0.00000e+00 1.04745e+01 25.171  1.06614e+02 205.171 0.8960 
1 1 1 12  5   0  o 2  2.32057e+01 8.75161e-01 3.78830e+02 97.149  -3.71065e+00 2.95843e+01  0.00000e+00 0.00000e+00 4.87899e+02 97.149  1.09068e+02 97.149  0.9831 
1 1 1 12  5   1  o 11 2.21713e+01 8.80117e-01 4.05613e+02 226.237 -2.38206e+01 -2.48725e+01 0.00000e+00 0.00000e+00 4.24784e+02 226.237 1.91709e+01 226.237 0.9854 
1 1 1 12  5   2  o 17 1.26470e+01 1.11257e+00 2.14624e+02 253.856 -3.03901e+00 -1.04989e+01 0.00000e+00 0.00000e+00 2.43717e+02 253.856 2.90933e+01 253.856 0.9531 
1 1 1 12  5   3  o 6  1.20042e+01 2.23106e+00 1.63518e+02 126.993 -3.88939e+00 5.16279e+00  0.00000e+00 0.00000e+00 2.56108e+02 126.993 9.25900e+01 126.993 0.9190 
1 1 1 12  5   4  o 18 9.40293e+00 1.70690e+00 1.89636e+02 337.218 7.13438e+00  -2.99631e+00 0.00000e+00 0.00000e+00 1.44134e+02 337.218 4.55018e+01 157.218 0.9329 
1 1 1 12  5   5  o 1  1.66970e+01 1.48942e+00 3.36815e+02 188.334 -2.83249e+01 -4.14930e+00 0.00000e+00 0.00000e+00 2.87400e+02 188.334 4.94150e+01 8.334   0.9824 
1 1 1 12  5   6  o 17 7.17956e+00 2.02327e+00 1.98189e+02 276.491 7.89099e-01  -6.93530e+00 0.00000e+00 0.00000e+00 5.46625e+01 276.491 1.43526e+02 96.491  0.9253 
1 1 1 12  5   7  o 9  1.01054e+01 2.20624e+00 1.52896e+02 61.567  3.66698e+00  6.77255e+00  0.00000e+00 0.00000e+00 2.05840e+02 61.567  5.29444e+01 61.567  0.9326 
1 1 1 12  5   8  o 14 3.68083e+00 1.23412e+00 6.96755e+01 343.899 1.99327e+00  -5.75370e-01 0.00000e+00 0.00000e+00 2.97564e+01 343.899 3.99191e+01 163.899 0.7097 
1 1 1 12  5   9  o 10 9.21560e+00 1.82447e+00 1.43332e+02 145.651 -7.26638e+00 4.96598e+00  0.00000e+00 0.00000e+00 1.86876e+02 145.651 4.35435e+01 145.651 0.9413 
1 1 1 12  5   10 o 18 6.39293e+00 1.72120e+00 1.34870e+02 290.490 2.41665e+00  -6.46707e+00 0.00000e+00 0.00000e+00 9.00620e+01 290.490 4.48083e+01 110.490 0.9244 
1 1 1 12  5   11 o 9  1.78641e+01 1.48950e+00 3.09069e+02 234.971 -3.07300e+01 -4.38398e+01 0.00000e+00 0.00000e+00 3.64356e+02 234.971 5.52871e+01 234.971 0.9906 
1 1 1 12  5   12 o 8  8.44919e+00 2.08100e+00 1.69788e+02 99.783  -1.79996e+00 1.04395e+01  0.00000e+00 0.00000e+00 1.36099e+02 99.783  3.36888e+01 279.783 0.9516 
1 1 1 12  6   0  o 4  2.24256e+01 8.59634e-01 3.75443e+02 59.738  1.44093e+01  2.46958e+01  0.00000e+00 0.00000e+00 4.61515e+02 59.738  8.60717e+01 59.738  0.9824 
1 1 1 12  6   1  o 9  1.25943e+01 1.07134e+00 2.96936e+02 170.841 -1.37582e+01 2.21829e+00  0.00000e+00 0.00000e+00 1.64255e+02 170.841 1.32681e+02 350.841 0.9634 
1 1 1 12  6   2  o 3  5.04535e+00 1.43296e+00 6.62729e+01 77.163  2.81420e-01  1.23499e+00  0.00000e+00 0.00000e+00 3.59694e+01 77.163  3.03035e+01 257.163 0.5329 
1 1 1 12  6   3  o 14 1.22085e+01 2.19093e+00 2.18078e+02 343.317 8.84104e+00  -2.64954e+00 0.00000e+00 0.00000e+00 2.20365e+02 343.317 2.28730e+00 343.317 0.9442 
1 1 1 12  6   4  f 0  2.24923e+01 1.31019e+00 4.58533e+02 163.345 -4.75574e+01 1.42272e+01  0.00000e+00 0.00000e+00 3.88567e+02 163.345 6.99661e+01 343.345 0.9899 
1 1 1 12  6   5  o 15 6.98226e+00 1.48960e+00 6.98251e+01 335.144 2.25076e+00  -1.04269e+00 0.00000e+00 0.00000e+00 1.32875e+02 335.144 6.30497e+01 335.144 0.7629 
1 1 1 12  6   6  o 8  6.84127e+00 1.88640e+00 8.90988e+01 123.764 -1.75823e+00 2.63000e+00  0.00000e+00 0.00000e+00 1.24776e+02 123.764 3.56769e+01 123.764 0.8214 
1 1 1 12  6   7  o 3  4.99345e+00 1.65435e+00 1.06037e+02 71.917  1.02644e+00  3.14352e+00  0.00000e+00 0.00000e+00 5.17855e+01 71.917  5.42515e+01 251.917 0.8303 
1 1 1 12  6   8  o 5  9.21341e+00 1.66818e+00 1.34486e+02 289.896 2.85647e+00  -7.89257e+00 0.00000e+00 0.00000e+00 1.94614e+02 289.896 6.01282e+01 289.896 0.9384 
1 1 1 12  6   9  o 18 4.45845e+00 1.42046e+00 1.04057e+02 176.420 -3.69926e+00 2.31409e-01  0.00000e+00 0.00000e+00 4.03952e+01 176.420 6.36621e+01 356.420 0.8512 
1 1 1 12  6   10 o 12 6.65915e+00 1.66128e+00 1.03497e+02 15.551  5.48492e+00  1.52633e+00  0.00000e+00 0.00000e+00 1.26457e+02 15.551  2.29599e+01 15.551  0.9073 
1 1 1 12  6   11 o 7  6.94639e+00 1.89499e+00 1.70810e+02 299.090 4.78692e+00  -8.60385e+00 0.00000e+00 0.00000e+00 7.97201e+01 299.090 9.10894e+01 119.090 0.9478 
1 1 1 12  6   12 o 8  5.87048e+00 1.78158e+00 7.80822e+01 137.499 -2.97917e+00 2.73000e+00  0.00000e+00 0.00000e+00 1.15127e+02 137.499 3.70451e+01 137.499 0.8651 
1 1 1 12  7   0  o 18 2.37834e+01 8.52291e-01 4.39235e+02 120.567 -1.80456e+01 3.05532e+01  0.00000e+00 0.00000e+00 4.51504e+02 120.567 1.22687e+01 120.567 0.9858 
1 1 1 12  7   1  o 8  1.88993e+01 9.01508e-01 2.96019e+02 356.501 2.13019e+01  -1.30237e+00 0.00000e+00 0.00000e+00 4.05278e+02 356.501 1.09259e+02 356.501 0.9763 
1 1 1 12  7   2  o 2  1.17643e+01 1.42277e+00 8.32628e+01 311.192 2.44742e+00  -2.79648e+00 0.00000e+00 0.00000e+00 2.97696e+02 311.192 2.14434e+02 311.192 0.8516 
1 1 1 12  7   3  o 9  3.01771e+01 1.88418e+00 5.37234e+02 145.899 -5.06969e+01 3.43261e+01  0.00000e+00 0.00000e+00 6.01170e+02 145.899 6.39366e+01 145.899 0.9918 
1 1 1 12  7   4  o 9  2.08927e+01 1.28074e+00 2.54052e+02 308.810 1.61149e+01  -2.00359e+01 0.00000e+00 0.00000e+00 5.25225e+02 308.810 2.71173e+02 308.810 0.9804 
1 1 1 12  7   5  o 9  8.46447e+00 1.64564e+00 2.31988e+02 26.054  8.56561e+00  4.18768e+00  0.00000e+00 0.00000e+00 7.27296e+01 26.054  1.59259e+02 206.054 0.9460 
1 1 1 12  7   6  o 18 8.64598e+00 2.17544e+00 1.63026e+02 206.776 -5.85086e+00 -2.95238e+00 0.00000e+00 0.00000e+00 1.39774e+02 206.776 2.32516e+01 26.776  0.9202 
1 1 1 12  7   7  o 15 2.43867e+01 1.69476e+00 4.44365e+02 71.153  2.15088e+01  6.30121e+01  0.00000e+00 0.00000e+00 4.76870e+02 71.153  3.25052e+01 71.153  0.9925 
1 1 1 12  7   8  o 3  6.25819e+00 1.61788e+00 6.15947e+01 45.860  1.85769e+00  1.91427e+00  0.00000e+00 0.00000e+00 1.24699e+02 45.860  6.31043e+01 45.860  0.7820 
1 1 1 12  7   9  o 11 7.43037e+00 1.79815e+00 1.48342e+02 94.811  -6.23171e-01 7.40390e+00  0.00000e+00 0.00000e+00 1.14693e+02 94.811  3.36485e+01 274.811 0.9300 
1 1 1 12  7   10 o 3  8.94946e+00 1.65756e+00 1.73430e+02 133.416 -8.82735e+00 9.32929e+00  0.00000e+00 0.00000e+00 1.53637e+02 133.416 1.97923e+01 313.416 0.9602 
1 1 1 12  7   11 o 5  4.61300e+00 1.49792e+00 4.80397e+01 295.823 1.01733e+00  -2.10230e+00 0.00000e+00 0.00000e+00 8.28868e+01 295.823 3.48471e+01 295.823 0.7459 
1 1 1 12  7   12 o 12 5.54808e+00 1.71931e+00 5.43525e+01 103.851 -6.60411e-01 2.67840e+00  0.00000e+00 0.00000e+00 1.12487e+02 103.851 5.81341e+01 103.851 0.7904 
1 1 1 12  8   0  o 2  2.53581e+01 8.54302e-01 4.01449e+02 103.775 -9.32798e+00 3.80494e+01  0.00000e+00 0.00000e+00 5.49543e+02 103.775 1.48094e+02 103.775 0.9872 
1 1 1 12  8   1  o 14 1.84378e+01 9.16883e-01 2.99568e+02 354.100 2.29543e+01  -2.37191e+00 0.00000e+00 0.00000e+00 3.85854e+02 354.100 8.62853e+01 354.100 0.9781 
1 1 1 12  8   2  o 4  7.18495e+00 1.54835e+00 1.14506e+02 191.752 -2.97376e+00 -6.18632e-01 0.00000e+00 0.00000e+00 1.07520e+02 191.752 6.98527e+00 11.752  0.8127 
1 1 1 12  8   3  o 7  1.19516e+01 2.40536e+00 1.88722e+02 101.940 -1.51791e+00 7.17790e+00  0.00000e+00 0.00000e+00 2.33634e+02 101.940 4.49120e+01 101.940 0.9291 
1 1 1 12  8   4  o 14 6.80708e+00 1.81696e+00 1.51823e+02 107.380 -1.29620e+00 4.14121e+00  0.00000e+00 0.00000e+00 7.48900e+01 107.380 7.69326e+01 287.380 0.8754 
1 1 1 12  8   5  o 19 1.00972e+01 1.79849e+00 2.57317e+02 67.269  4.64618e+00  1.10900e+01  0.00000e+00 0.00000e+00 1.10573e+02 67.269  1.46744e+02 247.269 0.9575 
1 1 1 12  8   6  o 16 5.54943e+00 1.78375e+00 1.03036e+02 140.523 -2.37754e+00 1.95831e+00  0.00000e+00 0.00000e+00 6.92542e+01 140.523 3.37815e+01 320.523 0.8157 
1 1 1 12  8   7  o 16 1.48377e+01 2.02495e+00 2.79136e+02 218.679 -1.73646e+01 -1.39010e+01 0.00000e+00 0.00000e+00 2.72775e+02 218.679 6.36086e+00 38.679  0.9773 
1 1 1 12  8   8  o 19 1.13489e+01 1.52728e+00 1.96222e+02 313.009 1.09393e+01  -1.17275e+01 0.00000e+00 0.00000e+00 2.22061e+02 313.009 2.58389e+01 313.009 0.9683 
1 1 1 12  8   9  o 12 7.65236e+00 1.71804e+00 7.62164e+01 56.693  2.36494e+00  3.59934e+00  0.00000e+00 0.00000e+00 1.78453e+02 56.693  1.02237e+02 56.693  0.8744 
1 1 1 12  8   10 o 5  6.50019e+00 1.65011e+00 1.50199e+02 278.748 1.23319e+00  -8.01411e+00 0.00000e+00 0.00000e+00 8.13883e+01 278.748 6.88104e+01 98.748  0.9361 
1 1 1 12  8   11 o 1  7.49665e+00 1.80378e+00 4.76881e+01 59.181  1.60507e+00  2.69050e+00  0.00000e+00 0.00000e+00 1.86043e+02 59.181  1.38355e+02 59.181  0.8193 
1 1 1 12  8   12 o 9  4.86645e+00 1.61776e+00 1.41933e+02 215.953 -5.43408e+00 -3.94131e+00 0.00000e+00 0.00000e+00 2.87983e+01 215.953 1.13134e+02 35.953  0.9222 
1 1 1 12  9   0  f 0  1.16416e+01 1.11137e+00 3.05016e+02 151.812 -1.16064e+01 6.22019e+00  0.00000e+00 0.00000e+00 1.20104e+02 151.812 1.84912e+02 331.812 0.9612 
1 1 1 12  9   1  o 6  2.25143e+01 8.68983e-01 3.42520e+02 77.905  6.79104e+00  3.16907e+01  0.00000e+00 0.00000e+00 4.99873e+02 77.905  1.57353e+02 77.905  0.9844 
1 1 1 12  9   2  o 18 1.78045e+01 1.08233e+00 3.19904e+02 37.095  1.89077e+01  1.42974e+01  0.00000e+00 0.00000e+00 3.42620e+02 37.095  2.27158e+01 37.095  0.9787 
1 1 1 12  9   3  o 4  2.70349e+01 1.28024e+00 4.71453e+02 234.563 -3.23120e+01 -4.54047e+01 0.00000e+00 0.00000e+00 5.47534e+02 234.563 7.60805e+01 234.563 0.9910 
1 1 1 12  9   4  o 1  2.80535e+01 1.30552e+00 4.82688e+02 145.219 -5.34862e+01 3.71477e+01  0.00000e+00 0.00000e+00 5.76369e+02 145.219 9.36813e+01 145.219 0.9923 
1 1 1 12  9   5  o 12 9.40677e+00 1.69491e+00 1.96532e+02 15.647  8.50436e+00  2.38203e+00  0.00000e+00 0.00000e+00 1.40500e+02 15.647  5.60323e+01 195.647 0.9416 
1 1 1 12  9   6  o 5  1.14288e+01 2.11145e+00 1.45195e+02 294.576 3.28637e+00  -7.18611e+00 0.00000e+00 0.00000e+00 2.61229e+02 294.576 1.16034e+02 294.576 0.9344 
1 1 1 12  9   7  o 2  2.38638e+01 1.67041e+00 4.36389e+02 331.589 5.73892e+01  -3.10440e+01 0.00000e+00 0.00000e+00 4.64913e+02 331.589 2.85247e+01 331.589 0.9923 
1 1 1 12  9   8  o 11 9.27904e+00 1.65899e+00 1.42299e+02 116.706 -4.03950e+00 8.02947e+00  0.00000e+00 0.00000e+00 1.90615e+02 116.706 4.83157e+01 116.706 0.9426 
1 1 1 12  9   9  o 5  1.29935e+01 1.53626e+00 2.39522e+02 312.566 1.69490e+01  -1.84537e+01 0.00000e+00 0.00000e+00 2.45051e+02 312.566 5.52886e+00 312.566 0.9798 
1 1 1 12  9   10 f 0  5.48058e+00 1.48606e+00 1.13158e+02 225.351 -4.13061e+00 -4.18147e+00 0.00000e+00 0.00000e+00 7.67333e+01 225.351 3.64243e+01 45.351  0.9104 
1 1 1 12  9   11 o 17 5.07697e+00 1.59917e+00 1.01225e+02 350.663 5.02692e+00  -8.26529e-01 0.00000e+00 0.00000e+00 7.17779e+01 350.663 2.94473e+01 170.663 0.8955 
1 1 1 12  9   12 o 5  1.32409e+01 2.20315e+00 2.69895e+02 210.842 -2.10926e+01 -1.25945e+01 0.00000e+00 0.00000e+00 2.23467e+02 210.842 4.64274e+01 30.842  0.9794 
1 1 1 12  10  0  o 7  2.67557e+01 8.48683e-01 4.03312e+02 292.399 1.58083e+01  -3.83560e+01 0.00000e+00 0.00000e+00 6.00773e+02 292.399 1.97460e+02 292.399 0.9879 
1 1 1 12  10  1  o 19 6.13510e+00 1.48100e+00 1.02576e+02 270.725 3.00007e-02  -2.37005e+00 0.00000e+00 0.00000e+00 7.23277e+01 270.725 3.02483e+01 90.725  0.7501 
1 1 1 12  10  2  o 3  8.77868e+00 1.53200e+00 1.97402e+02 55.616  3.72360e+00  5.44147e+00  0.00000e+00 0.00000e+00 1.09900e+02 55.616  8.75013e+01 235.616 0.9207 
1 1 1 12  10  5  o 4  2.23147e+01 2.06531e+00 3.73378e+02 301.407 1.86882e+01  -3.06075e+01 0.00000e+00 0.00000e+00 4.63808e+02 301.407 9.04297e+01 301.407 0.9860 
1 1 1 12  10  6  o 7  5.45578e+00 1.75480e+00 6.33180e+01 122.115 -9.98905e-01 1.59150e+00  0.00000e+00 0.00000e+00 7.72214e+01 122.115 1.39034e+01 122.115 0.6769 
1 1 1 12  10  7  o 13 2.11524e+01 1.76843e+00 3.18517e+02 229.072 -2.65724e+01 -3.06456e+01 0.00000e+00 0.00000e+00 4.76567e+02 229.072 1.58049e+02 229.072 0.9876 
1 1 1 12  10  8  o 14 1.30791e+01 1.44626e+00 2.13961e+02 129.965 -1.33744e+01 1.59586e+01  0.00000e+00 0.00000e+00 2.71744e+02 129.965 5.77829e+01 129.965 0.9757 
1 1 1 12  10  9  o 11 1.86641e+01 1.31503e+00 2.94225e+02 275.208 4.44034e+00  -4.87170e+01 0.00000e+00 0.00000e+00 4.08831e+02 275.208 1.14606e+02 275.208 0.9897 
1 1 1 12  10  10 o 4  5.05355e+00 1.56640e+00 1.48287e+02 73.583  1.92166e+00  6.52195e+00  0.00000e+00 0.00000e+00 2.92660e+01 73.583  1.19021e+02 253.583 0.9232 
1 1 1 12  10  11 o 14 6.79305e+00 1.85533e+00 1.32152e+02 181.059 -7.62386e+00 -1.40961e-01 0.00000e+00 0.00000e+00 1.08727e+02 181.059 2.34250e+01 1.059   0.9319 
1 1 1 12  10  12 o 16 6.16565e+00 1.91267e+00 1.59314e+02 288.698 2.70230e+00  -7.98439e+00 0.00000e+00 0.00000e+00 6.08529e+01 288.698 9.84609e+01 108.698 0.9387 
1 1 1 12  11  0  o 7  9.76544e+00 1.27354e+00 8.07491e+01 8.745   2.80868e+00  4.32060e-01  0.00000e+00 0.00000e+00 2.15120e+02 8.745   1.34371e+02 8.745   0.7976 
1 1 1 12  11  1  o 13 3.07222e+01 8.89050e-01 6.27716e+02 276.698 9.40648e+00  -8.01028e+01 0.00000e+00 0.00000e+00 5.32612e+02 276.698 9.51039e+01 96.698  0.9938 
1 1 1 12  11  2  o 19 2.46225e+01 1.07393e+00 3.48594e+02 223.837 -2.57596e+01 -2.47347e+01 0.00000e+00 0.00000e+00 5.74345e+02 223.837 2.25751e+02 223.837 0.9859 
1 1 1 12  11  3  o 5  3.04713e+01 1.28194e+00 6.40702e+02 31.211  7.15324e+01  4.33401e+01  0.00000e+00 0.00000e+00 5.11241e+02 31.211  1.29461e+02 211.211 0.9940 
1 1 1 12  11  4  o 10 1.37688e+01 1.52397e+00 1.80590e+02 187.332 -1.21503e+01 -1.56345e+00 0.00000e+00 0.00000e+00 3.21352e+02 187.332 1.40762e+02 187.332 0.9583 
1 1 1 12  11  5  o 15 1.50142e+01 1.92856e+00 2.68044e+02 125.858 -1.06150e+01 1.46865e+01  0.00000e+00 0.00000e+00 2.87257e+02 125.858 1.92128e+01 125.858 0.9720 
1 1 1 12  11  6  o 15 1.44677e+01 2.06478e+00 1.92927e+02 219.675 -1.02892e+01 -8.53481e+00 0.00000e+00 0.00000e+00 3.36646e+02 219.675 1.43719e+02 219.675 0.9618 
1 1 1 12  11  7  o 14 1.33055e+01 2.08782e+00 1.91634e+02 296.230 5.94283e+00  -1.20613e+01 0.00000e+00 0.00000e+00 2.95553e+02 296.230 1.03919e+02 296.230 0.9621 
1 1 1 12  11  8  o 3  1.02277e+01 1.56018e+00 2.67715e+02 185.819 -1.93205e+01 -1.96916e+00 0.00000e+00 0.00000e+00 1.11397e+02 185.819 1.56319e+02 5.820   0.9739 
1 1 1 12  11  9  o 4  1.90039e+01 1.24512e+00 3.29281e+02 0.786   5.74533e+01  7.88482e-01  0.00000e+00 0.00000e+00 3.87665e+02 0.786   5.83849e+01 0.786   0.9913 
1 1 1 12  11  10 o 15 1.35357e+01 1.59592e+00 1.86369e+02 189.847 -2.21853e+01 -3.85079e+00 0.00000e+00 0.00000e+00 3.17165e+02 189.847 1.30795e+02 189.847 0.9775 
1 1 1 12  11  11 o 6  7.27251e+00 1.79302e+00 1.58407e+02 314.795 7.06131e+00  -7.11205e+00 0.00000e+00 0.00000e+00 1.04116e+02 314.795 5.42917e+01 134.795 0.9487 
1 1 1 12  11  12 o 2  1.43745e+01 2.19723e+00 2.91253e+02 63.121  1.36365e+01  2.69040e+01  0.00000e+00 0.00000e+00 2.46424e+02 63.121  4.48286e+01 243.121 0.9833 
1 1 1 12  12  0  o 2  2.94811e+01 8.63921e-01 5.26724e+02 234.862 -3.76113e+01 -5.34408e+01 0.00000e+00 0.00000e+00 5.84552e+02 234.862 5.78285e+01 234.862 0.9923 
1 1 1 12  12  1  o 15 7.97981e+00 1.43774e+00 2.20630e+02 69.920  2.29077e+00  6.26675e+00  0.00000e+00 0.00000e+00 5.88801e+01 69.920  1.61750e+02 249.920 0.9217 
1 1 1 12  12  2  o 7  1.08705e+01 1.38655e+00 1.67084e+02 354.028 7.07835e+00  -7.40432e-01 0.00000e+00 0.00000e+00 2.15950e+02 354.028 4.88656e+01 354.028 0.9268 
1 1 1 12  12  3  o 6  1.28194e+01 1.51871e+00 2.81270e+02 177.705 -1.46272e+01 5.86224e-01  0.00000e+00 0.00000e+00 1.89307e+02 177.705 9.19628e+01 357.705 0.9652 
1 1 1 12  12  4  o 7  1.75906e+01 1.33482e+00 3.81400e+02 188.491 -3.44052e+01 -5.13643e+00 0.00000e+00 0.00000e+00 2.78080e+02 188.491 1.03320e+02 8.491   0.9855 
1 1 1 12  12  5  o 15 1.39917e+01 1.96347e+00 2.30525e+02 190.183 -1.41198e+01 -2.53628e+00 0.00000e+00 0.00000e+00 2.82944e+02 190.183 5.24192e+01 190.183 0.9645 
1 1 1 12  12  6  o 14 8.21227e+00 2.14386e+00 1.14431e+02 205.837 -3.92903e+00 -1.90248e+00 0.00000e+00 0.00000e+00 1.59407e+02 205.837 4.49757e+01 205.837 0.8762 
1 1 1 12  12  7  o 13 1.83424e+01 1.31721e+00 3.58697e+02 232.743 -2.84911e+01 -3.74580e+01 0.00000e+00 0.00000e+00 3.31923e+02 232.743 2.67738e+01 52.743  0.9893 
1 1 1 12  12  8  o 11 1.98149e+01 1.15985e+00 2.94997e+02 30.478  4.57183e+01  2.69062e+01  0.00000e+00 0.00000e+00 4.51997e+02 30.478  1.57000e+02 30.478  0.9905 
1 1 1 12  12  9  o 12 8.04121e+00 1.78769e+00 1.40706e+02 205.438 -7.51383e+00 -3.57400e+00 0.00000e+00 0.00000e+00 1.46298e+02 205.438 5.59191e+00 205.438 0.9378 
1 1 1 12  12  10 o 14 3.87788e+00 1.31142e+00 9.08500e+01 86.369  2.31611e-01  3.64955e+00  0.00000e+00 0.00000e+00 3.44210e+01 86.369  5.64290e+01 266.369 0.8489 
1 1 1 12  12  11 o 12 1.06356e+01 1.95065e+00 1.59563e+02 186.847 -1.33514e+01 -1.60306e+00 0.00000e+00 0.00000e+00 2.29751e+02 186.847 7.01882e+01 186.847 0.9621 
1 1 1 12  12  12 o 5  1.09916e+01 2.06124e+00 2.20085e+02 253.143 -5.48834e+00 -1.81131e+01 0.00000e+00 0.00000e+00 1.86834e+02 253.143 3.32515e+01 73.143  0.9732 
1 1 1 12  13  0  o 11 2.98928e+01 8.79113e-01 4.33322e+02 197.701 -5.17534e+01 -1.65177e+01 0.00000e+00 0.00000e+00 6.91656e+02 197.701 2.58335e+02 197.701 0.9908 
1 1 1 12  13  1  o 16 2.46535e+01 8.66199e-01 4.23547e+02 221.484 -3.27098e+01 -2.89228e+01 0.00000e+00 0.00000e+00 5.02552e+02 221.484 7.90050e+01 221.484 0.9885 
1 1 1 12  13  2  f 0  1.84327e+01 1.02586e+00 3.38706e+02 133.455 -1.88060e+01 1.98488e+01  0.00000e+00 0.00000e+00 3.49118e+02 133.455 1.04119e+01 133.455 0.9815 
1 1 1 12  13  3  f 0  2.80221e+01 1.25846e+00 5.69063e+02 347.405 6.68312e+01  -1.49326e+01 0.00000e+00 0.00000e+00 4.88798e+02 347.405 8.02645e+01 167.405 0.9927 
1 1 1 12  13  4  o 16 1.72656e+01 1.33139e+00 2.92092e+02 128.991 -1.64509e+01 2.03219e+01  0.00000e+00 0.00000e+00 3.52007e+02 128.991 5.99150e+01 128.991 0.9807 
1 1 1 12  13  5  o 16 6.91787e+00 1.83702e+00 5.63748e+01 202.941 -1.66373e+00 -7.04207e-01 0.00000e+00 0.00000e+00 1.18219e+02 202.941 6.18438e+01 202.941 0.6633 
1 1 1 12  13  6  o 7  2.49980e+01 1.60304e+00 4.42179e+02 37.085  4.98548e+01  3.76844e+01  0.00000e+00 0.00000e+00 5.01441e+02 37.085  5.92625e+01 37.085  0.9920 
1 1 1 12  13  7  o 8  2.41434e+01 1.20556e+00 4.36087e+02 209.696 -7.10971e+01 -4.05471e+01 0.00000e+00 0.00000e+00 4.77104e+02 209.696 4.10169e+01 209.696 0.9939 
1 1 1 12  13  8  f 0  1.57706e+01 1.25408e+00 3.69607e+02 93.758  -3.33376e+00 5.07553e+01  0.00000e+00 0.00000e+00 2.24658e+02 93.758  1.44949e+02 273.758 0.9901 
1 1 1 12  13  9  o 2  1.62157e+01 1.30728e+00 2.29842e+02 266.734 -1.97033e+00 -3.45324e+01 0.00000e+00 0.00000e+00 3.78284e+02 266.734 1.48443e+02 266.734 0.9854 
1 1 1 12  13  10 o 12 1.19525e+01 1.70807e+00 2.26319e+02 245.153 -9.57984e+00 -2.06878e+01 0.00000e+00 0.00000e+00 2.18416e+02 245.153 7.90276e+00 65.153  0.9778 
1 1 1 12  13  11 o 18 7.13086e+00 1.92479e+00 1.79984e+02 349.801 1.01603e+01  -1.82785e+00 0.00000e+00 0.00000e+00 7.78265e+01 349.801 1.02158e+02 169.801 0.9503 
1 1 1 12  13  12 o 12 4.80463e+00 1.51575e+00 6.28181e+01 75.388  8.39126e-01  3.21870e+00  0.00000e+00 0.00000e+00 8.91450e+01 75.388  2.63269e+01 75.388  0.8315 
1 1 1 12  14  0  o 5  2.54885e+01 8.54711e-01 2.84800e+02 268.200 -9.57901e-01 -3.04892e+01 0.00000e+00 0.00000e+00 6.67343e+02 268.200 3.82543e+02 268.200 0.9835 
1 1 1 12  14  1  o 18 1.55121e+01 9.71937e-01 3.26806e+02 22.257  1.92940e+01  7.89597e+00  0.00000e+00 0.00000e+00 2.48349e+02 22.257  7.84569e+01 202.257 0.9757 
1 1 1 12  14  2  o 13 1.37256e+01 1.14189e+00 2.90400e+02 329.062 1.46457e+01  -8.77857e+00 0.00000e+00 0.00000e+00 2.15873e+02 329.062 7.45267e+01 149.062 0.9703 
1 1 1 12  14  3  o 1  8.43724e+00 1.78250e+00 2.29543e+02 63.079  3.32788e+00  6.55377e+00  0.00000e+00 0.00000e+00 6.86103e+01 63.079  1.60932e+02 243.079 0.9292 
1 1 1 12  14  4  o 17 1.89217e+01 1.37739e+00 3.13283e+02 35.897  2.37823e+01  1.72133e+01  0.00000e+00 0.00000e+00 3.94106e+02 35.897  8.08229e+01 35.897  0.9828 
1 1 1 12  14  5  o 13 1.36492e+01 1.62083e+00 2.85044e+02 93.418  -1.23843e+00 2.07322e+01  0.00000e+00 0.00000e+00 2.21600e+02 93.418  6.34436e+01 273.418 0.9756 
1 1 1 12  14  6  o 5  6.84961e+00 1.86074e+00 1.32318e+02 190.282 -4.59614e+00 -8.33799e-01 0.00000e+00 0.00000e+00 9.83907e+01 190.282 3.39271e+01 10.282  0.8852 
1 1 1 12  14  7  o 8  2.59296e+01 1.19985e+00 4.03936e+02 170.676 -8.04289e+01 1.32055e+01  0.00000e+00 0.00000e+00 5.76753e+02 170.676 1.72817e+02 170.676 0.9938 
1 1 1 12  14  8  o 18 6.94718e+00 1.68829e+00 1.30758e+02 320.610 5.05095e+00  -4.14748e+00 0.00000e+00 0.00000e+00 1.12463e+02 320.610 1.82949e+01 140.610 0.9200 
1 1 1 12  14  9  o 8  8.10451e+00 1.76225e+00 1.23322e+02 301.113 3.84272e+00  -6.36684e+00 0.00000e+00 0.00000e+00 1.63539e+02 301.113 4.02171e+01 301.113 0.9301 
1 1 1 12  14  10 o 14 4.48719e+00 1.44133e+00 1.29302e+02 111.663 -2.08541e+00 5.25019e+00  0.00000e+00 0.00000e+00 2.54834e+01 111.663 1.03819e+02 291.663 0.9065 
1 1 1 12  14  11 o 6  1.05385e+01 1.95784e+00 1.72519e+02 95.647  -1.41085e+00 1.42690e+01  0.00000e+00 0.00000e+00 2.14178e+02 95.647  4.16591e+01 95.647  0.9645 
1 1 1 12  14  12 o 3  6.45661e+00 1.94279e+00 9.91346e+01 315.017 3.69271e+00  -3.69056e+00 0.00000e+00 0.00000e+00 1.21470e+02 315.017 2.23353e+01 315.017 0.8983 
1 1 1 12  15  0  o 9  1.57164e+01 9.33111e-01 2.03706e+02 98.542  -1.97145e+00 1.31258e+01  0.00000e+00 0.00000e+00 3.70290e+02 98.542  1.66584e+02 98.542  0.9616 
1 1 1 12  15  1  o 12 2.67612e+01 8.71381e-01 4.27708e+02 342.198 4.68681e+01  -1.50497e+01 0.00000e+00 0.00000e+00 5.78816e+02 342.198 1.51107e+02 342.198 0.9898 
1 1 1 12  15  2  f 0  1.67375e+01 1.04652e+00 2.07014e+02 117.406 -6.93988e+00 1.33847e+01  0.00000e+00 0.00000e+00 4.07773e+02 117.406 2.00759e+02 117.406 0.9662 
1 1 1 12  15  3  o 6  5.42640e+00 1.46422e+00 2.41244e+02 344.057 5.49450e+00  -1.56957e+00 0.00000e+00 0.00000e+00 5.39456e+01 164.057 2.95189e+02 164.057 0.9077 
1 1 1 12  15  4  o 14 1.78394e+01 1.27208e+00 3.73267e+02 89.686  1.85593e-01  3.38214e+01  0.00000e+00 0.00000e+00 2.95184e+02 89.686  7.80831e+01 269.686 0.9851 
1 1 1 12  15  5  o 5  1.18912e+01 2.00044e+00 2.41306e+02 280.915 2.54291e+00  -1.31864e+01 0.00000e+00 0.00000e+00 1.93910e+02 280.915 4.73963e+01 100.915 0.9620 
1 1 1 12  15  6  f 0  6.44728e+00 1.94813e+00 1.83373e+02 21.298  5.70673e+00  2.22472e+00  0.00000e+00 0.00000e+00 4.09164e+01 21.298  1.42456e+02 201.298 0.9143 
1 1 1 12  15  7  o 15 7.10335e+00 1.61582e+00 2.39777e+02 310.313 7.30093e+00  -8.60507e+00 0.00000e+00 0.00000e+00 1.82634e+01 310.313 2.21514e+02 130.313 0.9546 
1 1 1 12  15  8  o 13 7.36443e+00 1.65947e+00 1.11768e+02 101.876 -1.22119e+00 5.80684e+00  0.00000e+00 0.00000e+00 1.43632e+02 101.876 3.18642e+01 101.876 0.9113 
1 1 1 12  15  9  f 0  4.33415e+00 1.37970e+00 9.73384e+01 278.097 5.55039e-01  -3.90134e+00 0.00000e+00 0.00000e+00 4.46991e+01 278.097 5.26393e+01 98.097  0.8612 
1 1 1 12  15  10 o 16 7.11705e+00 1.81523e+00 8.29646e+01 56.269  2.60408e+00  3.90013e+00  0.00000e+00 0.00000e+00 1.56872e+02 56.269  7.39071e+01 56.269  0.8856 
1 1 1 12  15  11 o 16 4.91351e+00 1.58671e+00 5.30884e+01 329.704 2.22269e+00  -1.29861e+00 0.00000e+00 0.00000e+00 9.13772e+01 329.704 3.82888e+01 329.704 0.7728 
1 1 1 12  15  12 o 5  4.49405e+00 1.51771e+00 6.85317e+01 253.909 -9.01701e-01 -3.12584e+00 0.00000e+00 0.00000e+00 7.28470e+01 253.909 4.31528e+00 253.909 0.8271 
1 1 1 12  16  0  o 3  1.91283e+01 8.57408e-01 3.22284e+02 172.517 -2.55731e+01 3.35924e+00  0.00000e+00 0.00000e+00 3.89992e+02 172.517 6.77078e+01 172.517 0.9804 
1 1 1 12  16  1  o 18 7.57773e+00 1.38189e+00 1.69330e+02 203.557 -4.61803e+00 -2.01346e+00 0.00000e+00 0.00000e+00 8.81588e+01 203.557 8.11709e+01 23.557  0.8943 
1 1 1 12  16  2  o 1  8.00388e+00 1.54129e+00 1.57421e+02 104.773 -1.32481e+00 5.02363e+00  0.00000e+00 0.00000e+00 1.15711e+02 104.773 4.17098e+01 284.773 0.8977 
1 1 1 12  16  3  o 19 1.56977e+01 1.29670e+00 3.78758e+02 253.418 -7.68958e+00 -2.58241e+01 0.00000e+00 0.00000e+00 2.06965e+02 253.418 1.71793e+02 73.418  0.9813 
1 1 1 12  16  4  o 15 1.42279e+01 1.53370e+00 1.91230e+02 238.504 -6.73267e+00 -1.09883e+01 0.00000e+00 0.00000e+00 3.28493e+02 238.504 1.37262e+02 238.504 0.9604 
1 1 1 12  16  5  o 1  1.79053e+01 1.66119e+00 3.73983e+02 57.780  1.87671e+01  2.97787e+01  0.00000e+00 0.00000e+00 2.97450e+02 57.780  7.65327e+01 237.780 0.9857 
1 1 1 12  16  6  o 18 5.68114e+00 1.76753e+00 2.18032e+02 237.501 -3.68910e+00 -5.79104e+00 0.00000e+00 0.00000e+00 1.82973e+01 57.501  2.36330e+02 57.501  0.9240 
1 1 1 12  16  7  o 8  9.06691e+00 1.76345e+00 1.96044e+02 99.911  -1.90712e+00 1.09145e+01  0.00000e+00 0.00000e+00 1.33015e+02 99.911  6.30297e+01 279.911 0.9537 
1 1 1 12  16  8  o 10 7.47315e+00 1.62766e+00 1.47667e+02 238.309 -4.23724e+00 -6.86310e+00 0.00000e+00 0.00000e+00 1.18449e+02 238.309 2.92177e+01 58.309  0.9358 
1 1 1 12  16  9  o 18 9.60306e+00 1.67427e+00 2.49357e+02 100.488 -3.50884e+00 1.89534e+01  0.00000e+00 0.00000e+00 1.06449e+02 100.488 1.42908e+02 280.488 0.9737 
1 1 1 12  16  10 o 15 4.54430e+00 1.44253e+00 9.29255e+01 300.324 2.12910e+00  -3.63999e+00 0.00000e+00 0.00000e+00 5.77374e+01 300.324 3.51881e+01 120.324 0.8714 
1 1 1 12  16  11 o 2  6.90147e+00 1.84419e+00 1.17828e+02 293.592 2.75388e+00  -6.30574e+00 0.00000e+00 0.00000e+00 1.24812e+02 293.592 6.98470e+00 293.592 0.9242 
1 1 1 12  16  12 o 4  4.79205e+00 1.59349e+00 8.56367e+01 60.764  2.02048e+00  3.60995e+00  0.00000e+00 0.00000e+00 7.26724e+01 60.764  1.29642e+01 240.764 0.8686 
1 1 1 12  17  0  o 9  1.00373e+01 1.37115e+00 9.32813e+01 80.861  5.69432e-01  3.53969e+00  0.00000e+00 0.00000e+00 2.29002e+02 80.861  1.35721e+02 80.861  0.8454 
1 1 1 12  17  1  o 9  3.53026e+01 1.06937e+00 5.17192e+02 4.303   7.57091e+01  5.69662e+00  0.00000e+00 0.00000e+00 8.15303e+02 4.303   2.98111e+02 4.303   0.9934 
1 1 1 12  17  2  o 9  7.88473e+00 1.52149e+00 1.44190e+02 359.973 4.70506e+00  -2.17862e-03 0.00000e+00 0.00000e+00 1.21368e+02 359.973 2.28218e+01 179.973 0.8861 
1 1 1 12  17  3  o 18 1.04712e+01 1.65940e+00 1.63183e+02 210.025 -6.50647e+00 -3.76027e+00 0.00000e+00 0.00000e+00 2.07446e+02 210.025 4.42633e+01 210.025 0.9309 
1 1 1 12  17  4  o 12 2.76162e+01 1.26064e+00 3.94455e+02 346.115 5.42156e+01  -1.34020e+01 0.00000e+00 0.00000e+00 6.46447e+02 346.115 2.51992e+02 346.115 0.9910 
1 1 1 12  17  5  o 12 1.30427e+01 1.90339e+00 3.01705e+02 346.689 1.89761e+01  -4.48969e+00 0.00000e+00 0.00000e+00 1.81565e+02 346.689 1.20140e+02 166.689 0.9740 
1 1 1 12  17  6  o 1  8.83855e+00 2.00388e+00 1.03900e+02 239.547 -2.48310e+00 -4.22337e+00 0.00000e+00 0.00000e+00 1.95726e+02 239.547 9.18258e+01 239.547 0.8910 
1 1 1 12  17  7  o 14 1.64438e+01 1.39029e+00 3.37217e+02 73.546  1.13688e+01  3.84947e+01  0.00000e+00 0.00000e+00 2.80634e+02 73.546  5.65828e+01 253.546 0.9875 
1 1 1 12  17  8  o 12 9.55596e+00 1.63687e+00 1.03101e+02 184.339 -7.14521e+00 -5.42158e-01 0.00000e+00 0.00000e+00 2.34097e+02 184.339 1.30996e+02 184.339 0.9273 
1 1 1 12  17  9  o 7  4.72846e+00 1.44465e+00 5.22233e+01 340.805 2.10736e+00  -7.33658e-01 0.00000e+00 0.00000e+00 7.95388e+01 340.805 2.73155e+01 340.805 0.7323 
1 1 1 12  17  10 o 18 6.96038e+00 1.71141e+00 1.43343e+02 177.814 -8.57149e+00 3.27196e-01  0.00000e+00 0.00000e+00 1.05523e+02 177.814 3.78200e+01 357.814 0.9398 
1 1 1 12  17  11 f 0  5.64945e+00 1.70034e+00 1.29394e+02 122.605 -3.61537e+00 5.65208e+00  0.00000e+00 0.00000e+00 6.87806e+01 122.605 6.06133e+01 302.605 0.9221 
1 1 1 12  17  12 o 4  6.06292e+00 1.84323e+00 5.82936e+01 236.479 -1.76321e+00 -2.66184e+00 0.00000e+00 0.00000e+00 1.31545e+02 236.479 7.32517e+01 236.479 0.8233 
1 1 1 12  18  0  o 8  5.04915e+00 1.33759e+00 2.04464e+02 228.727 -2.69868e+00 -3.07480e+00 0.00000e+00 0.00000e+00 3.82277e+01 48.727  2.42692e+02 48.727  0.8669 
1 1 1 12  18  1  o 17 1.21766e+01 1.16059e+00 1.46067e+02 78.539  1.50947e+00  7.44533e+00  0.00000e+00 0.00000e+00 2.84951e+02 78.539  1.38885e+02 78.539  0.9316 
1 1 1 12  18  2  o 8  1.95988e+01 1.19914e+00 4.76583e+02 227.860 -2.78225e+01 -3.07481e+01 0.00000e+00 0.00000e+00 2.59312e+02 227.860 2.17271e+02 47.860  0.9879 
1 1 1 12  18  3  o 4  4.71278e+00 1.41296e+00 7.44566e+01 238.486 -8.59911e-01 -1.40249e+00 0.00000e+00 0.00000e+00 3.84340e+01 238.486 3.60227e+01 58.486  0.6300 
1 1 1 12  18  4  o 17 8.33077e+00 1.77945e+00 1.08069e+02 253.407 -1.14129e+00 -3.82997e+00 0.00000e+00 0.00000e+00 1.65481e+02 253.407 5.74115e+01 253.407 0.8634 
1 1 1 12  18  5  o 17 7.22286e+00 1.90557e+00 1.34754e+02 44.652  3.42537e+00  3.38398e+00  0.00000e+00 0.00000e+00 1.09479e+02 44.652  2.52754e+01 224.652 0.8889 
1 1 1 12  18  6  o 1  4.55217e+00 1.54080e+00 1.31966e+02 128.572 -2.39460e+00 3.00270e+00  0.00000e+00 0.00000e+00 1.64751e+01 128.572 1.15491e+02 308.572 0.8571 
1 1 1 12  18  7  o 4  8.30988e+00 1.64118e+00 1.41322e+02 184.188 -7.66808e+00 -5.61444e-01 0.00000e+00 0.00000e+00 1.53516e+02 184.188 1.21946e+01 184.188 0.9325 
1 1 1 12  18  8  o 15 5.06952e+00 1.47737e+00 6.08229e+01 323.118 1.99257e+00  -1.49508e+00 0.00000e+00 0.00000e+00 8.65527e+01 323.118 2.57299e+01 323.118 0.7640 
1 1 1 12  18  9  o 7  7.74057e+00 1.66836e+00 1.36066e+02 96.584  -1.00258e+00 8.68620e+00  0.00000e+00 0.00000e+00 1.41058e+02 96.584  4.99210e+00 96.584  0.9409 
1 1 1 12  18  10 o 4  9.66653e+00 1.81646e+00 1.68028e+02 0.257   1.31611e+01  5.89395e-02  0.00000e+00 0.00000e+00 1.85472e+02 0.257   1.74443e+01 0.257   0.9612 
1 1 1 12  18  11 o 1  7.56822e+00 1.91536e+00 1.64223e+02 187.738 -9.94932e+00 -1.35185e+00 0.00000e+00 0.00000e+00 1.08926e+02 187.738 5.52974e+01 7.738   0.9488 
1 1 1 12  18  12 o 6  5.61715e+00 1.72257e+00 1.12425e+02 318.615 4.62009e+00  -4.07106e+00 0.00000e+00 0.00000e+00 8.29842e+01 318.615 2.94411e+01 138.615 0.9147 
1 1 1 12  19  0  o 12 1.71284e+01 8.90781e-01 3.65321e+02 56.641  1.47158e+01  2.23523e+01  0.00000e+00 0.00000e+00 2.72861e+02 56.641  9.24596e+01 236.641 0.9811 
1 1 1 12  19  1  o 16 2.11822e+01 9.56298e-01 4.04464e+02 238.672 -1.96796e+01 -3.23318e+01 0.00000e+00 0.00000e+00 3.89591e+02 238.672 1.48727e+01 58.672  0.9867 
1 1 1 12  19  2  o 5  2.55453e+01 1.17562e+00 4.02930e+02 339.023 4.19856e+01  -1.60974e+01 0.00000e+00 0.00000e+00 5.57116e+02 339.023 1.54187e+02 339.023 0.9888 
1 1 1 12  19  3  o 13 4.56328e+00 1.40780e+00 1.06321e+02 59.864  1.14171e+00  1.96667e+00  0.00000e+00 0.00000e+00 2.17214e+01 59.864  8.45992e+01 239.864 0.7380 
1 1 1 12  19  4  o 14 2.08998e+01 1.06399e+00 3.53879e+02 270.412 3.02424e-01  -4.20571e+01 0.00000e+00 0.00000e+00 4.31433e+02 270.412 7.75540e+01 270.412 0.9880 
1 1 1 12  19  5  o 16 5.49549e+00 1.69764e+00 1.19154e+02 115.890 -1.58443e+00 3.26443e+00  0.00000e+00 0.00000e+00 5.80151e+01 115.890 6.11393e+01 295.890 0.8476 
1 1 1 12  19  6  o 14 8.45295e+00 2.06282e+00 1.10008e+02 205.748 -4.35301e+00 -2.09947e+00 0.00000e+00 0.00000e+00 1.75991e+02 205.748 6.59827e+01 205.748 0.8894 
1 1 1 12  19  7  o 13 1.43202e+01 1.57710e+00 2.75767e+02 121.324 -1.37973e+01 2.26708e+01  0.00000e+00 0.00000e+00 2.58705e+02 121.324 1.70616e+01 301.324 0.9810 
1 1 1 12  19  8  o 11 8.09678e+00 1.71279e+00 2.25095e+02 14.526  1.27702e+01  3.30886e+00  0.00000e+00 0.00000e+00 7.10532e+01 14.526  1.54042e+02 194.526 0.9613 
1 1 1 12  19  9  o 19 6.76834e+00 1.49903e+00 1.45353e+02 161.871 -8.47497e+00 2.77483e+00  0.00000e+00 0.00000e+00 9.72591e+01 161.871 4.80938e+01 341.871 0.9421 
1 1 1 12  19  10 o 9  8.48571e+00 1.82543e+00 1.27902e+02 30.123  7.34755e+00  4.26316e+00  0.00000e+00 0.00000e+00 1.75275e+02 30.123  4.73733e+01 30.123  0.9392 
1 1 1 12  19  11 o 1  6.21833e+00 1.81424e+00 1.04662e+02 166.229 -5.41851e+00 1.32799e+00  0.00000e+00 0.00000e+00 1.09458e+02 166.229 4.79613e+00 166.229 0.9053 
1 1 1 12  19  12 o 6  3.71402e+00 1.30313e+00 8.71740e+01 166.811 -4.01027e+00 9.39796e-01  0.00000e+00 0.00000e+00 3.54129e+01 166.811 5.17611e+01 346.811 0.8679 
1 1 1 12  20  0  o 10 1.47490e+01 9.28274e-01 1.60523e+02 128.973 -6.62073e+00 8.18375e+00  0.00000e+00 0.00000e+00 3.72235e+02 128.973 2.11712e+02 128.973 0.9512 
1 1 1 12  20  1  o 9  2.91760e+01 9.70990e-01 4.29859e+02 137.411 -4.28739e+01 3.94095e+01  0.00000e+00 0.00000e+00 6.68984e+02 137.411 2.39126e+02 137.411 0.9914 
1 1 1 12  20  2  o 5  1.10286e+01 1.48631e+00 1.25095e+02 76.641  1.30056e+00  5.47677e+00  0.00000e+00 0.00000e+00 2.54726e+02 76.641  1.29631e+02 76.641  0.9062 
1 1 1 12  20  3  o 11 7.89647e+00 1.69623e+00 1.74886e+02 117.887 -3.02371e+00 5.71391e+00  0.00000e+00 0.00000e+00 1.01009e+02 117.887 7.38773e+01 297.887 0.9190 
1 1 1 12  20  4  o 13 7.48399e+00 2.23181e+00 1.21807e+02 211.071 -3.13158e+00 -1.88693e+00 0.00000e+00 0.00000e+00 1.19780e+02 211.071 2.02724e+00 31.071  0.8489 
1 1 1 12  20  5  f 0  1.67548e+01 1.69282e+00 1.79667e+02 266.404 -1.04664e+00 -1.66561e+01 0.00000e+00 0.00000e+00 4.38217e+02 266.404 2.58549e+02 266.404 0.9696 
1 1 1 12  20  6  o 9  1.47100e+01 2.00385e+00 2.60321e+02 179.846 -1.96686e+01 5.29778e-02  0.00000e+00 0.00000e+00 2.84855e+02 179.846 2.45343e+01 179.846 0.9742 
1 1 1 12  20  7  o 7  2.21882e+01 1.20495e+00 3.34871e+02 22.161  5.32508e+01  2.16885e+01  0.00000e+00 0.00000e+00 5.01903e+02 22.161  1.67032e+02 22.161  0.9913 
1 1 1 12  20  8  o 13 8.87771e+00 1.57959e+00 1.74299e+02 199.556 -1.09580e+01 -3.89248e+00 0.00000e+00 0.00000e+00 1.48594e+02 199.556 2.57047e+01 19.556  0.9560 
1 1 1 12  20  9  o 16 7.03963e+00 1.71191e+00 7.05289e+01 270.824 5.78091e-02  -4.02091e+00 0.00000e+00 0.00000e+00 1.60957e+02 270.824 9.04277e+01 270.824 0.8643 
1 1 1 12  20  10 o 1  5.65347e+00 1.64088e+00 1.11578e+02 67.239  2.10979e+00  5.02858e+00  0.00000e+00 0.00000e+00 8.26083e+01 67.239  2.89697e+01 247.239 0.9029 
1 1 1 12  20  11 f 0  4.37693e+00 1.43594e+00 7.13293e+00 27.300  2.98649e-01  1.54144e-01  0.00000e+00 0.00000e+00 2.04541e+01 27.300  1.33212e+01 27.300  0.1657 
1 1 1 12  20  12 o 9  7.65157e+00 1.83073e+00 1.32231e+02 174.285 -9.14398e+00 9.15180e-01  0.00000e+00 0.00000e+00 1.42411e+02 174.285 1.01802e+01 174.285 0.9439 
1 1 1 12  21  0  o 1  1.15444e+01 1.06921e+00 1.93863e+02 16.586  9.29540e+00  2.76868e+00  0.00000e+00 0.00000e+00 2.21234e+02 16.586  2.73710e+01 16.586  0.9470 
1 1 1 12  21  1  o 1  2.32270e+01 9.48739e-01 3.87681e+02 80.217  7.12019e+00  4.12955e+01  0.00000e+00 0.00000e+00 4.84076e+02 80.217  9.63946e+01 80.217  0.9880 
1 1 1 12  21  2  o 12 3.26063e+01 1.21723e+00 5.99106e+02 232.109 -5.53764e+01 -7.11581e+01 0.00000e+00 0.00000e+00 6.33140e+02 232.109 3.40339e+01 232.109 0.9944 
1 1 1 12  21  3  o 10 1.47781e+01 1.32672e+00 2.69200e+02 147.582 -1.74270e+01 1.10671e+01  0.00000e+00 0.00000e+00 2.78816e+02 147.582 9.61623e+00 147.582 0.9755 
1 1 1 12  21  4  o 12 1.25363e+01 1.47467e+00 1.59663e+02 288.460 3.28992e+00  -9.85544e+00 0.00000e+00 0.00000e+00 2.93484e+02 288.460 1.33821e+02 288.460 0.9506 
1 1 1 12  21  5  o 1  1.35964e+01 1.86824e+00 2.68934e+02 305.667 1.11371e+01  -1.55178e+01 0.00000e+00 0.00000e+00 2.34465e+02 305.667 3.44688e+01 125.667 0.9735 
1 1 1 12  21  6  o 1  1.58956e+01 1.80062e+00 2.82083e+02 74.664  6.58057e+00  2.39953e+01  0.00000e+00 0.00000e+00 3.10299e+02 74.664  2.82160e+01 74.664  0.9797 
1 1 1 12  21  7  o 13 7.35136e+00 1.66799e+00 1.84605e+02 116.134 -4.02046e+00 8.19447e+00  0.00000e+00 0.00000e+00 7.92640e+01 116.134 1.05341e+02 296.134 0.9435 
1 1 1 12  21  8  o 7  1.53460e+01 1.27750e+00 3.00027e+02 313.523 2.71556e+01  -2.85927e+01 0.00000e+00 0.00000e+00 2.76341e+02 313.523 2.36851e+01 133.523 0.9872 
1 1 1 12  21  9  f 0  7.93963e+00 1.74795e+00 2.34359e+02 111.637 -5.44976e+00 1.37383e+01  0.00000e+00 0.00000e+00 5.72786e+01 111.637 1.77080e+02 291.637 0.9656 
1 1 1 12  21  10 o 2  5.87498e+00 1.67732e+00 1.22685e+02 316.251 4.51254e+00  -4.31966e+00 0.00000e+00 0.00000e+00 8.20258e+01 316.251 4.06593e+01 136.251 0.9160 
1 1 1 12  21  11 o 2  4.38185e+00 1.45256e+00 9.02694e+01 12.572  4.11268e+00  9.17153e-01  0.00000e+00 0.00000e+00 5.49292e+01 12.572  3.53402e+01 192.572 0.8713 
1 1 1 12  21  12 o 12 5.16314e+00 1.65535e+00 7.41227e+01 163.669 -3.77974e+00 1.10749e+00  0.00000e+00 0.00000e+00 9.49366e+01 163.669 2.08139e+01 163.669 0.8611 
1 1 1 12  22  0  o 8  1.26094e+01 1.08055e+00 2.49478e+02 128.175 -8.84867e+00 1.12548e+01  0.00000e+00 0.00000e+00 2.12250e+02 128.175 3.72285e+01 308.175 0.9644 
1 1 1 12  22  1  o 5  5.76040e+00 1.44027e+00 1.39359e+02 317.629 2.45214e+00  -2.23683e+00 0.00000e+00 0.00000e+00 4.24897e+01 317.629 9.68690e+01 137.629 0.8311 
1 1 1 12  22  2  o 7  1.28610e+01 1.43625e+00 1.82343e+02 169.791 -1.01139e+01 1.82138e+00  0.00000e+00 0.00000e+00 2.81962e+02 169.791 9.96187e+01 169.791 0.9500 
1 1 1 12  22  3  f 0  1.63583e+01 1.25826e+00 4.32255e+02 4.756   3.59238e+01  2.98898e+00  0.00000e+00 0.00000e+00 1.80891e+02 4.756   2.51364e+02 184.756 0.9860 
1 1 1 12  22  4  o 5  4.78695e+00 1.54460e+00 9.86766e+01 260.365 -4.01387e-01 -2.36440e+00 0.00000e+00 0.00000e+00 3.84654e+01 260.365 6.02113e+01 80.365  0.7535 
1 1 1 12  22  5  o 14 8.45017e+00 1.94615e+00 1.68116e+02 97.079  -8.87464e-01 7.14612e+00  0.00000e+00 0.00000e+00 1.30025e+02 97.079  3.80905e+01 277.079 0.9277 
1 1 1 12  22  6  o 19 9.54480e+00 1.55179e+00 1.17170e+02 285.827 1.98294e+00  -6.99477e+00 0.00000e+00 0.00000e+00 2.19904e+02 285.827 1.02734e+02 285.827 0.9284 
1 1 1 12  22  7  o 8  1.32631e+01 1.51099e+00 2.79625e+02 350.780 2.62713e+01  -4.26420e+00 0.00000e+00 0.00000e+00 2.15336e+02 350.780 6.42893e+01 170.781 0.9810 
1 1 1 12  22  8  o 3  1.43943e+01 1.28486e+00 3.06837e+02 139.639 -3.00292e+01 2.55220e+01  0.00000e+00 0.00000e+00 2.33749e+02 139.639 7.30880e+01 319.639 0.9872 
1 1 1 12  22  9  o 6  6.90708e+00 1.74511e+00 1.47352e+02 38.040  6.15367e+00  4.81466e+00  0.00000e+00 0.00000e+00 9.79533e+01 38.040  4.93985e+01 218.040 0.9336 
1 1 1 12  22  10 o 18 4.49972e+00 1.45373e+00 5.04781e+01 263.950 -2.34379e-01 -2.21126e+00 0.00000e+00 0.00000e+00 7.46835e+01 263.950 2.42054e+01 263.950 0.7313 
1 1 1 12  22  11 o 11 6.59685e+00 1.80648e+00 8.38257e+01 242.438 -2.21084e+00 -4.23586e+00 0.00000e+00 0.00000e+00 1.38948e+02 242.438 5.51227e+01 242.438 0.8880 
1 1 1 12  22  12 o 18 1.19339e+01 2.09319e+00 2.95838e+02 135.078 -1.94666e+01 1.94137e+01  0.00000e+00 0.00000e+00 1.49584e+02 135.078 1.46255e+02 315.078 0.9816 
1 1 1 12  23  0  o 15 8.78207e+00 1.31807e+00 1.70229e+02 246.191 -2.61357e+00 -5.92331e+00 0.00000e+00 0.00000e+00 1.36236e+02 246.191 3.39926e+01 66.191  0.9192 
1 1 1 12  23  1  o 8  2.92106e+01 1.12163e+00 5.23598e+02 164.488 -6.49525e+01 1.80277e+01  0.00000e+00 0.00000e+00 5.77661e+02 164.488 5.40624e+01 164.488 0.9926 
1 1 1 12  23  2  o 5  1.82802e+01 1.20632e+00 2.83554e+02 99.351  -4.14790e+00 2.51898e+01  0.00000e+00 0.00000e+00 3.97322e+02 99.351  1.13769e+02 99.351  0.9802 
1 1 1 12  23  3  o 19 1.60424e+01 1.32433e+00 4.19827e+02 273.033 1.78324e+00  -3.36586e+01 0.00000e+00 0.00000e+00 1.80846e+02 273.033 2.38982e+02 93.033  0.9851 
1 1 1 12  23  4  o 17 2.46660e+01 1.41114e+00 3.73731e+02 162.219 -5.00851e+01 1.60619e+01  0.00000e+00 0.00000e+00 5.55141e+02 162.219 1.81410e+02 162.219 0.9904 
1 1 1 12  23  5  o 19 1.05165e+01 1.93850e+00 1.54160e+02 350.121 8.01589e+00  -1.39597e+00 0.00000e+00 0.00000e+00 2.20324e+02 350.121 6.61644e+01 350.121 0.9364 
1 1 1 12  23  6  o 7  6.32372e+00 1.69871e+00 2.03952e+02 139.400 -6.00332e+00 5.14550e+00  0.00000e+00 0.00000e+00 2.08006e+01 139.400 1.83151e+02 319.400 0.9344 
1 1 1 12  23  7  o 16 8.05218e+00 1.52497e+00 2.03288e+02 173.269 -1.17063e+01 1.38153e+00  0.00000e+00 0.00000e+00 8.97060e+01 173.269 1.13582e+02 353.269 0.9566 
1 1 1 12  23  8  o 19 6.55268e+00 1.63114e+00 1.49630e+02 215.882 -6.04589e+00 -4.37362e+00 0.00000e+00 0.00000e+00 8.22683e+01 215.882 6.73617e+01 35.882  0.9304 
1 1 1 12  23  9  o 12 2.31350e+01 1.16089e+00 3.17363e+02 229.019 -4.91029e+01 -5.65247e+01 0.00000e+00 0.00000e+00 5.56742e+02 229.019 2.39379e+02 229.019 0.9933 
1 1 1 12  23  10 o 8  6.10869e+00 1.66449e+00 1.68229e+02 47.331  6.29472e+00  6.82886e+00  0.00000e+00 0.00000e+00 5.12202e+01 47.331  1.17008e+02 227.331 0.9445 
1 1 1 12  23  11 o 1  8.45673e+00 1.99792e+00 1.81426e+02 124.438 -6.69123e+00 9.75841e+00  0.00000e+00 0.00000e+00 1.26261e+02 124.438 5.51645e+01 304.438 0.9568 
1 1 1 12  23  12 o 11 4.92953e+00 1.62013e+00 1.84554e+02 284.543 2.32350e+00  -8.95640e+00 0.00000e+00 0.00000e+00 7.57266e+00 104.543 1.92127e+02 104.543 0.9443 
1 1 1 12  24  0  o 13 8.33600e+00 1.33983e+00 2.04295e+02 248.037 -2.69035e+00 -6.67142e+00 0.00000e+00 0.00000e+00 8.92691e+01 248.037 1.15026e+02 68.037  0.9276 
1 1 1 12  24  1  o 8  1.99989e+01 1.09286e+00 4.59764e+02 81.345  6.55338e+00  4.30531e+01  0.00000e+00 0.00000e+00 2.91044e+02 81.345  1.68720e+02 261.345 0.9885 
1 1 1 12  24  2  o 2  1.71205e+01 1.23038e+00 2.93660e+02 321.060 1.91151e+01  -1.54459e+01 0.00000e+00 0.00000e+00 3.43474e+02 321.060 4.98135e+01 321.060 0.9794 
1 1 1 12  24  3  o 18 1.19080e+01 1.49238e+00 1.47149e+02 227.706 -5.68684e+00 -6.25113e+00 0.00000e+00 0.00000e+00 2.77769e+02 227.706 1.30620e+02 227.706 0.9388 
1 1 1 12  24  4  o 18 8.37017e+00 1.89052e+00 1.68475e+02 30.045  5.93546e+00  3.43299e+00  0.00000e+00 0.00000e+00 1.25531e+02 30.045  4.29441e+01 210.044 0.9239 
1 1 1 12  24  5  o 13 7.07232e+00 1.90260e+00 1.45736e+02 177.714 -5.22971e+00 2.08742e-01  0.00000e+00 0.00000e+00 9.59144e+01 177.714 4.98214e+01 357.714 0.8985 
1 1 1 12  24  6  o 11 9.09471e+00 1.79800e+00 1.50255e+02 205.806 -7.31467e+00 -3.53696e+00 0.00000e+00 0.00000e+00 1.73595e+02 205.806 2.33393e+01 205.806 0.9363 
1 1 1 12  24  7  o 8  1.08026e+01 1.47681e+00 1.61749e+02 59.387  6.53138e+00  1.10381e+01  0.00000e+00 0.00000e+00 2.32777e+02 59.387  7.10276e+01 59.387  0.9602 
1 1 1 12  24  8  o 11 1.32393e+01 1.37021e+00 1.94348e+02 293.416 8.35675e+00  -1.92966e+01 0.00000e+00 0.00000e+00 2.97107e+02 293.416 1.02760e+02 293.416 0.9759 
1 1 1 12  24  9  o 3  8.98135e+00 1.75167e+00 1.48757e+02 185.052 -1.07700e+01 -9.52038e-01 0.00000e+00 0.00000e+00 1.76648e+02 185.052 2.78907e+01 185.052 0.9526 
1 1 1 12  24  10 o 16 1.11314e+01 1.75044e+00 1.70726e+02 76.347  3.85734e+00  1.58799e+01  0.00000e+00 0.00000e+00 2.39453e+02 76.347  6.87275e+01 76.347  0.9689 
1 1 1 12  24  11 o 13 4.67308e+00 1.52318e+00 4.47560e+01 106.714 -6.31846e-01 2.10412e+00  0.00000e+00 0.00000e+00 8.45366e+01 106.714 3.97806e+01 106.714 0.7276 
1 1 1 12  24  12 o 18 4.42509e+00 1.50329e+00 8.38656e+01 84.592  3.82388e-01  4.03951e+00  0.00000e+00 0.00000e+00 6.17708e+01 84.592  2.20948e+01 264.592 0.8657 
1 1 1 12  25  0  o 1  1.79720e+01 9.23720e-01 4.16098e+02 67.572  1.30007e+01  3.14986e+01  0.00000e+00 0.00000e+00 2.56056e+02 67.572  1.60042e+02 247.572 0.9852 
1 1 1 12  25  1  o 11 2.02585e+01 1.06872e+00 3.71835e+02 96.952  -4.32691e+00 3.54843e+01  0.00000e+00 0.00000e+00 3.86713e+02 96.952  1.48784e+01 96.952  0.9859 
1 1 1 12  25  2  o 9  9.72149e+00 1.62406e+00 1.98028e+02 233.931 -5.41698e+00 -7.43692e+00 0.00000e+00 0.00000e+00 1.50634e+02 233.931 4.73938e+01 53.931  0.9440 
1 1 1 12  25  3  o 6  7.61736e+00 1.77576e+00 1.13376e+01 105.883 -1.10311e-01 3.87681e-01  0.00000e+00 0.00000e+00 4.58540e+01 105.883 3.45164e+01 105.883 0.1975 
1 1 1 12  25  4  o 15 1.24891e+01 1.82615e+00 1.70418e+02 42.276  8.02037e+00  7.29185e+00  0.00000e+00 0.00000e+00 2.81909e+02 42.276  1.11491e+02 42.276  0.9527 
1 1 1 12  25  5  o 4  7.73055e+00 1.93978e+00 1.35518e+02 281.945 1.12683e+00  -5.32638e+00 0.00000e+00 0.00000e+00 1.29845e+02 281.945 5.67268e+00 101.945 0.9028 
1 1 1 12  25  6  o 1  1.01262e+01 1.79836e+00 1.12613e+02 61.370  3.36229e+00  6.15917e+00  0.00000e+00 0.00000e+00 2.43882e+02 61.370  1.31269e+02 61.370  0.9257 
1 1 1 12  25  7  o 8  1.58582e+01 1.15731e+00 2.96465e+02 351.292 3.86879e+01  -5.92545e+00 0.00000e+00 0.00000e+00 2.98914e+02 351.292 2.44935e+00 351.292 0.9871 
1 1 1 12  25  8  o 9  1.16899e+01 1.50964e+00 1.86762e+02 188.574 -1.65855e+01 -2.50048e+00 0.00000e+00 0.00000e+00 2.44389e+02 188.574 5.76269e+01 188.574 0.9697 
1 1 1 12  25  9  o 7  1.28125e+01 1.47103e+00 2.25693e+02 125.561 -1.57963e+01 2.20955e+01  0.00000e+00 0.00000e+00 2.52543e+02 125.561 2.68503e+01 125.561 0.9814 
1 1 1 12  25  10 o 12 4.98257e+00 1.51672e+00 1.22742e+02 3.136   5.90512e+00  3.23544e-01  0.00000e+00 0.00000e+00 4.98765e+01 3.136   7.28654e+01 183.136 0.9110 
1 1 1 12  25  11 o 6  6.76307e+00 1.77158e+00 7.13163e+01 61.566  1.99290e+00  3.68053e+00  0.00000e+00 0.00000e+00 1.52481e+02 61.566  8.11647e+01 61.566  0.8703 
1 1 1 12  25  12 o 17 5.62796e+00 1.77039e+00 6.26322e+01 161.780 -3.24433e+00 1.06791e+00  0.00000e+00 0.00000e+00 1.16347e+02 161.780 5.37152e+01 161.780 0.8366 
1 1 1 12  26  0  o 12 1.21869e+01 1.06732e+00 2.01673e+02 44.010  8.40280e+00  8.11729e+00  0.00000e+00 0.00000e+00 2.40661e+02 44.010  3.89874e+01 44.010  0.9562 
1 1 1 12  26  1  o 7  1.46427e+01 1.54080e+00 2.85705e+02 24.221  1.72972e+01  7.78148e+00  0.00000e+00 0.00000e+00 2.55499e+02 24.221  3.02059e+01 204.221 0.9733 
1 1 1 12  26  2  o 16 2.28793e+01 1.16992e+00 3.63948e+02 221.473 -3.24979e+01 -2.87247e+01 0.00000e+00 0.00000e+00 4.95172e+02 221.473 1.31224e+02 221.473 0.9884 
1 1 1 12  26  3  o 13 1.83995e+01 1.13572e+00 4.43225e+02 4.115   4.53797e+01  3.26441e+00  0.00000e+00 0.00000e+00 2.48288e+02 4.115   1.94937e+02 184.114 0.9889 
1 1 1 12  26  4  o 5  2.96964e+01 1.41716e+00 5.02787e+02 191.352 -8.54020e+01 -1.71455e+01 0.00000e+00 0.00000e+00 6.19579e+02 191.352 1.16792e+02 191.352 0.9942 
1 1 1 12  26  5  o 8  1.25230e+01 1.80763e+00 2.20445e+02 111.672 -5.56331e+00 1.39996e+01  0.00000e+00 0.00000e+00 2.39612e+02 111.672 1.91662e+01 111.672 0.9662 
1 1 1 12  26  6  o 15 3.28535e+00 1.55701e+00 1.09420e+02 326.721 2.03956e+00  -1.33869e+00 0.00000e+00 0.00000e+00 1.46874e+01 146.721 1.24107e+02 146.721 0.7583 
1 1 1 12  26  7  o 3  1.27100e+01 1.35370e+00 2.42206e+02 340.845 2.43329e+01  -8.45227e+00 0.00000e+00 0.00000e+00 2.31685e+02 340.845 1.05209e+01 160.845 0.9804 
1 1 1 12  26  8  o 19 3.67238e+00 1.22747e+00 7.34426e+01 123.820 -1.38975e+00 2.07443e+00  0.00000e+00 0.00000e+00 3.33545e+01 123.820 4.00881e+01 303.820 0.7647 
1 1 1 12  26  9  o 19 9.76513e+00 1.75179e+00 2.16948e+02 318.777 1.25559e+01  -1.10006e+01 0.00000e+00 0.00000e+00 1.43119e+02 318.777 7.38280e+01 138.777 0.9696 
1 1 1 12  26  10 o 11 7.04930e+00 1.80199e+00 1.70243e+02 156.814 -8.99804e+00 3.85403e+00  0.00000e+00 0.00000e+00 8.37310e+01 156.814 8.65120e+01 336.814 0.9475 
1 1 1 12  26  11 o 19 8.34165e+00 1.95495e+00 2.22008e+02 279.075 2.27654e+00  -1.42527e+01 0.00000e+00 0.00000e+00 8.39521e+01 279.075 1.38056e+02 99.075  0.9647 
1 1 1 12  26  12 o 1  8.13706e+00 2.04468e+00 1.46081e+02 97.451  -1.25158e+00 9.56985e+00  0.00000e+00 0.00000e+00 1.46733e+02 97.451  6.51991e-01 97.451  0.9467 
1 1 1 12  27  0  o 17 1.60400e+01 9.61637e-01 1.92076e+02 277.408 2.05974e+00  -1.58419e+01 0.00000e+00 0.00000e+00 3.97364e+02 277.408 2.05288e+02 277.408 0.9682 
1 1 1 12  27  2  o 17 2.09827e+01 1.18884e+00 3.29933e+02 74.027  9.85413e+00  3.44267e+01  0.00000e+00 0.00000e+00 4.55946e+02 74.027  1.26013e+02 74.027  0.9859 
1 1 1 12  27  3  o 2  1.67212e+01 1.12126e+00 3.01694e+02 194.307 -2.78728e+01 -7.10813e+00 0.00000e+00 0.00000e+00 3.22577e+02 194.307 2.08832e+01 194.307 0.9825 
1 1 1 12  27  4  o 2  2.52818e+01 1.43216e+00 3.65876e+02 248.435 -2.06197e+01 -5.21719e+01 0.00000e+00 0.00000e+00 5.86502e+02 248.435 2.20626e+02 248.435 0.9910 
1 1 1 12  27  5  o 1  6.61470e+00 1.90384e+00 1.40796e+02 200.197 -4.84907e+00 -1.78387e+00 0.00000e+00 0.00000e+00 8.48116e+01 200.197 5.59846e+01 20.197  0.8971 
1 1 1 12  27  6  o 15 7.33315e+00 2.03718e+00 4.63149e+01 176.125 -1.87979e+00 1.27312e-01  0.00000e+00 0.00000e+00 1.42679e+02 176.125 9.63643e+01 176.125 0.6778 
1 1 1 12  27  7  o 18 1.89871e+01 1.11979e+00 3.10664e+02 207.815 -4.80060e+01 -2.53264e+01 0.00000e+00 0.00000e+00 4.04686e+02 207.815 9.40222e+01 207.815 0.9907 
1 1 1 12  27  8  o 8  5.24664e+00 1.52370e+00 8.66573e+01 312.157 2.55671e+00  -2.82392e+00 0.00000e+00 0.00000e+00 8.40880e+01 312.157 2.56926e+00 132.157 0.8558 
1 1 1 12  27  9  o 7  1.04958e+01 1.66174e+00 2.55065e+02 288.790 7.43151e+00  -2.18428e+01 0.00000e+00 0.00000e+00 1.35313e+02 288.790 1.19753e+02 108.790 0.9781 
1 1 1 12  27  10 o 19 5.04678e+00 1.53963e+00 7.39853e+01 278.369 5.12650e-01  -3.48474e+00 0.00000e+00 0.00000e+00 8.76410e+01 278.369 1.36557e+01 278.369 0.8423 
1 1 1 12  27  11 o 13 6.74782e+00 1.89877e+00 9.67058e+01 269.801 -1.93784e-02 -5.59079e+00 0.00000e+00 0.00000e+00 1.35585e+02 269.801 3.88793e+01 269.801 0.9055 
1 1 1 12  27  12 o 2  5.67976e+00 1.73874e+00 4.11189e+01 229.308 -1.54367e+00 -1.79518e+00 0.00000e+00 0.00000e+00 1.20750e+02 229.308 7.96307e+01 229.308 0.7498 
1 1 1 12  28  0  o 6  1.14080e+01 1.14301e+00 2.16571e+02 335.468 1.12048e+01  -5.11387e+00 0.00000e+00 0.00000e+00 1.98431e+02 335.468 1.81395e+01 155.468 0.9585 
1 1 1 12  28  1  o 10 1.85801e+01 1.17045e+00 3.79469e+02 7.878   3.76856e+01  5.21485e+00  0.00000e+00 0.00000e+00 3.16689e+02 7.878   6.27800e+01 187.878 0.9868 
1 1 1 12  28  2  o 7  2.66022e+01 1.16854e+00 3.73868e+02 132.697 -3.53048e+01 3.82629e+01  0.00000e+00 0.00000e+00 6.26866e+02 132.697 2.52998e+02 132.697 0.9903 
1 1 1 12  28  3  o 3  1.46723e+01 1.16862e+00 1.40390e+02 40.210  8.84601e+00  7.47817e+00  0.00000e+00 0.00000e+00 3.92487e+02 40.210  2.52097e+02 40.210  0.9558 
1 1 1 12  28  4  o 2  8.58002e+00 1.86436e+00 1.65846e+02 271.234 1.60203e-01  -7.43978e+00 0.00000e+00 0.00000e+00 1.37486e+02 271.234 2.83604e+01 91.234  0.9302 
1 1 1 12  28  5  o 2  6.41137e+00 1.70689e+00 8.40161e+01 350.776 3.06138e+00  -4.97126e-01 0.00000e+00 0.00000e+00 1.15167e+02 350.776 3.11511e+01 350.776 0.8172 
1 1 1 12  28  6  o 18 6.45248e+00 2.10756e+00 1.35958e+02 197.718 -4.49284e+00 -1.43539e+00 0.00000e+00 0.00000e+00 8.14972e+01 197.718 5.44604e+01 17.718  0.8864 
1 1 1 12  28  7  o 19 2.12409e+01 1.07099e+00 4.33545e+02 347.576 8.30545e+01  -1.82971e+01 0.00000e+00 0.00000e+00 3.69374e+02 347.576 6.41704e+01 167.576 0.9941 
1 1 1 12  28  8  o 11 6.74248e+00 1.57902e+00 1.01410e+02 115.157 -2.36774e+00 5.04156e+00  0.00000e+00 0.00000e+00 1.30649e+02 115.157 2.92393e+01 115.157 0.9051 
1 1 1 12  28  9  o 17 7.03833e+00 1.70723e+00 1.77649e+02 325.263 8.63087e+00  -5.98464e+00 0.00000e+00 0.00000e+00 7.69011e+01 325.263 1.00747e+02 145.263 0.9511 
1 1 1 12  28  10 o 16 3.64556e+00 1.23850e+00 8.14738e+01 149.981 -3.15896e+00 1.82519e+00  0.00000e+00 0.00000e+00 3.61328e+01 149.981 4.53410e+01 329.981 0.8485 
1 1 1 12  28  11 o 9  4.82745e+00 1.55011e+00 7.65215e+01 246.823 -1.54785e+00 -3.61536e+00 0.00000e+00 0.00000e+00 8.14631e+01 246.823 4.94156e+00 246.823 0.8609 
1 1 1 12  28  12 o 8  5.19187e+00 1.69113e+00 1.61899e+02 60.611  4.17118e+00  7.40599e+00  0.00000e+00 0.00000e+00 2.34262e+01 60.611  1.38472e+02 240.611 0.9392 
1 1 1 12  29  0  o 12 2.18176e+01 9.06042e-01 4.29320e+02 215.815 -4.34609e+01 -3.13624e+01 0.00000e+00 0.00000e+00 3.90897e+02 215.815 3.84226e+01 35.815  0.9906 
1 1 1 12  29  1  o 10 1.91179e+01 1.12134e+00 4.56319e+02 48.255  3.05529e+01  3.42379e+01  0.00000e+00 0.00000e+00 2.61582e+02 48.255  1.94737e+02 228.255 0.9890 
1 1 1 12  29  2  o 11 4.73649e+00 1.40267e+00 1.70234e+02 273.742 2.74335e-01  -4.19415e+00 0.00000e+00 0.00000e+00 1.35569e+01 93.742  1.83791e+02 93.742  0.8709 
1 1 1 12  29  3  o 14 9.43000e+00 1.77091e+00 9.01352e+01 282.708 9.47598e-01  -4.20206e+00 0.00000e+00 0.00000e+00 2.23149e+02 282.708 1.33014e+02 282.708 0.8744 
1 1 1 12  29  4  o 13 8.70873e+00 1.88778e+00 1.72685e+02 22.672  7.18446e+00  3.00120e+00  0.00000e+00 0.00000e+00 1.36241e+02 22.672  3.64437e+01 202.672 0.9334 
1 1 1 12  29  5  o 16 1.02579e+01 1.37690e+00 1.41164e+02 187.382 -9.28570e+00 -1.20302e+00 0.00000e+00 0.00000e+00 2.27318e+02 187.382 8.61539e+01 187.382 0.9450 
1 1 1 12  29  6  o 14 6.58067e+00 1.52131e+00 1.65398e+02 45.597  5.23063e+00  5.34081e+00  0.00000e+00 0.00000e+00 6.73983e+01 45.597  9.79995e+01 225.597 0.9305 
1 1 1 12  29  7  o 17 1.03965e+01 1.44590e+00 1.49395e+02 180.996 -1.27259e+01 -2.21145e-01 0.00000e+00 0.00000e+00 2.30035e+02 180.996 8.06403e+01 180.996 0.9599 
1 1 1 12  29  8  o 16 6.25513e+00 1.57609e+00 1.30141e+02 232.412 -4.20222e+00 -5.45911e+00 0.00000e+00 0.00000e+00 8.96856e+01 232.412 4.04552e+01 52.412  0.9243 
1 1 1 12  29  9  o 8  3.90947e+00 1.27080e+00 4.39427e+01 117.533 -8.45550e-01 1.62202e+00  0.00000e+00 0.00000e+00 5.52962e+01 117.533 1.13535e+01 117.533 0.6676 
1 1 1 12  29  10 o 12 7.09329e+00 1.82935e+00 1.77712e+02 291.850 3.99481e+00  -9.96225e+00 0.00000e+00 0.00000e+00 7.90710e+01 291.850 9.86415e+01 111.850 0.9522 
1 1 1 12  29  11 o 15 1.06538e+01 1.90706e+00 2.20527e+02 174.407 -1.91244e+01 1.87281e+00  0.00000e+00 0.00000e+00 1.73760e+02 174.407 4.67666e+01 354.407 0.9736 
1 1 1 12  29  12 o 5  1.07769e+01 2.17643e+00 2.12818e+02 342.384 1.62373e+01  -5.15564e+00 0.00000e+00 0.00000e+00 1.84533e+02 342.384 2.82849e+01 162.384 0.9702 
1 1 1 12  30  0  o 14 2.39253e+01 8.99257e-01 4.41018e+02 222.728 -4.27190e+01 -3.94586e+01 0.00000e+00 0.00000e+00 4.59033e+02 222.728 1.80155e+01 222.728 0.9914 
1 1 1 12  30  1  o 11 1.30154e+01 1.29982e+00 3.72174e+02 42.745  1.80521e+01  1.66844e+01  0.00000e+00 0.00000e+00 1.11786e+02 42.745  2.60387e+02 222.745 0.9794 
1 1 1 12  30  2  o 15 8.15504e+00 1.57015e+00 1.58812e+02 42.881  4.70404e+00  4.36837e+00  0.00000e+00 0.00000e+00 1.25642e+02 42.881  3.31700e+01 222.881 0.9184 
1 1 1 12  30  3  o 3  1.01009e+01 1.68844e+00 1.80982e+02 110.343 -3.39485e+00 9.15611e+00  0.00000e+00 0.00000e+00 1.82552e+02 110.343 1.57043e+00 110.343 0.9473 
1 1 1 12  30  4  o 9  4.13363e+00 1.38514e+00 3.91292e+01 184.654 -9.79716e-01 -7.97473e-02 0.00000e+00 0.00000e+00 3.00383e+01 184.654 9.09091e+00 4.654   0.4403 
1 1 1 12  30  5  o 15 1.06268e+01 1.39669e+00 2.24077e+02 278.435 2.40480e+00  -1.62172e+01 0.00000e+00 0.00000e+00 1.67325e+02 278.435 5.67514e+01 98.435  0.9690 
1 1 1 12  30  6  o 10 2.50980e+01 9.60189e-01 4.21202e+02 242.021 -4.37612e+01 -8.23766e+01 0.00000e+00 0.00000e+00 5.27780e+02 242.021 1.06578e+02 242.021 0.9946 
1 1 1 12  30  7  o 19 6.00354e+00 1.46009e+00 7.50551e+01 357.228 3.66028e+00  -1.77189e-01 0.00000e+00 0.00000e+00 1.18785e+02 357.228 4.37304e+01 357.228 0.8493 
1 1 1 12  30  8  o 11 1.26529e+01 1.39575e+00 2.85622e+02 339.515 3.23790e+01  -1.20965e+01 0.00000e+00 0.00000e+00 1.88426e+02 339.515 9.71956e+01 159.515 0.9854 
1 1 1 12  30  9  o 3  4.82687e+00 1.49184e+00 1.10716e+02 194.261 -5.03387e+00 -1.27951e+00 0.00000e+00 0.00000e+00 5.40197e+01 194.261 5.66961e+01 14.261  0.8977 
1 1 1 12  30  10 o 10 4.25526e+00 1.39500e+00 9.50011e+01 182.828 -4.44211e+00 -2.19412e-01 0.00000e+00 0.00000e+00 4.71503e+01 182.828 4.78508e+01 2.828   0.8788 
1 1 1 12  30  11 o 18 6.08707e+00 1.74598e+00 8.88863e+01 52.993  3.10331e+00  4.11712e+00  0.00000e+00 0.00000e+00 1.18615e+02 52.993  2.97289e+01 52.993  0.8969 
1 1 1 12  30  12 o 7  7.06026e+00 1.88903e+00 7.17327e+01 175.763 -4.54276e+00 3.36571e-01  0.00000e+00 0.00000e+00 1.64882e+02 175.763 9.31497e+01 175.763 0.8819 
1 1 1 12  31  0  o 19 6.69100e+00 1.37378e+00 9.84525e+01 103.851 -7.78865e-01 3.15884e+00  0.00000e+00 0.00000e+00 1.11535e+02 103.851 1.30824e+01 103.851 0.8271 
1 1 1 12  31  1  o 3  5.76591e+00 1.52476e+00 1.04365e+02 20.756  2.68570e+00  1.01782e+00  0.00000e+00 0.00000e+00 7.07529e+01 20.756  3.36124e+01 200.756 0.8001 
1 1 1 12  31  2  o 18 2.44193e+01 1.28839e+00 3.52498e+02 301.111 2.42712e+01  -4.02166e+01 0.00000e+00 0.00000e+00 5.64921e+02 301.111 2.12423e+02 301.111 0.9893 
1 1 1 12  31  3  o 19 8.66553e+00 1.79971e+00 1.83250e+02 161.389 -8.03679e+00 2.70637e+00  0.00000e+00 0.00000e+00 1.25875e+02 161.389 5.73749e+01 341.389 0.9390 
1 1 1 12  31  4  o 14 4.45580e+00 1.45741e+00 3.89648e+01 351.033 1.06312e+00  -1.67750e-01 0.00000e+00 0.00000e+00 4.10807e+01 351.033 2.11591e+00 351.033 0.4728 
1 1 1 12  31  5  o 6  1.09727e+01 1.40255e+00 1.23048e+02 289.440 3.11848e+00  -8.83583e+00 0.00000e+00 0.00000e+00 2.71064e+02 289.440 1.48016e+02 289.440 0.9450 
1 1 1 12  31  6  o 10 5.30466e+00 1.54778e+00 1.11548e+02 67.065  1.64523e+00  3.88813e+00  0.00000e+00 0.00000e+00 6.41919e+01 67.065  4.73559e+01 247.065 0.8715 
1 1 1 12  31  7  o 3  7.12553e+00 1.57820e+00 1.90388e+02 234.480 -5.92176e+00 -8.29585e+00 0.00000e+00 0.00000e+00 6.68402e+01 234.480 1.23548e+02 54.480  0.9496 
1 1 1 12  31  8  o 7  7.18145e+00 1.59677e+00 1.33358e+02 91.058  -1.52299e-01 8.24708e+00  0.00000e+00 0.00000e+00 1.22528e+02 91.058  1.08293e+01 271.058 0.9373 
1 1 1 12  31  9  o 3  7.96951e+00 1.68504e+00 1.39557e+02 88.949  1.77889e-01  9.70025e+00  0.00000e+00 0.00000e+00 1.47339e+02 88.949  7.78133e+00 88.949  0.9470 
1 1 1 12  31  10 o 11 5.71553e+00 1.58131e+00 7.06279e+01 1.380   3.99421e+00  9.62294e-02  0.00000e+00 0.00000e+00 1.16939e+02 1.380   4.63108e+01 1.380   0.8633 
1 1 1 12  31  11 o 12 6.25144e+00 1.78367e+00 1.45413e+02 147.096 -7.09634e+00 4.59151e+00  0.00000e+00 0.00000e+00 7.76434e+01 147.096 6.77697e+01 327.096 0.9388 
1 1 1 12  31  12 o 13 7.42590e+00 1.95816e+00 1.47361e+02 242.041 -4.25792e+00 -8.02191e+00 0.00000e+00 0.00000e+00 1.18782e+02 242.041 2.85791e+01 62.041  0.9432 
1 1 1 12  32  0  o 15 1.84848e+01 9.05706e-01 2.96058e+02 111.975 -1.13198e+01 2.80534e+01  0.00000e+00 0.00000e+00 3.93574e+02 111.975 9.75158e+01 111.975 0.9833 
1 1 1 12  32  1  o 18 1.36312e+01 1.08737e+00 2.32726e+02 330.793 1.56198e+01  -8.73223e+00 0.00000e+00 0.00000e+00 2.70013e+02 330.793 3.72872e+01 330.793 0.9716 
1 1 1 12  32  2  o 4  7.64840e+00 1.78670e+00 1.44683e+02 307.851 3.42508e+00  -4.40744e+00 0.00000e+00 0.00000e+00 1.18252e+02 307.851 2.64313e+01 127.851 0.9053 
1 1 1 12  32  3  o 5  6.65535e+00 1.64481e+00 7.03560e+01 250.125 -8.96875e-01 -2.48100e+00 0.00000e+00 0.00000e+00 1.26635e+02 250.125 5.62790e+01 250.125 0.7792 
1 1 1 12  32  4  o 12 1.81296e+01 1.43224e+00 3.83703e+02 22.763  4.27226e+01  1.79264e+01  0.00000e+00 0.00000e+00 2.97662e+02 22.763  8.60403e+01 202.763 0.9891 
1 1 1 12  32  5  f 0  1.60608e+01 1.10817e+00 2.68308e+02 184.905 -3.45121e+01 -2.96198e+00 0.00000e+00 0.00000e+00 3.33179e+02 184.905 6.48715e+01 184.905 0.9855 
1 1 1 12  32  6  o 7  1.36258e+01 1.12982e+00 2.32876e+02 141.105 -2.07461e+01 1.67369e+01  0.00000e+00 0.00000e+00 2.75216e+02 141.105 4.23396e+01 141.105 0.9811 
1 1 1 12  32  7  o 11 1.76133e+01 1.11529e+00 2.41910e+02 265.569 -3.15318e+00 -4.06892e+01 0.00000e+00 0.00000e+00 4.19355e+02 265.569 1.77446e+02 265.569 0.9877 
1 1 1 12  32  8  o 15 1.74401e+01 1.18510e+00 2.89170e+02 170.277 -5.25924e+01 9.01126e+00  0.00000e+00 0.00000e+00 3.67544e+02 170.277 7.83739e+01 170.277 0.9906 
1 1 1 12  32  9  o 19 7.04345e+00 1.76777e+00 1.61122e+02 242.017 -4.29969e+00 -8.09233e+00 0.00000e+00 0.00000e+00 9.15517e+01 242.017 6.95707e+01 62.017  0.9437 
1 1 1 12  32  10 o 4  5.94533e+00 1.56306e+00 1.42792e+02 39.417  6.52862e+00  5.36598e+00  0.00000e+00 0.00000e+00 6.93549e+01 39.417  7.34373e+01 219.417 0.9388 
1 1 1 12  32  11 o 13 4.25084e+00 1.43111e+00 7.29072e+01 106.504 -9.79924e-01 3.30727e+00  0.00000e+00 0.00000e+00 6.25315e+01 106.504 1.03756e+01 286.504 0.8384 
1 1 1 12  32  12 o 10 6.26044e+00 1.83565e+00 3.70852e+01 300.576 1.05661e+00  -1.78836e+00 0.00000e+00 0.00000e+00 1.31806e+02 300.576 9.47207e+01 300.576 0.7100 
1 1 1 12  33  0  f 0  7.93423e+00 1.34172e+00 1.51265e+02 272.244 2.48799e-01  -6.34794e+00 0.00000e+00 0.00000e+00 1.24908e+02 272.244 2.63573e+01 92.244  0.9175 
1 1 1 12  33  1  o 14 1.72665e+01 1.25576e+00 3.34788e+02 250.626 -1.05591e+01 -3.00286e+01 0.00000e+00 0.00000e+00 3.10172e+02 250.626 2.46168e+01 70.626  0.9842 
1 1 1 12  33  2  o 15 1.06792e+01 1.32640e+00 1.61018e+02 87.881  3.82066e-01  1.03260e+01  0.00000e+00 0.00000e+00 2.24311e+02 87.881  6.32924e+01 87.881  0.9503 
1 1 1 12  33  3  o 17 6.48534e+00 1.74453e+00 8.44523e+01 125.111 -1.71973e+00 2.44588e+00  0.00000e+00 0.00000e+00 1.14884e+02 125.111 3.04313e+01 125.111 0.8092 
1 1 1 12  33  4  o 15 1.56642e+01 1.55654e+00 2.39533e+02 205.409 -2.15081e+01 -1.02169e+01 0.00000e+00 0.00000e+00 3.42947e+02 205.409 1.03413e+02 205.409 0.9788 
1 1 1 12  33  5  o 2  8.42044e+00 1.39091e+00 2.20788e+02 35.320  1.09812e+01  7.78096e+00  0.00000e+00 0.00000e+00 8.70613e+01 35.320  1.33727e+02 215.320 0.9621 
1 1 1 12  33  6  o 4  7.95562e+00 1.49007e+00 1.47488e+02 344.550 8.26087e+00  -2.28317e+00 0.00000e+00 0.00000e+00 1.36641e+02 344.550 1.08478e+01 164.550 0.9397 
1 1 1 12  33  7  o 1  1.01025e+01 1.42608e+00 2.24155e+02 190.976 -1.77403e+01 -3.44059e+00 0.00000e+00 0.00000e+00 1.49047e+02 190.976 7.51081e+01 10.976  0.9719 
1 1 1 12  33  8  o 17 5.11895e+00 1.50250e+00 1.17901e+02 26.866  4.66850e+00  2.36503e+00  0.00000e+00 0.00000e+00 5.69263e+01 26.866  6.09743e+01 206.866 0.8985 
1 1 1 12  33  9  o 14 1.48205e+01 1.32008e+00 2.53813e+02 323.737 3.19182e+01  -2.34143e+01 0.00000e+00 0.00000e+00 3.02329e+02 323.737 4.85162e+01 323.737 0.9873 
1 1 1 12  33  10 o 15 5.15644e+00 1.55114e+00 6.20813e+01 97.518  -4.21342e-01 3.19284e+00  0.00000e+00 0.00000e+00 9.96038e+01 97.518  3.75225e+01 97.518  0.8251 
1 1 1 12  33  11 o 18 6.97332e+00 1.84866e+00 1.28751e+02 358.171 8.07853e+00  -2.57908e-01 0.00000e+00 0.00000e+00 1.19249e+02 358.171 9.50193e+00 178.171 0.9359 
1 1 1 12  33  12 o 7  4.32873e+00 1.46744e+00 7.79477e+01 32.356  3.41796e+00  2.16540e+00  0.00000e+00 0.00000e+00 6.43470e+01 32.356  1.36007e+01 212.356 0.8653 
1 1 1 12  34  0  o 10 1.63572e+01 1.29518e+00 3.81752e+02 173.426 -3.38137e+01 3.89671e+00  0.00000e+00 0.00000e+00 2.29552e+02 173.426 1.52200e+02 353.426 0.9852 
1 1 1 12  34  1  o 19 7.01588e+00 1.73307e+00 1.13185e+02 91.067  -7.59871e-02 4.07974e+00  0.00000e+00 0.00000e+00 1.17540e+02 91.067  4.35510e+00 91.067  0.8665 
1 1 1 12  34  2  o 15 1.53600e+01 1.02062e+00 2.36272e+02 318.835 1.78397e+01  -1.55980e+01 0.00000e+00 0.00000e+00 3.34442e+02 318.835 9.81696e+01 318.835 0.9787 
1 1 1 12  34  3  o 8  2.30407e+01 1.35068e+00 4.69333e+02 246.130 -2.68953e+01 -6.07797e+01 0.00000e+00 0.00000e+00 3.99104e+02 246.130 7.02295e+01 66.130  0.9924 
1 1 1 12  34  4  o 13 9.82247e+00 1.80443e+00 2.17828e+02 89.994  1.17315e-03  1.18596e+01  0.00000e+00 0.00000e+00 1.39218e+02 89.994  7.86096e+01 269.994 0.9569 
1 1 1 12  34  5  o 5  7.76783e+00 1.39529e+00 2.06768e+02 155.611 -1.05613e+01 4.78835e+00  0.00000e+00 0.00000e+00 7.53539e+01 155.611 1.31414e+02 335.611 0.9559 
1 1 1 12  34  6  o 5  1.46734e+01 1.08421e+00 2.64516e+02 78.309  7.34273e+00  3.54862e+01  0.00000e+00 0.00000e+00 2.85356e+02 78.309  2.08404e+01 78.309  0.9861 
1 1 1 12  34  7  o 5  1.60396e+01 1.09656e+00 2.70739e+02 220.468 -3.01030e+01 -2.56811e+01 0.00000e+00 0.00000e+00 3.31100e+02 220.468 6.03607e+01 220.468 0.9873 
1 1 1 12  34  8  o 4  6.69022e+00 1.58003e+00 1.70519e+02 43.660  7.32409e+00  6.98918e+00  0.00000e+00 0.00000e+00 7.08462e+01 43.660  9.96732e+01 223.660 0.9492 
1 1 1 12  34  9  o 4  1.92316e+01 1.18519e+00 3.37619e+02 112.310 -2.91141e+01 7.09510e+01  0.00000e+00 0.00000e+00 3.88496e+02 112.310 5.08769e+01 112.310 0.9935 
1 1 1 12  34  10 o 12 5.83454e+00 1.63524e+00 1.71651e+02 310.566 6.22693e+00  -7.27382e+00 0.00000e+00 0.00000e+00 3.81510e+01 310.566 1.33500e+02 130.566 0.9462 
1 1 1 12  34  11 o 18 5.94400e+00 1.78557e+00 1.59734e+02 165.996 -8.61425e+00 2.14846e+00  0.00000e+00 0.00000e+00 5.29831e+01 165.996 1.06751e+02 345.996 0.9419 
1 1 1 12  34  12 o 6  6.90111e+00 1.97733e+00 1.07131e+02 48.787  4.14238e+00  4.72967e+00  0.00000e+00 0.00000e+00 1.33158e+02 48.787  2.60272e+01 48.787  0.9166 
1 1 1 12  35  0  o 12 1.71432e+01 1.23439e+00 2.85274e+02 218.968 -2.10039e+01 -1.69894e+01 0.00000e+00 0.00000e+00 3.52817e+02 218.968 6.75431e+01 218.968 0.9813 
1 1 1 12  35  1  o 17 6.04560e+00 1.51635e+00 1.52499e+02 129.801 -3.24799e+00 3.89821e+00  0.00000e+00 0.00000e+00 5.28427e+01 129.801 9.96564e+01 309.801 0.8951 
1 1 1 12  35  2  o 16 9.68807e+00 2.28571e+00 1.45932e+02 102.113 -1.31681e+00 6.13576e+00  0.00000e+00 0.00000e+00 1.91115e+02 102.113 4.51827e+01 102.113 0.9164 
1 1 1 12  35  3  o 15 1.68544e+01 1.42038e+00 2.90460e+02 25.371  2.77687e+01  1.31686e+01  0.00000e+00 0.00000e+00 3.39080e+02 25.371  4.86200e+01 25.371  0.9836 
1 1 1 12  35  4  o 12 7.72440e+00 1.54874e+00 1.26550e+02 130.541 -4.13297e+00 4.83215e+00  0.00000e+00 0.00000e+00 1.42682e+02 130.541 1.61312e+01 130.541 0.9176 
1 1 1 12  35  5  o 10 3.74251e+00 1.19318e+00 8.60322e+01 337.902 2.31865e+00  -9.41403e-01 0.00000e+00 0.00000e+00 2.27799e+01 337.902 6.32523e+01 157.902 0.7653 
1 1 1 12  35  6  o 18 9.06113e+00 1.38986e+00 9.78123e+01 348.691 7.05644e+00  -1.41116e+00 0.00000e+00 0.00000e+00 2.21589e+02 348.691 1.23777e+02 348.691 0.9277 
1 1 1 12  35  7  o 17 4.96190e+00 1.39473e+00 7.67704e+01 11.457  3.20621e+00  6.49810e-01  0.00000e+00 0.00000e+00 7.93971e+01 11.457  2.62672e+00 11.457  0.8282 
1 1 1 12  35  8  o 3  1.24041e+01 1.40476e+00 2.25435e+02 246.510 -1.08340e+01 -2.49290e+01 0.00000e+00 0.00000e+00 2.37200e+02 246.510 1.17657e+01 246.510 0.9814 
1 1 1 12  35  9  o 8  4.12499e+00 1.27324e+00 5.32365e+01 309.562 1.57386e+00  -1.90506e+00 0.00000e+00 0.00000e+00 6.61820e+01 309.562 1.29456e+01 309.562 0.7618 
1 1 1 12  35  10 o 7  6.63464e+00 1.71674e+00 8.56138e+01 220.169 -3.95442e+00 -3.33811e+00 0.00000e+00 0.00000e+00 1.40594e+02 220.169 5.49800e+01 220.169 0.8973 
1 1 1 12  35  11 o 13 6.32601e+00 1.81158e+00 1.26941e+02 225.348 -5.25236e+00 -5.31652e+00 0.00000e+00 0.00000e+00 9.66836e+01 225.348 3.02574e+01 45.348  0.9305 
1 1 1 12  36  0  o 8  1.35290e+01 1.49136e+00 2.28051e+02 154.230 -1.54152e+01 7.44220e+00  0.00000e+00 0.00000e+00 2.69836e+02 154.230 4.17852e+01 154.230 0.9703 
1 1 1 12  36  1  o 11 7.65818e+00 1.57740e+00 1.54481e+02 271.987 2.27157e-01  -6.54616e+00 0.00000e+00 0.00000e+00 1.12891e+02 271.987 4.15905e+01 91.987  0.9201 
1 1 1 12  36  2  o 4  1.44659e+01 1.90555e+00 2.26775e+02 295.680 7.31433e+00  -1.52116e+01 0.00000e+00 0.00000e+00 3.05805e+02 295.680 7.90305e+01 295.680 0.9699 
1 1 1 12  36  3  o 12 2.03301e+01 1.36171e+00 3.93512e+02 147.090 -4.29065e+01 2.77685e+01  0.00000e+00 0.00000e+00 3.70851e+02 147.090 2.26610e+01 327.090 0.9902 
1 1 1 12  36  4  o 9  6.03755e+00 1.42965e+00 1.38061e+02 96.050  -6.03422e-01 5.69362e+00  0.00000e+00 0.00000e+00 7.01265e+01 96.050  6.79343e+01 276.050 0.9079 
1 1 1 12  36  5  o 10 8.35022e+00 1.69564e+00 1.39780e+02 199.038 -7.33293e+00 -2.53043e+00 0.00000e+00 0.00000e+00 1.56223e+02 199.038 1.64428e+01 199.038 0.9331 
1 1 1 12  36  6  o 18 1.62612e+01 1.00493e+00 3.14703e+02 87.429  2.16843e+00  4.82890e+01  0.00000e+00 0.00000e+00 2.96715e+02 87.429  1.79882e+01 267.429 0.9896 
1 1 1 12  36  7  o 13 5.32888e+00 1.44364e+00 7.19574e+01 114.605 -1.38877e+00 3.03259e+00  0.00000e+00 0.00000e+00 9.65168e+01 114.605 2.45594e+01 114.605 0.8320 
1 1 1 12  36  8  o 11 7.58402e+00 1.57643e+00 6.41706e+01 147.394 -3.53773e+00 2.26301e+00  0.00000e+00 0.00000e+00 1.86776e+02 147.394 1.22605e+02 147.394 0.8708 
1 1 1 12  36  9  o 1  3.37624e+00 1.17323e+00 5.73782e+01 220.704 -1.70984e+00 -1.47089e+00 0.00000e+00 0.00000e+00 3.69872e+01 220.704 2.03910e+01 40.704  0.7356 
1 1 1 12  36  10 o 8  4.22238e+00 1.39810e+00 6.24793e+01 357.492 2.98597e+00  -1.30777e-01 0.00000e+00 0.00000e+00 6.73297e+01 357.492 4.85036e+00 357.492 0.8092 
1 1 1 12  36  11 o 13 8.51324e+00 2.01175e+00 1.48565e+02 126.696 -6.19154e+00 8.30787e+00  0.00000e+00 0.00000e+00 1.58809e+02 126.696 1.02442e+01 126.696 0.9504 
1 1 1 12  37  0  o 5  2.50692e+01 1.05917e+00 3.67939e+02 246.368 -2.39022e+01 -5.46263e+01 0.00000e+00 0.00000e+00 5.74745e+02 246.368 2.06806e+02 246.368 0.9916 
1 1 1 12  37  1  o 18 1.56770e+01 1.46526e+00 2.66445e+02 32.074  2.12068e+01  1.32894e+01  0.00000e+00 0.00000e+00 3.16329e+02 32.074  4.98837e+01 32.074  0.9798 
1 1 1 12  37  2  o 18 4.82684e+00 2.00999e+00 7.26441e+01 4.290   1.70719e+00  1.28062e-01  0.00000e+00 0.00000e+00 4.53993e+01 4.290   2.72449e+01 184.290 0.6443 
1 1 1 12  37  3  o 4  6.84884e+00 1.63531e+00 1.46663e+02 266.931 -3.31140e-01 -6.17554e+00 0.00000e+00 0.00000e+00 9.13000e+01 266.931 5.53631e+01 86.931  0.9151 
1 1 1 12  37  4  o 17 1.78623e+01 9.32912e-01 2.98596e+02 287.902 1.39296e+01  -4.31229e+01 0.00000e+00 0.00000e+00 3.72240e+02 287.902 7.36443e+01 287.902 0.9889 
1 1 1 12  37  5  o 13 1.26693e+01 1.47361e+00 2.10209e+02 57.155  1.06249e+01  1.64580e+01  0.00000e+00 0.00000e+00 2.58589e+02 57.155  4.83801e+01 57.155  0.9741 
1 1 1 12  37  6  o 10 8.82408e+00 1.36978e+00 1.40684e+02 194.599 -1.01682e+01 -2.64842e+00 0.00000e+00 0.00000e+00 1.78177e+02 194.599 3.74934e+01 194.599 0.9512 
1 1 1 12  37  7  o 8  6.12664e+00 1.51337e+00 1.68770e+02 201.678 -8.39187e+00 -3.33586e+00 0.00000e+00 0.00000e+00 5.07130e+01 201.678 1.18057e+02 21.678  0.9429 
1 1 1 12  37  8  o 13 3.54315e+00 1.19353e+00 1.11658e+02 104.765 -1.11124e+00 4.21630e+00  0.00000e+00 0.00000e+00 6.28124e+00 104.765 1.05377e+02 284.765 0.8761 
1 1 1 12  37  9  o 3  4.91892e+00 1.46300e+00 1.25195e+01 271.093 1.15576e-02  -6.05855e-01 0.00000e+00 0.00000e+00 4.16552e+01 271.093 2.91357e+01 271.093 0.2899 
1 1 1 12  37  10 o 16 4.49606e+00 1.44843e+00 5.04957e+01 187.444 -2.35708e+00 -3.07965e-01 0.00000e+00 0.00000e+00 7.77697e+01 187.444 2.72740e+01 187.444 0.7509 
1 1 1 12  37  11 o 6  5.71627e+00 1.68953e+00 1.09423e+02 203.959 -5.56158e+00 -2.47137e+00 0.00000e+00 0.00000e+00 8.89606e+01 203.959 2.04629e+01 23.959  0.9137 
1 1 1 12  38  0  o 13 1.32462e+01 1.42886e+00 2.69537e+02 144.867 -1.77071e+01 1.24601e+01  0.00000e+00 0.00000e+00 2.21001e+02 144.867 4.85361e+01 324.867 0.9766 
1 1 1 12  38  1  o 10 5.25788e+00 1.52433e+00 1.25653e+02 308.333 2.41620e+00  -3.05586e+00 0.00000e+00 0.00000e+00 4.57625e+01 308.333 7.98906e+01 128.333 0.8594 
1 1 1 12  38  2  o 7  2.05617e+01 1.63458e+00 3.75477e+02 202.941 -4.13848e+01 -1.75162e+01 0.00000e+00 0.00000e+00 3.96121e+02 202.941 2.06442e+01 202.941 0.9888 
1 1 1 12  38  3  o 6  9.42441e+00 1.66343e+00 1.05074e+02 127.318 -3.50586e+00 4.59906e+00  0.00000e+00 0.00000e+00 2.20095e+02 127.318 1.15021e+02 127.318 0.9088 
1 1 1 12  38  4  o 8  1.48553e+01 1.01219e+00 2.56752e+02 66.203  1.27207e+01  2.88464e+01  0.00000e+00 0.00000e+00 2.98338e+02 66.203  4.15857e+01 66.203  0.9840 
1 1 1 12  38  5  o 18 6.99081e+00 1.63811e+00 1.70217e+02 266.887 -4.43033e-01 -8.14646e+00 0.00000e+00 0.00000e+00 7.84557e+01 266.887 9.17611e+01 86.887  0.9365 
1 1 1 12  38  6  o 16 1.48245e+01 1.04126e+00 3.20704e+02 31.477  3.80856e+01  2.33178e+01  0.00000e+00 0.00000e+00 2.36093e+02 31.477  8.46110e+01 211.477 0.9887 
1 1 1 12  38  7  o 4  6.28953e+00 1.44922e+00 1.43096e+02 180.821 -8.37156e+00 -1.19930e-01 0.00000e+00 0.00000e+00 8.10855e+01 180.821 6.20108e+01 0.821   0.9382 
1 1 1 12  38  8  o 3  1.15029e+01 1.40616e+00 2.43157e+02 80.032  4.80131e+00  2.73183e+01  0.00000e+00 0.00000e+00 1.85903e+02 80.032  5.72545e+01 260.032 0.9818 
1 1 1 12  38  9  o 1  3.50686e+00 1.20275e+00 8.92791e+01 173.320 -3.89795e+00 4.56525e-01  0.00000e+00 0.00000e+00 2.53694e+01 173.320 6.39096e+01 353.320 0.8606 
1 1 1 12  38  10 o 12 6.54400e+00 1.72498e+00 1.28460e+02 95.645  -7.89553e-01 7.98739e+00  0.00000e+00 0.00000e+00 1.04078e+02 95.645  2.43812e+01 275.645 0.9355 
1 1 1 12  38  11 o 16 5.69394e+00 1.73521e+00 8.20168e+01 302.556 2.49073e+00  -3.90117e+00 0.00000e+00 0.00000e+00 1.09152e+02 302.556 2.71357e+01 302.556 0.8840 
1 1 1 12  39  0  o 3  6.24902e+00 1.60524e+00 1.41230e+02 106.931 -1.47368e+00 4.84107e+00  0.00000e+00 0.00000e+00 7.07668e+01 106.931 7.04629e+01 286.931 0.8948 
1 1 1 12  39  1  f 0  1.70076e+01 1.06963e+00 2.81951e+02 247.873 -1.20454e+01 -2.96246e+01 0.00000e+00 0.00000e+00 3.53010e+02 247.873 7.10590e+01 247.873 0.9842 
1 1 1 12  39  2  o 7  2.20952e+01 1.58467e+00 4.02772e+02 41.960  4.16145e+01  3.74171e+01  0.00000e+00 0.00000e+00 4.28142e+02 41.960  2.53704e+01 41.960  0.9910 
1 1 1 12  39  3  o 3  7.67312e+00 1.52361e+00 1.85900e+02 77.659  2.00026e+00  9.14297e+00  0.00000e+00 0.00000e+00 8.93363e+01 77.659  9.65634e+01 257.659 0.9450 
1 1 1 12  39  4  o 14 1.22573e+01 1.01361e+00 1.54756e+02 256.743 -3.58946e+00 -1.52353e+01 0.00000e+00 0.00000e+00 2.95527e+02 256.743 1.40771e+02 256.743 0.9675 
1 1 1 12  39  5  o 13 6.02167e+00 1.59368e+00 1.84906e+02 163.755 -7.46930e+00 2.17639e+00  0.00000e+00 0.00000e+00 2.85339e+01 163.755 1.56372e+02 343.755 0.9333 
1 1 1 12  39  6  o 18 3.90441e+00 1.18500e+00 7.77740e+01 70.205  9.55960e-01  2.65599e+00  0.00000e+00 0.00000e+00 4.02708e+01 70.205  3.75032e+01 250.205 0.7960 
1 1 1 12  39  7  o 16 9.74835e+00 1.39686e+00 1.82143e+02 171.182 -1.67293e+01 2.59510e+00  0.00000e+00 0.00000e+00 1.77052e+02 171.182 5.09124e+00 351.182 0.9700 
1 1 1 12  39  8  o 4  1.38288e+01 1.30898e+00 2.29424e+02 304.962 1.95038e+01  -2.78932e+01 0.00000e+00 0.00000e+00 2.88119e+02 304.962 5.86951e+01 304.962 0.9852 
1 1 1 12  39  9  o 8  7.09125e+00 1.58075e+00 1.91179e+02 32.227  1.13141e+01  7.13243e+00  0.00000e+00 0.00000e+00 6.79147e+01 32.227  1.23264e+02 212.227 0.9619 
1 1 1 12  39  10 o 10 8.55569e+00 1.82727e+00 1.64444e+02 206.399 -1.08147e+01 -5.36831e+00 0.00000e+00 0.00000e+00 1.46758e+02 206.399 1.76856e+01 26.399  0.9576 
1 1 1 12  39  11 o 6  1.33211e+01 1.84355e+00 2.39201e+02 302.053 1.59885e+01  -2.55343e+01 0.00000e+00 0.00000e+00 2.58215e+02 302.053 1.90138e+01 302.053 0.9833 
1 1 1 12  40  0  o 1  2.49899e+01 1.19995e+00 3.89320e+02 354.220 6.22165e+01  -6.29784e+00 0.00000e+00 0.00000e+00 5.50456e+02 354.220 1.61135e+02 354.220 0.9920 
1 1 1 12  40  1  o 18 1.38861e+01 9.74464e-01 1.79647e+02 107.544 -5.40129e+00 1.70853e+01  0.00000e+00 0.00000e+00 3.32106e+02 107.544 1.52458e+02 107.544 0.9717 
1 1 1 12  40  2  o 10 1.50002e+01 1.32839e+00 2.99679e+02 155.351 -2.68867e+01 1.23374e+01  0.00000e+00 0.00000e+00 2.59762e+02 155.351 3.99170e+01 335.351 0.9829 
1 1 1 12  40  3  o 19 9.73675e+00 1.50782e+00 2.08564e+02 112.969 -5.27905e+00 1.24553e+01  0.00000e+00 0.00000e+00 1.47063e+02 112.969 6.15010e+01 292.969 0.9623 
1 1 1 12  40  4  o 8  8.58335e+00 1.22689e+00 1.89199e+02 290.279 4.31708e+00  -1.16840e+01 0.00000e+00 0.00000e+00 1.23304e+02 290.279 6.58955e+01 110.279 0.9590 
1 1 1 12  40  5  o 6  6.06798e+00 1.40595e+00 1.41690e+02 92.143  -2.62491e-01 7.01375e+00  0.00000e+00 0.00000e+00 7.16209e+01 92.143  7.00686e+01 272.143 0.9257 
1 1 1 12  40  6  o 13 1.81746e+01 9.96538e-01 3.11974e+02 319.552 4.08049e+01  -3.47864e+01 0.00000e+00 0.00000e+00 3.71811e+02 319.552 5.98368e+01 319.552 0.9906 
1 1 1 12  40  7  o 17 7.46985e+00 1.69059e+00 1.14460e+02 91.426  -1.67954e-01 6.74532e+00  0.00000e+00 0.00000e+00 1.47301e+02 91.426  3.28403e+01 91.426  0.9226 
1 1 1 12  40  8  o 9  1.01246e+01 1.49704e+00 1.55802e+02 41.249  1.10810e+01  9.71757e+00  0.00000e+00 0.00000e+00 2.15479e+02 41.249  5.96771e+01 41.249  0.9655 
1 1 1 12  40  9  o 11 7.21893e+00 1.66211e+00 1.22855e+02 102.882 -1.86542e+00 8.15682e+00  0.00000e+00 0.00000e+00 1.34386e+02 102.882 1.15313e+01 102.882 0.9382 
1 1 1 12  40  10 o 6  8.40003e+00 1.66264e+00 1.52544e+02 294.034 5.24424e+00  -1.17598e+01 0.00000e+00 0.00000e+00 1.53824e+02 294.034 1.27964e+00 294.034 0.9603 
1 1 1 12  40  11 o 13 4.58367e+00 1.50611e+00 1.03009e+02 86.232  3.53834e-01  5.37257e+00  0.00000e+00 0.00000e+00 5.39149e+01 86.232  4.90939e+01 266.232 0.9016 
1 1 1 12  41  0  o 19 2.42406e+01 1.05160e+00 4.04897e+02 174.903 -6.87392e+01 6.13131e+00  0.00000e+00 0.00000e+00 5.07296e+02 174.903 1.02399e+02 174.903 0.9927 
1 1 1 12  41  1  o 15 1.26334e+01 1.30233e+00 2.03081e+02 294.483 7.40038e+00  -1.62516e+01 0.00000e+00 0.00000e+00 2.62409e+02 294.483 5.93287e+01 294.483 0.9716 
1 1 1 12  41  2  o 9  1.07857e+01 1.38232e+00 1.59991e+02 316.627 8.68565e+00  -8.20573e+00 0.00000e+00 0.00000e+00 2.31687e+02 316.627 7.16952e+01 316.627 0.9572 
1 1 1 12  41  3  o 16 6.37738e+00 1.31153e+00 9.93612e+01 267.497 -2.06460e-01 -4.72249e+00 0.00000e+00 0.00000e+00 1.15231e+02 267.497 1.58694e+01 267.497 0.8866 
1 1 1 12  41  4  o 4  5.82154e+00 1.31566e+00 1.28843e+02 67.672  2.20990e+00  5.38085e+00  0.00000e+00 0.00000e+00 7.21313e+01 67.672  5.67120e+01 247.672 0.9094 
1 1 1 12  41  5  o 13 8.83778e+00 1.26698e+00 1.10135e+02 132.199 -5.58014e+00 6.15427e+00  0.00000e+00 0.00000e+00 2.04532e+02 132.199 9.43970e+01 132.199 0.9377 
1 1 1 12  41  6  o 12 4.47652e+00 1.29095e+00 4.32626e+01 18.410  1.65313e+00  5.50235e-01  0.00000e+00 0.00000e+00 6.73325e+01 18.410  2.40699e+01 18.410  0.6506 
1 1 1 12  41  7  o 14 6.09257e+00 1.61297e+00 9.71529e+01 211.463 -4.40218e+00 -2.69377e+00 0.00000e+00 0.00000e+00 1.10395e+02 211.463 1.32422e+01 211.463 0.8970 
1 1 1 12  41  8  o 17 1.20944e+01 1.39540e+00 1.88712e+02 112.750 -8.92133e+00 2.12753e+01  0.00000e+00 0.00000e+00 2.60553e+02 112.750 7.18412e+01 112.750 0.9781 
1 1 1 12  41  9  o 4  6.91624e+00 1.68865e+00 9.11508e+01 95.557  -5.64110e-01 5.79799e+00  0.00000e+00 0.00000e+00 1.47756e+02 95.557  5.66048e+01 95.557  0.9096 
1 1 1 12  41  10 o 4  5.13977e+00 1.55637e+00 6.13501e+01 20.141  3.05612e+00  1.12086e+00  0.00000e+00 0.00000e+00 1.00103e+02 20.141  3.87532e+01 20.141  0.8272 
1 1 1 12  41  11 o 15 5.32163e+00 1.62155e+00 1.25881e+02 276.081 7.60290e-01  -7.13714e+00 0.00000e+00 0.00000e+00 6.15145e+01 276.081 6.43662e+01 96.081  0.9275 
1 1 1 12  42  0  o 13 1.48521e+01 1.04536e+00 2.82027e+02 47.949  2.12095e+01  2.35135e+01  0.00000e+00 0.00000e+00 2.71936e+02 47.949  1.00907e+01 227.949 0.9841 
1 1 1 12  42  1  o 10 5.41140e+00 1.42735e+00 9.22658e+01 193.355 -3.08891e+00 -7.33348e-01 0.00000e+00 0.00000e+00 7.64299e+01 193.355 1.58359e+01 13.356  0.8221 
1 1 1 12  42  2  o 4  1.53680e+01 1.19742e+00 3.09128e+02 139.228 -2.68451e+01 2.31492e+01  0.00000e+00 0.00000e+00 2.65561e+02 139.228 4.35669e+01 319.228 0.9858 
1 1 1 12  42  3  o 2  4.06002e+00 1.16984e+00 7.93234e+01 326.422 2.10275e+00  -1.39590e+00 0.00000e+00 0.00000e+00 3.89319e+01 326.422 4.03915e+01 146.422 0.7676 
1 1 1 12  42  4  o 13 6.83766e+00 1.34345e+00 1.27257e+02 295.565 2.90712e+00  -6.07707e+00 0.00000e+00 0.00000e+00 1.12157e+02 295.565 1.50996e+01 115.565 0.9225 
1 1 1 12  42  5  o 16 7.58608e+00 1.42688e+00 1.17711e+02 208.350 -6.48447e+00 -3.49885e+00 0.00000e+00 0.00000e+00 1.49968e+02 208.350 3.22562e+01 208.350 0.9294 
1 1 1 12  42  6  o 5  4.33260e+00 1.28322e+00 7.65127e+01 151.798 -2.73825e+00 1.46837e+00  0.00000e+00 0.00000e+00 5.79914e+01 151.798 1.85213e+01 331.798 0.8176 
1 1 1 12  42  7  f 0  4.96733e+00 1.50242e+00 9.57929e+01 171.017 -4.33950e+00 6.85985e-01  0.00000e+00 0.00000e+00 6.96548e+01 171.017 2.61380e+01 351.017 0.8771 
1 1 1 12  42  8  o 14 3.79900e+00 1.23156e+00 3.73806e+01 216.351 -1.31714e+00 -9.69333e-01 0.00000e+00 0.00000e+00 5.31982e+01 216.351 1.58176e+01 216.351 0.6279 
1 1 1 12  42  9  o 7  4.61644e+00 1.41792e+00 9.01773e+01 51.230  2.83582e+00  3.53081e+00  0.00000e+00 0.00000e+00 6.42925e+01 51.230  2.58848e+01 231.230 0.8812 
1 1 1 12  42  10 o 2  5.07063e+00 1.46782e+00 1.28220e+02 28.835  6.19690e+00  3.41165e+00  0.00000e+00 0.00000e+00 5.01297e+01 28.835  7.80907e+01 208.835 0.9263 
1 1 1 12  42  11 o 11 5.64626e+00 1.62022e+00 1.16475e+02 259.768 -1.19753e+00 -6.63441e+00 0.00000e+00 0.00000e+00 8.12708e+01 259.768 3.52046e+01 79.768  0.9225 
1 1 1 12  43  0  o 5  8.73347e+00 1.27919e+00 1.88844e+02 182.094 -1.10085e+01 -4.02423e-01 0.00000e+00 0.00000e+00 1.26734e+02 182.094 6.21101e+01 2.094   0.9535 
1 1 1 12  43  1  o 8  1.43085e+01 1.16374e+00 2.36595e+02 331.062 2.21083e+01  -1.22236e+01 0.00000e+00 0.00000e+00 2.95060e+02 331.062 5.84647e+01 331.062 0.9800 
1 1 1 12  43  2  o 11 2.52731e+01 1.07930e+00 4.44535e+02 290.755 3.22738e+01  -8.51630e+01 0.00000e+00 0.00000e+00 5.08786e+02 290.755 6.42510e+01 290.755 0.9945 
1 1 1 12  43  3  o 18 1.24111e+01 9.79301e-01 2.32282e+02 150.080 -2.08256e+01 1.19849e+01  0.00000e+00 0.00000e+00 2.28718e+02 150.080 3.56459e+00 330.080 0.9790 
1 1 1 12  43  4  o 3  5.60417e+00 1.22897e+00 1.43284e+02 86.378  4.10481e-01  6.48491e+00  0.00000e+00 0.00000e+00 5.22779e+01 86.378  9.10061e+01 266.378 0.9195 
1 1 1 12  43  5  o 11 5.55804e+00 1.32721e+00 1.43811e+02 92.452  -2.86514e-01 6.68983e+00  0.00000e+00 0.00000e+00 5.07115e+01 92.452  9.30993e+01 272.452 0.9220 
1 1 1 12  43  6  o 6  5.07302e+00 1.35190e+00 4.91797e+01 92.615  -1.07642e-01 2.35651e+00  0.00000e+00 0.00000e+00 9.50300e+01 92.615  4.58502e+01 92.615  0.7487 
1 1 1 12  43  7  o 13 6.71716e+00 1.64039e+00 9.76369e+01 184.233 -5.45692e+00 -4.03895e-01 0.00000e+00 0.00000e+00 1.32742e+02 184.233 3.51051e+01 184.233 0.9033 
1 1 1 12  43  8  o 1  9.85271e+00 1.45807e+00 1.37593e+02 282.340 2.89460e+00  -1.32313e+01 0.00000e+00 0.00000e+00 2.22430e+02 282.340 8.48372e+01 282.340 0.9623 
1 1 1 12  43  9  o 5  4.69081e+00 1.44687e+00 1.46304e+02 21.121  6.84757e+00  2.64521e+00  0.00000e+00 0.00000e+00 1.91827e+01 21.121  1.27121e+02 201.121 0.9292 
1 1 1 12  43  10 o 13 6.83722e+00 1.69412e+00 1.27252e+02 163.250 -8.27178e+00 2.48959e+00  0.00000e+00 0.00000e+00 1.16802e+02 163.250 1.04498e+01 343.250 0.9402 
1 1 1 12  44  0  o 2  5.40725e+00 1.34854e+00 9.34304e+01 281.582 7.10010e-01  -3.46431e+00 0.00000e+00 0.00000e+00 7.92937e+01 281.582 1.41367e+01 101.582 0.8430 
1 1 1 12  44  1  o 10 9.65673e+00 1.39049e+00 1.01905e+02 27.683  6.06657e+00  3.18269e+00  0.00000e+00 0.00000e+00 2.36298e+02 27.683  1.34393e+02 27.683  0.9238 
1 1 1 12  44  2  o 16 1.45118e+01 1.17562e+00 2.78847e+02 152.867 -2.81854e+01 1.44439e+01  0.00000e+00 0.00000e+00 2.62754e+02 152.867 1.60930e+01 332.867 0.9841 
1 1 1 12  44  3  o 15 4.36969e+00 1.25177e+00 5.56668e+01 71.070  6.27284e-01  1.82901e+00  0.00000e+00 0.00000e+00 5.81485e+01 71.070  2.48171e+00 71.070  0.6866 
1 1 1 12  44  4  o 3  9.22387e+00 1.20366e+00 1.22399e+02 169.520 -9.86752e+00 1.82530e+00  0.00000e+00 0.00000e+00 2.09701e+02 169.520 8.73020e+01 169.520 0.9488 
1 1 1 12  44  5  o 4  8.28507e+00 1.34882e+00 1.64554e+02 352.941 1.17117e+01  -1.45021e+00 0.00000e+00 0.00000e+00 1.36279e+02 352.941 2.82757e+01 172.941 0.9566 
1 1 1 12  44  6  o 8  6.69457e+00 1.42529e+00 1.11998e+02 174.615 -7.02479e+00 6.62231e-01  0.00000e+00 0.00000e+00 1.23371e+02 174.615 1.13729e+01 174.615 0.9262 
1 1 1 12  44  7  o 4  8.32059e+00 1.53097e+00 2.08600e+02 165.195 -1.55707e+01 4.11533e+00  0.00000e+00 0.00000e+00 9.73194e+01 165.195 1.11280e+02 345.195 0.9684 
1 1 1 12  44  8  o 3  4.57928e+00 1.33988e+00 6.08545e+01 176.946 -2.92751e+00 1.56168e-01  0.00000e+00 0.00000e+00 7.90652e+01 176.946 1.82107e+01 176.946 0.8048 
1 1 1 12  44  9  o 7  5.95518e+00 1.61825e+00 1.07089e+02 189.022 -6.24473e+00 -9.91523e-01 0.00000e+00 0.00000e+00 1.00254e+02 189.022 6.83549e+00 9.022   0.9171 
1 1 1 12  44  10 o 8  5.53470e+00 1.59806e+00 7.17553e+01 76.607  9.82721e-01  4.12718e+00  0.00000e+00 0.00000e+00 1.11503e+02 76.607  3.97479e+01 76.607  0.8722 
1 1 1 12  45  0  o 18 4.90266e+00 1.24090e+00 1.42422e+02 39.955  3.92847e+00  3.29110e+00  0.00000e+00 0.00000e+00 2.40507e+01 39.955  1.18372e+02 219.955 0.8962 
1 1 1 12  45  1  o 6  5.53799e+00 1.41865e+00 1.75313e+02 251.465 -2.21066e+00 -6.59374e+00 0.00000e+00 0.00000e+00 1.88684e+01 251.465 1.56444e+02 71.465  0.9250 
1 1 1 12  45  2  o 19 1.54283e+01 1.15382e+00 2.97365e+02 24.663  3.28340e+01  1.50766e+01  0.00000e+00 0.00000e+00 2.79529e+02 24.663  1.78358e+01 204.663 0.9861 
1 1 1 12  45  3  o 7  2.42133e+01 8.40062e-01 4.74089e+02 127.616 -6.46813e+01 8.39434e+01  0.00000e+00 0.00000e+00 4.40051e+02 127.616 3.40372e+01 307.616 0.9953 
1 1 1 12  45  4  o 6  6.42781e+00 1.29009e+00 1.36181e+02 353.109 7.34326e+00  -8.87483e-01 0.00000e+00 0.00000e+00 9.05688e+01 353.109 4.56119e+01 173.109 0.9297 
1 1 1 12  45  5  o 12 4.83004e+00 1.27534e+00 7.03967e+01 192.578 -2.81496e+00 -6.28091e-01 0.00000e+00 0.00000e+00 7.64395e+01 192.578 6.04277e+00 192.578 0.8010 
1 1 1 12  45  6  o 6  5.10954e+00 1.34404e+00 8.69798e+01 77.490  9.41843e-01  4.24476e+00  0.00000e+00 0.00000e+00 8.28525e+01 77.490  4.12732e+00 257.490 0.8757 
1 1 1 12  45  7  o 12 7.96641e+00 1.49208e+00 1.55467e+02 163.067 -1.15100e+01 3.50427e+00  0.00000e+00 0.00000e+00 1.34086e+02 163.067 2.13811e+01 343.067 0.9575 
1 1 1 12  45  8  o 3  4.19450e+00 1.30041e+00 7.55463e+01 262.168 -5.11453e-01 -3.71833e+00 0.00000e+00 0.00000e+00 6.03256e+01 262.168 1.52208e+01 82.168  0.8533 
1 1 1 12  45  9  o 9  4.89265e+00 1.44508e+00 1.24104e+02 139.482 -4.84171e+00 4.13789e+00  0.00000e+00 0.00000e+00 4.63408e+01 139.482 7.77635e+01 319.482 0.9177 
1 1 1 12  45  10 o 2  6.92511e+00 1.79651e+00 1.08646e+02 49.059  4.49237e+00  5.17863e+00  0.00000e+00 0.00000e+00 1.34196e+02 49.059  2.55505e+01 49.059  0.9239 
1 1 1 12  46  0  o 19 2.23724e+01 1.00532e+00 3.03617e+02 193.398 -5.47479e+01 -1.30405e+01 0.00000e+00 0.00000e+00 5.36369e+02 193.398 2.32751e+02 193.398 0.9911 
1 1 1 12  46  1  o 17 2.31154e+01 1.01139e+00 3.19355e+02 102.795 -1.34976e+01 5.94353e+01  0.00000e+00 0.00000e+00 5.49524e+02 102.795 2.30169e+02 102.795 0.9918 
1 1 1 12  46  2  o 4  1.05527e+01 1.05472e+00 1.55662e+02 202.561 -1.29532e+01 -5.38167e+00 0.00000e+00 0.00000e+00 2.29915e+02 202.561 7.42528e+01 202.561 0.9637 
1 1 1 12  46  3  o 1  4.91413e+00 1.22613e+00 1.64278e+02 351.944 6.47437e+00  -9.16349e-01 0.00000e+00 0.00000e+00 7.19434e+00 351.944 1.57084e+02 171.944 0.9200 
1 1 1 12  46  4  o 13 9.72302e+00 1.14604e+00 1.40093e+02 209.337 -1.10409e+01 -6.20524e+00 0.00000e+00 0.00000e+00 2.13908e+02 209.337 7.38157e+01 209.337 0.9597 
1 1 1 12  46  5  o 8  4.61559e+00 1.23902e+00 9.61457e+01 90.261  -1.86109e-02 4.07927e+00  0.00000e+00 0.00000e+00 5.56186e+01 90.261  4.05271e+01 270.261 0.8665 
1 1 1 12  46  6  f 0  3.60803e+00 1.14662e+00 5.41043e+01 98.685  -3.02188e-01 1.97833e+00  0.00000e+00 0.00000e+00 4.14723e+01 98.685  1.26320e+01 278.685 0.6980 
1 1 1 12  46  7  f 0  4.48695e+00 1.29674e+00 1.54653e+02 308.677 4.49843e+00  -5.61963e+00 0.00000e+00 0.00000e+00 3.33488e+00 308.677 1.51318e+02 128.677 0.9277 
1 1 1 12  46  8  o 10 7.18597e+00 1.51329e+00 1.56869e+02 27.794  1.02372e+01  5.39598e+00  0.00000e+00 0.00000e+00 1.03819e+02 27.794  5.30506e+01 207.794 0.9558 
1 1 1 12  46  9  o 6  5.07365e+00 1.40447e+00 7.15453e+01 268.090 -1.41128e-01 -4.23260e+00 0.00000e+00 0.00000e+00 9.63729e+01 268.090 2.48275e+01 268.090 0.8720 
1 1 1 12  46  10 o 5  4.02350e+00 1.33850e+00 6.33798e+01 266.402 -2.06037e-01 -3.27630e+00 0.00000e+00 0.00000e+00 6.31904e+01 266.402 1.89404e-01 86.402  0.8289 
1 1 1 12  47  0  o 12 1.67751e+01 1.01902e+00 3.67978e+02 263.768 -5.51564e+00 -5.05099e+01 0.00000e+00 0.00000e+00 2.61159e+02 263.768 1.06819e+02 83.768  0.9901 
1 1 1 12  47  1  o 17 7.89787e+00 1.75478e+00 1.30608e+02 199.695 -6.06010e+00 -2.16925e+00 0.00000e+00 0.00000e+00 1.44342e+02 199.695 1.37337e+01 199.695 0.9187 
1 1 1 12  47  2  o 17 1.51476e+01 9.07464e-01 3.43744e+02 29.822  4.08674e+01  2.34257e+01  0.00000e+00 0.00000e+00 2.24388e+02 29.822  1.19357e+02 209.822 0.9893 
1 1 1 12  47  3  o 14 4.30206e+00 1.17198e+00 1.64998e+02 29.177  5.57797e+00  3.11443e+00  0.00000e+00 0.00000e+00 1.52270e+01 209.177 1.80225e+02 209.177 0.9180 
1 1 1 12  47  4  o 7  1.20803e+01 1.00623e+00 2.43808e+02 33.372  2.45768e+01  1.61882e+01  0.00000e+00 0.00000e+00 2.06590e+02 33.372  3.72183e+01 213.372 0.9829 
1 1 1 12  47  5  o 16 6.04784e+00 1.40167e+00 9.65624e+01 196.659 -5.16539e+00 -1.54570e+00 0.00000e+00 0.00000e+00 1.10355e+02 196.659 1.37925e+01 196.659 0.9017 
1 1 1 12  47  6  o 1  1.04501e+01 1.25595e+00 2.49626e+02 263.047 -3.31085e+00 -2.71471e+01 0.00000e+00 0.00000e+00 1.39607e+02 263.047 1.10020e+02 83.047  0.9815 
1 1 1 12  47  7  o 6  1.00446e+01 1.39953e+00 1.29529e+02 177.686 -1.31091e+01 5.29638e-01  0.00000e+00 0.00000e+00 2.36840e+02 177.686 1.07311e+02 177.686 0.9611 
1 1 1 12  47  8  o 11 7.93106e+00 1.58331e+00 1.41767e+02 43.090  8.11642e+00  7.59252e+00  0.00000e+00 0.00000e+00 1.45350e+02 43.090  3.58306e+00 43.090  0.9539 
1 1 1 12  47  9  o 2  6.82925e+00 1.68094e+00 1.44884e+02 261.957 -1.29589e+00 -9.17043e+00 0.00000e+00 0.00000e+00 9.98680e+01 261.957 4.50156e+01 81.957  0.9444 
1 1 1 12  47  10 o 2  5.42073e+00 1.57158e+00 7.29882e+01 122.852 -2.43639e+00 3.77298e+00  0.00000e+00 0.00000e+00 1.08041e+02 122.852 3.50523e+01 122.852 0.8801 
1 1 1 12  48  0  o 18 5.33576e+00 1.37550e+00 1.13032e+02 307.859 2.68543e+00  -3.45470e+00 0.00000e+00 0.00000e+00 6.41091e+01 307.859 4.89226e+01 127.859 0.8766 
1 1 1 12  48  1  f 0  1.40757e+01 1.08543e+00 2.30707e+02 289.714 9.24040e+00  -2.57872e+01 0.00000e+00 0.00000e+00 2.92809e+02 289.714 6.21022e+01 289.714 0.9816 
1 1 1 12  48  2  o 14 1.60807e+01 8.53771e-01 3.35849e+02 93.335  -2.88966e+00 4.95828e+01  0.00000e+00 0.00000e+00 2.67538e+02 93.335  6.83110e+01 273.335 0.9899 
1 1 1 12  48  3  o 5  9.07221e+00 1.09319e+00 1.19952e+02 239.266 -5.07913e+00 -8.54284e+00 0.00000e+00 0.00000e+00 2.06259e+02 239.266 8.63066e+01 239.266 0.9483 
1 1 1 12  48  4  o 13 7.13345e+00 1.29231e+00 9.21737e+01 221.082 -4.18065e+00 -3.64464e+00 0.00000e+00 0.00000e+00 1.52599e+02 221.082 6.04251e+01 221.082 0.9047 
1 1 1 12  48  5  o 4  5.83927e+00 1.44275e+00 1.57477e+02 52.500  5.22348e+00  6.80731e+00  0.00000e+00 0.00000e+00 5.07062e+01 52.500  1.06771e+02 232.500 0.9398 
1 1 1 12  48  6  o 9  6.45024e+00 1.39113e+00 1.35628e+02 94.008  -5.79500e-01 8.27090e+00  0.00000e+00 0.00000e+00 9.38378e+01 94.008  4.17898e+01 274.008 0.9376 
1 1 1 12  48  7  o 1  7.14208e+00 1.40174e+00 1.88306e+02 100.362 -2.53640e+00 1.38712e+01  0.00000e+00 0.00000e+00 7.29103e+01 100.362 1.15396e+02 280.362 0.9639 
1 1 1 12  48  8  o 8  1.51782e+01 1.20769e+00 3.63582e+02 314.444 4.72214e+01  -4.81472e+01 0.00000e+00 0.00000e+00 2.08092e+02 314.444 1.55490e+02 134.444 0.9926 
1 1 1 12  48  9  f 0  9.42280e+00 1.58198e+00 7.50973e+01 222.913 -5.47785e+00 -5.09274e+00 0.00000e+00 0.00000e+00 2.57612e+02 222.913 1.82515e+02 222.913 0.9305 
1 1 1 12  48  10 o 10 5.27167e+00 1.63351e+00 1.21873e+02 272.866 3.37208e-01  -6.73575e+00 0.00000e+00 0.00000e+00 6.26528e+01 272.866 5.92200e+01 92.866  0.9226 
1 1 1 12  49  0  o 18 1.35229e+01 1.54665e+00 2.74207e+02 324.677 2.13630e+01  -1.51384e+01 0.00000e+00 0.00000e+00 2.28017e+02 324.677 4.61901e+01 144.677 0.9807 
1 1 1 12  49  1  o 2  1.00185e+01 1.38302e+00 1.30517e+02 222.308 -7.36314e+00 -6.70193e+00 0.00000e+00 0.00000e+00 2.29447e+02 222.308 9.89307e+01 222.308 0.9484 
1 1 1 12  49  2  o 18 1.29404e+01 8.95485e-01 1.97041e+02 317.780 1.88356e+01  -1.70910e+01 0.00000e+00 0.00000e+00 2.83672e+02 317.780 8.66308e+01 317.780 0.9801 
1 1 1 12  49  3  o 12 1.08670e+01 1.04541e+00 1.79191e+02 52.923  1.10137e+01  1.45748e+01  0.00000e+00 0.00000e+00 2.21374e+02 52.923  4.21828e+01 52.923  0.9722 
1 1 1 12  49  4  o 19 1.95295e+01 8.64822e-01 2.84584e+02 259.314 -1.09932e+01 -5.82559e+01 0.00000e+00 0.00000e+00 4.49775e+02 259.314 1.65191e+02 259.314 0.9915 
1 1 1 12  49  5  f 0  1.03675e+01 1.11754e+00 1.24835e+02 182.777 -1.41086e+01 -6.84371e-01 0.00000e+00 0.00000e+00 2.54233e+02 182.777 1.29397e+02 182.777 0.9639 
1 1 1 12  49  6  o 15 4.64050e+00 1.30716e+00 5.35376e+01 187.320 -2.57397e+00 -3.30643e-01 0.00000e+00 0.00000e+00 8.28922e+01 187.320 2.93546e+01 187.320 0.7750 
1 1 1 12  49  7  f 0  1.53690e+01 1.07487e+00 2.60379e+02 74.968  1.26998e+01  4.72906e+01  0.00000e+00 0.00000e+00 3.16743e+02 74.968  5.63641e+01 74.968  0.9897 
1 1 1 12  49  8  o 8  5.31097e+00 1.52464e+00 9.72732e+01 342.815 5.03804e+00  -1.55811e+00 0.00000e+00 0.00000e+00 8.39535e+01 342.815 1.33196e+01 162.815 0.8994 
1 1 1 12  49  9  o 16 4.26457e+00 1.33412e+00 5.77391e+01 265.070 -2.49573e-01 -2.89355e+00 0.00000e+00 0.00000e+00 7.21288e+01 265.070 1.43897e+01 265.070 0.8027 
1 1 1 12  49  10 o 15 4.57323e+00 1.41213e+00 1.05897e+02 242.396 -2.76099e+00 -5.28030e+00 0.00000e+00 0.00000e+00 5.22771e+01 242.396 5.36202e+01 62.396  0.9117 
1 1 1 12  50  0  o 6  1.16049e+01 1.11218e+00 2.20746e+02 287.350 6.44110e+00  -2.06161e+01 0.00000e+00 0.00000e+00 2.08364e+02 287.350 1.23812e+01 107.350 0.9766 
1 1 1 12  50  1  o 11 8.04902e+00 1.19359e+00 2.09578e+02 192.780 -1.34692e+01 -3.05512e+00 0.00000e+00 0.00000e+00 8.40725e+01 192.780 1.25505e+02 12.780  0.9631 
1 1 1 12  50  2  o 8  6.10874e+00 1.22778e+00 1.01636e+02 336.605 4.93767e+00  -2.13618e+00 0.00000e+00 0.00000e+00 1.07059e+02 336.605 5.42222e+00 336.605 0.9015 
1 1 1 12  50  3  o 5  5.68663e+00 1.29272e+00 1.46261e+02 354.334 7.34742e+00  -7.29005e-01 0.00000e+00 0.00000e+00 5.41299e+01 354.334 9.21307e+01 174.334 0.9296 
1 1 1 12  50  4  o 11 8.07546e+00 1.20067e+00 1.84088e+02 3.829   1.44214e+01  9.65198e-01  0.00000e+00 0.00000e+00 1.11332e+02 3.829   7.27560e+01 183.829 0.9648 
1 1 1 12  50  5  f 0  6.80561e+00 1.29191e+00 2.88708e+02 111.977 -7.05269e+00 1.74764e+01  0.00000e+00 0.00000e+00 3.75388e+01 291.977 3.26246e+02 291.977 0.9731 
1 1 1 12  50  6  o 13 6.09301e+00 1.40899e+00 8.79892e+01 358.187 5.44605e+00  -1.72378e-01 0.00000e+00 0.00000e+00 1.20677e+02 358.187 3.26876e+01 358.187 0.9028 
1 1 1 12  50  7  o 15 8.13518e+00 1.31836e+00 1.69916e+02 354.322 1.46266e+01  -1.45420e+00 0.00000e+00 0.00000e+00 1.28005e+02 354.322 4.19113e+01 174.322 0.9654 
1 1 1 12  50  8  o 15 7.90881e+00 1.61239e+00 1.16507e+02 164.801 -8.61435e+00 2.34028e+00  0.00000e+00 0.00000e+00 1.66183e+02 164.801 4.96767e+01 164.801 0.9422 
1 1 1 12  50  9  o 14 5.56237e+00 1.58531e+00 1.74694e+02 247.979 -3.87848e+00 -9.58945e+00 0.00000e+00 0.00000e+00 2.58398e+01 247.979 1.48855e+02 67.979  0.9504 
1 1 1 12  50  10 o 7  5.64498e+00 1.65571e+00 1.06988e+02 167.383 -5.90635e+00 1.32204e+00  0.00000e+00 0.00000e+00 8.85411e+01 167.383 1.84466e+01 347.383 0.9132 
1 1 1 12  51  0  o 7  7.47869e+00 1.28041e+00 7.45306e+01 248.622 -1.75027e+00 -4.47128e+00 0.00000e+00 0.00000e+00 1.77053e+02 248.622 1.02522e+02 248.622 0.8886 
1 1 1 12  51  1  o 9  9.05996e+00 1.14795e+00 2.40728e+02 255.923 -4.74914e+00 -1.89387e+01 0.00000e+00 0.00000e+00 9.35182e+01 255.923 1.47210e+02 75.923  0.9740 
1 1 1 12  51  2  o 1  7.45365e+00 1.12090e+00 1.71967e+02 69.732  4.16774e+00  1.12861e+01  0.00000e+00 0.00000e+00 9.84517e+01 69.732  7.35151e+01 249.732 0.9575 
1 1 1 12  51  3  o 16 3.87555e+00 1.11020e+00 8.86014e+01 232.548 -1.89185e+00 -2.46983e+00 0.00000e+00 0.00000e+00 3.15409e+01 232.548 5.70605e+01 52.548  0.8179 
1 1 1 12  51  4  o 13 6.85043e+00 1.11209e+00 1.87992e+02 106.204 -3.79754e+00 1.30682e+01  0.00000e+00 0.00000e+00 6.19978e+01 106.204 1.25995e+02 286.204 0.9625 
1 1 1 12  51  5  o 2  4.74817e+00 1.28617e+00 1.26716e+02 199.403 -5.85969e+00 -2.06383e+00 0.00000e+00 0.00000e+00 3.81333e+01 199.403 8.85824e+01 19.403  0.9155 
1 1 1 12  51  6  o 7  7.42221e+00 1.55734e+00 1.26169e+02 304.537 4.80164e+00  -6.97685e+00 0.00000e+00 0.00000e+00 1.38151e+02 304.537 1.19821e+01 304.537 0.9390 
1 1 1 12  51  7  o 6  1.10672e+01 1.30198e+00 2.27852e+02 341.509 2.82818e+01  -9.45797e+00 0.00000e+00 0.00000e+00 1.84828e+02 341.509 4.30243e+01 161.509 0.9831 
1 1 1 12  51  8  o 14 3.84689e+00 1.25057e+00 9.84356e+01 88.480  1.17624e-01  4.43362e+00  0.00000e+00 0.00000e+00 2.97370e+01 88.480  6.86986e+01 268.480 0.8784 
1 1 1 12  51  9  o 17 4.21574e+00 1.34678e+00 3.69164e+01 238.704 -1.01584e+00 -1.67100e+00 0.00000e+00 0.00000e+00 7.34700e+01 238.704 3.65536e+01 238.704 0.6903 
1 1 1 12  51  10 o 2  4.66747e+00 1.48650e+00 9.39189e+01 208.639 -4.55433e+00 -2.48711e+00 0.00000e+00 0.00000e+00 6.49719e+01 208.639 2.89470e+01 28.639  0.8976 
1 1 1 12  52  0  o 8  5.76199e+00 1.36692e+00 5.75621e+01 193.343 -2.64055e+00 -6.26287e-01 0.00000e+00 0.00000e+00 1.13955e+02 193.343 5.63933e+01 193.343 0.7864 
1 1 1 12  52  1  o 7  5.42061e+00 1.24875e+00 1.40999e+02 250.502 -2.27369e+00 -6.42142e+00 0.00000e+00 0.00000e+00 4.85508e+01 250.502 9.24484e+01 70.502  0.9234 
1 1 1 12  52  2  o 19 5.85696e+00 1.10137e+00 1.70177e+02 97.674  -1.27998e+00 9.49983e+00  0.00000e+00 0.00000e+00 3.98010e+01 97.674  1.30376e+02 277.674 0.9463 
1 1 1 12  52  3  o 15 1.74205e+01 8.54490e-01 3.18912e+02 290.511 2.08127e+01  -5.56337e+01 0.00000e+00 0.00000e+00 3.35705e+02 290.511 1.67923e+01 290.511 0.9915 
1 1 1 12  52  4  o 5  8.55563e+00 1.22718e+00 1.52754e+02 120.589 -6.89918e+00 1.16711e+01  0.00000e+00 0.00000e+00 1.59373e+02 120.589 6.61906e+00 120.589 0.9624 
1 1 1 12  52  5  o 12 7.16782e+00 1.28770e+00 1.10311e+02 42.228  5.83854e+00  5.29927e+00  0.00000e+00 0.00000e+00 1.43594e+02 42.228  3.32825e+01 42.228  0.9342 
1 1 1 12  52  6  o 8  7.05369e+00 1.57470e+00 1.18439e+02 353.886 7.61261e+00  -8.15460e-01 0.00000e+00 0.00000e+00 1.30911e+02 353.886 1.24722e+01 353.886 0.9322 
1 1 1 12  52  7  o 11 1.85966e+01 1.00863e+00 2.65562e+02 252.893 -1.99348e+01 -6.47700e+01 0.00000e+00 0.00000e+00 4.34487e+02 252.893 1.68925e+02 252.893 0.9926 
1 1 1 12  52  8  o 2  9.34123e+00 1.56900e+00 1.14453e+02 328.217 9.56699e+00  -5.92787e+00 0.00000e+00 0.00000e+00 2.23695e+02 328.217 1.09242e+02 328.217 0.9545 
1 1 1 12  52  9  o 7  3.67571e+00 1.21478e+00 3.06937e+01 78.809  2.86013e-01  1.44566e+00  0.00000e+00 0.00000e+00 5.14900e+01 78.809  2.07963e+01 78.809  0.5896 
1 1 1 12  52  10 o 19 4.61340e+00 1.48895e+00 1.02307e+02 115.842 -2.49601e+00 5.15369e+00  0.00000e+00 0.00000e+00 5.65214e+01 115.842 4.57856e+01 295.842 0.9079 
1 1 1 12  53  0  o 5  8.83836e+00 1.25699e+00 1.13276e+02 201.481 -8.26867e+00 -3.25402e+00 0.00000e+00 0.00000e+00 2.01810e+02 201.481 8.85332e+01 201.481 0.9419 
1 1 1 12  53  1  o 1  3.29004e+00 1.02929e+00 9.31456e+01 156.414 -2.64512e+00 1.15483e+00  0.00000e+00 0.00000e+00 6.66654e+00 156.414 8.64791e+01 336.414 0.8012 
1 1 1 12  53  2  o 14 1.13535e+01 9.49704e-01 2.08818e+02 251.887 -7.07797e+00 -2.16381e+01 0.00000e+00 0.00000e+00 2.11694e+02 251.887 2.87560e+00 251.887 0.9778 
1 1 1 12  53  3  o 1  1.15268e+01 9.86596e-01 2.14064e+02 329.056 2.24891e+01  -1.34829e+01 0.00000e+00 0.00000e+00 2.14303e+02 329.056 2.38209e-01 329.056 0.9807 
1 1 1 12  53  4  o 8  1.05230e+01 1.04693e+00 1.58624e+02 174.882 -1.78063e+01 1.59474e+00  0.00000e+00 0.00000e+00 2.28902e+02 174.882 7.02782e+01 174.882 0.9716 
1 1 1 12  53  5  o 17 5.88056e+00 1.36673e+00 9.94004e+01 318.305 4.41842e+00  -3.93598e+00 0.00000e+00 0.00000e+00 1.03705e+02 318.305 4.30447e+00 318.305 0.9111 
1 1 1 12  53  6  o 7  4.58531e+00 1.39116e+00 7.46106e+01 129.793 -2.30769e+00 2.77044e+00  0.00000e+00 0.00000e+00 7.25483e+01 129.793 2.06227e+00 309.793 0.8464 
1 1 1 12  53  7  o 7  4.71218e+00 1.31825e+00 1.08735e+02 277.274 7.44698e-01  -5.83444e+00 0.00000e+00 0.00000e+00 5.39526e+01 277.274 5.47819e+01 97.274  0.9105 
1 1 1 12  53  8  o 12 6.09672e+00 1.61861e+00 1.37047e+02 351.045 8.01722e+00  -1.26337e+00 0.00000e+00 0.00000e+00 7.93921e+01 351.045 5.76553e+01 171.045 0.9362 
1 1 1 12  53  9  o 9  8.74110e+00 1.70360e+00 1.42673e+02 94.768  -1.04927e+00 1.25790e+01  0.00000e+00 0.00000e+00 1.75367e+02 94.768  3.26938e+01 94.768  0.9595 
1 1 1 12  53  10 o 2  4.38953e+00 1.43294e+00 6.93469e+01 11.447  3.53623e+00  7.16041e-01  0.00000e+00 0.00000e+00 7.15447e+01 11.447  2.19780e+00 11.447  0.8466 
1 1 1 12  54  0  o 8  5.43435e+00 1.29509e+00 1.39884e+02 326.965 5.40214e+00  -3.51287e+00 0.00000e+00 0.00000e+00 4.90536e+01 326.965 9.08308e+01 146.965 0.9187 
1 1 1 12  54  1  o 7  1.82308e+01 9.01229e-01 3.88701e+02 180.573 -7.33540e+01 -7.33823e-01 0.00000e+00 0.00000e+00 2.96786e+02 180.573 9.19153e+01 0.573   0.9932 
1 1 1 12  54  2  o 2  9.85151e+00 1.05436e+00 1.69142e+02 179.626 -1.65309e+01 1.07839e-01  0.00000e+00 0.00000e+00 1.92509e+02 179.626 2.33663e+01 179.626 0.9693 
1 1 1 12  54  3  o 15 1.08750e+01 1.00401e+00 2.41013e+02 34.904  2.47450e+01  1.72647e+01  0.00000e+00 0.00000e+00 1.64118e+02 34.904  7.68948e+01 214.904 0.9833 
1 1 1 12  54  4  o 4  1.14379e+01 1.05339e+00 1.98849e+02 111.523 -9.64561e+00 2.44585e+01  0.00000e+00 0.00000e+00 2.26287e+02 111.523 2.74385e+01 111.523 0.9808 
1 1 1 12  54  5  o 7  4.74905e+00 1.17345e+00 1.39572e+02 60.962  3.70241e+00  6.66876e+00  0.00000e+00 0.00000e+00 2.81878e+01 60.962  1.11384e+02 240.961 0.9319 
1 1 1 12  54  6  o 10 1.02090e+01 1.53375e+00 1.81079e+02 240.384 -8.64849e+00 -1.52141e+01 0.00000e+00 0.00000e+00 1.94724e+02 240.384 1.36448e+01 240.384 0.9710 
1 1 1 12  54  7  o 3  4.53044e+00 1.34190e+00 6.68104e+01 239.258 -1.75777e+00 -2.95555e+00 0.00000e+00 0.00000e+00 7.71020e+01 239.258 1.02916e+01 239.258 0.8378 
1 1 1 12  54  8  o 15 9.89193e+00 1.47631e+00 1.95174e+02 185.028 -2.17293e+01 -1.91167e+00 0.00000e+00 0.00000e+00 1.71175e+02 185.028 2.39986e+01 5.028   0.9768 
1 1 1 12  54  9  o 11 5.80201e+00 1.45293e+00 1.09561e+02 20.557  7.31749e+00  2.74425e+00  0.00000e+00 0.00000e+00 9.58147e+01 20.557  1.37462e+01 200.557 0.9336 
1 1 1 12  54  10 o 12 5.37398e+00 1.54505e+00 8.73820e+01 324.457 4.36747e+00  -3.12027e+00 0.00000e+00 0.00000e+00 9.62285e+01 324.457 8.84650e+00 324.457 0.9013 
1 1 1 12  55  0  o 13 8.06222e+00 1.15450e+00 1.20939e+02 261.629 -1.26383e+00 -8.58888e+00 0.00000e+00 0.00000e+00 1.65960e+02 261.629 4.50212e+01 261.629 0.9405 
1 1 1 12  55  1  o 8  2.70855e+01 8.38538e-01 4.86737e+02 232.404 -8.64898e+01 -1.12324e+02 0.00000e+00 0.00000e+00 5.34925e+02 232.404 4.81877e+01 232.404 0.9965 
1 1 1 12  55  2  o 6  1.79920e+01 8.26018e-01 2.64724e+02 86.659  3.13157e+00  5.36420e+01  0.00000e+00 0.00000e+00 4.10235e+02 86.659  1.45512e+02 86.659  0.9907 
1 1 1 12  55  3  o 16 1.07330e+01 1.03001e+00 2.20537e+02 263.857 -2.87359e+00 -2.67014e+01 0.00000e+00 0.00000e+00 1.78399e+02 263.857 4.21378e+01 83.857  0.9812 
1 1 1 12  55  4  o 3  5.04994e+00 1.28301e+00 1.48911e+02 314.394 5.25871e+00  -5.37114e+00 0.00000e+00 0.00000e+00 2.92133e+01 314.394 1.19697e+02 134.394 0.9309 
1 1 1 12  55  5  o 1  3.30439e+00 1.04484e+00 8.60807e+00 237.208 -1.80488e-01 -2.80149e-01 0.00000e+00 0.00000e+00 1.19750e+01 237.208 3.36688e+00 237.208 0.1644 
1 1 1 12  55  6  o 8  4.91562e+00 1.47009e+00 8.59859e+01 63.221  2.03956e+00  4.04135e+00  0.00000e+00 0.00000e+00 7.81882e+01 63.221  7.79770e+00 243.221 0.8811 
1 1 1 12  55  7  o 1  9.11139e+00 1.32167e+00 1.80827e+02 38.298  1.48536e+01  1.17297e+01  0.00000e+00 0.00000e+00 1.55316e+02 38.298  2.55113e+01 218.298 0.9732 
1 1 1 12  55  8  o 6  8.82598e+00 1.53445e+00 1.50761e+02 181.612 -1.46406e+01 -4.12024e-01 0.00000e+00 0.00000e+00 1.72192e+02 181.612 2.14311e+01 181.612 0.9652 
1 1 1 12  55  9  o 3  8.59999e+00 1.62989e+00 1.67834e+02 330.351 1.33739e+01  -7.61248e+00 0.00000e+00 0.00000e+00 1.47395e+02 330.351 2.04397e+01 150.351 0.9669 
1 1 1 12  55  10 o 6  3.81416e+00 1.29339e+00 4.87335e+01 47.376  1.72458e+00  1.87388e+00  0.00000e+00 0.00000e+00 6.25843e+01 47.376  1.38508e+01 47.376  0.7700 
1 1 1 12  56  0  o 4  1.37725e+01 8.26754e-01 2.57749e+02 290.433 1.33641e+01  -3.58714e+01 0.00000e+00 0.00000e+00 2.56422e+02 290.433 1.32693e+00 110.433 0.9869 
1 1 1 12  56  1  o 5  1.05352e+01 9.88357e-01 1.65078e+02 170.822 -1.82350e+01 2.94629e+00  0.00000e+00 0.00000e+00 2.22709e+02 170.822 5.76311e+01 170.822 0.9725 
1 1 1 12  56  2  o 5  1.06831e+01 9.45921e-01 1.90750e+02 61.535  1.14575e+01  2.11332e+01  0.00000e+00 0.00000e+00 2.05238e+02 61.535  1.44884e+01 61.535  0.9790 
1 1 1 12  56  3  o 7  8.44206e+00 1.10607e+00 1.37401e+02 266.476 -7.43230e-01 -1.20701e+01 0.00000e+00 0.00000e+00 1.68824e+02 266.476 3.14228e+01 266.476 0.9577 
1 1 1 12  56  4  o 9  1.03264e+01 1.16915e+00 1.91896e+02 324.025 1.78556e+01  -1.29610e+01 0.00000e+00 0.00000e+00 1.90353e+02 324.025 1.54348e+00 144.025 0.9771 
1 1 1 12  56  5  o 12 5.31024e+00 1.32548e+00 7.09404e+01 240.387 -1.94940e+00 -3.42969e+00 0.00000e+00 0.00000e+00 1.02388e+02 240.387 3.14475e+01 240.387 0.8614 
1 1 1 12  56  6  o 9  5.48703e+00 1.38942e+00 8.00160e+01 136.996 -3.54221e+00 3.30359e+00  0.00000e+00 0.00000e+00 1.04984e+02 136.996 2.49684e+01 136.996 0.8896 
1 1 1 12  56  7  o 3  6.96496e+00 1.47877e+00 1.32607e+02 190.754 -9.33404e+00 -1.77288e+00 0.00000e+00 0.00000e+00 1.17076e+02 190.754 1.55317e+01 10.754  0.9458 
1 1 1 12  56  8  o 9  4.55599e+00 1.43127e+00 1.05291e+02 331.696 4.94968e+00  -2.66562e+00 0.00000e+00 0.00000e+00 5.11723e+01 331.696 5.41186e+01 151.696 0.9061 
1 1 1 12  56  9  o 3  4.63403e+00 1.39799e+00 8.82615e+01 242.168 -2.25099e+00 -4.26367e+00 0.00000e+00 0.00000e+00 6.78932e+01 242.168 2.03684e+01 62.168  0.8891 
1 1 1 12  57  0  o 18 9.02950e+00 9.95297e-01 1.08813e+02 276.433 1.16473e+00  -1.03294e+01 0.00000e+00 0.00000e+00 2.15858e+02 276.433 1.07045e+02 276.433 0.9506 
1 1 1 12  57  1  o 11 5.67623e+00 1.20927e+00 1.19018e+02 202.983 -6.28132e+00 -2.66409e+00 0.00000e+00 0.00000e+00 7.93503e+01 202.983 3.96673e+01 22.983  0.9235 
1 1 1 12  57  2  o 13 8.83351e+00 1.09596e+00 1.06426e+02 196.569 -9.91923e+00 -2.95122e+00 0.00000e+00 0.00000e+00 2.11391e+02 196.569 1.04965e+02 196.569 0.9504 
1 1 1 12  57  3  o 19 1.16636e+01 9.29383e-01 2.41368e+02 53.566  1.96365e+01  2.66009e+01  0.00000e+00 0.00000e+00 1.93593e+02 53.566  4.77749e+01 233.566 0.9848 
1 1 1 12  57  4  o 16 1.30799e+01 9.43567e-01 2.59675e+02 183.585 -4.36288e+01 -2.73351e+00 0.00000e+00 0.00000e+00 2.30086e+02 183.585 2.95885e+01 3.585   0.9885 
1 1 1 12  57  5  o 19 5.79147e+00 1.32445e+00 1.56574e+02 314.015 6.76806e+00  -7.00490e+00 0.00000e+00 0.00000e+00 5.12623e+01 314.015 1.05311e+02 134.015 0.9472 
1 1 1 12  57  6  o 16 5.88753e+00 1.38389e+00 5.12063e+01 355.794 3.32393e+00  -2.44460e-01 0.00000e+00 0.00000e+00 1.34383e+02 355.794 8.31764e+01 355.794 0.8319 
1 1 1 12  57  7  o 3  5.79634e+00 1.41627e+00 8.71948e+01 9.973   5.76284e+00  1.01331e+00  0.00000e+00 0.00000e+00 1.12693e+02 9.973   2.54980e+01 9.973   0.9100 
1 1 1 12  57  8  o 6  4.89603e+00 1.53006e+00 4.27025e+01 287.292 6.93195e-01  -2.22674e+00 0.00000e+00 0.00000e+00 9.56107e+01 287.292 5.29081e+01 287.292 0.7454 
1 1 1 12  57  9  o 10 6.17864e+00 1.62472e+00 1.15495e+02 223.507 -5.58840e+00 -5.30452e+00 0.00000e+00 0.00000e+00 1.02882e+02 223.507 1.26130e+01 43.507  0.9326 
1 1 1 12  58  0  o 15 2.28501e+01 8.88231e-01 3.52183e+02 74.300  2.62944e+01  9.35427e+01  0.00000e+00 0.00000e+00 5.07526e+02 74.300  1.55343e+02 74.300  0.9948 
1 1 1 12  58  1  o 19 1.10479e+01 9.02366e-01 2.09940e+02 220.019 -2.12724e+01 -1.78616e+01 0.00000e+00 0.00000e+00 2.00474e+02 220.019 9.46646e+00 40.019  0.9818 
1 1 1 12  58  2  o 9  5.13100e+00 1.21741e+00 1.14703e+02 86.468  3.59441e-01  5.82299e+00  0.00000e+00 0.00000e+00 6.19726e+01 86.468  5.27308e+01 266.468 0.9097 
1 1 1 12  58  3  o 19 1.57314e+01 8.58452e-01 2.86622e+02 95.824  -5.87947e+00 5.76437e+01  0.00000e+00 0.00000e+00 3.03860e+02 95.824  1.72378e+01 95.824  0.9913 
1 1 1 12  58  4  o 1  1.04384e+01 1.11935e+00 2.07443e+02 244.757 -1.04416e+01 -2.21468e+01 0.00000e+00 0.00000e+00 1.79740e+02 244.757 2.77031e+01 64.757  0.9794 
1 1 1 12  58  5  o 17 1.44266e+01 9.88276e-01 2.58318e+02 132.151 -3.13963e+01 3.46846e+01  0.00000e+00 0.00000e+00 2.82312e+02 132.151 2.39948e+01 132.151 0.9893 
1 1 1 12  58  6  o 5  6.07718e+00 1.33350e+00 1.21880e+02 4.813   8.42724e+00  7.09548e-01  0.00000e+00 0.00000e+00 9.42921e+01 4.813   2.75880e+01 184.813 0.9389 
1 1 1 12  58  7  o 16 1.03037e+01 1.29468e+00 1.71801e+02 43.917  1.49809e+01  1.44251e+01  0.00000e+00 0.00000e+00 2.09107e+02 43.917  3.73061e+01 43.917  0.9757 
1 1 1 12  58  8  o 4  3.33799e+00 1.17456e+00 8.29732e+01 331.338 3.47723e+00  -1.90070e+00 0.00000e+00 0.00000e+00 2.60633e+01 331.338 5.69098e+01 151.338 0.8621 
1 1 1 12  58  9  o 19 6.77684e+00 1.62383e+00 9.67603e+01 186.096 -7.21412e+00 -7.70512e-01 0.00000e+00 0.00000e+00 1.41598e+02 186.096 4.48373e+01 186.096 0.9283 
1 1 1 12  59  0  o 18 1.30827e+01 8.17134e-01 1.57333e+02 333.497 2.27949e+01  -1.13666e+01 0.00000e+00 0.00000e+00 3.27553e+02 333.497 1.70220e+02 333.497 0.9802 
1 1 1 12  59  1  o 12 1.56958e+01 8.16560e-01 2.71806e+02 276.042 5.25666e+00  -4.96654e+01 0.00000e+00 0.00000e+00 3.15991e+02 276.042 4.41857e+01 276.042 0.9899 
1 1 1 12  59  2  o 8  2.84371e+01 8.36353e-01 4.65022e+02 109.905 -5.48297e+01 1.51425e+02  0.00000e+00 0.00000e+00 6.07831e+02 109.905 1.42809e+02 109.905 0.9969 
1 1 1 12  59  3  f 0  1.47897e+01 8.76019e-01 2.21366e+02 8.616   4.14638e+01  6.28302e+00  0.00000e+00 0.00000e+00 3.31816e+02 8.616   1.10450e+02 8.616   0.9880 
1 1 1 12  59  4  o 5  9.59070e+00 1.08712e+00 1.42866e+02 115.761 -7.39235e+00 1.53187e+01  0.00000e+00 0.00000e+00 2.09468e+02 115.761 6.66021e+01 115.761 0.9701 
1 1 1 12  59  5  o 18 6.88615e+00 1.32271e+00 9.39389e+01 346.369 7.21261e+00  -1.74911e+00 0.00000e+00 0.00000e+00 1.48610e+02 346.369 5.46710e+01 346.369 0.9300 
1 1 1 12  59  6  o 10 6.14026e+00 1.34026e+00 3.30976e+01 182.054 -2.30831e+00 -8.27671e-02 0.00000e+00 0.00000e+00 1.39637e+02 182.054 1.06539e+02 182.054 0.7426 
1 1 1 12  59  7  o 9  7.60979e+00 1.45300e+00 1.36039e+02 181.903 -1.13670e+01 -3.77665e-01 0.00000e+00 0.00000e+00 1.39272e+02 181.903 3.23285e+00 181.903 0.9550 
1 1 1 12  59  8  o 9  5.83645e+00 1.66038e+00 1.34064e+02 135.509 -5.96695e+00 5.86176e+00  0.00000e+00 0.00000e+00 7.33796e+01 135.509 6.06847e+01 315.509 0.9382 
1 1 1 12  59  9  o 8  4.76395e+00 1.46894e+00 6.84600e+01 126.896 -2.26679e+00 3.01952e+00  0.00000e+00 0.00000e+00 8.57231e+01 126.896 1.72631e+01 126.896 0.8543 
1 1 1 12  60  0  o 11 1.01206e+01 8.97021e-01 1.76292e+02 294.432 8.37329e+00  -1.84312e+01 0.00000e+00 0.00000e+00 1.96762e+02 294.432 2.04701e+01 294.432 0.9750 
1 1 1 12  60  1  o 11 1.34439e+01 8.58297e-01 2.06345e+02 93.638  -2.21060e+00 3.47656e+01  0.00000e+00 0.00000e+00 2.94801e+02 93.638  8.84564e+01 93.638  0.9855 
1 1 1 12  60  2  o 1  7.17846e+00 1.13647e+00 8.82170e+01 284.086 1.74363e+00  -6.94897e+00 0.00000e+00 0.00000e+00 1.63666e+02 284.086 7.54488e+01 284.086 0.9273 
1 1 1 12  60  3  o 19 7.19038e+00 1.18872e+00 1.29716e+02 285.493 2.72545e+00  -9.83213e+00 0.00000e+00 0.00000e+00 1.28746e+02 285.493 9.69835e-01 105.493 0.9497 
1 1 1 12  60  4  o 1  9.47612e+00 1.14077e+00 2.38116e+02 113.997 -1.08522e+01 2.43780e+01  0.00000e+00 0.00000e+00 1.13875e+02 113.997 1.24241e+02 293.997 0.9811 
1 1 1 12  60  5  o 8  2.68393e+00 9.12211e-01 4.93188e+01 225.773 -1.32921e+00 -1.36555e+00 0.00000e+00 0.00000e+00 1.99639e+01 225.773 2.93549e+01 45.773  0.6817 
1 1 1 12  60  6  o 12 7.14071e+00 1.34079e+00 1.82940e+02 242.143 -6.79328e+00 -1.28537e+01 0.00000e+00 0.00000e+00 7.80406e+01 242.143 1.04899e+02 62.143  0.9650 
1 1 1 12  60  7  o 16 4.55771e+00 1.36368e+00 1.39873e+02 32.654  6.58309e+00  4.21879e+00  0.00000e+00 0.00000e+00 2.13140e+01 32.654  1.18559e+02 212.654 0.9337 
1 1 1 12  60  8  o 1  7.69295e+00 1.54022e+00 1.42281e+02 167.616 -1.19176e+01 2.61670e+00  0.00000e+00 0.00000e+00 1.36912e+02 167.616 5.36861e+00 347.616 0.9581 
1 1 1 12  60  9  o 2  5.32000e+00 1.53310e+00 1.00636e+02 359.230 6.16540e+00  -8.28168e-02 0.00000e+00 0.00000e+00 8.37180e+01 359.230 1.69178e+01 179.230 0.9149 
1 1 1 12  61  0  o 1  6.87035e+00 1.10481e+00 1.10403e+02 238.766 -4.27310e+00 -7.04639e+00 0.00000e+00 0.00000e+00 1.32991e+02 238.766 2.25886e+01 238.766 0.9372 
1 1 1 12  61  1  o 7  7.72569e+00 1.10854e+00 1.46765e+02 211.806 -1.10536e+01 -6.85521e+00 0.00000e+00 0.00000e+00 1.33936e+02 211.806 1.28291e+01 31.806  0.9608 
1 1 1 12  61  2  o 15 9.22655e+00 1.00519e+00 1.63863e+02 104.120 -4.61002e+00 1.83262e+01  0.00000e+00 0.00000e+00 1.75835e+02 104.120 1.19719e+01 104.120 0.9732 
1 1 1 12  61  3  o 16 4.66412e+00 1.22745e+00 8.22094e+01 84.820  3.81506e-01  4.20832e+00  0.00000e+00 0.00000e+00 7.16517e+01 84.820  1.05576e+01 264.820 0.8717 
1 1 1 12  61  4  o 3  4.07913e+00 1.17487e+00 9.21496e+01 178.205 -4.30101e+00 1.34756e-01  0.00000e+00 0.00000e+00 4.28478e+01 178.205 4.93019e+01 358.205 0.8742 
1 1 1 12  61  5  o 19 3.79797e+00 1.14890e+00 8.36561e+01 133.926 -2.77972e+00 2.88592e+00  0.00000e+00 0.00000e+00 4.05588e+01 133.926 4.30973e+01 313.926 0.8638 
1 1 1 12  61  6  o 19 8.25652e+00 1.30100e+00 1.90147e+02 15.767  1.87775e+01  5.30190e+00  0.00000e+00 0.00000e+00 1.14395e+02 15.767  7.57519e+01 195.767 0.9740 
1 1 1 12  61  7  o 4  1.10098e+01 1.26554e+00 1.90995e+02 127.719 -1.70214e+01 2.20078e+01  0.00000e+00 0.00000e+00 2.18402e+02 127.719 2.74072e+01 127.719 0.9819 
1 1 1 12  61  8  f 0  3.86950e+00 1.27019e+00 1.09676e+01 199.339 -5.10969e-01 -1.79335e-01 0.00000e+00 0.00000e+00 2.73257e+01 199.339 1.63581e+01 199.339 0.2613 
1 1 1 12  61  9  o 10 1.33081e+01 1.38988e+00 2.39819e+02 0.051   4.14343e+01  3.71721e-02  0.00000e+00 0.00000e+00 2.58060e+02 0.051   1.82411e+01 0.051   0.9879 
1 1 1 12  62  0  o 7  1.01914e+01 8.84503e-01 1.17047e+02 189.782 -1.49110e+01 -2.57074e+00 0.00000e+00 0.00000e+00 2.55175e+02 189.782 1.38128e+02 189.782 0.9664 
1 1 1 12  62  1  o 18 8.17889e+00 1.25889e+00 1.32848e+02 174.889 -1.15640e+01 1.03428e+00  0.00000e+00 0.00000e+00 1.62772e+02 174.889 2.99247e+01 174.889 0.9559 
1 1 1 12  62  2  o 6  8.17809e+00 1.10602e+00 1.99398e+02 347.480 1.81073e+01  -4.02097e+00 0.00000e+00 0.00000e+00 1.01488e+02 347.480 9.79102e+01 167.480 0.9727 
1 1 1 12  62  3  o 3  8.84759e+00 1.15344e+00 1.69879e+02 137.766 -1.30786e+01 1.18733e+01  0.00000e+00 0.00000e+00 1.55282e+02 137.766 1.45977e+01 317.766 0.9713 
1 1 1 12  62  4  o 19 3.98782e+00 1.17387e+00 5.12343e+01 283.663 6.01960e-01  -2.47630e+00 0.00000e+00 0.00000e+00 6.50092e+01 283.663 1.37748e+01 283.663 0.7702 
1 1 1 12  62  5  o 3  8.57403e+00 1.19847e+00 1.42557e+02 18.040  1.43292e+01  4.66679e+00  0.00000e+00 0.00000e+00 1.71065e+02 18.040  2.85078e+01 18.040  0.9662 
1 1 1 12  62  6  o 8  9.96198e+00 1.30872e+00 1.22314e+02 151.788 -1.34903e+01 7.23704e+00  0.00000e+00 0.00000e+00 2.42334e+02 151.788 1.20020e+02 151.788 0.9668 
1 1 1 12  62  7  o 15 4.06945e+00 1.24055e+00 1.49022e+02 52.007  4.79711e+00  6.14153e+00  0.00000e+00 0.00000e+00 5.18647e+00 232.007 1.54209e+02 232.007 0.9334 
1 1 1 12  62  8  o 8  4.77166e+00 1.41197e+00 1.23643e+02 50.719  4.64701e+00  5.68144e+00  0.00000e+00 0.00000e+00 4.42403e+01 50.719  7.94024e+01 230.719 0.9291 
1 1 1 12  62  9  o 10 7.86990e+00 1.70988e+00 1.28844e+02 161.113 -1.00893e+01 3.45169e+00  0.00000e+00 0.00000e+00 1.54814e+02 161.113 2.59698e+01 161.113 0.9519 
1 1 1 12  63  0  o 5  1.33979e+01 7.86527e-01 2.70809e+02 212.181 -4.22557e+01 -2.65901e+01 0.00000e+00 0.00000e+00 2.30370e+02 212.181 4.04390e+01 32.181  0.9899 
1 1 1 12  63  1  o 19 8.73846e+00 1.01838e+00 1.55700e+02 74.079  4.42347e+00  1.55068e+01  0.00000e+00 0.00000e+00 1.64242e+02 74.079  8.54202e+00 74.079  0.9685 
1 1 1 12  63  2  o 12 1.06791e+01 9.23572e-01 9.83824e+01 303.406 7.77631e+00  -1.17908e+01 0.00000e+00 0.00000e+00 2.90924e+02 303.406 1.92542e+02 303.406 0.9639 
1 1 1 12  63  3  o 4  1.07267e+01 1.03901e+00 1.71617e+02 89.307  2.72813e-01  2.25454e+01  0.00000e+00 0.00000e+00 2.25091e+02 89.307  5.34737e+01 89.307  0.9776 
1 1 1 12  63  4  o 1  7.68668e+00 1.29169e+00 1.85547e+02 8.412   1.65290e+01  2.44444e+00  0.00000e+00 0.00000e+00 9.64910e+01 8.412   8.90561e+01 188.412 0.9696 
1 1 1 12  63  5  o 18 3.51395e+00 1.11938e+00 7.08309e+01 124.843 -1.89400e+00 2.72074e+00  0.00000e+00 0.00000e+00 3.96721e+01 124.843 3.11588e+01 304.843 0.8308 
1 1 1 12  63  6  o 11 3.86640e+00 1.20219e+00 8.31378e+01 272.082 1.48841e-01  -4.09422e+00 0.00000e+00 0.00000e+00 4.37827e+01 272.082 3.93552e+01 92.082  0.8671 
1 1 1 12  63  7  o 16 4.29078e+00 1.31349e+00 6.33628e+01 340.607 3.46703e+00  -1.22043e+00 0.00000e+00 0.00000e+00 7.46786e+01 340.607 1.13157e+01 340.607 0.8498 
1 1 1 12  63  8  o 13 1.07315e+01 1.41789e+00 1.74621e+02 102.248 -5.06212e+00 2.33195e+01  0.00000e+00 0.00000e+00 2.23067e+02 102.248 4.84458e+01 102.248 0.9788 
1 1 1 12  63  9  o 9  4.06962e+00 1.32585e+00 8.75397e+01 307.187 3.08509e+00  -4.06635e+00 0.00000e+00 0.00000e+00 5.04679e+01 307.187 3.70718e+01 127.187 0.8957 
1 1 1 12  64  0  o 19 4.85377e+00 1.06157e+00 1.00050e+02 251.447 -1.79285e+00 -5.34181e+00 0.00000e+00 0.00000e+00 6.61446e+01 251.447 3.39049e+01 71.447  0.9063 
1 1 1 12  64  1  o 2  4.51500e+00 1.16074e+00 1.14611e+02 99.646  -9.87572e-01 5.81037e+00  0.00000e+00 0.00000e+00 4.08033e+01 99.646  7.38078e+01 279.646 0.9107 
1 1 1 12  64  2  o 13 6.78659e+00 1.21850e+00 1.99487e+02 245.853 -6.28735e+00 -1.40248e+01 0.00000e+00 0.00000e+00 4.86404e+01 245.853 1.50846e+02 65.853  0.9669 
1 1 1 12  64  3  o 18 3.52182e+00 1.06707e+00 1.18310e+02 294.237 2.26144e+00  -5.02325e+00 0.00000e+00 0.00000e+00 2.11400e+00 294.237 1.16196e+02 114.237 0.9040 
1 1 1 12  64  4  o 9  3.70189e+00 1.12421e+00 9.78418e+01 302.651 2.50963e+00  -3.91645e+00 0.00000e+00 0.00000e+00 2.60615e+01 302.651 7.17803e+01 122.651 0.8846 
1 1 1 12  64  5  o 13 1.02274e+01 1.15367e+00 1.77908e+02 222.986 -1.80856e+01 -1.68566e+01 0.00000e+00 0.00000e+00 2.01222e+02 222.986 2.33133e+01 222.986 0.9796 
1 1 1 12  64  6  o 17 9.80600e+00 1.26090e+00 2.22296e+02 329.916 2.46208e+01  -1.42628e+01 0.00000e+00 0.00000e+00 1.42272e+02 329.916 8.00241e+01 149.916 0.9823 
1 1 1 12  64  7  o 3  7.37773e+00 1.53620e+00 2.18289e+02 81.098  2.78668e+00  1.77911e+01  0.00000e+00 0.00000e+00 5.31082e+01 81.098  1.65181e+02 261.098 0.9718 
1 1 1 12  64  8  o 8  1.16368e+01 1.35998e+00 1.45936e+02 232.352 -1.28719e+01 -1.66854e+01 0.00000e+00 0.00000e+00 2.83973e+02 232.352 1.38036e+02 232.352 0.9760 
1 1 1 12  64  9  o 9  6.90481e+00 1.66528e+00 1.42897e+02 32.601  9.28920e+00  5.94103e+00  0.00000e+00 0.00000e+00 1.06315e+02 32.601  3.65817e+01 212.601 0.9535 
1 1 1 12  65  0  o 6  6.51963e+00 1.10246e+00 1.49751e+02 126.051 -7.06635e+00 9.70776e+00  0.00000e+00 0.00000e+00 8.60344e+01 126.051 6.37164e+01 306.051 0.9574 
1 1 1 12  65  1  o 1  1.15536e+01 8.58120e-01 1.68392e+02 316.326 1.90321e+01  -1.81710e+01 0.00000e+00 0.00000e+00 2.59856e+02 316.326 9.14633e+01 316.326 0.9808 
1 1 1 12  65  2  o 5  6.09727e+00 1.19373e+00 1.05571e+02 359.765 8.10049e+00  -3.32601e-02 0.00000e+00 0.00000e+00 1.10208e+02 359.765 4.63743e+00 359.765 0.9361 
1 1 1 12  65  3  o 13 6.64140e+00 1.24984e+00 1.45200e+02 262.739 -1.46251e+00 -1.14792e+01 0.00000e+00 0.00000e+00 9.48594e+01 262.739 5.03402e+01 82.739  0.9558 
1 1 1 12  65  4  o 5  8.73751e+00 1.18931e+00 1.40603e+02 250.069 -5.18321e+00 -1.42941e+01 0.00000e+00 0.00000e+00 1.78867e+02 250.069 3.82633e+01 250.069 0.9665 
1 1 1 12  65  5  o 11 1.36848e+01 9.69133e-01 2.30219e+02 185.670 -4.40347e+01 -4.37216e+00 0.00000e+00 0.00000e+00 2.81686e+02 185.670 5.14674e+01 185.670 0.9886 
1 1 1 12  65  6  o 2  4.46382e+00 1.21211e+00 1.45197e+02 134.059 -6.16297e+00 6.36888e+00  0.00000e+00 0.00000e+00 1.38878e+01 134.059 1.31310e+02 314.059 0.9418 
1 1 1 12  65  7  o 19 8.41282e+00 1.46765e+00 1.46725e+02 55.155  7.96294e+00  1.14382e+01  0.00000e+00 0.00000e+00 1.60020e+02 55.155  1.32955e+01 55.155  0.9634 
1 1 1 12  65  8  o 4  7.43196e+00 1.54282e+00 1.00632e+02 220.597 -6.57868e+00 -5.63807e+00 0.00000e+00 0.00000e+00 1.63875e+02 220.597 6.32434e+01 220.597 0.9404 
1 1 1 12  65  9  o 15 3.64490e+00 1.22586e+00 7.90427e+01 114.434 -1.92575e+00 4.23852e+00  0.00000e+00 0.00000e+00 4.29990e+01 114.434 3.60437e+01 294.434 0.8847 
1 1 1 12  66  0  o 8  3.72244e+00 1.08005e+00 6.07264e+01 324.183 2.23126e+00  -1.61022e+00 0.00000e+00 0.00000e+00 5.03099e+01 324.183 1.04165e+01 144.183 0.7898 
1 1 1 12  66  1  o 7  6.67895e+00 1.12802e+00 8.86025e+01 220.529 -5.26807e+00 -4.50393e+00 0.00000e+00 0.00000e+00 1.44770e+02 220.529 5.61673e+01 220.529 0.9248 
1 1 1 12  66  2  o 13 5.91761e+00 1.21795e+00 1.21782e+02 182.740 -8.75360e+00 -4.19005e-01 0.00000e+00 0.00000e+00 8.87225e+01 182.740 3.30599e+01 2.740   0.9411 
1 1 1 12  66  3  o 16 3.78146e+00 1.09064e+00 7.09633e+01 262.304 -4.70007e-01 -3.47813e+00 0.00000e+00 0.00000e+00 4.93739e+01 262.304 2.15895e+01 82.304  0.8416 
1 1 1 12  66  4  o 10 6.67230e+00 1.17670e+00 1.11824e+02 234.615 -5.26284e+00 -7.40953e+00 0.00000e+00 0.00000e+00 1.26220e+02 234.615 1.43955e+01 234.615 0.9433 
1 1 1 12  66  5  o 19 3.84725e+00 1.18329e+00 6.26381e+01 60.331  1.53714e+00  2.69831e+00  0.00000e+00 0.00000e+00 5.63402e+01 60.331  6.29793e+00 240.331 0.8175 
1 1 1 12  66  6  o 6  3.96777e+00 1.19502e+00 5.43736e+01 314.167 2.12221e+00  -2.18481e+00 0.00000e+00 0.00000e+00 6.77243e+01 314.167 1.33507e+01 314.167 0.8133 
1 1 1 12  66  7  o 12 1.41774e+01 1.18529e+00 1.66279e+02 275.190 3.08089e+00  -3.39161e+01 0.00000e+00 0.00000e+00 3.62245e+02 275.190 1.95966e+02 275.190 0.9852 
1 1 1 12  66  8  o 10 1.59408e+01 1.18377e+00 2.57489e+02 191.965 -5.98783e+01 -1.26897e+01 0.00000e+00 0.00000e+00 3.40762e+02 191.965 8.32737e+01 191.965 0.9918 
1 1 1 12  66  9  o 10 5.10125e+00 1.53617e+00 3.69389e+01 101.227 -4.54753e-01 2.29103e+00  0.00000e+00 0.00000e+00 1.07034e+02 101.227 7.00953e+01 101.227 0.7459 
1 1 1 12  67  0  o 2  7.80306e+00 1.46526e+00 1.33893e+02 287.395 3.35314e+00  -1.07029e+01 0.00000e+00 0.00000e+00 1.47297e+02 287.395 1.34040e+01 287.395 0.9543 
1 1 1 12  67  1  o 18 1.07439e+01 8.94467e-01 1.12017e+02 147.267 -1.46040e+01 9.38759e+00  0.00000e+00 0.00000e+00 2.81996e+02 147.267 1.69978e+02 147.267 0.9708 
1 1 1 12  67  2  o 7  4.52466e+00 1.17934e+00 4.94071e+01 276.291 3.03897e-01  -2.75643e+00 0.00000e+00 0.00000e+00 8.59736e+01 276.291 3.65665e+01 276.291 0.7917 
1 1 1 12  67  3  o 9  8.06423e+00 1.13454e+00 1.17460e+02 342.565 1.15286e+01  -3.62053e+00 0.00000e+00 0.00000e+00 1.74508e+02 342.565 5.70479e+01 342.565 0.9577 
1 1 1 12  67  4  o 1  1.48709e+01 9.22949e-01 2.73391e+02 176.698 -6.28070e+01 3.62332e+00  0.00000e+00 0.00000e+00 2.84468e+02 176.698 1.10766e+01 176.698 0.9920 
1 1 1 12  67  5  o 4  7.39171e+00 1.29733e+00 4.69074e+01 100.959 -8.42521e-01 4.35088e+00  0.00000e+00 0.00000e+00 1.98643e+02 100.959 1.51736e+02 100.959 0.8783 
1 1 1 12  67  6  o 9  4.68146e+00 1.31485e+00 9.62366e+01 225.306 -4.27619e+00 -4.32214e+00 0.00000e+00 0.00000e+00 6.55536e+01 225.306 3.06831e+01 45.306  0.9136 
1 1 1 12  67  7  o 11 7.38556e+00 1.62506e+00 1.34838e+02 311.841 7.34466e+00  -8.20264e+00 0.00000e+00 0.00000e+00 1.31565e+02 311.841 3.27241e+00 131.841 0.9534 
1 1 1 12  67  8  o 17 1.01541e+01 1.58204e+00 2.06026e+02 74.240  6.58838e+00  2.33453e+01  0.00000e+00 0.00000e+00 1.70132e+02 74.240  3.58943e+01 254.240 0.9792 
1 1 1 12  67  9  o 9  5.18628e+00 1.51695e+00 3.79175e+01 107.989 -7.95280e-01 2.44916e+00  0.00000e+00 0.00000e+00 1.13734e+02 107.989 7.58161e+01 107.989 0.7729 
1 1 1 12  68  0  o 11 5.24571e+00 1.19836e+00 7.89176e+01 214.021 -4.23983e+00 -2.86202e+00 0.00000e+00 0.00000e+00 9.85290e+01 214.021 1.96114e+01 214.021 0.8960 
1 1 1 12  68  1  o 17 7.86842e+00 1.11728e+00 1.34162e+02 177.034 -1.35295e+01 7.00977e-01  0.00000e+00 0.00000e+00 1.51847e+02 177.034 1.76850e+01 177.034 0.9624 
1 1 1 12  68  2  o 5  1.21053e+01 8.93153e-01 2.44084e+02 60.428  2.10833e+01  3.71554e+01  0.00000e+00 0.00000e+00 2.07936e+02 60.428  3.61482e+01 240.428 0.9882 
1 1 1 12  68  3  o 12 5.30876e+00 1.25630e+00 9.74557e+01 269.057 -9.93175e-02 -6.03162e+00 0.00000e+00 0.00000e+00 8.57198e+01 269.057 1.17359e+01 89.057  0.9129 
1 1 1 12  68  4  o 9  4.13526e+00 1.13691e+00 4.98942e+01 179.439 -2.87653e+00 2.81482e-02  0.00000e+00 0.00000e+00 7.52519e+01 179.439 2.53577e+01 179.439 0.8004 
1 1 1 12  68  5  o 4  8.00225e+00 1.29462e+00 1.00539e+02 280.389 1.88286e+00  -1.02703e+01 0.00000e+00 0.00000e+00 1.87198e+02 280.389 8.66598e+01 280.389 0.9508 
1 1 1 12  68  6  o 10 3.93108e+00 1.20528e+00 4.32227e+01 219.969 -1.83328e+00 -1.53663e+00 0.00000e+00 0.00000e+00 6.86939e+01 219.969 2.54712e+01 219.969 0.7527 
1 1 1 12  68  7  o 1  4.60640e+00 1.47036e+00 3.31040e+01 134.182 -1.22861e+00 1.26420e+00  0.00000e+00 0.00000e+00 8.09740e+01 134.182 4.78700e+01 134.182 0.6547 
1 1 1 12  68  8  o 2  6.57542e+00 1.63543e+00 1.13956e+02 117.569 -3.96212e+00 7.58877e+00  0.00000e+00 0.00000e+00 1.19753e+02 117.569 5.79776e+00 117.569 0.9396 
1 1 1 12  68  9  o 1  4.58757e+00 1.44475e+00 1.10023e+02 203.476 -6.38579e+00 -2.77350e+00 0.00000e+00 0.00000e+00 5.05044e+01 203.476 5.95184e+01 23.476  0.9251 
1 1 1 12  69  0  o 6  8.62888e+00 1.04858e+00 1.23100e+02 28.119  1.24578e+01  6.65712e+00  0.00000e+00 0.00000e+00 1.90861e+02 28.119  6.77609e+01 28.119  0.9639 
1 1 1 12  69  1  f 0  9.96027e+00 9.68688e-01 2.10853e+02 52.945  1.76195e+01  2.33350e+01  0.00000e+00 0.00000e+00 1.58794e+02 52.945  5.20587e+01 232.945 0.9827 
1 1 1 12  69  2  o 19 4.45549e+00 1.19521e+00 1.31306e+02 172.673 -7.40090e+00 9.51557e-01  0.00000e+00 0.00000e+00 2.52928e+01 172.673 1.06013e+02 352.673 0.9304 
1 1 1 12  69  3  o 14 7.72431e+00 1.19595e+00 1.56161e+02 193.908 -1.54936e+01 -3.83669e+00 0.00000e+00 0.00000e+00 1.26451e+02 193.908 2.97095e+01 13.908  0.9681 
1 1 1 12  69  4  o 4  5.71790e+00 1.31927e+00 1.78522e+02 25.915  1.15851e+01  5.62923e+00  0.00000e+00 0.00000e+00 2.90537e+01 25.915  1.49468e+02 205.915 0.9604 
1 1 1 12  69  5  o 16 5.73489e+00 1.37739e+00 9.37046e+01 271.807 2.12553e-01  -6.73789e+00 0.00000e+00 0.00000e+00 1.06327e+02 271.807 1.26223e+01 271.807 0.9225 
1 1 1 12  69  6  o 11 1.23755e+01 1.16049e+00 1.92356e+02 201.340 -3.01930e+01 -1.17958e+01 0.00000e+00 0.00000e+00 2.68343e+02 201.340 7.59872e+01 201.340 0.9845 
1 1 1 12  69  7  o 7  4.84050e+00 1.50297e+00 1.10031e+02 27.279  5.63317e+00  2.90494e+00  0.00000e+00 0.00000e+00 5.78895e+01 27.279  5.21419e+01 207.279 0.9173 
1 1 1 12  69  8  o 9  5.30911e+00 1.47975e+00 1.26937e+02 203.933 -7.96540e+00 -3.53527e+00 0.00000e+00 0.00000e+00 6.19502e+01 203.933 6.49865e+01 23.933  0.9407 
1 1 1 12  69  9  o 9  3.78568e+00 1.24470e+00 8.91035e+01 112.892 -2.06932e+00 4.90077e+00  0.00000e+00 0.00000e+00 3.97887e+01 112.892 4.93148e+01 292.892 0.9003 
1 1 1 12  70  0  o 18 6.74222e+00 1.20275e+00 1.24338e+02 87.822  3.91506e-01  1.02934e+01  0.00000e+00 0.00000e+00 1.17424e+02 87.822  6.91381e+00 267.822 0.9501 
1 1 1 12  70  1  o 9  6.50208e+00 1.11971e+00 8.47038e+01 117.549 -3.39156e+00 6.50156e+00  0.00000e+00 0.00000e+00 1.43380e+02 117.549 5.86759e+01 117.549 0.9291 
1 1 1 12  70  2  o 16 9.62471e+00 1.02538e+00 2.20034e+02 307.183 1.87297e+01  -2.46905e+01 0.00000e+00 0.00000e+00 1.37589e+02 307.183 8.24453e+01 127.183 0.9837 
1 1 1 12  70  3  o 14 1.37568e+01 9.39479e-01 2.26978e+02 37.897  3.85027e+01  2.99704e+01  0.00000e+00 0.00000e+00 2.87451e+02 37.897  6.04731e+01 37.897  0.9897 
1 1 1 12  70  4  o 12 5.87772e+00 1.36108e+00 1.58607e+02 185.881 -1.13517e+01 -1.16930e+00 0.00000e+00 0.00000e+00 5.35672e+01 185.881 1.05040e+02 5.881   0.9551 
1 1 1 12  70  5  o 4  8.29447e+00 1.25565e+00 9.62197e+01 240.293 -5.55185e+00 -9.73056e+00 0.00000e+00 0.00000e+00 2.02988e+02 240.293 1.06768e+02 240.293 0.9543 
1 1 1 12  70  6  f 0  4.19109e+00 1.22815e+00 1.03606e+02 20.830  5.63280e+00  2.14308e+00  0.00000e+00 0.00000e+00 4.10266e+01 20.830  6.25795e+01 200.830 0.9128 
1 1 1 12  70  7  o 6  5.32558e+00 1.56589e+00 8.52327e+01 280.239 9.37542e-01  -5.19043e+00 0.00000e+00 0.00000e+00 9.58699e+01 280.239 1.06372e+01 280.239 0.8994 
1 1 1 12  70  8  o 5  3.88549e+00 1.25154e+00 4.66120e+01 250.177 -9.36142e-01 -2.59697e+00 0.00000e+00 0.00000e+00 6.95400e+01 250.177 2.29280e+01 250.177 0.7906 
1 1 1 12  70  9  o 9  6.89353e+00 1.71728e+00 1.23992e+02 165.675 -9.54787e+00 2.43813e+00  0.00000e+00 0.00000e+00 1.23053e+02 165.675 9.38964e-01 345.675 0.9478 
1 1 1 12  71  0  o 7  5.78316e+00 1.13771e+00 1.04924e+02 327.895 6.76603e+00  -4.24511e+00 0.00000e+00 0.00000e+00 9.91308e+01 327.895 5.79362e+00 147.895 0.9351 
1 1 1 12  71  1  o 15 4.49141e+00 1.07187e+00 1.44708e+02 3.934   8.33581e+00  5.73239e-01  0.00000e+00 0.00000e+00 1.43437e+01 3.934   1.30364e+02 183.934 0.9381 
1 1 1 12  71  2  o 17 3.36879e+00 1.03787e+00 7.90244e+01 103.377 -8.33937e-01 3.50683e+00  0.00000e+00 0.00000e+00 2.86520e+01 103.377 5.03724e+01 283.377 0.8464 
1 1 1 12  71  3  o 16 1.21572e+01 9.33018e-01 1.81740e+02 64.779  1.49836e+01  3.18114e+01  0.00000e+00 0.00000e+00 2.70938e+02 64.779  8.91983e+01 64.779  0.9857 
1 1 1 12  71  4  o 17 1.14642e+01 1.05710e+00 2.57391e+02 253.757 -1.18109e+01 -4.05397e+01 0.00000e+00 0.00000e+00 1.70640e+02 253.757 8.67515e+01 73.757  0.9881 
1 1 1 12  71  5  o 2  1.07871e+01 1.15342e+00 1.69111e+02 21.413  2.47024e+01  9.68707e+00  0.00000e+00 0.00000e+00 2.30824e+02 21.413  6.17127e+01 21.413  0.9810 
1 1 1 12  71  6  o 12 7.85853e+00 1.42361e+00 1.70782e+02 195.384 -1.54290e+01 -4.24536e+00 0.00000e+00 0.00000e+00 1.16835e+02 195.384 5.39472e+01 15.385  0.9682 
1 1 1 12  71  7  f 0  4.89956e+00 1.41800e+00 9.02046e+01 284.150 1.40382e+00  -5.56823e+00 0.00000e+00 0.00000e+00 7.80053e+01 284.150 1.21993e+01 104.150 0.9082 
1 1 1 12  71  8  o 11 4.86145e+00 1.36874e+00 4.43907e+01 110.955 -1.07327e+00 2.80247e+00  0.00000e+00 0.00000e+00 1.04485e+02 110.955 6.00940e+01 110.955 0.8101 
1 1 1 12  71  9  o 8  5.62561e+00 1.43851e+00 2.67614e+01 7.057   2.12923e+00  2.63577e-01  0.00000e+00 0.00000e+00 1.26416e+02 7.057   9.96544e+01 7.057   0.7203 
1 1 1 12  72  0  o 10 4.63707e+00 1.13469e+00 5.66075e+01 28.915  3.15232e+00  1.74124e+00  0.00000e+00 0.00000e+00 9.14237e+01 28.915  3.48161e+01 28.915  0.8462 
1 1 1 12  72  1  o 11 3.67409e+00 1.05659e+00 2.52465e+01 244.167 -5.41769e-01 -1.11908e+00 0.00000e+00 0.00000e+00 4.76917e+01 244.167 2.24452e+01 244.167 0.5260 
1 1 1 12  72  2  o 5  6.36718e+00 1.16896e+00 1.67244e+02 164.103 -1.32975e+01 3.78721e+00  0.00000e+00 0.00000e+00 6.42952e+01 164.103 1.02949e+02 344.103 0.9631 
1 1 1 12  72  3  o 17 9.17920e+00 1.15089e+00 1.32636e+02 321.646 1.33080e+01  -1.05304e+01 0.00000e+00 0.00000e+00 2.03679e+02 321.646 7.10430e+01 321.646 0.9701 
1 1 1 12  72  4  o 16 3.87262e+00 1.16592e+00 5.40277e+01 82.443  4.10190e-01  3.09175e+00  0.00000e+00 0.00000e+00 6.57083e+01 82.443  1.16806e+01 82.443  0.8184 
1 1 1 12  72  5  o 1  7.96934e+00 1.37651e+00 1.46280e+02 23.875  1.35891e+01  6.01476e+00  0.00000e+00 0.00000e+00 1.44543e+02 23.875  1.73677e+00 203.875 0.9657 
1 1 1 12  72  6  o 15 1.33177e+01 1.14843e+00 1.97589e+02 235.755 -2.19934e+01 -3.23079e+01 0.00000e+00 0.00000e+00 2.99242e+02 235.755 1.01652e+02 235.755 0.9871 
1 1 1 12  72  7  o 14 3.53831e+00 1.16520e+00 3.56785e+01 52.301  1.23186e+00  1.59392e+00  0.00000e+00 0.00000e+00 5.79533e+01 52.301  2.22748e+01 52.301  0.7001 
1 1 1 12  72  8  o 4  6.53514e+00 1.53742e+00 8.16529e+01 205.620 -6.16619e+00 -2.95696e+00 0.00000e+00 0.00000e+00 1.46505e+02 205.620 6.48516e+01 205.620 0.9237 
1 1 1 12  72  9  o 12 4.92399e+00 1.48259e+00 6.53867e+01 129.274 -2.96697e+00 3.62825e+00  0.00000e+00 0.00000e+00 9.94237e+01 129.274 3.40370e+01 129.274 0.8856 
1 1 1 12  73  0  o 16 9.45955e+00 9.30190e-01 1.72160e+02 249.670 -8.88218e+00 -2.39725e+01 0.00000e+00 0.00000e+00 1.77578e+02 249.670 5.41748e+00 249.670 0.9802 
1 1 1 12  73  1  o 19 5.86880e+00 1.13020e+00 7.46707e+01 229.615 -3.76840e+00 -4.43015e+00 0.00000e+00 0.00000e+00 1.26721e+02 229.615 5.20505e+01 229.615 0.9094 
1 1 1 12  73  2  o 10 4.60519e+00 1.20558e+00 9.44195e+01 277.033 7.18599e-01  -5.82481e+00 0.00000e+00 0.00000e+00 6.38237e+01 277.033 3.05958e+01 97.033  0.9103 
1 1 1 12  73  3  o 10 1.17754e+01 9.91748e-01 1.69576e+02 340.360 2.79053e+01  -9.95878e+00 0.00000e+00 0.00000e+00 2.67511e+02 340.360 9.79349e+01 340.360 0.9830 
1 1 1 12  73  4  o 19 6.94591e+00 1.33376e+00 1.37749e+02 167.069 -1.18802e+01 2.72766e+00  0.00000e+00 0.00000e+00 1.13607e+02 167.069 2.41423e+01 347.069 0.9581 
1 1 1 12  73  5  o 4  5.96567e+00 1.39594e+00 5.37945e+01 140.718 -3.08916e+00 2.52686e+00  0.00000e+00 0.00000e+00 1.40748e+02 140.718 8.69538e+01 140.718 0.8632 
1 1 1 12  73  6  o 10 4.20738e+00 1.25196e+00 8.10168e+01 21.489  4.51910e+00  1.77910e+00  0.00000e+00 0.00000e+00 6.04645e+01 21.489  2.05523e+01 201.489 0.8900 
1 1 1 12  73  7  o 18 5.15899e+00 1.41888e+00 1.37173e+02 209.947 -8.57400e+00 -4.93956e+00 0.00000e+00 0.00000e+00 4.76473e+01 209.947 8.95256e+01 29.947  0.9480 
1 1 1 12  73  8  o 10 5.19061e+00 1.48696e+00 7.25220e+01 28.756  4.34879e+00  2.38639e+00  0.00000e+00 0.00000e+00 1.02534e+02 28.756  3.00121e+01 28.756  0.8925 
1 1 1 12  73  9  o 13 4.66099e+00 1.49766e+00 5.22616e+01 45.820  2.50204e+00  2.57472e+00  0.00000e+00 0.00000e+00 9.66875e+01 45.820  4.44260e+01 45.820  0.8457 
1 1 1 12  74  0  o 6  6.65058e+00 1.08106e+00 1.48041e+02 296.366 6.38338e+00  -1.28783e+01 0.00000e+00 0.00000e+00 9.38621e+01 296.366 5.41784e+01 116.366 0.9646 
1 1 1 12  74  1  o 13 3.83252e+00 1.09645e+00 6.99181e+01 53.955  2.27332e+00  3.12376e+00  0.00000e+00 0.00000e+00 5.41468e+01 53.955  1.57713e+01 233.955 0.8581 
1 1 1 12  74  2  o 17 2.97724e+00 9.69249e-01 6.51574e+01 133.485 -2.11194e+00 2.22668e+00  0.00000e+00 0.00000e+00 2.64153e+01 133.485 3.87421e+01 313.485 0.8150 
1 1 1 12  74  3  o 3  6.74780e+00 1.26678e+00 9.10500e+01 353.354 8.50591e+00  -9.91065e-01 0.00000e+00 0.00000e+00 1.48334e+02 353.354 5.72839e+01 353.354 0.9397 
1 1 1 12  74  4  o 7  5.62900e+00 1.39267e+00 1.10973e+02 162.155 -7.02724e+00 2.26234e+00  0.00000e+00 0.00000e+00 8.66300e+01 162.155 2.43428e+01 342.155 0.9296 
1 1 1 12  74  5  o 9  8.31585e+00 1.36962e+00 1.42054e+02 296.747 6.55700e+00  -1.30107e+01 0.00000e+00 0.00000e+00 1.61074e+02 296.747 1.90198e+01 296.747 0.9650 
1 1 1 12  74  6  o 2  4.56113e+00 1.31005e+00 1.03515e+02 133.480 -4.55254e+00 4.80069e+00  0.00000e+00 0.00000e+00 5.51777e+01 133.480 4.83369e+01 313.480 0.9210 
1 1 1 12  74  7  o 2  4.25278e+00 1.27342e+00 7.45699e+01 140.336 -3.65925e+00 3.03405e+00  0.00000e+00 0.00000e+00 6.80014e+01 140.336 6.56851e+00 320.336 0.8873 
1 1 1 12  74  8  o 9  3.32668e+00 1.12192e+00 5.01315e+01 347.949 2.97782e+00  -6.35706e-01 0.00000e+00 0.00000e+00 5.20847e+01 347.949 1.95315e+00 347.949 0.8133 
1 1 1 12  74  9  o 4  4.82282e+00 1.55471e+00 4.55179e+01 205.774 -2.75942e+00 -1.33240e+00 0.00000e+00 0.00000e+00 1.02914e+02 205.774 5.73959e+01 205.774 0.8146 
1 1 1 12  75  0  o 5  3.59270e+00 1.05494e+00 8.35385e+01 151.518 -3.89162e+00 2.11139e+00  0.00000e+00 0.00000e+00 3.54096e+01 151.518 4.81289e+01 331.518 0.8782 
1 1 1 12  75  1  o 14 9.99733e+00 9.43495e-01 1.83316e+02 219.601 -2.26660e+01 -1.87517e+01 0.00000e+00 0.00000e+00 1.87307e+02 219.601 3.99078e+00 219.601 0.9829 
1 1 1 12  75  2  f 0  3.83225e+00 1.06953e+00 3.76452e+01 195.333 -2.12167e+00 -5.81751e-01 0.00000e+00 0.00000e+00 6.76313e+01 195.333 2.99861e+01 195.333 0.7280 
1 1 1 12  75  3  o 10 5.65489e+00 1.26716e+00 6.19933e+01 39.573  3.65498e+00  3.02077e+00  0.00000e+00 0.00000e+00 1.27343e+02 39.573  6.53500e+01 39.573  0.8870 
1 1 1 12  75  4  o 10 2.99795e+00 9.73226e-01 4.12834e+01 258.861 -3.89065e-01 -1.97591e+00 0.00000e+00 0.00000e+00 3.79551e+01 258.861 3.32834e+00 78.861  0.7000 
1 1 1 12  75  5  o 12 6.39785e+00 1.45692e+00 8.36852e+01 39.875  5.04455e+00  4.21417e+00  0.00000e+00 0.00000e+00 1.38701e+02 39.875  5.50158e+01 39.875  0.9204 
1 1 1 12  75  6  o 5  7.75517e+00 1.43008e+00 1.23112e+02 148.028 -1.07095e+01 6.68464e+00  0.00000e+00 0.00000e+00 1.57948e+02 148.028 3.48364e+01 148.028 0.9595 
1 1 1 12  75  7  o 14 5.81769e+00 1.36128e+00 1.14842e+02 14.356  9.53176e+00  2.43955e+00  0.00000e+00 0.00000e+00 9.34245e+01 14.356  2.14172e+01 194.356 0.9477 
1 1 1 12  75  8  o 4  6.34713e+00 1.34914e+00 1.11660e+02 328.354 9.21838e+00  -5.68133e+00 0.00000e+00 0.00000e+00 1.16742e+02 328.354 5.08200e+00 328.354 0.9526 
1 1 1 12  75  9  o 8  3.85830e+00 1.32102e+00 2.96085e+01 324.286 1.55999e+00  -1.12153e+00 0.00000e+00 0.00000e+00 7.01375e+01 324.286 4.05290e+01 324.286 0.6844 
1 1 1 12  76  0  o 7  3.55550e+00 1.01832e+00 6.00051e+01 213.476 -2.59943e+00 -1.71899e+00 0.00000e+00 0.00000e+00 4.96559e+01 213.476 1.03492e+01 33.476  0.8182 
1 1 1 12  76  1  o 13 6.54997e+00 1.13090e+00 8.53888e+01 258.810 -1.59280e+00 -8.05195e+00 0.00000e+00 0.00000e+00 1.46042e+02 258.810 6.06535e+01 258.810 0.9369 
1 1 1 12  76  2  o 6  5.31024e+00 1.21009e+00 8.40439e+01 274.765 5.11195e-01  -6.13251e+00 0.00000e+00 0.00000e+00 9.91983e+01 274.765 1.51544e+01 274.765 0.9147 
1 1 1 12  76  3  o 9  4.77840e+00 1.22575e+00 1.33507e+02 298.748 4.01488e+00  -7.31890e+00 0.00000e+00 0.00000e+00 3.56495e+01 298.748 9.78571e+01 118.748 0.9380 
1 1 1 12  76  4  o 9  1.06603e+01 1.11858e+00 1.42301e+02 22.769  2.02034e+01  8.48002e+00  0.00000e+00 0.00000e+00 2.50818e+02 22.769  1.08517e+02 22.769  0.9769 
1 1 1 12  76  5  o 12 8.14615e+00 1.27957e+00 1.28270e+02 126.899 -8.87596e+00 1.18221e+01  0.00000e+00 0.00000e+00 1.68708e+02 126.899 4.04380e+01 126.899 0.9656 
1 1 1 12  76  6  o 3  7.80293e+00 1.41569e+00 1.15346e+02 10.003  1.20027e+01  2.11713e+00  0.00000e+00 0.00000e+00 1.66949e+02 10.003  5.16036e+01 10.003  0.9581 
1 1 1 12  76  7  f 0  3.66631e+00 1.18632e+00 6.84793e+01 75.629  1.04403e+00  4.07474e+00  0.00000e+00 0.00000e+00 5.21207e+01 75.629  1.63586e+01 255.629 0.8710 
1 1 1 12  76  8  o 4  3.99257e+00 1.27484e+00 4.05025e+01 18.368  2.65218e+00  8.80605e-01  0.00000e+00 0.00000e+00 7.91555e+01 18.368  3.86530e+01 18.368  0.7936 
1 1 1 12  76  9  o 12 5.13913e+00 1.55985e+00 1.34068e+02 151.007 -8.26705e+00 4.58121e+00  0.00000e+00 0.00000e+00 4.94370e+01 151.007 8.46313e+01 331.007 0.9455 
1 1 1 12  77  0  o 3  6.95618e+00 1.06789e+00 4.83742e+01 321.182 4.15990e+00  -3.34684e+00 0.00000e+00 0.00000e+00 1.87745e+02 321.182 1.39370e+02 321.182 0.9007 
1 1 1 12  77  1  o 5  3.07411e+00 9.76299e-01 6.41150e+01 205.263 -2.83361e+00 -1.33719e+00 0.00000e+00 0.00000e+00 3.08538e+01 205.263 3.32612e+01 25.263  0.8194 
1 1 1 12  77  2  o 1  6.07233e+00 1.26560e+00 5.92221e+01 158.308 -4.27308e+00 1.69976e+00  0.00000e+00 0.00000e+00 1.43054e+02 158.308 8.38319e+01 158.308 0.8832 
1 1 1 12  77  3  o 10 5.28333e+00 1.25808e+00 8.37394e+01 59.789  3.02878e+00  5.20170e+00  0.00000e+00 0.00000e+00 9.81921e+01 59.789  1.44527e+01 59.789  0.9127 
1 1 1 12  77  4  o 8  3.36375e+00 1.07134e+00 8.44851e+01 77.490  9.59880e-01  4.32614e+00  0.00000e+00 0.00000e+00 2.70125e+01 77.490  5.74726e+01 257.490 0.8783 
1 1 1 12  77  5  o 18 3.77248e+00 1.16026e+00 8.11137e+01 293.029 1.85738e+00  -4.36950e+00 0.00000e+00 0.00000e+00 4.52267e+01 293.029 3.58870e+01 113.029 0.8872 
1 1 1 12  77  6  o 1  1.22904e+01 1.16705e+00 2.04112e+02 65.969  1.65294e+01  3.70723e+01  0.00000e+00 0.00000e+00 2.54150e+02 65.969  5.00377e+01 65.969  0.9876 
1 1 1 12  77  7  o 9  7.52233e+00 1.56961e+00 1.53503e+02 252.600 -4.30750e+00 -1.37453e+01 0.00000e+00 0.00000e+00 1.20477e+02 252.600 3.30262e+01 72.600  0.9646 
1 1 1 12  77  8  o 8  4.74593e+00 1.40457e+00 9.47707e+01 33.290  5.99229e+00  3.93468e+00  0.00000e+00 0.00000e+00 7.14125e+01 33.290  2.33582e+01 213.290 0.9274 
1 1 1 12  78  0  o 1  4.37686e+00 1.11416e+00 9.18118e+01 306.821 3.58858e+00  -4.79322e+00 0.00000e+00 0.00000e+00 5.86157e+01 306.821 3.31961e+01 126.821 0.9122 
1 1 1 12  78  1  o 13 6.48558e+00 1.15533e+00 1.23954e+02 134.504 -7.69918e+00 7.83360e+00  0.00000e+00 0.00000e+00 1.09112e+02 134.504 1.48418e+01 314.504 0.9533 
1 1 1 12  78  2  o 10 3.30930e+00 9.89733e-01 5.04591e+01 257.946 -5.61869e-01 -2.63109e+00 0.00000e+00 0.00000e+00 4.74057e+01 257.946 3.05340e+00 77.946  0.7842 
1 1 1 12  78  3  o 11 5.78118e+00 1.27654e+00 1.19393e+02 263.825 -9.71339e-01 -8.97746e+00 0.00000e+00 0.00000e+00 8.62318e+01 263.825 3.31615e+01 83.825  0.9429 
1 1 1 12  78  4  o 3  1.29298e+01 9.96992e-01 2.10054e+02 3.544   4.56315e+01  2.82631e+00  0.00000e+00 0.00000e+00 2.72456e+02 3.544   6.24021e+01 3.544   0.9890 
1 1 1 12  78  5  o 10 4.40921e+00 1.25160e+00 9.96588e+01 8.259   6.52288e+00  9.46861e-01  0.00000e+00 0.00000e+00 5.35453e+01 8.259   4.61135e+01 188.259 0.9207 
1 1 1 12  78  6  o 16 4.97678e+00 1.21745e+00 1.30347e+02 150.347 -9.25749e+00 5.27036e+00  0.00000e+00 0.00000e+00 4.84594e+01 150.347 8.18880e+01 330.347 0.9518 
1 1 1 12  78  7  o 9  3.51678e+00 1.16157e+00 5.32244e+01 355.122 3.30202e+00  -2.81788e-01 0.00000e+00 0.00000e+00 5.70649e+01 355.122 3.84045e+00 355.122 0.8308 
1 1 1 12  78  8  o 4  3.48047e+00 1.14838e+00 1.99698e+01 323.727 1.10074e+00  -8.07786e-01 0.00000e+00 0.00000e+00 5.37444e+01 323.727 3.37747e+01 323.727 0.5610 
1 1 1 12  79  0  o 4  7.70605e+00 1.04771e+00 9.29598e+01 33.743  9.38759e+00  6.27091e+00  0.00000e+00 0.00000e+00 1.84156e+02 33.743  9.11964e+01 33.743  0.9546 
1 1 1 12  79  1  o 5  4.50907e+00 1.08449e+00 9.06318e+01 85.922  4.41711e-01  6.19532e+00  0.00000e+00 0.00000e+00 6.49457e+01 85.922  2.56862e+01 265.922 0.9155 
1 1 1 12  79  2  o 5  8.05755e+00 1.10187e+00 1.81875e+02 72.646  6.87368e+00  2.19956e+01  0.00000e+00 0.00000e+00 1.15243e+02 72.646  6.66323e+01 252.646 0.9781 
1 1 1 12  79  3  o 6  4.54932e+00 1.20571e+00 8.16831e+01 67.230  2.08909e+00  4.97697e+00  0.00000e+00 0.00000e+00 7.30524e+01 67.230  8.63066e+00 247.230 0.9019 
1 1 1 12  79  4  o 3  5.39373e+00 1.24681e+00 7.44416e+01 233.327 -3.50827e+00 -4.71137e+00 0.00000e+00 0.00000e+00 1.10794e+02 233.327 3.63525e+01 233.327 0.9104 
1 1 1 12  79  5  o 8  8.05651e+00 1.29086e+00 1.50086e+02 332.811 1.65422e+01  -8.49738e+00 0.00000e+00 0.00000e+00 1.45616e+02 332.811 4.46985e+00 152.811 0.9727 
1 1 1 12  79  6  o 13 4.87299e+00 1.34689e+00 1.18436e+02 229.887 -5.51977e+00 -6.55186e+00 0.00000e+00 0.00000e+00 5.43688e+01 229.887 6.40675e+01 49.887  0.9397 
1 1 1 12  79  7  o 13 7.41626e+00 1.43864e+00 1.03722e+02 160.857 -1.07896e+01 3.74534e+00  0.00000e+00 0.00000e+00 1.63628e+02 160.857 5.99055e+01 160.857 0.9552 
1 1 1 12  79  8  o 8  4.28851e+00 1.32492e+00 8.12989e+01 268.500 -1.55978e-01 -5.95558e+00 0.00000e+00 0.00000e+00 6.62659e+01 268.500 1.50330e+01 88.500  0.9117 
1 1 1 12  80  0  o 1  6.99123e+00 1.13133e+00 8.96209e+01 123.150 -5.29052e+00 8.10005e+00  0.00000e+00 0.00000e+00 1.59678e+02 123.150 7.00572e+01 123.150 0.9468 
1 1 1 12  80  1  o 17 1.53025e+01 8.21409e-01 2.45294e+02 195.315 -6.19948e+01 -1.69779e+01 0.00000e+00 0.00000e+00 3.26783e+02 195.315 8.14891e+01 195.315 0.9922 
1 1 1 12  80  2  o 8  7.54616e+00 1.13312e+00 1.40124e+02 30.472  1.36631e+01  8.03910e+00  0.00000e+00 0.00000e+00 1.35196e+02 30.472  4.92778e+00 210.472 0.9679 
1 1 1 12  80  3  o 16 6.19580e+00 1.22106e+00 7.34250e+01 127.155 -4.04358e+00 5.33594e+00  0.00000e+00 0.00000e+00 1.41963e+02 127.155 6.85377e+01 127.155 0.9220 
1 1 1 12  80  4  o 10 8.05884e+00 1.20820e+00 1.63193e+02 302.342 1.08862e+01  -1.71921e+01 0.00000e+00 0.00000e+00 1.33192e+02 302.342 3.00011e+01 122.342 0.9751 
1 1 1 12  80  5  o 14 4.74851e+00 1.30124e+00 7.08953e+01 253.054 -1.43313e+00 -4.70346e+00 0.00000e+00 0.00000e+00 8.87880e+01 253.054 1.78926e+01 253.054 0.8914 
1 1 1 12  80  6  o 1  7.84897e+00 1.48565e+00 1.92923e+02 62.852  9.17295e+00  1.78889e+01  0.00000e+00 0.00000e+00 9.57543e+01 62.852  9.71690e+01 242.852 0.9748 
1 1 1 12  80  7  o 4  5.02819e+00 1.36066e+00 1.17957e+02 205.038 -8.86815e+00 -4.14243e+00 0.00000e+00 0.00000e+00 6.18019e+01 205.038 5.61548e+01 25.038  0.9475 
1 1 1 12  80  8  o 1  4.98475e+00 1.45758e+00 4.26743e+01 0.725   3.21892e+00  4.07281e-02  0.00000e+00 0.00000e+00 1.12497e+02 0.725   6.98231e+01 0.725   0.8250 
1 1 1 12  81  0  o 5  6.74968e+00 1.13302e+00 1.16624e+02 172.182 -1.11391e+01 1.52943e+00  0.00000e+00 0.00000e+00 1.25945e+02 172.182 9.32153e+00 172.182 0.9544 
1 1 1 12  81  1  o 11 4.22568e+00 1.07635e+00 5.83373e+01 333.026 3.41309e+00  -1.73710e+00 0.00000e+00 0.00000e+00 7.80257e+01 333.026 1.96884e+01 333.026 0.8566 
1 1 1 12  81  2  o 5  8.40299e+00 1.13655e+00 1.52823e+02 68.678  7.18050e+00  1.83959e+01  0.00000e+00 0.00000e+00 1.55721e+02 68.678  2.89804e+00 68.678  0.9743 
1 1 1 12  81  3  o 9  8.22595e+00 1.15247e+00 1.44908e+02 274.772 1.60723e+00  -1.92525e+01 0.00000e+00 0.00000e+00 1.57057e+02 274.772 1.21484e+01 274.772 0.9738 
1 1 1 12  81  4  o 8  4.16196e+00 1.18327e+00 1.88238e+01 23.882  1.19433e+00  5.28801e-01  0.00000e+00 0.00000e+00 6.66198e+01 23.882  4.77960e+01 23.882  0.5444 
1 1 1 12  81  5  o 16 9.00875e+00 1.27368e+00 1.33822e+02 335.196 1.70980e+01  -7.90195e+00 0.00000e+00 0.00000e+00 1.96804e+02 335.196 6.29815e+01 335.196 0.9731 
1 1 1 12  81  6  o 9  6.90898e+00 1.39318e+00 1.06406e+02 187.329 -1.07770e+01 -1.38618e+00 0.00000e+00 0.00000e+00 1.41912e+02 187.329 3.55063e+01 187.329 0.9528 
1 1 1 12  81  7  o 2  5.27225e+00 1.30367e+00 6.16114e+01 343.622 5.08073e+00  -1.49317e+00 0.00000e+00 0.00000e+00 1.17356e+02 343.622 5.57449e+01 343.622 0.8998 
1 1 1 12  81  8  o 8  4.45007e+00 1.33224e+00 4.21071e+01 179.485 -3.20754e+00 2.88404e-02  0.00000e+00 0.00000e+00 9.62674e+01 179.485 5.41603e+01 179.485 0.8242 
1 1 1 12  82  0  o 1  3.70077e+00 1.06452e+00 8.31212e+01 232.464 -2.97979e+00 -3.87833e+00 0.00000e+00 0.00000e+00 4.09796e+01 232.464 4.21416e+01 52.464  0.8908 
1 1 1 12  82  1  o 8  5.18728e+00 1.15712e+00 5.91745e+01 83.902  4.94389e-01  4.62797e+00  0.00000e+00 0.00000e+00 1.13663e+02 83.902  5.44887e+01 83.902  0.8847 
1 1 1 12  82  2  o 4  7.04257e+00 1.13528e+00 1.10161e+02 132.751 -8.31215e+00 8.99157e+00  0.00000e+00 0.00000e+00 1.44105e+02 132.751 3.39439e+01 132.751 0.9583 
1 1 1 12  82  3  f 0  1.20919e+01 9.57090e-01 2.51813e+02 261.597 -8.35458e+00 -5.65587e+01 0.00000e+00 0.00000e+00 1.99919e+02 261.597 5.18945e+01 81.597  0.9912 
1 1 1 12  82  4  o 11 8.00104e+00 1.22531e+00 1.00532e+02 21.187  1.15677e+01  4.48387e+00  0.00000e+00 0.00000e+00 1.88679e+02 21.187  8.81462e+01 21.187  0.9588 
1 1 1 12  82  5  o 2  4.00077e+00 1.20434e+00 6.66485e+01 195.630 -4.17350e+00 -1.16761e+00 0.00000e+00 0.00000e+00 6.53881e+01 195.630 1.26040e+00 15.630  0.8752 
1 1 1 12  82  6  o 5  6.94765e+00 1.39979e+00 1.09305e+02 75.908  2.88381e+00  1.14874e+01  0.00000e+00 0.00000e+00 1.41394e+02 75.908  3.20891e+01 75.908  0.9568 
1 1 1 12  82  7  o 5  4.95683e+00 1.40122e+00 9.28960e+01 336.785 6.65976e+00  -2.85637e+00 0.00000e+00 0.00000e+00 8.06312e+01 336.785 1.22648e+01 156.785 0.9282 
1 1 1 12  82  8  o 17 5.98912e+00 1.61216e+00 1.27092e+02 147.049 -9.04582e+00 5.86337e+00  0.00000e+00 0.00000e+00 8.80535e+01 147.049 3.90388e+01 327.049 0.9524 
1 1 1 12  83  0  o 2  3.76899e+00 1.08203e+00 1.02894e+02 10.191  6.15522e+00  1.10645e+00  0.00000e+00 0.00000e+00 2.70608e+01 10.191  7.58336e+01 190.191 0.9161 
1 1 1 12  83  1  o 14 4.95832e+00 1.18227e+00 8.39613e+01 164.221 -6.12205e+00 1.72990e+00  0.00000e+00 0.00000e+00 8.73605e+01 164.221 3.39924e+00 164.221 0.9176 
1 1 1 12  83  2  o 14 5.21038e+00 1.22618e+00 9.89779e+01 206.860 -7.02723e+00 -3.55900e+00 0.00000e+00 0.00000e+00 8.43708e+01 206.860 1.46071e+01 26.860  0.9342 
1 1 1 12  83  3  o 1  1.06715e+01 9.92845e-01 2.03732e+02 303.729 2.20841e+01  -3.30770e+01 0.00000e+00 0.00000e+00 1.93290e+02 303.729 1.04416e+01 123.729 0.9873 
1 1 1 12  83  4  o 18 5.19053e+00 1.09660e+00 7.38243e+01 114.293 -2.81073e+00 6.22724e+00  0.00000e+00 0.00000e+00 1.06867e+02 114.293 3.30427e+01 114.293 0.9236 
1 1 1 12  83  5  o 1  3.76469e+00 1.15147e+00 8.16468e+01 244.683 -2.34418e+00 -4.95544e+00 0.00000e+00 0.00000e+00 4.65789e+01 244.683 3.50678e+01 64.683  0.9035 
1 1 1 12  83  6  o 14 4.78020e+00 1.27975e+00 1.33338e+02 3.765   1.12809e+01  7.42284e-01  0.00000e+00 0.00000e+00 3.87307e+01 3.765   9.46075e+01 183.765 0.9547 
1 1 1 12  83  7  o 12 8.64575e+00 1.49883e+00 1.20482e+02 172.568 -1.48959e+01 1.94297e+00  0.00000e+00 0.00000e+00 1.94484e+02 172.568 7.40029e+01 172.568 0.9661 
1 1 1 12  83  8  o 19 3.84309e+00 1.29201e+00 7.54650e+01 37.087  4.28691e+00  3.24068e+00  0.00000e+00 0.00000e+00 5.51623e+01 37.087  2.03027e+01 217.087 0.9014 
1 1 1 12  84  0  o 3  1.05405e+01 8.94192e-01 1.82269e+02 271.354 8.75429e-01  -3.70512e+01 0.00000e+00 0.00000e+00 2.08961e+02 271.354 2.66915e+01 271.354 0.9864 
1 1 1 12  84  1  o 4  4.11127e+00 1.12852e+00 8.84777e+01 166.153 -5.77369e+00 1.42320e+00  0.00000e+00 0.00000e+00 5.25970e+01 166.153 3.58807e+01 346.153 0.9115 
1 1 1 12  84  2  o 13 2.41529e+00 8.32349e-01 1.13292e+02 60.597  2.87785e+00  5.10671e+00  0.00000e+00 0.00000e+00 3.05052e+01 240.597 1.43798e+02 240.597 0.9102 
1 1 1 12  84  3  o 16 1.08161e+01 1.01386e+00 1.66129e+02 120.394 -1.73808e+01 2.96319e+01  0.00000e+00 0.00000e+00 2.35362e+02 120.394 6.92329e+01 120.394 0.9853 
1 1 1 12  84  4  o 8  5.74407e+00 1.29233e+00 6.96795e+01 217.825 -4.81464e+00 -3.73802e+00 0.00000e+00 0.00000e+00 1.28116e+02 217.825 5.84366e+01 217.825 0.9138 
1 1 1 12  84  5  o 18 7.05128e+00 1.33370e+00 8.58946e+01 153.809 -8.79313e+00 4.32496e+00  0.00000e+00 0.00000e+00 1.65921e+02 153.809 8.00260e+01 153.809 0.9475 
1 1 1 12  84  6  o 10 4.08638e+00 1.17911e+00 7.60423e+01 347.947 5.81746e+00  -1.24213e+00 0.00000e+00 0.00000e+00 6.43728e+01 347.947 1.16696e+01 167.947 0.9116 
1 1 1 12  84  7  o 18 3.76534e+00 1.18268e+00 2.44208e+01 247.098 -6.97707e-01 -1.65151e+00 0.00000e+00 0.00000e+00 6.93579e+01 247.098 4.49370e+01 247.098 0.6606 
1 1 1 12  84  8  o 8  5.46166e+00 1.55304e+00 9.49985e+01 326.509 6.55532e+00  -4.33733e+00 0.00000e+00 0.00000e+00 9.73240e+01 326.509 2.32555e+00 326.509 0.9340 
1 1 1 12  85  0  o 8  5.63000e+00 1.18241e+00 6.84348e+01 136.129 -4.44918e+00 4.27726e+00  0.00000e+00 0.00000e+00 1.25348e+02 136.129 5.69131e+01 136.129 0.9149 
1 1 1 12  85  1  o 10 4.17562e+00 1.17145e+00 2.78869e+01 150.989 -1.71134e+00 9.49040e-01  0.00000e+00 0.00000e+00 8.06384e+01 150.989 5.27515e+01 150.989 0.6906 
1 1 1 12  85  2  o 3  2.98275e+00 9.40602e-01 1.74536e+01 303.143 5.34458e-01  -8.18500e-01 0.00000e+00 0.00000e+00 3.17775e+01 303.143 1.43240e+01 303.143 0.4384 
1 1 1 12  85  3  o 18 6.32784e+00 1.31074e+00 1.50429e+02 204.189 -1.32533e+01 -5.95332e+00 0.00000e+00 0.00000e+00 7.95456e+01 204.189 7.08834e+01 24.189  0.9649 
1 1 1 12  85  4  o 5  3.60016e+00 1.09510e+00 1.10306e+02 90.004  -4.93797e-04 7.39698e+00  0.00000e+00 0.00000e+00 1.57919e+01 90.004  9.45145e+01 270.004 0.9297 
1 1 1 12  85  5  o 11 5.21173e+00 1.31179e+00 1.21708e+02 255.648 -2.70678e+00 -1.05794e+01 0.00000e+00 0.00000e+00 6.54578e+01 255.648 5.62501e+01 75.649  0.9531 
1 1 1 12  85  6  o 7  4.09235e+00 1.24423e+00 9.85364e+01 335.233 6.70683e+00  -3.09436e+00 0.00000e+00 0.00000e+00 4.48358e+01 335.233 5.37007e+01 155.233 0.9296 
1 1 1 12  85  7  o 10 5.44866e+00 1.47816e+00 9.32405e+01 35.688  6.57394e+00  4.72183e+00  0.00000e+00 0.00000e+00 9.89817e+01 35.688  5.74118e+00 35.688  0.9360 
1 1 1 12  86  0  o 6  8.05653e+00 1.07526e+00 1.34916e+02 153.303 -1.67476e+01 8.42207e+00  0.00000e+00 0.00000e+00 1.59898e+02 153.303 2.49818e+01 153.303 0.9730 
1 1 1 12  86  1  o 19 5.61330e+00 1.25330e+00 9.75114e+01 9.490   8.15451e+00  1.36317e+00  0.00000e+00 0.00000e+00 1.00484e+02 9.490   2.97249e+00 9.490   0.9374 
1 1 1 12  86  2  o 19 3.80744e+00 1.05392e+00 5.84217e+01 12.297  3.99554e+00  8.70923e-01  0.00000e+00 0.00000e+00 6.58189e+01 12.297  7.39715e+00 12.297  0.8669 
1 1 1 12  86  3  o 11 6.93968e+00 1.22424e+00 6.29032e+01 75.323  1.78558e+00  6.81727e+00  0.00000e+00 0.00000e+00 1.79086e+02 75.323  1.16183e+02 75.323  0.9261 
1 1 1 12  86  4  o 10 4.48058e+00 1.24528e+00 1.39113e+02 26.894  9.66590e+00  4.90251e+00  0.00000e+00 0.00000e+00 2.16622e+01 26.894  1.17451e+02 206.894 0.9527 
1 1 1 12  86  5  o 4  3.10478e+00 1.01005e+00 4.98219e+01 160.246 -3.00143e+00 1.07789e+00  0.00000e+00 0.00000e+00 4.64463e+01 160.246 3.37556e+00 340.246 0.8230 
1 1 1 12  86  6  o 9  6.84329e+00 1.45357e+00 1.41970e+02 329.941 1.27715e+01  -7.39104e+00 0.00000e+00 0.00000e+00 1.06977e+02 329.941 3.49933e+01 149.942 0.9655 
1 1 1 12  86  7  o 12 3.36094e+00 1.10857e+00 5.16856e+01 165.985 -3.69206e+00 9.21579e-01  0.00000e+00 0.00000e+00 5.66717e+01 165.985 4.98605e+00 165.985 0.8556 
1 1 1 12  87  0  o 6  3.51245e+00 1.04205e+00 7.81253e+01 28.568  4.50534e+00  2.45316e+00  0.00000e+00 0.00000e+00 4.02536e+01 28.568  3.78717e+01 208.568 0.8963 
1 1 1 12  87  1  o 11 5.18018e+00 1.20925e+00 3.46588e+01 171.505 -2.90899e+00 4.34497e-01  0.00000e+00 0.00000e+00 1.22319e+02 171.505 8.76599e+01 171.505 0.8055 
1 1 1 12  87  2  o 17 4.01334e+00 1.13398e+00 5.55378e+01 86.695  2.19762e-01  3.80566e+00  0.00000e+00 0.00000e+00 7.37306e+01 86.695  1.81928e+01 86.695  0.8559 
1 1 1 12  87  3  o 13 4.65752e+00 1.20796e+00 3.64391e+01 182.937 -2.89384e+00 -1.48474e-01 0.00000e+00 0.00000e+00 1.04202e+02 182.937 6.77627e+01 182.937 0.8021 
1 1 1 12  87  4  o 17 3.70698e+00 1.12673e+00 7.28344e+01 39.443  4.20464e+00  3.45899e+00  0.00000e+00 0.00000e+00 5.31822e+01 39.443  1.96522e+01 219.443 0.9028 
1 1 1 12  87  5  o 12 4.40043e+00 1.24237e+00 9.74551e+01 214.947 -6.32236e+00 -4.41831e+00 0.00000e+00 0.00000e+00 5.71312e+01 214.947 4.03239e+01 34.947  0.9327 
1 1 1 12  87  6  f 0  4.86143e+00 1.17834e+00 2.78709e+01 209.833 -2.51640e+00 -1.44309e+00 0.00000e+00 0.00000e+00 1.19066e+02 209.833 9.11947e+01 209.833 0.8024 
1 1 1 12  87  7  o 9  6.71129e+00 1.47308e+00 1.26731e+02 84.192  1.40118e+00  1.37763e+01  0.00000e+00 0.00000e+00 1.16793e+02 84.192  9.93785e+00 264.192 0.9632 
1 1 1 12  88  0  o 5  4.38336e+00 1.12650e+00 5.81832e+01 58.636  2.32171e+00  3.80900e+00  0.00000e+00 0.00000e+00 8.66873e+01 58.636  2.85041e+01 58.636  0.8792 
1 1 1 12  88  1  o 15 2.55899e+00 8.62447e-01 5.40505e+01 0.969   2.86221e+00  4.83890e-02  0.00000e+00 0.00000e+00 2.28753e+01 0.969   3.11752e+01 180.969 0.7993 
1 1 1 12  88  2  f 0  3.27891e+00 1.03001e+00 6.56974e+01 355.895 4.20222e+00  -3.01575e-01 0.00000e+00 0.00000e+00 4.17846e+01 355.895 2.39128e+01 175.895 0.8712 
1 1 1 12  88  3  f 0  3.62368e+00 1.12595e+00 4.65985e+01 6.191   3.28594e+00  3.56468e-01  0.00000e+00 0.00000e+00 6.66329e+01 6.191   2.00345e+01 6.191   0.8302 
1 1 1 12  88  4  o 3  4.68964e+00 1.27314e+00 1.11666e+02 290.374 3.04728e+00  -8.20526e+00 0.00000e+00 0.00000e+00 5.44697e+01 290.374 5.71963e+01 110.374 0.9410 
1 1 1 12  88  5  o 17 3.20147e+00 1.04375e+00 4.50337e+01 140.399 -2.33753e+00 1.93383e+00  0.00000e+00 0.00000e+00 5.29077e+01 140.399 7.87402e+00 140.399 0.8125 
1 1 1 12  88  6  o 5  5.67703e+00 1.40661e+00 9.80647e+01 234.517 -5.33728e+00 -7.48718e+00 0.00000e+00 0.00000e+00 1.03750e+02 234.517 5.68481e+00 234.517 0.9439 
1 1 1 12  88  7  o 19 2.62151e+00 9.12748e-01 2.75969e+01 279.235 3.12574e-01  -1.92237e+00 0.00000e+00 0.00000e+00 4.04299e+01 279.235 1.28330e+01 279.235 0.6890 
1 1 1 12  89  0  o 17 4.53245e+00 1.14191e+00 8.07707e+01 222.266 -4.86817e+00 -4.42439e+00 0.00000e+00 0.00000e+00 7.60313e+01 222.266 4.73949e+00 42.266  0.9205 
1 1 1 12  89  1  o 1  5.83048e+00 1.23192e+00 9.25106e+01 71.961  2.79944e+00  8.59568e+00  0.00000e+00 0.00000e+00 1.14211e+02 71.961  2.17004e+01 71.961  0.9430 
1 1 1 12  89  2  o 14 6.90064e+00 1.19388e+00 1.14244e+02 279.361 2.32353e+00  -1.40949e+01 0.00000e+00 0.00000e+00 1.36068e+02 279.361 2.18240e+01 279.361 0.9643 
1 1 1 12  89  3  o 14 4.12217e+00 1.17907e+00 7.92364e+01 49.289  4.11861e+00  4.78655e+00  0.00000e+00 0.00000e+00 6.29947e+01 49.289  1.62417e+01 229.289 0.9170 
1 1 1 12  89  4  f 0  3.07628e+00 1.01927e+00 3.11615e+01 163.739 -1.99557e+00 5.82085e-01  0.00000e+00 0.00000e+00 5.10786e+01 163.739 1.99171e+01 163.739 0.7103 
1 1 1 12  89  5  o 6  5.08688e+00 1.32409e+00 6.41483e+01 136.690 -4.09692e+00 3.86208e+00  0.00000e+00 0.00000e+00 1.09388e+02 136.690 4.52398e+01 136.690 0.9062 
1 1 1 12  89  6  o 9  3.03002e+00 1.00545e+00 4.39939e+01 43.447  2.50413e+00  2.37193e+00  0.00000e+00 0.00000e+00 5.16541e+01 43.447  7.66018e+00 43.447  0.8384 
1 1 1 12  90  0  o 3  6.05087e+00 1.19211e+00 8.49337e+01 150.608 -8.13218e+00 4.58083e+00  0.00000e+00 0.00000e+00 1.29874e+02 150.608 4.49402e+01 150.608 0.9448 
1 1 1 12  90  1  o 14 4.96308e+00 1.22067e+00 9.69629e+01 302.508 4.67949e+00  -7.34319e+00 0.00000e+00 0.00000e+00 7.85401e+01 302.508 1.84228e+01 122.508 0.9407 
1 1 1 12  90  2  o 3  2.62275e+00 8.89230e-01 5.17246e+01 15.312  3.22051e+00  8.81760e-01  0.00000e+00 0.00000e+00 3.03592e+01 15.312  2.13654e+01 195.312 0.8322 
1 1 1 12  90  3  o 8  3.00631e+00 9.57679e-01 4.01899e+01 71.677  8.75944e-01  2.64512e+00  0.00000e+00 0.00000e+00 4.94769e+01 71.677  9.28699e+00 71.677  0.7929 
1 1 1 12  90  4  o 17 4.36182e+00 1.24286e+00 4.10157e+01 143.571 -2.56532e+00 1.89334e+00  0.00000e+00 0.00000e+00 9.40622e+01 143.571 5.30464e+01 143.571 0.8230 
1 1 1 12  90  5  o 1  3.30219e+00 1.05493e+00 7.58867e+01 58.328  3.09077e+00  5.00988e+00  0.00000e+00 0.00000e+00 3.72799e+01 58.328  3.86068e+01 238.328 0.9106 
1 1 1 12  90  6  o 18 5.51987e+00 1.39548e+00 8.63021e+01 207.473 -7.65656e+00 -3.98111e+00 0.00000e+00 0.00000e+00 1.09038e+02 207.473 2.27363e+01 207.473 0.9401 
1 1 1 12  91  0  f 0  6.76385e+00 1.15467e+00 7.53232e+01 320.274 7.71561e+00  -6.41153e+00 0.00000e+00 0.00000e+00 1.65742e+02 320.274 9.04190e+01 320.274 0.9488 
1 1 1 12  91  1  o 2  4.09140e+00 1.14804e+00 3.35818e+01 187.453 -2.70476e+00 -3.53829e-01 0.00000e+00 0.00000e+00 8.75306e+01 187.453 5.39488e+01 187.453 0.7877 
1 1 1 12  91  2  o 10 9.73467e+00 1.04588e+00 2.03851e+02 1.537   4.25108e+01  1.14056e+00  0.00000e+00 0.00000e+00 1.57810e+02 1.537   4.60408e+01 181.537 0.9882 
1 1 1 12  91  3  o 12 3.84573e+00 1.10754e+00 3.42031e+01 166.660 -2.63440e+00 6.24681e-01  0.00000e+00 0.00000e+00 7.94497e+01 166.660 4.52466e+01 166.660 0.7858 
1 1 1 12  91  4  o 17 4.33698e+00 1.22345e+00 3.99182e+01 68.940  1.17052e+00  3.03977e+00  0.00000e+00 0.00000e+00 9.50663e+01 68.940  5.51481e+01 68.940  0.8273 
1 1 1 12  91  5  o 8  3.82334e+00 1.13743e+00 4.32987e+01 98.454  -5.19174e-01 3.49288e+00  0.00000e+00 0.00000e+00 7.79355e+01 98.454  3.46368e+01 98.454  0.8427 
1 1 1 12  91  6  o 18 4.88236e+00 1.29498e+00 9.33666e+01 95.929  -9.44143e-01 9.09178e+00  0.00000e+00 0.00000e+00 8.00067e+01 95.929  1.33599e+01 275.929 0.9436 
1 1 1 12  92  0  o 13 4.31740e+00 1.15143e+00 9.09134e+01 73.785  2.01898e+00  6.94273e+00  0.00000e+00 0.00000e+00 5.95568e+01 73.785  3.13566e+01 253.785 0.9280 
1 1 1 12  92  1  o 19 4.87268e+00 1.18274e+00 5.89233e+01 238.478 -2.86324e+00 -4.66840e+00 0.00000e+00 0.00000e+00 1.06465e+02 238.478 4.75414e+01 238.478 0.9034 
1 1 1 12  92  2  o 15 5.91490e+00 1.30958e+00 1.18374e+02 345.280 1.17296e+01  -3.08167e+00 0.00000e+00 0.00000e+00 9.45766e+01 345.280 2.37977e+01 165.280 0.9578 
1 1 1 12  92  3  o 17 3.39320e+00 1.06983e+00 5.15936e+01 326.473 3.06223e+00  -2.02895e+00 0.00000e+00 0.00000e+00 5.68099e+01 326.473 5.21630e+00 326.473 0.8497 
1 1 1 12  92  4  o 19 4.08467e+00 1.16169e+00 6.28629e+01 74.063  1.49885e+00  5.24887e+00  0.00000e+00 0.00000e+00 7.58643e+01 74.063  1.30014e+01 74.063  0.9030 
1 1 1 12  92  5  o 17 3.09780e+00 1.02235e+00 2.46685e+01 142.779 -1.51162e+00 1.14826e+00  0.00000e+00 0.00000e+00 5.46130e+01 142.779 2.99444e+01 142.779 0.6803 
1 1 1 12  93  0  o 4  3.69603e+00 1.05698e+00 2.75453e+01 343.399 2.04915e+00  -6.10914e-01 0.00000e+00 0.00000e+00 7.22617e+01 343.399 4.47164e+01 343.399 0.7192 
1 1 1 12  93  1  o 6  9.49184e+00 1.04278e+00 1.84158e+02 214.031 -3.15056e+01 -2.12756e+01 0.00000e+00 0.00000e+00 1.67662e+02 214.031 1.64958e+01 34.031  0.9868 
1 1 1 12  93  2  o 5  6.33227e+00 1.30217e+00 7.98397e+01 288.065 2.70345e+00  -8.28839e+00 0.00000e+00 0.00000e+00 1.44017e+02 288.065 6.41776e+01 288.065 0.9408 
1 1 1 12  93  3  o 6  4.51589e+00 1.20401e+00 7.83123e+01 355.369 7.36141e+00  -5.96332e-01 0.00000e+00 0.00000e+00 7.94898e+01 355.369 1.17742e+00 355.369 0.9296 
1 1 1 12  93  4  o 4  3.22576e+00 1.03188e+00 5.00780e+01 121.435 -2.12460e+00 3.47588e+00  0.00000e+00 0.00000e+00 5.49948e+01 121.435 4.91681e+00 121.435 0.8663 
1 1 1 12  93  5  o 8  3.74331e+00 1.16219e+00 3.44145e+01 99.344  -4.78549e-01 2.90843e+00  0.00000e+00 0.00000e+00 7.90573e+01 99.344  4.46428e+01 99.344  0.8060 
1 1 1 12  94  0  o 17 7.61613e+00 1.13903e+00 1.11739e+02 227.201 -1.12310e+01 -1.21289e+01 0.00000e+00 0.00000e+00 1.65354e+02 227.201 5.36153e+01 227.201 0.9693 
1 1 1 12  94  1  o 5  3.69945e+00 1.08334e+00 6.66091e+01 30.894  4.38502e+00  2.62376e+00  0.00000e+00 0.00000e+00 5.78512e+01 30.894  8.75782e+00 210.894 0.8959 
1 1 1 12  94  2  o 5  4.15702e+00 1.18060e+00 2.55161e+01 221.050 -1.70861e+00 -1.48787e+00 0.00000e+00 0.00000e+00 8.95680e+01 221.050 6.40519e+01 221.050 0.7369 
1 1 1 12  94  3  o 4  6.10975e+00 1.26964e+00 1.08685e+02 329.584 1.08419e+01  -6.36483e+00 0.00000e+00 0.00000e+00 1.11592e+02 329.584 2.90697e+00 329.584 0.9594 
1 1 1 12  94  4  o 19 3.44409e+00 1.08282e+00 7.85449e+01 159.591 -6.24302e+00 2.32288e+00  0.00000e+00 0.00000e+00 4.07626e+01 159.591 3.77823e+01 339.591 0.9215 
1 1 1 12  94  5  o 12 4.44935e+00 1.25142e+00 5.74585e+01 90.789  -7.22012e-02 5.24025e+00  0.00000e+00 0.00000e+00 9.28803e+01 90.789  3.54218e+01 90.789  0.8987 
1 1 1 12  95  0  o 16 5.71129e+00 1.13830e+00 8.42082e+01 196.134 -1.02791e+01 -2.97346e+00 0.00000e+00 0.00000e+00 1.19842e+02 196.134 3.56335e+01 196.134 0.9521 
1 1 1 12  95  1  o 13 4.30141e+00 1.18722e+00 5.88403e+01 123.407 -2.89673e+00 4.39203e+00  0.00000e+00 0.00000e+00 8.63565e+01 123.407 2.75162e+01 123.407 0.8991 
1 1 1 12  95  2  o 2  4.22950e+00 1.16983e+00 6.35695e+01 276.019 5.74244e-01  -5.44623e+00 0.00000e+00 0.00000e+00 7.99334e+01 276.019 1.63640e+01 276.019 0.9034 
1 1 1 12  95  3  o 2  6.99352e+00 1.28592e+00 1.03591e+02 270.769 1.88231e-01  -1.40252e+01 0.00000e+00 0.00000e+00 1.49613e+02 270.769 4.60219e+01 270.769 0.9637 
1 1 1 12  95  4  o 6  3.15951e+00 1.02520e+00 7.02934e+01 102.084 -1.22055e+00 5.70107e+00  0.00000e+00 0.00000e+00 3.77141e+01 102.084 3.25793e+01 282.084 0.9096 
1 1 1 12  96  0  f 0  2.60298e+00 8.62585e-01 8.86748e+01 109.812 -2.09479e+00 5.81460e+00  0.00000e+00 0.00000e+00 6.86955e-01 109.812 8.79879e+01 289.812 0.9151 
1 1 1 12  96  1  o 11 3.81705e+00 1.07076e+00 6.94899e+01 48.172  4.01233e+00  4.48309e+00  0.00000e+00 0.00000e+00 6.12580e+01 48.172  8.23186e+00 228.172 0.9126 
1 1 1 12  96  2  o 7  6.42615e+00 1.22056e+00 7.82797e+01 249.592 -3.61268e+00 -9.71012e+00 0.00000e+00 0.00000e+00 1.51053e+02 249.592 7.27738e+01 249.592 0.9504 
1 1 1 12  96  3  o 15 2.81263e+00 9.35897e-01 2.35259e+01 61.952  8.19669e-01  1.53846e+00  0.00000e+00 0.00000e+00 4.52236e+01 61.952  2.16977e+01 61.952  0.6508 
1 1 1 12  96  4  o 17 3.31756e+00 1.05834e+00 1.23630e+01 284.862 2.60234e-01  -9.80618e-01 0.00000e+00 0.00000e+00 4.39169e+01 284.862 3.15539e+01 284.862 0.4515 
1 1 1 12  97  0  o 3  4.16640e+00 1.08694e+00 8.32304e+01 88.957  1.50815e-01  8.28171e+00  0.00000e+00 0.00000e+00 6.32764e+01 88.957  1.99540e+01 268.957 0.9375 
1 1 1 12  97  1  o 7  5.01476e+00 1.14717e+00 9.42734e+01 234.980 -5.98630e+00 -8.54285e+00 0.00000e+00 0.00000e+00 8.46385e+01 234.980 9.63488e+00 54.980  0.9508 
1 1 1 12  97  2  o 1  2.71228e+00 9.27701e-01 3.27768e+01 180.967 -2.36021e+00 -3.98469e-02 0.00000e+00 0.00000e+00 4.34761e+01 180.967 1.06992e+01 180.967 0.7489 
1 1 1 12  97  3  o 4  2.53629e+00 8.63915e-01 3.27576e+01 331.449 2.16063e+00  -1.17561e+00 0.00000e+00 0.00000e+00 3.96766e+01 331.449 6.91907e+00 331.449 0.7605 
1 1 1 12  97  4  o 15 4.49001e+00 1.21583e+00 9.50995e+01 50.266  6.22462e+00  7.48851e+00  0.00000e+00 0.00000e+00 6.46402e+01 50.266  3.04593e+01 230.266 0.9472 
1 1 1 12  98  0  o 13 2.84866e+00 9.10287e-01 9.66983e+00 45.486  5.64916e-01  5.74574e-01  0.00000e+00 0.00000e+00 3.02118e+01 45.486  2.05420e+01 45.486  0.3734 
1 1 1 12  98  1  o 18 3.89059e+00 1.03401e+00 4.01546e+01 87.851  1.40806e-01  3.75162e+00  0.00000e+00 0.00000e+00 8.43935e+01 87.851  4.42389e+01 87.851  0.8534 
1 1 1 12  98  2  o 9  4.94550e+00 1.08809e+00 9.76006e+01 183.711 -1.14738e+01 -7.44226e-01 0.00000e+00 0.00000e+00 7.97315e+01 183.711 1.78690e+01 3.711   0.9555 
1 1 1 12  98  3  f 0  3.20199e+00 1.00163e+00 5.68129e+01 308.402 3.04107e+00  -3.83659e+00 0.00000e+00 0.00000e+00 5.02786e+01 308.402 6.53428e+00 128.402 0.8909 
1 1 1 12  98  4  o 14 2.65585e+00 9.02532e-01 6.79428e+01 148.343 -4.73742e+00 2.92092e+00  0.00000e+00 0.00000e+00 2.23155e+01 148.343 4.56273e+01 328.343 0.9050 
1 1 1 12  99  0  o 13 2.37106e+00 7.99425e-01 3.23817e+01 162.546 -2.30754e+00 7.25546e-01  0.00000e+00 0.00000e+00 3.48033e+01 162.546 2.42158e+00 162.546 0.7559 
1 1 1 12  99  1  o 4  2.85579e+00 9.17651e-01 6.14423e+01 194.650 -4.82612e+00 -1.26162e+00 0.00000e+00 0.00000e+00 3.42117e+01 194.650 2.72306e+01 14.650  0.8931 
1 1 1 12  99  2  o 2  2.76525e+00 8.71333e-01 4.10416e+01 31.398  3.11056e+00  1.89852e+00  0.00000e+00 0.00000e+00 4.69665e+01 31.398  5.92493e+00 31.398  0.8483 
1 1 1 12  99  3  o 3  3.23846e+00 9.89612e-01 3.54025e+01 331.575 2.68412e+00  -1.45282e+00 0.00000e+00 0.00000e+00 6.35033e+01 331.575 2.81009e+01 331.575 0.8138 
1 1 1 12  100 0  o 13 6.54872e+00 1.07423e+00 1.02757e+02 345.479 1.69106e+01  -4.37983e+00 0.00000e+00 0.00000e+00 1.35534e+02 345.479 3.27767e+01 345.479 0.9709 
1 1 1 12  100 1  f 0  3.93787e+00 1.06850e+00 3.52170e+01 205.862 -3.13722e+00 -1.52076e+00 0.00000e+00 0.00000e+00 8.88611e+01 205.862 5.36441e+01 205.862 0.8404 
1 1 1 12  100 2  o 5  2.86509e+00 9.27504e-01 7.47084e+01 106.414 -1.71241e+00 5.81283e+00  0.00000e+00 0.00000e+00 2.34361e+01 106.414 5.12724e+01 286.414 0.9133 
1 1 1 12  100 3  o 11 3.46638e+00 1.04789e+00 4.56237e+01 196.173 -4.22431e+00 -1.22510e+00 0.00000e+00 0.00000e+00 6.84734e+01 196.173 2.28498e+01 196.173 0.8773 
1 1 1 12  101 0  o 4  8.44491e+00 9.78003e-01 1.07305e+02 152.811 -2.36475e+01 1.21474e+01  0.00000e+00 0.00000e+00 2.03083e+02 152.811 9.57777e+01 152.811 0.9810 
1 1 1 12  101 1  f 0  5.04612e+00 1.02780e+00 2.83768e+01 102.965 -8.22924e-01 3.57429e+00  0.00000e+00 0.00000e+00 1.32284e+02 102.965 1.03907e+02 102.965 0.8494 
1 1 1 12  101 2  o 6  3.96037e+00 1.06511e+00 7.00905e+01 356.710 7.56552e+00  -4.34925e-01 0.00000e+00 0.00000e+00 6.82372e+01 356.710 1.85331e+00 176.710 0.9315 
1 1 1 12  102 0  o 11 2.08098e+00 7.16997e-01 5.80032e+01 329.339 4.15471e+00  -2.46301e+00 0.00000e+00 0.00000e+00 1.13112e+01 329.339 4.66919e+01 149.339 0.8893 
1 1 1 12  102 1  o 15 5.85848e+00 1.15082e+00 5.89677e+01 127.529 -5.30394e+00 6.90498e+00  0.00000e+00 0.00000e+00 1.47544e+02 127.529 8.85760e+01 127.529 0.9407 
1 1 1 12  102 2  o 11 6.15338e+00 1.11928e+00 9.17379e+01 325.019 1.21906e+01  -8.52985e+00 0.00000e+00 0.00000e+00 1.31043e+02 325.019 3.93051e+01 325.019 0.9658 
1 1 1 12  103 0  o 5  2.55234e+00 8.42442e-01 3.31390e+01 42.572  2.30684e+00  2.11920e+00  0.00000e+00 0.00000e+00 4.51655e+01 42.572  1.20265e+01 42.572  0.8193 
1 1 1 12  103 1  o 1  2.93909e+00 9.31645e-01 2.95696e+01 326.248 2.34949e+00  -1.57000e+00 0.00000e+00 0.00000e+00 5.80986e+01 326.248 2.85290e+01 326.248 0.7962 
1 1 1 12  104 0  o 6  3.12485e+00 9.74164e-01 7.99734e+01 331.606 6.89036e+00  -3.72464e+00 0.00000e+00 0.00000e+00 2.92587e+01 331.606 5.07147e+01 151.606 0.9338 
1 1 1 12  104 1  o 8  4.76470e+00 1.17665e+00 4.83641e+01 96.371  -6.55252e-01 5.86838e+00  0.00000e+00 0.00000e+00 1.14173e+02 96.371  6.58089e+01 96.371  0.9109 
1 1 1 12  105 0  o 18 1.97270e+00 6.83989e-01 2.42454e+01 113.523 -8.80482e-01 2.02278e+00  0.00000e+00 0.00000e+00 2.95644e+01 113.523 5.31894e+00 113.523 0.7289 
1 1 1 12  105 1  o 15 2.68196e+00 8.52452e-01 3.01058e+01 89.827  9.25541e-03  3.06736e+00  0.00000e+00 0.00000e+00 5.17163e+01 89.827  2.16105e+01 89.827  0.8148 
1 1 1 12  106 0  o 18 3.74422e+00 1.06138e+00 3.67906e+01 213.596 -3.39904e+00 -2.25798e+00 0.00000e+00 0.00000e+00 8.45981e+01 213.596 4.78075e+01 213.596 0.8666 
1 1 1 12  107 0  o 9  2.61532e+00 8.48857e-01 4.16387e+01 79.899  7.37330e-01  4.13909e+00  0.00000e+00 0.00000e+00 4.35549e+01 79.899  1.91615e+00 79.899  0.8709 
1 1 1 12  108 0  o 18 2.98853e+00 9.46303e-01 6.99401e+01 76.869  1.90206e+00  8.15365e+00  0.00000e+00 0.00000e+00 3.49013e+01 76.869  3.50389e+01 256.869 0.9382 
1 1 1 13  0   0  o 8  9.80080e+00 2.48592e+00 1.23057e+02 0.000   2.57461e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.45727e+02 0.000   1.22669e+02 0.000   0.9885 
1 1 1 13  0   1  o 11 8.58944e+00 3.00010e+00 3.42457e+01 180.000 -6.01091e-01 0.00000e+00  0.00000e+00 0.00000e+00 1.41697e+02 180.000 1.07452e+02 180.000 0.5378 
1 1 1 13  0   2  o 11 9.96653e+00 2.80448e+00 3.12283e+02 0.000   6.49312e+00  0.00000e+00  0.00000e+00 0.00000e+00 6.74658e+01 0.000   2.44817e+02 180.000 1.0000 
1 1 1 13  0   3  o 15 1.16680e+01 3.38950e+00 2.13816e+02 180.000 -5.05843e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.30894e+02 180.000 1.70788e+01 180.000 0.9999 
1 1 1 13  0   4  o 5  3.92643e+00 2.65772e+00 9.45952e+00 0.000   9.66011e-02  0.00000e+00  0.00000e+00 0.00000e+00 4.95772e+00 0.000   4.50179e+00 180.000 0.0963 
1 1 1 13  0   5  o 19 1.44916e+01 3.14049e+00 3.86500e+02 0.000   1.32001e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.66183e+02 0.000   2.20317e+02 180.000 1.0000 
1 1 1 13  0   6  o 11 6.14030e+00 2.79352e+00 1.35013e+02 0.000   2.36000e+00  0.00000e+00  0.00000e+00 0.00000e+00 9.50705e+01 0.000   3.99425e+01 180.000 0.9823 
1 1 1 13  0   7  o 4  3.66916e+00 2.32611e+00 8.87638e+01 180.000 -1.18059e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.70876e+01 180.000 6.16762e+01 0.000   0.8276 
1 1 1 13  0   8  o 16 1.04189e+01 2.48256e+00 1.75516e+02 0.000   7.06217e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.21989e+02 0.000   4.64730e+01 0.000   1.0000 
1 1 1 13  0   9  o 6  5.85675e+00 3.04324e+00 5.80292e+01 180.000 -1.12290e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.22647e+02 180.000 6.46182e+01 180.000 0.8086 
1 1 1 13  0   10 o 9  3.55195e+00 2.39449e+00 1.02756e+02 180.000 -1.68459e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.37348e+01 180.000 7.90216e+01 0.000   0.9335 
1 1 1 13  0   11 o 16 2.52270e+00 1.83191e+00 1.11398e+02 0.000   1.65361e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.19653e+01 180.000 1.33363e+02 180.000 0.9294 
1 1 1 13  1   0  o 8  6.17609e+00 1.61256e+00 9.34544e+01 213.276 -2.14549e+00 -1.40803e+00 0.00000e+00 0.00000e+00 8.80517e+01 213.276 5.40266e+00 33.276  0.7720 
1 1 1 13  1   1  o 6  1.17502e+01 1.56270e+00 2.24685e+02 210.609 -1.10574e+01 -6.54162e+00 0.00000e+00 0.00000e+00 2.05048e+02 210.609 1.96367e+01 30.609  0.9603 
1 1 1 13  1   2  o 9  1.52237e+01 1.39909e+00 2.09797e+02 316.970 1.15555e+01  -1.07868e+01 0.00000e+00 0.00000e+00 3.51606e+02 316.970 1.41810e+02 316.970 0.9678 
1 1 1 13  1   3  o 19 1.07570e+01 2.06879e+00 3.04661e+02 54.859  8.62542e+00  1.22542e+01  0.00000e+00 0.00000e+00 9.14332e+01 54.859  2.13228e+02 234.859 0.9660 
1 1 1 13  1   4  o 1  1.51886e+01 1.83500e+00 1.84550e+02 21.187  1.38203e+01  5.35685e+00  0.00000e+00 0.00000e+00 3.74678e+02 21.187  1.90128e+02 21.187  0.9657 
1 1 1 13  1   5  o 4  7.66591e+00 2.04392e+00 6.81332e+01 185.582 -2.62816e+00 -2.56851e-01 0.00000e+00 0.00000e+00 1.59755e+02 185.582 9.16213e+01 185.582 0.7795 
1 1 1 13  1   6  f 0  7.17081e+00 1.56867e+00 2.07860e+02 162.885 -9.61493e+00 2.96076e+00  0.00000e+00 0.00000e+00 5.16986e+01 162.885 1.56162e+02 342.885 0.9489 
1 1 1 13  1   7  o 6  5.02802e+00 1.50195e+00 1.04529e+02 337.192 3.74508e+00  -1.57492e+00 0.00000e+00 0.00000e+00 6.15657e+01 337.192 4.29630e+01 157.192 0.8659 
1 1 1 13  1   8  o 7  9.58754e+00 1.68390e+00 9.54139e+01 185.369 -7.29909e+00 -6.85942e-01 0.00000e+00 0.00000e+00 2.44424e+02 185.369 1.49010e+02 185.369 0.9291 
1 1 1 13  1   9  o 13 1.73664e+01 1.44489e+00 2.90039e+02 191.904 -4.79325e+01 -1.01048e+01 0.00000e+00 0.00000e+00 3.65737e+02 191.904 7.56980e+01 191.904 0.9897 
1 1 1 13  1   10 o 13 1.02815e+01 1.97921e+00 2.61094e+02 320.673 1.61761e+01  -1.32528e+01 0.00000e+00 0.00000e+00 1.21654e+02 320.673 1.39440e+02 140.673 0.9758 
1 1 1 13  1   11 o 19 5.15981e+00 1.64028e+00 8.46453e+01 140.241 -3.21947e+00 2.67849e+00  0.00000e+00 0.00000e+00 8.66684e+01 140.241 2.02320e+00 140.241 0.8704 
1 1 1 13  2   0  o 14 1.67133e+01 1.29955e+00 2.99374e+02 149.756 -2.08223e+01 1.21402e+01  0.00000e+00 0.00000e+00 3.23513e+02 149.756 2.41395e+01 149.756 0.9790 
1 1 1 13  2   1  o 12 1.97999e+01 1.26283e+00 3.71591e+02 231.546 -2.41604e+01 -3.04236e+01 0.00000e+00 0.00000e+00 3.72737e+02 231.546 1.14658e+00 231.546 0.9870 
1 1 1 13  2   2  o 19 8.05613e+00 1.59986e+00 1.35036e+02 349.153 5.00353e+00  -9.58719e-01 0.00000e+00 0.00000e+00 1.39853e+02 349.153 4.81704e+00 349.153 0.8955 
1 1 1 13  2   3  o 17 2.51577e+01 1.48327e+00 3.62249e+02 6.819   5.05309e+01  6.04201e+00  0.00000e+00 0.00000e+00 5.87206e+02 6.819   2.24957e+02 6.819   0.9901 
1 1 1 13  2   4  o 12 7.98507e+00 1.98582e+00 1.84867e+02 153.756 -6.61636e+00 3.26194e+00  0.00000e+00 0.00000e+00 9.81297e+01 153.756 8.67378e+01 333.756 0.9295 
1 1 1 13  2   5  o 8  1.02900e+01 2.29263e+00 1.31156e+02 287.589 1.86759e+00  -5.89120e+00 0.00000e+00 0.00000e+00 2.27952e+02 287.589 9.67964e+01 287.589 0.9151 
1 1 1 13  2   6  o 11 5.19911e+00 1.49470e+00 1.47191e+02 13.950  5.16317e+00  1.28250e+00  0.00000e+00 0.00000e+00 3.13587e+01 13.950  1.15832e+02 193.950 0.9003 
1 1 1 13  2   7  o 6  9.44706e+00 1.67369e+00 2.16472e+02 335.299 1.37190e+01  -6.31014e+00 0.00000e+00 0.00000e+00 1.31786e+02 335.299 8.46866e+01 155.300 0.9663 
1 1 1 13  2   8  o 4  1.04840e+01 1.67778e+00 2.14648e+02 358.822 1.80871e+01  -3.71747e-01 0.00000e+00 0.00000e+00 1.74124e+02 358.822 4.05231e+01 178.823 0.9720 
1 1 1 13  2   9  o 13 4.19163e+00 1.32909e+00 8.43884e+01 44.807  2.59527e+00  2.57784e+00  0.00000e+00 0.00000e+00 5.13763e+01 44.807  3.30121e+01 224.807 0.8489 
1 1 1 13  2   10 o 13 1.04665e+01 1.99863e+00 1.98404e+02 222.481 -1.17946e+01 -1.08006e+01 0.00000e+00 0.00000e+00 1.88205e+02 222.481 1.01982e+01 42.481  0.9682 
1 1 1 13  2   11 o 5  4.30871e+00 1.44650e+00 4.28997e+01 231.046 -1.25114e+00 -1.54754e+00 0.00000e+00 0.00000e+00 7.15158e+01 231.046 2.86160e+01 231.046 0.6961 
1 1 1 13  3   0  o 6  2.49532e+01 1.23173e+00 4.43114e+02 222.045 -4.01790e+01 -3.62340e+01 0.00000e+00 0.00000e+00 4.97957e+02 222.045 5.48424e+01 222.045 0.9907 
1 1 1 13  3   1  o 7  1.08489e+01 1.62556e+00 1.54240e+02 6.614   7.70286e+00  8.93167e-01  0.00000e+00 0.00000e+00 2.31302e+02 6.614   7.70614e+01 6.614   0.9331 
1 1 1 13  3   2  o 9  1.03384e+01 1.69498e+00 2.24495e+02 217.333 -8.40587e+00 -6.41116e+00 0.00000e+00 0.00000e+00 1.50298e+02 217.333 7.41967e+01 37.333  0.9515 
1 1 1 13  3   3  o 2  1.59777e+01 1.74319e+00 2.20631e+02 89.784  6.79967e-02  1.80691e+01  0.00000e+00 0.00000e+00 3.71278e+02 89.784  1.50647e+02 89.784  0.9719 
1 1 1 13  3   4  o 17 1.57341e+01 1.79274e+00 2.71685e+02 216.385 -1.84794e+01 -1.36168e+01 0.00000e+00 0.00000e+00 3.15007e+02 216.385 4.33218e+01 216.385 0.9780 
1 1 1 13  3   5  o 7  5.45153e+00 1.77606e+00 4.30323e+01 178.262 -1.31493e+00 3.98885e-02  0.00000e+00 0.00000e+00 7.07178e+01 178.262 2.76856e+01 178.262 0.5471 
1 1 1 13  3   6  o 3  8.51619e+00 1.60072e+00 2.32331e+02 13.595  1.28108e+01  3.09799e+00  0.00000e+00 0.00000e+00 7.99389e+01 13.595  1.52392e+02 193.595 0.9613 
1 1 1 13  3   7  o 6  3.73339e+00 1.23563e+00 4.16312e+01 208.509 -1.22901e+00 -6.67558e-01 0.00000e+00 0.00000e+00 3.95594e+01 208.509 2.07180e+00 28.509  0.5700 
1 1 1 13  3   8  o 1  1.01667e+01 1.63752e+00 1.47739e+02 27.916  1.08920e+01  5.77095e+00  0.00000e+00 0.00000e+00 2.24059e+02 27.916  7.63199e+01 27.916  0.9585 
1 1 1 13  3   9  o 10 7.80132e+00 1.69440e+00 1.39634e+02 162.551 -8.82349e+00 2.77335e+00  0.00000e+00 0.00000e+00 1.41421e+02 162.551 1.78790e+00 162.551 0.9443 
1 1 1 13  3   10 o 18 1.10236e+01 1.82204e+00 1.67965e+02 251.544 -5.01069e+00 -1.50137e+01 0.00000e+00 0.00000e+00 2.39075e+02 251.544 7.11090e+01 251.544 0.9679 
1 1 1 13  3   11 o 10 5.66709e+00 1.74755e+00 1.12844e+02 182.966 -5.74147e+00 -2.97484e-01 0.00000e+00 0.00000e+00 8.35025e+01 182.966 2.93410e+01 2.966   0.9083 
1 1 1 13  4   0  o 9  2.42957e+01 1.22013e+00 3.92517e+02 78.439  1.02288e+01  5.00035e+01  0.00000e+00 0.00000e+00 5.23228e+02 78.439  1.30712e+02 78.439  0.9902 
1 1 1 13  4   1  o 15 5.64851e+00 1.56092e+00 1.75278e+02 359.406 4.67136e+00  -4.84302e-02 0.00000e+00 0.00000e+00 1.51427e+01 359.406 1.60136e+02 179.406 0.8852 
1 1 1 13  4   2  o 1  7.39525e+00 1.69493e+00 1.14780e+02 57.711  2.06500e+00  3.26787e+00  0.00000e+00 0.00000e+00 1.27022e+02 57.711  1.22423e+01 57.711  0.8582 
1 1 1 13  4   3  o 5  1.13054e+01 2.02538e+00 2.17355e+02 209.459 -9.93279e+00 -5.61038e+00 0.00000e+00 0.00000e+00 1.94216e+02 209.459 2.31397e+01 29.459  0.9551 
1 1 1 13  4   4  o 17 2.70221e+01 1.50471e+00 4.34766e+02 66.171  2.82266e+01  6.39112e+01  0.00000e+00 0.00000e+00 5.88123e+02 66.171  1.53357e+02 66.171  0.9928 
1 1 1 13  4   5  o 5  7.66638e+00 2.40631e+00 1.97108e+02 53.835  3.90041e+00  5.33599e+00  0.00000e+00 0.00000e+00 7.21374e+01 53.835  1.24971e+02 233.835 0.9209 
1 1 1 13  4   6  o 5  1.24229e+01 1.39973e+00 2.21834e+02 197.979 -1.89072e+01 -6.13572e+00 0.00000e+00 0.00000e+00 2.39953e+02 197.979 1.81187e+01 197.979 0.9745 
1 1 1 13  4   7  o 18 5.55927e+00 1.60518e+00 6.96136e+01 156.014 -2.69558e+00 1.19934e+00  0.00000e+00 0.00000e+00 1.01376e+02 156.014 3.17629e+01 156.014 0.8062 
1 1 1 13  4   8  o 3  1.26871e+01 1.54785e+00 2.25907e+02 329.312 2.11715e+01  -1.25646e+01 0.00000e+00 0.00000e+00 2.48194e+02 329.312 2.22875e+01 329.312 0.9795 
1 1 1 13  4   9  o 9  6.00120e+00 1.67653e+00 1.41429e+02 108.684 -2.33111e+00 6.89331e+00  0.00000e+00 0.00000e+00 7.11578e+01 108.684 7.02708e+01 288.684 0.9285 
1 1 1 13  4   10 o 12 1.31282e+01 1.71321e+00 2.11422e+02 128.261 -1.56747e+01 1.98754e+01  0.00000e+00 0.00000e+00 2.79419e+02 128.261 6.79965e+01 128.261 0.9800 
1 1 1 13  4   11 o 1  7.54601e+00 1.72727e+00 1.30951e+02 218.901 -6.99732e+00 -5.64639e+00 0.00000e+00 0.00000e+00 1.40380e+02 218.901 9.42900e+00 218.901 0.9426 
1 1 1 13  5   0  o 17 1.35017e+01 1.44752e+00 3.08388e+02 136.537 -1.52277e+01 1.44321e+01  0.00000e+00 0.00000e+00 1.93164e+02 136.537 1.15224e+02 316.537 0.9759 
1 1 1 13  5   1  o 18 6.05630e+00 1.64263e+00 2.42774e+02 149.773 -5.85440e+00 3.41107e+00  0.00000e+00 0.00000e+00 2.98962e+01 329.773 2.72671e+02 329.773 0.9229 
1 1 1 13  5   2  o 2  6.63985e+00 1.73975e+00 1.18583e+02 7.468   3.68960e+00  4.83661e-01  0.00000e+00 0.00000e+00 9.69297e+01 7.468   2.16531e+01 187.468 0.8519 
1 1 1 13  5   3  o 11 2.11403e+01 1.49223e+00 3.94424e+02 77.467  1.00677e+01  4.52897e+01  0.00000e+00 0.00000e+00 4.02616e+02 77.467  8.19166e+00 77.467  0.9892 
1 1 1 13  5   4  o 14 9.29728e+00 2.08943e+00 6.17813e+01 119.443 -1.35577e+00 2.40191e+00  0.00000e+00 0.00000e+00 2.18393e+02 119.443 1.56612e+02 119.443 0.7904 
1 1 1 13  5   5  o 13 4.70000e+00 2.08714e+00 1.42000e+02 347.609 3.23780e+00  -7.11328e-01 0.00000e+00 0.00000e+00 6.91865e+00 347.609 1.35082e+02 167.609 0.8308 
1 1 1 13  5   6  o 16 1.36029e+01 1.27786e+00 2.14005e+02 55.081  1.25818e+01  1.80229e+01  0.00000e+00 0.00000e+00 2.92918e+02 55.081  7.89131e+01 55.081  0.9770 
1 1 1 13  5   7  o 3  4.71915e+00 1.46459e+00 6.01042e+01 227.797 -1.54957e+00 -1.70878e+00 0.00000e+00 0.00000e+00 7.35203e+01 227.797 1.34161e+01 227.797 0.7422 
1 1 1 13  5   8  o 15 5.22720e+00 1.56337e+00 7.93758e+01 295.570 1.52600e+00  -3.18926e+00 0.00000e+00 0.00000e+00 8.87264e+01 295.570 9.35061e+00 295.570 0.8429 
1 1 1 13  5   9  o 13 5.50871e+00 1.62571e+00 1.24250e+02 303.775 3.35412e+00  -5.01497e+00 0.00000e+00 0.00000e+00 6.76040e+01 303.775 5.66457e+01 123.775 0.9129 
1 1 1 13  5   10 o 2  8.75574e+00 1.99127e+00 1.53520e+02 195.846 -9.99995e+00 -2.83829e+00 0.00000e+00 0.00000e+00 1.64007e+02 195.846 1.04874e+01 195.846 0.9506 
1 1 1 13  5   11 o 1  4.13338e+00 1.42102e+00 6.94585e+01 283.443 7.29220e-01  -3.05081e+00 0.00000e+00 0.00000e+00 5.97664e+01 283.443 9.69205e+00 103.443 0.8196 
1 1 1 13  6   0  o 9  2.07280e+01 1.22683e+00 3.75006e+02 352.093 4.11033e+01  -5.70896e+00 0.00000e+00 0.00000e+00 4.04449e+02 352.093 2.94437e+01 352.093 0.9879 
1 1 1 13  6   1  o 7  1.20571e+01 1.53060e+00 2.26041e+02 264.459 -1.25116e+00 -1.28971e+01 0.00000e+00 0.00000e+00 2.15054e+02 264.459 1.09866e+01 84.459  0.9606 
1 1 1 13  6   2  o 15 2.11297e+01 1.35630e+00 4.22775e+02 108.426 -1.49344e+01 4.48277e+01  0.00000e+00 0.00000e+00 3.73716e+02 108.426 4.90594e+01 288.425 0.9894 
1 1 1 13  6   3  o 8  1.31905e+01 1.83769e+00 1.92252e+02 250.874 -4.11893e+00 -1.18776e+01 0.00000e+00 0.00000e+00 2.90074e+02 250.874 9.78220e+01 250.874 0.9594 
1 1 1 13  6   4  o 15 2.92676e+01 1.49147e+00 5.16490e+02 63.859  3.97638e+01  8.10227e+01  0.00000e+00 0.00000e+00 5.93184e+02 63.859  7.66931e+01 63.859  0.9944 
1 1 1 13  6   5  o 19 7.29217e+00 2.29121e+00 4.37785e+01 236.775 -8.42101e-01 -1.28567e+00 0.00000e+00 0.00000e+00 1.24504e+02 236.775 8.07251e+01 236.775 0.6051 
1 1 1 13  6   6  o 7  5.19266e+00 1.46842e+00 1.98778e+02 168.770 -7.10687e+00 1.41105e+00  0.00000e+00 0.00000e+00 1.49382e+01 348.770 2.13716e+02 348.770 0.9282 
1 1 1 13  6   7  o 18 1.21494e+01 1.55823e+00 2.53307e+02 129.721 -1.53186e+01 1.84374e+01  0.00000e+00 0.00000e+00 2.00397e+02 129.721 5.29099e+01 309.721 0.9789 
1 1 1 13  6   8  o 3  6.91176e+00 1.81431e+00 1.11874e+02 357.021 5.78245e+00  -3.00926e-01 0.00000e+00 0.00000e+00 1.27811e+02 357.021 1.59363e+01 357.021 0.9090 
1 1 1 13  6   9  o 17 7.27460e+00 1.75818e+00 8.30978e+01 185.141 -4.93450e+00 -4.43978e-01 0.00000e+00 0.00000e+00 1.64548e+02 185.141 8.14506e+01 185.141 0.8923 
1 1 1 13  6   10 o 15 6.30301e+00 1.78815e+00 1.22282e+02 71.500  2.13254e+00  6.37346e+00  0.00000e+00 0.00000e+00 9.94805e+01 71.500  2.28014e+01 251.500 0.9223 
1 1 1 13  6   11 o 6  5.55000e+00 1.72889e+00 9.47900e+01 333.782 4.54554e+00  -2.23847e+00 0.00000e+00 0.00000e+00 9.46627e+01 333.782 1.27328e-01 153.782 0.8949 
1 1 1 13  7   0  f 0  3.32727e+01 1.30919e+00 4.84371e+02 291.474 3.08261e+01  -7.83618e+01 0.00000e+00 0.00000e+00 7.74602e+02 291.474 2.90230e+02 291.474 0.9940 
1 1 1 13  7   1  o 12 3.77739e+01 1.41779e+00 7.70190e+02 78.969  2.72706e+01  1.39896e+02  0.00000e+00 0.00000e+00 6.63317e+02 78.969  1.06873e+02 258.969 0.9965 
1 1 1 13  7   2  o 8  3.82616e+01 1.46891e+00 7.17301e+02 282.398 3.01846e+01  -1.37306e+02 0.00000e+00 0.00000e+00 7.35271e+02 282.398 1.79699e+01 282.398 0.9964 
1 1 1 13  7   3  o 2  6.90433e+00 1.91643e+00 1.47951e+02 91.197  -1.02910e-01 4.92335e+00  0.00000e+00 0.00000e+00 8.66757e+01 91.197  6.12755e+01 271.197 0.8916 
1 1 1 13  7   4  f 0  1.21324e+01 2.06076e+00 3.01299e+02 359.545 1.75381e+01  -1.39193e-01 0.00000e+00 0.00000e+00 1.47872e+02 359.545 1.53427e+02 179.545 0.9711 
1 1 1 13  7   5  o 15 1.11210e+01 2.06183e+00 1.89221e+02 19.769  1.04924e+01  3.77104e+00  0.00000e+00 0.00000e+00 2.15393e+02 19.769  2.61722e+01 19.769  0.9540 
1 1 1 13  7   6  o 3  1.78431e+01 1.16792e+00 2.59710e+02 97.026  -4.44992e+00 3.61040e+01  0.00000e+00 0.00000e+00 4.11453e+02 97.026  1.51743e+02 97.026  0.9862 
1 1 1 13  7   7  f 0  1.57576e+01 1.36520e+00 2.75095e+02 228.847 -2.42456e+01 -2.77416e+01 0.00000e+00 0.00000e+00 3.17803e+02 228.847 4.27081e+01 228.847 0.9863 
1 1 1 13  7   8  o 14 4.22077e+00 1.36113e+00 7.69563e+01 316.939 2.23639e+00  -2.08995e+00 0.00000e+00 0.00000e+00 5.41787e+01 316.939 2.27776e+01 136.939 0.8144 
1 1 1 13  7   9  o 14 6.12785e+00 1.69961e+00 9.79302e+01 257.054 -1.13770e+00 -4.94935e+00 0.00000e+00 0.00000e+00 1.11341e+02 257.054 1.34111e+01 257.054 0.8952 
1 1 1 13  7   10 o 5  6.81338e+00 1.92126e+00 1.14541e+02 348.340 6.15805e+00  -1.27083e+00 0.00000e+00 0.00000e+00 1.23701e+02 348.340 9.16018e+00 348.340 0.9166 
1 1 1 13  7   11 o 3  6.20763e+00 1.82232e+00 1.91714e+02 106.045 -2.98560e+00 1.03811e+01  0.00000e+00 0.00000e+00 3.38251e+01 106.045 1.57889e+02 286.045 0.9525 
1 1 1 13  8   0  o 16 9.61957e+00 1.64452e+00 1.08571e+02 190.393 -4.88346e+00 -8.95698e-01 0.00000e+00 0.00000e+00 2.18249e+02 190.393 1.09678e+02 190.393 0.8926 
1 1 1 13  8   1  f 0  1.20572e+01 1.48953e+00 2.04921e+02 133.148 -8.11456e+00 8.65697e+00  0.00000e+00 0.00000e+00 2.34455e+02 133.148 2.95344e+01 133.148 0.9569 
1 1 1 13  8   2  o 8  9.74668e+00 1.59139e+00 2.42677e+02 32.238  9.88095e+00  6.23150e+00  0.00000e+00 0.00000e+00 1.12396e+02 32.238  1.30281e+02 212.238 0.9562 
1 1 1 13  8   3  o 1  8.53852e+00 2.08469e+00 1.66594e+02 148.706 -5.64509e+00 3.43145e+00  0.00000e+00 0.00000e+00 1.33081e+02 148.706 3.35131e+01 328.706 0.9209 
1 1 1 13  8   4  o 15 1.24557e+01 2.61596e+00 1.72877e+02 61.578  3.97226e+00  7.33974e+00  0.00000e+00 0.00000e+00 2.72568e+02 61.578  9.96913e+01 61.578  0.9380 
1 1 1 13  8   5  o 8  5.88233e+00 1.42804e+00 1.88778e+02 202.309 -7.00618e+00 -2.87469e+00 0.00000e+00 0.00000e+00 2.01594e+01 202.309 1.68618e+02 22.309  0.9314 
1 1 1 13  8   6  o 12 1.03181e+01 1.48440e+00 1.90488e+02 239.216 -7.31729e+00 -1.22825e+01 0.00000e+00 0.00000e+00 1.89040e+02 239.216 1.44731e+00 59.216  0.9644 
1 1 1 13  8   7  o 4  1.22919e+01 1.52533e+00 2.06437e+02 11.951  1.96212e+01  4.15295e+00  0.00000e+00 0.00000e+00 2.50613e+02 11.951  4.41760e+01 11.951  0.9747 
1 1 1 13  8   8  o 18 5.34850e+00 1.51842e+00 5.05364e+01 32.585  2.04682e+00  1.30824e+00  0.00000e+00 0.00000e+00 1.03936e+02 32.585  5.34000e+01 32.585  0.7571 
1 1 1 13  8   9  o 9  9.25140e+00 1.78772e+00 1.64541e+02 97.356  -1.60629e+00 1.24417e+01  0.00000e+00 0.00000e+00 1.74021e+02 97.356  9.47993e+00 97.356  0.9593 
1 1 1 13  8   10 o 15 5.70881e+00 1.73378e+00 9.11962e+01 125.895 -2.74836e+00 3.79742e+00  0.00000e+00 0.00000e+00 1.01665e+02 125.895 1.04685e+01 125.895 0.8856 
1 1 1 13  8   11 o 18 9.76456e+00 2.07157e+00 1.94569e+02 41.320  1.10865e+01  9.74674e+00  0.00000e+00 0.00000e+00 1.65032e+02 41.320  2.95372e+01 221.320 0.9655 
1 1 1 13  9   0  o 10 8.72087e+00 1.63563e+00 8.83238e+01 90.277  -1.77345e-02 3.66903e+00  0.00000e+00 0.00000e+00 1.93652e+02 90.277  1.05328e+02 90.277  0.8495 
1 1 1 13  9   1  o 4  1.94950e+01 1.31669e+00 3.15940e+02 357.433 3.08957e+01  -1.38491e+00 0.00000e+00 0.00000e+00 4.14362e+02 357.433 9.84221e+01 357.433 0.9837 
1 1 1 13  9   2  o 2  5.93497e+00 1.56264e+00 1.95520e+02 272.493 2.51274e-01  -5.77115e+00 0.00000e+00 0.00000e+00 9.95769e+00 272.493 1.85562e+02 92.493  0.9087 
1 1 1 13  9   3  o 15 1.34713e+01 1.88492e+00 1.97379e+02 217.034 -1.05970e+01 -7.99519e+00 0.00000e+00 0.00000e+00 2.96311e+02 217.034 9.89329e+01 217.034 0.9616 
1 1 1 13  9   4  f 0  2.10073e+01 2.11402e+00 4.71819e+02 284.532 1.16839e+01  -4.50738e+01 0.00000e+00 0.00000e+00 3.20420e+02 284.532 1.51400e+02 104.532 0.9892 
1 1 1 13  9   5  o 15 1.90966e+01 1.07259e+00 3.38981e+02 48.808  3.28534e+01  3.75392e+01  0.00000e+00 0.00000e+00 3.81908e+02 48.808  4.29268e+01 48.808  0.9899 
1 1 1 13  9   6  o 8  5.04484e+00 1.50137e+00 1.25424e+02 1.808   4.56619e+00  1.44114e-01  0.00000e+00 0.00000e+00 4.43458e+01 1.808   8.10780e+01 181.808 0.8823 
1 1 1 13  9   7  o 14 5.53270e+00 1.53796e+00 9.92670e+01 136.434 -3.12606e+00 2.97337e+00  0.00000e+00 0.00000e+00 8.53178e+01 136.434 1.39492e+01 316.434 0.8746 
1 1 1 13  9   8  o 4  7.29999e+00 1.75818e+00 1.36375e+02 169.613 -7.75405e+00 1.42127e+00  0.00000e+00 0.00000e+00 1.23793e+02 169.613 1.25818e+01 349.613 0.9342 
1 1 1 13  9   9  o 8  6.62347e+00 1.82362e+00 1.25165e+02 249.677 -2.32512e+00 -6.27774e+00 0.00000e+00 0.00000e+00 1.07790e+02 249.677 1.73755e+01 69.677  0.9220 
1 1 1 13  9   10 o 16 6.71785e+00 1.84665e+00 1.15222e+02 138.162 -4.87445e+00 4.36402e+00  0.00000e+00 0.00000e+00 1.20549e+02 138.162 5.32724e+00 138.162 0.9200 
1 1 1 13  9   11 o 19 4.96745e+00 1.60336e+00 2.02172e+01 51.303  6.54643e-01  8.17230e-01  0.00000e+00 0.00000e+00 6.74742e+01 51.303  4.72570e+01 51.303  0.4628 
1 1 1 13  10  0  o 5  9.85452e+00 1.66846e+00 2.31712e+02 338.837 9.74251e+00  -3.77165e+00 0.00000e+00 0.00000e+00 1.24941e+02 338.837 1.06770e+02 158.837 0.9509 
1 1 1 13  10  1  o 3  1.56535e+01 1.36780e+00 2.18223e+02 73.024  4.98343e+00  1.63250e+01  0.00000e+00 0.00000e+00 3.60141e+02 73.024  1.41918e+02 73.024  0.9702 
1 1 1 13  10  2  f 0  7.46486e+00 1.58455e+00 5.88452e+01 163.644 -2.08311e+00 6.11345e-01  0.00000e+00 0.00000e+00 1.47038e+02 163.644 8.81926e+01 163.644 0.7239 
1 1 1 13  10  3  o 8  9.53804e+00 2.02904e+00 1.68930e+02 176.755 -7.61868e+00 4.31976e-01  0.00000e+00 0.00000e+00 1.69847e+02 176.755 9.16703e-01 176.755 0.9320 
1 1 1 13  10  4  o 1  1.73074e+01 2.22261e+00 2.14455e+02 44.260  1.19763e+01  1.16708e+01  0.00000e+00 0.00000e+00 4.25317e+02 44.260  2.10862e+02 44.260  0.9696 
1 1 1 13  10  5  o 7  5.54289e+00 1.52179e+00 1.81199e+02 188.052 -6.53928e+00 -9.25043e-01 0.00000e+00 0.00000e+00 1.34330e+01 188.052 1.67766e+02 8.052   0.9208 
1 1 1 13  10  6  o 10 6.21877e+00 1.60597e+00 8.41119e+01 278.772 5.51012e-01  -3.57087e+00 0.00000e+00 0.00000e+00 1.16735e+02 278.772 3.26235e+01 278.772 0.8468 
1 1 1 13  10  7  o 9  4.58183e+00 1.38376e+00 1.09423e+02 219.667 -3.16590e+00 -2.62534e+00 0.00000e+00 0.00000e+00 4.22313e+01 219.667 6.71921e+01 39.667  0.8677 
1 1 1 13  10  8  o 19 7.96721e+00 1.82915e+00 1.71343e+02 274.438 8.05320e-01  -1.03756e+01 0.00000e+00 0.00000e+00 1.17591e+02 274.438 5.37527e+01 94.438  0.9507 
1 1 1 13  10  9  o 17 8.25889e+00 1.78609e+00 7.60017e+01 60.356  2.55994e+00  4.49822e+00  0.00000e+00 0.00000e+00 2.06699e+02 60.356  1.30697e+02 60.356  0.8973 
1 1 1 13  10  10 o 16 6.48871e+00 1.79419e+00 1.16939e+02 244.229 -2.87631e+00 -5.95772e+00 0.00000e+00 0.00000e+00 1.11015e+02 244.229 5.92455e+00 64.229  0.9210 
1 1 1 13  10  11 o 6  6.89552e+00 1.95458e+00 1.90579e+02 353.768 1.09078e+01  -1.19108e+00 0.00000e+00 0.00000e+00 6.01344e+01 353.768 1.30445e+02 173.768 0.9533 
1 1 1 13  11  1  o 5  1.05808e+01 1.64136e+00 2.14150e+02 336.867 9.64942e+00  -4.12236e+00 0.00000e+00 0.00000e+00 1.69056e+02 336.867 4.50947e+01 156.867 0.9511 
1 1 1 13  11  2  o 19 1.08858e+01 1.94762e+00 1.57157e+02 82.577  9.89916e-01  7.59759e+00  0.00000e+00 0.00000e+00 2.29453e+02 82.577  7.22963e+01 82.577  0.9323 
1 1 1 13  11  3  o 10 1.52306e+01 1.81045e+00 3.19005e+02 313.930 1.72626e+01  -1.79195e+01 0.00000e+00 0.00000e+00 2.49654e+02 313.930 6.93504e+01 133.930 0.9797 
1 1 1 13  11  4  o 12 1.07764e+01 2.79891e+00 2.54766e+02 121.775 -5.21451e+00 8.41826e+00  0.00000e+00 0.00000e+00 1.34723e+02 121.775 1.20043e+02 301.775 0.9481 
1 1 1 13  11  5  o 18 1.73409e+01 1.12141e+00 3.58626e+02 317.498 3.51977e+01  -3.22550e+01 0.00000e+00 0.00000e+00 2.95650e+02 317.498 6.29757e+01 137.498 0.9895 
1 1 1 13  11  6  o 2  6.79460e+00 1.55132e+00 6.16328e+01 268.977 -5.28086e-02 -2.95785e+00 0.00000e+00 0.00000e+00 1.47455e+02 268.977 8.58218e+01 268.977 0.8069 
1 1 1 13  11  7  o 17 1.10552e+01 1.52001e+00 1.27998e+02 156.006 -9.98238e+00 4.44318e+00  0.00000e+00 0.00000e+00 2.73904e+02 156.006 1.45906e+02 156.006 0.9531 
1 1 1 13  11  8  o 11 6.26555e+00 1.70345e+00 9.45328e+01 198.736 -4.56966e+00 -1.54999e+00 0.00000e+00 0.00000e+00 1.17985e+02 198.736 2.34521e+01 198.736 0.8892 
1 1 1 13  11  9  o 7  9.89636e+00 1.85599e+00 1.82285e+02 272.704 6.74533e-01  -1.42830e+01 0.00000e+00 0.00000e+00 1.81776e+02 272.704 5.08766e-01 92.704  0.9644 
1 1 1 13  11  10 o 9  3.81007e+00 1.30144e+00 6.46063e+01 98.071  -4.03594e-01 2.84603e+00  0.00000e+00 0.00000e+00 5.16974e+01 98.071  1.29088e+01 278.071 0.8003 
1 1 1 13  11  11 o 10 7.57392e+00 2.07959e+00 7.73201e+01 154.589 -3.97305e+00 1.88744e+00  0.00000e+00 0.00000e+00 1.76095e+02 154.589 9.87751e+01 154.589 0.8773 
1 1 1 13  12  0  o 15 8.32256e+00 1.66124e+00 2.40417e+02 157.605 -8.46591e+00 3.48859e+00  0.00000e+00 0.00000e+00 5.85051e+01 157.605 1.81912e+02 337.605 0.9437 
1 1 1 13  12  1  o 12 5.07686e+00 1.49498e+00 6.18765e+00 53.449  9.02246e-02  1.21706e-01  0.00000e+00 0.00000e+00 8.41460e+00 53.449  2.22695e+00 53.449  0.0755 
1 1 1 13  12  2  o 18 6.72933e+00 2.23613e+00 1.51714e+02 24.286  3.77613e+00  1.70389e+00  0.00000e+00 0.00000e+00 7.10046e+01 24.286  8.07098e+01 204.286 0.8688 
1 1 1 13  12  3  o 11 1.96196e+01 1.53529e+00 4.28705e+02 155.995 -4.32025e+01 1.92397e+01  0.00000e+00 0.00000e+00 3.11033e+02 155.995 1.17672e+02 335.995 0.9894 
1 1 1 13  12  4  o 7  1.88318e+01 2.12767e+00 2.79432e+02 337.845 2.35604e+01  -9.59317e+00 0.00000e+00 0.00000e+00 4.24202e+02 337.845 1.44770e+02 337.845 0.9801 
1 1 1 13  12  5  o 6  1.47702e+01 1.18570e+00 2.41252e+02 242.068 -1.25323e+01 -2.36370e+01 0.00000e+00 0.00000e+00 3.11314e+02 242.068 7.00620e+01 242.068 0.9811 
1 1 1 13  12  6  o 6  8.01404e+00 1.50935e+00 1.36735e+02 181.753 -7.94979e+00 -2.43379e-01 0.00000e+00 0.00000e+00 1.48987e+02 181.753 1.22515e+01 181.753 0.9348 
1 1 1 13  12  7  o 10 1.38768e+01 1.29456e+00 2.30241e+02 48.214  1.81241e+01  2.02805e+01  0.00000e+00 0.00000e+00 2.89231e+02 48.214  5.89905e+01 48.214  0.9814 
1 1 1 13  12  8  o 4  8.11963e+00 1.77093e+00 1.37744e+02 208.940 -7.69105e+00 -4.25266e+00 0.00000e+00 0.00000e+00 1.53786e+02 208.940 1.60414e+01 208.940 0.9413 
1 1 1 13  12  9  o 18 1.34366e+01 1.63110e+00 2.18377e+02 80.726  4.11599e+00  2.52065e+01  0.00000e+00 0.00000e+00 2.84027e+02 80.726  6.56496e+01 80.726  0.9802 
1 1 1 13  12  10 o 6  7.80994e+00 1.93097e+00 1.11170e+02 153.666 -6.25121e+00 3.09410e+00  0.00000e+00 0.00000e+00 1.64457e+02 153.666 5.32870e+01 153.666 0.9253 
1 1 1 13  12  11 o 10 5.46696e+00 1.73730e+00 7.74603e+01 190.923 -3.84087e+00 -7.41243e-01 0.00000e+00 0.00000e+00 1.01860e+02 190.923 2.43995e+01 190.923 0.8600 
1 1 1 13  13  0  f 0  1.53148e+01 1.29236e+00 2.08257e+02 304.929 9.22188e+00  -1.32050e+01 0.00000e+00 0.00000e+00 3.56205e+02 304.929 1.47949e+02 304.929 0.9684 
1 1 1 13  13  1  o 18 6.29088e+00 1.66471e+00 8.34823e+01 33.110  2.02046e+00  1.31761e+00  0.00000e+00 0.00000e+00 9.73914e+01 33.110  1.39091e+01 33.110  0.7551 
1 1 1 13  13  2  o 11 1.69787e+01 1.43090e+00 3.05565e+02 164.265 -2.62312e+01 7.39074e+00  0.00000e+00 0.00000e+00 3.29238e+02 164.265 2.36727e+01 164.265 0.9815 
1 1 1 13  13  3  o 3  1.04056e+01 2.01275e+00 2.01406e+02 32.748  8.69808e+00  5.59435e+00  0.00000e+00 0.00000e+00 1.75442e+02 32.748  2.59634e+01 212.748 0.9503 
1 1 1 13  13  4  o 1  9.93894e+00 2.11605e+00 2.43632e+02 277.056 1.44373e+00  -1.16635e+01 0.00000e+00 0.00000e+00 1.18742e+02 277.056 1.24889e+02 97.056  0.9565 
1 1 1 13  13  5  o 5  5.18443e+00 1.45844e+00 1.90351e+02 6.116   6.67293e+00  7.15062e-01  0.00000e+00 0.00000e+00 8.06134e+00 186.116 1.98413e+02 186.116 0.9222 
1 1 1 13  13  6  o 5  5.48699e+00 1.50805e+00 1.74538e+02 197.654 -6.62440e+00 -2.10821e+00 0.00000e+00 0.00000e+00 1.90195e+01 197.654 1.55518e+02 17.654  0.9250 
1 1 1 13  13  7  o 13 9.94399e+00 1.60922e+00 1.89780e+02 199.118 -1.32116e+01 -4.57960e+00 0.00000e+00 0.00000e+00 1.75671e+02 199.118 1.41095e+01 19.118  0.9636 
1 1 1 13  13  8  f 0  3.82179e+00 1.29192e+00 1.05073e+02 301.278 2.09769e+00  -3.45304e+00 0.00000e+00 0.00000e+00 2.10323e+01 301.278 8.40404e+01 121.278 0.8651 
1 1 1 13  13  9  o 4  9.10207e+00 2.14310e+00 1.75606e+02 131.898 -7.03212e+00 7.83800e+00  0.00000e+00 0.00000e+00 1.54661e+02 131.898 2.09450e+01 311.898 0.9513 
1 1 1 13  13  10 o 8  8.03467e+00 1.99560e+00 2.27315e+02 229.368 -9.16502e+00 -1.06808e+01 0.00000e+00 0.00000e+00 6.80447e+01 229.368 1.59270e+02 49.368  0.9638 
1 1 1 13  13  11 o 8  5.97049e+00 1.80221e+00 1.56077e+02 27.158  7.35853e+00  3.77495e+00  0.00000e+00 0.00000e+00 5.73755e+01 27.158  9.87012e+01 207.158 0.9374 
1 1 1 13  14  0  o 18 1.00675e+01 1.55740e+00 1.25888e+02 53.207  3.60074e+00  4.81440e+00  0.00000e+00 0.00000e+00 2.23742e+02 53.207  9.78537e+01 53.207  0.9125 
1 1 1 13  14  1  o 15 9.09906e+00 1.69255e+00 1.62406e+02 121.724 -3.72301e+00 6.02240e+00  0.00000e+00 0.00000e+00 1.58556e+02 121.724 3.85033e+00 301.724 0.9264 
1 1 1 13  14  2  o 17 7.33900e+00 1.66848e+00 1.45329e+02 175.980 -5.59671e+00 3.93289e-01  0.00000e+00 0.00000e+00 1.07909e+02 175.980 3.74204e+01 355.980 0.9058 
1 1 1 13  14  3  o 14 1.52878e+01 1.70006e+00 2.62768e+02 359.914 2.22327e+01  -3.32445e-02 0.00000e+00 0.00000e+00 3.06541e+02 359.914 4.37736e+01 359.914 0.9772 
1 1 1 13  14  4  o 14 5.08321e+00 1.63850e+00 1.15301e+02 224.506 -2.43033e+00 -2.38877e+00 0.00000e+00 0.00000e+00 4.67115e+01 224.506 6.85894e+01 44.506  0.8361 
1 1 1 13  14  5  o 19 1.60130e+01 1.14492e+00 3.45657e+02 354.793 4.18833e+01  -3.81711e+00 0.00000e+00 0.00000e+00 2.57579e+02 354.793 8.80785e+01 174.793 0.9880 
1 1 1 13  14  6  o 5  8.30166e+00 1.60442e+00 9.51714e+01 293.887 2.22880e+00  -5.03254e+00 0.00000e+00 0.00000e+00 1.90986e+02 293.887 9.58143e+01 293.887 0.9039 
1 1 1 13  14  7  o 17 1.64422e+01 1.24456e+00 2.95383e+02 33.041  3.69999e+01  2.40656e+01  0.00000e+00 0.00000e+00 3.24572e+02 33.041  2.91896e+01 33.041  0.9886 
1 1 1 13  14  8  o 9  5.94703e+00 1.52044e+00 5.15696e+01 71.520  8.70399e-01  2.60434e+00  0.00000e+00 0.00000e+00 1.27469e+02 71.520  7.58994e+01 71.520  0.7893 
1 1 1 13  14  9  o 19 6.09267e+00 1.62042e+00 1.84992e+02 268.818 -2.03436e-01 -9.85647e+00 0.00000e+00 0.00000e+00 3.52758e+01 268.818 1.49716e+02 88.818  0.9478 
1 1 1 13  14  10 o 9  7.42378e+00 1.87285e+00 1.13506e+02 126.659 -4.16648e+00 5.59811e+00  0.00000e+00 0.00000e+00 1.48485e+02 126.659 3.49790e+01 126.659 0.9253 
1 1 1 13  14  11 o 15 5.46841e+00 1.73808e+00 1.24766e+02 188.482 -6.22604e+00 -9.28462e-01 0.00000e+00 0.00000e+00 6.64069e+01 188.482 5.83593e+01 8.482   0.9167 
1 1 1 13  15  0  o 12 9.98102e+00 1.55475e+00 1.59164e+02 235.977 -4.21580e+00 -6.24483e+00 0.00000e+00 0.00000e+00 1.94483e+02 235.977 3.53190e+01 235.977 0.9311 
1 1 1 13  15  1  o 3  1.21983e+01 1.55067e+00 2.21591e+02 182.473 -1.34908e+01 -5.82618e-01 0.00000e+00 0.00000e+00 2.25309e+02 182.473 3.71731e+00 182.473 0.9622 
1 1 1 13  15  2  o 11 1.87436e+01 1.19155e+00 2.80026e+02 307.723 1.95441e+01  -2.52665e+01 0.00000e+00 0.00000e+00 4.22667e+02 307.723 1.42641e+02 307.723 0.9842 
1 1 1 13  15  3  o 1  1.42670e+01 1.77898e+00 3.02418e+02 154.340 -2.08990e+01 1.00402e+01  0.00000e+00 0.00000e+00 2.29367e+02 154.340 7.30503e+01 334.339 0.9782 
1 1 1 13  15  4  o 18 9.03351e+00 2.08194e+00 1.24516e+02 223.601 -4.20891e+00 -4.00818e+00 0.00000e+00 0.00000e+00 1.88594e+02 223.601 6.40784e+01 223.601 0.9093 
1 1 1 13  15  5  o 12 1.72818e+01 1.09525e+00 3.68843e+02 358.974 5.15155e+01  -9.22445e-01 0.00000e+00 0.00000e+00 2.83621e+02 358.974 8.52218e+01 178.974 0.9902 
1 1 1 13  15  6  o 12 1.77576e+01 1.13759e+00 3.22824e+02 221.584 -3.60513e+01 -3.19894e+01 0.00000e+00 0.00000e+00 3.47272e+02 221.584 2.44487e+01 221.584 0.9896 
1 1 1 13  15  7  f 0  6.74141e+00 1.68681e+00 4.32615e+01 38.392  1.69531e+00  1.34328e+00  0.00000e+00 0.00000e+00 1.42575e+02 38.392  9.93136e+01 38.392  0.7228 
1 1 1 13  15  8  o 4  9.49119e+00 1.75156e+00 1.06162e+02 46.535  5.49456e+00  5.79707e+00  0.00000e+00 0.00000e+00 2.32355e+02 46.535  1.26193e+02 46.535  0.9351 
1 1 1 13  15  9  o 8  1.35597e+01 1.56717e+00 2.64294e+02 169.482 -3.17014e+01 5.88590e+00  0.00000e+00 0.00000e+00 2.44801e+02 169.482 1.94928e+01 349.482 0.9844 
1 1 1 13  15  10 o 17 7.09209e+00 1.94188e+00 9.55336e+01 79.607  9.71490e-01  5.29704e+00  0.00000e+00 0.00000e+00 1.48338e+02 79.607  5.28046e+01 79.607  0.9016 
1 1 1 13  15  11 o 4  4.97950e+00 1.60233e+00 8.35825e+01 12.993  4.27250e+00  9.85843e-01  0.00000e+00 0.00000e+00 8.29209e+01 12.993  6.61585e-01 192.993 0.8768 
1 1 1 13  16  0  o 12 1.82586e+01 1.26551e+00 2.13636e+02 259.258 -3.71847e+00 -1.96003e+01 0.00000e+00 0.00000e+00 4.63532e+02 259.258 2.49896e+02 259.258 0.9746 
1 1 1 13  16  1  o 1  1.14154e+01 1.48541e+00 2.30056e+02 150.871 -1.16660e+01 6.50103e+00  0.00000e+00 0.00000e+00 1.87957e+02 150.871 4.20988e+01 330.870 0.9618 
1 1 1 13  16  2  o 4  2.13046e+01 1.11308e+00 4.16738e+02 210.672 -4.74091e+01 -2.81185e+01 0.00000e+00 0.00000e+00 3.87342e+02 210.672 2.93962e+01 30.672  0.9909 
1 1 1 13  16  3  o 7  5.97137e+00 1.68236e+00 7.82299e+01 75.372  6.59738e-01  2.52770e+00  0.00000e+00 0.00000e+00 9.84892e+01 75.372  2.02593e+01 75.372  0.7767 
1 1 1 13  16  4  o 11 1.88654e+01 1.70809e+00 2.62967e+02 352.994 2.95370e+01  -3.62968e+00 0.00000e+00 0.00000e+00 4.43902e+02 352.994 1.80935e+02 352.994 0.9831 
1 1 1 13  16  5  o 10 1.74869e+01 1.09053e+00 3.10614e+02 219.242 -3.40167e+01 -2.77853e+01 0.00000e+00 0.00000e+00 3.48433e+02 219.242 3.78190e+01 219.242 0.9885 
1 1 1 13  16  6  o 2  1.35368e+01 1.27903e+00 2.06825e+02 71.341  7.13361e+00  2.11252e+01  0.00000e+00 0.00000e+00 2.97647e+02 71.341  9.08216e+01 71.341  0.9773 
1 1 1 13  16  7  o 6  5.50979e+00 1.57042e+00 1.13454e+02 140.832 -3.79557e+00 3.09200e+00  0.00000e+00 0.00000e+00 7.37474e+01 140.832 3.97062e+01 320.832 0.8909 
1 1 1 13  16  8  f 0  1.35443e+01 1.49444e+00 2.10679e+02 132.009 -1.66400e+01 1.84746e+01  0.00000e+00 0.00000e+00 2.95390e+02 132.009 8.47111e+01 132.009 0.9797 
1 1 1 13  16  9  o 2  4.83144e+00 1.52602e+00 1.35578e+02 327.034 5.17895e+00  -3.35893e+00 0.00000e+00 0.00000e+00 3.30202e+01 327.034 1.02558e+02 147.034 0.9150 
1 1 1 13  16  10 o 9  5.61292e+00 1.68803e+00 6.10680e+01 218.935 -2.47235e+00 -1.99742e+00 0.00000e+00 0.00000e+00 1.14966e+02 218.935 5.38980e+01 218.935 0.8224 
1 1 1 13  16  11 o 2  5.55095e+00 1.75177e+00 7.69160e+01 327.876 3.45976e+00  -2.17228e+00 0.00000e+00 0.00000e+00 1.06544e+02 327.876 2.96285e+01 327.876 0.8667 
1 1 1 13  17  0  o 17 6.04149e+00 1.62482e+00 6.23841e+01 344.922 1.77928e+00  -4.79335e-01 0.00000e+00 0.00000e+00 9.16843e+01 344.922 2.93002e+01 344.922 0.6702 
1 1 1 13  17  1  f 0  9.83445e+00 1.43121e+00 2.91388e+02 239.641 -7.61349e+00 -1.29983e+01 0.00000e+00 0.00000e+00 7.03704e+01 239.641 2.21017e+02 59.641  0.9662 
1 1 1 13  17  2  o 10 2.35167e+01 1.40080e+00 4.18577e+02 141.174 -4.51073e+01 3.63007e+01  0.00000e+00 0.00000e+00 4.69344e+02 141.174 5.07669e+01 141.174 0.9913 
1 1 1 13  17  3  o 8  9.23733e+00 2.02498e+00 1.78687e+02 337.768 7.52038e+00  -3.07397e+00 0.00000e+00 0.00000e+00 1.50839e+02 337.768 2.78478e+01 157.768 0.9363 
1 1 1 13  17  4  o 19 2.34186e+01 1.59684e+00 4.25481e+02 161.716 -5.91742e+01 1.95516e+01  0.00000e+00 0.00000e+00 4.59892e+02 161.716 3.44115e+01 161.716 0.9919 
1 1 1 13  17  5  o 6  1.42955e+01 1.18287e+00 2.40220e+02 245.403 -1.11932e+01 -2.44509e+01 0.00000e+00 0.00000e+00 2.94534e+02 245.403 5.43141e+01 245.403 0.9812 
1 1 1 13  17  6  o 16 9.47469e+00 1.61355e+00 1.44192e+02 114.944 -3.99743e+00 8.59451e+00  0.00000e+00 0.00000e+00 1.97454e+02 114.944 5.32615e+01 114.944 0.9457 
1 1 1 13  17  7  o 7  1.29992e+01 1.47199e+00 2.29611e+02 287.639 7.07735e+00  -2.22580e+01 0.00000e+00 0.00000e+00 2.55381e+02 287.639 2.57708e+01 287.639 0.9784 
1 1 1 13  17  8  o 7  5.69286e+00 1.60466e+00 1.47820e+02 31.017  5.94326e+00  3.57354e+00  0.00000e+00 0.00000e+00 5.29638e+01 31.017  9.48561e+01 211.017 0.9248 
1 1 1 13  17  9  o 12 5.18407e+00 1.58704e+00 7.27965e+01 20.566  3.21800e+00  1.20742e+00  0.00000e+00 0.00000e+00 9.28327e+01 20.566  2.00362e+01 20.566  0.8377 
1 1 1 13  17  10 o 18 4.31680e+00 1.41754e+00 1.30670e+02 196.374 -5.89052e+00 -1.73081e+00 0.00000e+00 0.00000e+00 1.98732e+01 196.374 1.10797e+02 16.374  0.9145 
1 1 1 13  17  11 o 10 7.38817e+00 2.02387e+00 1.49368e+02 133.861 -6.15305e+00 6.40267e+00  0.00000e+00 0.00000e+00 1.15978e+02 133.861 3.33902e+01 313.861 0.9419 
1 1 1 13  18  0  o 8  1.41177e+01 1.35247e+00 1.83845e+02 203.128 -1.26041e+01 -5.38339e+00 0.00000e+00 0.00000e+00 3.33355e+02 203.128 1.49510e+02 203.128 0.9628 
1 1 1 13  18  1  o 14 1.22942e+01 1.52663e+00 2.41289e+02 157.299 -1.39730e+01 5.84538e+00  0.00000e+00 0.00000e+00 2.11016e+02 157.299 3.02734e+01 337.299 0.9664 
1 1 1 13  18  2  o 18 7.99111e+00 1.98077e+00 9.24879e+01 219.404 -2.75162e+00 -2.26052e+00 0.00000e+00 0.00000e+00 1.64451e+02 219.404 7.19632e+01 219.404 0.8442 
1 1 1 13  18  3  o 3  8.10751e+00 1.81492e+00 1.89428e+02 44.720  5.73507e+00  5.67931e+00  0.00000e+00 0.00000e+00 9.96447e+01 44.720  8.97831e+01 224.720 0.9358 
1 1 1 13  18  4  o 8  1.28329e+01 1.94248e+00 2.15160e+02 310.362 9.41114e+00  -1.10728e+01 0.00000e+00 0.00000e+00 2.56783e+02 310.362 4.16232e+01 310.362 0.9650 
1 1 1 13  18  5  o 13 6.11386e+00 1.53641e+00 1.10280e+02 42.812  3.38434e+00  3.13525e+00  0.00000e+00 0.00000e+00 9.56513e+01 42.812  1.46287e+01 222.812 0.8836 
1 1 1 13  18  6  o 11 1.34166e+01 1.43424e+00 2.39738e+02 43.900  1.87377e+01  1.80316e+01  0.00000e+00 0.00000e+00 2.61880e+02 43.900  2.21425e+01 43.900  0.9806 
1 1 1 13  18  7  o 10 1.22535e+01 1.49753e+00 1.85999e+02 213.745 -1.46503e+01 -9.78705e+00 0.00000e+00 0.00000e+00 2.67803e+02 213.745 8.18045e+01 213.745 0.9712 
1 1 1 13  18  8  o 5  1.07530e+01 1.64169e+00 1.91621e+02 92.680  -8.27691e-01 1.76797e+01  0.00000e+00 0.00000e+00 2.06694e+02 92.680  1.50733e+01 92.680  0.9713 
1 1 1 13  18  9  o 6  5.99405e+00 1.66711e+00 1.55158e+02 326.496 7.00063e+00  -4.63439e+00 0.00000e+00 0.00000e+00 5.93496e+01 326.496 9.58087e+01 146.496 0.9384 
1 1 1 13  18  10 o 15 5.57618e+00 1.65123e+00 9.38478e+01 203.738 -4.53618e+00 -1.99479e+00 0.00000e+00 0.00000e+00 9.58989e+01 203.738 2.05112e+00 203.738 0.8923 
1 1 1 13  18  11 o 1  4.76668e+00 1.60117e+00 1.21881e+02 70.372  2.05190e+00  5.75335e+00  0.00000e+00 0.00000e+00 4.42390e+01 70.372  7.76424e+01 250.372 0.9140 
1 1 1 13  19  0  o 5  1.85642e+01 1.27507e+00 3.24843e+02 342.433 3.15643e+01  -9.99263e+00 0.00000e+00 0.00000e+00 3.70745e+02 342.433 4.59017e+01 342.433 0.9848 
1 1 1 13  19  1  o 14 7.18474e+00 1.89897e+00 1.79863e+02 261.739 -9.01790e-01 -6.21138e+00 0.00000e+00 0.00000e+00 7.07901e+01 261.739 1.09072e+02 81.739  0.9165 
1 1 1 13  19  2  o 10 2.31062e+01 1.41547e+00 4.37622e+02 113.129 -2.32034e+01 5.43224e+01  0.00000e+00 0.00000e+00 4.34868e+02 113.129 2.75380e+00 293.129 0.9915 
1 1 1 13  19  3  o 2  5.87757e+00 1.76695e+00 8.61305e+01 53.940  1.59149e+00  2.18569e+00  0.00000e+00 0.00000e+00 8.97500e+01 53.940  3.61942e+00 53.940  0.7855 
1 1 1 13  19  4  o 13 1.50449e+01 1.83544e+00 2.28771e+02 341.907 1.79266e+01  -5.85684e+00 0.00000e+00 0.00000e+00 3.29170e+02 341.907 1.00399e+02 341.907 0.9731 
1 1 1 13  19  5  o 2  8.29367e+00 1.52128e+00 2.18886e+02 229.541 -8.10211e+00 -9.50023e+00 0.00000e+00 0.00000e+00 8.43248e+01 229.541 1.34561e+02 49.541  0.9591 
1 1 1 13  19  6  o 17 6.92449e+00 1.62226e+00 4.23535e+01 180.520 -2.17619e+00 -1.97392e-02 0.00000e+00 0.00000e+00 1.48971e+02 180.520 1.06617e+02 180.520 0.7247 
1 1 1 13  19  7  o 17 1.19877e+01 1.48749e+00 2.68775e+02 358.958 2.65560e+01  -4.83011e-01 0.00000e+00 0.00000e+00 1.79641e+02 358.958 8.91340e+01 178.958 0.9810 
1 1 1 13  19  8  o 12 4.81865e+00 1.47270e+00 1.06492e+02 181.478 -4.81880e+00 -1.24301e-01 0.00000e+00 0.00000e+00 5.68726e+01 181.478 4.96191e+01 1.478   0.8890 
1 1 1 13  19  9  o 12 9.93568e+00 1.72615e+00 1.45321e+02 50.211  8.05993e+00  9.67775e+00  0.00000e+00 0.00000e+00 2.18197e+02 50.211  7.28754e+01 50.211  0.9594 
1 1 1 13  19  10 o 12 3.96239e+00 1.34317e+00 1.24429e+02 190.881 -5.50593e+00 -1.05836e+00 0.00000e+00 0.00000e+00 1.24277e+01 190.881 1.12001e+02 10.881  0.9058 
1 1 1 13  19  11 o 15 1.29715e+01 2.08888e+00 1.18616e+02 27.889  1.05035e+01  5.55867e+00  0.00000e+00 0.00000e+00 3.54660e+02 27.889  2.36043e+02 27.889  0.9570 
1 1 1 13  20  0  o 10 1.43269e+01 1.44957e+00 2.70519e+02 44.996  1.43148e+01  1.43125e+01  0.00000e+00 0.00000e+00 2.60931e+02 44.996  9.58800e+00 224.995 0.9750 
1 1 1 13  20  1  o 15 2.22776e+01 1.53957e+00 4.90823e+02 182.104 -5.98334e+01 -2.19847e+00 0.00000e+00 0.00000e+00 3.50065e+02 182.104 1.40759e+02 2.104   0.9916 
1 1 1 13  20  2  o 8  1.74026e+01 1.51891e+00 2.55909e+02 98.290  -3.78686e+00 2.59903e+01  0.00000e+00 0.00000e+00 3.94069e+02 98.290  1.38160e+02 98.290  0.9808 
1 1 1 13  20  3  o 17 1.76680e+01 1.59130e+00 3.21313e+02 329.372 2.77166e+01  -1.64095e+01 0.00000e+00 0.00000e+00 3.41233e+02 329.372 1.99196e+01 329.372 0.9844 
1 1 1 13  20  4  o 11 1.07771e+01 1.38239e+00 2.40359e+02 144.815 -1.46811e+01 1.03505e+01  0.00000e+00 0.00000e+00 1.58731e+02 144.815 8.16277e+01 324.815 0.9718 
1 1 1 13  20  5  o 12 1.90545e+01 1.03483e+00 3.66481e+02 187.181 -5.69359e+01 -7.17300e+00 0.00000e+00 0.00000e+00 3.53464e+02 187.181 1.30169e+01 7.181   0.9912 
1 1 1 13  20  6  o 11 9.97748e+00 1.67005e+00 1.66853e+02 104.451 -2.98145e+00 1.15693e+01  0.00000e+00 0.00000e+00 1.97246e+02 104.451 3.03927e+01 104.451 0.9572 
1 1 1 13  20  7  o 4  7.19764e+00 1.69529e+00 1.41477e+02 192.429 -7.42005e+00 -1.63540e+00 0.00000e+00 0.00000e+00 1.14207e+02 192.429 2.72701e+01 12.429  0.9317 
1 1 1 13  20  8  o 8  1.55611e+01 1.34836e+00 2.37434e+02 84.844  3.32580e+00  3.68571e+01  0.00000e+00 0.00000e+00 3.47863e+02 84.844  1.10430e+02 84.844  0.9864 
1 1 1 13  20  9  o 10 4.91602e+00 1.50125e+00 4.71200e+00 270.961 3.79486e-03  -2.26132e-01 0.00000e+00 0.00000e+00 1.63516e+01 270.961 1.16396e+01 270.961 0.1124 
1 1 1 13  20  10 o 17 1.06449e+01 1.95002e+00 1.35236e+02 215.441 -9.29976e+00 -6.61891e+00 0.00000e+00 0.00000e+00 2.52440e+02 215.441 1.17203e+02 215.441 0.9551 
1 1 1 13  20  11 o 16 4.70558e+00 1.55694e+00 6.06850e+01 98.728  -4.75202e-01 3.09530e+00  0.00000e+00 0.00000e+00 8.62910e+01 98.728  2.56060e+01 98.728  0.8193 
1 1 1 13  21  0  o 18 1.02195e+01 1.44319e+00 2.52774e+02 272.091 5.32816e-01  -1.45933e+01 0.00000e+00 0.00000e+00 1.22463e+02 272.091 1.30312e+02 92.091  0.9651 
1 1 1 13  21  1  o 17 5.73055e+00 1.71504e+00 9.51981e+01 305.767 1.68975e+00  -2.34575e+00 0.00000e+00 0.00000e+00 7.96466e+01 305.767 1.55515e+01 125.767 0.8016 
1 1 1 13  21  2  o 9  2.18065e+01 1.38417e+00 3.52148e+02 64.321  2.04956e+01  4.26267e+01  0.00000e+00 0.00000e+00 4.69409e+02 64.321  1.17262e+02 64.321  0.9894 
1 1 1 13  21  3  o 9  3.10522e+01 1.47578e+00 5.33951e+02 239.818 -5.13848e+01 -8.83502e+01 0.00000e+00 0.00000e+00 6.43139e+02 239.818 1.09188e+02 239.818 0.9951 
1 1 1 13  21  4  o 4  1.03047e+01 1.33322e+00 1.99607e+02 46.246  1.00276e+01  1.04734e+01  0.00000e+00 0.00000e+00 1.79266e+02 46.246  2.03411e+01 226.246 0.9649 
1 1 1 13  21  5  f 0  9.45359e+00 1.41582e+00 1.39535e+02 307.146 5.70563e+00  -7.53156e+00 0.00000e+00 0.00000e+00 2.01151e+02 307.146 6.16162e+01 307.146 0.9455 
1 1 1 13  21  6  o 18 1.02285e+01 1.70834e+00 1.51459e+02 131.830 -7.27938e+00 8.13292e+00  0.00000e+00 0.00000e+00 2.20157e+02 131.830 6.86980e+01 131.830 0.9530 
1 1 1 13  21  7  o 14 5.59759e+00 1.59445e+00 6.21101e+01 194.570 -2.72429e+00 -7.08113e-01 0.00000e+00 0.00000e+00 1.07623e+02 194.570 4.55130e+01 194.570 0.7953 
1 1 1 13  21  8  o 18 5.23424e+00 1.56114e+00 1.38264e+02 237.176 -3.41552e+00 -5.29496e+00 0.00000e+00 0.00000e+00 4.47088e+01 237.176 9.35554e+01 57.176  0.9168 
1 1 1 13  21  9  o 10 8.11308e+00 1.74815e+00 1.17364e+02 270.700 9.88280e-02  -8.08426e+00 0.00000e+00 0.00000e+00 1.72169e+02 270.700 5.48053e+01 270.700 0.9359 
1 1 1 13  21  10 o 5  4.77630e+00 1.56124e+00 5.67764e+01 95.491  -2.66385e-01 2.77128e+00  0.00000e+00 0.00000e+00 8.75735e+01 95.491  3.07971e+01 95.491  0.7927 
1 1 1 13  21  11 o 11 6.88384e+00 1.94117e+00 2.03277e+02 352.200 1.18642e+01  -1.62514e+00 0.00000e+00 0.00000e+00 4.79470e+01 352.200 1.55330e+02 172.200 0.9573 
1 1 1 13  22  0  o 6  1.33468e+01 1.39085e+00 2.03629e+02 102.340 -3.33127e+00 1.52273e+01  0.00000e+00 0.00000e+00 2.87543e+02 102.340 8.39138e+01 102.340 0.9674 
1 1 1 13  22  1  o 11 5.49157e+00 1.74660e+00 1.27142e+02 173.289 -3.63030e+00 4.27145e-01  0.00000e+00 0.00000e+00 5.02736e+01 173.289 7.68686e+01 353.289 0.8488 
1 1 1 13  22  2  o 5  6.69693e+00 1.81412e+00 1.08613e+02 178.202 -3.87346e+00 1.21580e-01  0.00000e+00 0.00000e+00 1.10319e+02 178.202 1.70628e+00 178.202 0.8586 
1 1 1 13  22  3  f 0  7.09691e+00 1.85044e+00 1.34768e+02 278.973 8.01281e-01  -5.07474e+00 0.00000e+00 0.00000e+00 1.07579e+02 278.973 2.71888e+01 98.973  0.8965 
1 1 1 13  22  4  o 2  1.26619e+01 1.18378e+00 1.81516e+02 27.507  1.53102e+01  7.97226e+00  0.00000e+00 0.00000e+00 2.86753e+02 27.507  1.05236e+02 27.507  0.9706 
1 1 1 13  22  5  o 15 1.06371e+01 1.33195e+00 1.61631e+02 49.212  8.68077e+00  1.00611e+01  0.00000e+00 0.00000e+00 2.28211e+02 49.212  6.65808e+01 49.212  0.9616 
1 1 1 13  22  6  o 9  5.36590e+00 1.58688e+00 9.33264e+01 8.500   3.80752e+00  5.69072e-01  0.00000e+00 0.00000e+00 8.20708e+01 8.500   1.12556e+01 188.500 0.8575 
1 1 1 13  22  7  o 12 7.79214e+00 1.64419e+00 1.30390e+02 192.558 -7.82752e+00 -1.74370e+00 0.00000e+00 0.00000e+00 1.47491e+02 192.558 1.71011e+01 192.558 0.9354 
1 1 1 13  22  8  o 1  1.46132e+01 1.39609e+00 2.62937e+02 47.413  2.46134e+01  2.67789e+01  0.00000e+00 0.00000e+00 2.86510e+02 47.413  2.35726e+01 47.413  0.9862 
1 1 1 13  22  9  o 7  1.48137e+01 1.87980e+00 2.17923e+02 121.338 -1.31115e+01 2.15326e+01  0.00000e+00 0.00000e+00 3.35567e+02 121.338 1.17644e+02 121.338 0.9800 
1 1 1 13  22  10 o 14 1.50070e+01 1.77674e+00 2.74749e+02 66.362  1.48700e+01  3.39752e+01  0.00000e+00 0.00000e+00 2.89631e+02 66.362  1.48817e+01 66.362  0.9864 
1 1 1 13  22  11 o 12 5.14175e+00 1.66689e+00 1.37297e+02 206.735 -6.22451e+00 -3.13539e+00 0.00000e+00 0.00000e+00 4.40476e+01 206.735 9.32489e+01 26.735  0.9252 
1 1 1 13  23  0  o 11 7.10088e+00 1.64221e+00 3.70754e+01 58.551  7.46131e-01  1.21999e+00  0.00000e+00 0.00000e+00 1.19149e+02 58.551  8.20739e+01 58.551  0.5784 
1 1 1 13  23  1  o 9  9.70683e+00 1.56859e+00 1.17748e+02 299.333 3.24785e+00  -5.77986e+00 0.00000e+00 0.00000e+00 2.22551e+02 299.333 1.04803e+02 299.333 0.9212 
1 1 1 13  23  2  o 5  4.61655e+00 1.46110e+00 1.56031e+02 8.506   4.29462e+00  6.42266e-01  0.00000e+00 0.00000e+00 2.13909e+00 188.506 1.58170e+02 188.506 0.8755 
1 1 1 13  23  3  o 12 1.38576e+01 1.80723e+00 2.38265e+02 121.354 -9.91106e+00 1.62661e+01  0.00000e+00 0.00000e+00 2.75511e+02 121.354 3.72461e+01 121.354 0.9734 
1 1 1 13  23  4  o 15 4.46603e+00 1.35278e+00 8.03464e+01 36.666  2.03392e+00  1.51416e+00  0.00000e+00 0.00000e+00 5.04757e+01 36.666  2.98707e+01 216.666 0.7688 
1 1 1 13  23  5  o 8  1.34710e+01 1.17531e+00 2.37476e+02 222.036 -1.94654e+01 -1.75487e+01 0.00000e+00 0.00000e+00 2.66018e+02 222.036 2.85422e+01 222.036 0.9807 
1 1 1 13  23  6  o 9  4.72924e+00 1.42606e+00 6.16937e+01 23.707  2.20862e+00  9.69847e-01  0.00000e+00 0.00000e+00 7.44250e+01 23.707  1.27313e+01 23.707  0.7551 
1 1 1 13  23  7  o 12 1.35091e+01 1.32013e+00 2.45626e+02 158.645 -2.97284e+01 1.16232e+01  0.00000e+00 0.00000e+00 2.61238e+02 158.645 1.56119e+01 158.645 0.9842 
1 1 1 13  23  8  o 4  6.53746e+00 1.61912e+00 1.08862e+02 203.517 -5.75372e+00 -2.50382e+00 0.00000e+00 0.00000e+00 1.19548e+02 203.517 1.06861e+01 203.517 0.9164 
1 1 1 13  23  9  o 16 4.95767e+00 1.54759e+00 1.29980e+02 281.063 1.16205e+00  -5.94323e+00 0.00000e+00 0.00000e+00 4.26281e+01 281.063 8.73521e+01 101.063 0.9132 
1 1 1 13  23  10 o 7  5.13928e+00 1.58897e+00 7.15556e+01 289.855 1.20568e+00  -3.33881e+00 0.00000e+00 0.00000e+00 9.37386e+01 289.855 2.21830e+01 289.855 0.8437 
1 1 1 13  23  11 o 2  6.33167e+00 1.87466e+00 1.21363e+02 355.913 6.64269e+00  -4.74676e-01 0.00000e+00 0.00000e+00 1.01049e+02 355.913 2.03140e+01 175.913 0.9215 
1 1 1 13  24  0  f 0  1.75131e+01 1.57914e+00 2.09709e+02 353.746 2.02280e+01  -2.21692e+00 0.00000e+00 0.00000e+00 4.39860e+02 353.746 2.30151e+02 353.746 0.9751 
1 1 1 13  24  1  o 16 2.05366e+01 1.24933e+00 3.11376e+02 238.817 -2.12852e+01 -3.51692e+01 0.00000e+00 0.00000e+00 4.60601e+02 238.817 1.49224e+02 238.817 0.9878 
1 1 1 13  24  2  o 19 9.10746e+00 1.92554e+00 1.90152e+02 242.669 -4.00716e+00 -7.75341e+00 0.00000e+00 0.00000e+00 1.36077e+02 242.669 5.40758e+01 62.669  0.9408 
1 1 1 13  24  3  f 0  1.27010e+01 2.38785e+00 2.20892e+02 178.076 -1.23733e+01 4.15641e-01  0.00000e+00 0.00000e+00 2.42880e+02 178.076 2.19873e+01 178.076 0.9587 
1 1 1 13  24  4  f 0  2.69336e+01 9.59243e-01 4.30196e+02 175.370 -9.74693e+01 7.89431e+00  0.00000e+00 0.00000e+00 5.90672e+02 175.370 1.60476e+02 175.370 0.9949 
1 1 1 13  24  5  o 7  7.67181e+00 1.50803e+00 1.94532e+02 3.399   1.08112e+01  6.42185e-01  0.00000e+00 0.00000e+00 8.39814e+01 3.399   1.10551e+02 183.399 0.9527 
1 1 1 13  24  6  o 15 4.40343e+00 1.37247e+00 1.12391e+02 5.242   4.06084e+00  3.72558e-01  0.00000e+00 0.00000e+00 3.30313e+01 5.242   7.93602e+01 185.242 0.8665 
1 1 1 13  24  7  o 19 6.71600e+00 1.60220e+00 1.28171e+02 41.362  5.39524e+00  4.75015e+00  0.00000e+00 0.00000e+00 1.09301e+02 41.362  1.88695e+01 221.362 0.9276 
1 1 1 13  24  8  o 10 4.72483e+00 1.47757e+00 1.21512e+02 69.489  1.92256e+00  5.13909e+00  0.00000e+00 0.00000e+00 4.12407e+01 69.489  8.02716e+01 249.489 0.9036 
1 1 1 13  24  9  o 2  7.11607e+00 1.82846e+00 8.31021e+01 326.108 4.23835e+00  -2.84717e+00 0.00000e+00 0.00000e+00 1.59908e+02 326.108 7.68059e+01 326.108 0.8958 
1 1 1 13  24  10 o 14 4.74480e+00 1.53477e+00 9.59657e+01 199.569 -4.27144e+00 -1.51838e+00 0.00000e+00 0.00000e+00 6.34384e+01 199.569 3.25273e+01 19.569  0.8813 
1 1 1 13  24  11 o 15 1.35323e+01 2.02816e+00 1.96298e+02 67.215  8.43743e+00  2.00862e+01  0.00000e+00 0.00000e+00 3.07519e+02 67.215  1.11221e+02 67.215  0.9768 
1 1 1 13  25  0  o 8  6.35573e+00 1.64046e+00 1.49394e+02 60.680  2.62883e+00  4.68065e+00  0.00000e+00 0.00000e+00 6.84791e+01 60.680  8.09148e+01 240.680 0.9013 
1 1 1 13  25  1  o 8  7.86652e+00 1.51060e+00 9.63304e+01 91.123  -8.81866e-02 4.49691e+00  0.00000e+00 0.00000e+00 1.67175e+02 91.123  7.08450e+01 91.123  0.8803 
1 1 1 13  25  2  o 5  1.78198e+01 1.53768e+00 3.11823e+02 355.445 3.34328e+01  -2.66352e+00 0.00000e+00 0.00000e+00 3.56382e+02 355.445 4.45592e+01 355.445 0.9850 
1 1 1 13  25  3  o 9  1.48331e+01 1.65723e+00 2.38698e+02 283.084 4.69820e+00  -2.02147e+01 0.00000e+00 0.00000e+00 3.12424e+02 283.084 7.37258e+01 283.084 0.9756 
1 1 1 13  25  4  o 10 2.06423e+01 9.80187e-01 3.49476e+02 98.757  -9.19139e+00 5.96669e+01  0.00000e+00 0.00000e+00 4.30370e+02 98.757  8.08943e+01 98.757  0.9917 
1 1 1 13  25  5  o 19 1.38541e+01 1.21848e+00 1.99820e+02 162.822 -2.15237e+01 6.65374e+00  0.00000e+00 0.00000e+00 3.16242e+02 162.822 1.16422e+02 162.822 0.9775 
1 1 1 13  25  6  o 15 6.82808e+00 1.48355e+00 7.79415e+01 122.587 -2.24721e+00 3.51567e+00  0.00000e+00 0.00000e+00 1.48422e+02 122.587 7.04803e+01 122.587 0.8698 
1 1 1 13  25  7  o 8  9.57625e+00 1.56842e+00 1.43119e+02 187.870 -1.18798e+01 -1.64217e+00 0.00000e+00 0.00000e+00 2.06335e+02 187.870 6.32156e+01 187.870 0.9574 
1 1 1 13  25  8  o 19 4.58384e+00 1.43810e+00 5.17963e+01 144.898 -1.89495e+00 1.33189e+00  0.00000e+00 0.00000e+00 7.81078e+01 144.898 2.63115e+01 144.898 0.7434 
1 1 1 13  25  9  f 0  4.59214e+00 1.46204e+00 6.80999e+01 238.680 -1.75021e+00 -2.87638e+00 0.00000e+00 0.00000e+00 7.78663e+01 238.680 9.76645e+00 238.680 0.8338 
1 1 1 13  25  10 o 13 4.17982e+00 1.38809e+00 8.68414e+01 103.281 -9.83237e-01 4.16563e+00  0.00000e+00 0.00000e+00 5.23281e+01 103.281 3.45133e+01 283.281 0.8735 
1 1 1 13  25  11 o 7  4.80184e+00 1.58219e+00 5.59080e+01 281.290 5.92276e-01  -2.96672e+00 0.00000e+00 0.00000e+00 9.26693e+01 281.290 3.67612e+01 281.290 0.8118 
1 1 1 13  26  0  o 4  1.00557e+01 1.46846e+00 2.11506e+02 291.380 4.64279e+00  -1.18589e+01 0.00000e+00 0.00000e+00 1.55598e+02 291.380 5.59088e+01 111.380 0.9599 
1 1 1 13  26  1  o 2  1.06366e+01 1.36527e+00 1.54210e+02 131.640 -6.77951e+00 7.62531e+00  0.00000e+00 0.00000e+00 2.30144e+02 131.640 7.59340e+01 131.640 0.9497 
1 1 1 13  26  2  o 1  1.18331e+01 1.81702e+00 1.94462e+02 63.796  5.52951e+00  1.12357e+01  0.00000e+00 0.00000e+00 2.37614e+02 63.796  4.31522e+01 63.796  0.9592 
1 1 1 13  26  3  o 13 2.54680e+01 1.39838e+00 4.11711e+02 193.890 -7.01569e+01 -1.73486e+01 0.00000e+00 0.00000e+00 5.51413e+02 193.890 1.39702e+02 193.890 0.9931 
1 1 1 13  26  4  o 2  1.32290e+01 1.19813e+00 1.79577e+02 34.493  1.52254e+01  1.04612e+01  0.00000e+00 0.00000e+00 3.10524e+02 34.493  1.30946e+02 34.493  0.9725 
1 1 1 13  26  5  f 0  5.86600e+00 1.50528e+00 1.22218e+02 188.374 -5.15233e+00 -7.58479e-01 0.00000e+00 0.00000e+00 7.84916e+01 188.374 4.37269e+01 8.374   0.8980 
1 1 1 13  26  6  o 16 1.02058e+01 1.56281e+00 2.09330e+02 33.729  1.39763e+01  9.33128e+00  0.00000e+00 0.00000e+00 1.67856e+02 33.729  4.14742e+01 213.729 0.9698 
1 1 1 13  26  7  o 2  4.33023e+00 1.35644e+00 2.51930e+01 94.052  -7.51592e-02 1.06100e+00  0.00000e+00 0.00000e+00 5.21295e+01 94.052  2.69366e+01 94.052  0.4685 
1 1 1 13  26  8  o 13 4.07443e+00 1.28339e+00 1.28649e+02 304.526 3.23480e+00  -4.70203e+00 0.00000e+00 0.00000e+00 1.22996e+01 304.526 1.16349e+02 124.526 0.9076 
1 1 1 13  26  9  o 10 3.83998e+00 1.29394e+00 3.09105e+01 215.548 -1.12793e+00 -8.05964e-01 0.00000e+00 0.00000e+00 5.20432e+01 215.548 2.11327e+01 215.548 0.5667 
1 1 1 13  26  10 o 19 4.07581e+00 1.37449e+00 2.17494e+01 262.906 -1.23089e-01 -9.89137e-01 0.00000e+00 0.00000e+00 4.74192e+01 262.906 2.56698e+01 262.906 0.4452 
1 1 1 13  26  11 o 11 6.27228e+00 1.83394e+00 2.52979e+01 46.636  1.03586e+00  1.09678e+00  0.00000e+00 0.00000e+00 1.17710e+02 46.636  9.24120e+01 46.636  0.5983 
1 1 1 13  27  0  o 11 1.11006e+01 1.37665e+00 1.53745e+02 357.432 1.05737e+01  -4.74241e-01 0.00000e+00 0.00000e+00 2.47935e+02 357.432 9.41899e+01 357.432 0.9515 
1 1 1 13  27  1  o 13 1.64020e+01 1.40956e+00 2.57946e+02 64.937  1.08141e+01  2.31248e+01  0.00000e+00 0.00000e+00 3.53770e+02 64.937  9.58244e+01 64.937  0.9802 
1 1 1 13  27  2  o 16 1.26099e+01 1.70470e+00 1.22038e+02 248.741 -3.35252e+00 -8.61721e+00 0.00000e+00 0.00000e+00 3.31202e+02 248.741 2.09164e+02 248.741 0.9443 
1 1 1 13  27  3  o 8  1.27160e+01 1.77004e+00 2.07267e+02 297.455 7.24354e+00  -1.39413e+01 0.00000e+00 0.00000e+00 2.61267e+02 297.455 5.40000e+01 297.455 0.9676 
1 1 1 13  27  4  o 18 1.81335e+01 1.00985e+00 3.44247e+02 101.314 -1.01437e+01 5.07007e+01  0.00000e+00 0.00000e+00 3.39753e+02 101.314 4.49392e+00 281.314 0.9903 
1 1 1 13  27  5  o 6  1.20298e+01 1.31135e+00 2.75935e+02 163.382 -2.71188e+01 8.09354e+00  0.00000e+00 0.00000e+00 1.74225e+02 163.382 1.01710e+02 343.382 0.9822 
1 1 1 13  27  6  o 15 1.05093e+01 1.45422e+00 1.42325e+02 34.985  9.66937e+00  6.76682e+00  0.00000e+00 0.00000e+00 2.40791e+02 34.985  9.84658e+01 34.985  0.9566 
1 1 1 13  27  7  o 7  8.08006e+00 1.74490e+00 1.56003e+02 54.010  5.89416e+00  8.11558e+00  0.00000e+00 0.00000e+00 1.36163e+02 54.010  1.98398e+01 234.010 0.9488 
1 1 1 13  27  8  o 9  5.51223e+00 1.48589e+00 7.59709e+01 27.878  3.60787e+00  1.90849e+00  0.00000e+00 0.00000e+00 1.06095e+02 27.878  3.01239e+01 27.878  0.8666 
1 1 1 13  27  9  o 7  1.25108e+01 1.61861e+00 2.22318e+02 19.695  2.52505e+01  9.03863e+00  0.00000e+00 0.00000e+00 2.45551e+02 19.695  2.32336e+01 19.695  0.9812 
1 1 1 13  27  10 o 6  6.08046e+00 1.76687e+00 1.29206e+02 203.909 -6.38325e+00 -2.82988e+00 0.00000e+00 0.00000e+00 8.52318e+01 203.909 4.39742e+01 23.909  0.9253 
1 1 1 13  27  11 o 17 4.21295e+00 1.43541e+00 5.31039e+01 28.248  2.35470e+00  1.26513e+00  0.00000e+00 0.00000e+00 7.25364e+01 28.248  1.94325e+01 28.248  0.7826 
1 1 1 13  28  0  o 9  1.05531e+01 1.39667e+00 2.59819e+02 220.591 -1.26280e+01 -1.08199e+01 0.00000e+00 0.00000e+00 1.29220e+02 220.591 1.30599e+02 40.591  0.9695 
1 1 1 13  28  1  o 2  1.85578e+01 1.42379e+00 3.32007e+02 128.336 -2.39844e+01 3.03300e+01  0.00000e+00 0.00000e+00 3.64835e+02 128.336 3.28277e+01 128.336 0.9870 
1 1 1 13  28  2  o 19 1.17589e+01 1.73925e+00 1.72524e+02 346.821 1.16871e+01  -2.73660e+00 0.00000e+00 0.00000e+00 2.55968e+02 346.821 8.34436e+01 346.821 0.9574 
1 1 1 13  28  3  o 16 8.44398e+00 1.42599e+00 2.30078e+02 106.292 -3.75023e+00 1.28313e+01  0.00000e+00 0.00000e+00 7.91631e+01 106.292 1.50915e+02 286.292 0.9618 
1 1 1 13  28  4  o 19 4.01950e+00 1.26657e+00 3.72332e+01 70.008  3.87543e-01  1.06522e+00  0.00000e+00 0.00000e+00 3.80435e+01 70.008  8.10300e-01 70.008  0.4917 
1 1 1 13  28  5  o 2  1.27771e+01 1.21084e+00 2.36690e+02 11.873  2.62750e+01  5.52397e+00  0.00000e+00 0.00000e+00 2.40926e+02 11.873  4.23584e+00 11.873  0.9812 
1 1 1 13  28  6  o 4  8.42231e+00 1.57642e+00 7.62069e+01 305.761 2.79963e+00  -3.88736e+00 0.00000e+00 0.00000e+00 2.08867e+02 305.761 1.32660e+02 305.761 0.8883 
1 1 1 13  28  7  o 18 1.16100e+01 1.51127e+00 2.56974e+02 131.174 -1.69701e+01 1.94025e+01  0.00000e+00 0.00000e+00 1.76804e+02 131.174 8.01701e+01 311.174 0.9804 
1 1 1 13  28  8  o 1  1.35253e+01 1.38317e+00 1.56205e+02 271.089 3.98606e-01  -2.09677e+01 0.00000e+00 0.00000e+00 3.46820e+02 271.089 1.90615e+02 271.089 0.9759 
1 1 1 13  28  9  o 14 8.05100e+00 1.81034e+00 2.41917e+02 194.862 -1.62522e+01 -4.31276e+00 0.00000e+00 0.00000e+00 5.56509e+01 194.862 1.86266e+02 14.862  0.9698 
1 1 1 13  28  10 o 18 4.52482e+00 1.48955e+00 5.87195e+01 159.708 -2.79460e+00 1.03329e+00  0.00000e+00 0.00000e+00 8.06903e+01 159.708 2.19708e+01 159.708 0.8085 
1 1 1 13  28  11 o 8  5.07714e+00 1.59932e+00 6.47651e+01 283.596 8.29006e-01  -3.42767e+00 0.00000e+00 0.00000e+00 9.82243e+01 283.596 3.34592e+01 283.596 0.8425 
1 1 1 13  29  0  o 16 9.72975e+00 1.43337e+00 1.89682e+02 318.920 8.31942e+00  -7.25242e+00 0.00000e+00 0.00000e+00 1.63096e+02 318.920 2.65857e+01 138.920 0.9536 
1 1 1 13  29  1  o 16 1.35051e+01 1.57147e+00 2.41339e+02 76.766  4.44068e+00  1.88825e+01  0.00000e+00 0.00000e+00 2.59002e+02 76.766  1.76627e+01 76.766  0.9739 
1 1 1 13  29  2  o 11 1.14444e+01 1.52612e+00 2.45938e+02 356.199 1.72606e+01  -1.14676e+00 0.00000e+00 0.00000e+00 1.76835e+02 356.199 6.91035e+01 176.199 0.9707 
1 1 1 13  29  3  f 0  1.49470e+01 1.06219e+00 2.79626e+02 192.065 -3.33818e+01 -7.13522e+00 0.00000e+00 0.00000e+00 2.81048e+02 192.065 1.42179e+00 192.065 0.9852 
1 1 1 13  29  4  o 15 1.35863e+01 1.09948e+00 3.26178e+02 60.295  1.84979e+01  3.24235e+01  0.00000e+00 0.00000e+00 1.84271e+02 60.295  1.41907e+02 240.295 0.9865 
1 1 1 13  29  5  o 7  6.37690e+00 1.53468e+00 8.08791e+01 283.155 8.94602e-01  -3.82759e+00 0.00000e+00 0.00000e+00 1.28230e+02 283.155 4.73505e+01 283.155 0.8608 
1 1 1 13  29  6  o 6  1.17553e+01 1.40983e+00 2.03608e+02 113.480 -8.14542e+00 1.87509e+01  0.00000e+00 0.00000e+00 2.33189e+02 113.480 2.95803e+01 113.480 0.9752 
1 1 1 13  29  7  f 0  5.86315e+00 1.55547e+00 8.02397e+01 6.542   3.94625e+00  4.52534e-01  0.00000e+00 0.00000e+00 1.12448e+02 6.542   3.22085e+01 6.542   0.8624 
1 1 1 13  29  8  o 15 8.33598e+00 1.62905e+00 1.88098e+02 337.686 1.29165e+01  -5.30100e+00 0.00000e+00 0.00000e+00 1.17977e+02 337.686 7.01206e+01 157.687 0.9635 
1 1 1 13  29  9  o 7  4.38438e+00 1.41570e+00 1.37049e+02 118.827 -3.14658e+00 5.71729e+00  0.00000e+00 0.00000e+00 1.66387e+01 118.827 1.20410e+02 298.827 0.9198 
1 1 1 13  29  10 o 10 1.17573e+01 1.85907e+00 2.76357e+02 266.761 -1.57516e+00 -2.78323e+01 0.00000e+00 0.00000e+00 1.63563e+02 266.761 1.12794e+02 86.761  0.9819 
1 1 1 13  29  11 o 7  5.12964e+00 1.65445e+00 2.26628e+01 265.216 -1.01614e-01 -1.21408e+00 0.00000e+00 0.00000e+00 7.86629e+01 265.216 5.60001e+01 265.216 0.5184 
1 1 1 13  30  0  o 12 1.35257e+01 1.24076e+00 3.15636e+02 54.613  1.64544e+01  2.31650e+01  0.00000e+00 0.00000e+00 1.89485e+02 54.613  1.26151e+02 234.613 0.9822 
1 1 1 13  30  1  o 16 1.61093e+01 1.40795e+00 2.92159e+02 122.117 -1.67926e+01 2.67517e+01  0.00000e+00 0.00000e+00 3.10845e+02 122.117 1.86857e+01 122.117 0.9840 
1 1 1 13  30  2  o 10 5.22647e+00 1.55610e+00 8.91241e+01 203.821 -2.76633e+00 -1.22129e+00 0.00000e+00 0.00000e+00 7.23276e+01 203.821 1.67966e+01 23.821  0.8117 
1 1 1 13  30  3  o 10 1.37757e+01 1.08156e+00 2.24258e+02 351.990 2.47685e+01  -3.48546e+00 0.00000e+00 0.00000e+00 2.89586e+02 351.990 6.53283e+01 351.990 0.9798 
1 1 1 13  30  4  o 5  1.81458e+01 1.00240e+00 3.37977e+02 301.849 2.84821e+01  -4.58494e+01 0.00000e+00 0.00000e+00 3.46610e+02 301.849 8.63352e+00 301.849 0.9907 
1 1 1 13  30  5  o 2  9.26447e+00 1.51815e+00 1.43877e+02 174.334 -1.05219e+01 1.04384e+00  0.00000e+00 0.00000e+00 1.91889e+02 174.334 4.80120e+01 174.334 0.9515 
1 1 1 13  30  6  o 4  5.44939e+00 1.46086e+00 1.32565e+02 99.566  -1.03730e+00 6.15523e+00  0.00000e+00 0.00000e+00 5.75999e+01 99.566  7.49647e+01 279.566 0.9160 
1 1 1 13  30  7  o 14 1.50082e+01 1.29411e+00 2.40576e+02 337.199 3.42896e+01  -1.44148e+01 0.00000e+00 0.00000e+00 3.23540e+02 337.199 8.29640e+01 337.199 0.9865 
1 1 1 13  30  8  o 9  1.56459e+01 1.34620e+00 3.26144e+02 208.363 -4.65910e+01 -2.51526e+01 0.00000e+00 0.00000e+00 2.64392e+02 208.363 6.17516e+01 28.363  0.9905 
1 1 1 13  30  9  o 5  6.05520e+00 1.67140e+00 1.42533e+02 56.555  4.43752e+00  6.71831e+00  0.00000e+00 0.00000e+00 7.33607e+01 56.555  6.91720e+01 236.555 0.9357 
1 1 1 13  30  10 o 18 4.48386e+00 1.48296e+00 1.16939e+02 116.051 -2.48425e+00 5.08191e+00  0.00000e+00 0.00000e+00 3.79665e+01 116.051 7.89723e+01 296.051 0.9067 
1 1 1 13  30  11 o 6  6.01570e+00 1.83523e+00 1.33090e+02 155.361 -6.51604e+00 2.98858e+00  0.00000e+00 0.00000e+00 7.94562e+01 155.361 5.36334e+01 335.361 0.9274 
1 1 1 13  31  0  f 0  1.00238e+01 1.41898e+00 2.39475e+02 295.092 6.80987e+00  -1.45427e+01 0.00000e+00 0.00000e+00 1.29538e+02 295.092 1.09938e+02 115.092 0.9683 
1 1 1 13  31  1  o 5  8.80959e+00 1.79314e+00 1.69355e+02 213.824 -6.90760e+00 -4.62842e+00 0.00000e+00 0.00000e+00 1.44879e+02 213.824 2.44760e+01 33.824  0.9378 
1 1 1 13  31  2  o 15 1.48327e+01 1.45528e+00 2.18708e+02 316.274 1.59684e+01  -1.52736e+01 0.00000e+00 0.00000e+00 3.32788e+02 316.274 1.14080e+02 316.274 0.9771 
1 1 1 13  31  3  o 2  4.64182e+00 1.30541e+00 1.40847e+02 283.298 1.12404e+00  -4.75587e+00 0.00000e+00 0.00000e+00 1.65366e+01 283.298 1.24310e+02 103.298 0.8907 
1 1 1 13  31  4  o 7  5.99360e+00 1.43687e+00 1.34784e+02 6.038   5.99742e+00  6.34398e-01  0.00000e+00 0.00000e+00 7.35489e+01 6.038   6.12352e+01 186.038 0.9128 
1 1 1 13  31  5  o 3  5.18574e+00 1.51910e+00 1.01508e+02 87.634  1.72100e-01  4.16524e+00  0.00000e+00 0.00000e+00 7.02721e+01 87.634  3.12356e+01 267.634 0.8697 
1 1 1 13  31  6  o 16 4.19969e+00 1.32054e+00 1.19610e+02 313.556 3.19147e+00  -3.35651e+00 0.00000e+00 0.00000e+00 2.18303e+01 313.556 9.77798e+01 133.556 0.8841 
1 1 1 13  31  7  o 1  5.66635e+00 1.59366e+00 1.29736e+02 77.369  1.37632e+00  6.14148e+00  0.00000e+00 0.00000e+00 6.81664e+01 77.369  6.15696e+01 257.368 0.9167 
1 1 1 13  31  8  o 12 4.92649e+00 1.45264e+00 1.29293e+02 180.005 -6.49402e+00 -5.28694e-04 0.00000e+00 0.00000e+00 4.32902e+01 180.005 8.60026e+01 0.005   0.9194 
1 1 1 13  31  9  o 7  4.67910e+00 1.49669e+00 1.11864e+02 347.216 5.30049e+00  -1.20268e+00 0.00000e+00 0.00000e+00 4.90533e+01 347.216 6.28108e+01 167.216 0.9026 
1 1 1 13  31  10 o 16 5.26342e+00 1.53619e+00 7.07906e+01 203.527 -3.75509e+00 -1.63483e+00 0.00000e+00 0.00000e+00 1.03095e+02 203.527 3.23045e+01 203.527 0.8671 
1 1 1 13  31  11 o 3  7.92913e+00 2.07820e+00 1.99457e+02 235.983 -7.10364e+00 -1.05249e+01 0.00000e+00 0.00000e+00 9.04600e+01 235.983 1.08997e+02 55.983  0.9598 
1 1 1 13  32  0  o 5  1.38555e+01 1.31361e+00 2.87430e+02 267.133 -1.37969e+00 -2.75498e+01 0.00000e+00 0.00000e+00 2.29635e+02 267.133 5.77949e+01 87.133  0.9817 
1 1 1 13  32  1  o 10 8.62353e+00 1.66093e+00 2.22074e+02 7.865   1.18300e+01  1.63414e+00  0.00000e+00 0.00000e+00 9.18548e+01 7.865   1.30219e+02 187.865 0.9572 
1 1 1 13  32  2  o 14 5.62921e+00 1.56056e+00 5.66463e+01 70.369  6.99595e-01  1.96138e+00  0.00000e+00 0.00000e+00 9.56090e+01 70.369  3.89627e+01 70.369  0.7109 
1 1 1 13  32  3  o 15 5.97299e+00 1.36284e+00 8.41603e+01 161.370 -3.48271e+00 1.17411e+00  0.00000e+00 0.00000e+00 1.09034e+02 161.370 2.48738e+01 161.370 0.8498 
1 1 1 13  32  4  o 11 1.07151e+01 1.32778e+00 1.98578e+02 159.342 -1.55367e+01 5.85784e+00  0.00000e+00 0.00000e+00 1.96917e+02 159.342 1.66037e+00 339.342 0.9694 
1 1 1 13  32  5  o 14 1.24567e+01 1.59472e+00 2.05121e+02 295.230 8.12345e+00  -1.72394e+01 0.00000e+00 0.00000e+00 2.56667e+02 295.230 5.15454e+01 295.230 0.9734 
1 1 1 13  32  6  o 11 1.41993e+01 1.19558e+00 1.91448e+02 215.891 -2.24587e+01 -1.62520e+01 0.00000e+00 0.00000e+00 3.39581e+02 215.891 1.48133e+02 215.891 0.9818 
1 1 1 13  32  7  o 2  6.87455e+00 1.60517e+00 1.46367e+02 32.197  7.56879e+00  4.76573e+00  0.00000e+00 0.00000e+00 1.00423e+02 32.197  4.59449e+01 212.197 0.9423 
1 1 1 13  32  8  o 13 1.01700e+01 1.62890e+00 2.02974e+02 220.142 -1.43345e+01 -1.20887e+01 0.00000e+00 0.00000e+00 1.74016e+02 220.142 2.89576e+01 40.142  0.9730 
1 1 1 13  32  9  o 16 7.14910e+00 1.77825e+00 1.47566e+02 243.618 -4.11820e+00 -8.30274e+00 0.00000e+00 0.00000e+00 1.09665e+02 243.618 3.79010e+01 63.618  0.9444 
1 1 1 13  32  10 o 3  5.28723e+00 1.64824e+00 6.47456e+01 50.760  2.20990e+00  2.70575e+00  0.00000e+00 0.00000e+00 1.04608e+02 50.760  3.98619e+01 50.760  0.8408 
1 1 1 13  32  11 o 6  5.47745e+00 1.70310e+00 1.26923e+02 169.536 -7.00330e+00 1.29347e+00  0.00000e+00 0.00000e+00 6.64675e+01 169.536 6.04558e+01 349.536 0.9269 
1 1 1 13  33  0  o 6  1.68317e+01 9.97058e-01 2.99565e+02 230.466 -2.33479e+01 -2.82887e+01 0.00000e+00 0.00000e+00 3.31433e+02 230.466 3.18679e+01 230.466 0.9863 
1 1 1 13  33  1  o 2  6.90119e+00 1.59693e+00 1.57260e+02 112.101 -2.60574e+00 6.41699e+00  0.00000e+00 0.00000e+00 8.54229e+01 112.101 7.18374e+01 292.101 0.9247 
1 1 1 13  33  2  o 1  1.07840e+01 1.45132e+00 2.00785e+02 200.240 -1.43826e+01 -5.30308e+00 0.00000e+00 0.00000e+00 1.95882e+02 200.240 4.90312e+00 20.240  0.9668 
1 1 1 13  33  3  o 15 6.17328e+00 1.46268e+00 1.49238e+02 99.544  -1.12025e+00 6.66277e+00  0.00000e+00 0.00000e+00 6.75547e+01 99.544  8.16835e+01 279.544 0.9227 
1 1 1 13  33  4  o 14 6.01547e+00 1.44192e+00 8.15302e+01 150.004 -3.41919e+00 1.97378e+00  0.00000e+00 0.00000e+00 1.15768e+02 150.004 3.42374e+01 150.004 0.8615 
1 1 1 13  33  5  o 18 1.05366e+01 1.63145e+00 1.99949e+02 295.260 6.84472e+00  -1.45064e+01 0.00000e+00 0.00000e+00 1.88582e+02 295.260 1.13668e+01 115.260 0.9683 
1 1 1 13  33  6  o 11 7.50743e+00 1.63397e+00 1.28737e+02 90.175  -2.49778e-02 8.17080e+00  0.00000e+00 0.00000e+00 1.39091e+02 90.175  1.03545e+01 90.175  0.9366 
1 1 1 13  33  7  o 12 9.51460e+00 1.53347e+00 1.38621e+02 335.162 1.10480e+01  -5.11391e+00 0.00000e+00 0.00000e+00 2.08600e+02 335.162 6.99790e+01 335.162 0.9580 
1 1 1 13  33  8  o 17 5.47288e+00 1.57238e+00 5.39512e+01 282.879 6.10251e-01  -2.66904e+00 0.00000e+00 0.00000e+00 1.10461e+02 282.879 5.65096e+01 282.879 0.7886 
1 1 1 13  33  9  o 7  4.05187e+00 1.36464e+00 5.52162e+01 200.292 -2.42773e+00 -8.97667e-01 0.00000e+00 0.00000e+00 6.43007e+01 200.292 9.08450e+00 200.292 0.7743 
1 1 1 13  33  10 o 15 5.39535e+00 1.65282e+00 1.00239e+02 281.611 1.10648e+00  -5.38530e+00 0.00000e+00 0.00000e+00 8.55121e+01 281.611 1.47271e+01 101.611 0.9038 
1 1 1 13  33  11 o 19 6.96690e+00 1.91603e+00 9.57255e+01 271.795 1.84634e-01  -5.89231e+00 0.00000e+00 0.00000e+00 1.45940e+02 271.795 5.02148e+01 271.795 0.9107 
1 1 1 13  34  0  o 19 9.19842e+00 1.24667e+00 2.14032e+02 140.712 -1.10654e+01 9.05298e+00  0.00000e+00 0.00000e+00 1.23115e+02 140.712 9.09172e+01 320.712 0.9644 
1 1 1 13  34  1  o 18 1.55275e+01 1.18366e+00 2.54139e+02 203.706 -2.70830e+01 -1.18921e+01 0.00000e+00 0.00000e+00 3.26238e+02 203.706 7.20992e+01 203.706 0.9829 
1 1 1 13  34  2  o 4  4.81785e+00 1.46276e+00 2.20299e+01 41.716  5.57762e-01  4.97224e-01  0.00000e+00 0.00000e+00 4.20722e+01 41.716  2.00423e+01 41.716  0.3497 
1 1 1 13  34  3  f 0  9.10665e+00 1.26093e+00 1.97891e+02 228.159 -9.52945e+00 -1.06427e+01 0.00000e+00 0.00000e+00 1.36316e+02 228.159 6.15748e+01 48.159  0.9643 
1 1 1 13  34  4  o 7  4.77140e+00 1.33947e+00 1.23060e+02 220.527 -3.70449e+00 -3.16700e+00 0.00000e+00 0.00000e+00 3.86645e+01 220.527 8.43959e+01 40.527  0.8904 
1 1 1 13  34  5  o 3  5.13469e+00 1.54776e+00 1.00029e+02 211.443 -3.31496e+00 -2.02690e+00 0.00000e+00 0.00000e+00 6.79145e+01 211.443 3.21143e+01 31.443  0.8590 
1 1 1 13  34  6  o 3  4.89016e+00 1.43456e+00 1.33271e+02 215.904 -4.94142e+00 -3.57748e+00 0.00000e+00 0.00000e+00 3.69336e+01 215.904 9.63370e+01 35.904  0.9139 
1 1 1 13  34  7  o 12 4.74833e+00 1.36450e+00 9.67277e+01 190.655 -4.57813e+00 -8.61339e-01 0.00000e+00 0.00000e+00 6.33005e+01 190.655 3.34273e+01 10.655  0.8848 
1 1 1 13  34  8  o 7  5.69859e+00 1.59257e+00 8.26121e+01 186.059 -4.28869e+00 -4.55209e-01 0.00000e+00 0.00000e+00 1.07229e+02 186.059 2.46169e+01 186.059 0.8746 
1 1 1 13  34  9  o 6  8.46382e+00 1.78094e+00 9.17381e+01 130.192 -4.49525e+00 5.32095e+00  0.00000e+00 0.00000e+00 2.06534e+02 130.192 1.14796e+02 130.192 0.9251 
1 1 1 13  34  10 o 18 7.19889e+00 1.88687e+00 2.29758e+02 123.305 -8.04705e+00 1.22481e+01  0.00000e+00 0.00000e+00 3.49207e+01 123.305 1.94838e+02 303.305 0.9653 
1 1 1 13  34  11 o 15 5.88258e+00 1.78890e+00 1.24433e+02 269.617 -4.83200e-02 -7.23457e+00 0.00000e+00 0.00000e+00 8.34917e+01 269.617 4.09417e+01 89.617  0.9281 
1 1 1 13  35  0  o 5  8.97664e+00 1.50967e+00 1.83411e+02 74.689  2.89713e+00  1.05825e+01  0.00000e+00 0.00000e+00 1.41793e+02 74.689  4.16180e+01 254.689 0.9533 
1 1 1 13  35  1  o 10 5.97856e+00 1.56041e+00 9.74594e+01 262.013 -5.49012e-01 -3.91306e+00 0.00000e+00 0.00000e+00 9.84037e+01 262.013 9.44273e-01 262.013 0.8616 
1 1 1 13  35  2  o 17 1.15407e+01 1.10687e+00 1.83941e+02 59.298  8.68818e+00  1.46314e+01  0.00000e+00 0.00000e+00 2.41951e+02 59.298  5.80099e+01 59.298  0.9702 
1 1 1 13  35  3  o 15 9.80960e+00 1.28241e+00 1.45459e+02 274.385 8.66203e-01  -1.12950e+01 0.00000e+00 0.00000e+00 2.10946e+02 274.385 6.54864e+01 274.385 0.9548 
1 1 1 13  35  4  o 15 1.08535e+01 1.28888e+00 1.76951e+02 281.771 3.44281e+00  -1.65215e+01 0.00000e+00 0.00000e+00 2.23748e+02 281.771 4.67975e+01 281.771 0.9699 
1 1 1 13  35  5  o 16 1.59880e+01 1.36616e+00 3.36735e+02 314.847 3.30888e+01  -3.32663e+01 0.00000e+00 0.00000e+00 2.65469e+02 314.847 7.12655e+01 134.847 0.9893 
1 1 1 13  35  6  o 17 8.49075e+00 1.55376e+00 1.42707e+02 213.236 -8.91255e+00 -5.84031e+00 0.00000e+00 0.00000e+00 1.65063e+02 213.236 2.23557e+01 213.236 0.9519 
1 1 1 13  35  7  o 14 5.16420e+00 1.55747e+00 6.89115e+01 126.676 -1.99186e+00 2.67461e+00  0.00000e+00 0.00000e+00 9.47267e+01 126.676 2.58152e+01 126.676 0.8320 
1 1 1 13  35  8  f 0  8.10879e+00 1.64290e+00 8.01937e+01 139.914 -4.80295e+00 4.04240e+00  0.00000e+00 0.00000e+00 2.02859e+02 139.914 1.22665e+02 139.914 0.9165 
1 1 1 13  35  9  o 1  3.69633e+00 1.26827e+00 9.49863e+01 288.501 1.29238e+00  -3.86222e+00 0.00000e+00 0.00000e+00 2.69731e+01 288.501 6.80132e+01 108.501 0.8663 
1 1 1 13  35  10 o 16 4.59471e+00 1.56930e+00 1.13243e+02 223.107 -3.98613e+00 -3.73110e+00 0.00000e+00 0.00000e+00 4.47885e+01 223.107 6.84549e+01 43.107  0.9031 
1 1 1 13  36  0  o 8  9.07786e+00 1.53990e+00 1.06699e+02 83.432  7.57755e-01  6.58170e+00  0.00000e+00 0.00000e+00 2.11037e+02 83.432  1.04337e+02 83.432  0.9211 
1 1 1 13  36  1  o 4  1.09559e+01 1.40790e+00 1.79497e+02 276.467 1.59297e+00  -1.40533e+01 0.00000e+00 0.00000e+00 2.22024e+02 276.467 4.25265e+01 276.467 0.9640 
1 1 1 13  36  2  o 7  1.88786e+01 9.05568e-01 3.23639e+02 166.272 -5.33399e+01 1.30304e+01  0.00000e+00 0.00000e+00 3.87838e+02 166.272 6.41990e+01 166.272 0.9909 
1 1 1 13  36  3  o 9  4.59384e+00 1.27782e+00 7.70261e+01 174.512 -2.80242e+00 2.69262e-01  0.00000e+00 0.00000e+00 6.19937e+01 174.512 1.50324e+01 354.512 0.7953 
1 1 1 13  36  4  o 14 4.52684e+00 1.33519e+00 1.12426e+02 301.328 2.27551e+00  -3.73840e+00 0.00000e+00 0.00000e+00 3.86056e+01 301.328 7.38200e+01 121.328 0.8766 
1 1 1 13  36  5  o 1  6.45903e+00 1.47031e+00 4.63563e+01 29.878  2.15358e+00  1.23726e+00  0.00000e+00 0.00000e+00 1.41315e+02 29.878  9.49587e+01 29.878  0.7632 
1 1 1 13  36  6  o 14 6.03409e+00 1.54678e+00 3.69059e+01 233.048 -1.13528e+00 -1.50922e+00 0.00000e+00 0.00000e+00 1.19010e+02 233.048 8.21041e+01 233.048 0.6786 
1 1 1 13  36  7  o 18 1.12874e+01 1.65722e+00 1.95963e+02 179.748 -1.89718e+01 8.34560e-02  0.00000e+00 0.00000e+00 2.22401e+02 179.748 2.64381e+01 179.748 0.9733 
1 1 1 13  36  8  o 7  5.04121e+00 1.43827e+00 7.12706e+01 75.838  9.43450e-01  3.73881e+00  0.00000e+00 0.00000e+00 9.34114e+01 75.838  2.21408e+01 75.838  0.8577 
1 1 1 13  36  9  o 13 7.04039e+00 1.78444e+00 1.51342e+02 193.819 -9.51199e+00 -2.33964e+00 0.00000e+00 0.00000e+00 1.02712e+02 193.819 4.86296e+01 13.819  0.9475 
1 1 1 13  36  10 o 5  5.29928e+00 1.62958e+00 9.20580e+01 348.716 5.08235e+00  -1.01411e+00 0.00000e+00 0.00000e+00 8.90579e+01 348.716 3.00006e+00 168.716 0.8975 
1 1 1 13  37  0  o 16 3.64396e+00 1.18355e+00 4.87112e+01 46.405  9.56333e-01  1.00444e+00  0.00000e+00 0.00000e+00 2.97795e+01 46.405  1.89317e+01 226.405 0.5669 
1 1 1 13  37  1  o 8  7.41040e+00 1.65744e+00 2.03458e+02 71.047  3.18593e+00  9.27741e+00  0.00000e+00 0.00000e+00 6.34756e+01 71.047  1.39982e+02 251.047 0.9476 
1 1 1 13  37  2  o 18 1.12332e+01 1.08695e+00 1.88502e+02 338.543 1.66424e+01  -6.54124e+00 0.00000e+00 0.00000e+00 2.26585e+02 338.543 3.80828e+01 338.543 0.9716 
1 1 1 13  37  3  o 6  3.41290e+00 1.10945e+00 1.11996e+02 139.849 -2.70210e+00 2.27946e+00  0.00000e+00 0.00000e+00 2.54815e+00 319.849 1.14545e+02 319.849 0.8429 
1 1 1 13  37  4  o 18 6.36775e+00 1.40227e+00 1.61766e+02 276.354 9.25820e-01  -8.31423e+00 0.00000e+00 0.00000e+00 6.55897e+01 276.354 9.61761e+01 96.354  0.9382 
1 1 1 13  37  5  o 17 5.26025e+00 1.25879e+00 8.66845e+01 16.698  4.14141e+00  1.24231e+00  0.00000e+00 0.00000e+00 8.85069e+01 16.698  1.82236e+00 16.698  0.8749 
1 1 1 13  37  6  o 13 8.39576e+00 1.50498e+00 1.28018e+02 126.704 -5.92995e+00 7.95442e+00  0.00000e+00 0.00000e+00 1.75075e+02 126.704 4.70576e+01 126.704 0.9482 
1 1 1 13  37  7  o 18 9.94843e+00 1.67701e+00 2.04808e+02 282.318 3.76939e+00  -1.72613e+01 0.00000e+00 0.00000e+00 1.63131e+02 282.318 4.16770e+01 102.318 0.9713 
1 1 1 13  37  8  o 15 4.71149e+00 1.44714e+00 5.66795e+01 99.286  -4.61961e-01 2.82531e+00  0.00000e+00 0.00000e+00 8.67308e+01 99.286  3.00513e+01 99.286  0.7993 
1 1 1 13  37  9  o 17 8.78339e+00 1.75169e+00 1.19042e+02 316.409 6.79449e+00  -6.46820e+00 0.00000e+00 0.00000e+00 1.97075e+02 316.409 7.80331e+01 316.409 0.9451 
1 1 1 13  37  10 o 18 5.43317e+00 1.65215e+00 5.94711e+01 195.742 -3.34180e+00 -9.41982e-01 0.00000e+00 0.00000e+00 1.14239e+02 195.742 5.47682e+01 195.742 0.8396 
1 1 1 13  38  0  o 13 4.47753e+00 1.32516e+00 9.59871e+01 152.201 -2.81632e+00 1.48480e+00  0.00000e+00 0.00000e+00 4.39630e+01 152.201 5.20241e+01 332.201 0.8227 
1 1 1 13  38  1  o 16 5.59244e+00 1.49149e+00 1.12942e+02 58.670  2.28070e+00  3.74667e+00  0.00000e+00 0.00000e+00 7.34610e+01 58.670  3.94808e+01 238.670 0.8769 
1 1 1 13  38  2  o 11 9.56989e+00 1.24142e+00 1.82525e+02 213.677 -1.17184e+01 -7.80846e+00 0.00000e+00 0.00000e+00 1.68221e+02 213.677 1.43033e+01 33.677  0.9638 
1 1 1 13  38  3  o 8  8.92807e+00 1.26981e+00 1.56312e+02 159.163 -1.11399e+01 4.23981e+00  0.00000e+00 0.00000e+00 1.68748e+02 159.163 1.24366e+01 159.163 0.9571 
1 1 1 13  38  4  o 16 8.14504e+00 1.35025e+00 2.03583e+02 207.730 -1.27137e+01 -6.68337e+00 0.00000e+00 0.00000e+00 9.53686e+01 207.730 1.08214e+02 27.730  0.9645 
1 1 1 13  38  5  o 19 4.93690e+00 1.38495e+00 5.75109e+01 50.181  1.69262e+00  2.03016e+00  0.00000e+00 0.00000e+00 8.90063e+01 50.181  3.14953e+01 50.181  0.7797 
1 1 1 13  38  6  o 8  6.71334e+00 1.54936e+00 1.23522e+02 21.733  6.74555e+00  2.68882e+00  0.00000e+00 0.00000e+00 1.13739e+02 21.733  9.78234e+00 201.733 0.9283 
1 1 1 13  38  7  o 2  6.03469e+00 1.69253e+00 3.87197e+01 1.542   2.07815e+00  5.59457e-02  0.00000e+00 0.00000e+00 1.24488e+02 1.542   8.57683e+01 1.542   0.7103 
1 1 1 13  38  8  o 19 9.88919e+00 1.72136e+00 2.37747e+02 78.472  4.25798e+00  2.08760e+01  0.00000e+00 0.00000e+00 1.29859e+02 78.472  1.07888e+02 258.472 0.9762 
1 1 1 13  38  9  o 19 5.26462e+00 1.56126e+00 1.05419e+02 306.268 3.51731e+00  -4.79377e+00 0.00000e+00 0.00000e+00 7.73033e+01 306.268 2.81160e+01 126.268 0.9115 
1 1 1 13  38  10 o 2  4.94816e+00 1.46099e+00 1.07469e+02 160.617 -5.89460e+00 2.07381e+00  0.00000e+00 0.00000e+00 6.51181e+01 160.617 4.23508e+01 340.617 0.9161 
1 1 1 13  39  0  o 7  2.47947e+01 1.07662e+00 3.96515e+02 97.266  -1.00464e+01 7.88002e+01  0.00000e+00 0.00000e+00 5.39439e+02 97.266  1.42923e+02 97.266  0.9937 
1 1 1 13  39  1  o 17 1.18696e+01 1.34023e+00 1.67261e+02 308.170 9.42741e+00  -1.19931e+01 0.00000e+00 0.00000e+00 2.68817e+02 308.170 1.01556e+02 308.170 0.9666 
1 1 1 13  39  2  o 16 1.32245e+01 1.03135e+00 2.08156e+02 262.106 -3.28934e+00 -2.37223e+01 0.00000e+00 0.00000e+00 2.84068e+02 262.106 7.59123e+01 262.106 0.9789 
1 1 1 13  39  3  f 0  1.24725e+01 1.06416e+00 1.26256e+02 194.080 -1.47124e+01 -3.69002e+00 0.00000e+00 0.00000e+00 3.32248e+02 194.080 2.05992e+02 194.080 0.9665 
1 1 1 13  39  4  o 15 5.62757e+00 1.41284e+00 9.39717e+01 230.678 -2.68744e+00 -3.28088e+00 0.00000e+00 0.00000e+00 9.27849e+01 230.678 1.18682e+00 50.678  0.8722 
1 1 1 13  39  5  o 11 6.95924e+00 1.46139e+00 5.08324e+01 89.245  4.31014e-02  3.26978e+00  0.00000e+00 0.00000e+00 1.68504e+02 89.245  1.17671e+02 89.245  0.8281 
1 1 1 13  39  6  o 7  7.29953e+00 1.56619e+00 1.61034e+02 258.024 -2.21309e+00 -1.04337e+01 0.00000e+00 0.00000e+00 1.03463e+02 258.024 5.75706e+01 78.024  0.9519 
1 1 1 13  39  7  o 5  5.48582e+00 1.61604e+00 5.20850e+01 155.820 -2.42072e+00 1.08690e+00  0.00000e+00 0.00000e+00 1.10966e+02 155.820 5.88806e+01 155.820 0.7807 
1 1 1 13  39  8  o 3  6.10101e+00 1.65623e+00 1.09506e+02 138.568 -4.73307e+00 4.17742e+00  0.00000e+00 0.00000e+00 1.03489e+02 138.568 6.01755e+00 318.568 0.9170 
1 1 1 13  39  9  o 14 5.18161e+00 1.56031e+00 1.03724e+02 328.621 4.72432e+00  -2.88137e+00 0.00000e+00 0.00000e+00 7.47057e+01 328.621 2.90180e+01 148.621 0.9044 
1 1 1 13  39  10 o 11 4.59729e+00 1.50893e+00 9.08805e+01 187.189 -4.78705e+00 -6.03841e-01 0.00000e+00 0.00000e+00 6.47434e+01 187.189 2.61371e+01 7.189   0.8892 
1 1 1 13  40  0  o 5  9.47596e+00 1.47166e+00 2.49325e+02 279.871 2.95275e+00  -1.69696e+01 0.00000e+00 0.00000e+00 9.99986e+01 279.871 1.49326e+02 99.871  0.9705 
1 1 1 13  40  1  o 19 8.75367e+00 1.52305e+00 2.11067e+02 338.808 1.24033e+01  -4.80891e+00 0.00000e+00 0.00000e+00 1.08836e+02 338.808 1.02231e+02 158.808 0.9616 
1 1 1 13  40  2  o 7  5.08672e+00 1.36796e+00 1.23510e+02 40.436  3.97212e+00  3.38480e+00  0.00000e+00 0.00000e+00 5.01980e+01 40.436  7.33122e+01 220.436 0.8982 
1 1 1 13  40  3  o 14 8.20216e+00 1.31400e+00 1.13285e+02 35.404  6.39277e+00  4.54375e+00  0.00000e+00 0.00000e+00 1.78044e+02 35.404  6.47588e+01 35.404  0.9339 
1 1 1 13  40  4  o 9  3.03464e+00 1.02679e+00 2.27389e+01 42.084  5.15162e-01  4.65228e-01  0.00000e+00 0.00000e+00 1.50968e+01 42.084  7.64218e+00 222.084 0.3277 
1 1 1 13  40  5  o 5  5.80666e+00 1.50766e+00 1.12719e+02 80.544  9.68743e-01  5.81652e+00  0.00000e+00 0.00000e+00 8.85228e+01 80.544  2.41958e+01 260.544 0.9107 
1 1 1 13  40  6  o 15 4.98626e+00 1.40514e+00 1.22050e+02 25.580  5.44982e+00  2.60874e+00  0.00000e+00 0.00000e+00 5.12254e+01 25.580  7.08242e+01 205.580 0.9130 
1 1 1 13  40  7  o 6  1.22466e+01 1.70864e+00 1.09987e+02 255.962 -2.83580e+00 -1.13416e+01 0.00000e+00 0.00000e+00 3.35791e+02 255.962 2.25804e+02 255.962 0.9562 
1 1 1 13  40  8  o 2  1.14384e+01 1.60886e+00 1.68931e+02 304.027 1.05119e+01  -1.55688e+01 0.00000e+00 0.00000e+00 2.54764e+02 304.027 8.58329e+01 304.027 0.9730 
1 1 1 13  40  9  o 9  4.59902e+00 1.44080e+00 7.72012e+01 148.211 -3.52775e+00 2.18634e+00  0.00000e+00 0.00000e+00 7.49546e+01 148.211 2.24659e+00 328.211 0.8691 
1 1 1 13  40  10 o 18 5.75114e+00 1.65535e+00 4.67186e+01 205.754 -2.42782e+00 -1.17124e+00 0.00000e+00 0.00000e+00 1.25073e+02 205.754 7.83548e+01 205.754 0.7847 
1 1 1 13  41  0  o 9  1.32617e+01 1.29550e+00 2.01605e+02 77.338  4.62472e+00  2.05855e+01  0.00000e+00 0.00000e+00 2.89986e+02 77.338  8.83816e+01 77.338  0.9760 
1 1 1 13  41  1  o 9  5.97216e+00 1.31463e+00 5.45037e+01 121.922 -1.34842e+00 2.16447e+00  0.00000e+00 0.00000e+00 1.20312e+02 121.922 6.58081e+01 121.922 0.7703 
1 1 1 13  41  2  o 12 6.94499e+00 1.44168e+00 1.29817e+02 11.615  7.00644e+00  1.44010e+00  0.00000e+00 0.00000e+00 1.14976e+02 11.615  1.48411e+01 191.615 0.9272 
1 1 1 13  41  3  o 17 1.48736e+01 9.80869e-01 2.38212e+02 226.498 -2.46380e+01 -2.59610e+01 0.00000e+00 0.00000e+00 3.19458e+02 226.498 8.12467e+01 226.498 0.9859 
1 1 1 13  41  4  o 9  1.75092e+01 1.00987e+00 3.30232e+02 124.311 -3.44275e+01 5.04478e+01  0.00000e+00 0.00000e+00 3.30356e+02 124.311 1.24056e-01 124.311 0.9918 
1 1 1 13  41  5  o 14 4.38326e+00 1.30742e+00 9.27608e+01 28.449  3.40803e+00  1.84649e+00  0.00000e+00 0.00000e+00 5.04370e+01 28.449  4.23237e+01 208.449 0.8586 
1 1 1 13  41  6  o 7  7.95966e+00 1.47602e+00 2.31540e+02 331.593 1.58918e+01  -8.59531e+00 0.00000e+00 0.00000e+00 6.28771e+01 331.593 1.68663e+02 151.593 0.9719 
1 1 1 13  41  7  o 11 1.89508e+01 1.18398e+00 2.27489e+02 227.513 -3.32531e+01 -3.63055e+01 0.00000e+00 0.00000e+00 4.86455e+02 227.513 2.58966e+02 227.513 0.9898 
1 1 1 13  41  8  o 6  4.47006e+00 1.39242e+00 8.08394e+01 72.931  1.20668e+00  3.92990e+00  0.00000e+00 0.00000e+00 6.67936e+01 72.931  1.40459e+01 252.931 0.8677 
1 1 1 13  41  9  o 4  1.09145e+01 1.72924e+00 2.21839e+02 191.285 -2.30114e+01 -4.59198e+00 0.00000e+00 0.00000e+00 1.84670e+02 191.285 3.71689e+01 11.285  0.9785 
1 1 1 13  41  10 o 2  4.04088e+00 1.37409e+00 7.47799e+01 46.282  2.49792e+00  2.61228e+00  0.00000e+00 0.00000e+00 5.54731e+01 46.282  1.93068e+01 226.282 0.8469 
1 1 1 13  42  0  o 12 1.02645e+01 1.42792e+00 2.77304e+02 222.569 -1.56953e+01 -1.44169e+01 0.00000e+00 0.00000e+00 1.03236e+02 222.569 1.74068e+02 42.569  0.9762 
1 1 1 13  42  1  o 4  1.20855e+01 9.99331e-01 2.15909e+02 27.084  2.23648e+01  1.14367e+01  0.00000e+00 0.00000e+00 2.34032e+02 27.084  1.81231e+01 27.084  0.9799 
1 1 1 13  42  2  o 19 9.52472e+00 1.34558e+00 1.58734e+02 289.569 4.33499e+00  -1.21950e+01 0.00000e+00 0.00000e+00 1.89025e+02 289.569 3.02907e+01 289.569 0.9606 
1 1 1 13  42  3  o 14 3.81768e+00 1.14984e+00 1.05783e+02 356.335 3.60516e+00  -2.30926e-01 0.00000e+00 0.00000e+00 1.71395e+01 356.335 8.86434e+01 176.335 0.8468 
1 1 1 13  42  4  f 0  4.92530e+00 1.26482e+00 8.56013e+01 152.266 -3.68214e+00 1.93595e+00  0.00000e+00 0.00000e+00 7.72736e+01 152.266 8.32777e+00 332.266 0.8694 
1 1 1 13  42  5  o 11 5.23498e+00 1.35561e+00 1.57363e+02 10.236  8.09085e+00  1.46101e+00  0.00000e+00 0.00000e+00 2.92683e+01 10.236  1.28095e+02 190.236 0.9371 
1 1 1 13  42  6  o 12 9.29879e+00 1.52024e+00 2.25583e+02 64.475  8.34534e+00  1.74764e+01  0.00000e+00 0.00000e+00 1.19004e+02 64.475  1.06580e+02 244.474 0.9738 
1 1 1 13  42  7  o 10 6.41312e+00 1.60636e+00 1.77350e+02 186.022 -1.11623e+01 -1.17757e+00 0.00000e+00 0.00000e+00 5.55791e+01 186.022 1.21771e+02 6.022   0.9544 
1 1 1 13  42  8  o 16 1.16440e+01 1.56761e+00 1.82956e+02 351.418 2.05932e+01  -3.10782e+00 0.00000e+00 0.00000e+00 2.49446e+02 351.418 6.64902e+01 351.418 0.9757 
1 1 1 13  42  9  o 9  7.02576e+00 1.77734e+00 1.83180e+02 64.074  5.35138e+00  1.10079e+01  0.00000e+00 0.00000e+00 7.30563e+01 64.074  1.10124e+02 244.074 0.9582 
1 1 1 13  43  0  o 15 8.08788e+00 1.43799e+00 1.58909e+02 75.199  2.64350e+00  1.00044e+01  0.00000e+00 0.00000e+00 1.32956e+02 75.199  2.59537e+01 255.199 0.9504 
1 1 1 13  43  1  o 11 1.19403e+01 9.90117e-01 1.95924e+02 263.082 -2.67667e+00 -2.20622e+01 0.00000e+00 0.00000e+00 2.47357e+02 263.082 5.14331e+01 263.082 0.9772 
1 1 1 13  43  2  o 17 5.44274e+00 1.40047e+00 7.38480e+01 144.008 -2.64264e+00 1.91942e+00  0.00000e+00 0.00000e+00 9.74060e+01 144.008 2.35580e+01 144.008 0.8279 
1 1 1 13  43  3  o 8  9.13991e+00 1.27779e+00 2.03690e+02 129.972 -1.08365e+01 1.29271e+01  0.00000e+00 0.00000e+00 1.33348e+02 129.972 7.03415e+01 309.972 0.9699 
1 1 1 13  43  4  o 19 7.84361e+00 1.30662e+00 1.46987e+02 43.798  8.31948e+00  7.97749e+00  0.00000e+00 0.00000e+00 1.38071e+02 43.798  8.91516e+00 223.798 0.9556 
1 1 1 13  43  5  o 14 5.70575e+00 1.39814e+00 2.37761e+01 147.349 -1.08031e+00 6.92248e-01  0.00000e+00 0.00000e+00 9.29477e+01 147.349 6.91716e+01 147.349 0.5378 
1 1 1 13  43  6  o 1  7.09856e+00 1.48846e+00 1.52253e+02 209.675 -9.02986e+00 -5.14528e+00 0.00000e+00 0.00000e+00 1.04494e+02 209.675 4.77588e+01 29.675  0.9506 
1 1 1 13  43  7  o 10 7.62886e+00 1.59087e+00 1.39248e+02 134.159 -7.25490e+00 7.47102e+00  0.00000e+00 0.00000e+00 1.36745e+02 134.159 2.50377e+00 314.159 0.9507 
1 1 1 13  43  8  o 11 6.61322e+00 1.48426e+00 1.23173e+02 158.386 -8.41053e+00 3.33229e+00  0.00000e+00 0.00000e+00 1.14153e+02 158.386 9.01999e+00 338.386 0.9430 
1 1 1 13  43  9  o 6  6.41457e+00 1.70342e+00 1.19684e+02 78.026  1.53748e+00  7.24963e+00  0.00000e+00 0.00000e+00 1.07305e+02 78.026  1.23784e+01 258.026 0.9299 
1 1 1 13  44  0  f 0  6.98654e+00 1.61870e+00 3.95787e+01 182.251 -2.02526e+00 -7.96118e-02 0.00000e+00 0.00000e+00 1.46664e+02 182.251 1.07085e+02 182.251 0.7021 
1 1 1 13  44  1  o 19 6.80805e+00 1.26514e+00 8.82394e+01 254.503 -1.42159e+00 -5.12719e+00 0.00000e+00 0.00000e+00 1.44588e+02 254.503 5.63485e+01 254.503 0.9003 
1 1 1 13  44  2  o 8  2.19609e+01 8.59129e-01 3.32478e+02 42.346  5.68750e+01  5.18353e+01  0.00000e+00 0.00000e+00 4.96631e+02 42.346  1.64153e+02 42.346  0.9935 
1 1 1 13  44  3  o 18 7.15690e+00 1.37451e+00 1.36986e+02 33.816  7.32675e+00  4.90788e+00  0.00000e+00 0.00000e+00 1.19163e+02 33.816  1.78222e+01 213.816 0.9415 
1 1 1 13  44  4  o 5  3.46265e+00 1.10407e+00 7.35930e+01 165.208 -2.70855e+00 7.15237e-01  0.00000e+00 0.00000e+00 3.09782e+01 165.208 4.26148e+01 345.208 0.7942 
1 1 1 13  44  5  o 19 1.38081e+01 1.09092e+00 2.35100e+02 95.481  -3.59608e+00 3.74782e+01  0.00000e+00 0.00000e+00 2.83093e+02 95.481  4.79939e+01 95.481  0.9866 
1 1 1 13  44  6  o 7  5.96427e+00 1.46568e+00 7.96536e+01 201.140 -4.48489e+00 -1.73416e+00 0.00000e+00 0.00000e+00 1.22007e+02 201.140 4.23530e+01 201.140 0.8887 
1 1 1 13  44  7  o 15 7.26270e+00 1.58948e+00 8.46593e+01 306.566 3.60653e+00  -4.86219e+00 0.00000e+00 0.00000e+00 1.67688e+02 306.566 8.30292e+01 306.566 0.9132 
1 1 1 13  44  8  o 11 1.29404e+01 1.54462e+00 2.08218e+02 331.386 2.40340e+01  -1.31114e+01 0.00000e+00 0.00000e+00 2.75105e+02 331.386 6.68875e+01 331.386 0.9816 
1 1 1 13  44  9  o 3  6.10404e+00 1.69683e+00 1.09046e+02 40.153  5.17267e+00  4.36398e+00  0.00000e+00 0.00000e+00 1.05301e+02 40.153  3.74549e+00 220.153 0.9228 
1 1 1 13  45  0  o 11 8.18980e+00 1.47142e+00 1.51088e+02 321.440 7.82487e+00  -6.23755e+00 0.00000e+00 0.00000e+00 1.43841e+02 321.440 7.24735e+00 141.440 0.9486 
1 1 1 13  45  1  o 4  2.03761e+01 8.53038e-01 2.48273e+02 100.456 -9.20559e+00 4.98820e+01  0.00000e+00 0.00000e+00 5.17952e+02 100.456 2.69679e+02 100.456 0.9901 
1 1 1 13  45  2  o 15 4.38389e+00 1.17788e+00 8.38200e+01 150.732 -2.83105e+00 1.58665e+00  0.00000e+00 0.00000e+00 5.38711e+01 150.732 2.99489e+01 330.732 0.8266 
1 1 1 13  45  3  o 10 4.77038e+00 1.30378e+00 8.96778e+01 320.682 3.20559e+00  -2.62541e+00 0.00000e+00 0.00000e+00 6.78627e+01 320.682 2.18150e+01 140.682 0.8688 
1 1 1 13  45  4  o 8  8.70885e+00 1.42547e+00 1.73578e+02 43.161  9.92831e+00  9.31065e+00  0.00000e+00 0.00000e+00 1.45150e+02 43.161  2.84283e+01 223.161 0.9625 
1 1 1 13  45  5  o 12 4.23323e+00 1.25092e+00 1.07320e+02 173.637 -4.85608e+00 5.41563e-01  0.00000e+00 0.00000e+00 3.60781e+01 173.637 7.12417e+01 353.637 0.8907 
1 1 1 13  45  6  o 6  4.15679e+00 1.27793e+00 7.65972e+01 277.532 4.60188e-01  -3.48047e+00 0.00000e+00 0.00000e+00 5.64882e+01 277.532 2.01090e+01 97.532  0.8417 
1 1 1 13  45  7  o 12 4.84639e+00 1.41658e+00 9.14475e+01 353.487 4.77482e+00  -5.45095e-01 0.00000e+00 0.00000e+00 7.24041e+01 353.487 1.90435e+01 173.487 0.8887 
1 1 1 13  45  8  o 13 4.78719e+00 1.43139e+00 1.11359e+02 243.118 -2.80505e+00 -5.53346e+00 0.00000e+00 0.00000e+00 5.53721e+01 243.118 5.59866e+01 63.118  0.9154 
1 1 1 13  45  9  o 14 5.11579e+00 1.52353e+00 5.61118e+01 313.104 2.30012e+00  -2.45763e+00 0.00000e+00 0.00000e+00 1.06177e+02 313.104 5.00653e+01 313.104 0.8338 
1 1 1 13  46  0  o 19 4.97728e+00 1.31880e+00 7.54160e+01 88.363  9.01054e-02  3.15359e+00  0.00000e+00 0.00000e+00 7.96541e+01 88.363  4.23809e+00 88.363  0.8208 
1 1 1 13  46  1  f 0  9.97423e+00 1.04633e+00 9.43701e+01 49.711  5.98052e+00  7.05474e+00  0.00000e+00 0.00000e+00 2.63304e+02 49.711  1.68934e+02 49.711  0.9443 
1 1 1 13  46  2  o 16 1.23444e+01 9.94601e-01 2.09739e+02 86.536  1.59115e+00  2.62876e+01  0.00000e+00 0.00000e+00 2.50258e+02 86.536  4.05191e+01 86.536  0.9808 
1 1 1 13  46  3  o 8  8.04243e+00 1.27141e+00 1.63562e+02 322.050 1.05522e+01  -8.22939e+00 0.00000e+00 0.00000e+00 1.30448e+02 322.050 3.31143e+01 142.050 0.9619 
1 1 1 13  46  4  o 12 1.12917e+01 1.11801e+00 1.70658e+02 15.300  2.08694e+01  5.70922e+00  0.00000e+00 0.00000e+00 2.48590e+02 15.300  7.79318e+01 15.300  0.9766 
1 1 1 13  46  5  o 4  1.12189e+01 1.23541e+00 2.03067e+02 52.944  1.53126e+01  2.02791e+01  0.00000e+00 0.00000e+00 2.15078e+02 52.944  1.20102e+01 52.944  0.9801 
1 1 1 13  46  6  o 15 7.87362e+00 1.56266e+00 1.43328e+02 123.457 -5.79722e+00 8.77287e+00  0.00000e+00 0.00000e+00 1.41526e+02 123.457 1.80163e+00 303.457 0.9512 
1 1 1 13  46  7  o 12 6.78453e+00 1.59972e+00 1.04502e+02 273.242 3.91454e-01  -6.91087e+00 0.00000e+00 0.00000e+00 1.34132e+02 273.242 2.96305e+01 273.242 0.9246 
1 1 1 13  46  8  o 14 5.04421e+00 1.51941e+00 5.69834e+01 281.895 6.25432e-01  -2.96909e+00 0.00000e+00 0.00000e+00 9.89256e+01 281.895 4.19423e+01 281.895 0.8125 
1 1 1 13  46  9  o 9  4.72226e+00 1.49448e+00 8.68357e+01 51.935  2.90601e+00  3.71077e+00  0.00000e+00 0.00000e+00 7.23795e+01 51.935  1.44562e+01 231.934 0.8863 
1 1 1 13  47  0  o 15 4.54833e+00 1.23173e+00 3.58196e+01 233.329 -8.85850e-01 -1.18970e+00 0.00000e+00 0.00000e+00 6.63660e+01 233.329 3.05464e+01 233.329 0.5920 
1 1 1 13  47  1  o 13 5.92470e+00 1.28212e+00 7.95621e+01 247.773 -1.61194e+00 -3.94466e+00 0.00000e+00 0.00000e+00 1.16804e+02 247.773 3.72415e+01 247.773 0.8729 
1 1 1 13  47  2  o 8  3.35690e+00 1.06353e+00 3.59231e+01 246.910 -4.87818e-01 -1.14423e+00 0.00000e+00 0.00000e+00 3.11727e+01 246.910 4.75045e+00 66.910  0.5262 
1 1 1 13  47  3  o 8  1.32593e+01 1.00512e+00 2.55300e+02 99.176  -6.20330e+00 3.84022e+01  0.00000e+00 0.00000e+00 2.42053e+02 99.176  1.32471e+01 279.176 0.9871 
1 1 1 13  47  4  o 1  6.66321e+00 1.34321e+00 1.65305e+02 300.411 5.41709e+00  -9.22903e+00 0.00000e+00 0.00000e+00 7.58433e+01 300.411 8.94615e+01 120.411 0.9521 
1 1 1 13  47  5  o 19 5.75521e+00 1.43328e+00 8.99599e+01 170.277 -4.92941e+00 8.44629e-01  0.00000e+00 0.00000e+00 1.05544e+02 170.277 1.55839e+01 170.277 0.8934 
1 1 1 13  47  6  o 10 5.72905e+00 1.65530e+00 3.79404e+01 211.309 -1.77970e+00 -1.08248e+00 0.00000e+00 0.00000e+00 1.16958e+02 211.309 7.90173e+01 211.309 0.7110 
1 1 1 13  47  7  o 15 5.44902e+00 1.49381e+00 8.96818e+01 220.920 -3.95057e+00 -3.42449e+00 0.00000e+00 0.00000e+00 9.65168e+01 220.920 6.83509e+00 220.920 0.8984 
1 1 1 13  47  8  o 17 5.42081e+00 1.45042e+00 1.13177e+02 187.668 -7.06213e+00 -9.50818e-01 0.00000e+00 0.00000e+00 7.79444e+01 187.668 3.52330e+01 7.668   0.9269 
1 1 1 13  47  9  f 0  4.55008e+00 1.39483e+00 5.58353e+01 340.205 2.97589e+00  -1.07106e+00 0.00000e+00 0.00000e+00 8.63149e+01 340.205 3.04796e+01 340.205 0.8213 
1 1 1 13  48  0  o 10 1.05779e+01 1.02931e+00 2.80637e+02 212.986 -2.50060e+01 -1.62301e+01 0.00000e+00 0.00000e+00 1.13975e+02 212.986 1.66662e+02 32.986  0.9831 
1 1 1 13  48  1  o 17 5.42178e+00 1.12198e+00 1.24875e+02 43.248  4.96853e+00  4.67366e+00  0.00000e+00 0.00000e+00 6.52163e+01 43.248  5.96591e+01 223.248 0.9235 
1 1 1 13  48  2  o 14 7.89638e+00 1.25233e+00 1.54424e+02 328.723 1.03301e+01  -6.27515e+00 0.00000e+00 0.00000e+00 1.32810e+02 328.723 2.16136e+01 148.723 0.9577 
1 1 1 13  48  3  o 8  6.70607e+00 1.25964e+00 1.94213e+02 228.823 -8.35556e+00 -9.55213e+00 0.00000e+00 0.00000e+00 5.03391e+01 228.823 1.43874e+02 48.823  0.9598 
1 1 1 13  48  4  o 9  5.33754e+00 1.35548e+00 8.24289e+01 33.662  3.71393e+00  2.47331e+00  0.00000e+00 0.00000e+00 9.59364e+01 33.662  1.35075e+01 33.662  0.8792 
1 1 1 13  48  5  o 13 9.96132e+00 1.34414e+00 1.78208e+02 337.635 1.70430e+01  -7.01231e+00 0.00000e+00 0.00000e+00 1.90076e+02 337.635 1.18678e+01 337.635 0.9725 
1 1 1 13  48  6  o 8  4.52658e+00 1.43601e+00 8.20277e+01 349.447 3.92151e+00  -7.30562e-01 0.00000e+00 0.00000e+00 6.65306e+01 349.447 1.54971e+01 169.447 0.8631 
1 1 1 13  48  7  o 2  3.86244e+00 1.25714e+00 1.84951e+01 145.104 -6.84225e-01 4.77248e-01  0.00000e+00 0.00000e+00 3.79957e+01 145.104 1.95007e+01 145.104 0.3846 
1 1 1 13  48  8  o 1  3.87313e+00 1.25812e+00 1.08116e+02 132.976 -3.73381e+00 4.00738e+00  0.00000e+00 0.00000e+00 2.49560e+01 132.976 8.31603e+01 312.976 0.9034 
1 1 1 13  48  9  o 8  6.28450e+00 1.75151e+00 8.16258e+01 192.224 -4.73056e+00 -1.02483e+00 0.00000e+00 0.00000e+00 1.30988e+02 192.224 4.93617e+01 192.224 0.8895 
1 1 1 13  49  0  o 1  2.95841e+00 9.67863e-01 4.82322e+01 12.416  1.49523e+00  3.29182e-01  0.00000e+00 0.00000e+00 1.95334e+01 12.416  2.86989e+01 192.416 0.6037 
1 1 1 13  49  1  o 1  1.12456e+01 9.70543e-01 1.54997e+02 51.496  1.22031e+01  1.53391e+01  0.00000e+00 0.00000e+00 2.60858e+02 51.496  1.05861e+02 51.496  0.9741 
1 1 1 13  49  2  o 11 1.88145e+01 8.91341e-01 2.76233e+02 235.236 -3.57379e+01 -5.14895e+01 0.00000e+00 0.00000e+00 4.32567e+02 235.236 1.56334e+02 235.236 0.9920 
1 1 1 13  49  3  o 3  8.12778e+00 1.31694e+00 1.09851e+02 350.926 8.96869e+00  -1.43244e+00 0.00000e+00 0.00000e+00 1.81404e+02 350.926 7.15529e+01 350.926 0.9432 
1 1 1 13  49  4  o 5  5.33645e+00 1.34669e+00 1.14744e+02 339.973 5.88397e+00  -2.14468e+00 0.00000e+00 0.00000e+00 7.10740e+01 339.973 4.36704e+01 159.973 0.9163 
1 1 1 13  49  5  o 11 7.27671e+00 1.47325e+00 1.15201e+02 253.215 -2.43753e+00 -8.08133e+00 0.00000e+00 0.00000e+00 1.44463e+02 253.215 2.92620e+01 253.215 0.9387 
1 1 1 13  49  6  o 18 5.16601e+00 1.56507e+00 9.33583e+01 131.890 -3.21709e+00 3.58673e+00  0.00000e+00 0.00000e+00 8.12482e+01 131.890 1.21100e+01 311.890 0.8890 
1 1 1 13  49  7  o 6  1.14485e+01 1.46397e+00 2.04252e+02 58.261  1.38321e+01  2.23617e+01  0.00000e+00 0.00000e+00 2.22714e+02 58.261  1.84615e+01 58.261  0.9808 
1 1 1 13  49  8  o 7  8.88824e+00 1.73277e+00 1.91863e+02 133.727 -1.15331e+01 1.20574e+01  0.00000e+00 0.00000e+00 1.35840e+02 133.727 5.60234e+01 313.727 0.9696 
1 1 1 13  49  9  o 12 7.18232e+00 1.76515e+00 1.26568e+02 260.929 -1.40953e+00 -8.82860e+00 0.00000e+00 0.00000e+00 1.30795e+02 260.929 4.22642e+00 260.929 0.9423 
1 1 1 13  50  0  o 17 7.45993e+00 1.15231e+00 1.15141e+02 116.566 -3.98926e+00 7.97811e+00  0.00000e+00 0.00000e+00 1.51497e+02 116.566 3.63562e+01 116.566 0.9422 
1 1 1 13  50  1  o 1  4.41556e+00 1.20055e+00 5.47584e+01 321.792 1.99875e+00  -1.57331e+00 0.00000e+00 0.00000e+00 7.42342e+01 321.792 1.94758e+01 321.792 0.7697 
1 1 1 13  50  2  f 0  4.98041e+00 1.24516e+00 8.86971e+01 17.575  4.13174e+00  1.30867e+00  0.00000e+00 0.00000e+00 7.68258e+01 17.575  1.18713e+01 197.575 0.8752 
1 1 1 13  50  3  o 1  1.33723e+01 1.01158e+00 2.30623e+02 221.309 -2.62818e+01 -2.30963e+01 0.00000e+00 0.00000e+00 2.70028e+02 221.309 3.94051e+01 221.309 0.9856 
1 1 1 13  50  4  o 11 3.06096e+00 1.00762e+00 4.24514e+01 327.520 1.30968e+00  -8.33722e-01 0.00000e+00 0.00000e+00 2.83645e+01 327.520 1.40869e+01 147.520 0.6089 
1 1 1 13  50  5  o 4  4.37571e+00 1.25656e+00 5.99723e+01 145.687 -2.38452e+00 1.62738e+00  0.00000e+00 0.00000e+00 7.32859e+01 145.687 1.33136e+01 145.687 0.8013 
1 1 1 13  50  6  o 6  9.47739e+00 1.70131e+00 1.52194e+02 197.335 -1.26189e+01 -3.93878e+00 0.00000e+00 0.00000e+00 1.94179e+02 197.335 4.19851e+01 197.335 0.9614 
1 1 1 13  50  7  o 17 5.42752e+00 1.50029e+00 7.44630e+01 279.636 7.05317e-01  -4.15435e+00 0.00000e+00 0.00000e+00 1.05324e+02 279.636 3.08608e+01 279.636 0.8713 
1 1 1 13  50  8  o 7  6.11700e+00 1.63140e+00 9.94295e+01 206.935 -5.47101e+00 -2.77981e+00 0.00000e+00 0.00000e+00 1.13249e+02 206.935 1.38199e+01 206.935 0.9144 
1 1 1 13  50  9  o 11 4.42138e+00 1.43562e+00 5.41767e+01 261.219 -4.43227e-01 -2.86931e+00 0.00000e+00 0.00000e+00 8.07447e+01 261.219 2.65680e+01 261.219 0.8026 
1 1 1 13  51  0  o 15 1.28523e+01 9.18900e-01 1.84442e+02 232.972 -1.70389e+01 -2.25881e+01 0.00000e+00 0.00000e+00 2.94375e+02 232.972 1.09933e+02 232.972 0.9822 
1 1 1 13  51  1  o 13 6.44300e+00 1.31398e+00 1.52036e+02 335.949 8.88205e+00  -3.96403e+00 0.00000e+00 0.00000e+00 7.95458e+01 335.949 7.24902e+01 155.949 0.9471 
1 1 1 13  51  2  o 17 1.31304e+01 1.01299e+00 2.26459e+02 142.100 -2.76515e+01 2.15263e+01  0.00000e+00 0.00000e+00 2.64895e+02 142.100 3.84360e+01 142.100 0.9856 
1 1 1 13  51  3  o 4  8.20782e+00 1.25693e+00 1.18173e+02 255.233 -2.63663e+00 -1.00026e+01 0.00000e+00 0.00000e+00 1.78093e+02 255.233 5.99195e+01 255.233 0.9504 
1 1 1 13  51  4  o 19 8.04964e+00 1.32637e+00 2.08243e+02 152.971 -1.56586e+01 7.98828e+00  0.00000e+00 0.00000e+00 8.87547e+01 152.971 1.19488e+02 332.971 0.9711 
1 1 1 13  51  5  o 1  4.12888e+00 1.16428e+00 1.23263e+02 34.375  5.38328e+00  3.68250e+00  0.00000e+00 0.00000e+00 2.10564e+01 34.375  1.02206e+02 214.375 0.9198 
1 1 1 13  51  6  o 7  3.94302e+00 1.23882e+00 1.49282e+01 103.265 -1.63045e-01 6.91600e-01  0.00000e+00 0.00000e+00 3.52179e+01 103.265 2.02897e+01 103.265 0.3346 
1 1 1 13  51  7  o 9  5.60374e+00 1.47722e+00 1.70163e+02 347.792 1.05278e+01  -2.27770e+00 0.00000e+00 0.00000e+00 3.27151e+01 347.792 1.37448e+02 167.792 0.9524 
1 1 1 13  51  8  o 6  6.64882e+00 1.80613e+00 1.00278e+02 17.899  6.00138e+00  1.93832e+00  0.00000e+00 0.00000e+00 1.31477e+02 17.899  3.11992e+01 17.899  0.9169 
1 1 1 13  51  9  o 13 6.38078e+00 1.75971e+00 7.31090e+01 129.471 -2.84748e+00 3.45786e+00  0.00000e+00 0.00000e+00 1.40291e+02 129.471 6.71823e+01 129.471 0.8797 
1 1 1 13  52  0  o 1  6.86289e+00 1.18969e+00 2.34703e+02 155.187 -1.54137e+01 7.12638e+00  0.00000e+00 0.00000e+00 1.77977e+01 155.187 2.16905e+02 335.187 0.9701 
1 1 1 13  52  1  o 16 1.09719e+01 1.03400e+00 2.24239e+02 114.493 -1.09765e+01 2.40933e+01  0.00000e+00 0.00000e+00 1.84152e+02 114.493 4.00862e+01 294.493 0.9809 
1 1 1 13  52  2  o 19 2.24211e+01 8.73203e-01 3.40728e+02 307.363 5.57224e+01  -7.29789e+01 0.00000e+00 0.00000e+00 5.05762e+02 307.363 1.65034e+02 307.363 0.9945 
1 1 1 13  52  3  o 1  5.23219e+00 1.27421e+00 7.28164e+01 97.049  -5.11001e-01 4.13228e+00  0.00000e+00 0.00000e+00 9.99566e+01 97.049  2.71402e+01 97.049  0.8695 
1 1 1 13  52  4  o 14 9.60148e+00 1.25038e+00 1.41376e+02 105.638 -4.17014e+00 1.48978e+01  0.00000e+00 0.00000e+00 2.11367e+02 105.638 6.99915e+01 105.638 0.9671 
1 1 1 13  52  5  o 5  5.49464e+00 1.37368e+00 7.78721e+01 225.752 -3.32626e+00 -3.41472e+00 0.00000e+00 0.00000e+00 1.07458e+02 225.752 2.95854e+01 225.752 0.8877 
1 1 1 13  52  6  o 18 3.98387e+00 1.26566e+00 6.75550e+01 302.146 1.75602e+00  -2.79433e+00 0.00000e+00 0.00000e+00 5.81017e+01 302.146 9.45334e+00 122.146 0.8299 
1 1 1 13  52  7  o 17 1.49742e+01 1.23783e+00 2.71228e+02 150.824 -4.42920e+01 2.47295e+01  0.00000e+00 0.00000e+00 2.92285e+02 150.824 2.10567e+01 150.824 0.9901 
1 1 1 13  52  8  o 3  6.61717e+00 1.48927e+00 1.35694e+02 172.843 -1.02761e+01 1.29029e+00  0.00000e+00 0.00000e+00 1.03363e+02 172.843 3.23303e+01 352.843 0.9504 
1 1 1 13  52  9  o 3  7.59377e+00 1.78500e+00 8.28700e+01 60.989  2.97342e+00  5.36182e+00  0.00000e+00 0.00000e+00 1.81057e+02 60.989  9.81873e+01 60.989  0.9143 
1 1 1 13  53  0  o 7  1.92783e+01 8.27848e-01 3.56658e+02 160.360 -8.26142e+01 2.94830e+01  0.00000e+00 0.00000e+00 3.70213e+02 160.360 1.35546e+01 160.360 0.9943 
1 1 1 13  53  1  o 10 5.56957e+00 1.23553e+00 1.25516e+02 28.716  6.27972e+00  3.44028e+00  0.00000e+00 0.00000e+00 7.04255e+01 28.716  5.50903e+01 208.716 0.9273 
1 1 1 13  53  2  o 15 1.17641e+01 9.96881e-01 2.46505e+02 245.107 -1.47687e+01 -3.18267e+01 0.00000e+00 0.00000e+00 1.93604e+02 245.107 5.29007e+01 65.107  0.9856 
1 1 1 13  53  3  o 8  3.97324e+00 1.18806e+00 7.36242e+01 163.823 -3.07680e+00 8.92565e-01  0.00000e+00 0.00000e+00 5.06855e+01 163.823 2.29387e+01 343.823 0.8240 
1 1 1 13  53  4  o 19 3.83971e+00 1.17793e+00 7.65440e+01 7.746   3.38163e+00  4.59956e-01  0.00000e+00 0.00000e+00 4.54382e+01 7.746   3.11059e+01 187.746 0.8364 
1 1 1 13  53  5  o 17 4.35257e+00 1.27334e+00 6.35967e+01 244.496 -1.41255e+00 -2.96091e+00 0.00000e+00 0.00000e+00 7.34479e+01 244.496 9.85112e+00 244.496 0.8288 
1 1 1 13  53  6  o 2  3.99139e+00 1.23950e+00 1.19338e+02 234.350 -3.27103e+00 -4.56048e+00 0.00000e+00 0.00000e+00 1.80537e+01 234.350 1.01284e+02 54.350  0.9059 
1 1 1 13  53  7  o 11 3.79862e+00 1.25209e+00 9.14397e+01 10.887  4.48008e+00  8.61654e-01  0.00000e+00 0.00000e+00 3.59047e+01 10.887  5.55351e+01 190.887 0.8821 
1 1 1 13  53  8  o 7  5.85340e+00 1.71171e+00 1.01607e+02 242.221 -2.79871e+00 -5.31287e+00 0.00000e+00 0.00000e+00 1.01376e+02 242.221 2.31102e-01 62.221  0.9124 
1 1 1 13  53  9  o 16 6.63633e+00 1.75775e+00 1.57817e+02 2.670   1.04787e+01  4.88573e-01  0.00000e+00 0.00000e+00 8.20628e+01 2.670   7.57538e+01 182.669 0.9511 
1 1 1 13  54  0  o 14 7.70581e+00 1.34828e+00 1.68812e+02 175.231 -1.25594e+01 1.04775e+00  0.00000e+00 0.00000e+00 1.11515e+02 175.231 5.72969e+01 355.231 0.9595 
1 1 1 13  54  1  o 12 1.33864e+01 9.23336e-01 2.20943e+02 301.502 1.93398e+01  -3.15568e+01 0.00000e+00 0.00000e+00 2.79950e+02 301.502 5.90073e+01 301.502 0.9864 
1 1 1 13  54  2  o 12 5.94704e+00 1.26810e+00 7.71641e+01 340.034 4.72820e+00  -1.71778e+00 0.00000e+00 0.00000e+00 1.24625e+02 340.034 4.74608e+01 340.034 0.8941 
1 1 1 13  54  3  o 13 1.36207e+01 9.79035e-01 1.98224e+02 207.028 -2.99717e+01 -1.52901e+01 0.00000e+00 0.00000e+00 3.11139e+02 207.028 1.12915e+02 207.028 0.9850 
1 1 1 13  54  4  o 15 7.71657e+00 1.38221e+00 1.43580e+02 82.791  1.56980e+00  1.24113e+01  0.00000e+00 0.00000e+00 1.37499e+02 82.791  6.08073e+00 262.791 0.9592 
1 1 1 13  54  5  o 8  5.69201e+00 1.40482e+00 1.19754e+02 240.646 -3.66403e+00 -6.51480e+00 0.00000e+00 0.00000e+00 8.14290e+01 240.646 3.83253e+01 60.646  0.9305 
1 1 1 13  54  6  o 10 5.58153e+00 1.45353e+00 1.38669e+02 202.380 -8.09451e+00 -3.33294e+00 0.00000e+00 0.00000e+00 6.08825e+01 202.380 7.77863e+01 22.380  0.9410 
1 1 1 13  54  7  o 15 5.08986e+00 1.41374e+00 9.79235e+01 96.056  -6.32705e-01 5.96401e+00  0.00000e+00 0.00000e+00 7.85221e+01 96.056  1.94014e+01 276.056 0.9123 
1 1 1 13  54  8  o 11 5.15455e+00 1.60877e+00 9.67959e+01 336.390 4.71869e+00  -2.06255e+00 0.00000e+00 0.00000e+00 7.88531e+01 336.390 1.79427e+01 156.390 0.8967 
1 1 1 13  54  9  o 16 4.22910e+00 1.38978e+00 3.94368e+01 147.849 -1.83238e+00 1.15175e+00  0.00000e+00 0.00000e+00 7.67531e+01 147.849 3.73163e+01 147.849 0.7230 
1 1 1 13  55  0  o 1  9.59329e+00 1.01695e+00 1.66571e+02 259.434 -3.51232e+00 -1.88302e+01 0.00000e+00 0.00000e+00 1.87484e+02 259.434 2.09129e+01 259.434 0.9735 
1 1 1 13  55  1  o 15 4.80306e+00 1.31777e+00 3.84162e+01 313.051 1.30747e+00  -1.39956e+00 0.00000e+00 0.00000e+00 8.60726e+01 313.051 4.76563e+01 313.051 0.6834 
1 1 1 13  55  2  o 18 1.73926e+01 8.69996e-01 3.09356e+02 142.097 -5.37972e+01 4.18848e+01  0.00000e+00 0.00000e+00 3.45744e+02 142.097 3.63874e+01 142.097 0.9926 
1 1 1 13  55  3  o 10 5.05392e+00 1.25684e+00 1.17374e+02 193.227 -6.43769e+00 -1.51318e+00 0.00000e+00 0.00000e+00 5.92998e+01 193.227 5.80747e+01 13.227  0.9209 
1 1 1 13  55  4  o 5  1.10883e+01 1.10617e+00 1.39636e+02 341.771 1.90617e+01  -6.27776e+00 0.00000e+00 0.00000e+00 2.70765e+02 341.771 1.31129e+02 341.771 0.9748 
1 1 1 13  55  5  o 13 8.75757e+00 1.37794e+00 1.06219e+02 297.585 4.79635e+00  -9.18060e+00 0.00000e+00 0.00000e+00 2.09907e+02 297.585 1.03688e+02 297.585 0.9504 
1 1 1 13  55  6  o 13 5.37468e+00 1.43230e+00 1.15007e+02 93.758  -4.71170e-01 7.17303e+00  0.00000e+00 0.00000e+00 7.43758e+01 93.758  4.06314e+01 273.758 0.9276 
1 1 1 13  55  7  o 6  6.01378e+00 1.51188e+00 9.04821e+01 152.737 -5.25988e+00 2.71050e+00  0.00000e+00 0.00000e+00 1.17671e+02 152.737 2.71893e+01 152.737 0.9111 
1 1 1 13  55  8  o 10 6.05845e+00 1.66256e+00 1.29596e+02 322.459 6.50011e+00  -4.99516e+00 0.00000e+00 0.00000e+00 8.60584e+01 322.459 4.35373e+01 142.459 0.9369 
1 1 1 13  55  9  o 6  5.47828e+00 1.55349e+00 6.73253e+01 190.928 -4.28374e+00 -8.27057e-01 0.00000e+00 0.00000e+00 1.15043e+02 190.928 4.77176e+01 190.928 0.8762 
1 1 1 13  56  0  o 16 1.87793e+01 8.23467e-01 2.60565e+02 166.092 -6.22272e+01 1.54093e+01  0.00000e+00 0.00000e+00 4.45669e+02 166.092 1.85104e+02 166.092 0.9922 
1 1 1 13  56  1  o 6  1.81373e+01 9.69127e-01 2.90926e+02 214.210 -5.54820e+01 -3.77201e+01 0.00000e+00 0.00000e+00 3.91742e+02 214.210 1.00817e+02 214.210 0.9925 
1 1 1 13  56  2  o 14 5.64689e+00 1.29107e+00 8.37898e+01 318.079 3.75649e+00  -3.37303e+00 0.00000e+00 0.00000e+00 1.07845e+02 318.079 2.40554e+01 318.079 0.8945 
1 1 1 13  56  3  o 9  7.31210e+00 1.30310e+00 2.05021e+02 30.748  1.38203e+01  8.22146e+00  0.00000e+00 0.00000e+00 6.37239e+01 30.748  1.41297e+02 210.748 0.9684 
1 1 1 13  56  4  o 13 6.50631e+00 1.44016e+00 7.66333e+01 168.861 -5.26243e+00 1.03614e+00  0.00000e+00 0.00000e+00 1.45969e+02 168.861 6.93353e+01 168.861 0.9012 
1 1 1 13  56  5  o 15 6.99397e+00 1.36900e+00 1.58269e+02 46.421  8.79438e+00  9.24172e+00  0.00000e+00 0.00000e+00 9.66902e+01 46.421  6.15793e+01 226.421 0.9600 
1 1 1 13  56  6  o 6  1.06447e+01 1.32166e+00 1.27295e+02 264.726 -1.48112e+00 -1.60442e+01 0.00000e+00 0.00000e+00 2.64252e+02 264.726 1.36956e+02 264.726 0.9685 
1 1 1 13  56  7  o 11 7.34103e+00 1.61318e+00 6.21661e+01 138.377 -3.76557e+00 3.34593e+00  0.00000e+00 0.00000e+00 1.87201e+02 138.377 1.25035e+02 138.377 0.8942 
1 1 1 13  56  8  o 5  5.42703e+00 1.49878e+00 1.13258e+02 342.485 7.06159e+00  -2.22858e+00 0.00000e+00 0.00000e+00 7.84338e+01 342.485 3.48246e+01 162.485 0.9298 
1 1 1 13  56  9  o 3  6.78800e+00 1.73856e+00 1.06751e+02 229.001 -5.06724e+00 -5.82948e+00 0.00000e+00 0.00000e+00 1.33795e+02 229.001 2.70437e+01 229.001 0.9328 
1 1 1 13  57  0  o 7  1.00827e+01 9.80376e-01 1.79370e+02 190.527 -2.14707e+01 -3.98975e+00 0.00000e+00 0.00000e+00 1.93889e+02 190.527 1.45183e+01 190.527 0.9768 
1 1 1 13  57  1  o 18 5.55440e+00 1.34870e+00 7.84969e+01 22.268  4.17903e+00  1.71122e+00  0.00000e+00 0.00000e+00 1.07002e+02 22.268  2.85055e+01 22.268  0.8808 
1 1 1 13  57  2  o 17 1.56241e+01 9.16080e-01 2.83833e+02 29.101  5.11949e+01  2.84958e+01  0.00000e+00 0.00000e+00 3.03759e+02 29.101  1.99257e+01 29.101  0.9914 
1 1 1 13  57  3  o 17 1.21210e+01 1.06398e+00 1.74391e+02 235.700 -1.61295e+01 -2.36453e+01 0.00000e+00 0.00000e+00 2.77459e+02 235.700 1.03069e+02 235.700 0.9824 
1 1 1 13  57  4  o 3  4.57433e+00 1.25404e+00 7.35592e+01 43.476  2.90603e+00  2.75537e+00  0.00000e+00 0.00000e+00 7.64110e+01 43.476  2.85174e+00 43.476  0.8637 
1 1 1 13  57  5  o 19 1.08145e+01 1.27853e+00 1.83725e+02 254.988 -6.49367e+00 -2.42143e+01 0.00000e+00 0.00000e+00 2.18610e+02 254.988 3.48853e+01 254.988 0.9798 
1 1 1 13  57  6  o 15 3.43503e+00 1.13022e+00 3.59604e+01 331.348 1.53842e+00  -8.40572e-01 0.00000e+00 0.00000e+00 4.91909e+01 331.348 1.32304e+01 331.348 0.6528 
1 1 1 13  57  7  o 11 5.14193e+00 1.47921e+00 5.77704e+01 279.120 5.46556e-01  -3.40461e+00 0.00000e+00 0.00000e+00 1.05953e+02 279.120 4.81831e+01 279.120 0.8384 
1 1 1 13  57  8  o 17 4.70262e+00 1.43937e+00 1.27281e+02 223.684 -5.10733e+00 -4.87793e+00 0.00000e+00 0.00000e+00 3.81602e+01 223.684 8.91208e+01 43.684  0.9262 
1 1 1 13  57  9  o 14 3.93706e+00 1.33446e+00 9.87067e+01 343.889 5.28232e+00  -1.52573e+00 0.00000e+00 0.00000e+00 3.64465e+01 343.889 6.22601e+01 163.889 0.9038 
1 1 1 13  58  0  o 10 3.96145e+00 1.09938e+00 7.75531e+01 75.543  9.01796e-01  3.49783e+00  0.00000e+00 0.00000e+00 4.95514e+01 75.543  2.80017e+01 255.543 0.8468 
1 1 1 13  58  1  o 17 1.37755e+01 1.07389e+00 2.91870e+02 75.991  1.21603e+01  4.87386e+01  0.00000e+00 0.00000e+00 2.25144e+02 75.991  6.67256e+01 255.991 0.9900 
1 1 1 13  58  2  o 18 7.32101e+00 1.28703e+00 1.23592e+02 284.679 2.47945e+00  -9.46541e+00 0.00000e+00 0.00000e+00 1.39477e+02 284.679 1.58843e+01 284.679 0.9474 
1 1 1 13  58  3  o 3  6.87691e+00 1.23310e+00 1.28945e+02 234.641 -6.22814e+00 -8.77703e+00 0.00000e+00 0.00000e+00 1.19539e+02 234.641 9.40640e+00 54.641  0.9523 
1 1 1 13  58  4  o 18 1.08541e+01 1.15159e+00 2.49965e+02 49.011  2.25415e+01  2.59413e+01  0.00000e+00 0.00000e+00 1.55942e+02 49.011  9.40223e+01 229.011 0.9853 
1 1 1 13  58  5  o 12 5.78409e+00 1.42226e+00 1.35783e+02 282.841 1.90599e+00  -8.36172e+00 0.00000e+00 0.00000e+00 7.05659e+01 282.841 6.52175e+01 102.841 0.9398 
1 1 1 13  58  6  o 4  4.01936e+00 1.25991e+00 9.51436e+01 24.936  4.60658e+00  2.14183e+00  0.00000e+00 0.00000e+00 4.14772e+01 24.936  5.36664e+01 204.936 0.8952 
1 1 1 13  58  7  o 16 1.14892e+01 1.34603e+00 2.42840e+02 229.526 -2.32686e+01 -2.72690e+01 0.00000e+00 0.00000e+00 1.87326e+02 229.526 5.55148e+01 49.526  0.9860 
1 1 1 13  58  8  o 14 4.13173e+00 1.33787e+00 8.35327e+01 20.837  4.29594e+00  1.63501e+00  0.00000e+00 0.00000e+00 5.50349e+01 20.837  2.84978e+01 200.837 0.8831 
1 1 1 13  58  9  f 0  7.12006e+00 1.78125e+00 6.06029e+01 170.160 -4.54437e+00 7.88249e-01  0.00000e+00 0.00000e+00 1.78305e+02 170.160 1.17702e+02 170.160 0.8835 
1 1 1 13  59  0  o 5  3.64517e+00 1.08207e+00 8.98498e+01 78.507  8.11327e-01  3.99020e+00  0.00000e+00 0.00000e+00 2.97770e+01 78.507  6.00728e+01 258.507 0.8662 
1 1 1 13  59  1  o 11 4.14759e+00 1.19552e+00 1.08224e+02 153.151 -4.54401e+00 2.30018e+00  0.00000e+00 0.00000e+00 3.25593e+01 153.151 7.56649e+01 333.151 0.8955 
1 1 1 13  59  2  o 9  1.02155e+01 1.11174e+00 1.18491e+02 62.822  7.28867e+00  1.41955e+01  0.00000e+00 0.00000e+00 2.56551e+02 62.822  1.38060e+02 62.822  0.9681 
1 1 1 13  59  3  f 0  4.74011e+00 1.25471e+00 4.44420e+01 51.125  1.57383e+00  1.95221e+00  0.00000e+00 0.00000e+00 9.32654e+01 51.125  4.88235e+01 51.125  0.7658 
1 1 1 13  59  4  o 3  2.90754e+00 9.75313e-01 3.88395e+01 104.936 -4.20181e-01 1.57513e+00  0.00000e+00 0.00000e+00 3.03071e+01 104.936 8.53232e+00 284.936 0.6267 
1 1 1 13  59  5  o 9  4.13753e+00 1.24403e+00 4.25451e+01 230.723 -1.45679e+00 -1.78130e+00 0.00000e+00 0.00000e+00 7.39074e+01 230.723 3.13623e+01 230.723 0.7415 
1 1 1 13  59  6  o 7  5.31797e+00 1.44715e+00 1.19238e+02 214.771 -5.89866e+00 -4.09518e+00 0.00000e+00 0.00000e+00 6.80135e+01 214.771 5.12245e+01 34.771  0.9275 
1 1 1 13  59  7  o 16 5.86095e+00 1.50702e+00 1.53770e+02 193.503 -1.02434e+01 -2.45988e+00 0.00000e+00 0.00000e+00 5.79199e+01 193.503 9.58498e+01 13.503  0.9513 
1 1 1 13  59  8  o 1  5.01618e+00 1.47351e+00 8.45855e+01 120.565 -2.64524e+00 4.47904e+00  0.00000e+00 0.00000e+00 8.64289e+01 120.565 1.84338e+00 120.565 0.8979 
1 1 1 13  59  9  o 18 4.12446e+00 1.36104e+00 5.99281e+01 22.331  3.21897e+00  1.32222e+00  0.00000e+00 0.00000e+00 7.16320e+01 22.331  1.17039e+01 22.331  0.8400 
1 1 1 13  60  0  o 12 1.59114e+01 8.27973e-01 2.46924e+02 124.989 -3.03979e+01 4.34309e+01  0.00000e+00 0.00000e+00 3.50083e+02 124.989 1.03160e+02 124.989 0.9905 
1 1 1 13  60  1  o 18 8.07964e+00 1.18676e+00 1.46189e+02 320.818 1.15731e+01  -9.43270e+00 0.00000e+00 0.00000e+00 1.49578e+02 320.818 3.38851e+00 320.818 0.9659 
1 1 1 13  60  2  o 6  5.78381e+00 1.31581e+00 7.00567e+01 126.924 -2.81614e+00 3.74750e+00  0.00000e+00 0.00000e+00 1.24148e+02 126.924 5.40914e+01 126.924 0.8856 
1 1 1 13  60  3  o 11 7.50461e+00 1.24350e+00 1.39621e+02 88.861  2.50328e-01  1.25893e+01  0.00000e+00 0.00000e+00 1.33474e+02 88.861  6.14709e+00 268.861 0.9594 
1 1 1 13  60  4  o 12 3.95606e+00 1.20164e+00 1.16892e+02 250.766 -2.01350e+00 -5.77088e+00 0.00000e+00 0.00000e+00 2.03055e+01 250.766 9.65866e+01 70.766  0.9141 
1 1 1 13  60  5  f 0  9.77352e+00 1.31902e+00 1.66447e+02 315.895 1.47520e+01  -1.42984e+01 0.00000e+00 0.00000e+00 1.95317e+02 315.895 2.88696e+01 315.895 0.9754 
1 1 1 13  60  6  o 11 4.33028e+00 1.30569e+00 9.77002e+01 339.096 5.19141e+00  -1.98287e+00 0.00000e+00 0.00000e+00 5.10311e+01 339.096 4.66691e+01 159.095 0.9049 
1 1 1 13  60  7  o 14 9.37892e+00 1.63847e+00 2.20800e+02 46.624  1.50806e+01  1.59604e+01  0.00000e+00 0.00000e+00 1.27039e+02 46.624  9.37608e+01 226.624 0.9770 
1 1 1 13  60  8  f 0  4.80468e+00 1.46957e+00 1.33116e+02 209.365 -6.91340e+00 -3.89002e+00 0.00000e+00 0.00000e+00 3.73736e+01 209.365 9.57426e+01 29.365  0.9347 
1 1 1 13  60  9  o 18 3.77771e+00 1.27264e+00 7.36841e+01 75.120  1.06564e+00  4.01070e+00  0.00000e+00 0.00000e+00 5.09546e+01 75.120  2.27296e+01 255.120 0.8690 
1 1 1 13  61  0  o 12 5.82917e+00 1.21511e+00 6.11892e+01 244.588 -1.90269e+00 -4.00483e+00 0.00000e+00 0.00000e+00 1.32726e+02 244.588 7.15367e+01 244.588 0.8784 
1 1 1 13  61  1  o 18 4.55654e+00 1.14652e+00 1.27146e+02 159.282 -6.85964e+00 2.59456e+00  0.00000e+00 0.00000e+00 3.32673e+01 159.282 9.38784e+01 339.282 0.9291 
1 1 1 13  61  2  o 9  6.38848e+00 1.26200e+00 8.39767e+01 338.268 5.90428e+00  -2.35345e+00 0.00000e+00 0.00000e+00 1.38236e+02 338.268 5.42594e+01 338.268 0.9176 
1 1 1 13  61  3  o 8  1.32268e+01 1.05461e+00 1.90858e+02 26.674  3.12040e+01  1.56759e+01  0.00000e+00 0.00000e+00 3.03501e+02 26.674  1.12643e+02 26.674  0.9856 
1 1 1 13  61  4  o 1  1.48255e+01 1.00541e+00 3.28020e+02 277.258 8.48385e+00  -6.66142e+01 0.00000e+00 0.00000e+00 2.30174e+02 277.258 9.78459e+01 97.258  0.9925 
1 1 1 13  61  5  o 12 5.87889e+00 1.40883e+00 6.75462e+01 111.737 -1.74810e+00 4.38454e+00  0.00000e+00 0.00000e+00 1.30195e+02 111.737 6.26487e+01 111.737 0.8865 
1 1 1 13  61  6  o 19 3.64052e+00 1.13608e+00 7.57804e+01 327.809 3.37756e+00  -2.12622e+00 0.00000e+00 0.00000e+00 4.34774e+01 327.809 3.23031e+01 147.809 0.8632 
1 1 1 13  61  7  o 16 1.17230e+01 1.42042e+00 2.59815e+02 151.879 -3.41223e+01 1.82354e+01  0.00000e+00 0.00000e+00 1.79353e+02 151.879 8.04622e+01 331.879 0.9870 
1 1 1 13  61  8  o 9  8.16286e+00 1.64028e+00 1.08586e+02 47.801  6.80575e+00  7.50607e+00  0.00000e+00 0.00000e+00 1.85550e+02 47.801  7.69640e+01 47.801  0.9493 
1 1 1 13  61  9  o 10 4.04596e+00 1.33001e+00 4.83989e+01 109.099 -9.59765e-01 2.77181e+00  0.00000e+00 0.00000e+00 7.52208e+01 109.099 2.68219e+01 109.099 0.8049 
1 1 1 13  62  0  o 13 4.59231e+00 1.22099e+00 9.28365e+01 242.310 -2.41858e+00 -4.60858e+00 0.00000e+00 0.00000e+00 6.33101e+01 242.310 2.95264e+01 62.310  0.8979 
1 1 1 13  62  1  o 3  6.76487e+00 1.18085e+00 8.92446e+01 322.714 5.95761e+00  -4.53621e+00 0.00000e+00 0.00000e+00 1.49263e+02 322.714 6.00187e+01 322.714 0.9306 
1 1 1 13  62  2  o 3  1.55000e+01 9.12373e-01 3.05636e+02 351.543 6.73266e+01  -1.00106e+01 0.00000e+00 0.00000e+00 2.77516e+02 351.543 2.81194e+01 171.543 0.9926 
1 1 1 13  62  3  o 2  8.31371e+00 1.24359e+00 1.70823e+02 124.780 -9.51576e+00 1.37016e+01  0.00000e+00 0.00000e+00 1.34802e+02 124.780 3.60207e+01 304.780 0.9695 
1 1 1 13  62  4  o 2  5.20392e+00 1.31016e+00 1.06946e+02 202.514 -6.44741e+00 -2.67242e+00 0.00000e+00 0.00000e+00 7.56849e+01 202.514 3.12608e+01 22.514  0.9253 
1 1 1 13  62  5  o 14 1.00927e+01 1.26754e+00 1.35659e+02 253.754 -4.84913e+00 -1.66410e+01 0.00000e+00 0.00000e+00 2.36016e+02 253.754 1.00357e+02 253.754 0.9707 
1 1 1 13  62  6  o 1  4.53625e+00 1.25874e+00 9.50025e+01 357.541 5.85488e+00  -2.51425e-01 0.00000e+00 0.00000e+00 6.16549e+01 357.541 3.33476e+01 177.541 0.9101 
1 1 1 13  62  7  o 18 4.82270e+00 1.48370e+00 7.24275e+01 339.079 3.88707e+00  -1.48595e+00 0.00000e+00 0.00000e+00 8.66987e+01 339.079 1.42712e+01 339.079 0.8695 
1 1 1 13  62  8  o 17 5.05360e+00 1.48187e+00 1.06098e+02 134.292 -4.76620e+00 4.88542e+00  0.00000e+00 0.00000e+00 7.10289e+01 134.292 3.50688e+01 314.292 0.9235 
1 1 1 13  63  0  o 14 5.86585e+00 1.10830e+00 1.33815e+02 5.285   1.00790e+01  9.32321e-01  0.00000e+00 0.00000e+00 7.69960e+01 5.285   5.68194e+01 185.285 0.9492 
1 1 1 13  63  1  o 8  7.32759e+00 1.22376e+00 8.32522e+01 152.187 -6.55412e+00 3.45753e+00  0.00000e+00 0.00000e+00 1.74840e+02 152.187 9.15875e+01 152.187 0.9298 
1 1 1 13  63  2  o 13 5.12443e+00 1.29701e+00 1.35705e+02 290.724 2.95919e+00  -7.82151e+00 0.00000e+00 0.00000e+00 4.64786e+01 290.724 8.92266e+01 110.724 0.9382 
1 1 1 13  63  3  o 1  6.31018e+00 1.29847e+00 1.46716e+02 242.122 -5.08197e+00 -9.60692e+00 0.00000e+00 0.00000e+00 8.12153e+01 242.122 6.55010e+01 62.122  0.9528 
1 1 1 13  63  4  o 2  3.37391e+00 1.07329e+00 7.64269e+01 94.198  -2.77257e-01 3.77743e+00  0.00000e+00 0.00000e+00 3.29430e+01 94.198  4.34839e+01 274.198 0.8548 
1 1 1 13  63  5  o 9  4.57081e+00 1.31445e+00 1.17277e+02 41.825  5.22028e+00  4.67162e+00  0.00000e+00 0.00000e+00 4.31975e+01 41.825  7.40797e+01 221.825 0.9256 
1 1 1 13  63  6  o 16 4.12043e+00 1.29390e+00 7.66028e+01 28.661  3.73007e+00  2.03883e+00  0.00000e+00 0.00000e+00 5.97908e+01 28.661  1.68121e+01 208.661 0.8725 
1 1 1 13  63  7  o 11 4.69800e+00 1.46814e+00 6.85825e+01 110.898 -1.39940e+00 3.66497e+00  0.00000e+00 0.00000e+00 8.48060e+01 110.898 1.62235e+01 110.898 0.8605 
1 1 1 13  63  8  o 17 4.94428e+00 1.47173e+00 1.31370e+02 299.544 4.30255e+00  -7.59103e+00 0.00000e+00 0.00000e+00 4.51403e+01 299.544 8.62294e+01 119.544 0.9408 
1 1 1 13  64  0  o 3  6.21171e+00 1.20498e+00 7.76018e+01 57.374  3.19302e+00  4.98776e+00  0.00000e+00 0.00000e+00 1.36641e+02 57.374  5.90387e+01 57.374  0.9111 
1 1 1 13  64  1  o 11 5.96355e+00 1.23593e+00 6.42684e+01 319.577 3.63787e+00  -3.09853e+00 0.00000e+00 0.00000e+00 1.36287e+02 319.577 7.20191e+01 319.577 0.8880 
1 1 1 13  64  2  o 5  5.44435e+00 1.25973e+00 5.34816e+01 92.835  -1.83682e-01 3.70951e+00  0.00000e+00 0.00000e+00 1.22177e+02 92.835  6.86956e+01 92.835  0.8515 
1 1 1 13  64  3  o 11 4.34615e+00 1.18170e+00 1.09683e+02 3.307   6.46188e+00  3.73420e-01  0.00000e+00 0.00000e+00 4.17282e+01 3.307   6.79543e+01 183.307 0.9191 
1 1 1 13  64  4  o 5  6.12522e+00 1.41562e+00 4.57654e+01 321.787 2.60516e+00  -2.05101e+00 0.00000e+00 0.00000e+00 1.47191e+02 321.787 1.01426e+02 321.787 0.8309 
1 1 1 13  64  5  o 18 9.20810e+00 1.33891e+00 1.18993e+02 203.012 -1.28280e+01 -5.44826e+00 0.00000e+00 0.00000e+00 2.17447e+02 203.012 9.84533e+01 203.012 0.9634 
1 1 1 13  64  6  o 14 4.30952e+00 1.28344e+00 2.78214e+01 88.505  4.19068e-02  1.60533e+00  0.00000e+00 0.00000e+00 7.37301e+01 88.505  4.59086e+01 88.505  0.6212 
1 1 1 13  64  7  o 9  4.11040e+00 1.36511e+00 5.53592e+01 254.001 -8.36742e-01 -2.91817e+00 0.00000e+00 0.00000e+00 7.13514e+01 254.001 1.59922e+01 254.001 0.8126 
1 1 1 13  64  8  o 7  4.72105e+00 1.42395e+00 1.28100e+02 80.442  1.35018e+00  8.01850e+00  0.00000e+00 0.00000e+00 3.96053e+01 80.442  8.84951e+01 260.442 0.9363 
1 1 1 13  65  0  o 14 8.32962e+00 1.11206e+00 1.32406e+02 204.798 -1.33901e+01 -6.18648e+00 0.00000e+00 0.00000e+00 1.71967e+02 204.798 3.95612e+01 204.798 0.9655 
1 1 1 13  65  1  o 9  1.00168e+01 1.05581e+00 1.74651e+02 18.226  2.15763e+01  7.10479e+00  0.00000e+00 0.00000e+00 1.96203e+02 18.226  2.15520e+01 18.226  0.9777 
1 1 1 13  65  2  o 17 9.50574e+00 1.15185e+00 1.94528e+02 240.019 -1.17765e+01 -2.04130e+01 0.00000e+00 0.00000e+00 1.57847e+02 240.019 3.66809e+01 60.019  0.9785 
1 1 1 13  65  3  o 12 4.89769e+00 1.30097e+00 1.19518e+02 6.961   7.41977e+00  9.05955e-01  0.00000e+00 0.00000e+00 5.31845e+01 6.961   6.63331e+01 186.961 0.9305 
1 1 1 13  65  4  o 5  5.62353e+00 1.38105e+00 1.18788e+02 157.614 -7.28675e+00 3.00126e+00  0.00000e+00 0.00000e+00 8.03654e+01 157.614 3.84227e+01 337.614 0.9342 
1 1 1 13  65  5  o 12 3.55804e+00 1.14766e+00 4.93835e+01 39.746  1.97378e+00  1.64136e+00  0.00000e+00 0.00000e+00 5.47824e+01 39.746  5.39893e+00 39.746  0.7721 
1 1 1 13  65  6  o 14 9.24253e+00 1.38420e+00 1.37535e+02 73.661  4.37373e+00  1.49192e+01  0.00000e+00 0.00000e+00 2.01519e+02 73.661  6.39836e+01 73.661  0.9673 
1 1 1 13  65  7  o 5  4.64736e+00 1.48928e+00 7.05408e+01 76.300  9.59644e-01  3.93652e+00  0.00000e+00 0.00000e+00 8.20202e+01 76.300  1.14794e+01 76.300  0.8655 
1 1 1 13  65  8  o 4  5.05450e+00 1.51431e+00 7.65097e+01 55.030  2.90787e+00  4.15751e+00  0.00000e+00 0.00000e+00 9.50983e+01 55.030  1.85886e+01 55.030  0.8951 
1 1 1 13  66  0  o 18 3.67355e+00 1.03423e+00 2.20304e+01 129.440 -7.48833e-01 9.10337e-01  0.00000e+00 0.00000e+00 4.83295e+01 129.440 2.62991e+01 129.440 0.5062 
1 1 1 13  66  1  o 7  4.40601e+00 1.13882e+00 7.14208e+01 72.654  1.20470e+00  3.85682e+00  0.00000e+00 0.00000e+00 7.28790e+01 72.654  1.45823e+00 72.654  0.8651 
1 1 1 13  66  2  o 13 8.71602e+00 1.19828e+00 1.23533e+02 193.003 -1.34116e+01 -3.09708e+00 0.00000e+00 0.00000e+00 1.94364e+02 193.003 7.08304e+01 193.003 0.9630 
1 1 1 13  66  3  o 19 7.74279e+00 1.31955e+00 1.17167e+02 281.289 2.23269e+00  -1.11843e+01 0.00000e+00 0.00000e+00 1.63032e+02 281.289 4.58643e+01 281.289 0.9551 
1 1 1 13  66  4  o 3  5.26748e+00 1.24632e+00 9.89931e+01 111.858 -2.74596e+00 6.84529e+00  0.00000e+00 0.00000e+00 8.65769e+01 111.858 1.24162e+01 291.858 0.9295 
1 1 1 13  66  5  o 19 8.12966e+00 1.34029e+00 1.23727e+02 151.407 -1.15375e+01 6.28853e+00  0.00000e+00 0.00000e+00 1.72505e+02 151.407 4.87788e+01 151.407 0.9612 
1 1 1 13  66  6  o 16 4.16816e+00 1.27735e+00 8.48357e+01 82.259  6.50706e-01  4.78686e+00  0.00000e+00 0.00000e+00 5.57176e+01 82.259  2.91180e+01 262.259 0.8893 
1 1 1 13  66  7  o 19 4.46248e+00 1.40008e+00 1.29590e+02 76.806  1.78235e+00  7.60249e+00  0.00000e+00 0.00000e+00 2.84000e+01 76.806  1.01190e+02 256.806 0.9336 
1 1 1 13  66  8  o 8  5.78956e+00 1.63967e+00 1.20877e+02 328.951 7.11765e+00  -4.28494e+00 0.00000e+00 0.00000e+00 8.50206e+01 328.951 3.58569e+01 148.951 0.9377 
1 1 1 13  67  0  o 7  5.49088e+00 1.26296e+00 7.73290e+01 71.902  1.57746e+00  4.82677e+00  0.00000e+00 0.00000e+00 1.08632e+02 71.902  3.13028e+01 71.902  0.8952 
1 1 1 13  67  1  o 17 1.29157e+01 9.44276e-01 1.84146e+02 235.848 -2.08117e+01 -3.06794e+01 0.00000e+00 0.00000e+00 2.98105e+02 235.848 1.13958e+02 235.848 0.9864 
1 1 1 13  67  2  f 0  4.00201e+00 1.14462e+00 6.67114e+01 35.552  3.05333e+00  2.18210e+00  0.00000e+00 0.00000e+00 6.26071e+01 35.552  4.10427e+00 215.552 0.8533 
1 1 1 13  67  3  o 2  5.27877e+00 1.33644e+00 1.41453e+02 320.625 7.00037e+00  -5.74508e+00 0.00000e+00 0.00000e+00 4.71338e+01 320.625 9.43194e+01 140.625 0.9431 
1 1 1 13  67  4  o 11 9.30313e+00 1.25651e+00 1.35708e+02 45.665  1.18212e+01  1.20988e+01  0.00000e+00 0.00000e+00 2.06244e+02 45.665  7.05362e+01 45.665  0.9700 
1 1 1 13  67  5  o 7  1.46166e+01 1.10774e+00 2.25574e+02 179.712 -4.94376e+01 2.48428e-01  0.00000e+00 0.00000e+00 3.22819e+02 179.712 9.72451e+01 179.712 0.9898 
1 1 1 13  67  6  f 0  6.64778e+00 1.47476e+00 1.46883e+02 26.940  1.06621e+01  5.41849e+00  0.00000e+00 0.00000e+00 9.43631e+01 26.940  5.25204e+01 206.940 0.9572 
1 1 1 13  67  7  o 2  1.17174e+01 1.49275e+00 2.14684e+02 31.439  2.83898e+01  1.73556e+01  0.00000e+00 0.00000e+00 2.22865e+02 31.439  8.18104e+00 31.439  0.9849 
1 1 1 13  67  8  o 3  7.31062e+00 1.73729e+00 1.63970e+02 206.070 -1.18055e+01 -5.77590e+00 0.00000e+00 0.00000e+00 1.02473e+02 206.070 6.14971e+01 26.070  0.9612 
1 1 1 13  68  0  o 3  5.69793e+00 1.23517e+00 1.14589e+02 44.447  5.82704e+00  5.71569e+00  0.00000e+00 0.00000e+00 8.72742e+01 44.447  2.73150e+01 224.447 0.9366 
1 1 1 13  68  1  o 14 9.14448e+00 1.13029e+00 1.93762e+02 141.525 -1.96718e+01 1.56337e+01  0.00000e+00 0.00000e+00 1.45356e+02 141.525 4.84062e+01 321.525 0.9799 
1 1 1 13  68  2  o 19 6.31980e+00 1.23577e+00 1.10332e+02 71.655  2.95772e+00  8.92001e+00  0.00000e+00 0.00000e+00 1.15832e+02 71.655  5.50033e+00 71.655  0.9452 
1 1 1 13  68  3  o 5  6.85284e+00 1.40543e+00 1.61991e+02 153.800 -1.22562e+01 6.03073e+00  0.00000e+00 0.00000e+00 8.78755e+01 153.800 7.41160e+01 333.800 0.9627 
1 1 1 13  68  4  o 2  5.55638e+00 1.34266e+00 1.60069e+02 299.464 5.34005e+00  -9.45220e+00 0.00000e+00 0.00000e+00 4.05052e+01 299.464 1.19564e+02 119.464 0.9528 
1 1 1 13  68  5  o 2  3.05178e+00 1.04244e+00 2.91749e+01 12.402  1.31668e+00  2.89536e-01  0.00000e+00 0.00000e+00 3.51616e+01 12.402  5.98675e+00 12.402  0.5563 
1 1 1 13  68  6  o 13 4.42352e+00 1.35712e+00 7.80083e+01 280.504 8.53707e-01  -4.60435e+00 0.00000e+00 0.00000e+00 7.04574e+01 280.504 7.55097e+00 100.504 0.8855 
1 1 1 13  68  7  f 0  4.84958e+00 1.46242e+00 8.09867e+01 230.651 -3.25645e+00 -3.97163e+00 0.00000e+00 0.00000e+00 8.38174e+01 230.651 2.83073e+00 230.651 0.8964 
1 1 1 13  68  8  o 7  4.03811e+00 1.30176e+00 5.32946e+01 192.880 -3.19236e+00 -7.29983e-01 0.00000e+00 0.00000e+00 7.35269e+01 192.880 2.02323e+01 192.880 0.8284 
1 1 1 13  69  0  o 14 7.72225e+00 1.17819e+00 6.90656e+01 151.259 -6.42210e+00 3.52202e+00  0.00000e+00 0.00000e+00 2.02247e+02 151.259 1.33181e+02 151.259 0.9290 
1 1 1 13  69  1  o 14 4.48308e+00 1.16993e+00 7.56984e+01 91.890  -1.57224e-01 4.76420e+00  0.00000e+00 0.00000e+00 7.48800e+01 91.890  8.18401e-01 271.890 0.8877 
1 1 1 13  69  2  o 13 3.72847e+00 1.13747e+00 9.07770e+01 319.809 3.53017e+00  -2.98226e+00 0.00000e+00 0.00000e+00 3.39605e+01 319.809 5.68165e+01 139.809 0.8838 
1 1 1 13  69  3  f 0  4.12989e+00 1.24020e+00 1.40202e+02 180.480 -7.83837e+00 -6.57255e-02 0.00000e+00 0.00000e+00 5.84487e+00 180.480 1.34357e+02 0.480   0.9338 
1 1 1 13  69  4  o 1  7.26323e+00 1.35418e+00 1.09712e+02 349.267 1.01217e+01  -1.91856e+00 0.00000e+00 0.00000e+00 1.51707e+02 349.267 4.19950e+01 349.267 0.9502 
1 1 1 13  69  5  o 10 4.90102e+00 1.23848e+00 5.10680e+01 316.530 2.54574e+00  -2.41324e+00 0.00000e+00 0.00000e+00 1.05199e+02 316.530 5.41309e+01 316.530 0.8415 
1 1 1 13  69  6  o 6  4.83643e+00 1.40617e+00 4.65480e+01 106.337 -8.55876e-01 2.91985e+00  0.00000e+00 0.00000e+00 1.02480e+02 106.337 5.59323e+01 106.337 0.8131 
1 1 1 13  69  7  o 9  9.76959e+00 1.59657e+00 1.76663e+02 44.619  1.51543e+01  1.49539e+01  0.00000e+00 0.00000e+00 1.84818e+02 44.619  8.15462e+00 44.619  0.9762 
1 1 1 13  69  8  o 18 4.16581e+00 1.26442e+00 8.23239e+01 179.436 -5.60047e+00 5.51572e-02  0.00000e+00 0.00000e+00 6.06834e+01 179.436 2.16405e+01 359.436 0.9057 
1 1 1 13  70  0  o 4  3.06162e+00 1.00244e+00 4.68314e+01 53.980  1.30957e+00  1.80113e+00  0.00000e+00 0.00000e+00 3.78786e+01 53.980  8.95276e+00 233.980 0.7317 
1 1 1 13  70  1  o 17 4.35102e+00 1.11237e+00 5.32212e+01 330.155 2.78328e+00  -1.59690e+00 0.00000e+00 0.00000e+00 8.24635e+01 330.155 2.92423e+01 330.155 0.8243 
1 1 1 13  70  2  o 16 7.66912e+00 1.30534e+00 1.22583e+02 82.031  1.77042e+00  1.26470e+01  0.00000e+00 0.00000e+00 1.56066e+02 82.031  3.34826e+01 82.031  0.9600 
1 1 1 13  70  3  o 12 4.04882e+00 1.20983e+00 1.65145e+01 202.458 -8.18347e-01 -3.38263e-01 0.00000e+00 0.00000e+00 4.54703e+01 202.458 2.89559e+01 202.458 0.4044 
1 1 1 13  70  4  o 17 7.35510e+00 1.28947e+00 1.94571e+02 288.301 6.24449e+00  -1.88805e+01 0.00000e+00 0.00000e+00 7.68931e+01 288.301 1.17678e+02 108.301 0.9745 
1 1 1 13  70  5  o 14 4.59103e+00 1.30985e+00 9.12697e+01 235.554 -3.24885e+00 -4.73670e+00 0.00000e+00 0.00000e+00 6.66816e+01 235.554 2.45881e+01 55.554  0.9082 
1 1 1 13  70  6  o 14 5.42384e+00 1.46225e+00 1.43595e+02 191.582 -9.99546e+00 -2.04849e+00 0.00000e+00 0.00000e+00 5.15657e+01 191.582 9.20298e+01 11.582  0.9497 
1 1 1 13  70  7  o 1  4.86910e+00 1.47166e+00 7.81378e+01 55.453  2.90266e+00  4.21600e+00  0.00000e+00 0.00000e+00 8.71965e+01 55.453  9.05868e+00 55.453  0.8961 
1 1 1 13  70  8  o 19 5.63016e+00 1.55644e+00 9.08512e+01 170.065 -6.90688e+00 1.20985e+00  0.00000e+00 0.00000e+00 1.06655e+02 170.065 1.58033e+01 170.065 0.9257 
1 1 1 13  71  0  f 0  6.30213e+00 1.37775e+00 1.09199e+02 321.896 6.78878e+00  -5.32389e+00 0.00000e+00 0.00000e+00 1.14787e+02 321.896 5.58844e+00 321.896 0.9401 
1 1 1 13  71  1  o 15 8.06956e+00 1.15737e+00 1.45316e+02 53.902  1.03552e+01  1.42015e+01  0.00000e+00 0.00000e+00 1.51090e+02 53.902  5.77335e+00 53.902  0.9711 
1 1 1 13  71  2  o 13 7.62376e+00 1.31949e+00 1.93569e+02 198.834 -1.82632e+01 -6.22925e+00 0.00000e+00 0.00000e+00 8.73367e+01 198.834 1.06232e+02 18.834  0.9737 
1 1 1 13  71  3  o 8  5.11960e+00 1.36347e+00 1.15728e+02 8.526   7.52784e+00  1.12854e+00  0.00000e+00 0.00000e+00 6.48511e+01 8.526   5.08765e+01 188.526 0.9318 
1 1 1 13  71  4  o 16 4.72372e+00 1.25749e+00 2.96083e+01 146.207 -1.61061e+00 1.07791e+00  0.00000e+00 0.00000e+00 9.33329e+01 146.207 6.37246e+01 146.207 0.6873 
1 1 1 13  71  5  o 11 7.18099e+00 1.49459e+00 9.45602e+01 215.807 -6.78788e+00 -4.89675e+00 0.00000e+00 0.00000e+00 1.60616e+02 215.807 6.60554e+01 215.807 0.9382 
1 1 1 13  71  6  o 10 6.55985e+00 1.41595e+00 5.68083e+01 188.291 -5.16053e+00 -7.51981e-01 0.00000e+00 0.00000e+00 1.66382e+02 188.291 1.09574e+02 188.291 0.8981 
1 1 1 13  71  7  o 8  3.35073e+00 1.13790e+00 5.09412e+01 63.963  1.27932e+00  2.61872e+00  0.00000e+00 0.00000e+00 5.10576e+01 63.963  1.16380e-01 63.963  0.8035 
1 1 1 13  71  8  o 3  6.82586e+00 1.65364e+00 1.15601e+02 132.785 -6.92752e+00 7.48503e+00  0.00000e+00 0.00000e+00 1.30002e+02 132.785 1.44005e+01 132.785 0.9496 
1 1 1 13  72  0  o 14 6.63931e+00 1.36029e+00 9.48013e+01 249.116 -2.81320e+00 -7.37335e+00 0.00000e+00 0.00000e+00 1.39664e+02 249.116 4.48625e+01 249.116 0.9343 
1 1 1 13  72  1  o 2  6.30982e+00 1.31423e+00 5.67914e+01 4.546   4.68730e+00  3.72646e-01  0.00000e+00 0.00000e+00 1.54616e+02 4.546   9.78248e+01 4.546   0.8860 
1 1 1 13  72  2  o 14 8.54372e+00 1.22667e+00 1.17290e+02 253.293 -3.76956e+00 -1.25588e+01 0.00000e+00 0.00000e+00 1.93360e+02 253.293 7.60707e+01 253.293 0.9611 
1 1 1 13  72  3  o 1  7.71185e+00 1.41282e+00 1.79345e+02 105.343 -4.67494e+00 1.70381e+01  0.00000e+00 0.00000e+00 1.04138e+02 105.343 7.52069e+01 285.343 0.9713 
1 1 1 13  72  4  o 6  5.84694e+00 1.40044e+00 1.30571e+02 319.772 7.42987e+00  -6.28493e+00 0.00000e+00 0.00000e+00 7.90832e+01 319.772 5.14875e+01 139.772 0.9471 
1 1 1 13  72  5  o 11 1.39669e+01 1.19241e+00 2.54528e+02 142.991 -4.47117e+01 3.37035e+01  0.00000e+00 0.00000e+00 2.69622e+02 142.991 1.50940e+01 142.991 0.9910 
1 1 1 13  72  6  o 10 3.61273e+00 1.19238e+00 6.34600e+01 245.492 -1.50188e+00 -3.29433e+00 0.00000e+00 0.00000e+00 5.24583e+01 245.492 1.10017e+01 65.492  0.8472 
1 1 1 13  72  7  o 8  3.97864e+00 1.26780e+00 9.97151e+01 317.016 4.72958e+00  -4.40785e+00 0.00000e+00 0.00000e+00 3.87915e+01 317.016 6.09236e+01 137.017 0.9190 
1 1 1 13  72  8  o 10 3.26338e+00 1.12197e+00 9.03637e+01 21.362  5.18278e+00  2.02719e+00  0.00000e+00 0.00000e+00 2.15190e+01 21.362  6.88448e+01 201.362 0.9050 
1 1 1 13  73  0  o 19 6.66027e+00 1.40012e+00 1.84167e+02 250.750 -5.01145e+00 -1.43504e+01 0.00000e+00 0.00000e+00 5.90993e+01 250.750 1.25068e+02 70.750  0.9665 
1 1 1 13  73  1  o 4  4.94090e+00 1.29444e+00 1.15306e+02 71.336  2.28896e+00  6.77632e+00  0.00000e+00 0.00000e+00 5.79029e+01 71.336  5.74031e+01 251.336 0.9272 
1 1 1 13  73  2  o 8  3.51135e+00 1.10766e+00 4.60651e+01 329.023 2.07813e+00  -1.24753e+00 0.00000e+00 0.00000e+00 5.44047e+01 329.023 8.33956e+00 329.023 0.7565 
1 1 1 13  73  3  o 7  6.07721e+00 1.41341e+00 1.20837e+02 157.668 -8.48379e+00 3.48501e+00  0.00000e+00 0.00000e+00 9.61961e+01 157.668 2.46406e+01 337.668 0.9438 
1 1 1 13  73  4  o 17 5.27038e+00 1.37784e+00 1.48728e+02 303.704 5.74990e+00  -8.62025e+00 0.00000e+00 0.00000e+00 4.08757e+01 303.704 1.07852e+02 123.704 0.9504 
1 1 1 13  73  5  o 1  1.04063e+01 1.29837e+00 1.49990e+02 109.681 -7.75431e+00 2.16790e+01  0.00000e+00 0.00000e+00 2.35342e+02 109.681 8.53519e+01 109.681 0.9780 
1 1 1 13  73  6  o 16 4.16795e+00 1.27835e+00 8.13576e+01 10.895  5.18543e+00  9.98055e-01  0.00000e+00 0.00000e+00 6.06113e+01 10.895  2.07463e+01 190.895 0.8995 
1 1 1 13  73  7  o 14 9.40573e+00 1.52385e+00 1.63459e+02 58.962  1.05739e+01  1.75716e+01  0.00000e+00 0.00000e+00 1.83960e+02 58.962  2.05007e+01 58.962  0.9753 
1 1 1 13  73  8  o 7  3.72470e+00 1.24122e+00 4.50506e+01 204.778 -2.74261e+00 -1.26599e+00 0.00000e+00 0.00000e+00 6.94299e+01 204.778 2.43794e+01 204.778 0.8115 
1 1 1 13  74  0  o 19 5.28736e+00 1.31646e+00 1.25948e+02 237.363 -4.76085e+00 -7.43362e+00 0.00000e+00 0.00000e+00 6.21404e+01 237.363 6.38079e+01 57.363  0.9415 
1 1 1 13  74  1  o 6  3.91489e+00 1.14097e+00 7.07605e+01 169.767 -3.99989e+00 7.22038e-01  0.00000e+00 0.00000e+00 5.73903e+01 169.767 1.33701e+01 349.767 0.8660 
1 1 1 13  74  2  o 19 1.23364e+01 1.04088e+00 1.50870e+02 7.073   2.79611e+01  3.46916e+00  0.00000e+00 0.00000e+00 3.07308e+02 7.073   1.56438e+02 7.073   0.9821 
1 1 1 13  74  3  o 7  2.67021e+00 9.24281e-01 4.26459e+01 281.899 4.08108e-01  -1.93675e+00 0.00000e+00 0.00000e+00 2.74950e+01 281.899 1.51509e+01 101.899 0.6943 
1 1 1 13  74  4  o 18 4.12454e+00 1.22428e+00 5.79301e+01 29.602  3.20141e+00  1.81878e+00  0.00000e+00 0.00000e+00 7.47544e+01 29.602  1.68243e+01 29.602  0.8501 
1 1 1 13  74  5  o 8  7.28337e+00 1.44846e+00 1.40986e+02 90.829  -1.96302e-01 1.35697e+01  0.00000e+00 0.00000e+00 1.24349e+02 90.829  1.66368e+01 270.829 0.9624 
1 1 1 13  74  6  o 19 7.60046e+00 1.52509e+00 1.93490e+02 205.171 -1.70532e+01 -8.01418e+00 0.00000e+00 0.00000e+00 8.65190e+01 205.171 1.06971e+02 25.171  0.9731 
1 1 1 13  74  7  o 4  6.44263e+00 1.64163e+00 1.27001e+02 292.885 4.07271e+00  -9.64835e+00 0.00000e+00 0.00000e+00 1.04990e+02 292.885 2.20111e+01 112.885 0.9510 
1 1 1 13  74  8  o 14 4.29007e+00 1.35787e+00 6.90140e+01 116.286 -2.17473e+00 4.40287e+00  0.00000e+00 0.00000e+00 7.57749e+01 116.286 6.76085e+00 116.286 0.8913 
1 1 1 13  75  0  o 7  1.29825e+01 9.08502e-01 1.83721e+02 174.656 -4.22880e+01 3.95544e+00  0.00000e+00 0.00000e+00 3.00882e+02 174.656 1.17161e+02 174.656 0.9882 
1 1 1 13  75  1  o 17 1.14629e+01 1.01414e+00 2.18573e+02 306.326 2.28231e+01  -3.10409e+01 0.00000e+00 0.00000e+00 2.08988e+02 306.326 9.58530e+00 126.325 0.9869 
1 1 1 13  75  2  o 9  3.50734e+00 1.11372e+00 5.13297e+01 188.172 -2.75219e+00 -3.95229e-01 0.00000e+00 0.00000e+00 5.37443e+01 188.172 2.41454e+00 188.172 0.7923 
1 1 1 13  75  3  o 19 1.12867e+01 1.18668e+00 2.37234e+02 98.596  -6.02718e+00 3.98711e+01  0.00000e+00 0.00000e+00 1.84345e+02 98.596  5.28895e+01 278.596 0.9875 
1 1 1 13  75  4  o 3  3.47139e+00 1.12839e+00 9.00434e+01 283.557 1.22251e+00  -5.06985e+00 0.00000e+00 0.00000e+00 2.79205e+01 283.557 6.21229e+01 103.557 0.8981 
1 1 1 13  75  5  o 6  3.71843e+00 1.17739e+00 2.30628e+01 194.636 -1.40567e+00 -3.67091e-01 0.00000e+00 0.00000e+00 5.91549e+01 194.636 3.60922e+01 194.636 0.5842 
1 1 1 13  75  6  f 0  3.84810e+00 1.22547e+00 1.25836e+02 356.145 7.78383e+00  -5.24556e-01 0.00000e+00 0.00000e+00 1.01386e+01 356.145 1.15697e+02 176.145 0.9335 
1 1 1 13  75  7  o 6  4.89874e+00 1.46781e+00 6.39168e+01 4.290   4.71589e+00  3.53751e-01  0.00000e+00 0.00000e+00 1.00522e+02 4.290   3.66050e+01 4.290   0.8867 
1 1 1 13  75  8  o 9  7.43711e+00 1.68478e+00 1.01327e+02 106.006 -2.60723e+00 9.08890e+00  0.00000e+00 0.00000e+00 1.64904e+02 106.006 6.35769e+01 106.006 0.9455 
1 1 1 13  76  0  o 10 3.23775e+00 1.01300e+00 5.44787e+01 316.314 2.06683e+00  -1.97411e+00 0.00000e+00 0.00000e+00 4.32136e+01 316.314 1.12651e+01 136.314 0.7989 
1 1 1 13  76  1  o 3  3.60631e+00 1.10380e+00 8.66871e+01 7.808   4.81360e+00  6.60034e-01  0.00000e+00 0.00000e+00 3.45898e+01 7.808   5.20973e+01 187.808 0.8900 
1 1 1 13  76  2  o 12 5.42153e+00 1.38403e+00 4.07026e+01 330.031 2.48896e+00  -1.43523e+00 0.00000e+00 0.00000e+00 1.23283e+02 330.031 8.25808e+01 330.031 0.8001 
1 1 1 13  76  3  f 0  7.58026e+00 1.32391e+00 1.01609e+02 30.298  9.53787e+00  5.57300e+00  0.00000e+00 0.00000e+00 1.71745e+02 30.298  7.01361e+01 30.298  0.9536 
1 1 1 13  76  4  o 6  3.79593e+00 1.19193e+00 6.60952e+01 299.464 2.04369e+00  -3.61753e+00 0.00000e+00 0.00000e+00 5.87179e+01 299.464 7.37729e+00 119.464 0.8692 
1 1 1 13  76  5  o 1  3.69278e+00 1.19189e+00 8.54153e+01 286.692 1.50442e+00  -5.01709e+00 0.00000e+00 0.00000e+00 4.01434e+01 286.692 4.52719e+01 106.692 0.8986 
1 1 1 13  76  6  o 4  9.22206e+00 1.53400e+00 2.26404e+02 116.083 -1.21556e+01 2.48309e+01  0.00000e+00 0.00000e+00 1.16227e+02 116.083 1.10177e+02 296.083 0.9817 
1 1 1 13  76  7  o 14 3.44103e+00 1.15757e+00 4.15623e+01 163.875 -2.67824e+00 7.74289e-01  0.00000e+00 0.00000e+00 6.17170e+01 163.875 2.01546e+01 163.875 0.7930 
1 1 1 13  77  0  o 13 3.72713e+00 1.08888e+00 8.15413e+01 184.785 -4.74462e+00 -3.97153e-01 0.00000e+00 0.00000e+00 4.33639e+01 184.785 3.81774e+01 4.785   0.8875 
1 1 1 13  77  1  o 17 4.24395e+00 1.18703e+00 1.15263e+02 130.830 -4.75643e+00 5.50445e+00  0.00000e+00 0.00000e+00 3.35964e+01 130.830 8.16669e+01 310.830 0.9285 
1 1 1 13  77  2  o 7  5.07351e+00 1.26597e+00 3.86712e+01 257.166 -6.29258e-01 -2.76203e+00 0.00000e+00 0.00000e+00 1.14118e+02 257.166 7.54466e+01 257.166 0.7968 
1 1 1 13  77  3  o 6  9.24842e+00 1.32156e+00 1.52175e+02 16.607  1.95687e+01  5.83622e+00  0.00000e+00 0.00000e+00 1.88817e+02 16.607  3.66413e+01 16.607  0.9752 
1 1 1 13  77  4  o 5  1.04197e+01 1.24283e+00 2.04129e+02 275.034 2.84287e+00  -3.22711e+01 0.00000e+00 0.00000e+00 1.83812e+02 275.034 2.03173e+01 95.034  0.9844 
1 1 1 13  77  5  o 8  5.96805e+00 1.47978e+00 9.35378e+01 96.284  -8.09090e-01 7.34720e+00  0.00000e+00 0.00000e+00 1.16348e+02 96.284  2.28105e+01 96.284  0.9297 
1 1 1 13  77  6  o 16 9.55334e+00 1.49561e+00 1.26220e+02 153.959 -1.56046e+01 7.62474e+00  0.00000e+00 0.00000e+00 2.24677e+02 153.959 9.84567e+01 153.959 0.9708 
1 1 1 13  77  7  o 14 8.33883e+00 1.65695e+00 1.42643e+02 309.420 9.77587e+00  -1.18927e+01 0.00000e+00 0.00000e+00 1.62480e+02 309.420 1.98363e+01 309.420 0.9670 
1 1 1 13  78  0  o 2  5.35257e+00 1.26112e+00 7.93766e+01 235.859 -3.41274e+00 -5.03289e+00 0.00000e+00 0.00000e+00 1.05229e+02 235.859 2.58526e+01 235.859 0.9136 
1 1 1 13  78  1  o 16 1.58934e+01 8.61309e-01 2.10678e+02 296.849 2.85270e+01  -5.63542e+01 0.00000e+00 0.00000e+00 3.84836e+02 296.849 1.74158e+02 296.849 0.9921 
1 1 1 13  78  2  o 7  9.53161e+00 1.15343e+00 1.55873e+02 76.432  5.60589e+00  2.32283e+01  0.00000e+00 0.00000e+00 1.96669e+02 76.432  4.07967e+01 76.432  0.9788 
1 1 1 13  78  3  o 17 5.60464e+00 1.35607e+00 1.36434e+02 278.266 1.55396e+00  -1.06965e+01 0.00000e+00 0.00000e+00 6.53695e+01 278.266 7.10643e+01 98.266  0.9526 
1 1 1 13  78  4  o 12 3.37544e+00 1.06649e+00 7.52180e+01 128.994 -2.91358e+00 3.59874e+00  0.00000e+00 0.00000e+00 3.76129e+01 128.994 3.76051e+01 308.994 0.8840 
1 1 1 13  78  5  o 12 3.63160e+00 1.18097e+00 5.88065e+01 229.571 -2.41406e+00 -2.83364e+00 0.00000e+00 0.00000e+00 5.82076e+01 229.571 5.98835e-01 49.571  0.8519 
1 1 1 13  78  6  o 12 3.97091e+00 1.26835e+00 1.30700e+01 144.857 -7.59666e-01 5.34752e-01  0.00000e+00 0.00000e+00 5.01197e+01 144.857 3.70497e+01 144.857 0.4207 
1 1 1 13  78  7  o 10 5.74889e+00 1.51736e+00 5.41874e+01 14.720  4.27511e+00  1.12311e+00  0.00000e+00 0.00000e+00 1.36762e+02 14.720  8.25744e+01 14.720  0.8779 
1 1 1 13  79  0  o 6  5.83264e+00 1.17470e+00 7.56670e+01 203.401 -6.45933e+00 -2.79540e+00 0.00000e+00 0.00000e+00 1.28174e+02 203.401 5.25066e+01 203.401 0.9260 
1 1 1 13  79  1  o 3  4.27234e+00 1.21887e+00 7.67687e+01 281.635 1.01576e+00  -4.93302e+00 0.00000e+00 0.00000e+00 6.74962e+01 281.635 9.27256e+00 101.635 0.8942 
1 1 1 13  79  2  o 4  8.79891e+00 1.21903e+00 1.64946e+02 87.509  1.02416e+00  2.35416e+01  0.00000e+00 0.00000e+00 1.60326e+02 87.509  4.62020e+00 267.509 0.9785 
1 1 1 13  79  3  o 19 6.64157e+00 1.40592e+00 1.20356e+02 267.727 -4.51704e-01 -1.13799e+01 0.00000e+00 0.00000e+00 1.19355e+02 267.727 1.00038e+00 87.727  0.9550 
1 1 1 13  79  4  o 11 8.11316e+00 1.39426e+00 1.41662e+02 332.593 1.44046e+01  -7.46874e+00 0.00000e+00 0.00000e+00 1.55437e+02 332.593 1.37752e+01 332.593 0.9687 
1 1 1 13  79  5  o 7  5.05958e+00 1.37883e+00 2.77944e+01 55.198  1.25126e+00  1.80019e+00  0.00000e+00 0.00000e+00 1.11286e+02 55.198  8.34918e+01 55.198  0.7270 
1 1 1 13  79  6  o 10 5.35855e+00 1.42067e+00 8.42750e+01 93.051  -3.74792e-01 7.03262e+00  0.00000e+00 0.00000e+00 1.03390e+02 93.051  1.91149e+01 93.051  0.9260 
1 1 1 13  79  7  o 18 4.45737e+00 1.33701e+00 7.83720e+01 317.010 4.35596e+00  -4.06052e+00 0.00000e+00 0.00000e+00 7.53324e+01 317.010 3.03957e+00 137.010 0.9117 
1 1 1 13  80  0  o 17 8.66015e+00 1.14093e+00 1.65536e+02 207.218 -2.10542e+01 -1.08288e+01 0.00000e+00 0.00000e+00 1.54273e+02 207.218 1.12632e+01 27.218  0.9786 
1 1 1 13  80  1  o 6  5.71516e+00 1.26031e+00 9.62761e+01 131.038 -5.68597e+00 6.53218e+00  0.00000e+00 0.00000e+00 1.06621e+02 131.038 1.03449e+01 131.038 0.9404 
1 1 1 13  80  2  o 12 1.53855e+01 9.05011e-01 2.23418e+02 270.834 9.63842e-01  -6.61844e+01 0.00000e+00 0.00000e+00 3.53279e+02 270.834 1.29861e+02 270.834 0.9924 
1 1 1 13  80  3  o 18 3.64079e+00 1.15672e+00 4.63672e+01 173.047 -2.85614e+00 3.48308e-01  0.00000e+00 0.00000e+00 6.37498e+01 173.047 1.73826e+01 173.047 0.8005 
1 1 1 13  80  4  f 0  9.22418e+00 1.31326e+00 1.12199e+02 42.563  1.19891e+01  1.10103e+01  0.00000e+00 0.00000e+00 2.25547e+02 42.563  1.13349e+02 42.563  0.9688 
1 1 1 13  80  5  o 3  3.78126e+00 1.19240e+00 3.94700e+01 189.736 -2.80431e+00 -4.81154e-01 0.00000e+00 0.00000e+00 7.45841e+01 189.736 3.51140e+01 189.736 0.7979 
1 1 1 13  80  6  o 5  3.34751e+00 1.12454e+00 4.65076e+01 164.655 -3.04858e+00 8.36586e-01  0.00000e+00 0.00000e+00 5.74408e+01 164.655 1.09332e+01 164.655 0.8212 
1 1 1 13  80  7  o 18 4.66239e+00 1.38381e+00 1.77906e+01 227.846 -9.64265e-01 -1.06515e+00 0.00000e+00 0.00000e+00 8.44925e+01 227.846 6.67019e+01 227.846 0.5801 
1 1 1 13  81  0  o 4  3.70151e+00 1.05594e+00 2.85240e+01 258.076 -3.81937e-01 -1.80863e+00 0.00000e+00 0.00000e+00 6.52138e+01 258.076 3.66897e+01 258.076 0.6713 
1 1 1 13  81  1  o 13 4.18307e+00 1.16712e+00 3.62486e+01 37.295  1.93913e+00  1.47694e+00  0.00000e+00 0.00000e+00 8.34360e+01 37.295  4.71875e+01 37.295  0.7580 
1 1 1 13  81  2  o 6  7.28232e+00 1.31223e+00 1.20283e+02 270.369 8.55958e-02  -1.32985e+01 0.00000e+00 0.00000e+00 1.44156e+02 270.369 2.38727e+01 270.369 0.9616 
1 1 1 13  81  3  o 3  4.63897e+00 1.25382e+00 6.74373e+01 8.877   4.84026e+00  7.55993e-01  0.00000e+00 0.00000e+00 8.86974e+01 8.877   2.12601e+01 8.877   0.8910 
1 1 1 13  81  4  o 7  6.62596e+00 1.39803e+00 1.13070e+02 225.846 -8.01326e+00 -8.25361e+00 0.00000e+00 0.00000e+00 1.26162e+02 225.846 1.30916e+01 225.846 0.9555 
1 1 1 13  81  5  o 1  4.22986e+00 1.23682e+00 7.76128e+01 314.556 3.96535e+00  -4.02731e+00 0.00000e+00 0.00000e+00 6.73259e+01 314.556 1.02869e+01 134.556 0.9066 
1 1 1 13  81  6  o 8  4.35041e+00 1.30600e+00 9.72828e+01 250.666 -2.36724e+00 -6.74676e+00 0.00000e+00 0.00000e+00 5.52001e+01 250.666 4.20827e+01 70.666  0.9272 
1 1 1 13  81  7  o 18 3.19833e+00 1.07742e+00 6.32663e+01 47.992  3.05258e+00  3.38928e+00  0.00000e+00 0.00000e+00 4.34007e+01 47.992  1.98657e+01 227.992 0.8821 
1 1 1 13  82  0  o 9  3.40231e+00 9.87106e-01 6.04999e+01 168.087 -3.92573e+00 8.28191e-01  0.00000e+00 0.00000e+00 5.03736e+01 168.087 1.01262e+01 348.087 0.8640 
1 1 1 13  82  1  o 9  5.25632e+00 1.23150e+00 4.28062e+01 290.758 1.28616e+00  -3.39331e+00 0.00000e+00 0.00000e+00 1.25312e+02 290.758 8.25058e+01 290.758 0.8476 
1 1 1 13  82  2  f 0  8.25440e+00 1.25096e+00 1.34353e+02 176.223 -1.73830e+01 1.14766e+00  0.00000e+00 0.00000e+00 1.68193e+02 176.223 3.38392e+01 176.223 0.9709 
1 1 1 13  82  3  o 16 4.35302e+00 1.23882e+00 8.78527e+01 67.088  2.47977e+00  5.86708e+00  0.00000e+00 0.00000e+00 6.30243e+01 67.088  2.48285e+01 247.088 0.9177 
1 1 1 13  82  4  o 14 3.61298e+00 1.12104e+00 9.62879e+01 189.628 -6.95451e+00 -1.17976e+00 0.00000e+00 0.00000e+00 3.01221e+01 189.628 6.61658e+01 9.628   0.9261 
1 1 1 13  82  5  o 2  6.73785e+00 1.50391e+00 1.24775e+02 339.515 1.13883e+01  -4.25461e+00 0.00000e+00 0.00000e+00 1.19127e+02 339.515 5.64736e+00 159.515 0.9579 
1 1 1 13  82  6  o 8  3.49335e+00 1.10119e+00 3.26660e+01 148.263 -2.03026e+00 1.25573e+00  0.00000e+00 0.00000e+00 6.66415e+01 148.263 3.39755e+01 148.263 0.7522 
1 1 1 13  82  7  o 2  3.99611e+00 1.27305e+00 6.81537e+01 34.584  4.38804e+00  3.02530e+00  0.00000e+00 0.00000e+00 6.78702e+01 34.584  2.83474e-01 214.584 0.9005 
1 1 1 13  83  0  o 1  3.22597e+00 1.02589e+00 6.82631e+01 41.877  3.09425e+00  2.77408e+00  0.00000e+00 0.00000e+00 3.74807e+01 41.877  3.07824e+01 221.877 0.8693 
1 1 1 13  83  1  o 16 8.83871e+00 1.08353e+00 1.74091e+02 299.117 1.32979e+01  -2.38750e+01 0.00000e+00 0.00000e+00 1.53216e+02 299.117 2.08757e+01 119.117 0.9815 
1 1 1 13  83  2  o 6  2.74914e+00 9.23122e-01 7.94110e+01 27.002  4.12928e+00  2.10418e+00  0.00000e+00 0.00000e+00 1.23324e+01 27.002  6.70786e+01 207.002 0.8842 
1 1 1 13  83  3  f 0  4.45317e+00 1.26548e+00 6.75865e+01 232.666 -3.12020e+00 -4.09082e+00 0.00000e+00 0.00000e+00 8.31779e+01 232.666 1.55913e+01 232.666 0.8966 
1 1 1 13  83  4  o 19 4.27244e+00 1.23614e+00 6.36223e+01 179.680 -4.99818e+00 2.79347e-02  0.00000e+00 0.00000e+00 8.05362e+01 179.680 1.69140e+01 179.680 0.8933 
1 1 1 13  83  5  o 10 4.78808e+00 1.39687e+00 6.85272e+01 13.071  5.01374e+00  1.16403e+00  0.00000e+00 0.00000e+00 9.36748e+01 13.071  2.51476e+01 13.071  0.8967 
1 1 1 13  83  6  o 10 3.63655e+00 1.15313e+00 4.67005e+01 73.257  1.04812e+00  3.48418e+00  0.00000e+00 0.00000e+00 6.98278e+01 73.257  2.31274e+01 73.257  0.8480 
1 1 1 13  84  0  o 12 8.16787e+00 1.15299e+00 1.65786e+02 203.948 -2.10592e+01 -9.35338e+00 0.00000e+00 0.00000e+00 1.35390e+02 203.948 3.03965e+01 23.948  0.9781 
1 1 1 13  84  1  o 8  5.07155e+00 1.27888e+00 9.43736e+01 332.064 6.83056e+00  -3.62204e+00 0.00000e+00 0.00000e+00 8.40836e+01 332.064 1.02900e+01 152.064 0.9329 
1 1 1 13  84  2  o 13 6.27740e+00 1.21928e+00 1.07858e+02 154.448 -1.08522e+01 5.18826e+00  0.00000e+00 0.00000e+00 1.18953e+02 154.448 1.10950e+01 154.448 0.9575 
1 1 1 13  84  3  o 9  5.32471e+00 1.30953e+00 4.52671e+01 342.870 3.97052e+00  -1.22376e+00 0.00000e+00 0.00000e+00 1.29452e+02 342.870 8.41845e+01 342.870 0.8692 
1 1 1 13  84  4  o 11 3.05739e+00 1.02236e+00 8.61108e+00 126.496 -3.41988e-01 4.62234e-01  0.00000e+00 0.00000e+00 2.32805e+01 126.496 1.46694e+01 126.496 0.2762 
1 1 1 13  84  5  o 13 3.64237e+00 1.15413e+00 8.97606e+01 337.921 5.91688e+00  -2.40007e+00 0.00000e+00 0.00000e+00 3.65271e+01 337.921 5.32336e+01 157.921 0.9180 
1 1 1 13  84  6  o 9  3.89089e+00 1.24529e+00 4.30855e+01 334.199 2.91683e+00  -1.41014e+00 0.00000e+00 0.00000e+00 7.83662e+01 334.199 3.52807e+01 334.199 0.8263 
1 1 1 13  85  0  o 19 6.47788e+00 1.22861e+00 1.18559e+02 268.286 -3.85936e-01 -1.28960e+01 0.00000e+00 0.00000e+00 1.15943e+02 268.286 2.61621e+00 88.286  0.9604 
1 1 1 13  85  1  o 12 6.38520e+00 1.29582e+00 8.31733e+01 181.113 -8.85954e+00 -1.72089e-01 0.00000e+00 0.00000e+00 1.43592e+02 181.113 6.04190e+01 181.113 0.9418 
1 1 1 13  85  2  o 3  4.55588e+00 1.22229e+00 6.91026e+01 313.245 4.00901e+00  -4.26248e+00 0.00000e+00 0.00000e+00 8.73054e+01 313.245 1.82028e+01 313.245 0.9100 
1 1 1 13  85  3  o 9  4.68327e+00 1.29103e+00 9.94542e+01 344.892 7.40588e+00  -1.99935e+00 0.00000e+00 0.00000e+00 6.53367e+01 344.892 3.41175e+01 164.892 0.9323 
1 1 1 13  85  4  o 18 3.24422e+00 1.06566e+00 6.17443e+01 168.442 -4.18507e+00 8.55843e-01  0.00000e+00 0.00000e+00 4.52044e+01 168.442 1.65399e+01 348.442 0.8732 
1 1 1 13  85  5  o 19 3.40628e+00 1.11442e+00 5.13619e+01 359.455 3.97606e+00  -3.78407e-02 0.00000e+00 0.00000e+00 5.95927e+01 359.455 8.23086e+00 359.455 0.8626 
1 1 1 13  85  6  o 18 3.94140e+00 1.22749e+00 2.27719e+01 284.887 4.70975e-01  -1.77162e+00 0.00000e+00 0.00000e+00 7.67252e+01 284.887 5.39533e+01 284.887 0.6684 
1 1 1 13  86  0  o 16 7.57446e+00 1.17045e+00 1.53510e+02 77.784  4.64084e+00  2.14351e+01  0.00000e+00 0.00000e+00 1.25334e+02 77.784  2.81756e+01 257.784 0.9769 
1 1 1 13  86  1  o 13 4.57335e+00 1.22261e+00 4.11055e+01 242.491 -1.61302e+00 -3.09738e+00 0.00000e+00 0.00000e+00 1.03850e+02 242.491 6.27441e+01 242.491 0.8407 
1 1 1 13  86  2  o 2  5.07888e+00 1.24656e+00 1.09832e+02 25.923  8.57024e+00  4.16581e+00  0.00000e+00 0.00000e+00 7.13838e+01 25.923  3.84485e+01 205.923 0.9460 
1 1 1 13  86  3  f 0  6.93777e+00 1.35271e+00 9.91581e+01 105.253 -2.96539e+00 1.08746e+01  0.00000e+00 0.00000e+00 1.50721e+02 105.253 5.15633e+01 105.253 0.9546 
1 1 1 13  86  4  o 14 3.44446e+00 1.08677e+00 5.94768e+01 264.089 -4.36351e-01 -4.21434e+00 0.00000e+00 0.00000e+00 5.38955e+01 264.089 5.58131e+00 84.089  0.8720 
1 1 1 13  86  5  o 10 3.13319e+00 1.04833e+00 9.76695e+01 305.793 4.06455e+00  -5.63700e+00 0.00000e+00 0.00000e+00 1.17425e+01 305.793 8.59270e+01 125.793 0.9250 
1 1 1 13  86  6  o 5  3.95329e+00 1.21323e+00 2.50871e+01 115.971 -8.82718e-01 1.81215e+00  0.00000e+00 0.00000e+00 7.94573e+01 115.971 5.43702e+01 115.971 0.7003 
1 1 1 13  87  0  o 7  2.88559e+00 9.59408e-01 3.74097e+01 81.919  3.53872e-01  2.49242e+00  0.00000e+00 0.00000e+00 4.59593e+01 81.919  8.54954e+00 81.919  0.7669 
1 1 1 13  87  1  f 0  8.62035e+00 1.14647e+00 1.60925e+02 224.451 -1.83219e+01 -1.79743e+01 0.00000e+00 0.00000e+00 1.57606e+02 224.451 3.31854e+00 44.451  0.9803 
1 1 1 13  87  2  o 18 6.18432e+00 1.31172e+00 1.00690e+02 10.022  1.04065e+01  1.83915e+00  0.00000e+00 0.00000e+00 1.21191e+02 10.022  2.05009e+01 10.022  0.9514 
1 1 1 13  87  3  o 10 3.37469e+00 1.08829e+00 8.56096e+01 112.799 -2.26959e+00 5.39926e+00  0.00000e+00 0.00000e+00 3.02463e+01 112.799 5.53633e+01 292.799 0.9101 
1 1 1 13  87  4  o 12 4.25836e+00 1.24361e+00 6.23126e+01 300.442 2.70264e+00  -4.59874e+00 0.00000e+00 0.00000e+00 8.24023e+01 300.442 2.00897e+01 300.442 0.9006 
1 1 1 13  87  5  f 0  5.06020e+00 1.35861e+00 1.22375e+01 170.166 -1.10311e+00 1.91205e-01  0.00000e+00 0.00000e+00 8.08050e+01 170.166 6.85674e+01 170.166 0.4872 
1 1 1 13  88  0  o 19 2.67874e+00 8.85867e-01 9.38952e+01 79.917  1.07777e+00  6.06094e+00  0.00000e+00 0.00000e+00 1.60482e+00 259.917 9.55000e+01 259.917 0.9147 
1 1 1 13  88  1  o 9  2.87399e+00 9.57559e-01 3.58871e+01 125.710 -1.37442e+00 1.91199e+00  0.00000e+00 0.00000e+00 4.51477e+01 125.710 9.26060e+00 125.710 0.7482 
1 1 1 13  88  2  o 18 3.09193e+00 1.00550e+00 4.08540e+01 57.460  1.47640e+00  2.31388e+00  0.00000e+00 0.00000e+00 5.11388e+01 57.460  1.02848e+01 57.460  0.7892 
1 1 1 13  88  3  o 14 4.41874e+00 1.26819e+00 6.03071e+01 347.635 4.71046e+00  -1.03264e+00 0.00000e+00 0.00000e+00 8.78586e+01 347.635 2.75515e+01 347.635 0.8891 
1 1 1 13  88  4  o 19 3.08610e+00 1.02349e+00 3.20561e+01 119.419 -1.15146e+00 2.04191e+00  0.00000e+00 0.00000e+00 5.49056e+01 119.419 2.28495e+01 119.419 0.7469 
1 1 1 13  88  5  o 13 3.99931e+00 1.23250e+00 8.75432e+01 197.917 -6.65709e+00 -2.15234e+00 0.00000e+00 0.00000e+00 5.21267e+01 197.917 3.54165e+01 17.917  0.9255 
1 1 1 13  89  0  o 17 2.70181e+00 9.06762e-01 2.93032e+01 8.876   1.90970e+00  2.98218e-01  0.00000e+00 0.00000e+00 4.05338e+01 8.876   1.12306e+01 8.876   0.6864 
1 1 1 13  89  1  o 2  6.31411e+00 1.21238e+00 1.21780e+02 269.317 -1.67536e-01 -1.40576e+01 0.00000e+00 0.00000e+00 1.07478e+02 269.317 1.43022e+01 89.317  0.9638 
1 1 1 13  89  2  o 7  4.35226e+00 1.21494e+00 5.02089e+01 129.823 -2.65408e+00 3.18292e+00  0.00000e+00 0.00000e+00 9.23174e+01 129.823 4.21085e+01 129.823 0.8688 
1 1 1 13  89  3  o 12 3.33755e+00 1.07884e+00 3.65319e+01 240.053 -1.39776e+00 -2.42613e+00 0.00000e+00 0.00000e+00 6.33910e+01 240.053 2.68591e+01 240.053 0.7940 
1 1 1 13  89  4  o 3  6.90404e+00 1.41983e+00 1.54605e+02 80.989  2.85690e+00  1.80163e+01  0.00000e+00 0.00000e+00 9.85505e+01 80.989  5.60542e+01 260.989 0.9722 
1 1 1 13  89  5  o 3  3.23720e+00 1.05623e+00 4.64368e+01 335.413 3.36025e+00  -1.53749e+00 0.00000e+00 0.00000e+00 5.74547e+01 335.413 1.10179e+01 335.413 0.8507 
1 1 1 13  90  0  o 5  3.82330e+00 1.11136e+00 1.12091e+02 59.390  4.42189e+00  7.47401e+00  0.00000e+00 0.00000e+00 2.32834e+01 59.390  8.88077e+01 239.390 0.9405 
1 1 1 13  90  1  o 9  3.22232e+00 1.04020e+00 6.87041e+01 222.624 -3.59357e+00 -3.30729e+00 0.00000e+00 0.00000e+00 3.93900e+01 222.624 2.93141e+01 42.625  0.8906 
1 1 1 13  90  2  o 3  3.85402e+00 1.13978e+00 3.22213e+01 330.440 2.34484e+00  -1.32989e+00 0.00000e+00 0.00000e+00 8.17384e+01 330.440 4.95171e+01 330.440 0.7847 
1 1 1 13  90  3  o 7  4.65835e+00 1.23336e+00 7.43786e+01 143.631 -5.45089e+00 4.01424e+00  0.00000e+00 0.00000e+00 8.76756e+01 143.631 1.32970e+01 143.631 0.9229 
1 1 1 13  90  4  o 16 9.12123e+00 1.29686e+00 1.31824e+02 4.491   2.25678e+01  1.77270e+00  0.00000e+00 0.00000e+00 2.04428e+02 4.491   7.26048e+01 4.491   0.9777 
1 1 1 13  91  0  o 16 4.03741e+00 1.09054e+00 5.80980e+01 121.337 -2.83798e+00 4.66082e+00  0.00000e+00 0.00000e+00 7.91198e+01 121.337 2.10218e+01 121.337 0.9030 
1 1 1 13  91  1  o 11 3.40755e+00 1.05803e+00 9.12301e+01 197.499 -6.94309e+00 -2.18901e+00 0.00000e+00 0.00000e+00 2.79143e+01 197.499 6.33159e+01 17.499  0.9285 
1 1 1 13  91  2  o 6  3.77649e+00 1.10887e+00 6.13890e+01 61.907  2.39085e+00  4.47894e+00  0.00000e+00 0.00000e+00 6.59617e+01 61.907  4.57266e+00 61.907  0.8951 
1 1 1 13  91  3  o 15 4.10843e+00 1.21943e+00 1.14420e+02 76.086  2.42914e+00  9.80520e+00  0.00000e+00 0.00000e+00 3.25352e+01 76.086  8.18851e+01 256.086 0.9491 
1 1 1 13  91  4  o 3  2.93629e+00 9.75737e-01 2.97381e+01 285.081 6.04101e-01  -2.24188e+00 0.00000e+00 0.00000e+00 5.26329e+01 285.081 2.28948e+01 285.081 0.7441 
1 1 1 13  92  0  o 14 4.03126e+00 1.16476e+00 9.95958e+01 61.176  3.96001e+00  7.19596e+00  0.00000e+00 0.00000e+00 4.25340e+01 61.176  5.70618e+01 241.175 0.9370 
1 1 1 13  92  1  o 9  3.57725e+00 1.08628e+00 3.87910e+01 84.981  2.71271e-01  3.08904e+00  0.00000e+00 0.00000e+00 7.12590e+01 84.981  3.24680e+01 84.981  0.8172 
1 1 1 13  92  2  o 15 5.58590e+00 1.30800e+00 6.31001e+01 277.435 8.64137e-01  -6.62205e+00 0.00000e+00 0.00000e+00 1.30819e+02 277.435 6.77185e+01 277.435 0.9218 
1 1 1 13  92  3  f 0  3.22314e+00 1.05227e+00 4.62955e+01 76.617  8.82357e-01  3.70866e+00  0.00000e+00 0.00000e+00 5.76418e+01 76.617  1.13463e+01 76.617  0.8559 
1 1 1 13  92  4  o 17 2.50900e+00 8.61640e-01 7.02818e+01 208.859 -5.01520e+00 -2.76388e+00 0.00000e+00 0.00000e+00 1.55681e+01 208.859 5.47137e+01 28.859  0.9079 
1 1 1 13  93  0  o 15 2.70132e+00 9.03927e-01 5.56717e+01 339.077 3.91122e+00  -1.49532e+00 0.00000e+00 0.00000e+00 3.27735e+01 339.077 2.28982e+01 159.077 0.8704 
1 1 1 13  93  1  o 15 3.07949e+00 9.65399e-01 2.57600e+01 263.618 -2.44391e-01 -2.18511e+00 0.00000e+00 0.00000e+00 5.86002e+01 263.618 3.28402e+01 263.618 0.7279 
1 1 1 13  93  2  o 12 3.40522e+00 1.06470e+00 3.69282e+01 24.792  2.66597e+00  1.23140e+00  0.00000e+00 0.00000e+00 6.63111e+01 24.792  2.93828e+01 24.792  0.8052 
1 1 1 13  93  3  o 13 3.12515e+00 1.00175e+00 4.97891e+01 176.985 -4.06606e+00 2.14192e-01  0.00000e+00 0.00000e+00 5.21792e+01 176.985 2.39013e+00 176.985 0.8662 
1 1 1 13  94  0  o 8  1.22287e+01 9.77081e-01 2.09758e+02 50.635  4.12767e+01  5.03135e+01  0.00000e+00 0.00000e+00 2.46600e+02 50.635  3.68415e+01 50.635  0.9923 
1 1 1 13  94  1  o 14 3.58440e+00 1.09123e+00 4.83639e+01 309.210 2.69178e+00  -3.29931e+00 0.00000e+00 0.00000e+00 6.93465e+01 309.210 2.09826e+01 309.210 0.8728 
1 1 1 13  94  2  o 18 6.10923e+00 1.34843e+00 1.29146e+02 267.074 -7.52336e-01 -1.47199e+01 0.00000e+00 0.00000e+00 9.28839e+01 267.074 3.62616e+01 87.074  0.9655 
1 1 1 13  94  3  o 14 7.16976e+00 1.22952e+00 1.35616e+02 84.504  1.99158e+00  2.06968e+01  0.00000e+00 0.00000e+00 1.27804e+02 84.504  7.81207e+00 264.503 0.9756 
1 1 1 13  95  0  o 14 2.93526e+00 9.52065e-01 3.83036e+01 18.161  2.90617e+00  9.53323e-01  0.00000e+00 0.00000e+00 5.15560e+01 18.161  1.32524e+01 18.161  0.8142 
1 1 1 13  95  1  o 4  6.28372e+00 1.30118e+00 9.17498e+01 245.285 -4.70890e+00 -1.02308e+01 0.00000e+00 0.00000e+00 1.33877e+02 245.285 4.21272e+01 245.285 0.9545 
1 1 1 13  95  2  o 2  2.96932e+00 9.84731e-01 4.73554e+01 121.431 -2.00670e+00 3.28355e+00  0.00000e+00 0.00000e+00 4.84585e+01 121.431 1.10317e+00 121.431 0.8574 
1 1 1 13  95  3  o 6  2.83057e+00 9.50316e-01 6.60650e+01 20.381  4.84839e+00  1.80130e+00  0.00000e+00 0.00000e+00 2.95478e+01 20.381  3.65172e+01 200.381 0.8972 
1 1 1 13  96  0  o 10 1.05808e+01 1.06339e+00 1.87143e+02 356.435 5.18569e+01  -3.23068e+00 0.00000e+00 0.00000e+00 2.06733e+02 356.435 1.95897e+01 356.435 0.9903 
1 1 1 13  96  1  o 16 4.41889e+00 1.22986e+00 1.26992e+02 242.184 -5.59827e+00 -1.06110e+01 0.00000e+00 0.00000e+00 3.21082e+01 242.184 9.48837e+01 62.184  0.9574 
1 1 1 13  96  2  o 3  2.97920e+00 9.80812e-01 3.16014e+01 358.440 2.52681e+00  -6.88127e-02 0.00000e+00 0.00000e+00 5.44809e+01 358.440 2.28795e+01 358.440 0.7680 
1 1 1 13  97  0  o 15 3.11637e+00 9.87917e-01 8.78807e+01 236.077 -4.07870e+00 -6.06452e+00 0.00000e+00 0.00000e+00 2.08945e+01 236.077 6.69862e+01 56.077  0.9288 
1 1 1 13  97  1  o 15 3.22405e+00 1.00072e+00 6.58364e+01 72.182  1.80835e+00  5.62620e+00  0.00000e+00 0.00000e+00 4.45840e+01 72.182  2.12524e+01 252.182 0.9109 
1 1 1 13  97  2  o 14 3.00179e+00 9.50766e-01 4.07307e+01 247.594 -1.44189e+00 -3.49718e+00 0.00000e+00 0.00000e+00 5.57637e+01 247.594 1.50330e+01 247.594 0.8546 
1 1 1 13  98  0  o 12 3.09621e+00 9.87020e-01 3.22653e+01 256.296 -7.04037e-01 -2.88715e+00 0.00000e+00 0.00000e+00 6.17082e+01 256.296 2.94428e+01 256.296 0.8079 
1 1 1 13  98  1  o 18 2.89204e+00 9.40946e-01 5.31668e+01 168.279 -4.78580e+00 9.92883e-01  0.00000e+00 0.00000e+00 4.36583e+01 168.279 9.50853e+00 348.279 0.8907 
1 1 1 13  99  0  o 1  2.85639e+00 9.24026e-01 4.74410e+01 259.421 -8.37597e-01 -4.48461e+00 0.00000e+00 0.00000e+00 4.71965e+01 259.421 2.44513e-01 79.421  0.8821 
1 1 1 13  99  1  o 17 2.64883e+00 8.92872e-01 7.10210e+01 17.543  6.09494e+00  1.92679e+00  0.00000e+00 0.00000e+00 2.03587e+01 17.543  5.06622e+01 197.543 0.9181 
1 1 1 13  100 0  o 5  2.56140e+00 8.50841e-01 3.34806e+01 87.499  1.35158e-01  3.09483e+00  0.00000e+00 0.00000e+00 4.50924e+01 87.499  1.16118e+01 87.499  0.8170 
1 1 1 13  100 1  f 0  2.68165e+00 9.01410e-01 1.68838e+01 63.416  7.15549e-01  1.42991e+00  0.00000e+00 0.00000e+00 4.55420e+01 63.416  2.86582e+01 63.416  0.6197 
1 1 1 13  101 0  o 4  3.98051e+00 1.13188e+00 2.69134e+01 353.482 2.88270e+00  -3.29350e-01 0.00000e+00 0.00000e+00 9.29868e+01 353.482 6.60734e+01 353.482 0.8024 
1 1 1 13  102 0  o 10 4.09378e+00 1.12405e+00 7.60093e+01 107.453 -2.47172e+00 7.86195e+00  0.00000e+00 0.00000e+00 6.79752e+01 107.453 8.03409e+00 287.453 0.9372 
1 1 1 13  103 0  o 11 3.05910e+00 9.73696e-01 4.64261e+01 313.166 3.22184e+00  -3.43493e+00 0.00000e+00 0.00000e+00 5.52801e+01 313.166 8.85397e+00 313.166 0.8862 
1 1 1 14  0   0  o 18 5.10837e+00 3.04361e+00 5.88666e+01 180.000 -7.20241e-01 0.00000e+00  0.00000e+00 0.00000e+00 6.13783e+01 180.000 2.51172e+00 180.000 0.6171 
1 1 1 14  0   1  o 7  1.37208e+01 2.96756e+00 3.20971e+02 180.000 -1.13050e+01 0.00000e+00  0.00000e+00 0.00000e+00 2.02711e+02 180.000 1.18260e+02 0.000   1.0000 
1 1 1 14  0   2  o 17 3.54239e+01 2.14568e+00 5.80203e+02 0.000   6.78671e+01  0.00000e+00  0.00000e+00 0.00000e+00 7.72466e+02 0.000   1.92262e+02 0.000   1.0000 
1 1 1 14  0   3  o 17 2.33507e+00 1.67504e+00 3.39592e+01 180.000 -3.10765e-01 0.00000e+00  0.00000e+00 0.00000e+00 7.09762e+00 0.000   4.10568e+01 0.000   0.3011 
1 1 1 14  0   4  o 9  4.61053e+00 2.56363e+00 7.47794e+01 0.000   1.08896e+00  0.00000e+00  0.00000e+00 0.00000e+00 6.55543e+01 0.000   9.22517e+00 180.000 0.7965 
1 1 1 14  0   5  o 7  1.27523e+01 2.79698e+00 7.50200e+01 0.000   3.05442e+00  0.00000e+00  0.00000e+00 0.00000e+00 4.10277e+02 0.000   3.35257e+02 0.000   0.9956 
1 1 1 14  0   6  o 7  8.46231e+00 3.07062e+00 1.43722e+02 0.000   3.59428e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.79338e+02 0.000   3.56169e+01 0.000   0.9985 
1 1 1 14  0   7  o 8  3.91036e+00 2.47425e+00 5.85753e+01 0.000   9.27742e-01  0.00000e+00  0.00000e+00 0.00000e+00 5.05154e+01 0.000   8.05984e+00 180.000 0.7295 
1 1 1 14  0   8  o 6  8.50238e+00 2.99804e+00 1.73680e+02 0.000   5.00376e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.51460e+02 0.000   2.22193e+01 180.000 0.9999 
1 1 1 14  0   9  o 10 5.30658e+00 3.06970e+00 1.40845e+02 180.000 -2.59747e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.98737e+01 180.000 8.09711e+01 0.000   0.9890 
1 1 1 14  0   10 o 8  3.31178e+00 2.31774e+00 3.14882e+01 0.000   5.11277e-01  0.00000e+00  0.00000e+00 0.00000e+00 2.81615e+01 0.000   3.32667e+00 180.000 0.4709 
1 1 1 14  1   0  o 1  8.95035e+00 2.07140e+00 1.90911e+02 271.358 2.00244e-01  -8.44587e+00 0.00000e+00 0.00000e+00 1.29622e+02 271.358 6.12886e+01 91.358  0.9388 
1 1 1 14  1   1  o 17 1.10634e+01 2.04419e+00 2.78218e+02 31.494  1.37776e+01  8.44084e+00  0.00000e+00 0.00000e+00 1.30758e+02 31.494  1.47460e+02 211.494 0.9685 
1 1 1 14  1   2  o 7  6.66641e+00 1.95009e+00 1.97484e+02 38.993  5.68201e+00  4.59998e+00  0.00000e+00 0.00000e+00 3.89608e+01 38.993  1.58523e+02 218.992 0.9288 
1 1 1 14  1   3  o 18 9.94420e+00 1.82112e+00 1.25971e+02 309.361 4.84016e+00  -5.90066e+00 0.00000e+00 0.00000e+00 2.28064e+02 309.361 1.02094e+02 309.361 0.9320 
1 1 1 14  1   4  o 11 8.06655e+00 1.67635e+00 2.01098e+02 95.720  -1.08349e+00 1.08174e+01  0.00000e+00 0.00000e+00 9.26200e+01 95.720  1.08478e+02 275.720 0.9528 
1 1 1 14  1   5  o 5  5.90217e+00 1.65036e+00 5.14634e+01 20.197  2.12890e+00  7.83138e-01  0.00000e+00 0.00000e+00 1.14874e+02 20.197  6.34109e+01 20.197  0.7373 
1 1 1 14  1   6  o 12 7.03363e+00 1.60461e+00 7.33272e+01 84.468  3.87595e-01  4.00158e+00  0.00000e+00 0.00000e+00 1.59103e+02 84.468  8.57762e+01 84.468  0.8643 
1 1 1 14  1   7  o 2  5.79497e+00 1.66130e+00 1.00071e+02 79.993  8.56256e-01  4.85241e+00  0.00000e+00 0.00000e+00 9.75251e+01 79.993  2.54584e+00 259.993 0.8917 
1 1 1 14  1   8  o 12 5.18549e+00 1.60839e+00 1.13669e+02 323.824 4.28294e+00  -3.13188e+00 0.00000e+00 0.00000e+00 6.48206e+01 323.824 4.88482e+01 143.824 0.9000 
1 1 1 14  1   9  o 15 1.19260e+01 1.84111e+00 1.43485e+02 64.277  6.26240e+00  1.29990e+01  0.00000e+00 0.00000e+00 2.96538e+02 64.277  1.53053e+02 64.277  0.9647 
1 1 1 14  1   10 o 13 1.43088e+01 1.96810e+00 2.33263e+02 205.900 -2.40794e+01 -1.16921e+01 0.00000e+00 0.00000e+00 3.03665e+02 205.900 7.04018e+01 205.900 0.9811 
1 1 1 14  2   0  o 9  1.10935e+01 1.95799e+00 1.79017e+02 328.990 8.79386e+00  -5.28595e+00 0.00000e+00 0.00000e+00 2.22979e+02 328.990 4.39613e+01 328.990 0.9499 
1 1 1 14  2   1  f 0  9.94884e+00 2.11339e+00 1.29337e+02 350.226 6.46948e+00  -1.11442e+00 0.00000e+00 0.00000e+00 2.20127e+02 350.226 9.07901e+01 350.226 0.9203 
1 1 1 14  2   2  o 7  9.29133e+00 2.18281e+00 2.44987e+02 214.454 -9.45757e+00 -6.48893e+00 0.00000e+00 0.00000e+00 9.39640e+01 214.454 1.51023e+02 34.454  0.9554 
1 1 1 14  2   3  o 9  1.04431e+01 1.65917e+00 1.21524e+02 2.751   8.26422e+00  3.97060e-01  0.00000e+00 0.00000e+00 2.52463e+02 2.751   1.30939e+02 2.751   0.9375 
1 1 1 14  2   4  o 16 8.73157e+00 1.60032e+00 1.57840e+02 292.875 3.74479e+00  -8.87595e+00 0.00000e+00 0.00000e+00 1.58005e+02 292.875 1.65546e-01 292.875 0.9466 
1 1 1 14  2   5  o 1  6.69667e+00 1.78950e+00 1.86335e+02 279.008 1.36570e+00  -8.61484e+00 0.00000e+00 0.00000e+00 5.44915e+01 279.008 1.31844e+02 99.008  0.9408 
1 1 1 14  2   6  o 5  1.35083e+01 1.43680e+00 3.41159e+02 119.515 -1.91530e+01 3.38320e+01  0.00000e+00 0.00000e+00 1.68629e+02 119.515 1.72530e+02 299.515 0.9871 
1 1 1 14  2   7  o 7  1.36112e+01 1.48692e+00 2.45256e+02 268.614 -7.53267e-01 -3.11312e+01 0.00000e+00 0.00000e+00 2.66813e+02 268.614 2.15565e+01 268.614 0.9838 
1 1 1 14  2   8  o 18 6.44202e+00 1.66138e+00 4.31508e+01 57.500  1.30546e+00  2.04919e+00  0.00000e+00 0.00000e+00 1.43383e+02 57.500  1.00232e+02 57.500  0.7571 
1 1 1 14  2   9  o 19 7.99231e+00 1.94969e+00 1.62065e+02 247.041 -4.00870e+00 -9.46297e+00 0.00000e+00 0.00000e+00 1.28334e+02 247.041 3.37312e+01 67.041  0.9500 
1 1 1 14  2   10 o 15 4.25465e+00 1.44443e+00 9.82248e+01 288.901 1.49552e+00  -4.36775e+00 0.00000e+00 0.00000e+00 4.55653e+01 288.901 5.26595e+01 108.901 0.8837 
1 1 1 14  3   0  o 6  7.09183e+00 1.98325e+00 6.81419e+01 227.143 -1.68150e+00 -1.81221e+00 0.00000e+00 0.00000e+00 1.37982e+02 227.143 6.98398e+01 227.143 0.7619 
1 1 1 14  3   1  o 12 9.69808e+00 2.22276e+00 1.83043e+02 50.794  5.47129e+00  6.70713e+00  0.00000e+00 0.00000e+00 1.65012e+02 50.794  1.80307e+01 230.794 0.9403 
1 1 1 14  3   2  o 7  7.01612e+00 1.96571e+00 1.41307e+02 24.057  4.99379e+00  2.22934e+00  0.00000e+00 0.00000e+00 1.00676e+02 24.057  4.06308e+01 204.057 0.9032 
1 1 1 14  3   3  o 5  6.30779e+00 1.68850e+00 1.01335e+02 288.024 1.27362e+00  -3.91425e+00 0.00000e+00 0.00000e+00 1.07782e+02 288.024 6.44740e+00 288.024 0.8678 
1 1 1 14  3   4  o 14 1.58644e+01 1.47057e+00 2.50521e+02 276.476 3.30923e+00  -2.91525e+01 0.00000e+00 0.00000e+00 3.45295e+02 276.476 9.47744e+01 276.476 0.9828 
1 1 1 14  3   5  o 7  1.32990e+01 1.62431e+00 3.12512e+02 115.349 -1.34499e+01 2.83910e+01  0.00000e+00 0.00000e+00 1.87682e+02 115.349 1.24830e+02 295.349 0.9840 
1 1 1 14  3   6  o 9  7.47923e+00 1.67510e+00 1.01198e+02 27.436  5.22965e+00  2.71497e+00  0.00000e+00 0.00000e+00 1.59211e+02 27.436  5.80129e+01 27.436  0.9107 
1 1 1 14  3   7  o 1  3.82841e+00 1.28902e+00 8.45495e+01 112.762 -1.29504e+00 3.08649e+00  0.00000e+00 0.00000e+00 3.73570e+01 112.762 4.71925e+01 292.762 0.8327 
1 1 1 14  3   8  o 4  9.37979e+00 1.70559e+00 1.91675e+02 209.267 -1.33747e+01 -7.49555e+00 0.00000e+00 0.00000e+00 1.55143e+02 209.267 3.65324e+01 29.267  0.9668 
1 1 1 14  3   9  o 11 5.61741e+00 1.63775e+00 6.52414e+01 17.515  3.33989e+00  1.05406e+00  0.00000e+00 0.00000e+00 1.15489e+02 17.515  5.02471e+01 17.515  0.8412 
1 1 1 14  3   10 o 7  7.58553e+00 1.90413e+00 1.22156e+02 128.513 -4.80973e+00 6.04379e+00  0.00000e+00 0.00000e+00 1.48464e+02 128.513 2.63080e+01 128.513 0.9328 
1 1 1 14  4   0  o 10 5.61838e+00 1.77317e+00 6.74922e+01 278.824 3.22358e-01  -2.07642e+00 0.00000e+00 0.00000e+00 8.54725e+01 278.824 1.79803e+01 278.824 0.7137 
1 1 1 14  4   1  o 13 1.19493e+01 2.10577e+00 2.00081e+02 255.827 -2.99497e+00 -1.18593e+01 0.00000e+00 0.00000e+00 2.36920e+02 255.827 3.68381e+01 255.827 0.9582 
1 1 1 14  4   2  o 5  6.98140e+00 1.96319e+00 5.94590e+01 318.673 1.72101e+00  -1.51337e+00 0.00000e+00 0.00000e+00 1.37895e+02 318.673 7.84357e+01 318.673 0.7403 
1 1 1 14  4   3  o 5  5.61420e+00 1.59711e+00 7.97594e+01 212.761 -2.51738e+00 -1.61989e+00 0.00000e+00 0.00000e+00 9.38494e+01 212.761 1.40901e+01 212.761 0.8095 
1 1 1 14  4   4  o 12 5.03752e+00 1.47379e+00 6.81391e+01 277.518 3.31042e-01  -2.50853e+00 0.00000e+00 0.00000e+00 7.97501e+01 277.518 1.16110e+01 277.518 0.7683 
1 1 1 14  4   5  o 5  1.08211e+01 1.49429e+00 2.08638e+02 180.377 -1.81248e+01 -1.19318e-01 0.00000e+00 0.00000e+00 1.93415e+02 180.377 1.52229e+01 0.377   0.9720 
1 1 1 14  4   6  o 13 5.03988e+00 1.51761e+00 1.03715e+02 114.126 -1.79757e+00 4.01366e+00  0.00000e+00 0.00000e+00 6.53233e+01 114.126 3.83912e+01 294.126 0.8772 
1 1 1 14  4   7  o 14 5.86027e+00 1.63364e+00 1.31266e+02 45.716  4.63112e+00  4.74841e+00  0.00000e+00 0.00000e+00 7.51672e+01 45.716  5.60989e+01 225.716 0.9212 
1 1 1 14  4   8  o 11 7.02865e+00 1.79819e+00 1.79339e+02 305.332 6.10324e+00  -8.60961e+00 0.00000e+00 0.00000e+00 7.63913e+01 305.332 1.02948e+02 125.332 0.9514 
1 1 1 14  4   9  o 4  5.00318e+00 1.59270e+00 1.24773e+02 256.856 -1.39349e+00 -5.96748e+00 0.00000e+00 0.00000e+00 5.01777e+01 256.856 7.45953e+01 76.856  0.9143 
1 1 1 14  4   10 o 5  4.87224e+00 1.54496e+00 1.06837e+02 47.132  3.87249e+00  4.17200e+00  0.00000e+00 0.00000e+00 6.22265e+01 47.132  4.46101e+01 227.132 0.9073 
1 1 1 14  5   0  o 14 1.99791e+01 1.63965e+00 2.82103e+02 309.498 2.08656e+01  -2.53135e+01 0.00000e+00 0.00000e+00 4.68302e+02 309.498 1.86199e+02 309.498 0.9846 
1 1 1 14  5   1  o 9  4.42455e+00 1.51238e+00 7.57348e+01 355.563 2.16178e+00  -1.67746e-01 0.00000e+00 0.00000e+00 4.64503e+01 355.563 2.92844e+01 175.563 0.7236 
1 1 1 14  5   2  o 14 1.14966e+01 2.09002e+00 2.16857e+02 150.537 -1.13656e+01 6.42071e+00  0.00000e+00 0.00000e+00 2.04962e+02 150.537 1.18947e+01 330.537 0.9609 
1 1 1 14  5   3  o 8  1.71237e+01 1.38483e+00 3.32660e+02 43.498  3.00438e+01  2.85089e+01  0.00000e+00 0.00000e+00 3.13513e+02 43.498  1.91474e+01 223.498 0.9879 
1 1 1 14  5   4  o 17 6.35750e+00 1.61440e+00 1.42152e+02 251.979 -1.94185e+00 -5.96902e+00 0.00000e+00 0.00000e+00 8.04918e+01 251.979 6.16598e+01 71.979  0.9165 
1 1 1 14  5   5  o 2  6.47952e+00 1.69998e+00 6.79982e+01 247.731 -1.21747e+00 -2.97313e+00 0.00000e+00 0.00000e+00 1.36224e+02 247.731 6.82253e+01 247.731 0.8246 
1 1 1 14  5   6  o 14 9.47814e+00 1.79989e+00 2.13908e+02 45.847  1.03251e+01  1.06349e+01  0.00000e+00 0.00000e+00 1.36022e+02 45.847  7.78868e+01 225.847 0.9657 
1 1 1 14  5   7  o 11 5.57987e+00 1.61664e+00 1.14435e+02 181.940 -5.55230e+00 -1.88080e-01 0.00000e+00 0.00000e+00 7.86321e+01 181.940 3.58026e+01 1.940   0.9048 
1 1 1 14  5   8  o 4  5.62026e+00 1.63043e+00 9.52911e+01 139.464 -3.75301e+00 3.20942e+00  0.00000e+00 0.00000e+00 9.64171e+01 139.464 1.12601e+00 139.464 0.8919 
1 1 1 14  5   9  o 2  5.95417e+00 1.73167e+00 2.33490e+02 95.524  -1.20875e+00 1.24982e+01  0.00000e+00 0.00000e+00 1.50378e+01 275.524 2.48527e+02 275.524 0.9593 
1 1 1 14  5   10 o 9  4.50734e+00 1.51772e+00 4.84218e+01 262.508 -3.16667e-01 -2.40806e+00 0.00000e+00 0.00000e+00 8.20740e+01 262.508 3.36522e+01 262.508 0.7570 
1 1 1 14  6   0  o 5  2.16190e+01 1.54745e+00 4.09009e+02 229.055 -3.48538e+01 -4.01723e+01 0.00000e+00 0.00000e+00 4.07854e+02 229.055 1.15422e+00 49.055  0.9906 
1 1 1 14  6   1  o 13 9.18673e+00 2.04850e+00 9.60752e+01 1.075   4.61934e+00  8.67056e-02  0.00000e+00 0.00000e+00 2.13783e+02 1.075   1.17708e+02 1.075   0.8838 
1 1 1 14  6   2  o 12 1.08837e+01 1.69492e+00 2.94375e+02 93.008  -1.03476e+00 1.96907e+01  0.00000e+00 0.00000e+00 1.10523e+02 93.008  1.83852e+02 273.008 0.9743 
1 1 1 14  6   3  o 11 1.34785e+01 1.29931e+00 2.00857e+02 293.839 8.22186e+00  -1.86075e+01 0.00000e+00 0.00000e+00 3.01191e+02 293.839 1.00334e+02 293.839 0.9751 
1 1 1 14  6   4  o 3  7.23850e+00 1.61150e+00 1.58939e+02 150.146 -6.93767e+00 3.98198e+00  0.00000e+00 0.00000e+00 9.97455e+01 150.146 5.91936e+01 330.146 0.9352 
1 1 1 14  6   5  o 13 8.54265e+00 1.59598e+00 1.13337e+02 289.053 2.41984e+00  -7.00645e+00 0.00000e+00 0.00000e+00 1.90293e+02 289.053 7.69562e+01 289.053 0.9299 
1 1 1 14  6   6  o 10 4.83396e+00 1.50549e+00 9.75781e+01 133.662 -2.75492e+00 2.88673e+00  0.00000e+00 0.00000e+00 6.19431e+01 133.662 3.56350e+01 313.662 0.8632 
1 1 1 14  6   7  o 8  1.39790e+01 1.44564e+00 2.66805e+02 0.914   3.55345e+01  5.67012e-01  0.00000e+00 0.00000e+00 2.60158e+02 0.914   6.64756e+00 180.914 0.9858 
1 1 1 14  6   8  o 10 6.93964e+00 1.76353e+00 1.16318e+02 97.638  -9.16219e-01 6.83183e+00  0.00000e+00 0.00000e+00 1.28986e+02 97.638  1.26682e+01 97.638  0.9243 
1 1 1 14  6   9  o 2  8.35509e+00 1.93052e+00 1.19683e+02 114.861 -3.37234e+00 7.27818e+00  0.00000e+00 0.00000e+00 1.79215e+02 114.861 5.95315e+01 114.861 0.9354 
1 1 1 14  6   10 o 19 5.68753e+00 1.76194e+00 4.88246e+01 152.409 -2.33967e+00 1.22271e+00  0.00000e+00 0.00000e+00 1.20703e+02 152.409 7.18788e+01 152.409 0.7794 
1 1 1 14  7   0  o 15 1.72715e+01 1.61737e+00 2.99025e+02 72.031  9.34268e+00  2.88068e+01  0.00000e+00 0.00000e+00 3.48812e+02 72.031  4.97875e+01 72.031  0.9833 
1 1 1 14  7   1  o 18 1.41707e+01 1.85014e+00 3.04397e+02 73.236  7.05501e+00  2.34200e+01  0.00000e+00 0.00000e+00 2.25248e+02 73.236  7.91494e+01 253.236 0.9793 
1 1 1 14  7   2  o 11 6.49635e+00 1.79786e+00 8.23998e+01 174.018 -3.14252e+00 3.29314e-01  0.00000e+00 0.00000e+00 1.21280e+02 174.018 3.88804e+01 174.018 0.8211 
1 1 1 14  7   3  f 0  7.66137e+00 1.57841e+00 9.92576e+01 351.260 5.06262e+00  -7.78261e-01 0.00000e+00 0.00000e+00 1.62999e+02 351.260 6.37413e+01 351.260 0.8961 
1 1 1 14  7   4  o 12 1.85141e+01 1.08467e+00 3.03965e+02 337.615 4.45825e+01  -1.83621e+01 0.00000e+00 0.00000e+00 3.96116e+02 337.615 9.21510e+01 337.615 0.9896 
1 1 1 14  7   5  o 11 5.73798e+00 1.57728e+00 1.42295e+02 95.874  -6.45173e-01 6.27117e+00  0.00000e+00 0.00000e+00 5.87880e+01 95.874  8.35072e+01 275.874 0.9168 
1 1 1 14  7   6  o 14 6.94694e+00 1.73078e+00 2.16451e+02 125.769 -6.64952e+00 9.23032e+00  0.00000e+00 0.00000e+00 3.71844e+01 125.769 1.79267e+02 305.769 0.9550 
1 1 1 14  7   7  o 10 9.22419e+00 1.74240e+00 1.57694e+02 8.211   1.14096e+01  1.64644e+00  0.00000e+00 0.00000e+00 1.79356e+02 8.211   2.16621e+01 8.211   0.9556 
1 1 1 14  7   8  o 11 9.02325e+00 1.95949e+00 1.63767e+02 252.684 -3.35565e+00 -1.07631e+01 0.00000e+00 0.00000e+00 1.65621e+02 252.684 1.85467e+00 252.684 0.9546 
1 1 1 14  7   9  o 15 4.02371e+00 1.35850e+00 2.36774e+01 86.214  7.09189e-02  1.07169e+00  0.00000e+00 0.00000e+00 4.89558e+01 86.214  2.52784e+01 86.214  0.4720 
1 1 1 14  7   10 o 10 5.84099e+00 1.79346e+00 1.20619e+02 228.141 -4.37954e+00 -4.88806e+00 0.00000e+00 0.00000e+00 8.49564e+01 228.141 3.56622e+01 48.141  0.9203 
1 1 1 14  8   0  o 6  6.74208e+00 1.91728e+00 1.19719e+02 146.275 -3.51794e+00 2.34836e+00  0.00000e+00 0.00000e+00 1.04481e+02 146.275 1.52379e+01 326.275 0.8718 
1 1 1 14  8   1  o 4  6.50029e+00 1.87501e+00 8.71789e+01 211.378 -2.71488e+00 -1.65576e+00 0.00000e+00 0.00000e+00 1.16853e+02 211.378 2.96736e+01 211.378 0.8225 
1 1 1 14  8   2  f 0  8.14747e+00 1.74474e+00 6.92467e+01 289.186 1.11767e+00  -3.21206e+00 0.00000e+00 0.00000e+00 1.90745e+02 289.186 1.21499e+02 289.186 0.8358 
1 1 1 14  8   3  o 15 1.14480e+01 1.36485e+00 2.45545e+02 153.995 -1.85069e+01 9.02832e+00  0.00000e+00 0.00000e+00 1.80985e+02 153.995 6.45601e+01 333.995 0.9754 
1 1 1 14  8   4  o 13 6.11368e+00 1.53100e+00 1.24970e+02 206.477 -4.91800e+00 -2.44952e+00 0.00000e+00 0.00000e+00 8.61447e+01 206.477 3.88254e+01 26.477  0.9037 
1 1 1 14  8   5  o 5  1.28662e+01 1.33302e+00 2.18826e+02 254.051 -6.67116e+00 -2.33439e+01 0.00000e+00 0.00000e+00 2.62708e+02 254.051 4.38820e+01 254.051 0.9792 
1 1 1 14  8   6  o 13 7.63382e+00 1.77001e+00 1.07688e+02 136.536 -4.42485e+00 4.19380e+00  0.00000e+00 0.00000e+00 1.59011e+02 136.536 5.13233e+01 136.536 0.9138 
1 1 1 14  8   7  o 3  2.77695e+01 1.20145e+00 4.24503e+02 326.082 1.02148e+02  -6.86873e+01 0.00000e+00 0.00000e+00 6.32999e+02 326.082 2.08496e+02 326.082 0.9959 
1 1 1 14  8   8  o 1  6.82430e+00 1.83961e+00 1.62646e+02 158.083 -8.41395e+00 3.38532e+00  0.00000e+00 0.00000e+00 8.34858e+01 158.083 7.91597e+01 338.083 0.9431 
1 1 1 14  8   9  o 14 5.19623e+00 1.62887e+00 1.28116e+02 13.162  6.22273e+00  1.45520e+00  0.00000e+00 0.00000e+00 5.43139e+01 13.162  7.38019e+01 193.162 0.9180 
1 1 1 14  8   10 o 13 5.88547e+00 1.75104e+00 1.56258e+02 13.147  8.57060e+00  2.00183e+00  0.00000e+00 0.00000e+00 5.56147e+01 13.147  1.00644e+02 193.147 0.9413 
1 1 1 14  9   0  o 12 6.75483e+00 1.83123e+00 7.46004e+01 201.935 -2.67553e+00 -1.07748e+00 0.00000e+00 0.00000e+00 1.31789e+02 201.935 5.71886e+01 201.935 0.8011 
1 1 1 14  9   1  o 10 6.87757e+00 1.95257e+00 2.26758e+02 105.633 -2.20522e+00 7.88078e+00  0.00000e+00 0.00000e+00 1.91073e+01 105.633 2.07651e+02 285.633 0.9367 
1 1 1 14  9   2  o 7  5.62454e+00 1.66992e+00 5.24094e+01 217.452 -1.45267e+00 -1.11273e+00 0.00000e+00 0.00000e+00 9.09923e+01 217.452 3.85829e+01 217.452 0.6678 
1 1 1 14  9   3  o 5  1.88262e+01 1.37146e+00 2.61578e+02 284.491 9.00021e+00  -3.48234e+01 0.00000e+00 0.00000e+00 4.47451e+02 284.491 1.85872e+02 284.491 0.9860 
1 1 1 14  9   4  o 15 5.21157e+00 1.49911e+00 8.52436e+01 170.004 -3.18757e+00 5.61809e-01  0.00000e+00 0.00000e+00 7.92546e+01 170.004 5.98900e+00 350.004 0.8261 
1 1 1 14  9   5  o 15 8.00621e+00 1.69550e+00 1.90156e+02 264.447 -1.05136e+00 -1.08139e+01 0.00000e+00 0.00000e+00 1.01408e+02 264.447 8.87477e+01 84.447  0.9528 
1 1 1 14  9   6  f 0  7.41160e+00 1.70287e+00 1.71072e+01 110.172 -3.35219e-01 9.12481e-01  0.00000e+00 0.00000e+00 1.06550e+02 110.172 8.94425e+01 110.172 0.4364 
1 1 1 14  9   7  o 4  5.53157e+00 1.63628e+00 1.20286e+02 310.187 3.59613e+00  -4.25746e+00 0.00000e+00 0.00000e+00 7.11630e+01 310.187 4.91225e+01 130.187 0.9052 
1 1 1 14  9   8  o 1  1.41506e+01 1.54835e+00 2.76103e+02 226.117 -2.61580e+01 -2.71980e+01 0.00000e+00 0.00000e+00 2.57801e+02 226.117 1.83017e+01 46.117  0.9867 
1 1 1 14  9   9  f 0  4.90533e+00 1.55692e+00 1.51627e+02 19.838  7.00940e+00  2.52873e+00  0.00000e+00 0.00000e+00 2.28790e+01 19.838  1.28748e+02 199.837 0.9303 
1 1 1 14  9   10 o 19 6.57043e+00 1.94010e+00 7.64886e+01 168.771 -4.18263e+00 8.30401e-01  0.00000e+00 0.00000e+00 1.42855e+02 168.771 6.63661e+01 168.771 0.8730 
1 1 1 14  10  0  o 11 6.41309e+00 1.85438e+00 7.03357e+01 162.846 -2.44275e+00 7.54017e-01  0.00000e+00 0.00000e+00 1.18255e+02 162.846 4.79196e+01 162.846 0.7710 
1 1 1 14  10  1  o 1  7.10158e+00 1.87541e+00 6.01437e+01 337.151 2.12713e+00  -8.96281e-01 0.00000e+00 0.00000e+00 1.41061e+02 337.151 8.09177e+01 337.151 0.7424 
1 1 1 14  10  2  o 17 9.06112e+00 1.95160e+00 1.29178e+02 71.039  2.12575e+00  6.18716e+00  0.00000e+00 0.00000e+00 1.89111e+02 71.039  5.99328e+01 71.039  0.9200 
1 1 1 14  10  3  o 14 1.57757e+01 1.16761e+00 2.80409e+02 83.729  3.80162e+00  3.45976e+01  0.00000e+00 0.00000e+00 3.13435e+02 83.729  3.30263e+01 83.729  0.9855 
1 1 1 14  10  4  o 9  8.51807e+00 1.61000e+00 1.39615e+02 321.898 6.51592e+00  -5.10950e+00 0.00000e+00 0.00000e+00 1.65516e+02 321.898 2.59011e+01 321.898 0.9375 
1 1 1 14  10  5  o 9  6.31836e+00 1.61184e+00 1.70161e+02 177.828 -7.96488e+00 3.02020e-01  0.00000e+00 0.00000e+00 5.56275e+01 177.828 1.14533e+02 357.828 0.9350 
1 1 1 14  10  6  o 18 8.16823e+00 1.74522e+00 1.99202e+02 41.123  9.52077e+00  8.31215e+00  0.00000e+00 0.00000e+00 1.00440e+02 41.123  9.87613e+01 221.123 0.9596 
1 1 1 14  10  7  o 10 4.83482e+00 1.50714e+00 6.27679e+01 11.456  2.66344e+00  5.39731e-01  0.00000e+00 0.00000e+00 8.26669e+01 11.456  1.98990e+01 11.456  0.7867 
1 1 1 14  10  8  o 6  1.24283e+01 1.64649e+00 2.19616e+02 188.989 -2.42615e+01 -3.83781e+00 0.00000e+00 0.00000e+00 2.45857e+02 188.989 2.62413e+01 188.989 0.9794 
1 1 1 14  10  9  o 10 4.51606e+00 1.47757e+00 8.22462e+01 85.172  3.28730e-01  3.89198e+00  0.00000e+00 0.00000e+00 6.62403e+01 85.172  1.60059e+01 265.172 0.8598 
1 1 1 14  10  10 o 15 6.67352e+00 1.92961e+00 1.40732e+02 279.608 1.33707e+00  -7.89876e+00 0.00000e+00 0.00000e+00 9.79616e+01 279.608 4.27706e+01 99.608  0.9353 
1 1 1 14  11  0  o 11 6.78630e+00 1.90170e+00 1.94489e+02 58.297  3.85446e+00  6.24011e+00  0.00000e+00 0.00000e+00 4.59893e+01 58.297  1.48500e+02 238.297 0.9291 
1 1 1 14  11  1  o 4  2.28753e+01 1.50669e+00 3.76460e+02 305.800 3.12184e+01  -4.32857e+01 0.00000e+00 0.00000e+00 4.88263e+02 305.800 1.11804e+02 305.800 0.9906 
1 1 1 14  11  2  o 4  1.17885e+01 1.68932e+00 2.21555e+02 4.438   1.61960e+01  1.25691e+00  0.00000e+00 0.00000e+00 2.14436e+02 4.438   7.11922e+00 184.438 0.9687 
1 1 1 14  11  3  o 16 4.67468e+00 1.38735e+00 1.04139e+02 305.961 2.07522e+00  -2.86037e+00 0.00000e+00 0.00000e+00 4.63498e+01 305.961 5.77896e+01 125.961 0.8429 
1 1 1 14  11  4  o 8  9.67454e+00 1.85086e+00 1.65801e+02 203.283 -9.23070e+00 -3.97216e+00 0.00000e+00 0.00000e+00 1.84939e+02 203.283 1.91375e+01 203.283 0.9489 
1 1 1 14  11  5  o 6  1.31030e+01 1.48060e+00 3.10710e+02 134.624 -2.24850e+01 2.27817e+01  0.00000e+00 0.00000e+00 1.82189e+02 134.624 1.28521e+02 314.624 0.9843 
1 1 1 14  11  6  o 7  9.24140e+00 1.89912e+00 1.51407e+02 198.115 -9.53319e+00 -3.11874e+00 0.00000e+00 0.00000e+00 1.83768e+02 198.115 3.23612e+01 198.115 0.9488 
1 1 1 14  11  7  o 7  1.33882e+01 1.49853e+00 2.64649e+02 307.327 1.93175e+01  -2.53332e+01 0.00000e+00 0.00000e+00 2.39138e+02 307.327 2.55107e+01 127.327 0.9842 
1 1 1 14  11  8  o 14 5.03816e+00 1.54200e+00 8.68405e+01 183.309 -4.16866e+00 -2.41039e-01 0.00000e+00 0.00000e+00 8.07555e+01 183.309 6.08505e+00 3.309   0.8700 
1 1 1 14  11  9  o 6  8.45823e+00 1.94703e+00 8.07708e+01 103.920 -1.30564e+00 5.26797e+00  0.00000e+00 0.00000e+00 2.11113e+02 103.920 1.30343e+02 103.920 0.9024 
1 1 1 14  11  10 o 7  5.95345e+00 1.83433e+00 1.35525e+02 242.333 -3.39332e+00 -6.47228e+00 0.00000e+00 0.00000e+00 7.59259e+01 242.333 5.95989e+01 62.333  0.9288 
1 1 1 14  12  0  o 16 6.63121e+00 1.89113e+00 1.17370e+02 83.697  4.76517e-01  4.31413e+00  0.00000e+00 0.00000e+00 1.04038e+02 83.697  1.33323e+01 263.697 0.8754 
1 1 1 14  12  1  o 6  8.22857e+00 1.99935e+00 7.40046e+01 180.034 -3.13177e+00 -1.85525e-03 0.00000e+00 0.00000e+00 1.83246e+02 180.034 1.09242e+02 180.034 0.8193 
1 1 1 14  12  2  o 7  1.91092e+01 1.35873e+00 3.52974e+02 220.493 -3.62138e+01 -3.09224e+01 0.00000e+00 0.00000e+00 3.68870e+02 220.493 1.58958e+01 220.493 0.9894 
1 1 1 14  12  3  o 19 9.99180e+00 1.46833e+00 2.55883e+02 25.682  1.61988e+01  7.78958e+00  0.00000e+00 0.00000e+00 1.14964e+02 25.682  1.40919e+02 205.682 0.9718 
1 1 1 14  12  4  o 3  4.72546e+00 1.51242e+00 2.51287e+01 17.845  8.19323e-01  2.63760e-01  0.00000e+00 0.00000e+00 4.61641e+01 17.845  2.10354e+01 17.845  0.3949 
1 1 1 14  12  5  o 6  1.64266e+01 1.23707e+00 3.04795e+02 36.489  3.51219e+01  2.59788e+01  0.00000e+00 0.00000e+00 3.15765e+02 36.489  1.09704e+01 36.489  0.9885 
1 1 1 14  12  6  o 11 4.85311e+00 1.49775e+00 7.75173e+01 299.192 1.61692e+00  -2.89411e+00 0.00000e+00 0.00000e+00 7.66167e+01 299.192 9.00569e-01 119.192 0.8308 
1 1 1 14  12  7  o 10 4.46581e+00 1.44998e+00 6.39027e+01 188.725 -2.72769e+00 -4.18607e-01 0.00000e+00 0.00000e+00 7.10706e+01 188.725 7.16796e+00 188.725 0.7905 
1 1 1 14  12  8  o 10 8.11638e+00 1.77663e+00 1.39149e+02 176.694 -9.41972e+00 5.44194e-01  0.00000e+00 0.00000e+00 1.54258e+02 176.694 1.51089e+01 176.694 0.9454 
1 1 1 14  12  9  f 0  5.45200e+00 1.67468e+00 1.49655e+02 79.254  1.42093e+00  7.48736e+00  0.00000e+00 0.00000e+00 4.46189e+01 79.254  1.05037e+02 259.254 0.9319 
1 1 1 14  12  10 o 11 7.10550e+00 1.97089e+00 9.65697e+01 276.067 6.02444e-01  -5.66842e+00 0.00000e+00 0.00000e+00 1.49981e+02 276.067 5.34113e+01 276.067 0.9074 
1 1 1 14  13  0  o 8  1.95682e+01 1.53074e+00 3.27224e+02 203.606 -3.60951e+01 -1.57738e+01 0.00000e+00 0.00000e+00 4.09532e+02 203.606 8.23077e+01 203.606 0.9872 
1 1 1 14  13  1  o 14 7.99305e+00 2.04384e+00 7.99596e+01 74.727  8.98827e-01  3.29174e+00  0.00000e+00 0.00000e+00 1.75139e+02 74.727  9.51794e+01 74.727  0.8364 
1 1 1 14  13  2  o 10 1.77026e+01 1.38736e+00 3.14139e+02 255.781 -9.94431e+00 -3.92462e+01 0.00000e+00 0.00000e+00 3.53283e+02 255.781 3.91444e+01 255.781 0.9876 
1 1 1 14  13  3  o 7  1.97368e+01 1.07126e+00 3.98747e+02 129.395 -4.05870e+01 4.94205e+01  0.00000e+00 0.00000e+00 3.49126e+02 129.395 4.96209e+01 309.395 0.9922 
1 1 1 14  13  4  o 9  1.40428e+01 1.77454e+00 9.84690e+01 297.756 4.16800e+00  -7.91993e+00 0.00000e+00 0.00000e+00 4.07115e+02 297.756 3.08646e+02 297.756 0.9424 
1 1 1 14  13  5  o 19 1.24993e+01 1.41856e+00 1.27447e+02 285.893 3.67371e+00  -1.29026e+01 0.00000e+00 0.00000e+00 3.32068e+02 285.893 2.04621e+02 285.893 0.9620 
1 1 1 14  13  6  o 11 1.74147e+01 1.21897e+00 2.75123e+02 156.649 -4.44102e+01 1.91730e+01  0.00000e+00 0.00000e+00 3.83641e+02 156.649 1.08519e+02 156.649 0.9896 
1 1 1 14  13  7  f 0  6.01929e+00 1.67797e+00 7.79301e+01 7.884   3.96826e+00  5.49512e-01  0.00000e+00 0.00000e+00 1.20844e+02 7.884   4.29139e+01 7.884   0.8638 
1 1 1 14  13  8  f 0  6.09257e+00 1.72736e+00 6.10412e+01 198.377 -3.03127e+00 -1.00701e+00 0.00000e+00 0.00000e+00 1.30767e+02 198.377 6.97255e+01 198.377 0.8234 
1 1 1 14  13  9  o 12 7.51715e+00 1.95293e+00 1.23185e+02 92.365  -3.02263e-01 7.31914e+00  0.00000e+00 0.00000e+00 1.43842e+02 92.365  2.06574e+01 92.365  0.9290 
1 1 1 14  13  10 o 13 5.13511e+00 1.61765e+00 1.09055e+02 2.717   5.81621e+00  2.75986e-01  0.00000e+00 0.00000e+00 6.95279e+01 2.717   3.95269e+01 182.717 0.9095 
1 1 1 14  14  0  o 18 3.20285e+01 1.46574e+00 5.71373e+02 82.427  1.51687e+01  1.14100e+02  0.00000e+00 0.00000e+00 6.44763e+02 82.427  7.33894e+01 82.427  0.9956 
1 1 1 14  14  1  o 13 2.19873e+01 1.48050e+00 3.05082e+02 251.175 -1.44739e+01 -4.24551e+01 0.00000e+00 0.00000e+00 5.24479e+02 251.175 2.19396e+02 251.175 0.9888 
1 1 1 14  14  2  o 16 5.11007e+00 1.48582e+00 1.69742e+02 5.387   6.04383e+00  5.69878e-01  0.00000e+00 0.00000e+00 8.44972e+00 5.387   1.61292e+02 185.387 0.9134 
1 1 1 14  14  3  o 2  9.30947e+00 1.39016e+00 1.78811e+02 155.522 -1.09676e+01 4.99303e+00  0.00000e+00 0.00000e+00 1.61637e+02 155.522 1.71742e+01 335.522 0.9576 
1 1 1 14  14  4  o 16 2.28407e+01 1.51975e+00 3.30131e+02 336.108 5.36785e+01  -2.37779e+01 0.00000e+00 0.00000e+00 5.35010e+02 336.108 2.04879e+02 336.108 0.9914 
1 1 1 14  14  5  o 6  8.52796e+00 1.62238e+00 1.78798e+02 124.102 -6.54299e+00 9.66333e+00  0.00000e+00 0.00000e+00 1.32806e+02 124.102 4.59925e+01 304.102 0.9561 
1 1 1 14  14  6  o 19 1.06524e+01 1.60814e+00 2.46660e+02 64.303  9.76965e+00  2.03024e+01  0.00000e+00 0.00000e+00 1.51376e+02 64.303  9.52840e+01 244.303 0.9776 
1 1 1 14  14  7  o 7  9.62504e+00 1.80164e+00 1.69091e+02 208.150 -1.14462e+01 -6.12450e+00 0.00000e+00 0.00000e+00 1.84407e+02 208.150 1.53158e+01 208.150 0.9607 
1 1 1 14  14  8  o 7  1.03309e+01 1.78762e+00 2.04722e+02 37.209  1.38490e+01  1.05153e+01  0.00000e+00 0.00000e+00 1.78742e+02 37.209  2.59797e+01 217.209 0.9708 
1 1 1 14  14  9  o 8  5.49622e+00 1.66907e+00 1.06085e+02 238.277 -2.94651e+00 -4.76654e+00 0.00000e+00 0.00000e+00 8.42560e+01 238.277 2.18292e+01 58.277  0.9057 
1 1 1 14  14  10 o 17 4.28237e+00 1.45748e+00 8.74657e+01 228.118 -2.92682e+00 -3.26406e+00 0.00000e+00 0.00000e+00 5.61035e+01 228.118 3.13622e+01 48.118  0.8768 
1 1 1 14  15  0  o 12 9.91187e+00 1.97895e+00 1.16331e+02 304.154 3.35661e+00  -4.94769e+00 0.00000e+00 0.00000e+00 2.28406e+02 304.154 1.12076e+02 304.154 0.9120 
1 1 1 14  15  1  o 17 1.59827e+01 1.34979e+00 2.47706e+02 22.709  2.56058e+01  1.07158e+01  0.00000e+00 0.00000e+00 3.51031e+02 22.709  1.03325e+02 22.709  0.9818 
1 1 1 14  15  2  o 11 1.40427e+01 1.55609e+00 3.04784e+02 157.370 -2.68557e+01 1.11955e+01  0.00000e+00 0.00000e+00 2.21979e+02 157.370 8.28048e+01 337.370 0.9827 
1 1 1 14  15  3  o 19 7.43658e+00 1.60806e+00 1.72501e+02 344.524 8.54132e+00  -2.36491e+00 0.00000e+00 0.00000e+00 9.49580e+01 344.524 7.75432e+01 164.524 0.9418 
1 1 1 14  15  4  o 12 6.37250e+00 2.30957e+00 3.70726e+01 120.778 -6.48905e-01 1.08949e+00  0.00000e+00 0.00000e+00 9.27735e+01 120.778 5.57009e+01 120.778 0.5334 
1 1 1 14  15  5  o 9  4.81307e+00 1.43862e+00 8.36358e+01 205.597 -3.02566e+00 -1.44944e+00 0.00000e+00 0.00000e+00 6.96008e+01 205.597 1.40350e+01 25.597  0.8332 
1 1 1 14  15  6  o 5  1.17416e+01 1.69891e+00 8.49689e+01 195.550 -7.85185e+00 -2.18483e+00 0.00000e+00 0.00000e+00 3.35313e+02 195.550 2.50344e+02 195.550 0.9365 
1 1 1 14  15  7  o 3  6.01021e+00 1.53931e+00 1.48790e+02 339.045 7.72189e+00  -2.95722e+00 0.00000e+00 0.00000e+00 6.65943e+01 339.045 8.21959e+01 159.045 0.9374 
1 1 1 14  15  8  o 6  5.85454e+00 1.67577e+00 1.27676e+02 195.665 -6.29874e+00 -1.76634e+00 0.00000e+00 0.00000e+00 7.82585e+01 195.665 4.94178e+01 15.665  0.9200 
1 1 1 14  15  9  o 4  4.07949e+00 1.36562e+00 9.59735e+01 175.236 -4.51146e+00 3.75960e-01  0.00000e+00 0.00000e+00 4.14614e+01 175.236 5.45121e+01 355.236 0.8811 
1 1 1 14  15  10 o 3  4.90841e+00 1.57108e+00 7.97026e+01 21.365  3.95810e+00  1.54834e+00  0.00000e+00 0.00000e+00 8.40363e+01 21.365  4.33365e+00 21.365  0.8725 
1 1 1 14  16  0  o 3  1.24908e+01 1.80105e+00 1.32593e+02 81.726  1.40615e+00  9.66981e+00  0.00000e+00 0.00000e+00 3.18651e+02 81.726  1.86058e+02 81.726  0.9474 
1 1 1 14  16  1  o 10 8.74242e+00 1.75459e+00 1.59689e+02 122.407 -4.53433e+00 7.14300e+00  0.00000e+00 0.00000e+00 1.53486e+02 122.407 6.20379e+00 302.407 0.9389 
1 1 1 14  16  2  o 19 1.92807e+01 1.05811e+00 3.56212e+02 348.829 5.51041e+01  -1.08817e+01 0.00000e+00 0.00000e+00 3.73187e+02 348.829 1.69758e+01 348.829 0.9911 
1 1 1 14  16  3  o 13 8.39602e+00 1.56963e+00 1.30769e+02 8.346   7.62188e+00  1.11814e+00  0.00000e+00 0.00000e+00 1.68255e+02 8.346   3.74864e+01 8.346   0.9326 
1 1 1 14  16  4  o 7  1.40594e+01 1.34132e+00 2.20951e+02 149.781 -2.25810e+01 1.31522e+01  0.00000e+00 0.00000e+00 3.05750e+02 149.781 8.47991e+01 149.781 0.9807 
1 1 1 14  16  5  o 2  5.41991e+00 1.51228e+00 1.30766e+02 47.444  3.68939e+00  4.01832e+00  0.00000e+00 0.00000e+00 5.62428e+01 47.444  7.45235e+01 227.444 0.9030 
1 1 1 14  16  6  o 16 5.35457e+00 1.62439e+00 7.75974e+01 203.573 -3.23456e+00 -1.41135e+00 0.00000e+00 0.00000e+00 9.48464e+01 203.573 1.72490e+01 203.573 0.8426 
1 1 1 14  16  7  o 15 7.61947e+00 1.86274e+00 1.57242e+02 70.175  3.14453e+00  8.72214e+00  0.00000e+00 0.00000e+00 1.17841e+02 70.175  3.94006e+01 250.175 0.9444 
1 1 1 14  16  8  o 5  4.88459e+00 1.51868e+00 6.16871e+01 298.936 1.39219e+00  -2.51824e+00 0.00000e+00 0.00000e+00 8.78008e+01 298.936 2.61138e+01 298.936 0.8005 
1 1 1 14  16  9  o 4  7.70673e+00 1.79209e+00 1.15806e+02 73.808  2.13340e+00  7.34712e+00  0.00000e+00 0.00000e+00 1.58851e+02 73.808  4.30456e+01 73.808  0.9321 
1 1 1 14  16  10 o 8  3.89428e+00 1.34967e+00 8.57010e+01 210.086 -3.62244e+00 -2.09864e+00 0.00000e+00 0.00000e+00 4.38793e+01 210.086 4.18217e+01 30.086  0.8703 
1 1 1 14  17  0  o 14 1.26502e+01 1.86694e+00 1.97469e+02 323.727 1.15573e+01  -8.48132e+00 0.00000e+00 0.00000e+00 2.67761e+02 323.727 7.02924e+01 323.727 0.9645 
1 1 1 14  17  1  o 14 2.76701e+01 1.27463e+00 4.48839e+02 53.810  5.33649e+01  7.29409e+01  0.00000e+00 0.00000e+00 6.00975e+02 53.810  1.52136e+02 53.810  0.9945 
1 1 1 14  17  2  o 12 1.33103e+01 1.50691e+00 2.99553e+02 266.095 -1.88106e+00 -2.75554e+01 0.00000e+00 0.00000e+00 1.99219e+02 266.095 1.00334e+02 86.095  0.9817 
1 1 1 14  17  3  o 15 2.09151e+01 1.37273e+00 3.98211e+02 153.703 -5.73576e+01 2.83436e+01  0.00000e+00 0.00000e+00 3.94182e+02 153.703 4.02888e+00 333.703 0.9922 
1 1 1 14  17  4  o 14 1.74562e+01 1.14340e+00 3.28479e+02 310.563 3.35793e+01  -3.92285e+01 0.00000e+00 0.00000e+00 3.31842e+02 310.563 3.36359e+00 310.563 0.9903 
1 1 1 14  17  5  o 1  6.56897e+00 1.58197e+00 2.02048e+02 155.802 -9.02422e+00 4.05519e+00  0.00000e+00 0.00000e+00 3.59089e+01 155.802 1.66139e+02 335.802 0.9480 
1 1 1 14  17  6  o 6  4.91861e+00 1.54287e+00 1.17498e+02 43.774  3.69543e+00  3.54056e+00  0.00000e+00 0.00000e+00 5.09436e+01 43.774  6.65546e+01 223.774 0.8960 
1 1 1 14  17  7  o 18 8.48207e+00 1.74087e+00 1.69279e+02 162.981 -1.13590e+01 3.47681e+00  0.00000e+00 0.00000e+00 1.40988e+02 162.981 2.82907e+01 342.981 0.9569 
1 1 1 14  17  8  o 5  6.38390e+00 1.75442e+00 1.29055e+02 287.033 2.17824e+00  -7.10989e+00 0.00000e+00 0.00000e+00 9.79386e+01 287.033 3.11163e+01 107.033 0.9301 
1 1 1 14  17  9  o 19 4.23848e+00 1.42382e+00 6.91670e+01 123.363 -1.71387e+00 2.60290e+00  0.00000e+00 0.00000e+00 6.34220e+01 123.363 5.74497e+00 303.363 0.8182 
1 1 1 14  17  10 o 6  4.46845e+00 1.51054e+00 7.51114e+01 166.746 -3.55918e+00 8.38359e-01  0.00000e+00 0.00000e+00 6.99038e+01 166.746 5.20754e+00 346.746 0.8489 
1 1 1 14  18  0  o 2  8.95362e+00 1.94081e+00 1.33064e+02 49.619  4.29338e+00  5.04813e+00  0.00000e+00 0.00000e+00 1.81405e+02 49.619  4.83406e+01 49.619  0.9211 
1 1 1 14  18  1  o 16 9.59336e+00 1.76015e+00 2.65720e+02 4.100   1.53469e+01  1.09998e+00  0.00000e+00 0.00000e+00 8.81671e+01 4.100   1.77553e+02 184.100 0.9669 
1 1 1 14  18  2  o 2  1.49825e+01 1.35324e+00 2.14925e+02 204.831 -2.14738e+01 -9.93650e+00 0.00000e+00 0.00000e+00 3.44713e+02 204.831 1.29788e+02 204.831 0.9786 
1 1 1 14  18  3  o 19 1.47100e+01 1.12211e+00 3.03427e+02 322.640 2.99824e+01  -2.28899e+01 0.00000e+00 0.00000e+00 2.50764e+02 322.640 5.26631e+01 142.640 0.9867 
1 1 1 14  18  4  o 12 1.99972e+01 1.07595e+00 2.84807e+02 177.869 -5.25561e+01 1.95603e+00  0.00000e+00 0.00000e+00 4.71734e+02 177.869 1.86926e+02 177.869 0.9904 
1 1 1 14  18  5  o 17 4.68076e+00 1.45138e+00 8.71326e+01 81.235  4.90500e-01  3.18128e+00  0.00000e+00 0.00000e+00 6.04046e+01 81.235  2.67280e+01 261.235 0.8249 
1 1 1 14  18  6  o 6  4.58727e+00 1.47032e+00 5.28161e+01 115.156 -9.46619e-01 2.01567e+00  0.00000e+00 0.00000e+00 7.54644e+01 115.156 2.26483e+01 115.156 0.7317 
1 1 1 14  18  7  o 14 7.41621e+00 1.74915e+00 1.26943e+02 150.605 -6.90618e+00 3.89067e+00  0.00000e+00 0.00000e+00 1.37994e+02 150.605 1.10503e+01 150.605 0.9346 
1 1 1 14  18  8  o 5  1.83559e+01 1.31277e+00 2.50358e+02 52.346  3.30545e+01  4.28392e+01  0.00000e+00 0.00000e+00 4.44828e+02 52.346  1.94471e+02 52.346  0.9907 
1 1 1 14  18  9  o 11 5.07292e+00 1.59174e+00 5.23770e+01 329.495 2.20539e+00  -1.29932e+00 0.00000e+00 0.00000e+00 9.72110e+01 329.495 4.48340e+01 329.495 0.7713 
1 1 1 14  18  10 o 18 5.90419e+00 1.77225e+00 1.19755e+02 26.595  5.83967e+00  2.92359e+00  0.00000e+00 0.00000e+00 8.78720e+01 26.595  3.18826e+01 206.594 0.9199 
1 1 1 14  19  0  o 5  2.36214e+01 1.48063e+00 3.93977e+02 88.234  1.93512e+00  6.27684e+01  0.00000e+00 0.00000e+00 4.99456e+02 88.234  1.05479e+02 88.234  0.9920 
1 1 1 14  19  1  o 9  1.28615e+01 1.53084e+00 2.06815e+02 154.534 -1.64994e+01 7.85761e+00  0.00000e+00 0.00000e+00 2.70210e+02 154.534 6.33947e+01 154.534 0.9722 
1 1 1 14  19  2  o 3  8.77756e+00 1.65909e+00 1.87768e+02 96.616  -1.23570e+00 1.06544e+01  0.00000e+00 0.00000e+00 1.31218e+02 96.616  5.65506e+01 276.616 0.9522 
1 1 1 14  19  3  f 0  1.51611e+01 1.13176e+00 2.46310e+02 11.034  3.08440e+01  6.01465e+00  0.00000e+00 0.00000e+00 3.23286e+02 11.034  7.69756e+01 11.034  0.9840 
1 1 1 14  19  4  o 13 6.04377e+00 1.57600e+00 9.90910e+01 279.112 7.33049e-01  -4.57057e+00 0.00000e+00 0.00000e+00 1.04976e+02 279.112 5.88466e+00 279.112 0.8840 
1 1 1 14  19  5  o 9  5.27524e+00 1.45670e+00 1.13904e+02 41.339  3.77435e+00  3.32039e+00  0.00000e+00 0.00000e+00 6.62811e+01 41.339  4.76228e+01 221.339 0.8940 
1 1 1 14  19  6  o 17 6.46902e+00 1.61647e+00 1.13630e+02 212.794 -5.06718e+00 -3.26484e+00 0.00000e+00 0.00000e+00 1.12025e+02 212.794 1.60501e+00 32.794  0.9128 
1 1 1 14  19  7  o 13 1.08819e+01 1.66080e+00 1.35984e+02 348.158 1.28099e+01  -2.68595e+00 0.00000e+00 0.00000e+00 2.63721e+02 348.158 1.27738e+02 348.158 0.9610 
1 1 1 14  19  8  o 4  4.82865e+00 1.51073e+00 1.13511e+02 157.959 -5.22866e+00 2.11692e+00  0.00000e+00 0.00000e+00 5.37893e+01 157.959 5.97216e+01 337.958 0.9064 
1 1 1 14  19  9  o 1  5.17144e+00 1.63328e+00 9.61138e+01 297.590 2.32744e+00  -4.45386e+00 0.00000e+00 0.00000e+00 8.06147e+01 297.590 1.54990e+01 117.590 0.8940 
1 1 1 14  19  10 o 18 7.92011e+00 1.86245e+00 1.44997e+02 47.621  7.05845e+00  7.73566e+00  0.00000e+00 0.00000e+00 1.42923e+02 47.621  2.07405e+00 227.621 0.9510 
1 1 1 14  20  0  o 2  1.62675e+01 1.46226e+00 2.63617e+02 275.802 2.94225e+00  -2.89575e+01 0.00000e+00 0.00000e+00 3.45845e+02 275.802 8.22282e+01 275.802 0.9827 
1 1 1 14  20  1  o 1  1.99701e+01 1.19928e+00 2.33354e+02 97.948  -5.01577e+00 3.59250e+01  0.00000e+00 0.00000e+00 5.17856e+02 97.948  2.84502e+02 97.948  0.9861 
1 1 1 14  20  2  o 18 1.45299e+01 1.28229e+00 2.78570e+02 138.685 -2.29215e+01 2.01478e+01  0.00000e+00 0.00000e+00 2.66790e+02 138.685 1.17802e+01 318.685 0.9835 
1 1 1 14  20  3  o 8  1.04697e+01 1.37894e+00 1.76527e+02 270.792 1.95675e-01  -1.41578e+01 0.00000e+00 0.00000e+00 2.08821e+02 270.792 3.22934e+01 270.792 0.9640 
1 1 1 14  20  4  o 5  9.84886e+00 1.52496e+00 1.92703e+02 99.789  -2.55187e+00 1.47906e+01  0.00000e+00 0.00000e+00 1.70702e+02 99.789  2.20003e+01 279.789 0.9661 
1 1 1 14  20  5  o 13 8.15122e+00 1.60331e+00 1.48597e+02 277.880 1.29538e+00  -9.35877e+00 0.00000e+00 0.00000e+00 1.45843e+02 277.880 2.75392e+00 97.880  0.9455 
1 1 1 14  20  6  o 9  6.71052e+00 1.56514e+00 8.57576e+01 296.620 2.16862e+00  -4.32687e+00 0.00000e+00 0.00000e+00 1.42345e+02 296.620 5.65875e+01 296.620 0.8895 
1 1 1 14  20  7  o 16 8.41994e+00 1.86154e+00 2.02550e+02 148.746 -1.11909e+01 6.79181e+00  0.00000e+00 0.00000e+00 1.06709e+02 148.746 9.58403e+01 328.746 0.9610 
1 1 1 14  20  8  o 16 1.43732e+01 1.55557e+00 3.55474e+02 357.526 5.11269e+01  -2.20935e+00 0.00000e+00 0.00000e+00 1.88526e+02 357.526 1.66948e+02 177.526 0.9902 
1 1 1 14  20  9  o 13 5.40979e+00 1.66778e+00 7.79209e+01 169.625 -4.09997e+00 7.50630e-01  0.00000e+00 0.00000e+00 1.01922e+02 169.625 2.40016e+01 169.625 0.8697 
1 1 1 14  20  10 o 18 6.72504e+00 1.90459e+00 1.36460e+02 262.807 -1.01914e+00 -8.07515e+00 0.00000e+00 0.00000e+00 1.04250e+02 262.807 3.22104e+01 82.807  0.9364 
1 1 1 14  21  0  o 16 1.99701e+01 1.57743e+00 3.08035e+02 126.315 -2.45671e+01 3.34263e+01  0.00000e+00 0.00000e+00 4.44065e+02 126.315 1.36030e+02 126.315 0.9879 
1 1 1 14  21  1  o 19 1.53559e+01 1.35700e+00 2.59524e+02 14.985  2.82659e+01  7.56599e+00  0.00000e+00 0.00000e+00 3.16113e+02 14.985  5.65884e+01 14.985  0.9828 
1 1 1 14  21  2  o 2  1.26245e+01 1.24391e+00 2.42928e+02 170.307 -2.41952e+01 4.13282e+00  0.00000e+00 0.00000e+00 2.28931e+02 170.307 1.39973e+01 350.307 0.9794 
1 1 1 14  21  3  o 10 1.52528e+01 1.14581e+00 2.70417e+02 341.490 3.27465e+01  -1.09631e+01 0.00000e+00 0.00000e+00 3.03407e+02 341.490 3.29903e+01 341.490 0.9854 
1 1 1 14  21  4  o 6  6.41136e+00 1.57153e+00 1.52247e+02 202.332 -6.81701e+00 -2.80035e+00 0.00000e+00 0.00000e+00 7.53336e+01 202.332 7.69138e+01 22.332  0.9294 
1 1 1 14  21  5  o 6  4.09795e+00 1.29009e+00 5.57735e+01 292.914 8.33875e-01  -1.97273e+00 0.00000e+00 0.00000e+00 5.69006e+01 292.914 1.12711e+00 292.914 0.7197 
1 1 1 14  21  6  o 7  6.69181e+00 1.62793e+00 7.46116e+01 357.382 4.31681e+00  -1.97376e-01 0.00000e+00 0.00000e+00 1.49083e+02 357.382 7.44718e+01 357.382 0.8748 
1 1 1 14  21  7  o 6  9.41059e+00 1.71603e+00 1.57001e+02 271.536 3.28841e-01  -1.22656e+01 0.00000e+00 0.00000e+00 1.87664e+02 271.536 3.06629e+01 271.536 0.9583 
1 1 1 14  21  8  o 4  3.85814e+00 1.30587e+00 1.16547e+02 189.332 -5.17406e+00 -8.50290e-01 0.00000e+00 0.00000e+00 1.59838e+01 189.332 1.00563e+02 9.332   0.8987 
1 1 1 14  21  9  o 12 7.47261e+00 1.88245e+00 1.55288e+02 227.974 -6.44600e+00 -7.15245e+00 0.00000e+00 0.00000e+00 1.15072e+02 227.974 4.02166e+01 47.974  0.9466 
1 1 1 14  21  10 f 0  8.34911e+00 2.06891e+00 1.03097e+02 332.877 6.24269e+00  -3.19771e+00 0.00000e+00 0.00000e+00 1.92312e+02 332.877 8.92152e+01 332.877 0.9257 
1 1 1 14  22  0  o 7  5.34750e+00 1.61321e+00 7.84504e+01 175.023 -2.77388e+00 2.41567e-01  0.00000e+00 0.00000e+00 8.31428e+01 175.023 4.69238e+00 175.023 0.7927 
1 1 1 14  22  1  o 10 1.40772e+01 1.48904e+00 2.70577e+02 352.708 2.63267e+01  -3.36862e+00 0.00000e+00 0.00000e+00 2.56139e+02 352.708 1.44377e+01 172.708 0.9810 
1 1 1 14  22  2  o 5  1.76269e+01 1.02801e+00 2.84593e+02 79.347  8.01180e+00  4.25944e+01  0.00000e+00 0.00000e+00 3.80241e+02 79.347  9.56477e+01 79.347  0.9884 
1 1 1 14  22  3  f 0  1.20590e+01 1.26359e+00 1.39973e+02 131.725 -9.77985e+00 1.09671e+01  0.00000e+00 0.00000e+00 3.04436e+02 131.725 1.64462e+02 131.725 0.9654 
1 1 1 14  22  4  o 2  1.07756e+01 1.42028e+00 1.90963e+02 120.902 -8.52760e+00 1.42473e+01  0.00000e+00 0.00000e+00 2.07954e+02 120.902 1.69909e+01 120.902 0.9694 
1 1 1 14  22  5  f 0  1.88114e+01 1.14852e+00 2.58039e+02 336.215 4.43142e+01  -1.95306e+01 0.00000e+00 0.00000e+00 4.53096e+02 336.215 1.95057e+02 336.215 0.9896 
1 1 1 14  22  6  o 16 4.02615e+00 1.31347e+00 1.02541e+02 305.483 2.44652e+00  -3.43210e+00 0.00000e+00 0.00000e+00 3.14952e+01 305.483 7.10454e+01 125.483 0.8713 
1 1 1 14  22  7  o 9  5.35989e+00 1.57519e+00 1.59211e+02 262.691 -9.96154e-01 -7.76660e+00 0.00000e+00 0.00000e+00 3.20518e+01 262.691 1.27159e+02 82.691  0.9338 
1 1 1 14  22  8  o 6  1.04414e+01 1.77897e+00 1.69523e+02 204.520 -1.41626e+01 -6.46019e+00 0.00000e+00 0.00000e+00 2.16499e+02 204.520 4.69762e+01 204.520 0.9673 
1 1 1 14  22  9  o 13 4.54407e+00 1.49644e+00 5.16998e+01 2.656   2.45306e+00  1.13781e-01  0.00000e+00 0.00000e+00 8.03112e+01 2.656   2.86114e+01 2.656   0.7601 
1 1 1 14  22  10 o 1  4.73478e+00 1.54842e+00 5.50642e+01 324.231 2.43759e+00  -1.75606e+00 0.00000e+00 0.00000e+00 9.15712e+01 324.231 3.65070e+01 324.231 0.8103 
1 1 1 14  23  0  o 9  9.12953e+00 1.58110e+00 1.20467e+02 77.693  1.57572e+00  7.22276e+00  0.00000e+00 0.00000e+00 2.03068e+02 77.693  8.26009e+01 77.693  0.9297 
1 1 1 14  23  1  o 11 6.26145e+00 1.73031e+00 1.42353e+02 336.143 5.14852e+00  -2.27693e+00 0.00000e+00 0.00000e+00 7.40525e+01 336.143 6.83005e+01 156.143 0.9062 
1 1 1 14  23  2  o 15 6.66716e+00 1.51783e+00 1.00494e+02 43.062  3.54029e+00  3.30859e+00  0.00000e+00 0.00000e+00 1.25841e+02 43.062  2.53474e+01 43.062  0.8897 
1 1 1 14  23  3  o 1  8.97529e+00 1.48133e+00 1.64852e+02 325.333 9.62595e+00  -6.65711e+00 0.00000e+00 0.00000e+00 1.62783e+02 325.333 2.06875e+00 145.333 0.9563 
1 1 1 14  23  4  o 10 2.04414e+01 1.05150e+00 3.57393e+02 113.119 -2.82616e+01 6.61970e+01  0.00000e+00 0.00000e+00 4.17751e+02 113.119 6.03582e+01 113.119 0.9930 
1 1 1 14  23  5  o 10 1.02275e+01 1.54369e+00 2.02080e+02 281.027 3.40424e+00  -1.74693e+01 0.00000e+00 0.00000e+00 1.77447e+02 281.027 2.46327e+01 101.027 0.9715 
1 1 1 14  23  6  o 11 6.58297e+00 1.60591e+00 5.98227e+01 188.843 -3.31254e+00 -5.15326e-01 0.00000e+00 0.00000e+00 1.49687e+02 188.843 8.98647e+01 188.843 0.8330 
1 1 1 14  23  7  o 5  8.74413e+00 1.75358e+00 1.82406e+02 1.300   1.32430e+01  3.00511e-01  0.00000e+00 0.00000e+00 1.38860e+02 1.300   4.35464e+01 181.300 0.9615 
1 1 1 14  23  8  o 7  6.99189e+00 1.78052e+00 9.28629e+01 203.209 -5.22088e+00 -2.23869e+00 0.00000e+00 0.00000e+00 1.49519e+02 203.209 5.66558e+01 203.209 0.9071 
1 1 1 14  23  9  o 9  3.92888e+00 1.33643e+00 2.90498e+01 228.619 -9.32894e-01 -1.05886e+00 0.00000e+00 0.00000e+00 5.70497e+01 228.619 2.79998e+01 228.619 0.5734 
1 1 1 14  23  10 o 19 5.02479e+00 1.62430e+00 5.00784e+01 67.484  1.01748e+00  2.45446e+00  0.00000e+00 0.00000e+00 9.99113e+01 67.484  4.98329e+01 67.484  0.7810 
1 1 1 14  24  0  o 4  1.68106e+01 1.29120e+00 3.57096e+02 278.093 6.35158e+00  -4.46650e+01 0.00000e+00 0.00000e+00 2.76526e+02 278.093 8.05708e+01 98.093  0.9889 
1 1 1 14  24  1  o 3  7.10417e+00 1.80142e+00 1.83727e+02 236.614 -4.39922e+00 -6.67534e+00 0.00000e+00 0.00000e+00 6.96453e+01 236.614 1.14082e+02 56.614  0.9352 
1 1 1 14  24  2  o 16 4.67746e+00 1.34492e+00 1.48335e+02 213.096 -4.50795e+00 -2.93825e+00 0.00000e+00 0.00000e+00 1.25589e+01 213.096 1.35777e+02 33.096  0.9015 
1 1 1 14  24  3  o 18 1.38264e+01 1.18102e+00 2.42039e+02 95.359  -2.77173e+00 2.95468e+01  0.00000e+00 0.00000e+00 2.76757e+02 95.359  3.47187e+01 95.359  0.9830 
1 1 1 14  24  4  o 17 1.59372e+01 1.15241e+00 3.13053e+02 333.121 4.20344e+01  -2.13060e+01 0.00000e+00 0.00000e+00 2.89004e+02 333.121 2.40487e+01 153.121 0.9893 
1 1 1 14  24  5  o 18 1.31398e+01 1.80188e+00 2.43216e+02 219.411 -1.86063e+01 -1.52893e+01 0.00000e+00 0.00000e+00 2.48127e+02 219.411 4.91128e+00 219.411 0.9790 
1 1 1 14  24  6  o 19 7.24878e+00 1.63226e+00 1.38984e+02 341.690 8.02417e+00  -2.65522e+00 0.00000e+00 0.00000e+00 1.21009e+02 341.690 1.79751e+01 161.690 0.9388 
1 1 1 14  24  7  o 18 1.89883e+01 1.23285e+00 3.18884e+02 225.305 -4.91050e+01 -4.96301e+01 0.00000e+00 0.00000e+00 4.01447e+02 225.305 8.25620e+01 225.305 0.9928 
1 1 1 14  24  8  o 10 7.97013e+00 1.83705e+00 1.99576e+02 95.228  -1.22558e+00 1.33937e+01  0.00000e+00 0.00000e+00 9.34457e+01 95.228  1.06130e+02 275.228 0.9621 
1 1 1 14  24  9  o 15 5.11117e+00 1.60021e+00 5.68622e+01 277.490 3.95726e-01  -3.00971e+00 0.00000e+00 0.00000e+00 1.01859e+02 277.490 4.49965e+01 277.490 0.8126 
1 1 1 14  24  10 o 8  4.69306e+00 1.53913e+00 1.52964e+02 40.737  6.06962e+00  5.22757e+00  0.00000e+00 0.00000e+00 1.47839e+01 40.737  1.38180e+02 220.737 0.9353 
1 1 1 14  25  0  o 12 1.38965e+01 1.42667e+00 2.78909e+02 49.844  1.78400e+01  2.11439e+01  0.00000e+00 0.00000e+00 2.41081e+02 49.844  3.78289e+01 229.844 0.9818 
1 1 1 14  25  1  o 6  4.67641e+00 1.46227e+00 2.68911e+01 308.584 5.75168e-01  -7.20902e-01 0.00000e+00 0.00000e+00 4.76799e+01 308.584 2.07888e+01 308.584 0.4182 
1 1 1 14  25  2  o 5  9.30738e+00 1.46269e+00 1.12485e+02 49.734  5.00766e+00  5.91202e+00  0.00000e+00 0.00000e+00 2.18836e+02 49.734  1.06350e+02 49.734  0.9330 
1 1 1 14  25  3  f 0  4.48802e+00 1.33770e+00 9.41378e+01 77.592  7.81891e-01  3.55392e+00  0.00000e+00 0.00000e+00 5.11316e+01 77.592  4.30062e+01 257.592 0.8480 
1 1 1 14  25  4  o 9  6.44072e+00 1.56746e+00 1.30554e+02 208.589 -5.54009e+00 -3.01915e+00 0.00000e+00 0.00000e+00 9.49301e+01 208.589 3.56241e+01 28.589  0.9169 
1 1 1 14  25  5  o 15 5.59949e+00 1.44127e+00 8.57802e+01 353.296 4.46037e+00  -5.24256e-01 0.00000e+00 0.00000e+00 1.02430e+02 353.296 1.66502e+01 353.296 0.8801 
1 1 1 14  25  6  o 10 3.41959e+00 1.16356e+00 1.60975e+02 139.103 -4.66756e+00 4.04275e+00  0.00000e+00 0.00000e+00 4.14469e+01 319.103 2.02422e+02 319.103 0.9150 
1 1 1 14  25  7  o 1  5.51211e+00 1.52860e+00 1.71495e+02 184.214 -9.20702e+00 -6.78315e-01 0.00000e+00 0.00000e+00 2.73540e+01 184.214 1.44141e+02 4.214   0.9442 
1 1 1 14  25  8  o 8  4.77140e+00 1.49226e+00 1.32455e+02 3.092   6.57598e+00  3.55264e-01  0.00000e+00 0.00000e+00 3.53902e+01 3.092   9.70650e+01 183.092 0.9206 
1 1 1 14  25  9  o 18 6.67981e+00 1.84961e+00 1.30511e+02 301.259 3.90089e+00  -6.42614e+00 0.00000e+00 0.00000e+00 1.07107e+02 301.259 2.34035e+01 121.259 0.9309 
1 1 1 14  25  10 o 19 5.03206e+00 1.62849e+00 1.00691e+02 99.635  -9.04348e-01 5.32701e+00  0.00000e+00 0.00000e+00 7.27465e+01 99.635  2.79449e+01 279.635 0.9020 
1 1 1 14  26  0  o 8  1.61325e+01 1.29432e+00 2.30830e+02 194.777 -2.82590e+01 -7.45431e+00 0.00000e+00 0.00000e+00 3.73390e+02 194.777 1.42560e+02 194.777 0.9827 
1 1 1 14  26  1  o 3  5.87373e+00 1.47166e+00 7.27279e+01 163.021 -3.01190e+00 9.19606e-01  0.00000e+00 0.00000e+00 1.11029e+02 163.021 3.83016e+01 163.021 0.8204 
1 1 1 14  26  2  f 0  1.27308e+01 1.20037e+00 1.84075e+02 153.955 -1.88240e+01 9.19924e+00  0.00000e+00 0.00000e+00 2.89867e+02 153.955 1.05793e+02 153.955 0.9758 
1 1 1 14  26  3  o 15 1.22274e+01 1.31807e+00 2.86605e+02 341.768 2.88846e+01  -9.51486e+00 0.00000e+00 0.00000e+00 1.72320e+02 341.768 1.14285e+02 161.768 0.9834 
1 1 1 14  26  4  o 4  1.20059e+01 1.34022e+00 2.40766e+02 237.481 -1.28601e+01 -2.01718e+01 0.00000e+00 0.00000e+00 2.07921e+02 237.481 3.28451e+01 57.481  0.9789 
1 1 1 14  26  5  o 6  1.15253e+01 1.40775e+00 2.76422e+02 81.145  4.65720e+00  2.98955e+01  0.00000e+00 0.00000e+00 1.56391e+02 81.145  1.20031e+02 261.145 0.9833 
1 1 1 14  26  6  o 17 3.99194e+00 1.28195e+00 6.37216e+01 73.620  7.56917e-01  2.57503e+00  0.00000e+00 0.00000e+00 5.57685e+01 73.620  7.95307e+00 253.620 0.7836 
1 1 1 14  26  7  o 11 1.01356e+01 1.66193e+00 1.62105e+02 146.097 -1.21590e+01 8.17143e+00  0.00000e+00 0.00000e+00 2.11667e+02 146.097 4.95624e+01 146.097 0.9652 
1 1 1 14  26  8  o 14 1.10608e+01 1.72156e+00 2.20563e+02 283.888 5.31719e+00  -2.15057e+01 0.00000e+00 0.00000e+00 1.92407e+02 283.888 2.81558e+01 103.888 0.9772 
1 1 1 14  26  9  o 5  6.81863e+00 1.79983e+00 1.49690e+02 175.389 -9.03758e+00 7.28946e-01  0.00000e+00 0.00000e+00 9.60374e+01 175.389 5.36523e+01 355.389 0.9431 
1 1 1 14  26  10 o 2  5.28823e+00 1.61900e+00 6.52470e+01 277.425 4.78180e-01  -3.66906e+00 0.00000e+00 0.00000e+00 1.06691e+02 277.425 4.14444e+01 277.425 0.8509 
1 1 1 14  27  0  o 7  7.33470e+00 1.73586e+00 1.14086e+02 358.866 5.46439e+00  -1.08200e-01 0.00000e+00 0.00000e+00 1.38362e+02 358.866 2.42756e+01 358.866 0.9032 
1 1 1 14  27  1  o 15 1.15821e+01 1.27467e+00 2.05956e+02 238.953 -9.80564e+00 -1.62888e+01 0.00000e+00 0.00000e+00 2.23882e+02 238.953 1.79259e+01 238.953 0.9733 
1 1 1 14  27  2  o 1  1.60409e+01 1.07949e+00 2.74207e+02 9.596   4.06236e+01  6.86810e+00  0.00000e+00 0.00000e+00 3.30234e+02 9.596   5.60277e+01 9.596   0.9878 
1 1 1 14  27  3  o 3  5.45487e+00 1.43300e+00 1.63765e+02 141.715 -5.63003e+00 4.44388e+00  0.00000e+00 0.00000e+00 2.92969e+01 141.715 1.34468e+02 321.715 0.9274 
1 1 1 14  27  4  o 14 1.10978e+01 1.32411e+00 1.68328e+02 159.548 -1.55479e+01 5.79843e+00  0.00000e+00 0.00000e+00 2.42371e+02 159.548 7.40435e+01 159.548 0.9694 
1 1 1 14  27  5  o 8  5.53739e+00 1.67777e+00 7.44883e+01 263.586 -3.79946e-01 -3.37966e+00 0.00000e+00 0.00000e+00 1.02239e+02 263.586 2.77504e+01 263.586 0.8358 
1 1 1 14  27  6  o 12 4.83794e+00 1.42658e+00 1.37485e+02 359.057 6.53179e+00  -1.07476e-01 0.00000e+00 0.00000e+00 3.25054e+01 359.057 1.04979e+02 179.057 0.9199 
1 1 1 14  27  7  o 12 4.16143e+00 1.36121e+00 9.05918e+01 0.930   3.92749e+00  6.37354e-02  0.00000e+00 0.00000e+00 4.62381e+01 0.930   4.43536e+01 180.930 0.8607 
1 1 1 14  27  8  o 13 4.52130e+00 1.46741e+00 7.55524e+01 37.092  2.88064e+00  2.17800e+00  0.00000e+00 0.00000e+00 7.07106e+01 37.092  4.84188e+00 217.092 0.8467 
1 1 1 14  27  9  o 10 5.03749e+00 1.59284e+00 8.25180e+01 176.993 -4.39857e+00 2.31092e-01  0.00000e+00 0.00000e+00 8.63689e+01 176.993 3.85094e+00 176.993 0.8775 
1 1 1 14  27  10 o 13 9.50412e+00 2.02965e+00 9.41799e+01 325.041 5.81714e+00  -4.06697e+00 0.00000e+00 0.00000e+00 2.42297e+02 325.041 1.48117e+02 325.041 0.9266 
1 1 1 14  28  0  o 9  7.22480e+00 1.75081e+00 1.48064e+02 301.633 3.67038e+00  -5.95838e+00 0.00000e+00 0.00000e+00 1.06735e+02 301.633 4.13288e+01 121.633 0.9255 
1 1 1 14  28  1  o 16 5.27190e+00 1.42674e+00 1.10697e+02 334.762 3.96329e+00  -1.86816e+00 0.00000e+00 0.00000e+00 6.55252e+01 334.762 4.51721e+01 154.762 0.8767 
1 1 1 14  28  2  o 7  4.78034e+00 1.38664e+00 4.78400e+01 176.335 -1.85788e+00 1.19016e-01  0.00000e+00 0.00000e+00 7.50038e+01 176.335 2.71638e+01 176.335 0.6737 
1 1 1 14  28  3  o 10 1.23396e+01 1.32063e+00 1.81850e+02 241.715 -8.95087e+00 -1.66337e+01 0.00000e+00 0.00000e+00 2.76388e+02 241.715 9.45375e+01 241.715 0.9732 
1 1 1 14  28  4  o 4  4.84564e+00 1.41623e+00 4.71293e+01 271.055 3.71205e-02  -2.01612e+00 0.00000e+00 0.00000e+00 8.24370e+01 271.055 3.53077e+01 271.055 0.7005 
1 1 1 14  28  5  o 13 5.71022e+00 1.66427e+00 1.05744e+02 313.284 3.31242e+00  -3.51698e+00 0.00000e+00 0.00000e+00 8.81630e+01 313.284 1.75812e+01 133.284 0.8893 
1 1 1 14  28  6  o 8  1.49179e+01 1.22971e+00 1.99665e+02 20.342  3.13087e+01  1.16075e+01  0.00000e+00 0.00000e+00 3.61496e+02 20.342  1.61831e+02 20.342  0.9849 
1 1 1 14  28  7  o 7  1.00081e+01 1.68586e+00 2.20144e+02 172.898 -1.90200e+01 2.36958e+00  0.00000e+00 0.00000e+00 1.52047e+02 172.898 6.80972e+01 352.898 0.9736 
1 1 1 14  28  8  o 6  1.06003e+01 1.78671e+00 1.73885e+02 127.601 -1.00601e+01 1.30627e+01  0.00000e+00 0.00000e+00 2.18604e+02 127.601 4.47195e+01 127.601 0.9692 
1 1 1 14  28  9  o 19 5.70423e+00 1.67467e+00 1.18242e+02 58.081  3.57731e+00  5.74294e+00  0.00000e+00 0.00000e+00 8.28693e+01 58.081  3.53725e+01 238.081 0.9228 
1 1 1 14  28  10 o 6  6.21106e+00 1.85929e+00 1.38849e+02 219.317 -6.16580e+00 -5.04977e+00 0.00000e+00 0.00000e+00 8.30124e+01 219.317 5.58369e+01 39.317  0.9350 
1 1 1 14  29  0  o 3  8.20039e+00 1.71559e+00 9.59172e+01 209.251 -4.56313e+00 -2.55556e+00 0.00000e+00 0.00000e+00 1.84813e+02 209.251 8.88955e+01 209.251 0.8985 
1 1 1 14  29  1  o 14 6.24958e+00 1.43965e+00 1.52859e+02 260.090 -1.32633e+00 -7.59183e+00 0.00000e+00 0.00000e+00 6.93520e+01 260.090 8.35066e+01 80.090  0.9327 
1 1 1 14  29  2  o 1  1.30204e+01 1.13235e+00 2.67200e+02 246.517 -1.25119e+01 -2.87985e+01 0.00000e+00 0.00000e+00 2.21441e+02 246.517 4.57589e+01 66.517  0.9839 
1 1 1 14  29  3  o 10 6.52739e+00 1.62685e+00 1.79537e+02 118.768 -4.30479e+00 7.84065e+00  0.00000e+00 0.00000e+00 5.51624e+01 118.768 1.24374e+02 298.768 0.9423 
1 1 1 14  29  4  o 1  5.52603e+00 1.50056e+00 1.64571e+02 46.697  5.28156e+00  5.60408e+00  0.00000e+00 0.00000e+00 3.21437e+01 46.697  1.32428e+02 226.697 0.9326 
1 1 1 14  29  5  o 2  1.10672e+01 1.68127e+00 1.71758e+02 163.556 -1.53330e+01 4.52562e+00  0.00000e+00 0.00000e+00 2.37365e+02 163.556 6.56067e+01 163.556 0.9682 
1 1 1 14  29  6  o 11 7.81940e+00 1.69439e+00 8.07693e+01 214.983 -4.49085e+00 -3.14256e+00 0.00000e+00 0.00000e+00 1.89025e+02 214.983 1.08256e+02 214.983 0.9035 
1 1 1 14  29  7  o 10 9.27260e+00 1.66235e+00 1.26843e+02 65.885  4.58569e+00  1.02442e+01  0.00000e+00 0.00000e+00 2.11170e+02 65.885  8.43276e+01 65.885  0.9544 
1 1 1 14  29  8  o 2  9.20398e+00 1.79873e+00 1.51293e+02 269.035 -2.08128e-01 -1.23546e+01 0.00000e+00 0.00000e+00 1.85761e+02 269.035 3.44686e+01 269.035 0.9586 
1 1 1 14  29  9  o 18 6.09029e+00 1.75426e+00 1.06671e+02 26.057  5.55927e+00  2.71832e+00  0.00000e+00 0.00000e+00 1.06259e+02 26.057  4.12753e-01 206.057 0.9152 
1 1 1 14  29  10 o 2  5.85253e+00 1.78340e+00 7.92692e+01 287.445 1.35022e+00  -4.29676e+00 0.00000e+00 0.00000e+00 1.17577e+02 287.445 3.83075e+01 287.445 0.8804 
1 1 1 14  30  0  o 8  1.41485e+01 1.50198e+00 2.69772e+02 283.945 6.68907e+00  -2.69393e+01 0.00000e+00 0.00000e+00 2.59479e+02 283.945 1.02928e+01 103.945 0.9818 
1 1 1 14  30  1  o 17 6.01812e+00 1.44657e+00 1.37587e+02 270.829 9.61855e-02  -6.64885e+00 0.00000e+00 0.00000e+00 7.37915e+01 270.829 6.37957e+01 90.829  0.9214 
1 1 1 14  30  2  o 7  8.54639e+00 1.39320e+00 1.43704e+02 77.557  2.22077e+00  1.00644e+01  0.00000e+00 0.00000e+00 1.65998e+02 77.557  2.22939e+01 77.557  0.9502 
1 1 1 14  30  3  o 3  7.66958e+00 1.63842e+00 1.53221e+02 42.650  6.28082e+00  5.78571e+00  0.00000e+00 0.00000e+00 1.21693e+02 42.650  3.15278e+01 222.650 0.9395 
1 1 1 14  30  4  o 9  4.58313e+00 1.28645e+00 1.59717e+02 167.372 -6.98291e+00 1.56447e+00  0.00000e+00 0.00000e+00 2.47907e+00 167.372 1.57238e+02 347.372 0.9272 
1 1 1 14  30  5  o 19 6.46602e+00 1.76292e+00 8.45313e+01 301.300 2.28301e+00  -3.75488e+00 0.00000e+00 0.00000e+00 1.32001e+02 301.300 4.74701e+01 301.300 0.8771 
1 1 1 14  30  6  o 1  1.25107e+01 1.36425e+00 1.94966e+02 0.628   2.44632e+01  2.67992e-01  0.00000e+00 0.00000e+00 2.72910e+02 0.628   7.79443e+01 0.628   0.9793 
1 1 1 14  30  7  o 9  1.04875e+01 1.73605e+00 1.27242e+02 157.975 -1.11301e+01 4.50245e+00  0.00000e+00 0.00000e+00 2.56249e+02 157.975 1.29007e+02 157.975 0.9574 
1 1 1 14  30  8  o 7  4.73315e+00 1.48199e+00 8.81318e+01 95.402  -4.03522e-01 4.26694e+00  0.00000e+00 0.00000e+00 6.98246e+01 95.402  1.83072e+01 275.402 0.8737 
1 1 1 14  30  9  o 11 1.25105e+01 1.82431e+00 1.80176e+02 290.386 7.23827e+00  -1.94776e+01 0.00000e+00 0.00000e+00 2.86069e+02 290.386 1.05893e+02 290.386 0.9756 
1 1 1 14  30  10 o 13 7.94484e+00 1.98050e+00 5.82726e+01 132.447 -2.64802e+00 2.89522e+00  0.00000e+00 0.00000e+00 2.02877e+02 132.447 1.44605e+02 132.447 0.8605 
1 1 1 14  31  0  o 8  1.35404e+01 1.37313e+00 2.45559e+02 318.428 2.06420e+01  -1.83088e+01 0.00000e+00 0.00000e+00 2.60846e+02 318.428 1.52869e+01 318.428 0.9817 
1 1 1 14  31  1  o 17 7.00379e+00 1.29667e+00 1.86590e+02 130.496 -7.17152e+00 8.39795e+00  0.00000e+00 0.00000e+00 6.79822e+01 130.496 1.18608e+02 310.496 0.9536 
1 1 1 14  31  2  o 7  6.69392e+00 1.42927e+00 2.14860e+02 248.830 -4.17500e+00 -1.07806e+01 0.00000e+00 0.00000e+00 2.91084e+01 248.830 1.85752e+02 68.830  0.9557 
1 1 1 14  31  3  o 15 9.24550e+00 1.48004e+00 1.32101e+02 187.261 -9.43580e+00 -1.20227e+00 0.00000e+00 0.00000e+00 2.01530e+02 187.261 6.94293e+01 187.261 0.9459 
1 1 1 14  31  4  o 2  3.70664e+00 1.19782e+00 4.79423e+01 229.295 -1.22389e+00 -1.42267e+00 0.00000e+00 0.00000e+00 4.77474e+01 229.295 1.94885e-01 49.295  0.6764 
1 1 1 14  31  5  o 9  8.04753e+00 1.57909e+00 9.80583e+01 97.970  -9.44050e-01 6.74293e+00  0.00000e+00 0.00000e+00 1.85602e+02 97.970  8.75438e+01 97.970  0.9233 
1 1 1 14  31  6  o 11 4.94396e+00 1.48002e+00 1.41257e+02 328.925 5.78211e+00  -3.48456e+00 0.00000e+00 0.00000e+00 3.29180e+01 328.925 1.08339e+02 148.925 0.9226 
1 1 1 14  31  7  o 6  5.56077e+00 1.61434e+00 1.16730e+02 107.049 -1.83998e+00 5.99987e+00  0.00000e+00 0.00000e+00 7.78910e+01 107.049 3.88388e+01 287.049 0.9164 
1 1 1 14  31  8  o 12 4.45991e+00 1.40860e+00 1.17095e+02 141.527 -4.76228e+00 3.78446e+00  0.00000e+00 0.00000e+00 3.85347e+01 141.527 7.85601e+01 321.527 0.9136 
1 1 1 14  31  9  o 4  4.14927e+00 1.38922e+00 9.00287e+01 258.069 -9.07594e-01 -4.29546e+00 0.00000e+00 0.00000e+00 4.89651e+01 258.069 4.10636e+01 78.069  0.8770 
1 1 1 14  31  10 o 18 4.17829e+00 1.43244e+00 6.18087e+01 247.899 -1.22538e+00 -3.01762e+00 0.00000e+00 0.00000e+00 7.02239e+01 247.899 8.41516e+00 247.899 0.8273 
1 1 1 14  32  0  o 19 4.23254e+00 1.37321e+00 8.64951e+01 210.653 -2.57785e+00 -1.52776e+00 0.00000e+00 0.00000e+00 4.40585e+01 210.653 4.24366e+01 30.653  0.8097 
1 1 1 14  32  1  o 2  5.70594e+00 1.44530e+00 3.75454e+01 173.131 -1.74437e+00 2.10142e-01  0.00000e+00 0.00000e+00 1.04584e+02 173.131 6.70388e+01 173.131 0.6535 
1 1 1 14  32  2  o 19 1.25895e+01 1.14040e+00 2.23570e+02 252.853 -7.88217e+00 -2.55474e+01 0.00000e+00 0.00000e+00 2.47421e+02 252.853 2.38510e+01 252.853 0.9811 
1 1 1 14  32  3  o 17 5.02928e+00 1.44014e+00 1.08605e+02 29.327  4.00991e+00  2.25272e+00  0.00000e+00 0.00000e+00 6.08364e+01 29.327  4.77682e+01 209.327 0.8832 
1 1 1 14  32  4  o 7  1.30969e+01 1.25753e+00 1.65678e+02 150.251 -1.92862e+01 1.10225e+01  0.00000e+00 0.00000e+00 3.22726e+02 150.251 1.57048e+02 150.251 0.9772 
1 1 1 14  32  5  o 16 7.38553e+00 1.57596e+00 1.61444e+02 332.791 9.57781e+00  -4.92428e+00 0.00000e+00 0.00000e+00 1.07048e+02 332.791 5.43969e+01 152.791 0.9524 
1 1 1 14  32  6  o 14 4.78522e+00 1.46665e+00 2.60996e+01 77.295  2.78112e-01  1.23357e+00  0.00000e+00 0.00000e+00 7.11551e+01 77.295  4.50556e+01 77.295  0.5323 
1 1 1 14  32  7  o 17 8.75441e+00 1.87174e+00 2.03023e+02 43.478  1.07320e+01  1.01765e+01  0.00000e+00 0.00000e+00 1.19772e+02 43.478  8.32505e+01 223.478 0.9656 
1 1 1 14  32  8  o 16 5.18400e+00 1.57145e+00 6.76324e+01 126.980 -2.21537e+00 2.94206e+00  0.00000e+00 0.00000e+00 1.00674e+02 126.980 3.30419e+01 126.980 0.8501 
1 1 1 14  32  9  o 15 9.38509e+00 1.97891e+00 1.26026e+02 182.017 -1.00017e+01 -3.52181e-01 0.00000e+00 0.00000e+00 2.14005e+02 182.017 8.79789e+01 182.017 0.9486 
1 1 1 14  32  10 o 14 4.23643e+00 1.43828e+00 9.04876e+01 154.742 -4.35061e+00 2.05259e+00  0.00000e+00 0.00000e+00 5.33171e+01 154.742 3.71705e+01 334.742 0.8888 
1 1 1 14  33  0  o 9  4.35342e+00 1.36007e+00 1.15766e+02 10.886  4.06700e+00  7.82167e-01  0.00000e+00 0.00000e+00 2.82914e+01 10.886  8.74743e+01 190.886 0.8688 
1 1 1 14  33  1  o 12 1.25369e+01 1.26318e+00 1.71758e+02 295.414 7.97761e+00  -1.67899e+01 0.00000e+00 0.00000e+00 2.92992e+02 295.414 1.21234e+02 295.414 0.9727 
1 1 1 14  33  2  o 13 1.63492e+01 1.00651e+00 3.30766e+02 167.164 -5.27420e+01 1.20175e+01  0.00000e+00 0.00000e+00 2.86809e+02 167.164 4.39566e+01 347.164 0.9907 
1 1 1 14  33  3  o 19 1.00537e+01 1.38136e+00 1.03061e+02 173.421 -9.23358e+00 1.06498e+00  0.00000e+00 0.00000e+00 2.59170e+02 173.421 1.56109e+02 173.421 0.9446 
1 1 1 14  33  4  f 0  7.22986e+00 1.64577e+00 7.64190e+01 23.518  4.24717e+00  1.84828e+00  0.00000e+00 0.00000e+00 1.67474e+02 23.518  9.10553e+01 23.518  0.8841 
1 1 1 14  33  5  o 10 3.82970e+00 1.26484e+00 6.57623e+01 230.109 -1.71877e+00 -2.05628e+00 0.00000e+00 0.00000e+00 4.87258e+01 230.109 1.70364e+01 50.109  0.7832 
1 1 1 14  33  6  o 1  8.00554e+00 1.50313e+00 1.66552e+02 66.878  5.18836e+00  1.21508e+01  0.00000e+00 0.00000e+00 1.27272e+02 66.878  3.92798e+01 246.878 0.9614 
1 1 1 14  33  7  f 0  5.11677e+00 1.57792e+00 5.48597e+01 251.524 -8.77882e-01 -2.62738e+00 0.00000e+00 0.00000e+00 9.97693e+01 251.524 4.49096e+01 251.524 0.7914 
1 1 1 14  33  8  o 19 5.80490e+00 1.58191e+00 2.01819e+02 242.805 -5.31663e+00 -1.03473e+01 0.00000e+00 0.00000e+00 1.01024e+01 242.805 1.91717e+02 62.805  0.9560 
1 1 1 14  33  9  o 13 6.96178e+00 1.87054e+00 1.16757e+02 72.902  2.16646e+00  7.04316e+00  0.00000e+00 0.00000e+00 1.30347e+02 72.902  1.35901e+01 72.902  0.9294 
1 1 1 14  33  10 o 14 4.44647e+00 1.49836e+00 4.37702e+01 145.815 -1.82879e+00 1.24212e+00  0.00000e+00 0.00000e+00 8.01047e+01 145.815 3.63345e+01 145.815 0.7295 
1 1 1 14  34  0  o 18 7.68496e+00 1.46767e+00 1.09260e+02 322.448 5.39901e+00  -4.15067e+00 0.00000e+00 0.00000e+00 1.60997e+02 322.448 5.17371e+01 322.448 0.9233 
1 1 1 14  34  1  f 0  1.15354e+01 1.30084e+00 2.32659e+02 178.390 -2.27608e+01 6.39651e-01  0.00000e+00 0.00000e+00 1.97152e+02 178.390 3.55074e+01 358.390 0.9778 
1 1 1 14  34  2  o 17 5.34648e+00 1.40480e+00 4.91393e+01 232.585 -1.28516e+00 -1.68003e+00 0.00000e+00 0.00000e+00 9.67674e+01 232.585 4.76280e+01 232.585 0.7158 
1 1 1 14  34  3  o 19 4.51800e+00 1.33250e+00 7.69041e+01 121.044 -1.71345e+00 2.84674e+00  0.00000e+00 0.00000e+00 6.63395e+01 121.044 1.05645e+01 301.044 0.8313 
1 1 1 14  34  4  o 11 1.28778e+01 1.29307e+00 2.20460e+02 30.871  2.34075e+01  1.39933e+01  0.00000e+00 0.00000e+00 2.61782e+02 30.871  4.13220e+01 30.871  0.9815 
1 1 1 14  34  5  o 18 9.77693e+00 1.44547e+00 1.73346e+02 320.526 1.27143e+01  -1.04713e+01 0.00000e+00 0.00000e+00 1.88278e+02 320.526 1.49322e+01 320.526 0.9692 
1 1 1 14  34  6  o 7  1.07561e+01 1.52602e+00 1.92283e+02 305.182 1.14695e+01  -1.62697e+01 0.00000e+00 0.00000e+00 2.07864e+02 305.182 1.55814e+01 305.182 0.9745 
1 1 1 14  34  7  o 13 7.56082e+00 1.97549e+00 1.60483e+02 175.274 -9.45062e+00 7.81357e-01  0.00000e+00 0.00000e+00 1.12514e+02 175.274 4.79693e+01 355.274 0.9457 
1 1 1 14  34  8  o 8  4.17253e+00 1.36105e+00 6.69937e+01 305.768 1.98793e+00  -2.75960e+00 0.00000e+00 0.00000e+00 6.61633e+01 305.768 8.30328e-01 125.768 0.8358 
1 1 1 14  34  9  o 15 4.87096e+00 1.54993e+00 1.50167e+02 337.955 7.80413e+00  -3.16027e+00 0.00000e+00 0.00000e+00 2.44113e+01 337.955 1.25756e+02 157.955 0.9386 
1 1 1 14  34  10 o 8  9.02953e+00 2.08148e+00 1.94868e+02 169.449 -1.38786e+01 2.58490e+00  0.00000e+00 0.00000e+00 1.37479e+02 169.449 5.73882e+01 349.449 0.9639 
1 1 1 14  35  0  o 4  1.26604e+01 1.10715e+00 2.24291e+02 248.080 -9.72935e+00 -2.41785e+01 0.00000e+00 0.00000e+00 2.48509e+02 248.080 2.42181e+01 248.080 0.9806 
1 1 1 14  35  1  o 8  4.19064e+00 1.28544e+00 6.99528e+01 251.735 -8.19308e-01 -2.48251e+00 0.00000e+00 0.00000e+00 5.40947e+01 251.735 1.58580e+01 71.735  0.7769 
1 1 1 14  35  2  o 12 9.80996e+00 1.33915e+00 1.73287e+02 160.128 -1.41000e+01 5.09629e+00  0.00000e+00 0.00000e+00 1.87984e+02 160.128 1.46965e+01 160.128 0.9661 
1 1 1 14  35  3  o 7  6.47751e+00 1.44412e+00 1.11459e+02 14.716  6.52054e+00  1.71257e+00  0.00000e+00 0.00000e+00 1.16434e+02 14.716  4.97532e+00 14.716  0.9225 
1 1 1 14  35  4  o 8  1.02279e+01 1.48504e+00 2.28648e+02 271.704 6.49231e-01  -2.18203e+01 0.00000e+00 0.00000e+00 1.52502e+02 271.704 7.61455e+01 91.704  0.9768 
1 1 1 14  35  5  o 19 4.64573e+00 1.30808e+00 3.14656e+01 271.943 5.32471e-02  -1.56987e+00 0.00000e+00 0.00000e+00 7.72369e+01 271.943 4.57714e+01 271.943 0.6131 
1 1 1 14  35  6  o 1  9.06062e+00 1.55234e+00 2.13463e+02 14.285  1.75735e+01  4.47464e+00  0.00000e+00 0.00000e+00 1.22705e+02 14.285  9.07578e+01 194.285 0.9720 
1 1 1 14  35  7  o 3  6.76929e+00 1.72334e+00 8.42939e+01 104.135 -1.26559e+00 5.02550e+00  0.00000e+00 0.00000e+00 1.47630e+02 104.135 6.33363e+01 104.135 0.8974 
1 1 1 14  35  8  o 8  4.83437e+00 1.53511e+00 7.78453e+01 207.836 -3.47984e+00 -1.83752e+00 0.00000e+00 0.00000e+00 8.10731e+01 207.836 3.22781e+00 207.836 0.8610 
1 1 1 14  35  9  o 6  4.95376e+00 1.56973e+00 3.03064e+01 141.891 -1.29227e+00 1.01359e+00  0.00000e+00 0.00000e+00 8.87419e+01 141.891 5.84356e+01 141.891 0.6294 
1 1 1 14  35  10 o 13 5.97974e+00 1.82639e+00 6.84631e+01 22.661  3.61191e+00  1.50804e+00  0.00000e+00 0.00000e+00 1.27919e+02 22.661  5.94557e+01 22.661  0.8601 
1 1 1 14  36  0  o 10 5.11714e+00 1.36587e+00 1.35928e+02 103.221 -1.36935e+00 5.82881e+00  0.00000e+00 0.00000e+00 4.18126e+01 103.221 9.41151e+01 283.221 0.9122 
1 1 1 14  36  1  o 7  4.35120e+00 1.33549e+00 1.71676e+02 150.653 -5.40067e+00 3.03656e+00  0.00000e+00 0.00000e+00 1.99398e+01 330.653 1.91616e+02 330.653 0.9153 
1 1 1 14  36  2  o 11 5.00369e+00 1.42511e+00 7.40664e+01 275.514 3.12878e-01  -3.24130e+00 0.00000e+00 0.00000e+00 8.37198e+01 275.514 9.65340e+00 275.514 0.8273 
1 1 1 14  36  3  o 19 3.77545e+00 1.21600e+00 4.63744e+01 262.773 -2.30252e-01 -1.81581e+00 0.00000e+00 0.00000e+00 4.97758e+01 262.773 3.40136e+00 262.773 0.6679 
1 1 1 14  36  4  o 2  1.07096e+01 1.40086e+00 1.73839e+02 325.563 1.45184e+01  -9.95463e+00 0.00000e+00 0.00000e+00 2.22916e+02 325.563 4.90778e+01 325.563 0.9712 
1 1 1 14  36  5  o 15 7.20907e+00 1.44344e+00 1.40071e+02 286.793 2.80689e+00  -9.30107e+00 0.00000e+00 0.00000e+00 1.20442e+02 286.793 1.96293e+01 106.793 0.9470 
1 1 1 14  36  6  o 4  9.28042e+00 1.57655e+00 1.97426e+02 86.118  1.24687e+00  1.83769e+01  0.00000e+00 0.00000e+00 1.47019e+02 86.118  5.04066e+01 266.118 0.9725 
1 1 1 14  36  7  o 9  5.78869e+00 1.58613e+00 8.02745e+01 48.797  3.01347e+00  3.44189e+00  0.00000e+00 0.00000e+00 1.14727e+02 48.797  3.44530e+01 48.797  0.8825 
1 1 1 14  36  8  o 4  5.38152e+00 1.58256e+00 3.13938e+01 32.347  1.52313e+00  9.64634e-01  0.00000e+00 0.00000e+00 1.04736e+02 32.347  7.33424e+01 32.347  0.6626 
1 1 1 14  36  9  o 14 6.93855e+00 1.85751e+00 1.85552e+02 202.301 -1.09264e+01 -4.48149e+00 0.00000e+00 0.00000e+00 6.78740e+01 202.301 1.17678e+02 22.301  0.9567 
1 1 1 14  37  0  o 14 4.01537e+00 1.22236e+00 9.47896e+01 215.982 -2.67772e+00 -1.94419e+00 0.00000e+00 0.00000e+00 3.21781e+01 215.982 6.26115e+01 35.982  0.8305 
1 1 1 14  37  1  o 8  7.67993e+00 1.37918e+00 9.32606e+01 52.623  3.76597e+00  4.92978e+00  0.00000e+00 0.00000e+00 1.74563e+02 52.623  8.13020e+01 52.623  0.9154 
1 1 1 14  37  2  o 19 1.27737e+01 1.20938e+00 2.21746e+02 291.576 1.05619e+01  -2.67086e+01 0.00000e+00 0.00000e+00 2.56552e+02 291.576 3.48053e+01 291.576 0.9824 
1 1 1 14  37  3  o 16 1.06501e+01 1.31625e+00 2.18900e+02 24.258  2.11111e+01  9.51328e+00  0.00000e+00 0.00000e+00 1.78312e+02 24.258  4.05878e+01 204.258 0.9782 
1 1 1 14  37  4  o 2  8.82434e+00 1.47976e+00 1.41477e+02 185.800 -1.18159e+01 -1.20031e+00 0.00000e+00 0.00000e+00 1.80609e+02 185.800 3.91314e+01 185.800 0.9569 
1 1 1 14  37  5  o 12 1.10518e+01 1.37243e+00 2.07413e+02 114.673 -9.80374e+00 2.13413e+01  0.00000e+00 0.00000e+00 2.05175e+02 114.673 2.23786e+00 294.673 0.9785 
1 1 1 14  37  6  o 4  4.98436e+00 1.47682e+00 1.20504e+02 285.556 1.69124e+00  -6.07523e+00 0.00000e+00 0.00000e+00 5.38980e+01 285.556 6.66060e+01 105.556 0.9169 
1 1 1 14  37  7  o 17 6.09379e+00 1.60328e+00 1.51095e+02 294.120 3.76317e+00  -8.40494e+00 0.00000e+00 0.00000e+00 6.84800e+01 294.120 8.26149e+01 114.120 0.9440 
1 1 1 14  37  8  o 18 7.64078e+00 1.75936e+00 1.87182e+02 153.460 -1.21617e+01 6.07430e+00  0.00000e+00 0.00000e+00 9.35463e+01 153.460 9.36357e+01 333.460 0.9625 
1 1 1 14  37  9  o 1  4.34406e+00 1.45709e+00 7.53130e+01 355.754 3.71038e+00  -2.75499e-01 0.00000e+00 0.00000e+00 6.59505e+01 355.754 9.36252e+00 175.754 0.8518 
1 1 1 14  38  0  o 14 7.57613e+00 1.38924e+00 1.48541e+02 158.185 -9.00950e+00 3.60619e+00  0.00000e+00 0.00000e+00 1.24601e+02 158.185 2.39397e+01 338.185 0.9470 
1 1 1 14  38  1  o 13 8.95883e+00 1.29659e+00 9.77475e+01 108.758 -2.62808e+00 7.73864e+00  0.00000e+00 0.00000e+00 2.21893e+02 108.758 1.24146e+02 108.758 0.9367 
1 1 1 14  38  2  o 6  8.04417e+00 1.43795e+00 1.83844e+02 24.788  1.25749e+01  5.80713e+00  0.00000e+00 0.00000e+00 1.11433e+02 24.788  7.24109e+01 204.788 0.9632 
1 1 1 14  38  3  o 4  5.42023e+00 1.43236e+00 8.58114e+01 87.254  2.00034e-01  4.17119e+00  0.00000e+00 0.00000e+00 9.39647e+01 87.254  8.15329e+00 87.254  0.8700 
1 1 1 14  38  4  o 19 1.24511e+01 1.21920e+00 2.11746e+02 278.878 4.45478e+00  -2.85200e+01 0.00000e+00 0.00000e+00 2.54823e+02 278.878 4.30767e+01 278.878 0.9825 
1 1 1 14  38  5  o 9  8.11201e+00 1.52860e+00 1.75257e+02 144.111 -1.12556e+01 8.14435e+00  0.00000e+00 0.00000e+00 1.22859e+02 144.111 5.23974e+01 324.111 0.9633 
1 1 1 14  38  6  o 17 8.15903e+00 1.61809e+00 2.20279e+02 292.282 6.57287e+00  -1.60406e+01 0.00000e+00 0.00000e+00 8.19385e+01 292.282 1.38341e+02 112.282 0.9707 
1 1 1 14  38  7  o 2  1.38220e+01 1.41048e+00 2.25253e+02 77.788  7.05125e+00  3.25798e+01  0.00000e+00 0.00000e+00 2.94288e+02 77.788  6.90344e+01 77.788  0.9849 
1 1 1 14  38  8  o 13 9.83544e+00 1.76612e+00 1.57973e+02 205.552 -1.32528e+01 -6.33616e+00 0.00000e+00 0.00000e+00 2.04422e+02 205.552 4.64481e+01 205.552 0.9653 
1 1 1 14  38  9  f 0  3.71248e+00 1.28283e+00 7.56387e+01 15.224  3.68082e+00  1.00170e+00  0.00000e+00 0.00000e+00 4.56625e+01 15.224  2.99762e+01 195.224 0.8560 
1 1 1 14  39  0  o 14 6.41212e+00 1.40346e+00 1.49083e+02 174.110 -8.44273e+00 8.70934e-01  0.00000e+00 0.00000e+00 8.01437e+01 174.110 6.89390e+01 354.110 0.9391 
1 1 1 14  39  1  o 14 4.40389e+00 1.26603e+00 1.45759e+02 61.055  3.06637e+00  5.54444e+00  0.00000e+00 0.00000e+00 8.09992e+00 61.055  1.37659e+02 241.055 0.9173 
1 1 1 14  39  2  o 13 1.90683e+01 9.67375e-01 3.67131e+02 258.556 -1.62731e+01 -8.03904e+01 0.00000e+00 0.00000e+00 3.55034e+02 258.556 1.20968e+01 78.557  0.9939 
1 1 1 14  39  3  o 5  1.47161e+01 1.10211e+00 2.31579e+02 258.916 -7.42117e+00 -3.78820e+01 0.00000e+00 0.00000e+00 3.22103e+02 258.916 9.05241e+01 258.916 0.9870 
1 1 1 14  39  4  o 5  4.76189e+00 1.39473e+00 9.16133e+01 16.352  4.17820e+00  1.22588e+00  0.00000e+00 0.00000e+00 6.74417e+01 16.352  2.41716e+01 196.352 0.8759 
1 1 1 14  39  5  o 7  3.96818e+00 1.26032e+00 9.89099e+00 145.381 -3.59982e-01 2.48507e-01  0.00000e+00 0.00000e+00 2.24481e+01 145.381 1.25571e+01 145.381 0.2136 
1 1 1 14  39  6  o 3  6.93059e+00 1.67547e+00 1.63005e+02 170.904 -1.04336e+01 1.67052e+00  0.00000e+00 0.00000e+00 8.85856e+01 170.904 7.44191e+01 350.904 0.9514 
1 1 1 14  39  7  o 10 4.31648e+00 1.36455e+00 6.62038e+01 256.768 -7.82819e-01 -3.32917e+00 0.00000e+00 0.00000e+00 7.16358e+01 256.768 5.43196e+00 256.768 0.8368 
1 1 1 14  39  8  o 8  4.74032e+00 1.50620e+00 5.46586e+01 160.102 -2.76012e+00 9.99059e-01  0.00000e+00 0.00000e+00 9.09932e+01 160.102 3.63346e+01 160.102 0.8051 
1 1 1 14  39  9  o 5  4.25882e+00 1.43476e+00 1.15074e+02 79.945  1.04865e+00  5.91377e+00  0.00000e+00 0.00000e+00 3.32401e+01 79.945  8.18339e+01 259.944 0.9125 
1 1 1 14  40  0  o 6  4.31025e+00 1.26428e+00 5.45219e+01 359.280 2.22169e+00  -2.79055e-02 0.00000e+00 0.00000e+00 6.54142e+01 359.280 1.08923e+01 359.280 0.7310 
1 1 1 14  40  1  o 8  7.66729e+00 1.35744e+00 9.86981e+01 309.585 4.70438e+00  -5.68973e+00 0.00000e+00 0.00000e+00 1.72735e+02 309.585 7.40365e+01 309.585 0.9296 
1 1 1 14  40  2  f 0  5.55044e+00 1.44326e+00 5.45333e+01 315.722 2.01784e+00  -1.96758e+00 0.00000e+00 0.00000e+00 1.13721e+02 315.722 5.91875e+01 315.722 0.7956 
1 1 1 14  40  3  o 10 6.36712e+00 1.45023e+00 1.86955e+02 28.616  9.63036e+00  5.25403e+00  0.00000e+00 0.00000e+00 4.44007e+01 28.616  1.42555e+02 208.615 0.9533 
1 1 1 14  40  4  f 0  5.72772e+00 1.41828e+00 1.15411e+02 280.458 1.21385e+00  -6.57622e+00 0.00000e+00 0.00000e+00 8.59256e+01 280.458 2.94850e+01 100.458 0.9219 
1 1 1 14  40  5  o 11 1.20354e+01 1.29155e+00 2.54655e+02 183.159 -3.34972e+01 -1.84880e+00 0.00000e+00 0.00000e+00 1.97501e+02 183.159 5.71539e+01 3.159   0.9850 
1 1 1 14  40  6  o 9  4.49801e+00 1.39230e+00 6.89368e+01 165.507 -3.30380e+00 8.53994e-01  0.00000e+00 0.00000e+00 7.45885e+01 165.507 5.65173e+00 165.507 0.8364 
1 1 1 14  40  7  o 2  5.02798e+00 1.51308e+00 5.88609e+01 53.592  1.81840e+00  2.46570e+00  0.00000e+00 0.00000e+00 9.74179e+01 53.592  3.85569e+01 53.592  0.8146 
1 1 1 14  40  8  o 16 5.23136e+00 1.59834e+00 3.04337e+01 34.211  1.35623e+00  9.22074e-01  0.00000e+00 0.00000e+00 9.51118e+01 34.211  6.46781e+01 34.211  0.6289 
1 1 1 14  40  9  o 15 4.78814e+00 1.52339e+00 8.80016e+01 210.369 -4.15728e+00 -2.43606e+00 0.00000e+00 0.00000e+00 7.44418e+01 210.369 1.35598e+01 30.369  0.8890 
1 1 1 14  41  0  o 7  1.91703e+01 8.95727e-01 2.87450e+02 300.551 3.24841e+01  -5.50360e+01 0.00000e+00 0.00000e+00 4.36420e+02 300.551 1.48970e+02 300.551 0.9921 
1 1 1 14  41  1  f 0  4.23420e+00 1.26331e+00 6.14946e+01 19.519  2.50341e+00  8.87450e-01  0.00000e+00 0.00000e+00 6.44229e+01 19.519  2.92830e+00 19.519  0.7810 
1 1 1 14  41  2  o 15 4.98337e+00 1.29555e+00 1.10614e+02 111.892 -1.97000e+00 4.90262e+00  0.00000e+00 0.00000e+00 6.01719e+01 111.892 5.04418e+01 291.892 0.8996 
1 1 1 14  41  3  o 19 3.41620e+00 1.12316e+00 9.60045e+01 100.266 -6.68040e-01 3.68825e+00  0.00000e+00 0.00000e+00 1.50692e+01 100.266 8.09352e+01 280.266 0.8531 
1 1 1 14  41  4  o 17 1.15109e+01 1.26890e+00 1.95548e+02 262.478 -3.10137e+00 -2.34888e+01 0.00000e+00 0.00000e+00 2.33956e+02 262.478 3.84077e+01 262.478 0.9787 
1 1 1 14  41  5  o 7  1.14903e+01 1.41974e+00 1.87162e+02 190.906 -2.12837e+01 -4.10074e+00 0.00000e+00 0.00000e+00 2.40816e+02 190.906 5.36534e+01 190.906 0.9767 
1 1 1 14  41  6  o 11 3.82266e+00 1.24439e+00 1.12550e+02 291.912 1.93179e+00  -4.80247e+00 0.00000e+00 0.00000e+00 1.82965e+01 291.912 9.42535e+01 111.912 0.8973 
1 1 1 14  41  7  o 15 1.10141e+01 1.57620e+00 2.95342e+02 104.401 -8.58497e+00 3.34335e+01  0.00000e+00 0.00000e+00 1.18740e+02 104.401 1.76602e+02 284.401 0.9854 
1 1 1 14  41  8  f 0  5.95743e+00 1.64524e+00 7.53889e+01 274.372 3.59808e-01  -4.70582e+00 0.00000e+00 0.00000e+00 1.26113e+02 274.372 5.07238e+01 274.372 0.8864 
1 1 1 14  41  9  o 5  4.63581e+00 1.51352e+00 3.80278e+01 331.342 1.84340e+00  -1.00747e+00 0.00000e+00 0.00000e+00 8.82113e+01 331.342 5.01835e+01 331.342 0.7136 
1 1 1 14  42  0  o 12 8.98585e+00 1.21400e+00 1.23866e+02 353.258 1.15573e+01  -1.36622e+00 0.00000e+00 0.00000e+00 2.03048e+02 353.258 7.91830e+01 353.258 0.9560 
1 1 1 14  42  1  o 8  7.98544e+00 1.38436e+00 1.02130e+02 139.557 -5.70806e+00 4.86525e+00  0.00000e+00 0.00000e+00 1.80853e+02 139.557 7.87233e+01 139.557 0.9307 
1 1 1 14  42  2  o 13 3.53715e+00 1.13956e+00 9.85434e+01 200.440 -3.63081e+00 -1.35320e+00 0.00000e+00 0.00000e+00 1.71350e+01 200.440 8.14083e+01 20.440  0.8585 
1 1 1 14  42  3  o 2  1.54878e+01 1.05769e+00 2.63670e+02 1.030   4.83753e+01  8.69943e-01  0.00000e+00 0.00000e+00 3.20418e+02 1.030   5.67479e+01 1.030   0.9896 
1 1 1 14  42  4  o 8  9.06079e+00 1.46664e+00 1.55908e+02 190.906 -1.34923e+01 -2.59969e+00 0.00000e+00 0.00000e+00 1.76690e+02 190.906 2.07821e+01 190.906 0.9629 
1 1 1 14  42  5  o 16 5.86440e+00 1.55878e+00 1.58221e+02 86.844  5.18844e-01  9.40932e+00  0.00000e+00 0.00000e+00 5.31851e+01 86.844  1.05036e+02 266.844 0.9454 
1 1 1 14  42  6  o 14 6.22781e+00 1.76686e+00 1.13327e+02 180.844 -6.23818e+00 -9.18605e-02 0.00000e+00 0.00000e+00 1.04239e+02 180.844 9.08801e+00 0.844   0.9159 
1 1 1 14  42  7  o 9  5.95389e+00 1.60807e+00 1.08494e+02 349.385 6.34824e+00  -1.18972e+00 0.00000e+00 0.00000e+00 1.00225e+02 349.385 8.26943e+00 169.385 0.9189 
1 1 1 14  42  8  o 12 6.83087e+00 1.76598e+00 1.34706e+02 300.124 4.59299e+00  -7.91580e+00 0.00000e+00 0.00000e+00 1.11227e+02 300.124 2.34787e+01 120.124 0.9437 
1 1 1 14  42  9  o 17 4.55748e+00 1.48568e+00 7.73545e+01 96.401  -4.50054e-01 4.01160e+00  0.00000e+00 0.00000e+00 7.30426e+01 96.401  4.31184e+00 276.401 0.8649 
1 1 1 14  43  0  o 14 5.70108e+00 1.39682e+00 1.75782e+02 172.335 -9.46577e+00 1.27385e+00  0.00000e+00 0.00000e+00 2.94542e+01 172.335 1.46327e+02 352.335 0.9461 
1 1 1 14  43  1  o 2  4.02061e+00 1.20777e+00 4.21538e+01 274.152 1.32102e-01  -1.81967e+00 0.00000e+00 0.00000e+00 5.99010e+01 274.152 1.77472e+01 274.152 0.6667 
1 1 1 14  43  2  o 8  9.00440e+00 1.31734e+00 1.63969e+02 130.684 -9.47468e+00 1.10216e+01  0.00000e+00 0.00000e+00 1.66977e+02 130.684 3.00789e+00 130.684 0.9650 
1 1 1 14  43  3  o 3  9.38078e+00 1.38106e+00 1.55908e+02 137.714 -1.11735e+01 1.01621e+01  0.00000e+00 0.00000e+00 1.89495e+02 137.714 3.35867e+01 137.714 0.9663 
1 1 1 14  43  4  o 4  8.16448e+00 1.45106e+00 1.19694e+02 21.854  9.25409e+00  3.71151e+00  0.00000e+00 0.00000e+00 1.75470e+02 21.854  5.57757e+01 21.854  0.9484 
1 1 1 14  43  5  o 11 1.04606e+01 1.38722e+00 1.80107e+02 286.856 6.04003e+00  -1.99354e+01 0.00000e+00 0.00000e+00 2.09047e+02 286.856 2.89406e+01 286.856 0.9757 
1 1 1 14  43  6  o 1  1.23539e+01 1.72928e+00 2.11545e+02 128.982 -1.52224e+01 1.88105e+01  0.00000e+00 0.00000e+00 2.49759e+02 128.982 3.82139e+01 128.982 0.9791 
1 1 1 14  43  7  o 9  5.19662e+00 1.52944e+00 7.54274e+01 211.240 -3.70017e+00 -2.24443e+00 0.00000e+00 0.00000e+00 9.80205e+01 211.240 2.25931e+01 211.240 0.8750 
1 1 1 14  43  8  o 18 1.41545e+01 1.49560e+00 2.50070e+02 102.507 -8.80043e+00 3.96722e+01  0.00000e+00 0.00000e+00 2.83205e+02 102.507 3.31348e+01 102.507 0.9876 
1 1 1 14  43  9  o 4  5.39674e+00 1.68121e+00 7.89968e+01 145.550 -3.66530e+00 2.51436e+00  0.00000e+00 0.00000e+00 1.01909e+02 145.550 2.29123e+01 145.550 0.8787 
1 1 1 14  44  0  o 17 1.35755e+01 9.93552e-01 2.27556e+02 20.663  3.16792e+01  1.19470e+01  0.00000e+00 0.00000e+00 2.81248e+02 20.663  5.36920e+01 20.663  0.9851 
1 1 1 14  44  1  o 10 9.69786e+00 1.27170e+00 2.15466e+02 105.180 -5.51472e+00 2.03261e+01  0.00000e+00 0.00000e+00 1.44819e+02 105.180 7.06475e+01 285.180 0.9760 
1 1 1 14  44  2  o 16 6.76610e+00 1.55035e+00 1.55037e+02 187.132 -9.51932e+00 -1.19117e+00 0.00000e+00 0.00000e+00 8.88187e+01 187.132 6.62182e+01 7.132   0.9464 
1 1 1 14  44  3  o 14 1.33562e+01 1.16721e+00 2.06459e+02 359.727 3.05523e+01  -1.45648e-01 0.00000e+00 0.00000e+00 2.94010e+02 359.727 8.75514e+01 359.727 0.9835 
1 1 1 14  44  4  o 19 7.64755e+00 1.43055e+00 1.04277e+02 259.409 -1.48691e+00 -7.95222e+00 0.00000e+00 0.00000e+00 1.68535e+02 259.409 6.42574e+01 259.409 0.9360 
1 1 1 14  44  5  o 11 6.30012e+00 1.50120e+00 1.85831e+02 67.314  4.68545e+00  1.12087e+01  0.00000e+00 0.00000e+00 4.42468e+01 67.314  1.41584e+02 247.314 0.9579 
1 1 1 14  44  6  o 3  1.26859e+01 1.76674e+00 2.68252e+02 211.917 -2.51122e+01 -1.56411e+01 0.00000e+00 0.00000e+00 2.07249e+02 211.917 6.10034e+01 31.917  0.9830 
1 1 1 14  44  7  o 3  5.29134e+00 1.54414e+00 1.08003e+02 319.465 4.73744e+00  -4.05112e+00 0.00000e+00 0.00000e+00 7.68197e+01 319.465 3.11832e+01 139.465 0.9158 
1 1 1 14  44  8  f 0  4.73779e+00 1.48356e+00 1.92127e+02 95.026  -9.35836e-01 1.06404e+01  0.00000e+00 0.00000e+00 2.00926e+01 275.026 2.12220e+02 275.026 0.9520 
1 1 1 14  44  9  o 7  1.03699e+01 1.84857e+00 2.15617e+02 306.867 1.26321e+01  -1.68446e+01 0.00000e+00 0.00000e+00 1.70431e+02 306.867 4.51855e+01 126.867 0.9760 
1 1 1 14  45  0  f 0  6.71081e+00 1.37360e+00 7.53411e+01 106.498 -1.41851e+00 4.78942e+00  0.00000e+00 0.00000e+00 1.52698e+02 106.498 7.73565e+01 106.498 0.8933 
1 1 1 14  45  1  o 13 2.85646e+01 9.29057e-01 4.96198e+02 317.443 1.30653e+02  -1.19960e+02 0.00000e+00 0.00000e+00 5.87939e+02 317.443 9.17415e+01 317.443 0.9972 
1 1 1 14  45  2  o 13 1.95943e+01 1.10746e+00 3.74988e+02 149.662 -7.32773e+01 4.28844e+01  0.00000e+00 0.00000e+00 3.66742e+02 149.662 8.24563e+00 329.662 0.9941 
1 1 1 14  45  3  o 6  8.10146e+00 1.35171e+00 1.27831e+02 17.152  1.02424e+01  3.16119e+00  0.00000e+00 0.00000e+00 1.66024e+02 17.152  3.81933e+01 17.152  0.9521 
1 1 1 14  45  4  o 4  5.57802e+00 1.49132e+00 1.14438e+02 296.837 2.79241e+00  -5.51919e+00 0.00000e+00 0.00000e+00 8.00941e+01 296.837 3.43435e+01 116.837 0.9151 
1 1 1 14  45  5  f 0  3.96844e+00 1.28512e+00 6.38678e+01 308.111 1.84046e+00  -2.34629e+00 0.00000e+00 0.00000e+00 5.84596e+01 308.111 5.40824e+00 128.111 0.8086 
1 1 1 14  45  6  o 8  7.88469e+00 1.85315e+00 9.26692e+01 195.250 -6.20661e+00 -1.69214e+00 0.00000e+00 0.00000e+00 1.83488e+02 195.250 9.08191e+01 195.250 0.9186 
1 1 1 14  45  7  o 4  4.02761e+00 1.30499e+00 1.20773e+02 105.402 -1.66818e+00 6.05532e+00  0.00000e+00 0.00000e+00 1.99944e+01 105.402 1.00779e+02 285.402 0.9165 
1 1 1 14  45  8  o 14 8.41976e+00 1.87982e+00 1.58955e+02 12.326  1.13759e+01  2.48585e+00  0.00000e+00 0.00000e+00 1.48047e+02 12.326  1.09075e+01 192.326 0.9560 
1 1 1 14  46  0  o 17 5.54927e+00 1.35049e+00 1.58990e+02 177.865 -8.97762e+00 3.34746e-01  0.00000e+00 0.00000e+00 3.99643e+01 177.865 1.19025e+02 357.865 0.9426 
1 1 1 14  46  1  f 0  1.11940e+01 1.18912e+00 1.37462e+02 341.846 1.62377e+01  -5.32438e+00 0.00000e+00 0.00000e+00 2.75882e+02 341.846 1.38420e+02 341.846 0.9703 
1 1 1 14  46  2  o 13 6.76931e+00 1.41540e+00 1.78080e+02 159.287 -1.10110e+01 4.16355e+00  0.00000e+00 0.00000e+00 6.84551e+01 159.287 1.09625e+02 339.287 0.9565 
1 1 1 14  46  3  o 7  7.01592e+00 1.44770e+00 5.75321e+01 311.115 2.71347e+00  -3.10884e+00 0.00000e+00 0.00000e+00 1.74488e+02 311.115 1.16955e+02 311.115 0.8682 
1 1 1 14  46  4  o 12 4.11866e+00 1.28200e+00 5.32275e+01 107.592 -7.93597e-01 2.50293e+00  0.00000e+00 0.00000e+00 6.88698e+01 107.592 1.56423e+01 107.592 0.7780 
1 1 1 14  46  5  o 9  6.54869e+00 1.53699e+00 1.13140e+02 302.692 4.06142e+00  -6.32824e+00 0.00000e+00 0.00000e+00 1.19216e+02 302.692 6.07574e+00 302.692 0.9309 
1 1 1 14  46  6  o 13 5.25625e+00 1.60101e+00 6.34864e+01 179.301 -3.27454e+00 3.99669e-02  0.00000e+00 0.00000e+00 1.02515e+02 179.301 3.90290e+01 179.301 0.8284 
1 1 1 14  46  7  o 7  5.04917e+00 1.48210e+00 7.46223e+01 58.023  2.21170e+00  3.54268e+00  0.00000e+00 0.00000e+00 9.28683e+01 58.023  1.82459e+01 58.023  0.8700 
1 1 1 14  46  8  o 14 4.55082e+00 1.46677e+00 6.69799e+01 356.803 3.65074e+00  -2.03898e-01 0.00000e+00 0.00000e+00 8.03336e+01 356.803 1.33537e+01 356.803 0.8489 
1 1 1 14  47  0  o 19 8.10901e+00 1.22856e+00 1.49780e+02 278.792 2.02035e+00  -1.30633e+01 0.00000e+00 0.00000e+00 1.46712e+02 278.792 3.06859e+00 98.792  0.9614 
1 1 1 14  47  1  o 19 6.44226e+00 1.36445e+00 8.05192e+01 188.446 -5.34600e+00 -7.93850e-01 0.00000e+00 0.00000e+00 1.40594e+02 188.446 6.00745e+01 188.446 0.9020 
1 1 1 14  47  2  o 8  4.49101e+00 1.34262e+00 6.78436e+01 131.922 -2.11826e+00 2.35901e+00  0.00000e+00 0.00000e+00 7.26671e+01 131.922 4.82357e+00 131.922 0.8218 
1 1 1 14  47  3  o 8  1.15777e+01 1.14708e+00 2.24834e+02 310.558 1.99924e+01  -2.33601e+01 0.00000e+00 0.00000e+00 2.08874e+02 310.558 1.59602e+01 130.558 0.9836 
1 1 1 14  47  4  o 11 5.95673e+00 1.49131e+00 1.00708e+02 27.211  5.57467e+00  2.86629e+00  0.00000e+00 0.00000e+00 1.07249e+02 27.211  6.54183e+00 27.211  0.9163 
1 1 1 14  47  5  o 11 4.89618e+00 1.42208e+00 6.55849e+01 164.545 -3.45891e+00 9.56333e-01  0.00000e+00 0.00000e+00 9.21981e+01 164.545 2.66133e+01 164.545 0.8456 
1 1 1 14  47  6  o 8  7.08742e+00 1.71608e+00 1.26908e+02 51.946  5.19052e+00  6.63068e+00  0.00000e+00 0.00000e+00 1.26664e+02 51.946  2.44669e-01 231.946 0.9386 
1 1 1 14  47  7  o 11 5.17373e+00 1.50081e+00 4.54654e+01 241.248 -1.30835e+00 -2.38465e+00 0.00000e+00 0.00000e+00 1.09758e+02 241.248 6.42924e+01 241.248 0.7869 
1 1 1 14  47  8  o 15 6.95819e+00 1.79181e+00 1.09046e+02 245.537 -3.00904e+00 -6.61407e+00 0.00000e+00 0.00000e+00 1.37263e+02 245.537 2.82165e+01 245.537 0.9284 
1 1 1 14  48  0  o 4  1.89552e+01 9.82488e-01 3.29927e+02 83.640  8.77456e+00  7.87219e+01  0.00000e+00 0.00000e+00 3.86306e+02 83.640  5.63786e+01 83.640  0.9937 
1 1 1 14  48  1  o 9  3.21368e+00 1.05977e+00 9.77796e+01 328.445 3.12310e+00  -1.91798e+00 0.00000e+00 0.00000e+00 6.06194e+00 328.445 9.17177e+01 148.445 0.8493 
1 1 1 14  48  2  o 11 5.71295e+00 1.39870e+00 2.59960e+01 165.419 -1.51083e+00 3.92995e-01  0.00000e+00 0.00000e+00 1.06847e+02 165.419 8.08506e+01 165.419 0.6109 
1 1 1 14  48  3  o 1  6.99109e+00 1.46222e+00 1.66338e+02 220.564 -8.69757e+00 -7.44529e+00 0.00000e+00 0.00000e+00 8.79786e+01 220.564 7.83598e+01 40.564  0.9553 
1 1 1 14  48  4  o 3  4.57379e+00 1.32880e+00 3.64319e+01 267.723 -7.56157e-02 -1.90215e+00 0.00000e+00 0.00000e+00 8.22729e+01 267.723 4.58410e+01 267.723 0.6813 
1 1 1 14  48  5  o 8  1.56588e+01 1.16069e+00 2.33061e+02 113.968 -1.82677e+01 4.10921e+01  0.00000e+00 0.00000e+00 3.56942e+02 113.968 1.23881e+02 113.968 0.9888 
1 1 1 14  48  6  f 0  1.75672e+01 1.18030e+00 2.80400e+02 289.619 2.28062e+01  -6.39794e+01 0.00000e+00 0.00000e+00 3.84197e+02 289.619 1.03796e+02 289.619 0.9926 
1 1 1 14  48  7  o 10 4.35474e+00 1.37329e+00 2.38840e+01 114.599 -5.62027e-01 1.22763e+00  0.00000e+00 0.00000e+00 6.85542e+01 114.599 4.46702e+01 114.599 0.5569 
1 1 1 14  48  8  o 1  4.78910e+00 1.58525e+00 9.20709e+01 198.738 -4.48684e+00 -1.52202e+00 0.00000e+00 0.00000e+00 6.98635e+01 198.738 2.22074e+01 18.738  0.8869 
1 1 1 14  49  0  o 7  4.58617e+00 1.29986e+00 1.18796e+02 168.754 -5.53486e+00 1.10057e+00  0.00000e+00 0.00000e+00 3.92605e+01 168.754 7.95358e+01 348.754 0.9064 
1 1 1 14  49  1  o 16 8.67595e+00 1.24180e+00 9.89596e+01 284.749 2.39598e+00  -9.10111e+00 0.00000e+00 0.00000e+00 2.13027e+02 284.749 1.14067e+02 284.749 0.9453 
1 1 1 14  49  2  o 9  8.60207e+00 1.35637e+00 1.77003e+02 160.817 -1.51990e+01 5.28763e+00  0.00000e+00 0.00000e+00 1.40047e+02 160.817 3.69563e+01 340.817 0.9684 
1 1 1 14  49  3  o 8  9.58109e+00 1.33546e+00 1.31793e+02 242.781 -6.70235e+00 -1.30309e+01 0.00000e+00 0.00000e+00 2.20333e+02 242.781 8.85400e+01 242.781 0.9653 
1 1 1 14  49  4  o 13 4.97811e+00 1.33120e+00 1.48299e+02 294.889 3.55690e+00  -7.66649e+00 0.00000e+00 0.00000e+00 2.97116e+01 294.889 1.18588e+02 114.889 0.9388 
1 1 1 14  49  5  o 12 6.78702e+00 1.57551e+00 1.16756e+02 343.080 7.94774e+00  -2.41770e+00 0.00000e+00 0.00000e+00 1.25724e+02 343.080 8.96872e+00 343.080 0.9377 
1 1 1 14  49  6  o 13 4.93777e+00 1.50186e+00 6.44787e+01 116.884 -1.61374e+00 3.18302e+00  0.00000e+00 0.00000e+00 9.44526e+01 116.884 2.99738e+01 116.884 0.8446 
1 1 1 14  49  7  o 3  3.89246e+00 1.29420e+00 9.16878e+00 60.290  2.31464e-01  4.05640e-01  0.00000e+00 0.00000e+00 2.45642e+01 60.290  1.53954e+01 60.290  0.2274 
1 1 1 14  49  8  o 12 6.29528e+00 1.78817e+00 1.43642e+02 257.098 -1.96198e+00 -8.56541e+00 0.00000e+00 0.00000e+00 8.22283e+01 257.098 6.14140e+01 77.098  0.9413 
1 1 1 14  50  0  o 14 1.18375e+01 1.12501e+00 1.93840e+02 95.938  -2.75989e+00 2.65362e+01  0.00000e+00 0.00000e+00 2.47661e+02 95.938  5.38215e+01 95.938  0.9811 
1 1 1 14  50  1  o 15 8.35857e+00 1.26926e+00 2.20957e+02 252.661 -6.21020e+00 -1.98908e+01 0.00000e+00 0.00000e+00 8.92485e+01 252.661 1.31709e+02 72.661  0.9757 
1 1 1 14  50  2  o 3  1.32376e+01 1.09300e+00 2.31508e+02 301.417 1.91089e+01  -3.12844e+01 0.00000e+00 0.00000e+00 2.65323e+02 301.417 3.38146e+01 301.417 0.9863 
1 1 1 14  50  3  o 13 4.90412e+00 1.29877e+00 7.00379e+01 49.048  2.63319e+00  3.03424e+00  0.00000e+00 0.00000e+00 9.13071e+01 49.048  2.12693e+01 49.048  0.8642 
1 1 1 14  50  4  o 18 4.53281e+00 1.33985e+00 4.36368e+01 305.139 1.29642e+00  -1.84197e+00 0.00000e+00 0.00000e+00 8.32717e+01 305.139 3.96349e+01 305.139 0.7352 
1 1 1 14  50  5  o 14 4.79452e+00 1.43132e+00 8.20850e+01 100.618 -7.87783e-01 4.20198e+00  0.00000e+00 0.00000e+00 7.74237e+01 100.618 4.66131e+00 280.618 0.8733 
1 1 1 14  50  6  o 15 1.06864e+01 1.49086e+00 2.13989e+02 171.569 -2.58944e+01 3.83812e+00  0.00000e+00 0.00000e+00 1.85343e+02 171.569 2.86453e+01 351.569 0.9807 
1 1 1 14  50  7  o 5  5.11511e+00 1.55229e+00 8.62094e+01 19.580  4.44876e+00  1.58234e+00  0.00000e+00 0.00000e+00 8.66009e+01 19.580  3.91554e-01 19.580  0.8865 
1 1 1 14  50  8  o 19 4.76992e+00 1.56175e+00 9.98792e+01 166.607 -5.29780e+00 1.26146e+00  0.00000e+00 0.00000e+00 6.42469e+01 166.607 3.56323e+01 346.607 0.9028 
1 1 1 14  51  0  o 18 8.95593e+00 1.25421e+00 9.52131e+01 128.205 -5.99725e+00 7.61976e+00  0.00000e+00 0.00000e+00 2.27148e+02 128.205 1.31935e+02 128.205 0.9469 
1 1 1 14  51  1  o 18 6.33215e+00 1.33046e+00 6.30319e+01 19.099  4.03942e+00  1.39873e+00  0.00000e+00 0.00000e+00 1.47279e+02 19.099  8.42469e+01 19.099  0.8733 
1 1 1 14  51  2  o 11 8.61917e+00 1.30661e+00 1.67136e+02 105.644 -4.58552e+00 1.63746e+01  0.00000e+00 0.00000e+00 1.51023e+02 105.644 1.61128e+01 285.644 0.9701 
1 1 1 14  51  3  o 8  4.01804e+00 1.24288e+00 1.30763e+02 169.492 -6.19725e+00 1.14944e+00  0.00000e+00 0.00000e+00 9.46130e+00 169.492 1.21302e+02 349.492 0.9168 
1 1 1 14  51  4  o 16 1.23161e+01 1.25447e+00 2.58190e+02 247.657 -1.49219e+01 -3.63063e+01 0.00000e+00 0.00000e+00 2.04773e+02 247.657 5.34167e+01 67.657  0.9872 
1 1 1 14  51  5  o 10 4.43304e+00 1.34765e+00 6.38913e+01 21.747  3.22562e+00  1.28673e+00  0.00000e+00 0.00000e+00 7.78880e+01 21.747  1.39967e+01 21.747  0.8397 
1 1 1 14  51  6  o 3  4.58343e+00 1.40434e+00 6.27896e+01 96.180  -3.60384e-01 3.32833e+00  0.00000e+00 0.00000e+00 8.26225e+01 96.180  1.98329e+01 96.180  0.8327 
1 1 1 14  51  7  o 1  3.71285e+00 1.20261e+00 4.31884e+01 169.190 -2.25469e+00 4.30490e-01  0.00000e+00 0.00000e+00 6.16147e+01 169.190 1.84263e+01 169.190 0.7408 
1 1 1 14  51  8  o 14 5.55645e+00 1.64676e+00 8.41486e+01 236.482 -2.80949e+00 -4.24176e+00 0.00000e+00 0.00000e+00 1.05445e+02 236.482 2.12968e+01 236.482 0.8954 
1 1 1 14  52  0  f 0  8.26784e+00 1.24544e+00 8.02674e+01 64.479  3.16444e+00  6.62801e+00  0.00000e+00 0.00000e+00 2.11707e+02 64.479  1.31439e+02 64.479  0.9292 
1 1 1 14  52  1  o 9  5.82997e+00 1.38142e+00 1.27465e+02 211.234 -7.17912e+00 -4.35360e+00 0.00000e+00 0.00000e+00 8.05711e+01 211.234 4.68934e+01 31.234  0.9384 
1 1 1 14  52  2  o 10 7.49205e+00 1.44795e+00 9.18351e+01 139.487 -5.57865e+00 4.76684e+00  0.00000e+00 0.00000e+00 1.72989e+02 139.487 8.11539e+01 139.487 0.9291 
1 1 1 14  52  3  o 9  1.89940e+01 1.00233e+00 2.49812e+02 294.225 2.67464e+01  -5.94440e+01 0.00000e+00 0.00000e+00 4.67521e+02 294.225 2.17709e+02 294.225 0.9923 
1 1 1 14  52  4  o 16 1.22828e+01 1.26726e+00 1.91771e+02 44.490  1.94959e+01  1.91521e+01  0.00000e+00 0.00000e+00 2.67232e+02 44.490  7.54613e+01 44.490  0.9815 
1 1 1 14  52  5  o 5  1.01775e+01 1.38659e+00 1.24013e+02 195.342 -1.47343e+01 -4.04240e+00 0.00000e+00 0.00000e+00 2.50677e+02 195.342 1.26664e+02 195.342 0.9667 
1 1 1 14  52  6  o 8  7.00601e+00 1.61659e+00 2.55559e+02 141.757 -1.50581e+01 1.18680e+01  0.00000e+00 0.00000e+00 4.26181e+00 141.757 2.51297e+02 321.757 0.9736 
1 1 1 14  52  7  o 15 6.12476e+00 1.69966e+00 5.66009e+01 256.867 -8.01856e-01 -3.43695e+00 0.00000e+00 0.00000e+00 1.40021e+02 256.867 8.34199e+01 256.867 0.8426 
1 1 1 14  52  8  o 3  4.33946e+00 1.42987e+00 2.99520e+01 168.241 -1.62217e+00 3.37689e-01  0.00000e+00 0.00000e+00 7.46467e+01 168.241 4.46948e+01 168.241 0.6326 
1 1 1 14  53  0  f 0  5.71210e+00 1.31894e+00 9.97137e+01 20.659  6.24627e+00  2.35520e+00  0.00000e+00 0.00000e+00 1.00355e+02 20.659  6.41324e-01 20.659  0.9217 
1 1 1 14  53  1  o 6  6.75183e+00 1.32835e+00 1.20048e+02 161.488 -8.79427e+00 2.94450e+00  0.00000e+00 0.00000e+00 1.22397e+02 161.488 2.34829e+00 161.488 0.9444 
1 1 1 14  53  2  o 6  4.02918e+00 1.17006e+00 8.10065e+01 9.916   4.01797e+00  7.02382e-01  0.00000e+00 0.00000e+00 5.17946e+01 9.916   2.92119e+01 189.916 0.8665 
1 1 1 14  53  3  o 12 6.06643e+00 1.41879e+00 8.73215e+01 331.655 5.06634e+00  -2.73306e+00 0.00000e+00 0.00000e+00 1.22385e+02 331.655 3.50631e+01 331.655 0.9084 
1 1 1 14  53  4  o 16 1.19082e+01 1.28739e+00 1.62574e+02 289.696 7.71692e+00  -2.15571e+01 0.00000e+00 0.00000e+00 2.80727e+02 289.696 1.18153e+02 289.696 0.9779 
1 1 1 14  53  5  o 18 5.47976e+00 1.45722e+00 1.06848e+02 210.708 -5.80635e+00 -3.44867e+00 0.00000e+00 0.00000e+00 8.56767e+01 210.708 2.11709e+01 30.708  0.9227 
1 1 1 14  53  6  o 18 6.45075e+00 1.61634e+00 1.26228e+02 91.410  -2.12653e-01 8.64161e+00  0.00000e+00 0.00000e+00 1.04780e+02 91.410  2.14485e+01 271.410 0.9402 
1 1 1 14  53  7  o 10 5.61859e+00 1.59037e+00 6.69226e+01 291.757 1.57588e+00  -3.94860e+00 0.00000e+00 0.00000e+00 1.19828e+02 291.757 5.29055e+01 291.757 0.8725 
1 1 1 14  53  8  o 3  9.20614e+00 1.85056e+00 1.89909e+02 311.167 1.13379e+01  -1.29665e+01 0.00000e+00 0.00000e+00 1.50483e+02 311.167 3.94250e+01 131.166 0.9705 
1 1 1 14  54  0  o 5  4.87447e+00 1.28035e+00 5.01981e+01 176.362 -2.87120e+00 1.82528e-01  0.00000e+00 0.00000e+00 9.80503e+01 176.362 4.78523e+01 176.362 0.8005 
1 1 1 14  54  1  o 7  4.08551e+00 1.20314e+00 7.81531e+01 100.925 -7.46754e-01 3.86872e+00  0.00000e+00 0.00000e+00 5.55967e+01 100.925 2.25564e+01 280.925 0.8612 
1 1 1 14  54  2  o 14 1.49211e+01 1.03385e+00 2.96061e+02 357.941 5.96379e+01  -2.14416e+00 0.00000e+00 0.00000e+00 2.66653e+02 357.941 2.94076e+01 177.941 0.9916 
1 1 1 14  54  3  o 17 9.33942e+00 1.38061e+00 1.77608e+02 260.104 -3.10548e+00 -1.78002e+01 0.00000e+00 0.00000e+00 1.67765e+02 260.104 9.84312e+00 80.104  0.9719 
1 1 1 14  54  4  o 4  1.49577e+01 1.18814e+00 2.16555e+02 185.344 -4.36847e+01 -4.08601e+00 0.00000e+00 0.00000e+00 3.46236e+02 185.344 1.29680e+02 185.344 0.9885 
1 1 1 14  54  5  o 1  8.53794e+00 1.48531e+00 1.47487e+02 31.726  1.23040e+01  7.60667e+00  0.00000e+00 0.00000e+00 1.66131e+02 31.726  1.86446e+01 31.726  0.9648 
1 1 1 14  54  6  o 8  4.09032e+00 1.29938e+00 8.96853e+01 97.528  -6.37240e-01 4.82206e+00  0.00000e+00 0.00000e+00 4.89662e+01 97.528  4.07191e+01 277.528 0.8901 
1 1 1 14  54  7  o 11 4.28615e+00 1.40769e+00 6.88394e+01 34.098  2.94150e+00  1.99138e+00  0.00000e+00 0.00000e+00 6.89085e+01 34.098  6.91909e-02 34.098  0.8438 
1 1 1 14  54  8  f 0  5.51620e+00 1.68465e+00 1.20911e+02 359.079 7.34705e+00  -1.18138e-01 0.00000e+00 0.00000e+00 7.43396e+01 359.079 4.65717e+01 179.079 0.9292 
1 1 1 14  55  0  o 14 1.18683e+01 1.05737e+00 1.95626e+02 76.282  7.35881e+00  3.01466e+01  0.00000e+00 0.00000e+00 2.47913e+02 76.282  5.22865e+01 76.282  0.9838 
1 1 1 14  55  1  o 3  5.80881e+00 1.34186e+00 1.39742e+02 8.858   9.08127e+00  1.41520e+00  0.00000e+00 0.00000e+00 6.86646e+01 8.858   7.10771e+01 188.858 0.9439 
1 1 1 14  55  2  o 15 1.67751e+01 9.94913e-01 2.65547e+02 258.353 -1.23915e+01 -6.01172e+01 0.00000e+00 0.00000e+00 3.67142e+02 258.353 1.01595e+02 258.353 0.9918 
1 1 1 14  55  3  o 19 3.79931e+00 1.20025e+00 4.97707e+01 194.437 -2.42330e+00 -6.23852e-01 0.00000e+00 0.00000e+00 6.08354e+01 194.437 1.10648e+01 194.437 0.7652 
1 1 1 14  55  4  o 9  1.03273e+01 1.33097e+00 1.83763e+02 220.767 -1.69968e+01 -1.46542e+01 0.00000e+00 0.00000e+00 2.00397e+02 220.767 1.66339e+01 220.767 0.9775 
1 1 1 14  55  5  o 13 8.06241e+00 1.42531e+00 1.33677e+02 93.060  -6.60305e-01 1.23527e+01  0.00000e+00 0.00000e+00 1.60556e+02 93.060  2.68783e+01 93.060  0.9587 
1 1 1 14  55  6  o 10 5.27023e+00 1.49651e+00 1.31800e+02 291.672 2.84247e+00  -7.15288e+00 0.00000e+00 0.00000e+00 5.53380e+01 291.672 7.64618e+01 111.672 0.9326 
1 1 1 14  55  7  o 11 5.29116e+00 1.55184e+00 1.19994e+02 223.954 -5.26150e+00 -5.07274e+00 0.00000e+00 0.00000e+00 6.71628e+01 223.954 5.28317e+01 43.954  0.9288 
1 1 1 14  55  8  o 19 4.88724e+00 1.52847e+00 3.65924e+01 92.580  -1.00431e-01 2.22872e+00  0.00000e+00 0.00000e+00 9.97118e+01 92.580  6.31194e+01 92.580  0.7323 
1 1 1 14  56  0  o 18 1.33288e+01 9.87015e-01 2.34701e+02 2.838   4.32597e+01  2.14439e+00  0.00000e+00 0.00000e+00 2.65689e+02 2.838   3.09873e+01 2.838   0.9884 
1 1 1 14  56  1  o 10 5.55655e+00 1.29826e+00 8.29141e+01 73.979  1.48334e+00  5.16581e+00  0.00000e+00 0.00000e+00 1.07432e+02 73.979  2.45181e+01 73.979  0.9014 
1 1 1 14  56  2  o 19 9.93994e+00 1.24801e+00 1.59216e+02 222.883 -1.36126e+01 -1.26423e+01 0.00000e+00 0.00000e+00 2.08397e+02 222.883 4.91814e+01 222.883 0.9727 
1 1 1 14  56  3  o 5  7.33791e+00 1.49005e+00 1.40730e+02 119.113 -5.26935e+00 9.46205e+00  0.00000e+00 0.00000e+00 1.25166e+02 119.113 1.55641e+01 299.113 0.9527 
1 1 1 14  56  4  o 3  3.41153e+00 1.13995e+00 4.54563e+01 9.911   2.15168e+00  3.75971e-01  0.00000e+00 0.00000e+00 4.87635e+01 9.911   3.30717e+00 9.911   0.7258 
1 1 1 14  56  5  o 17 3.74651e+00 1.21724e+00 9.26412e+01 303.393 2.75668e+00  -4.18188e+00 0.00000e+00 0.00000e+00 3.47812e+01 303.393 5.78600e+01 123.393 0.8936 
1 1 1 14  56  6  o 6  4.74881e+00 1.42687e+00 5.68183e+01 71.923  1.03135e+00  3.15967e+00  0.00000e+00 0.00000e+00 9.34766e+01 71.923  3.66583e+01 71.923  0.8313 
1 1 1 14  56  7  o 10 4.04766e+00 1.31971e+00 7.78034e+01 61.610  2.03958e+00  3.77369e+00  0.00000e+00 0.00000e+00 5.68671e+01 61.610  2.09363e+01 241.610 0.8738 
1 1 1 14  56  8  o 16 4.60494e+00 1.42666e+00 1.04905e+02 84.525  6.39635e-01  6.67348e+00  0.00000e+00 0.00000e+00 5.67874e+01 84.525  4.81174e+01 264.525 0.9221 
1 1 1 14  57  0  o 1  1.21841e+01 1.00940e+00 2.20943e+02 277.084 4.54038e+00  -3.65360e+01 0.00000e+00 0.00000e+00 2.35447e+02 277.084 1.45046e+01 277.084 0.9863 
1 1 1 14  57  1  f 0  1.00331e+01 1.18645e+00 1.51836e+02 128.276 -1.21163e+01 1.53552e+01  0.00000e+00 0.00000e+00 2.19520e+02 128.276 6.76838e+01 128.276 0.9741 
1 1 1 14  57  2  o 8  7.20654e+00 1.36559e+00 7.42504e+01 21.499  5.95162e+00  2.34424e+00  0.00000e+00 0.00000e+00 1.77275e+02 21.499  1.03025e+02 21.499  0.9181 
1 1 1 14  57  3  o 11 5.02705e+00 1.37095e+00 9.47293e+01 283.308 1.26667e+00  -5.35490e+00 0.00000e+00 0.00000e+00 7.80758e+01 283.308 1.66536e+01 103.308 0.9039 
1 1 1 14  57  4  o 2  5.81867e+00 1.50655e+00 1.10387e+02 187.292 -7.21972e+00 -9.23905e-01 0.00000e+00 0.00000e+00 9.51571e+01 187.292 1.52299e+01 7.292   0.9285 
1 1 1 14  57  5  o 19 7.08377e+00 1.52649e+00 8.40821e+01 83.714  7.33924e-01  6.66277e+00  0.00000e+00 0.00000e+00 1.64482e+02 83.714  8.04003e+01 83.714  0.9221 
1 1 1 14  57  6  f 0  4.29956e+00 1.35366e+00 8.51076e+01 132.812 -3.30986e+00 3.57280e+00  0.00000e+00 0.00000e+00 6.05956e+01 132.812 2.45120e+01 312.812 0.8903 
1 1 1 14  57  7  o 7  5.03357e+00 1.51344e+00 9.57230e+01 116.858 -2.61834e+00 5.17049e+00  0.00000e+00 0.00000e+00 7.84806e+01 116.858 1.72424e+01 296.858 0.9091 
1 1 1 14  57  8  o 18 5.98423e+00 1.66329e+00 9.18256e+01 356.138 6.17184e+00  -4.16628e-01 0.00000e+00 0.00000e+00 1.16689e+02 356.138 2.48633e+01 356.138 0.9152 
1 1 1 14  58  0  o 3  1.03091e+01 1.17606e+00 1.85977e+02 65.640  1.02088e+01  2.25468e+01  0.00000e+00 0.00000e+00 1.97481e+02 65.640  1.15043e+01 65.640  0.9796 
1 1 1 14  58  1  o 4  8.78215e+00 1.24113e+00 1.62716e+02 35.206  1.37373e+01  9.69255e+00  0.00000e+00 0.00000e+00 1.60850e+02 35.206  1.86564e+00 215.205 0.9698 
1 1 1 14  58  2  o 12 6.04612e+00 1.41703e+00 1.04985e+02 59.899  3.48533e+00  6.01239e+00  0.00000e+00 0.00000e+00 1.07581e+02 59.899  2.59570e+00 59.899  0.9250 
1 1 1 14  58  3  o 7  5.79265e+00 1.45301e+00 1.11631e+02 286.886 2.17785e+00  -7.17465e+00 0.00000e+00 0.00000e+00 9.33716e+01 286.886 1.82590e+01 106.886 0.9307 
1 1 1 14  58  4  o 4  5.69064e+00 1.48892e+00 4.46883e+01 337.870 2.59885e+00  -1.05685e+00 0.00000e+00 0.00000e+00 1.27294e+02 337.870 8.26054e+01 337.870 0.7945 
1 1 1 14  58  5  o 1  4.85415e+00 1.44028e+00 4.70132e+01 198.781 -2.60869e+00 -8.87124e-01 0.00000e+00 0.00000e+00 9.89237e+01 198.781 5.19105e+01 198.781 0.7901 
1 1 1 14  58  6  o 9  7.05771e+00 1.65406e+00 6.32278e+01 18.821  4.33748e+00  1.47834e+00  0.00000e+00 0.00000e+00 1.73870e+02 18.821  1.10642e+02 18.821  0.8827 
1 1 1 14  58  7  o 3  5.67706e+00 1.74083e+00 1.43456e+02 296.046 3.80428e+00  -7.78421e+00 0.00000e+00 0.00000e+00 5.97556e+01 296.046 8.37007e+01 116.046 0.9404 
1 1 1 14  58  8  o 12 5.25891e+00 1.59563e+00 1.35480e+02 123.604 -4.86124e+00 7.31571e+00  0.00000e+00 0.00000e+00 5.29524e+01 123.604 8.25273e+01 303.604 0.9412 
1 1 1 14  59  0  o 2  1.14764e+01 1.04473e+00 1.82812e+02 282.847 6.76411e+00  -2.96601e+01 0.00000e+00 0.00000e+00 2.45668e+02 282.847 6.28551e+01 282.847 0.9834 
1 1 1 14  59  1  o 10 1.16722e+01 1.30146e+00 1.67554e+02 132.575 -1.55099e+01 1.68816e+01  0.00000e+00 0.00000e+00 2.66037e+02 132.575 9.84833e+01 132.575 0.9779 
1 1 1 14  59  2  o 16 1.20668e+01 1.15348e+00 1.86578e+02 0.935   2.95659e+01  4.82664e-01  0.00000e+00 0.00000e+00 2.64177e+02 0.935   7.75992e+01 0.935   0.9829 
1 1 1 14  59  3  f 0  9.44762e+00 1.38174e+00 1.23762e+02 134.073 -9.83505e+00 1.01585e+01  0.00000e+00 0.00000e+00 2.22482e+02 134.073 9.87199e+01 134.073 0.9640 
1 1 1 14  59  4  o 18 3.45068e+00 1.14878e+00 1.36176e+02 242.883 -3.23434e+00 -6.31576e+00 0.00000e+00 0.00000e+00 1.45736e+01 62.883  1.50750e+02 62.883  0.9266 
1 1 1 14  59  5  o 14 3.97869e+00 1.29470e+00 1.12157e+02 336.799 5.52394e+00  -2.36766e+00 0.00000e+00 0.00000e+00 2.59631e+01 336.799 8.61939e+01 156.799 0.9125 
1 1 1 14  59  6  o 2  1.34557e+01 1.42853e+00 1.92805e+02 24.985  2.94497e+01  1.37234e+01  0.00000e+00 0.00000e+00 3.11268e+02 24.985  1.18464e+02 24.985  0.9845 
1 1 1 14  59  7  o 1  6.06057e+00 1.80352e+00 1.03974e+02 167.602 -6.23690e+00 1.37107e+00  0.00000e+00 0.00000e+00 1.07759e+02 167.602 3.78549e+00 167.602 0.9180 
1 1 1 14  59  8  o 7  6.48460e+00 1.74304e+00 1.01245e+02 308.543 4.51367e+00  -5.66565e+00 0.00000e+00 0.00000e+00 1.27842e+02 308.543 2.65964e+01 308.543 0.9282 
1 1 1 14  60  0  o 19 3.36433e+00 1.06702e+00 2.93033e+01 127.540 -8.02746e-01 1.04464e+00  0.00000e+00 0.00000e+00 4.06366e+01 127.540 1.13334e+01 127.540 0.5477 
1 1 1 14  60  1  o 15 6.99960e+00 1.39628e+00 1.83418e+02 43.311  1.11058e+01  1.04697e+01  0.00000e+00 0.00000e+00 7.35591e+01 43.311  1.09859e+02 223.311 0.9667 
1 1 1 14  60  2  o 11 7.15036e+00 1.40606e+00 1.22515e+02 218.941 -8.13911e+00 -6.57704e+00 0.00000e+00 0.00000e+00 1.35850e+02 218.941 1.33347e+01 218.941 0.9509 
1 1 1 14  60  3  o 11 5.08408e+00 1.39324e+00 1.24403e+02 169.810 -7.29518e+00 1.31128e+00  0.00000e+00 0.00000e+00 5.53026e+01 169.810 6.91003e+01 349.810 0.9299 
1 1 1 14  60  4  o 13 4.08342e+00 1.28536e+00 9.91752e+01 302.901 2.89556e+00  -4.47564e+00 0.00000e+00 0.00000e+00 4.06549e+01 302.901 5.85203e+01 122.901 0.9005 
1 1 1 14  60  5  o 1  9.75531e+00 1.49553e+00 1.91107e+02 13.967  2.10820e+01  5.24362e+00  0.00000e+00 0.00000e+00 1.71313e+02 13.967  1.97949e+01 193.967 0.9767 
1 1 1 14  60  6  o 1  4.97253e+00 1.44897e+00 1.23607e+02 331.346 6.72411e+00  -3.67428e+00 0.00000e+00 0.00000e+00 5.27611e+01 331.346 7.08457e+01 151.346 0.9323 
1 1 1 14  60  7  o 11 6.54813e+00 1.76493e+00 1.61083e+02 186.778 -1.13225e+01 -1.34578e+00 0.00000e+00 0.00000e+00 7.68968e+01 186.778 8.41857e+01 6.778   0.9551 
1 1 1 14  60  8  o 18 6.45785e+00 1.70759e+00 1.10740e+02 37.515  6.34800e+00  4.87361e+00  0.00000e+00 0.00000e+00 1.19111e+02 37.515  8.37081e+00 37.515  0.9353 
1 1 1 14  61  0  o 12 8.38021e+00 1.24987e+00 1.75653e+02 159.171 -1.70793e+01 6.49787e+00  0.00000e+00 0.00000e+00 1.33569e+02 159.171 4.20833e+01 339.171 0.9722 
1 1 1 14  61  1  o 19 7.77653e+00 1.42936e+00 1.52530e+02 296.162 6.15762e+00  -1.25351e+01 0.00000e+00 0.00000e+00 1.31990e+02 296.162 2.05402e+01 116.162 0.9635 
1 1 1 14  61  2  o 4  1.39585e+01 1.07256e+00 2.26756e+02 73.427  1.32154e+01  4.44056e+01  0.00000e+00 0.00000e+00 2.97784e+02 73.427  7.10277e+01 73.427  0.9891 
1 1 1 14  61  3  o 3  5.80538e+00 1.47233e+00 9.10660e+01 308.203 3.85255e+00  -4.89512e+00 0.00000e+00 0.00000e+00 1.10993e+02 308.203 1.99275e+01 308.203 0.9158 
1 1 1 14  61  4  o 16 4.81664e+00 1.33102e+00 5.69358e+01 259.051 -6.75719e-01 -3.49299e+00 0.00000e+00 0.00000e+00 9.76354e+01 259.051 4.06995e+01 259.051 0.8441 
1 1 1 14  61  5  o 7  4.42938e+00 1.35323e+00 8.46454e+01 324.326 3.80308e+00  -2.73015e+00 0.00000e+00 0.00000e+00 6.45081e+01 324.326 2.01373e+01 144.326 0.8854 
1 1 1 14  61  6  o 16 4.85643e+00 1.46188e+00 7.88336e+01 270.296 2.46747e-02  -4.77293e+00 0.00000e+00 0.00000e+00 8.51820e+01 270.296 6.34841e+00 270.296 0.8878 
1 1 1 14  61  7  o 11 7.52153e+00 1.81966e+00 1.26428e+02 357.472 9.61725e+00  -4.24674e-01 0.00000e+00 0.00000e+00 1.44437e+02 357.472 1.80096e+01 357.472 0.9465 
1 1 1 14  61  8  f 0  5.09238e+00 1.57150e+00 1.08546e+02 157.627 -6.35349e+00 2.61522e+00  0.00000e+00 0.00000e+00 7.05034e+01 157.627 3.80427e+01 337.627 0.9241 
1 1 1 14  62  0  o 11 9.75549e+00 1.13525e+00 1.67176e+02 359.751 2.30797e+01  -1.00351e-01 0.00000e+00 0.00000e+00 1.94897e+02 359.751 2.77214e+01 359.751 0.9781 
1 1 1 14  62  1  f 0  8.23787e+00 1.35835e+00 1.35831e+02 284.582 3.45773e+00  -1.32920e+01 0.00000e+00 0.00000e+00 1.65321e+02 284.582 2.94895e+01 284.582 0.9629 
1 1 1 14  62  2  o 11 4.37755e+00 1.27943e+00 9.12980e+01 61.867  2.36741e+00  4.42766e+00  0.00000e+00 0.00000e+00 5.73324e+01 61.867  3.39656e+01 241.867 0.8939 
1 1 1 14  62  3  o 15 6.57744e+00 1.49842e+00 1.08339e+02 238.098 -4.31862e+00 -6.93763e+00 0.00000e+00 0.00000e+00 1.25771e+02 238.098 1.74322e+01 238.098 0.9367 
1 1 1 14  62  4  o 1  5.36613e+00 1.38249e+00 7.89750e+01 340.053 5.05886e+00  -1.83596e+00 0.00000e+00 0.00000e+00 1.04926e+02 340.053 2.59505e+01 340.053 0.9015 
1 1 1 14  62  5  o 4  7.12856e+00 1.56854e+00 1.71305e+02 261.825 -1.95379e+00 -1.36007e+01 0.00000e+00 0.00000e+00 8.96959e+01 261.825 8.16091e+01 81.825  0.9629 
1 1 1 14  62  6  o 13 7.00257e+00 1.54594e+00 8.71784e+01 290.970 2.67059e+00  -6.96814e+00 0.00000e+00 0.00000e+00 1.60603e+02 290.970 7.34247e+01 290.970 0.9304 
1 1 1 14  62  7  f 0  6.38821e+00 1.73978e+00 7.71475e+01 86.220  3.46223e-01  5.24034e+00  0.00000e+00 0.00000e+00 1.41291e+02 86.220  6.41437e+01 86.220  0.8989 
1 1 1 14  62  8  o 10 7.27105e+00 1.44785e+00 1.60311e+02 172.801 -1.63631e+01 2.06685e+00  0.00000e+00 0.00000e+00 1.07783e+02 172.801 5.25283e+01 352.801 0.9692 
1 1 1 14  63  0  o 6  6.14064e+00 1.40722e+00 6.26542e+01 247.838 -1.72592e+00 -4.23724e+00 0.00000e+00 0.00000e+00 1.42946e+02 247.838 8.02916e+01 247.838 0.8825 
1 1 1 14  63  1  o 15 4.89964e+00 1.29905e+00 7.54291e+01 23.794  4.19972e+00  1.85178e+00  0.00000e+00 0.00000e+00 8.87840e+01 23.794  1.33549e+01 23.794  0.8829 
1 1 1 14  63  2  o 17 4.52246e+00 1.27919e+00 9.07699e+01 311.801 3.65710e+00  -4.09008e+00 0.00000e+00 0.00000e+00 6.44206e+01 311.801 2.63493e+01 131.801 0.9036 
1 1 1 14  63  3  o 7  8.54056e+00 1.39822e+00 1.66522e+02 316.892 1.28939e+01  -1.20692e+01 0.00000e+00 0.00000e+00 1.48639e+02 316.892 1.78824e+01 136.892 0.9713 
1 1 1 14  63  4  o 4  6.49501e+00 1.47515e+00 9.91865e+01 211.328 -6.49747e+00 -3.95483e+00 0.00000e+00 0.00000e+00 1.30817e+02 211.328 3.16305e+01 211.328 0.9317 
1 1 1 14  63  5  o 14 5.17378e+00 1.40288e+00 9.53121e+01 97.408  -8.09136e-01 6.22287e+00  0.00000e+00 0.00000e+00 8.49466e+01 97.408  1.03655e+01 277.408 0.9164 
1 1 1 14  63  6  o 6  4.86866e+00 1.45889e+00 1.33524e+02 192.955 -8.19605e+00 -1.88537e+00 0.00000e+00 0.00000e+00 4.02306e+01 192.955 9.32936e+01 12.955  0.9385 
1 1 1 14  63  7  f 0  9.57262e+00 1.78695e+00 9.29632e+01 324.705 7.73865e+00  -5.47830e+00 0.00000e+00 0.00000e+00 2.51340e+02 324.705 1.58377e+02 324.705 0.9457 
1 1 1 14  63  8  o 2  5.67066e+00 1.67857e+00 1.03179e+02 164.439 -6.90297e+00 1.92224e+00  0.00000e+00 0.00000e+00 9.68424e+01 164.439 6.33659e+00 344.439 0.9273 
1 1 1 14  64  0  o 17 1.16267e+01 1.05883e+00 2.41620e+02 266.980 -2.11899e+00 -4.01660e+01 0.00000e+00 0.00000e+00 1.93899e+02 266.980 4.77211e+01 86.980  0.9875 
1 1 1 14  64  1  f 0  1.06157e+01 1.13528e+00 1.92185e+02 293.544 1.19510e+01  -2.74282e+01 0.00000e+00 0.00000e+00 2.03924e+02 293.544 1.17386e+01 293.544 0.9831 
1 1 1 14  64  2  o 16 3.74274e+00 1.16368e+00 9.02899e+01 351.708 4.75523e+00  -6.93074e-01 0.00000e+00 0.00000e+00 3.60045e+01 351.708 5.42854e+01 171.707 0.8887 
1 1 1 14  64  3  f 0  3.81484e+00 1.21365e+00 4.60024e+01 309.075 1.57171e+00  -1.93568e+00 0.00000e+00 0.00000e+00 6.47522e+01 309.075 1.87498e+01 309.075 0.7643 
1 1 1 14  64  4  o 12 1.18861e+01 1.29673e+00 1.48106e+02 186.391 -2.26338e+01 -2.53535e+00 0.00000e+00 0.00000e+00 2.93539e+02 186.391 1.45433e+02 186.391 0.9778 
1 1 1 14  64  5  o 11 3.43112e+00 1.13287e+00 6.68224e+01 231.760 -2.21959e+00 -2.81658e+00 0.00000e+00 0.00000e+00 4.34450e+01 231.760 2.33774e+01 51.760  0.8455 
1 1 1 14  64  6  o 7  5.79313e+00 1.39838e+00 7.53518e+01 64.106  2.70520e+00  5.57261e+00  0.00000e+00 0.00000e+00 1.26242e+02 64.106  5.08904e+01 64.106  0.9153 
1 1 1 14  64  7  o 16 5.57988e+00 1.56885e+00 1.06397e+02 248.677 -2.70734e+00 -6.93566e+00 0.00000e+00 0.00000e+00 9.09735e+01 248.677 1.54231e+01 68.677  0.9302 
1 1 1 14  64  8  o 12 3.55754e+00 1.22561e+00 5.82943e+01 153.164 -3.42728e+00 1.73397e+00  0.00000e+00 0.00000e+00 5.76685e+01 153.164 6.25758e-01 333.164 0.8571 
1 1 1 14  65  0  o 1  6.67832e+00 1.32977e+00 1.18269e+02 204.152 -9.31774e+00 -4.17813e+00 0.00000e+00 0.00000e+00 1.22274e+02 204.152 4.00479e+00 204.152 0.9497 
1 1 1 14  65  1  o 1  3.66233e+00 1.15524e+00 4.33560e+01 264.121 -2.32586e-01 -2.25872e+00 0.00000e+00 0.00000e+00 5.91468e+01 264.121 1.57907e+01 264.121 0.7376 
1 1 1 14  65  2  o 8  7.60784e+00 1.41885e+00 4.49149e+01 356.835 4.17701e+00  -2.30976e-01 0.00000e+00 0.00000e+00 2.06429e+02 356.835 1.61514e+02 356.835 0.8702 
1 1 1 14  65  3  o 2  1.32142e+01 1.16620e+00 2.58935e+02 232.159 -3.03486e+01 -3.90680e+01 0.00000e+00 0.00000e+00 2.37842e+02 232.159 2.10929e+01 52.159  0.9898 
1 1 1 14  65  4  o 2  7.77628e+00 1.43526e+00 9.67131e+01 132.794 -6.28336e+00 6.78690e+00  0.00000e+00 0.00000e+00 1.82274e+02 132.794 8.55609e+01 132.794 0.9443 
1 1 1 14  65  5  o 16 8.68930e+00 1.59440e+00 1.13669e+02 155.110 -1.02881e+01 4.77337e+00  0.00000e+00 0.00000e+00 2.01651e+02 155.110 8.79819e+01 155.110 0.9548 
1 1 1 14  65  6  f 0  7.43931e+00 1.64566e+00 1.57038e+02 358.664 1.33730e+01  -3.11929e-01 0.00000e+00 0.00000e+00 1.14969e+02 358.664 4.20684e+01 178.664 0.9619 
1 1 1 14  65  7  f 0  1.00894e+01 1.62389e+00 1.79280e+02 246.629 -8.58540e+00 -1.98669e+01 0.00000e+00 0.00000e+00 1.95344e+02 246.629 1.60636e+01 246.629 0.9766 
1 1 1 14  65  8  o 9  3.77655e+00 1.27288e+00 9.74008e+01 83.687  7.20340e-01  6.51157e+00  0.00000e+00 0.00000e+00 3.47312e+01 83.687  6.26697e+01 263.687 0.9202 
1 1 1 14  66  0  o 7  1.14552e+01 1.08425e+00 1.93651e+02 141.943 -2.60797e+01 2.04173e+01  0.00000e+00 0.00000e+00 2.34116e+02 141.943 4.04650e+01 141.943 0.9848 
1 1 1 14  66  1  o 6  4.20534e+00 1.23658e+00 7.18608e+01 211.313 -3.56263e+00 -2.16725e+00 0.00000e+00 0.00000e+00 6.69087e+01 211.313 4.95214e+00 31.313  0.8698 
1 1 1 14  66  2  o 7  8.70001e+00 1.41812e+00 8.31595e+01 243.521 -3.99916e+00 -8.02862e+00 0.00000e+00 0.00000e+00 2.28081e+02 243.521 1.44921e+02 243.521 0.9425 
1 1 1 14  66  3  o 12 3.64781e+00 1.16019e+00 1.27033e+02 296.701 2.93695e+00  -5.83918e+00 0.00000e+00 0.00000e+00 3.99400e-01 296.701 1.26633e+02 116.701 0.9200 
1 1 1 14  66  4  o 1  5.89085e+00 1.43915e+00 1.02074e+02 91.454  -1.91514e-01 7.54468e+00  0.00000e+00 0.00000e+00 1.06299e+02 91.454  4.22501e+00 91.454  0.9312 
1 1 1 14  66  5  o 5  5.64101e+00 1.50332e+00 6.35768e+01 35.814  3.64599e+00  2.63096e+00  0.00000e+00 0.00000e+00 1.25094e+02 35.814  6.15167e+01 35.814  0.8802 
1 1 1 14  66  6  o 10 4.00755e+00 1.25027e+00 2.96317e+01 328.810 1.62821e+00  -9.85684e-01 0.00000e+00 0.00000e+00 7.41296e+01 328.810 4.44979e+01 328.810 0.6812 
1 1 1 14  66  7  o 7  5.64447e+00 1.48685e+00 1.07506e+02 106.703 -2.39228e+00 7.97247e+00  0.00000e+00 0.00000e+00 9.37212e+01 106.703 1.37845e+01 286.703 0.9379 
1 1 1 14  67  0  o 16 1.31343e+01 1.03989e+00 2.20958e+02 99.133  -6.75150e+00 4.19968e+01  0.00000e+00 0.00000e+00 2.71108e+02 99.133  5.01506e+01 99.133  0.9882 
1 1 1 14  67  1  o 1  9.20778e+00 1.27658e+00 1.91767e+02 326.768 2.01230e+01  -1.31843e+01 0.00000e+00 0.00000e+00 1.50173e+02 326.768 4.15937e+01 146.768 0.9790 
1 1 1 14  67  2  o 3  1.20729e+01 1.10694e+00 2.17159e+02 245.469 -1.71136e+01 -3.74987e+01 0.00000e+00 0.00000e+00 2.35424e+02 245.469 1.82648e+01 245.469 0.9878 
1 1 1 14  67  3  o 3  7.74143e+00 1.39009e+00 1.76960e+02 67.172  6.73929e+00  1.60099e+01  0.00000e+00 0.00000e+00 1.08364e+02 67.172  6.85956e+01 247.172 0.9708 
1 1 1 14  67  4  o 19 4.40509e+00 1.33834e+00 1.08527e+02 191.767 -6.43629e+00 -1.34073e+00 0.00000e+00 0.00000e+00 4.54686e+01 191.767 6.30579e+01 11.767  0.9205 
1 1 1 14  67  5  o 18 1.10036e+01 1.39623e+00 1.43439e+02 75.534  5.60596e+00  2.17300e+01  0.00000e+00 0.00000e+00 2.65172e+02 75.534  1.21733e+02 75.534  0.9775 
1 1 1 14  67  6  o 3  4.36607e+00 1.37395e+00 8.95943e+01 282.127 1.18966e+00  -5.53644e+00 0.00000e+00 0.00000e+00 6.08475e+01 282.127 2.87468e+01 102.127 0.9068 
1 1 1 14  67  7  o 5  4.84811e+00 1.44744e+00 5.18391e+01 140.816 -2.86957e+00 2.33902e+00  0.00000e+00 0.00000e+00 1.04963e+02 140.816 5.31241e+01 140.816 0.8510 
1 1 1 14  68  0  o 1  3.63530e+00 1.09902e+00 7.12070e+01 275.054 3.48301e-01  -3.93859e+00 0.00000e+00 0.00000e+00 4.75378e+01 275.054 2.36691e+01 95.054  0.8617 
1 1 1 14  68  1  o 2  4.67051e+00 1.30669e+00 1.10707e+02 142.285 -5.39577e+00 4.17263e+00  0.00000e+00 0.00000e+00 5.28709e+01 142.285 5.78361e+01 322.285 0.9235 
1 1 1 14  68  2  o 5  4.53177e+00 1.29545e+00 9.04295e+01 177.167 -5.29564e+00 2.62080e-01  0.00000e+00 0.00000e+00 6.43188e+01 177.167 2.61107e+01 357.167 0.8999 
1 1 1 14  68  3  o 3  6.48083e+00 1.50833e+00 1.50639e+02 0.012   1.16890e+01  2.38713e-03  0.00000e+00 0.00000e+00 8.45992e+01 0.012   6.60395e+01 180.012 0.9562 
1 1 1 14  68  4  o 19 6.52010e+00 1.50337e+00 1.00313e+02 233.734 -4.87551e+00 -6.64545e+00 0.00000e+00 0.00000e+00 1.31728e+02 233.734 3.14148e+01 233.734 0.9372 
1 1 1 14  68  5  o 8  4.30808e+00 1.30837e+00 3.09305e+01 236.586 -1.07301e+00 -1.62646e+00 0.00000e+00 0.00000e+00 8.18375e+01 236.586 5.09069e+01 236.586 0.6891 
1 1 1 14  68  6  o 12 1.13512e+01 1.54721e+00 1.88396e+02 13.291  2.62048e+01  6.19017e+00  0.00000e+00 0.00000e+00 2.34776e+02 13.291  4.63805e+01 13.291  0.9813 
1 1 1 14  68  7  o 8  3.47979e+00 1.18675e+00 4.46775e+01 241.033 -1.44238e+00 -2.60570e+00 0.00000e+00 0.00000e+00 6.22107e+01 241.033 1.75331e+01 241.033 0.8084 
1 1 1 14  69  0  o 4  4.15993e+00 1.14797e+00 8.90030e+01 299.812 2.81417e+00  -4.91152e+00 0.00000e+00 0.00000e+00 5.39493e+01 299.812 3.50537e+01 119.812 0.9067 
1 1 1 14  69  1  o 18 4.46761e+00 1.29222e+00 5.60380e+01 161.679 -3.08219e+00 1.02058e+00  0.00000e+00 0.00000e+00 8.40091e+01 161.679 2.79711e+01 161.679 0.8267 
1 1 1 14  69  2  o 4  4.04028e+00 1.23230e+00 8.34769e+01 253.901 -1.33645e+00 -4.63063e+00 0.00000e+00 0.00000e+00 5.27881e+01 253.901 3.06888e+01 73.901  0.8890 
1 1 1 14  69  3  o 10 4.11419e+00 1.25318e+00 4.36649e+01 141.972 -2.03741e+00 1.59341e+00  0.00000e+00 0.00000e+00 7.72032e+01 141.972 3.35383e+01 141.972 0.7741 
1 1 1 14  69  4  o 4  4.54085e+00 1.35075e+00 4.62259e+01 149.757 -2.57650e+00 1.50218e+00  0.00000e+00 0.00000e+00 9.31868e+01 149.757 4.69609e+01 149.757 0.8087 
1 1 1 14  69  5  o 10 7.63437e+00 1.62374e+00 1.15094e+02 351.091 1.04879e+01  -1.64397e+00 0.00000e+00 0.00000e+00 1.60820e+02 351.091 4.57266e+01 351.091 0.9517 
1 1 1 14  69  6  o 18 4.91540e+00 1.44050e+00 7.34529e+01 81.772  7.35617e-01  5.08705e+00  0.00000e+00 0.00000e+00 9.39406e+01 81.772  2.04877e+01 81.772  0.8965 
1 1 1 14  69  7  o 12 4.53936e+00 1.37896e+00 5.85193e+01 227.128 -2.93943e+00 -3.16630e+00 0.00000e+00 0.00000e+00 9.23469e+01 227.128 3.38276e+01 227.128 0.8748 
1 1 1 14  70  0  o 1  4.77344e+00 1.25852e+00 1.21175e+02 80.668  1.24124e+00  7.55326e+00  0.00000e+00 0.00000e+00 4.74312e+01 80.668  7.37434e+01 260.668 0.9322 
1 1 1 14  70  1  o 10 4.61999e+00 1.29504e+00 1.39585e+02 190.322 -8.69493e+00 -1.58353e+00 0.00000e+00 0.00000e+00 2.53372e+01 190.322 1.14248e+02 10.322  0.9416 
1 1 1 14  70  2  o 7  9.50429e+00 1.29364e+00 1.76026e+02 85.949  1.63709e+00  2.31155e+01  0.00000e+00 0.00000e+00 1.76600e+02 85.949  5.74389e-01 85.949  0.9782 
1 1 1 14  70  3  o 3  1.11207e+01 1.25618e+00 1.63064e+02 315.568 1.95019e+01  -1.91192e+01 0.00000e+00 0.00000e+00 2.51114e+02 315.568 8.80500e+01 315.568 0.9815 
1 1 1 14  70  4  o 1  4.45475e+00 1.32361e+00 7.81759e+01 88.352  1.50254e-01  5.22254e+00  0.00000e+00 0.00000e+00 7.37298e+01 88.352  4.44612e+00 268.352 0.8983 
1 1 1 14  70  5  o 15 4.00762e+00 1.27088e+00 7.08952e+01 81.954  6.22311e-01  4.40248e+00  0.00000e+00 0.00000e+00 6.28180e+01 81.954  8.07712e+00 261.954 0.8787 
1 1 1 14  70  6  o 11 6.11392e+00 1.59868e+00 9.14952e+01 325.804 5.82487e+00  -3.95798e+00 0.00000e+00 0.00000e+00 1.23517e+02 325.804 3.20221e+01 325.804 0.9260 
1 1 1 14  70  7  o 14 5.99239e+00 1.62687e+00 1.07559e+02 187.305 -8.39747e+00 -1.07652e+00 0.00000e+00 0.00000e+00 1.06159e+02 187.305 1.39980e+00 7.305   0.9389 
1 1 1 14  71  0  o 4  5.84199e+00 1.36254e+00 6.09264e+01 83.768  5.05433e-01  4.62881e+00  0.00000e+00 0.00000e+00 1.34884e+02 83.768  7.39580e+01 83.768  0.8848 
1 1 1 14  71  1  o 18 5.01772e+00 1.35614e+00 1.14265e+02 319.299 5.77135e+00  -4.96435e+00 0.00000e+00 0.00000e+00 6.29552e+01 319.299 5.13100e+01 139.299 0.9318 
1 1 1 14  71  2  o 11 5.73402e+00 1.39155e+00 1.18911e+02 178.335 -9.02262e+00 2.62263e-01  0.00000e+00 0.00000e+00 8.61104e+01 178.335 3.28010e+01 358.335 0.9429 
1 1 1 14  71  3  o 19 5.26257e+00 1.41891e+00 1.34512e+02 208.916 -8.37810e+00 -4.62796e+00 0.00000e+00 0.00000e+00 5.44015e+01 208.916 8.01101e+01 28.916  0.9462 
1 1 1 14  71  4  o 11 8.12569e+00 1.50426e+00 1.43485e+02 24.168  1.34225e+01  6.02324e+00  0.00000e+00 0.00000e+00 1.54221e+02 24.168  1.07358e+01 24.168  0.9654 
1 1 1 14  71  5  o 4  4.13157e+00 1.30367e+00 8.89988e+01 179.346 -5.55061e+00 6.33170e-02  0.00000e+00 0.00000e+00 5.29068e+01 179.346 3.60919e+01 359.346 0.9048 
1 1 1 14  71  6  o 10 5.40912e+00 1.52815e+00 1.05832e+02 337.894 7.43308e+00  -3.01916e+00 0.00000e+00 0.00000e+00 8.62939e+01 337.894 1.95377e+01 157.894 0.9354 
1 1 1 14  71  7  o 18 3.46490e+00 1.17431e+00 5.26528e+01 197.538 -3.38310e+00 -1.06915e+00 0.00000e+00 0.00000e+00 5.83500e+01 197.538 5.69721e+00 197.538 0.8436 
1 1 1 14  72  0  o 17 4.22707e+00 1.18352e+00 1.21555e+02 329.030 6.65580e+00  -3.99448e+00 0.00000e+00 0.00000e+00 2.78510e+01 329.030 9.37042e+01 149.030 0.9332 
1 1 1 14  72  1  o 6  1.40342e+01 1.01777e+00 1.94069e+02 74.281  1.26220e+01  4.48480e+01  0.00000e+00 0.00000e+00 3.32042e+02 74.281  1.37973e+02 74.281  0.9892 
1 1 1 14  72  2  o 7  5.51570e+00 1.42571e+00 7.03768e+01 258.450 -1.03058e+00 -5.04303e+00 0.00000e+00 0.00000e+00 1.17144e+02 258.450 4.67674e+01 258.450 0.8967 
1 1 1 14  72  3  o 1  4.45390e+00 1.18877e+00 8.41195e+01 254.525 -1.65968e+00 -5.99491e+00 0.00000e+00 0.00000e+00 7.05686e+01 254.525 1.35509e+01 74.525  0.9157 
1 1 1 14  72  4  o 4  3.87198e+00 1.22108e+00 9.27323e+01 147.274 -4.91307e+00 3.15732e+00  0.00000e+00 0.00000e+00 4.09327e+01 147.274 5.17996e+01 327.274 0.9098 
1 1 1 14  72  5  o 7  8.02500e+00 1.57157e+00 1.32295e+02 341.769 1.29708e+01  -4.27247e+00 0.00000e+00 0.00000e+00 1.60917e+02 341.769 2.86212e+01 341.769 0.9627 
1 1 1 14  72  6  o 18 8.19363e+00 1.61680e+00 1.26083e+02 5.774   1.37122e+01  1.38662e+00  0.00000e+00 0.00000e+00 1.73467e+02 5.774   4.73839e+01 5.774   0.9630 
1 1 1 14  72  7  o 12 5.69838e+00 1.59652e+00 8.85685e+01 149.404 -5.77621e+00 3.41551e+00  0.00000e+00 0.00000e+00 1.10952e+02 149.404 2.23835e+01 149.404 0.9221 
1 1 1 14  73  0  f 0  5.41568e+00 1.31736e+00 9.45760e+01 21.324  6.88062e+00  2.68600e+00  0.00000e+00 0.00000e+00 9.60741e+01 21.324  1.49812e+00 21.324  0.9296 
1 1 1 14  73  1  o 3  4.81151e+00 1.28692e+00 8.90487e+01 185.175 -6.25072e+00 -5.66096e-01 0.00000e+00 0.00000e+00 7.80240e+01 185.175 1.10246e+01 5.175   0.9164 
1 1 1 14  73  2  o 18 3.81742e+00 1.17603e+00 3.41776e+01 340.303 1.97836e+00  -7.08245e-01 0.00000e+00 0.00000e+00 6.91042e+01 340.303 3.49267e+01 340.303 0.7137 
1 1 1 14  73  3  o 10 3.55976e+00 1.14820e+00 6.20528e+01 43.771  2.60033e+00  2.49106e+00  0.00000e+00 0.00000e+00 5.21817e+01 43.771  9.87112e+00 223.770 0.8462 
1 1 1 14  73  4  f 0  4.12127e+00 1.28443e+00 5.71914e+01 114.965 -1.54681e+00 3.32242e+00  0.00000e+00 0.00000e+00 7.55877e+01 114.965 1.83963e+01 114.965 0.8493 
1 1 1 14  73  5  o 10 5.82860e+00 1.47594e+00 6.49916e+01 22.296  5.04958e+00  2.07054e+00  0.00000e+00 0.00000e+00 1.34735e+02 22.296  6.97433e+01 22.296  0.9030 
1 1 1 14  73  6  o 13 4.33951e+00 1.34288e+00 9.22643e+01 134.979 -4.46752e+00 4.47081e+00  0.00000e+00 0.00000e+00 5.87846e+01 134.979 3.34797e+01 314.979 0.9171 
1 1 1 14  73  7  o 14 5.69772e+00 1.56922e+00 9.42626e+01 202.470 -6.94254e+00 -2.87140e+00 0.00000e+00 0.00000e+00 1.07077e+02 202.470 1.28142e+01 202.470 0.9308 
1 1 1 14  74  0  o 15 4.53607e+00 1.27255e+00 6.92652e+01 17.809  4.42236e+00  1.42064e+00  0.00000e+00 0.00000e+00 8.26302e+01 17.809  1.33650e+01 17.809  0.8844 
1 1 1 14  74  1  o 11 3.26100e+00 1.07669e+00 4.99997e+01 72.652  8.40442e-01  2.69045e+00  0.00000e+00 0.00000e+00 4.82858e+01 72.652  1.71392e+00 252.652 0.7956 
1 1 1 14  74  2  f 0  5.42068e+00 1.32655e+00 7.40958e+01 335.353 5.26761e+00  -2.41688e+00 0.00000e+00 0.00000e+00 1.12663e+02 335.353 3.85668e+01 335.353 0.9091 
1 1 1 14  74  3  o 11 9.80239e+00 1.33156e+00 1.77914e+02 149.523 -2.24868e+01 1.32337e+01  0.00000e+00 0.00000e+00 1.86551e+02 149.523 8.63622e+00 149.523 0.9806 
1 1 1 14  74  4  o 13 9.72772e+00 1.42202e+00 1.56524e+02 112.607 -8.14016e+00 1.95489e+01  0.00000e+00 0.00000e+00 2.03612e+02 112.607 4.70877e+01 112.607 0.9761 
1 1 1 14  74  5  o 11 3.41878e+00 1.12525e+00 3.73547e+01 163.420 -2.39610e+00 7.13398e-01  0.00000e+00 0.00000e+00 6.18706e+01 163.420 2.45159e+01 163.420 0.7650 
1 1 1 14  74  6  o 4  4.84183e+00 1.42482e+00 7.36213e+01 344.387 5.29163e+00  -1.47878e+00 0.00000e+00 0.00000e+00 9.24246e+01 344.387 1.88033e+01 344.387 0.9037 
1 1 1 14  74  7  o 2  3.78546e+00 1.24121e+00 4.14777e+01 354.480 3.08499e+00  -2.98131e-01 0.00000e+00 0.00000e+00 7.59145e+01 354.480 3.44368e+01 354.480 0.8171 
1 1 1 14  75  0  o 19 3.00421e+00 1.00264e+00 2.67738e+01 45.926  1.06590e+00  1.10093e+00  0.00000e+00 0.00000e+00 4.19170e+01 45.926  1.51432e+01 45.926  0.6040 
1 1 1 14  75  1  o 12 3.58316e+00 1.12730e+00 3.88345e+01 113.663 -9.30278e-01 2.12291e+00  0.00000e+00 0.00000e+00 6.20828e+01 113.663 2.32484e+01 113.663 0.7436 
1 1 1 14  75  2  o 3  6.82905e+00 1.45373e+00 8.61860e+01 347.785 7.89831e+00  -1.70988e+00 0.00000e+00 0.00000e+00 1.55995e+02 347.785 6.98091e+01 347.785 0.9359 
1 1 1 14  75  3  o 15 1.01937e+01 1.31093e+00 1.66304e+02 239.703 -1.28516e+01 -2.19958e+01 0.00000e+00 0.00000e+00 2.12452e+02 239.703 4.61483e+01 239.703 0.9802 
1 1 1 14  75  4  o 9  5.20221e+00 1.46745e+00 1.41218e+02 90.715  -1.27878e-01 1.02394e+01  0.00000e+00 0.00000e+00 4.61578e+01 90.715  9.50604e+01 270.715 0.9498 
1 1 1 14  75  5  o 3  3.62356e+00 1.16066e+00 5.74002e+01 61.871  1.92518e+00  3.60111e+00  0.00000e+00 0.00000e+00 6.17191e+01 61.871  4.31893e+00 61.871  0.8667 
1 1 1 14  75  6  o 19 5.03358e+00 1.39491e+00 1.06823e+02 42.388  6.23279e+00  5.68886e+00  0.00000e+00 0.00000e+00 7.24513e+01 42.388  3.43718e+01 222.388 0.9387 
1 1 1 14  76  0  o 6  1.05406e+01 1.27254e+00 2.22653e+02 254.202 -9.53160e+00 -3.36896e+01 0.00000e+00 0.00000e+00 1.70527e+02 254.202 5.21256e+01 74.202  0.9856 
1 1 1 14  76  1  o 1  1.22105e+01 1.11648e+00 2.20393e+02 79.816  8.43480e+00  4.69554e+01  0.00000e+00 0.00000e+00 2.37098e+02 79.816  1.67056e+01 79.816  0.9895 
1 1 1 14  76  2  o 11 9.17481e+00 1.33831e+00 1.15221e+02 332.150 1.39668e+01  -7.37934e+00 0.00000e+00 0.00000e+00 2.21168e+02 332.150 1.05948e+02 332.150 0.9678 
1 1 1 14  76  3  o 5  4.43375e+00 1.29829e+00 6.53228e+01 219.405 -3.41429e+00 -2.80503e+00 0.00000e+00 0.00000e+00 8.21956e+01 219.405 1.68728e+01 219.405 0.8779 
1 1 1 14  76  4  o 9  8.02048e+00 1.46548e+00 1.64995e+02 71.161  6.30732e+00  1.84866e+01  0.00000e+00 0.00000e+00 1.31194e+02 71.161  3.38014e+01 251.161 0.9741 
1 1 1 14  76  5  o 6  3.83240e+00 1.24093e+00 7.73831e+01 111.193 -1.94589e+00 5.01849e+00  0.00000e+00 0.00000e+00 5.36481e+01 111.193 2.37350e+01 291.193 0.9016 
1 1 1 14  76  6  o 18 5.32823e+00 1.41462e+00 8.29555e+01 282.107 1.47860e+00  -6.89311e+00 0.00000e+00 0.00000e+00 1.04218e+02 282.107 2.12623e+01 282.107 0.9261 
1 1 1 14  77  0  o 12 9.43533e+00 1.30001e+00 1.67354e+02 188.351 -2.39430e+01 -3.51480e+00 0.00000e+00 0.00000e+00 1.82203e+02 188.351 1.48490e+01 188.351 0.9791 
1 1 1 14  77  1  o 4  6.55530e+00 1.37583e+00 1.07197e+02 32.951  8.56522e+00  5.55194e+00  0.00000e+00 0.00000e+00 1.28485e+02 32.951  2.12882e+01 32.951  0.9497 
1 1 1 14  77  2  o 16 9.27414e+00 1.38418e+00 1.58678e+02 122.453 -1.13109e+01 1.77865e+01  0.00000e+00 0.00000e+00 1.84152e+02 122.453 2.54732e+01 122.453 0.9760 
1 1 1 14  77  3  o 5  9.40198e+00 1.42846e+00 1.55023e+02 288.948 6.79817e+00  -1.98020e+01 0.00000e+00 0.00000e+00 1.92617e+02 288.948 3.75938e+01 288.948 0.9758 
1 1 1 14  77  4  o 12 3.48514e+00 1.13875e+00 3.46334e+01 173.083 -2.39916e+00 2.91070e-01  0.00000e+00 0.00000e+00 6.51878e+01 173.083 3.05544e+01 173.083 0.7556 
1 1 1 14  77  5  o 2  4.33712e+00 1.31310e+00 5.60573e+01 188.667 -4.14643e+00 -6.32070e-01 0.00000e+00 0.00000e+00 8.71086e+01 188.667 3.10513e+01 188.667 0.8706 
1 1 1 14  77  6  o 8  3.37602e+00 1.13884e+00 3.76147e+01 309.062 1.77607e+00  -2.18845e+00 0.00000e+00 0.00000e+00 6.42504e+01 309.062 2.66357e+01 309.062 0.7956 
1 1 1 14  78  0  o 7  7.45440e+00 1.45230e+00 1.37517e+02 174.886 -1.39847e+01 1.25163e+00  0.00000e+00 0.00000e+00 1.34246e+02 174.886 3.27112e+00 354.886 0.9637 
1 1 1 14  78  1  o 9  1.17561e+01 1.06940e+00 1.92659e+02 354.916 4.08734e+01  -3.63641e+00 0.00000e+00 0.00000e+00 2.46853e+02 354.916 5.41936e+01 354.916 0.9877 
1 1 1 14  78  2  o 19 4.30737e+00 1.23854e+00 4.05416e+01 227.276 -1.97339e+00 -2.13677e+00 0.00000e+00 0.00000e+00 9.04358e+01 227.276 4.98942e+01 227.276 0.8030 
1 1 1 14  78  3  o 16 4.21563e+00 1.26417e+00 5.53790e+01 248.773 -1.47380e+00 -3.79436e+00 0.00000e+00 0.00000e+00 8.29522e+01 248.773 2.75732e+01 248.773 0.8662 
1 1 1 14  78  4  o 18 7.49895e+00 1.44383e+00 1.32853e+02 322.493 1.15093e+01  -8.83359e+00 0.00000e+00 0.00000e+00 1.41357e+02 322.493 8.50315e+00 322.493 0.9649 
1 1 1 14  78  5  o 10 4.69488e+00 1.39316e+00 1.02322e+02 25.550  6.80741e+00  3.25432e+00  0.00000e+00 0.00000e+00 6.33988e+01 25.550  3.89228e+01 205.550 0.9312 
1 1 1 14  78  6  o 18 9.82694e+00 1.66640e+00 1.66289e+02 135.238 -1.53031e+01 1.51763e+01  0.00000e+00 0.00000e+00 1.97563e+02 135.238 3.12743e+01 135.238 0.9765 
1 1 1 14  79  0  o 7  3.67563e+00 1.08765e+00 6.45701e+01 113.410 -1.68275e+00 3.88674e+00  0.00000e+00 0.00000e+00 5.66537e+01 113.410 7.91645e+00 293.410 0.8720 
1 1 1 14  79  1  o 13 3.35895e+00 1.09415e+00 3.33164e+01 32.154  1.76541e+00  1.10975e+00  0.00000e+00 0.00000e+00 5.70943e+01 32.154  2.37779e+01 32.154  0.7113 
1 1 1 14  79  2  o 16 3.77735e+00 1.18898e+00 6.14221e+01 327.121 3.54541e+00  -2.29180e+00 0.00000e+00 0.00000e+00 6.32154e+01 327.121 1.79332e+00 327.121 0.8715 
1 1 1 14  79  3  o 11 4.33895e+00 1.26707e+00 4.73859e+01 44.106  2.64505e+00  2.56381e+00  0.00000e+00 0.00000e+00 9.23272e+01 44.106  4.49414e+01 44.106  0.8502 
1 1 1 14  79  4  o 6  5.56985e+00 1.35078e+00 5.96765e+01 203.109 -5.01401e+00 -2.13962e+00 0.00000e+00 0.00000e+00 1.30865e+02 203.109 7.11884e+01 203.109 0.9029 
1 1 1 14  79  5  o 4  5.26870e+00 1.46324e+00 1.45389e+02 128.773 -7.33639e+00 9.13333e+00  0.00000e+00 0.00000e+00 4.55704e+01 128.773 9.98181e+01 308.773 0.9563 
1 1 1 14  79  6  o 18 2.99502e+00 1.03650e+00 6.99458e+01 166.071 -5.10014e+00 1.26490e+00  0.00000e+00 0.00000e+00 3.21196e+01 166.071 3.78262e+01 346.071 0.8990 
1 1 1 14  80  0  o 10 3.13473e+00 1.03530e+00 5.30677e+01 188.450 -3.20829e+00 -4.76605e-01 0.00000e+00 0.00000e+00 4.49002e+01 188.450 8.16747e+00 8.450   0.8265 
1 1 1 14  80  1  o 7  4.02126e+00 1.21977e+00 8.49146e+01 209.148 -5.29105e+00 -2.95078e+00 0.00000e+00 0.00000e+00 5.40269e+01 209.148 3.08877e+01 29.148  0.9133 
1 1 1 14  80  2  o 6  6.36133e+00 1.40213e+00 1.07292e+02 84.807  9.83993e-01  1.08263e+01  0.00000e+00 0.00000e+00 1.22136e+02 84.807  1.48445e+01 84.807  0.9528 
1 1 1 14  80  3  o 18 3.94814e+00 1.23679e+00 7.76150e+01 206.146 -5.01119e+00 -2.45999e+00 0.00000e+00 0.00000e+00 5.77375e+01 206.146 1.98776e+01 26.146  0.9053 
1 1 1 14  80  4  o 13 6.80583e+00 1.46064e+00 1.41519e+02 302.482 7.68840e+00  -1.20769e+01 0.00000e+00 0.00000e+00 1.07115e+02 302.482 3.44044e+01 122.482 0.9644 
1 1 1 14  80  5  o 13 3.15900e+00 1.07089e+00 5.18095e+01 152.737 -3.36660e+00 1.73484e+00  0.00000e+00 0.00000e+00 5.05104e+01 152.737 1.29913e+00 332.737 0.8548 
1 1 1 14  81  0  o 6  5.16454e+00 1.30789e+00 9.59634e+01 213.450 -6.95238e+00 -4.59305e+00 0.00000e+00 0.00000e+00 8.71617e+01 213.450 8.80169e+00 33.450  0.9379 
1 1 1 14  81  1  o 7  4.14562e+00 1.22241e+00 1.16280e+02 286.469 2.53739e+00  -8.58307e+00 0.00000e+00 0.00000e+00 3.14903e+01 286.469 8.47899e+01 106.469 0.9424 
1 1 1 14  81  2  o 8  4.42498e+00 1.28405e+00 3.97660e+01 119.120 -1.41827e+00 2.54609e+00  0.00000e+00 0.00000e+00 9.47768e+01 119.120 5.50109e+01 119.120 0.8035 
1 1 1 14  81  3  o 3  8.12299e+00 1.47190e+00 1.12306e+02 270.589 1.41391e-01  -1.37531e+01 0.00000e+00 0.00000e+00 1.83820e+02 270.589 7.15139e+01 270.589 0.9629 
1 1 1 14  81  4  o 4  4.73419e+00 1.36630e+00 1.21831e+02 87.646  3.93870e-01  9.57975e+00  0.00000e+00 0.00000e+00 4.78375e+01 87.646  7.39935e+01 267.646 0.9463 
1 1 1 14  81  5  o 10 3.51688e+00 1.15678e+00 1.64824e+01 273.075 6.51623e-02  -1.21284e+00 0.00000e+00 0.00000e+00 5.24342e+01 273.075 3.59518e+01 273.075 0.5173 
1 1 1 14  82  0  o 10 3.92358e+00 1.18537e+00 8.06745e+01 157.820 -5.63354e+00 2.29672e+00  0.00000e+00 0.00000e+00 5.48164e+01 157.820 2.58581e+01 337.820 0.9136 
1 1 1 14  82  1  o 7  8.74379e+00 1.21229e+00 1.33621e+02 275.002 1.78748e+00  -2.04213e+01 0.00000e+00 0.00000e+00 1.88872e+02 275.002 5.52504e+01 275.002 0.9753 
1 1 1 14  82  2  o 17 9.90547e+00 1.26963e+00 1.60799e+02 28.223  2.46574e+01  1.32338e+01  0.00000e+00 0.00000e+00 2.07213e+02 28.223  4.64141e+01 28.223  0.9820 
1 1 1 14  82  3  o 13 3.84964e+00 1.18477e+00 4.17425e+01 186.435 -3.04245e+00 -3.43138e-01 0.00000e+00 0.00000e+00 7.69305e+01 186.435 3.51879e+01 186.435 0.8144 
1 1 1 14  82  4  o 11 3.53056e+00 1.15218e+00 4.90975e+01 260.548 -6.10645e-01 -3.66780e+00 0.00000e+00 0.00000e+00 6.47628e+01 260.548 1.56653e+01 260.548 0.8517 
1 1 1 14  82  5  o 1  5.18464e+00 1.42019e+00 1.16381e+02 275.818 1.04323e+00  -1.02385e+01 0.00000e+00 0.00000e+00 7.01856e+01 275.818 4.61953e+01 95.818  0.9501 
1 1 1 14  83  0  o 11 5.90771e+00 1.22632e+00 5.07831e+01 257.716 -1.17300e+00 -5.38716e+00 0.00000e+00 0.00000e+00 1.51042e+02 257.716 1.00259e+02 257.716 0.9041 
1 1 1 14  83  1  o 19 3.77222e+00 1.17283e+00 4.73261e+01 315.697 2.43573e+00  -2.37718e+00 0.00000e+00 0.00000e+00 7.18905e+01 315.697 2.45644e+01 315.697 0.8359 
1 1 1 14  83  2  f 0  7.38076e+00 1.38180e+00 1.06048e+02 4.925   1.23776e+01  1.06662e+00  0.00000e+00 0.00000e+00 1.61653e+02 4.925   5.56049e+01 4.925   0.9589 
1 1 1 14  83  3  o 5  7.38077e+00 1.38914e+00 1.18259e+02 145.796 -1.26709e+01 8.61229e+00  0.00000e+00 0.00000e+00 1.51767e+02 145.796 3.35085e+01 145.796 0.9668 
1 1 1 14  83  4  o 14 8.98501e+00 1.44600e+00 1.49625e+02 252.089 -6.67300e+00 -2.06464e+01 0.00000e+00 0.00000e+00 1.82569e+02 252.089 3.29432e+01 252.089 0.9767 
1 1 1 14  83  5  o 6  4.35346e+00 1.34947e+00 9.18610e+01 27.217  6.37242e+00  3.27738e+00  0.00000e+00 0.00000e+00 6.10083e+01 27.217  3.08527e+01 207.217 0.9273 
1 1 1 14  84  0  o 3  3.54650e+00 1.09631e+00 9.00367e+01 24.957  6.01879e+00  2.80113e+00  0.00000e+00 0.00000e+00 3.33981e+01 24.957  5.66386e+01 204.957 0.9213 
1 1 1 14  84  1  o 15 5.10915e+00 1.28294e+00 1.00015e+02 231.718 -5.45555e+00 -6.91244e+00 0.00000e+00 0.00000e+00 8.17879e+01 231.718 1.82270e+01 51.718  0.9414 
1 1 1 14  84  2  o 8  4.11122e+00 1.21047e+00 4.01348e+01 36.779  2.51537e+00  1.88031e+00  0.00000e+00 0.00000e+00 8.73332e+01 36.779  4.71984e+01 36.779  0.8199 
1 1 1 14  84  3  o 9  3.60854e+00 1.11447e+00 3.57089e+01 118.922 -1.38380e+00 2.50446e+00  0.00000e+00 0.00000e+00 7.33975e+01 118.922 3.76887e+01 118.922 0.7992 
1 1 1 14  84  4  o 18 4.96347e+00 1.40446e+00 1.19606e+02 284.906 2.64354e+00  -9.93125e+00 0.00000e+00 0.00000e+00 5.88548e+01 284.906 6.07516e+01 104.906 0.9500 
1 1 1 14  85  0  o 16 4.51466e+00 1.22242e+00 6.21719e+01 302.712 2.79744e+00  -4.35537e+00 0.00000e+00 0.00000e+00 9.08403e+01 302.712 2.86684e+01 302.712 0.8973 
1 1 1 14  85  1  o 18 3.49840e+00 1.09666e+00 4.69991e+01 207.207 -3.07283e+00 -1.57966e+00 0.00000e+00 0.00000e+00 6.38861e+01 207.207 1.68870e+01 207.207 0.8387 
1 1 1 14  85  2  o 18 2.80612e+00 9.54509e-01 4.35903e+01 355.169 3.14631e+00  -2.65931e-01 0.00000e+00 0.00000e+00 4.35130e+01 355.169 7.72167e-02 175.169 0.8210 
1 1 1 14  85  3  o 19 4.00755e+00 1.22380e+00 7.85853e+01 189.279 -6.12312e+00 -1.00035e+00 0.00000e+00 0.00000e+00 6.01764e+01 189.279 1.84089e+01 9.279   0.9154 
1 1 1 14  85  4  o 18 3.25292e+00 1.07589e+00 3.60112e+01 339.348 2.53518e+00  -9.55558e-01 0.00000e+00 0.00000e+00 6.07274e+01 339.348 2.47162e+01 339.348 0.7860 
1 1 1 14  86  0  o 8  2.94225e+00 9.73363e-01 4.64619e+01 109.480 -1.18679e+00 3.35504e+00  0.00000e+00 0.00000e+00 4.73232e+01 109.480 8.61311e-01 109.480 0.8441 
1 1 1 14  86  1  o 5  5.24820e+00 1.29261e+00 4.34017e+01 11.003  4.21043e+00  8.18652e-01  0.00000e+00 0.00000e+00 1.29860e+02 11.003  8.64582e+01 11.003  0.8738 
1 1 1 14  86  2  o 1  5.51771e+00 1.31599e+00 1.32018e+02 314.908 9.32492e+00  -9.35478e+00 0.00000e+00 0.00000e+00 6.84921e+01 314.908 6.35263e+01 134.908 0.9614 
1 1 1 14  86  3  o 17 3.74784e+00 1.16452e+00 3.31651e+01 340.849 2.66324e+00  -9.24892e-01 0.00000e+00 0.00000e+00 7.96035e+01 340.849 4.64384e+01 340.849 0.7957 
1 1 1 14  86  4  o 9  3.63480e+00 1.13952e+00 6.06149e+01 204.222 -4.55077e+00 -2.04730e+00 0.00000e+00 0.00000e+00 6.21929e+01 204.222 1.57801e+00 204.222 0.8932 
1 1 1 14  87  0  o 12 2.83873e+00 9.53534e-01 4.57804e+01 312.541 2.17393e+00  -2.36900e+00 0.00000e+00 0.00000e+00 4.26051e+01 312.541 3.17527e+00 132.541 0.8247 
1 1 1 14  87  1  o 5  4.39168e+00 1.09253e+00 4.01120e+01 324.176 3.17491e+00  -2.29187e+00 0.00000e+00 0.00000e+00 1.02584e+02 324.176 6.24719e+01 324.176 0.8602 
1 1 1 14  87  2  f 0  3.55540e+00 1.11071e+00 5.83140e+01 233.061 -2.84554e+00 -3.78456e+00 0.00000e+00 0.00000e+00 6.08446e+01 233.061 2.53052e+00 233.061 0.8869 
1 1 1 14  87  3  o 4  5.41153e+00 1.42347e+00 1.25201e+02 34.150  9.92193e+00  6.73022e+00  0.00000e+00 0.00000e+00 7.06616e+01 34.150  5.45395e+01 214.150 0.9573 
1 1 1 14  87  4  o 2  2.96732e+00 9.83924e-01 3.76864e+01 130.813 -2.08570e+00 2.41518e+00  0.00000e+00 0.00000e+00 5.46929e+01 130.813 1.70064e+01 130.813 0.8232 
1 1 1 14  88  0  f 0  3.82485e+00 1.16060e+00 4.09147e+01 90.471  -2.85978e-02 3.47715e+00  0.00000e+00 0.00000e+00 8.03379e+01 90.471  3.94233e+01 90.471  0.8399 
1 1 1 14  88  1  o 10 7.27150e+00 1.40490e+00 1.07630e+02 325.498 1.11643e+01  -7.67347e+00 0.00000e+00 0.00000e+00 1.56632e+02 325.498 4.90023e+01 325.498 0.9624 
1 1 1 14  88  2  o 12 3.51466e+00 1.09577e+00 3.13364e+01 281.804 5.11302e-01  -2.44665e+00 0.00000e+00 0.00000e+00 7.02405e+01 281.804 3.89041e+01 281.804 0.7649 
1 1 1 14  88  3  o 14 3.31052e+00 1.06571e+00 7.20086e+01 177.568 -5.85294e+00 2.48562e-01  0.00000e+00 0.00000e+00 4.18709e+01 177.568 3.01377e+01 357.568 0.9101 
1 1 1 14  89  0  o 9  6.67171e+00 1.34216e+00 6.44655e+01 322.603 6.50733e+00  -4.97467e+00 0.00000e+00 0.00000e+00 1.71379e+02 322.603 1.06914e+02 322.603 0.9368 
1 1 1 14  89  1  f 0  4.40489e+00 1.23067e+00 1.17140e+02 241.169 -4.97620e+00 -9.04014e+00 0.00000e+00 0.00000e+00 4.08891e+01 241.169 7.62514e+01 61.169  0.9502 
1 1 1 14  89  2  o 1  5.54274e+00 1.34436e+00 9.27551e+01 81.072  1.48386e+00  9.44582e+00  0.00000e+00 0.00000e+00 1.05338e+02 81.072  1.25825e+01 81.072  0.9462 
1 1 1 14  89  3  o 17 3.73482e+00 1.16461e+00 3.76918e+01 306.304 1.90129e+00  -2.58791e+00 0.00000e+00 0.00000e+00 7.86665e+01 306.304 4.09747e+01 306.304 0.8245 
1 1 1 14  90  0  o 13 3.82193e+00 1.15588e+00 3.48109e+01 30.116  2.64646e+00  1.53508e+00  0.00000e+00 0.00000e+00 8.25957e+01 30.116  4.77847e+01 30.116  0.8143 
1 1 1 14  90  1  o 1  2.55361e+00 8.81085e-01 4.51568e+01 260.536 -5.52510e-01 -3.31465e+00 0.00000e+00 0.00000e+00 3.51785e+01 260.536 9.97827e+00 80.537  0.8335 
1 1 1 14  90  2  f 0  5.99280e+00 1.37425e+00 5.85218e+01 48.544  4.42781e+00  5.01255e+00  0.00000e+00 0.00000e+00 1.50106e+02 48.544  9.15841e+01 48.544  0.9219 
1 1 1 14  90  3  o 6  3.16566e+00 1.04744e+00 8.09068e+01 246.164 -2.60212e+00 -5.88992e+00 0.00000e+00 0.00000e+00 2.89631e+01 246.164 5.19436e+01 66.165  0.9187 
1 1 1 14  91  0  o 7  7.93817e+00 1.26694e+00 1.41034e+02 266.507 -1.37567e+00 -2.25359e+01 0.00000e+00 0.00000e+00 1.51654e+02 266.507 1.06197e+01 266.507 0.9776 
1 1 1 14  91  1  o 9  7.11815e+00 1.38147e+00 1.19957e+02 158.729 -1.46718e+01 5.71175e+00  0.00000e+00 0.00000e+00 1.39979e+02 158.729 2.00220e+01 158.729 0.9677 
1 1 1 14  91  2  o 17 4.06743e+00 1.20433e+00 6.20834e+01 355.368 5.79666e+00  -4.69609e-01 0.00000e+00 0.00000e+00 7.75649e+01 355.368 1.54816e+01 355.368 0.9094 
1 1 1 14  92  0  o 15 4.79040e+00 1.26624e+00 6.48214e+01 144.755 -5.48278e+00 3.87409e+00  0.00000e+00 0.00000e+00 1.01752e+02 144.755 3.69307e+01 144.755 0.9222 
1 1 1 14  92  1  o 12 2.65932e+00 9.07965e-01 4.02477e+01 320.045 2.36990e+00  -1.98541e+00 0.00000e+00 0.00000e+00 4.16733e+01 320.045 1.42560e+00 320.045 0.8165 
1 1 1 14  92  2  o 14 2.76601e+00 9.38848e-01 3.77741e+01 242.320 -1.52305e+00 -2.90350e+00 0.00000e+00 0.00000e+00 4.87383e+01 242.320 1.09642e+01 242.320 0.8287 
1 1 1 14  93  0  o 19 3.34525e+00 1.05287e+00 5.67544e+01 130.784 -3.26792e+00 3.78809e+00  0.00000e+00 0.00000e+00 5.59148e+01 130.784 8.39610e-01 310.784 0.8935 
1 1 1 14  93  1  o 6  2.70321e+00 9.15593e-01 4.04212e+01 251.242 -1.13105e+00 -3.33037e+00 0.00000e+00 0.00000e+00 4.54261e+01 251.242 5.00490e+00 251.242 0.8420 
1 1 1 14  94  0  o 5  3.51416e+00 1.04527e+00 6.87164e+01 321.757 5.36180e+00  -4.22582e+00 0.00000e+00 0.00000e+00 5.35972e+01 321.757 1.51192e+01 141.757 0.9235 
1 1 1 14  95  0  o 10 2.37721e+00 8.22904e-01 3.49341e+01 280.361 5.49727e-01  -3.00679e+00 0.00000e+00 0.00000e+00 3.79814e+01 280.361 3.04728e+00 280.361 0.8141 
1 1 1 15  0   0  f 0  2.81414e+00 1.92494e+00 1.34949e+01 180.000 -1.58760e-01 0.00000e+00  0.00000e+00 0.00000e+00 3.44414e+00 180.000 1.00508e+01 0.000   0.1574 
1 1 1 15  0   1  o 19 1.67375e+01 1.60688e+00 2.58252e+02 0.000   1.95431e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.82030e+02 0.000   1.23778e+02 0.000   1.0000 
1 1 1 15  0   2  o 18 1.03786e+01 2.57993e+00 1.35178e+02 180.000 -4.71528e+00 0.00000e+00  0.00000e+00 0.00000e+00 2.61990e+02 180.000 1.26812e+02 180.000 0.9998 
1 1 1 15  0   3  f 0  1.25165e+01 2.11793e+00 2.87995e+02 0.000   1.39535e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.91274e+02 0.000   9.67210e+01 180.000 1.0000 
1 1 1 15  0   4  o 11 1.83784e+01 1.70584e+00 3.25462e+02 180.000 -3.15142e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.78542e+02 180.000 5.30803e+01 180.000 1.0000 
1 1 1 15  0   5  o 4  1.03243e+01 2.70334e+00 1.88281e+02 0.000   7.04122e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.07332e+02 0.000   1.90513e+01 0.000   1.0000 
1 1 1 15  0   6  o 3  1.55605e+01 1.93424e+00 2.09554e+02 0.000   1.67680e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.86864e+02 0.000   1.77310e+02 0.000   1.0000 
1 1 1 15  0   7  o 4  4.10926e+00 2.58287e+00 8.85910e+01 180.000 -1.55046e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.53756e+01 180.000 3.32154e+01 0.000   0.9139 
1 1 1 15  0   8  o 4  4.58046e+00 2.80369e+00 6.94648e+01 180.000 -1.29208e+00 0.00000e+00  0.00000e+00 0.00000e+00 8.15166e+01 180.000 1.20518e+01 180.000 0.8597 
1 1 1 15  0   9  o 5  4.77855e+00 2.97326e+00 8.22326e+01 180.000 -1.47953e+00 0.00000e+00  0.00000e+00 0.00000e+00 8.29340e+01 180.000 7.01415e-01 180.000 0.9014 
1 1 1 15  1   0  o 11 9.36277e+00 1.61246e+00 1.61773e+02 323.888 9.13891e+00  -6.66712e+00 0.00000e+00 0.00000e+00 1.79979e+02 323.888 1.82055e+01 323.888 0.9547 
1 1 1 15  1   1  o 2  1.00729e+01 1.55321e+00 1.99743e+02 281.881 3.13704e+00  -1.49110e+01 0.00000e+00 0.00000e+00 1.72721e+02 281.881 2.70214e+01 101.881 0.9666 
1 1 1 15  1   2  o 17 1.91511e+01 1.12587e+00 3.31491e+02 194.382 -5.62414e+01 -1.44218e+01 0.00000e+00 0.00000e+00 3.95154e+02 194.382 6.36629e+01 194.382 0.9914 
1 1 1 15  1   3  o 2  4.87010e+00 1.45766e+00 9.40714e+01 326.135 2.99751e+00  -2.01157e+00 0.00000e+00 0.00000e+00 6.38123e+01 326.135 3.02591e+01 146.135 0.8466 
1 1 1 15  1   4  o 3  6.06966e+00 1.65902e+00 1.14686e+02 218.511 -4.54853e+00 -3.61947e+00 0.00000e+00 0.00000e+00 9.67421e+01 218.511 1.79439e+01 38.511  0.9093 
1 1 1 15  1   5  o 4  8.54863e+00 1.86796e+00 8.49709e+01 216.859 -4.30896e+00 -3.23046e+00 0.00000e+00 0.00000e+00 2.10374e+02 216.859 1.25403e+02 216.859 0.9016 
1 1 1 15  1   6  o 8  7.60980e+00 1.82878e+00 1.44942e+02 248.814 -3.17678e+00 -8.19613e+00 0.00000e+00 0.00000e+00 1.29605e+02 248.814 1.53375e+01 68.814  0.9413 
1 1 1 15  1   7  o 3  1.46213e+01 1.55060e+00 2.28485e+02 204.100 -3.06336e+01 -1.37029e+01 0.00000e+00 0.00000e+00 3.23635e+02 204.100 9.51497e+01 204.100 0.9850 
1 1 1 15  1   8  o 19 6.92771e+00 1.83276e+00 6.26530e+01 176.059 -3.86016e+00 2.65925e-01  0.00000e+00 0.00000e+00 1.65334e+02 176.059 1.02681e+02 176.059 0.8583 
1 1 1 15  1   9  o 1  7.36690e+00 1.95941e+00 1.75666e+02 334.655 9.61315e+00  -4.55329e+00 0.00000e+00 0.00000e+00 9.31987e+01 334.655 8.24671e+01 154.655 0.9518 
1 1 1 15  2   0  o 1  5.82616e+00 1.59332e+00 8.14287e+01 229.254 -2.33301e+00 -2.70793e+00 0.00000e+00 0.00000e+00 1.06768e+02 229.254 2.53395e+01 229.254 0.8449 
1 1 1 15  2   1  o 8  3.34035e+01 1.09012e+00 5.49270e+02 312.554 1.14216e+02  -1.24409e+02 0.00000e+00 0.00000e+00 7.24759e+02 312.554 1.75489e+02 312.554 0.9970 
1 1 1 15  2   2  o 3  2.67816e+01 1.05823e+00 4.29685e+02 105.020 -2.79965e+01 1.04340e+02  0.00000e+00 0.00000e+00 5.90592e+02 105.020 1.60908e+02 105.020 0.9954 
1 1 1 15  2   3  o 13 9.85088e+00 1.60075e+00 1.74948e+02 303.681 7.06394e+00  -1.05994e+01 0.00000e+00 0.00000e+00 1.87128e+02 303.681 1.21796e+01 303.681 0.9599 
1 1 1 15  2   4  o 19 5.05857e+00 1.50558e+00 1.23967e+02 203.552 -5.20433e+00 -2.26852e+00 0.00000e+00 0.00000e+00 5.17923e+01 203.552 7.21743e+01 23.552  0.9070 
1 1 1 15  2   5  o 14 6.70066e+00 1.74215e+00 1.86702e+02 29.436  8.63444e+00  4.87248e+00  0.00000e+00 0.00000e+00 5.67424e+01 29.436  1.29960e+02 209.436 0.9481 
1 1 1 15  2   6  o 15 1.29397e+01 1.50507e+00 1.52524e+02 292.452 7.19201e+00  -1.74046e+01 0.00000e+00 0.00000e+00 3.30085e+02 292.452 1.77561e+02 292.452 0.9731 
1 1 1 15  2   7  o 17 4.19580e+00 1.36910e+00 9.04962e+01 295.058 1.79894e+00  -3.84771e+00 0.00000e+00 0.00000e+00 4.98333e+01 295.058 4.06629e+01 115.058 0.8724 
1 1 1 15  2   8  o 19 7.55117e+00 1.90147e+00 8.00448e+01 139.359 -3.91679e+00 3.36195e+00  0.00000e+00 0.00000e+00 1.79665e+02 139.359 9.96202e+01 139.359 0.8970 
1 1 1 15  2   9  o 13 7.72837e+00 2.02174e+00 1.07211e+02 106.467 -1.85784e+00 6.28505e+00  0.00000e+00 0.00000e+00 1.65486e+02 106.467 5.82745e+01 106.467 0.9202 
1 1 1 15  3   0  o 12 2.14302e+01 1.03410e+00 3.15213e+02 278.052 9.04148e+00  -6.39082e+01 0.00000e+00 0.00000e+00 4.97730e+02 278.052 1.82517e+02 278.052 0.9922 
1 1 1 15  3   1  f 0  1.20334e+01 1.37462e+00 9.01658e+01 122.280 -4.74705e+00 7.51495e+00  0.00000e+00 0.00000e+00 3.43434e+02 122.280 2.53269e+02 122.280 0.9419 
1 1 1 15  3   2  o 1  6.59973e+00 1.68020e+00 6.01855e+01 175.409 -2.84580e+00 2.28504e-01  0.00000e+00 0.00000e+00 1.41552e+02 175.409 8.13666e+01 175.409 0.7987 
1 1 1 15  3   3  o 9  1.12452e+01 1.59208e+00 1.69059e+02 84.482  1.35623e+00  1.40391e+01  0.00000e+00 0.00000e+00 2.45969e+02 84.482  7.69100e+01 84.482  0.9639 
1 1 1 15  3   4  o 17 3.86680e+00 1.28422e+00 8.10360e+01 290.304 1.10232e+00  -2.97936e+00 0.00000e+00 0.00000e+00 4.07555e+01 290.304 4.02805e+01 110.304 0.8222 
1 1 1 15  3   5  o 14 1.06484e+01 1.75298e+00 9.03656e+01 170.472 -7.47704e+00 1.25498e+00  0.00000e+00 0.00000e+00 2.89716e+02 170.472 1.99350e+02 170.472 0.9315 
1 1 1 15  3   6  o 3  4.78560e+00 1.47473e+00 7.03379e+01 135.102 -2.31323e+00 2.30501e+00  0.00000e+00 0.00000e+00 8.15110e+01 135.102 1.11730e+01 135.102 0.8279 
1 1 1 15  3   7  o 2  1.17358e+01 1.74099e+00 2.05725e+02 81.306  3.27101e+00  2.13909e+01  0.00000e+00 0.00000e+00 2.33664e+02 81.306  2.79385e+01 81.306  0.9766 
1 1 1 15  3   8  o 16 6.74755e+00 1.85334e+00 1.16248e+02 108.776 -2.22168e+00 6.53517e+00  0.00000e+00 0.00000e+00 1.22915e+02 108.776 6.66646e+00 108.776 0.9244 
1 1 1 15  3   9  o 19 4.84018e+00 1.59466e+00 1.15991e+02 239.140 -2.97432e+00 -4.97767e+00 0.00000e+00 0.00000e+00 5.27386e+01 239.140 6.32526e+01 59.140  0.9091 
1 1 1 15  4   0  o 14 2.03771e+01 1.05774e+00 3.66272e+02 257.879 -1.48375e+01 -6.90856e+01 0.00000e+00 0.00000e+00 4.07241e+02 257.879 4.09697e+01 257.879 0.9929 
1 1 1 15  4   1  o 6  6.40654e+00 1.62385e+00 1.45189e+02 126.766 -4.08231e+00 5.46363e+00  0.00000e+00 0.00000e+00 8.11276e+01 126.766 6.40611e+01 306.766 0.9235 
1 1 1 15  4   2  o 11 8.08061e+00 1.66438e+00 2.20458e+02 91.245  -2.80291e-01 1.28932e+01  0.00000e+00 0.00000e+00 7.65682e+01 91.245  1.43889e+02 271.245 0.9604 
1 1 1 15  4   3  o 15 4.00666e+00 1.31119e+00 3.21682e+01 152.108 -9.55670e-01 5.05834e-01  0.00000e+00 0.00000e+00 4.06203e+01 152.108 8.45212e+00 152.108 0.4745 
1 1 1 15  4   4  o 9  9.41434e+00 1.48852e+00 1.16770e+02 137.901 -7.44905e+00 6.73042e+00  0.00000e+00 0.00000e+00 2.25388e+02 137.901 1.08618e+02 137.901 0.9488 
1 1 1 15  4   5  o 16 9.91730e+00 1.72159e+00 2.00092e+02 33.305  1.32843e+01  8.72792e+00  0.00000e+00 0.00000e+00 1.67763e+02 33.305  3.23286e+01 213.305 0.9680 
1 1 1 15  4   6  o 14 6.04981e+00 1.73239e+00 8.51442e+01 228.554 -2.86696e+00 -3.24667e+00 0.00000e+00 0.00000e+00 1.17785e+02 228.554 3.26409e+01 228.554 0.8752 
1 1 1 15  4   7  o 13 8.74940e+00 1.70950e+00 1.45609e+02 266.842 -6.43774e-01 -1.16685e+01 0.00000e+00 0.00000e+00 1.75121e+02 266.842 2.95111e+01 266.842 0.9562 
1 1 1 15  4   8  o 15 8.16269e+00 1.93229e+00 1.71485e+02 160.734 -1.10690e+01 3.86901e+00  0.00000e+00 0.00000e+00 1.27828e+02 160.734 4.36568e+01 340.734 0.9564 
1 1 1 15  4   9  f 0  4.44273e+00 1.43816e+00 1.02336e+02 64.672  2.21703e+00  4.68414e+00  0.00000e+00 0.00000e+00 5.05503e+01 64.672  5.17853e+01 244.671 0.8974 
1 1 1 15  5   0  f 0  1.12865e+01 1.48418e+00 1.45470e+02 121.676 -6.82227e+00 1.10566e+01  0.00000e+00 0.00000e+00 2.69071e+02 121.676 1.23601e+02 121.676 0.9607 
1 1 1 15  5   1  o 11 6.14096e+00 1.64239e+00 1.58769e+02 159.261 -6.62824e+00 2.50974e+00  0.00000e+00 0.00000e+00 5.88740e+01 159.261 9.98953e+01 339.261 0.9265 
1 1 1 15  5   2  o 1  5.45224e+00 1.46230e+00 8.63319e+01 354.964 3.71924e+00  -3.27763e-01 0.00000e+00 0.00000e+00 9.15473e+01 354.964 5.21535e+00 354.964 0.8524 
1 1 1 15  5   3  o 18 4.74952e+00 1.46945e+00 8.94760e+01 328.397 3.01388e+00  -1.85439e+00 0.00000e+00 0.00000e+00 6.38487e+01 328.397 2.56272e+01 148.397 0.8431 
1 1 1 15  5   4  o 10 5.81841e+00 1.58978e+00 9.61560e+01 297.262 2.21902e+00  -4.30635e+00 0.00000e+00 0.00000e+00 1.02122e+02 297.262 5.96631e+00 297.262 0.8896 
1 1 1 15  5   5  o 10 9.48790e+00 1.76649e+00 1.85591e+02 192.751 -1.34320e+01 -3.03951e+00 0.00000e+00 0.00000e+00 1.64502e+02 192.751 2.10893e+01 12.751  0.9630 
1 1 1 15  5   6  o 17 1.08653e+01 1.70460e+00 2.07052e+02 201.892 -1.78245e+01 -7.16259e+00 0.00000e+00 0.00000e+00 1.98404e+02 201.892 8.64837e+00 21.892  0.9736 
1 1 1 15  5   7  f 0  8.77454e+00 1.93348e+00 1.20401e+02 346.536 8.24120e+00  -1.97299e+00 0.00000e+00 0.00000e+00 1.95457e+02 346.536 7.50560e+01 346.536 0.9390 
1 1 1 15  5   8  o 2  8.23969e+00 1.97593e+00 1.66712e+02 306.447 6.65312e+00  -9.00859e+00 0.00000e+00 0.00000e+00 1.34756e+02 306.447 3.19552e+01 126.447 0.9543 
1 1 1 15  5   9  o 1  5.78363e+00 1.78375e+00 1.61490e+02 141.417 -6.69250e+00 5.33939e+00  0.00000e+00 0.00000e+00 4.68954e+01 141.417 1.14595e+02 321.417 0.9396 
1 1 1 15  6   0  o 1  1.32063e+01 1.28568e+00 2.48179e+02 24.719  2.56881e+01  1.18254e+01  0.00000e+00 0.00000e+00 2.47693e+02 24.719  4.85613e-01 204.719 0.9822 
1 1 1 15  6   1  o 8  1.24084e+01 1.35485e+00 1.94118e+02 297.743 9.25769e+00  -1.76013e+01 0.00000e+00 0.00000e+00 2.68440e+02 297.743 7.43224e+01 297.743 0.9745 
1 1 1 15  6   2  o 16 8.19324e+00 1.59848e+00 1.10767e+02 131.985 -4.52786e+00 5.03141e+00  0.00000e+00 0.00000e+00 1.78614e+02 131.985 6.78474e+01 131.985 0.9229 
1 1 1 15  6   3  f 0  6.69936e+00 1.56915e+00 1.14376e+02 223.622 -4.40507e+00 -4.19818e+00 0.00000e+00 0.00000e+00 1.19991e+02 223.622 5.61442e+00 223.622 0.9137 
1 1 1 15  6   4  o 9  7.64769e+00 1.97582e+00 1.46041e+02 294.124 3.21762e+00  -7.18490e+00 0.00000e+00 0.00000e+00 1.27605e+02 294.124 1.84360e+01 114.124 0.9341 
1 1 1 15  6   5  o 1  3.84966e+00 1.26737e+00 7.07658e+01 74.183  7.50975e-01  2.65096e+00  0.00000e+00 0.00000e+00 4.57839e+01 74.183  2.49820e+01 254.183 0.7901 
1 1 1 15  6   6  o 14 7.79523e+00 1.74142e+00 1.52530e+02 331.617 8.74909e+00  -4.72733e+00 0.00000e+00 0.00000e+00 1.30795e+02 331.617 2.17350e+01 151.617 0.9483 
1 1 1 15  6   7  f 0  4.65645e+00 1.47050e+00 8.10198e+01 102.032 -8.32387e-01 3.90541e+00  0.00000e+00 0.00000e+00 7.30767e+01 102.032 7.94316e+00 282.032 0.8633 
1 1 1 15  6   8  o 11 4.73954e+00 1.52771e+00 6.67770e+01 351.461 3.38121e+00  -5.07700e-01 0.00000e+00 0.00000e+00 8.52779e+01 351.461 1.85009e+01 351.461 0.8368 
1 1 1 15  6   9  o 4  4.52342e+00 1.51519e+00 1.36718e+02 286.587 1.91639e+00  -6.43359e+00 0.00000e+00 0.00000e+00 2.32299e+01 286.587 1.13488e+02 106.587 0.9222 
1 1 1 15  7   0  o 1  8.18272e+00 1.61639e+00 1.26541e+02 105.850 -2.10605e+00 7.41770e+00  0.00000e+00 0.00000e+00 1.65230e+02 105.850 3.86883e+01 105.850 0.9327 
1 1 1 15  7   1  o 9  4.75029e+00 1.42963e+00 5.91458e+01 128.367 -1.39358e+00 1.76034e+00  0.00000e+00 0.00000e+00 7.42627e+01 128.367 1.51169e+01 128.367 0.7342 
1 1 1 15  7   2  o 13 7.82444e+00 1.63822e+00 1.02903e+02 347.637 5.75867e+00  -1.26224e+00 0.00000e+00 0.00000e+00 1.69808e+02 347.637 6.69050e+01 347.637 0.9107 
1 1 1 15  7   3  o 11 5.07042e+00 1.53728e+00 9.19176e+01 219.073 -2.91653e+00 -2.36792e+00 0.00000e+00 0.00000e+00 7.37745e+01 219.073 1.81431e+01 39.073  0.8535 
1 1 1 15  7   4  o 4  7.40422e+00 1.89156e+00 1.97658e+02 252.673 -3.21305e+00 -1.02990e+01 0.00000e+00 0.00000e+00 7.24678e+01 252.673 1.25190e+02 72.673  0.9525 
1 1 1 15  7   5  o 9  6.90517e+00 1.72295e+00 1.63866e+02 83.425  1.03654e+00  8.99263e+00  0.00000e+00 0.00000e+00 8.56414e+01 83.425  7.82245e+01 263.425 0.9430 
1 1 1 15  7   6  o 11 4.59812e+00 1.44904e+00 8.78433e+01 101.704 -8.05576e-01 3.88865e+00  0.00000e+00 0.00000e+00 6.41385e+01 101.704 2.37048e+01 281.704 0.8624 
1 1 1 15  7   7  o 10 4.95362e+00 1.56668e+00 1.25430e+02 170.317 -6.11886e+00 1.04407e+00  0.00000e+00 0.00000e+00 4.84118e+01 170.317 7.70180e+01 350.317 0.9155 
1 1 1 15  7   8  o 5  7.63729e+00 1.98058e+00 1.37226e+02 236.795 -4.66477e+00 -7.12702e+00 0.00000e+00 0.00000e+00 1.37821e+02 236.795 5.94908e-01 236.795 0.9393 
1 1 1 15  7   9  o 15 4.20052e+00 1.42155e+00 8.30258e+01 202.923 -3.69741e+00 -1.56357e+00 0.00000e+00 0.00000e+00 5.61436e+01 202.923 2.68823e+01 22.923  0.8641 
1 1 1 15  8   0  o 11 1.20302e+01 1.40171e+00 2.47474e+02 335.274 2.21753e+01  -1.02117e+01 0.00000e+00 0.00000e+00 2.02909e+02 335.274 4.45654e+01 155.274 0.9793 
1 1 1 15  8   1  o 14 6.83123e+00 1.64794e+00 2.31930e+02 109.745 -3.87766e+00 1.08032e+01  0.00000e+00 0.00000e+00 1.77149e+01 109.745 2.14215e+02 289.745 0.9554 
1 1 1 15  8   2  o 6  1.74132e+01 1.17021e+00 3.05231e+02 243.764 -2.10791e+01 -4.27714e+01 0.00000e+00 0.00000e+00 3.54155e+02 243.764 4.89241e+01 243.764 0.9895 
1 1 1 15  8   3  o 18 4.84998e+00 1.51146e+00 6.76631e+01 128.912 -1.68142e+00 2.08293e+00  0.00000e+00 0.00000e+00 7.77255e+01 128.912 1.00623e+01 128.912 0.7829 
1 1 1 15  8   4  o 14 5.08260e+00 1.60251e+00 9.24478e+01 138.796 -3.03869e+00 2.66052e+00  0.00000e+00 0.00000e+00 7.59480e+01 138.796 1.64998e+01 318.796 0.8650 
1 1 1 15  8   5  o 19 6.98511e+00 1.61587e+00 5.41530e+01 236.382 -1.85210e+00 -2.78569e+00 0.00000e+00 0.00000e+00 1.68679e+02 236.382 1.14526e+02 236.382 0.8326 
1 1 1 15  8   6  o 16 4.54881e+00 1.45500e+00 1.06982e+02 32.738  4.01040e+00  2.57840e+00  0.00000e+00 0.00000e+00 4.77768e+01 32.738  5.92051e+01 212.738 0.8877 
1 1 1 15  8   7  o 8  6.21143e+00 1.77269e+00 1.93663e+02 163.432 -1.01758e+01 3.02735e+00  0.00000e+00 0.00000e+00 3.29363e+01 163.432 1.60727e+02 343.432 0.9517 
1 1 1 15  8   8  o 14 3.88528e+00 1.32791e+00 6.23939e+01 114.032 -1.14250e+00 2.56224e+00  0.00000e+00 0.00000e+00 5.59544e+01 114.032 6.43955e+00 294.032 0.7945 
1 1 1 15  8   9  o 4  4.28874e+00 1.45131e+00 7.43062e+01 333.550 3.41207e+00  -1.69747e+00 0.00000e+00 0.00000e+00 6.64292e+01 333.550 7.87697e+00 153.550 0.8558 
1 1 1 15  9   0  o 3  6.14251e+00 1.50177e+00 6.22969e+01 262.407 -3.96414e-01 -2.97368e+00 0.00000e+00 0.00000e+00 1.27900e+02 262.407 6.56035e+01 262.407 0.8100 
1 1 1 15  9   1  o 8  2.23910e+01 1.05839e+00 4.33472e+02 269.416 -9.58175e-01 -9.40186e+01 0.00000e+00 0.00000e+00 4.18416e+02 269.416 1.50557e+01 89.416  0.9947 
1 1 1 15  9   2  o 4  1.11559e+01 1.50477e+00 2.34302e+02 64.038  9.26533e+00  1.90287e+01  0.00000e+00 0.00000e+00 1.82419e+02 64.038  5.18835e+01 244.038 0.9761 
1 1 1 15  9   3  o 16 8.30831e+00 1.70395e+00 1.89033e+02 199.536 -1.10059e+01 -3.90518e+00 0.00000e+00 0.00000e+00 1.15126e+02 199.536 7.39073e+01 19.536  0.9562 
1 1 1 15  9   4  o 19 5.79865e+00 1.73660e+00 1.11775e+02 91.856  -1.67959e-01 5.18179e+00  0.00000e+00 0.00000e+00 8.75572e+01 91.856  2.42181e+01 271.856 0.8975 
1 1 1 15  9   5  o 2  7.94404e+00 1.71220e+00 6.51113e+01 119.345 -2.12567e+00 3.78089e+00  0.00000e+00 0.00000e+00 2.01321e+02 119.345 1.36210e+02 119.345 0.8754 
1 1 1 15  9   6  o 3  4.79870e+00 1.50955e+00 9.07812e+01 300.121 2.16096e+00  -3.72475e+00 0.00000e+00 0.00000e+00 7.00187e+01 300.121 2.07625e+01 120.121 0.8743 
1 1 1 15  9   7  o 8  4.89690e+00 1.55507e+00 6.41832e+01 332.999 2.81585e+00  -1.43481e+00 0.00000e+00 0.00000e+00 8.99605e+01 332.999 2.57773e+01 332.999 0.8212 
1 1 1 15  9   8  o 2  4.39719e+00 1.44970e+00 4.91714e+01 132.810 -1.58122e+00 1.70695e+00  0.00000e+00 0.00000e+00 7.63822e+01 132.810 2.72108e+01 132.810 0.7448 
1 1 1 15  9   9  o 2  1.17386e+01 2.07184e+00 2.42196e+02 249.418 -7.96040e+00 -2.11981e+01 0.00000e+00 0.00000e+00 1.97830e+02 249.418 4.43658e+01 69.418  0.9777 
1 1 1 15  10  0  o 7  8.51493e+00 1.49565e+00 1.42851e+02 226.837 -6.46436e+00 -6.89268e+00 0.00000e+00 0.00000e+00 1.64913e+02 226.837 2.20616e+01 226.837 0.9455 
1 1 1 15  10  1  o 10 9.77599e+00 1.53143e+00 1.66804e+02 250.688 -4.25627e+00 -1.21457e+01 0.00000e+00 0.00000e+00 1.92284e+02 250.688 2.54795e+01 250.688 0.9603 
1 1 1 15  10  2  o 19 1.87673e+01 1.15653e+00 3.61814e+02 105.178 -1.68005e+01 6.19312e+01  0.00000e+00 0.00000e+00 3.50767e+02 105.178 1.10464e+01 285.178 0.9922 
1 1 1 15  10  3  o 7  8.61141e+00 1.57441e+00 1.09560e+02 169.825 -7.34647e+00 1.31857e+00  0.00000e+00 0.00000e+00 1.97180e+02 169.825 8.76197e+01 169.825 0.9304 
1 1 1 15  10  4  o 10 8.99464e+00 1.92759e+00 6.79307e+01 224.420 -3.15215e+00 -3.08900e+00 0.00000e+00 0.00000e+00 2.34449e+02 224.420 1.66519e+02 224.420 0.8777 
1 1 1 15  10  5  o 11 9.52645e+00 1.77006e+00 2.10451e+02 350.856 1.60733e+01  -2.58730e+00 0.00000e+00 0.00000e+00 1.43147e+02 350.856 6.73038e+01 170.856 0.9688 
1 1 1 15  10  6  o 4  6.42613e+00 1.70918e+00 9.52534e+01 305.969 3.16754e+00  -4.36477e+00 0.00000e+00 0.00000e+00 1.26827e+02 305.969 3.15740e+01 305.969 0.9018 
1 1 1 15  10  7  o 14 1.04799e+01 1.74771e+00 1.61023e+02 145.835 -1.24567e+01 8.45450e+00  0.00000e+00 0.00000e+00 2.27112e+02 145.835 6.60892e+01 145.835 0.9662 
1 1 1 15  10  8  o 11 5.11342e+00 1.59957e+00 9.57025e+01 356.769 4.80337e+00  -2.71185e-01 0.00000e+00 0.00000e+00 7.85352e+01 356.769 1.71673e+01 176.769 0.8888 
1 1 1 15  10  9  o 4  5.58613e+00 1.71324e+00 5.39885e+01 22.982  2.78870e+00  1.18268e+00  0.00000e+00 0.00000e+00 1.19947e+02 22.982  6.59585e+01 22.982  0.8121 
1 1 1 15  11  0  o 6  6.77778e+00 1.61998e+00 1.32183e+02 199.978 -6.18262e+00 -2.24757e+00 0.00000e+00 0.00000e+00 1.06307e+02 199.978 2.58761e+01 19.978  0.9205 
1 1 1 15  11  1  o 5  1.01253e+01 1.50244e+00 9.23584e+01 124.222 -4.20497e+00 6.18235e+00  0.00000e+00 0.00000e+00 2.67997e+02 124.222 1.75639e+02 124.222 0.9305 
1 1 1 15  11  2  o 9  9.04362e+00 1.64342e+00 1.73167e+02 144.689 -9.68449e+00 6.85977e+00  0.00000e+00 0.00000e+00 1.57993e+02 144.689 1.51736e+01 324.689 0.9569 
1 1 1 15  11  3  o 12 5.68976e+00 1.49640e+00 6.67082e+01 279.001 5.04931e-01  -3.18770e+00 0.00000e+00 0.00000e+00 1.13109e+02 279.001 4.64011e+01 279.001 0.8255 
1 1 1 15  11  4  o 6  1.09700e+01 1.60508e+00 2.70403e+02 26.357  2.27843e+01  1.12890e+01  0.00000e+00 0.00000e+00 1.41397e+02 26.357  1.29006e+02 206.357 0.9801 
1 1 1 15  11  5  o 16 5.02007e+00 1.53015e+00 1.43851e+02 331.864 5.89529e+00  -3.15250e+00 0.00000e+00 0.00000e+00 3.34476e+01 331.864 1.10403e+02 151.864 0.9218 
1 1 1 15  11  6  o 19 4.93979e+00 1.55125e+00 7.36719e+01 357.372 3.50703e+00  -1.60986e-01 0.00000e+00 0.00000e+00 8.56599e+01 357.372 1.19880e+01 357.372 0.8417 
1 1 1 15  11  7  o 8  8.47621e+00 1.74735e+00 5.75223e+01 272.746 2.08419e-01  -4.34468e+00 0.00000e+00 0.00000e+00 2.27005e+02 272.746 1.69482e+02 272.746 0.8757 
1 1 1 15  11  8  o 1  9.32993e+00 1.86029e+00 1.92958e+02 255.593 -3.76255e+00 -1.46471e+01 0.00000e+00 0.00000e+00 1.52681e+02 255.593 4.02764e+01 75.593  0.9663 
1 1 1 15  11  9  o 18 1.11969e+01 2.06912e+00 1.72756e+02 113.000 -6.02731e+00 1.41996e+01  0.00000e+00 0.00000e+00 2.42373e+02 113.000 6.96179e+01 113.000 0.9670 
1 1 1 15  12  0  o 7  6.44671e+00 1.47690e+00 8.27136e+01 356.395 4.16447e+00  -2.62383e-01 0.00000e+00 0.00000e+00 1.31638e+02 356.395 4.89244e+01 356.395 0.8699 
1 1 1 15  12  1  f 0  5.36855e+00 1.41278e+00 6.14552e+01 288.044 8.50698e-01  -2.61128e+00 0.00000e+00 0.00000e+00 1.00618e+02 288.044 3.91628e+01 288.044 0.7893 
1 1 1 15  12  2  o 14 1.32538e+01 1.41870e+00 2.14404e+02 98.118  -3.37620e+00 2.36697e+01  0.00000e+00 0.00000e+00 2.82048e+02 98.118  6.76444e+01 98.118  0.9789 
1 1 1 15  12  3  o 1  7.76402e+00 1.65535e+00 1.87806e+02 85.922  8.14898e-01  1.14297e+01  0.00000e+00 0.00000e+00 9.61476e+01 85.922  9.16580e+01 265.922 0.9553 
1 1 1 15  12  4  o 5  7.68509e+00 1.64735e+00 1.03900e+02 16.963  6.40061e+00  1.95238e+00  0.00000e+00 0.00000e+00 1.67447e+02 16.963  6.35469e+01 16.963  0.9219 
1 1 1 15  12  5  o 2  7.87273e+00 1.78909e+00 1.05398e+02 162.726 -6.36278e+00 1.97858e+00  0.00000e+00 0.00000e+00 1.72560e+02 162.726 6.71614e+01 162.726 0.9216 
1 1 1 15  12  6  f 0  8.74074e+00 1.86446e+00 1.13008e+02 355.781 7.93222e+00  -5.85138e-01 0.00000e+00 0.00000e+00 2.00125e+02 355.781 8.71166e+01 355.781 0.9348 
1 1 1 15  12  7  o 1  7.55808e+00 1.77840e+00 1.94278e+02 197.306 -1.22735e+01 -3.82423e+00 0.00000e+00 0.00000e+00 8.39130e+01 197.306 1.10365e+02 17.306  0.9603 
1 1 1 15  12  8  o 17 4.21706e+00 1.38395e+00 2.83876e+01 356.599 1.33575e+00  -7.93899e-02 0.00000e+00 0.00000e+00 6.10904e+01 356.599 3.27028e+01 356.599 0.5535 
1 1 1 15  12  9  o 16 7.47559e+00 1.98033e+00 8.68567e+01 61.906  2.63654e+00  4.93900e+00  0.00000e+00 0.00000e+00 1.72700e+02 61.906  8.58430e+01 61.906  0.9056 
1 1 1 15  13  0  o 16 4.53346e+00 1.38848e+00 1.14349e+02 221.791 -3.25664e+00 -2.91081e+00 0.00000e+00 0.00000e+00 3.75029e+01 221.791 7.68459e+01 41.791  0.8763 
1 1 1 15  13  1  o 13 1.60227e+01 1.13894e+00 2.29407e+02 100.480 -6.07987e+00 3.28671e+01  0.00000e+00 0.00000e+00 3.74149e+02 100.480 1.44742e+02 100.480 0.9849 
1 1 1 15  13  2  o 16 2.21720e+01 1.07688e+00 3.72046e+02 116.124 -3.35422e+01 6.83940e+01  0.00000e+00 0.00000e+00 4.70780e+02 116.124 9.87335e+01 116.124 0.9934 
1 1 1 15  13  3  o 3  5.41582e+00 1.53526e+00 1.08079e+02 232.447 -2.97346e+00 -3.86767e+00 0.00000e+00 0.00000e+00 7.65462e+01 232.447 3.15326e+01 52.447  0.8905 
1 1 1 15  13  4  o 13 5.58491e+00 1.65236e+00 1.42631e+02 130.912 -4.20250e+00 4.84945e+00  0.00000e+00 0.00000e+00 5.37998e+01 130.912 8.88314e+01 310.912 0.9184 
1 1 1 15  13  5  o 6  5.31869e+00 1.58951e+00 1.50563e+02 241.846 -3.40004e+00 -6.35325e+00 0.00000e+00 0.00000e+00 3.84764e+01 241.846 1.12086e+02 61.846  0.9278 
1 1 1 15  13  6  o 12 1.47913e+01 1.66410e+00 1.59474e+02 342.596 2.00544e+01  -6.28614e+00 0.00000e+00 0.00000e+00 3.93676e+02 342.596 2.34201e+02 342.596 0.9759 
1 1 1 15  13  7  o 12 6.03861e+00 1.66168e+00 1.13361e+02 265.768 -4.74040e-01 -6.40659e+00 0.00000e+00 0.00000e+00 9.92207e+01 265.768 1.41401e+01 85.768  0.9185 
1 1 1 15  13  8  o 12 1.31731e+01 1.70736e+00 1.84932e+02 85.076  2.04033e+00  2.36837e+01  0.00000e+00 0.00000e+00 3.09303e+02 85.076  1.24370e+02 85.076  0.9787 
1 1 1 15  13  9  o 7  4.45917e+00 1.48143e+00 5.40869e+01 133.385 -1.99855e+00 2.11451e+00  0.00000e+00 0.00000e+00 8.31985e+01 133.385 2.91116e+01 133.385 0.8031 
1 1 1 15  14  0  o 9  1.14158e+01 1.43906e+00 2.14912e+02 55.378  1.14744e+01  1.66192e+01  0.00000e+00 0.00000e+00 2.10480e+02 55.378  4.43169e+00 235.378 0.9749 
1 1 1 15  14  1  o 19 1.87312e+01 1.06348e+00 3.25901e+02 286.877 1.65839e+01  -5.46620e+01 0.00000e+00 0.00000e+00 3.84158e+02 286.877 5.82568e+01 286.877 0.9912 
1 1 1 15  14  2  o 16 1.42393e+01 1.29522e+00 2.04541e+02 57.251  1.33196e+01  2.07082e+01  0.00000e+00 0.00000e+00 3.29123e+02 57.251  1.24582e+02 57.251  0.9795 
1 1 1 15  14  3  o 9  4.73198e+00 1.38282e+00 1.16950e+02 113.863 -2.09198e+00 4.72905e+00  0.00000e+00 0.00000e+00 4.55734e+01 113.863 7.13769e+01 293.863 0.8972 
1 1 1 15  14  4  o 4  6.72645e+00 1.63822e+00 1.82329e+02 128.243 -6.15701e+00 7.81222e+00  0.00000e+00 0.00000e+00 6.19525e+01 128.243 1.20377e+02 308.243 0.9483 
1 1 1 15  14  5  o 14 8.54830e+00 1.68330e+00 9.45466e+01 311.406 4.56695e+00  -5.17902e+00 0.00000e+00 0.00000e+00 2.08187e+02 311.406 1.13640e+02 311.406 0.9245 
1 1 1 15  14  6  o 2  1.46244e+01 1.69876e+00 2.60885e+02 239.606 -1.68578e+01 -2.87400e+01 0.00000e+00 0.00000e+00 2.91029e+02 239.606 3.01444e+01 239.606 0.9849 
1 1 1 15  14  7  o 4  4.88307e+00 1.55016e+00 9.35937e+01 111.086 -1.65588e+00 4.29438e+00  0.00000e+00 0.00000e+00 7.17119e+01 111.086 2.18818e+01 291.086 0.8833 
1 1 1 15  14  8  o 13 6.05691e+00 1.69345e+00 1.08333e+02 35.580  5.25210e+00  3.75734e+00  0.00000e+00 0.00000e+00 1.05020e+02 35.580  3.31366e+00 215.580 0.9189 
1 1 1 15  14  9  o 17 8.38723e+00 2.01467e+00 1.22857e+02 296.493 3.87387e+00  -7.77232e+00 0.00000e+00 0.00000e+00 1.79551e+02 296.493 5.66937e+01 296.493 0.9405 
1 1 1 15  15  0  o 19 1.23677e+01 1.29443e+00 2.07308e+02 359.472 2.24899e+01  -2.07211e-01 0.00000e+00 0.00000e+00 2.54762e+02 359.472 4.74539e+01 359.472 0.9775 
1 1 1 15  15  1  o 3  1.08268e+01 1.40912e+00 1.98724e+02 330.640 1.52095e+01  -8.55595e+00 0.00000e+00 0.00000e+00 2.03275e+02 330.640 4.55042e+00 330.640 0.9709 
1 1 1 15  15  2  o 10 4.26201e+00 1.30336e+00 4.07397e+01 41.983  1.08650e+00  9.77711e-01  0.00000e+00 0.00000e+00 5.49039e+01 41.983  1.41642e+01 41.983  0.5865 
1 1 1 15  15  3  o 18 7.80794e+00 1.62102e+00 3.71272e+01 35.426  1.95602e+00  1.39141e+00  0.00000e+00 0.00000e+00 1.88146e+02 35.426  1.51019e+02 35.426  0.7537 
1 1 1 15  15  4  o 7  1.11950e+01 1.54700e+00 1.55769e+02 329.896 1.28074e+01  -7.42535e+00 0.00000e+00 0.00000e+00 2.58192e+02 329.896 1.02423e+02 329.896 0.9656 
1 1 1 15  15  5  o 3  7.55508e+00 1.92296e+00 1.80881e+02 138.166 -7.61902e+00 6.82034e+00  0.00000e+00 0.00000e+00 9.39939e+01 138.166 8.68867e+01 318.166 0.9498 
1 1 1 15  15  6  o 15 7.48896e+00 1.78764e+00 1.86694e+02 160.313 -1.09262e+01 3.90933e+00  0.00000e+00 0.00000e+00 8.76051e+01 160.313 9.90888e+01 340.313 0.9559 
1 1 1 15  15  7  o 11 4.29277e+00 1.42620e+00 1.15746e+02 65.211  2.25779e+00  4.88865e+00  0.00000e+00 0.00000e+00 3.25868e+01 65.211  8.31592e+01 245.210 0.9016 
1 1 1 15  15  8  o 19 6.85987e+00 1.82828e+00 1.15408e+02 38.223  5.61591e+00  4.42299e+00  0.00000e+00 0.00000e+00 1.28382e+02 38.223  1.29745e+01 38.223  0.9272 
1 1 1 15  15  9  o 7  7.64144e+00 2.04281e+00 1.50933e+02 131.895 -6.20409e+00 6.91572e+00  0.00000e+00 0.00000e+00 1.25750e+02 131.895 2.51833e+01 311.895 0.9445 
1 1 1 15  16  0  f 0  6.66943e+00 1.54924e+00 1.91769e+02 295.897 4.26227e+00  -8.77880e+00 0.00000e+00 0.00000e+00 4.96931e+01 295.897 1.42076e+02 115.897 0.9473 
1 1 1 15  16  1  o 1  1.25127e+01 1.27940e+00 2.39696e+02 44.408  1.92045e+01  1.88117e+01  0.00000e+00 0.00000e+00 2.29814e+02 44.408  9.88202e+00 224.408 0.9812 
1 1 1 15  16  2  o 11 1.22440e+01 1.44972e+00 1.31911e+02 287.359 4.04836e+00  -1.29504e+01 0.00000e+00 0.00000e+00 3.18943e+02 287.359 1.87032e+02 287.359 0.9624 
1 1 1 15  16  3  o 19 5.82397e+00 1.59682e+00 3.94821e+01 279.896 3.31163e-01  -1.89828e+00 0.00000e+00 0.00000e+00 1.13314e+02 279.896 7.38323e+01 279.896 0.6854 
1 1 1 15  16  4  o 5  9.71990e+00 1.66580e+00 2.38224e+02 78.669  3.85863e+00  1.92565e+01  0.00000e+00 0.00000e+00 1.24374e+02 78.669  1.13851e+02 258.669 0.9742 
1 1 1 15  16  5  o 2  1.91911e+01 1.25610e+00 3.47147e+02 143.023 -5.88867e+01 4.43374e+01  0.00000e+00 0.00000e+00 3.82971e+02 143.023 3.58246e+01 143.023 0.9932 
1 1 1 15  16  6  o 5  7.57508e+00 1.70380e+00 1.22435e+02 249.955 -2.73979e+00 -7.50926e+00 0.00000e+00 0.00000e+00 1.48995e+02 249.955 2.65601e+01 249.955 0.9352 
1 1 1 15  16  7  o 18 8.06482e+00 1.90090e+00 1.37161e+02 53.057  5.42359e+00  7.21222e+00  0.00000e+00 0.00000e+00 1.54247e+02 53.057  1.70858e+01 53.057  0.9428 
1 1 1 15  16  8  o 16 5.58408e+00 1.69248e+00 8.77060e+01 350.344 4.58359e+00  -7.79872e-01 0.00000e+00 0.00000e+00 1.01620e+02 350.344 1.39140e+01 350.344 0.8846 
1 1 1 15  16  9  o 14 8.17037e+00 1.98957e+00 2.18841e+02 258.938 -2.85752e+00 -1.46158e+01 0.00000e+00 0.00000e+00 8.36439e+01 258.938 1.35197e+02 78.938  0.9658 
1 1 1 15  17  0  o 3  5.43563e+00 1.50350e+00 1.69258e+02 111.403 -2.61311e+00 6.66679e+00  0.00000e+00 0.00000e+00 2.33710e+01 111.403 1.45887e+02 291.403 0.9273 
1 1 1 15  17  1  o 14 5.67655e+00 1.37711e+00 1.08821e+02 184.350 -5.28183e+00 -4.01791e-01 0.00000e+00 0.00000e+00 8.65045e+01 184.350 2.23168e+01 4.350   0.8998 
1 1 1 15  17  2  o 5  1.06955e+01 1.54823e+00 2.36139e+02 289.559 6.77647e+00  -1.90740e+01 0.00000e+00 0.00000e+00 1.62816e+02 289.559 7.33229e+01 109.559 0.9750 
1 1 1 15  17  3  o 17 9.28071e+00 1.62680e+00 1.41763e+02 296.303 4.95169e+00  -1.00176e+01 0.00000e+00 0.00000e+00 1.97178e+02 296.303 5.54148e+01 296.303 0.9541 
1 1 1 15  17  4  o 11 9.32788e+00 1.61383e+00 1.61182e+02 127.193 -7.92366e+00 1.04418e+01  0.00000e+00 0.00000e+00 1.82085e+02 127.193 2.09035e+01 127.193 0.9611 
1 1 1 15  17  5  o 8  3.36926e+00 1.15695e+00 8.06482e+01 323.661 2.54978e+00  -1.87570e+00 0.00000e+00 0.00000e+00 2.53710e+01 323.661 5.52771e+01 143.661 0.8215 
1 1 1 15  17  6  o 6  4.16307e+00 1.35576e+00 7.80569e+01 102.743 -7.49219e-01 3.31283e+00  0.00000e+00 0.00000e+00 5.52097e+01 102.743 2.28473e+01 282.743 0.8355 
1 1 1 15  17  7  o 13 3.97350e+00 1.33096e+00 6.96177e+01 159.439 -2.97029e+00 1.11414e+00  0.00000e+00 0.00000e+00 5.55441e+01 159.439 1.40737e+01 339.439 0.8220 
1 1 1 15  17  8  o 17 6.61816e+00 1.68657e+00 9.72384e+01 116.997 -2.78213e+00 5.46097e+00  0.00000e+00 0.00000e+00 1.34684e+02 116.997 3.74458e+01 116.997 0.9143 
1 1 1 15  17  9  o 15 6.96376e+00 2.00141e+00 1.61318e+02 299.524 4.57484e+00  -8.07812e+00 0.00000e+00 0.00000e+00 9.07929e+01 299.524 7.05256e+01 119.524 0.9445 
1 1 1 15  18  0  o 6  1.96695e+01 1.07389e+00 3.36527e+02 51.629  3.82503e+01  4.83093e+01  0.00000e+00 0.00000e+00 4.09026e+02 51.629  7.24987e+01 51.629  0.9919 
1 1 1 15  18  1  o 14 1.33945e+01 1.30779e+00 2.96727e+02 245.189 -1.40339e+01 -3.03564e+01 0.00000e+00 0.00000e+00 2.07724e+02 245.189 8.90027e+01 65.189  0.9849 
1 1 1 15  18  2  o 18 1.48669e+01 1.31871e+00 2.73150e+02 353.472 3.59341e+01  -4.11187e+00 0.00000e+00 0.00000e+00 2.87691e+02 353.472 1.45406e+01 353.472 0.9861 
1 1 1 15  18  3  o 9  5.71475e+00 1.53853e+00 1.07882e+02 163.272 -5.25040e+00 1.57795e+00  0.00000e+00 0.00000e+00 8.97346e+01 163.272 1.81479e+01 343.272 0.9035 
1 1 1 15  18  4  f 0  4.67110e+00 1.46022e+00 3.27547e+01 23.107  1.33104e+00  5.67930e-01  0.00000e+00 0.00000e+00 7.14788e+01 23.107  3.87241e+01 23.107  0.5828 
1 1 1 15  18  5  o 17 4.17494e+00 1.32649e+00 5.13965e+01 193.018 -2.14208e+00 -4.95261e-01 0.00000e+00 0.00000e+00 6.49894e+01 193.018 1.35930e+01 193.018 0.7278 
1 1 1 15  18  6  o 4  6.59701e+00 1.70963e+00 1.36820e+02 232.857 -5.05476e+00 -6.67318e+00 0.00000e+00 0.00000e+00 1.00311e+02 232.857 3.65095e+01 52.857  0.9382 
1 1 1 15  18  7  o 3  6.45695e+00 1.78672e+00 1.52668e+02 277.608 1.13997e+00  -8.53412e+00 0.00000e+00 0.00000e+00 7.99152e+01 277.608 7.27533e+01 97.608  0.9400 
1 1 1 15  18  8  o 6  5.12825e+00 1.60401e+00 9.62738e+01 12.713  5.06880e+00  1.14354e+00  0.00000e+00 0.00000e+00 8.01714e+01 12.713  1.61024e+01 192.713 0.8977 
1 1 1 15  18  9  o 8  6.04989e+00 1.84199e+00 4.32906e+01 311.770 1.61543e+00  -1.80865e+00 0.00000e+00 0.00000e+00 1.32151e+02 311.770 8.88608e+01 311.770 0.7566 
1 1 1 15  19  0  f 0  2.53082e+01 1.01067e+00 3.28998e+02 342.578 7.95536e+01  -2.49636e+01 0.00000e+00 0.00000e+00 6.32298e+02 342.578 3.03301e+02 342.578 0.9940 
1 1 1 15  19  1  o 6  2.07595e+01 1.03966e+00 2.72157e+02 125.072 -3.03589e+01 4.32415e+01  0.00000e+00 0.00000e+00 5.14042e+02 125.072 2.41885e+02 125.072 0.9905 
1 1 1 15  19  2  o 16 2.63282e+01 1.05370e+00 4.20074e+02 276.582 1.31951e+01  -1.14361e+02 0.00000e+00 0.00000e+00 5.82724e+02 276.582 1.62649e+02 276.582 0.9956 
1 1 1 15  19  3  o 10 5.21123e+00 1.53646e+00 7.44187e+01 12.161  3.37057e+00  7.26325e-01  0.00000e+00 0.00000e+00 9.27841e+01 12.161  1.83654e+01 12.161  0.8383 
1 1 1 15  19  4  o 10 1.01775e+01 1.65641e+00 1.99000e+02 294.199 6.88253e+00  -1.53148e+01 0.00000e+00 0.00000e+00 1.78878e+02 294.199 2.01227e+01 114.199 0.9697 
1 1 1 15  19  5  f 0  4.84545e+00 1.50587e+00 3.51081e+01 358.335 1.58325e+00  -4.60232e-02 0.00000e+00 0.00000e+00 7.92470e+01 358.335 4.41389e+01 358.335 0.6162 
1 1 1 15  19  6  o 1  4.79682e+00 1.44886e+00 1.38648e+02 63.657  3.20539e+00  6.47328e+00  0.00000e+00 0.00000e+00 3.18771e+01 63.657  1.06771e+02 243.657 0.9279 
1 1 1 15  19  7  o 14 4.98409e+00 1.55543e+00 9.23477e+01 244.579 -2.03657e+00 -4.28501e+00 0.00000e+00 0.00000e+00 7.70705e+01 244.579 1.52772e+01 64.579  0.8871 
1 1 1 15  19  8  o 2  6.04834e+00 1.68156e+00 6.88445e+01 342.575 3.97520e+00  -1.24768e+00 0.00000e+00 0.00000e+00 1.32731e+02 342.575 6.38862e+01 342.575 0.8696 
1 1 1 15  19  9  o 15 6.80612e+00 1.92697e+00 8.99461e+01 160.727 -5.06088e+00 1.76956e+00  0.00000e+00 0.00000e+00 1.45123e+02 160.727 5.51767e+01 160.727 0.9011 
1 1 1 15  20  0  o 5  1.40855e+01 1.21338e+00 2.64985e+02 340.766 3.24563e+01  -1.13238e+01 0.00000e+00 0.00000e+00 2.65354e+02 340.766 3.68621e-01 340.766 0.9853 
1 1 1 15  20  1  o 7  9.19370e+00 1.47267e+00 2.01070e+02 91.884  -4.75193e-01 1.44494e+01  0.00000e+00 0.00000e+00 1.38052e+02 91.884  6.30189e+01 271.884 0.9648 
1 1 1 15  20  2  o 16 1.55305e+01 1.21975e+00 2.76592e+02 356.931 4.14859e+01  -2.22416e+00 0.00000e+00 0.00000e+00 3.10301e+02 356.931 3.37090e+01 356.931 0.9879 
1 1 1 15  20  3  o 7  5.23612e+00 1.50087e+00 1.01781e+02 178.429 -4.82272e+00 1.32270e-01  0.00000e+00 0.00000e+00 7.63928e+01 178.429 2.53884e+01 358.429 0.8891 
1 1 1 15  20  4  o 3  7.89375e+00 1.68724e+00 1.35537e+02 327.276 7.33702e+00  -4.71464e+00 0.00000e+00 0.00000e+00 1.48783e+02 327.276 1.32463e+01 327.276 0.9408 
1 1 1 15  20  5  o 8  6.72082e+00 1.59065e+00 1.44899e+02 173.574 -8.80904e+00 9.92155e-01  0.00000e+00 0.00000e+00 9.75092e+01 173.574 4.73896e+01 353.574 0.9418 
1 1 1 15  20  6  o 16 9.39234e+00 1.67767e+00 1.61904e+02 247.836 -5.42186e+00 -1.33100e+01 0.00000e+00 0.00000e+00 1.85146e+02 247.836 2.32420e+01 247.836 0.9646 
1 1 1 15  20  7  o 11 4.85085e+00 1.55088e+00 8.38316e+01 222.543 -3.09529e+00 -2.84056e+00 0.00000e+00 0.00000e+00 7.80262e+01 222.543 5.80539e+00 42.543  0.8708 
1 1 1 15  20  8  o 19 4.95192e+00 1.54856e+00 1.35916e+02 121.599 -3.84337e+00 6.24766e+00  0.00000e+00 0.00000e+00 4.03940e+01 121.599 9.55224e+01 301.599 0.9291 
1 1 1 15  20  9  o 18 8.91078e+00 2.09458e+00 1.85206e+02 288.087 3.90259e+00  -1.19490e+01 0.00000e+00 0.00000e+00 1.42420e+02 288.087 4.27863e+01 108.087 0.9594 
1 1 1 15  21  0  o 6  3.87035e+00 1.24177e+00 8.85424e+01 196.267 -2.84258e+00 -8.29431e-01 0.00000e+00 0.00000e+00 3.08093e+01 196.267 5.77331e+01 16.267  0.8071 
1 1 1 15  21  1  o 4  8.79345e+00 1.45149e+00 2.06370e+02 355.930 1.51825e+01  -1.08020e+00 0.00000e+00 0.00000e+00 1.18576e+02 355.930 8.77942e+01 175.930 0.9666 
1 1 1 15  21  2  o 3  1.09364e+01 1.75859e+00 1.39504e+02 208.170 -1.03732e+01 -5.55505e+00 0.00000e+00 0.00000e+00 2.60630e+02 208.170 1.21126e+02 208.170 0.9565 
1 1 1 15  21  3  o 3  1.12499e+01 1.45802e+00 1.57546e+02 14.278  1.58896e+01  4.04361e+00  0.00000e+00 0.00000e+00 2.59625e+02 14.278  1.02079e+02 14.278  0.9690 
1 1 1 15  21  4  o 16 1.31610e+01 1.54759e+00 2.33167e+02 206.400 -2.52170e+01 -1.25177e+01 0.00000e+00 0.00000e+00 2.61645e+02 206.400 2.84774e+01 206.400 0.9821 
1 1 1 15  21  5  o 16 9.25757e+00 1.68091e+00 2.21652e+02 318.373 1.32703e+01  -1.17929e+01 0.00000e+00 0.00000e+00 1.22738e+02 318.373 9.89142e+01 138.373 0.9714 
1 1 1 15  21  6  o 19 7.60849e+00 1.67085e+00 1.30700e+02 83.637  1.03061e+00  9.24273e+00  0.00000e+00 0.00000e+00 1.44604e+02 83.637  1.39031e+01 83.637  0.9446 
1 1 1 15  21  7  o 3  7.91218e+00 1.89122e+00 1.53764e+02 297.356 4.52044e+00  -8.73739e+00 0.00000e+00 0.00000e+00 1.33535e+02 297.356 2.02297e+01 117.356 0.9477 
1 1 1 15  21  8  o 15 5.25652e+00 1.64031e+00 1.32921e+02 171.516 -7.08384e+00 1.05672e+00  0.00000e+00 0.00000e+00 5.38626e+01 171.516 7.90582e+01 351.516 0.9273 
1 1 1 15  21  9  o 6  5.58079e+00 1.73172e+00 9.08855e+01 315.610 3.45994e+00  -3.38703e+00 0.00000e+00 0.00000e+00 9.93699e+01 315.610 8.48439e+00 315.610 0.8896 
1 1 1 15  22  0  o 19 1.90538e+01 1.03831e+00 3.73999e+02 266.534 -4.02548e+00 -6.64683e+01 0.00000e+00 0.00000e+00 3.48501e+02 266.534 2.54986e+01 86.534  0.9925 
1 1 1 15  22  1  o 19 1.03623e+01 1.38824e+00 1.27321e+02 115.517 -4.90350e+00 1.02726e+01  0.00000e+00 0.00000e+00 2.50994e+02 115.517 1.23673e+02 115.517 0.9550 
1 1 1 15  22  2  o 7  1.04746e+01 1.53614e+00 1.36524e+02 1.368   1.23547e+01  2.94989e-01  0.00000e+00 0.00000e+00 2.47547e+02 1.368   1.11022e+02 1.368   0.9586 
1 1 1 15  22  3  o 9  1.33073e+01 1.27611e+00 1.90818e+02 287.537 7.41958e+00  -2.34793e+01 0.00000e+00 0.00000e+00 3.07947e+02 287.537 1.17128e+02 287.537 0.9795 
1 1 1 15  22  4  o 13 5.93007e+00 1.57494e+00 6.87460e+01 260.327 -6.18684e-01 -3.62967e+00 0.00000e+00 0.00000e+00 1.24227e+02 260.327 5.54815e+01 260.327 0.8501 
1 1 1 15  22  5  o 10 8.77194e+00 1.98457e+00 1.22985e+02 184.749 -8.08724e+00 -6.71917e-01 0.00000e+00 0.00000e+00 1.91488e+02 184.749 6.85029e+01 184.749 0.9362 
1 1 1 15  22  6  o 7  1.27370e+01 1.49368e+00 2.69112e+02 164.489 -3.43176e+01 9.52425e+00  0.00000e+00 0.00000e+00 2.11861e+02 164.489 5.72505e+01 344.489 0.9859 
1 1 1 15  22  7  o 8  7.73595e+00 1.88549e+00 1.88430e+02 65.662  4.87133e+00  1.07696e+01  0.00000e+00 0.00000e+00 9.51176e+01 65.662  9.33129e+01 245.662 0.9567 
1 1 1 15  22  8  o 10 6.69262e+00 1.64621e+00 1.66224e+02 246.049 -4.60886e+00 -1.03756e+01 0.00000e+00 0.00000e+00 7.86503e+01 246.049 8.75736e+01 66.049  0.9549 
1 1 1 15  22  9  o 8  4.29756e+00 1.44301e+00 4.69782e+01 14.430  2.38599e+00  6.13960e-01  0.00000e+00 0.00000e+00 7.83452e+01 14.430  3.13671e+01 14.430  0.7610 
1 1 1 15  23  0  o 1  4.98341e+00 1.42048e+00 7.83304e+01 269.076 -5.35542e-02 -3.32100e+00 0.00000e+00 0.00000e+00 7.99216e+01 269.076 1.59122e+00 269.076 0.8312 
1 1 1 15  23  1  o 18 4.65076e+00 1.38717e+00 1.26031e+02 346.840 5.11023e+00  -1.19478e+00 0.00000e+00 0.00000e+00 3.37659e+01 346.840 9.22650e+01 166.840 0.8988 
1 1 1 15  23  2  o 1  6.98042e+00 1.69940e+00 1.07884e+02 148.580 -5.25063e+00 3.20747e+00  0.00000e+00 0.00000e+00 1.36309e+02 148.580 2.84248e+01 148.580 0.9147 
1 1 1 15  23  3  o 15 3.70283e+00 1.23764e+00 3.95665e+01 264.607 -1.35834e-01 -1.43897e+00 0.00000e+00 0.00000e+00 4.29404e+01 264.607 3.37387e+00 264.607 0.5823 
1 1 1 15  23  4  o 9  6.50826e+00 1.61744e+00 8.54965e+01 300.648 2.51310e+00  -4.24125e+00 0.00000e+00 0.00000e+00 1.36657e+02 300.648 5.11602e+01 300.648 0.8917 
1 1 1 15  23  5  f 0  6.68618e+00 1.86066e+00 2.79293e+01 187.469 -1.49473e+00 -1.95957e-01 0.00000e+00 0.00000e+00 1.25167e+02 187.469 9.72382e+01 187.469 0.5980 
1 1 1 15  23  6  o 13 6.23628e+00 1.67888e+00 1.80256e+02 14.750  1.01522e+01  2.67280e+00  0.00000e+00 0.00000e+00 4.69232e+01 14.750  1.33333e+02 194.750 0.9511 
1 1 1 15  23  7  o 1  6.03987e+00 1.74532e+00 1.22481e+02 286.900 2.02594e+00  -6.66804e+00 0.00000e+00 0.00000e+00 9.15909e+01 286.900 3.08899e+01 106.900 0.9252 
1 1 1 15  23  8  o 3  3.99196e+00 1.35593e+00 6.21987e+01 185.200 -3.09134e+00 -2.81308e-01 0.00000e+00 0.00000e+00 6.28231e+01 185.200 6.24382e-01 185.200 0.8174 
1 1 1 15  23  9  o 1  8.67477e+00 2.11711e+00 1.36470e+02 243.047 -4.19250e+00 -8.24504e+00 0.00000e+00 0.00000e+00 1.77413e+02 243.047 4.09436e+01 243.047 0.9443 
1 1 1 15  24  0  o 6  4.26339e+00 1.29900e+00 7.14412e+01 344.474 2.63579e+00  -7.32254e-01 0.00000e+00 0.00000e+00 5.69608e+01 344.474 1.44805e+01 164.474 0.7884 
1 1 1 15  24  1  o 15 5.81439e+00 1.47813e+00 5.59038e+01 175.717 -2.77537e+00 2.07861e-01  0.00000e+00 0.00000e+00 1.20247e+02 175.717 6.43432e+01 175.717 0.7926 
1 1 1 15  24  2  o 17 4.18078e+00 1.36852e+00 7.17157e+01 117.873 -1.35996e+00 2.57140e+00  0.00000e+00 0.00000e+00 5.66773e+01 117.873 1.50384e+01 297.874 0.8030 
1 1 1 15  24  3  o 13 7.21536e+00 1.53757e+00 1.73478e+02 334.068 1.02230e+01  -4.97098e+00 0.00000e+00 0.00000e+00 9.01506e+01 334.068 8.33279e+01 154.068 0.9549 
1 1 1 15  24  4  o 10 6.15447e+00 1.56299e+00 1.52549e+02 182.070 -8.55932e+00 -3.09378e-01 0.00000e+00 0.00000e+00 6.88066e+01 182.070 8.37426e+01 2.070   0.9397 
1 1 1 15  24  5  o 7  6.62694e+00 1.82936e+00 1.29513e+02 339.950 6.53984e+00  -2.38678e+00 0.00000e+00 0.00000e+00 1.05219e+02 339.950 2.42942e+01 159.950 0.9251 
1 1 1 15  24  6  o 7  9.87714e+00 1.68638e+00 1.37025e+02 171.268 -1.23807e+01 1.90148e+00  0.00000e+00 0.00000e+00 2.25828e+02 171.268 8.88025e+01 171.268 0.9592 
1 1 1 15  24  7  o 3  6.38021e+00 1.71724e+00 1.25297e+02 160.531 -7.22320e+00 2.55351e+00  0.00000e+00 0.00000e+00 1.02549e+02 160.531 2.27477e+01 340.531 0.9322 
1 1 1 15  24  8  o 15 4.47693e+00 1.47624e+00 5.96809e+01 253.282 -8.55990e-01 -2.84988e+00 0.00000e+00 0.00000e+00 7.89378e+01 253.282 1.92569e+01 253.282 0.8082 
1 1 1 15  24  9  o 3  4.66137e+00 1.53166e+00 7.84737e+01 67.216  1.61213e+00  3.83816e+00  0.00000e+00 0.00000e+00 7.68233e+01 67.216  1.65045e+00 247.216 0.8695 
1 1 1 15  25  0  o 16 1.56082e+01 1.07941e+00 2.99319e+02 213.979 -3.98524e+01 -2.68593e+01 0.00000e+00 0.00000e+00 2.90671e+02 213.979 8.64777e+00 33.979  0.9895 
1 1 1 15  25  1  o 5  8.46313e+00 1.44860e+00 1.63892e+02 68.147  4.66361e+00  1.16288e+01  0.00000e+00 0.00000e+00 1.46391e+02 68.147  1.75018e+01 248.147 0.9592 
1 1 1 15  25  2  o 10 1.51757e+01 1.34361e+00 2.69639e+02 72.628  1.19863e+01  3.83133e+01  0.00000e+00 0.00000e+00 3.03421e+02 72.628  3.37820e+01 72.628  0.9875 
1 1 1 15  25  3  f 0  4.05131e+00 1.26815e+00 1.39154e+01 344.016 5.48167e-01  -1.57022e-01 0.00000e+00 0.00000e+00 2.85713e+01 344.016 1.46559e+01 344.016 0.2741 
1 1 1 15  25  4  o 1  9.15743e+00 1.58816e+00 1.72364e+02 227.653 -9.79935e+00 -1.07515e+01 0.00000e+00 0.00000e+00 1.65852e+02 227.653 6.51124e+00 47.653  0.9650 
1 1 1 15  25  5  o 19 4.74171e+00 1.54949e+00 3.91854e+01 290.763 6.25854e-01  -1.65077e+00 0.00000e+00 0.00000e+00 7.97672e+01 290.763 4.05819e+01 290.763 0.6552 
1 1 1 15  25  6  o 11 5.51268e+00 1.57792e+00 8.60054e+01 343.098 4.47670e+00  -1.36028e+00 0.00000e+00 0.00000e+00 1.00907e+02 343.098 1.49018e+01 343.098 0.8854 
1 1 1 15  25  7  o 8  6.21908e+00 1.73133e+00 1.20428e+02 316.220 4.91152e+00  -4.70665e+00 0.00000e+00 0.00000e+00 9.95079e+01 316.220 2.09201e+01 136.220 0.9233 
1 1 1 15  25  8  f 0  7.16478e+00 1.78367e+00 1.19417e+02 312.923 5.34231e+00  -5.74442e+00 0.00000e+00 0.00000e+00 1.36920e+02 312.923 1.75028e+01 312.923 0.9339 
1 1 1 15  25  9  o 1  6.25876e+00 1.84759e+00 1.87049e+02 168.478 -1.05841e+01 2.15752e+00  0.00000e+00 0.00000e+00 4.13584e+01 168.478 1.45691e+02 348.478 0.9525 
1 1 1 15  26  0  o 18 9.53101e+00 1.50620e+00 1.46831e+02 260.239 -2.08317e+00 -1.21093e+01 0.00000e+00 0.00000e+00 2.02079e+02 260.239 5.52479e+01 260.239 0.9584 
1 1 1 15  26  1  o 6  4.85581e+00 1.42601e+00 1.42010e+02 121.931 -3.43901e+00 5.51845e+00  0.00000e+00 0.00000e+00 2.86372e+01 121.931 1.13373e+02 301.930 0.9195 
1 1 1 15  26  2  o 13 1.03868e+01 1.43137e+00 2.33491e+02 3.142   2.17914e+01  1.19619e+00  0.00000e+00 0.00000e+00 1.54476e+02 3.142   7.90149e+01 183.142 0.9768 
1 1 1 15  26  3  o 16 1.13099e+01 1.37015e+00 1.85697e+02 143.885 -1.62951e+01 1.18892e+01  0.00000e+00 0.00000e+00 2.36105e+02 143.885 5.04079e+01 143.885 0.9749 
1 1 1 15  26  4  o 1  8.38732e+00 1.70395e+00 8.35847e+01 273.151 3.22388e-01  -5.85711e+00 0.00000e+00 0.00000e+00 2.08587e+02 273.151 1.25002e+02 273.151 0.9102 
1 1 1 15  26  5  f 0  5.26080e+00 1.60637e+00 4.53081e+01 47.383  1.46899e+00  1.59656e+00  0.00000e+00 0.00000e+00 1.00454e+02 47.383  5.51457e+01 47.383  0.7237 
1 1 1 15  26  6  o 4  8.10683e+00 1.72552e+00 2.06277e+02 233.100 -9.10253e+00 -1.21235e+01 0.00000e+00 0.00000e+00 9.37420e+01 233.100 1.12535e+02 53.100  0.9664 
1 1 1 15  26  7  o 14 1.56104e+01 1.76370e+00 2.52694e+02 79.248  6.54975e+00  3.44934e+01  0.00000e+00 0.00000e+00 3.36629e+02 79.248  8.39352e+01 79.248  0.9857 
1 1 1 15  26  8  o 3  5.93505e+00 1.76406e+00 4.42849e+01 159.300 -2.38949e+00 9.02934e-01  0.00000e+00 0.00000e+00 1.30957e+02 159.300 8.66722e+01 159.300 0.7708 
1 1 1 15  26  9  o 11 7.73165e+00 2.02276e+00 1.21327e+02 0.676   7.92339e+00  9.35431e-02  0.00000e+00 0.00000e+00 1.55500e+02 0.676   3.41738e+01 0.676   0.9346 
1 1 1 15  27  0  o 8  1.05715e+01 1.36037e+00 1.92852e+02 144.308 -1.56199e+01 1.12208e+01  0.00000e+00 0.00000e+00 2.00277e+02 144.308 7.42439e+00 144.308 0.9736 
1 1 1 15  27  1  o 16 1.89084e+01 1.04759e+00 2.72759e+02 0.934   5.84240e+01  9.52211e-01  0.00000e+00 0.00000e+00 4.43633e+02 0.934   1.70874e+02 0.934   0.9914 
1 1 1 15  27  2  o 8  5.45150e+00 1.49404e+00 1.41650e+02 88.555  1.69724e-01  6.72807e+00  0.00000e+00 0.00000e+00 5.06146e+01 88.555  9.10349e+01 268.555 0.9224 
1 1 1 15  27  3  o 7  5.40556e+00 1.52043e+00 8.81360e+01 133.003 -3.02488e+00 3.24349e+00  0.00000e+00 0.00000e+00 9.34964e+01 133.003 5.36042e+00 133.003 0.8784 
1 1 1 15  27  4  o 15 7.41713e+00 1.53417e+00 9.14586e+01 324.304 5.04981e+00  -3.62812e+00 0.00000e+00 0.00000e+00 1.68429e+02 324.304 7.69700e+01 324.304 0.9156 
1 1 1 15  27  5  o 15 6.22967e+00 1.65707e+00 1.02504e+02 295.020 2.38776e+00  -5.11590e+00 0.00000e+00 0.00000e+00 1.13668e+02 295.020 1.11632e+01 295.020 0.9065 
1 1 1 15  27  6  o 9  4.42241e+00 1.42848e+00 1.48102e+02 161.334 -6.71206e+00 2.26752e+00  0.00000e+00 0.00000e+00 8.78347e+00 161.334 1.39319e+02 341.334 0.9265 
1 1 1 15  27  7  o 10 4.26327e+00 1.43919e+00 4.69174e+01 353.274 2.30078e+00  -2.71319e-01 0.00000e+00 0.00000e+00 7.44799e+01 353.274 2.75625e+01 353.274 0.7435 
1 1 1 15  27  8  o 12 9.35423e+00 1.97309e+00 1.65805e+02 281.099 2.53186e+00  -1.29058e+01 0.00000e+00 0.00000e+00 1.78599e+02 281.099 1.27931e+01 281.099 0.9612 
1 1 1 15  27  9  o 13 5.98958e+00 1.76432e+00 4.33033e+01 108.635 -7.92647e-01 2.35060e+00  0.00000e+00 0.00000e+00 1.31736e+02 108.635 8.84323e+01 108.635 0.7629 
1 1 1 15  28  0  o 17 6.42311e+00 1.57383e+00 1.42822e+02 195.481 -7.71729e+00 -2.13748e+00 0.00000e+00 0.00000e+00 8.66139e+01 195.481 5.62077e+01 15.481  0.9353 
1 1 1 15  28  1  o 11 3.79181e+00 1.21751e+00 8.23516e+01 19.715  3.06908e+00  1.09977e+00  0.00000e+00 0.00000e+00 3.75537e+01 19.715  4.47979e+01 199.715 0.8275 
1 1 1 15  28  2  o 17 6.46123e+00 1.40025e+00 9.65784e+01 281.954 1.26245e+00  -5.96263e+00 0.00000e+00 0.00000e+00 1.29160e+02 281.954 3.25816e+01 281.954 0.9138 
1 1 1 15  28  3  o 8  1.05790e+01 1.40978e+00 1.47293e+02 62.373  7.16744e+00  1.36941e+01  0.00000e+00 0.00000e+00 2.44035e+02 62.373  9.67422e+01 62.373  0.9671 
1 1 1 15  28  4  o 18 7.02482e+00 1.60983e+00 8.76064e+01 204.200 -5.05260e+00 -2.27076e+00 0.00000e+00 0.00000e+00 1.55541e+02 204.200 6.79349e+01 204.200 0.9046 
1 1 1 15  28  5  o 4  6.02411e+00 1.63095e+00 1.33960e+02 150.546 -6.83405e+00 3.85930e+00  0.00000e+00 0.00000e+00 8.13940e+01 150.546 5.25659e+01 330.546 0.9339 
1 1 1 15  28  6  o 9  5.83707e+00 1.61674e+00 1.00251e+02 16.939  5.41507e+00  1.64925e+00  0.00000e+00 0.00000e+00 1.02396e+02 16.939  2.14534e+00 16.939  0.9067 
1 1 1 15  28  7  o 1  7.95329e+00 2.06618e+00 1.32338e+02 13.198  7.75088e+00  1.81770e+00  0.00000e+00 0.00000e+00 1.52413e+02 13.198  2.00751e+01 13.198  0.9349 
1 1 1 15  28  8  o 9  1.15517e+01 1.88998e+00 1.37121e+02 107.375 -4.32841e+00 1.38333e+01  0.00000e+00 0.00000e+00 2.89781e+02 107.375 1.52660e+02 107.375 0.9649 
1 1 1 15  28  9  o 11 6.60127e+00 1.87033e+00 1.04039e+02 175.579 -6.11251e+00 4.72576e-01  0.00000e+00 0.00000e+00 1.27161e+02 175.579 2.31221e+01 175.579 0.9143 
1 1 1 15  29  0  o 9  1.17980e+01 1.30529e+00 2.18960e+02 31.640  2.20146e+01  1.35645e+01  0.00000e+00 0.00000e+00 2.22783e+02 31.640  3.82313e+00 31.640  0.9805 
1 1 1 15  29  1  o 1  1.52420e+01 1.14939e+00 2.51920e+02 241.927 -1.85799e+01 -3.48363e+01 0.00000e+00 0.00000e+00 3.23055e+02 241.927 7.11356e+01 241.927 0.9873 
1 1 1 15  29  2  o 1  4.70401e+00 1.40529e+00 8.95411e+01 23.523  3.64732e+00  1.58763e+00  0.00000e+00 0.00000e+00 6.55949e+01 23.523  2.39463e+01 203.523 0.8627 
1 1 1 15  29  3  o 17 4.47593e+00 1.37598e+00 2.35350e+01 300.995 5.47454e-01  -9.11305e-01 0.00000e+00 0.00000e+00 5.66342e+01 300.995 3.30992e+01 300.995 0.4683 
1 1 1 15  29  4  o 4  1.29951e+01 1.30049e+00 1.67889e+02 160.215 -2.28259e+01 8.21097e+00  0.00000e+00 0.00000e+00 3.18971e+02 160.215 1.51081e+02 160.215 0.9792 
1 1 1 15  29  5  o 14 4.09042e+00 1.33925e+00 9.24920e+01 280.566 7.90072e-01  -4.23552e+00 0.00000e+00 0.00000e+00 4.44066e+01 280.566 4.80854e+01 100.566 0.8744 
1 1 1 15  29  6  o 5  4.87881e+00 1.53081e+00 8.29068e+01 4.679   4.21845e+00  3.45246e-01  0.00000e+00 0.00000e+00 7.99515e+01 4.679   2.95532e+00 184.679 0.8719 
1 1 1 15  29  7  o 11 8.64761e+00 1.98762e+00 2.01310e+02 170.945 -1.36234e+01 2.17122e+00  0.00000e+00 0.00000e+00 1.17594e+02 170.945 8.37154e+01 350.945 0.9630 
1 1 1 15  29  8  o 9  6.14909e+00 1.82863e+00 1.34303e+02 218.757 -5.94973e+00 -4.77630e+00 0.00000e+00 0.00000e+00 8.51723e+01 218.757 4.91311e+01 38.757  0.9320 
1 1 1 15  29  9  o 6  1.12288e+01 2.08097e+00 2.03654e+02 218.140 -1.44224e+01 -1.13250e+01 0.00000e+00 0.00000e+00 2.14532e+02 218.140 1.08780e+01 218.140 0.9723 
1 1 1 15  30  0  o 5  6.02030e+00 1.54086e+00 1.27967e+02 172.560 -6.76842e+00 8.83853e-01  0.00000e+00 0.00000e+00 8.43408e+01 172.560 4.36261e+01 352.560 0.9235 
1 1 1 15  30  1  o 13 1.29338e+01 1.35874e+00 1.64440e+02 125.456 -1.14867e+01 1.61301e+01  0.00000e+00 0.00000e+00 3.17081e+02 125.456 1.52641e+02 125.456 0.9744 
1 1 1 15  30  2  o 4  6.48964e+00 1.49187e+00 1.41627e+02 295.470 3.56723e+00  -7.48893e+00 0.00000e+00 0.00000e+00 9.09782e+01 295.470 5.06487e+01 115.470 0.9376 
1 1 1 15  30  3  o 1  4.97524e+00 1.45062e+00 1.41950e+02 352.766 6.97112e+00  -8.84839e-01 0.00000e+00 0.00000e+00 3.42106e+01 352.766 1.07739e+02 172.766 0.9258 
1 1 1 15  30  4  o 3  8.50930e+00 1.66863e+00 1.33515e+02 145.555 -8.44631e+00 5.79314e+00  0.00000e+00 0.00000e+00 1.75715e+02 145.555 4.22007e+01 145.555 0.9499 
1 1 1 15  30  5  o 15 6.70369e+00 1.66654e+00 1.50291e+02 288.721 3.03040e+00  -8.94227e+00 0.00000e+00 0.00000e+00 9.22772e+01 288.721 5.80133e+01 108.721 0.9455 
1 1 1 15  30  6  o 12 8.14470e+00 1.73173e+00 1.35773e+02 30.625  8.79531e+00  5.20672e+00  0.00000e+00 0.00000e+00 1.60351e+02 30.625  2.45781e+01 30.625  0.9497 
1 1 1 15  30  7  o 19 5.25405e+00 1.66097e+00 5.16934e+01 189.809 -2.71394e+00 -4.69196e-01 0.00000e+00 0.00000e+00 1.07242e+02 189.809 5.55489e+01 189.809 0.7900 
1 1 1 15  30  8  o 3  5.93959e+00 1.79527e+00 8.40860e+01 3.384   4.70353e+00  2.78091e-01  0.00000e+00 0.00000e+00 1.17496e+02 3.384   3.34105e+01 3.384   0.8862 
1 1 1 15  30  9  o 3  6.65139e+00 1.89737e+00 9.38118e+01 259.832 -1.00423e+00 -5.59900e+00 0.00000e+00 0.00000e+00 1.37294e+02 259.832 4.34823e+01 259.832 0.9072 
1 1 1 15  31  0  o 6  5.96110e+00 1.51030e+00 9.44222e+01 10.320  4.78786e+00  8.71808e-01  0.00000e+00 0.00000e+00 1.08192e+02 10.320  1.37695e+01 10.320  0.8902 
1 1 1 15  31  1  o 2  1.05958e+01 1.34624e+00 1.83579e+02 228.861 -1.28482e+01 -1.47080e+01 0.00000e+00 0.00000e+00 2.10716e+02 228.861 2.71365e+01 228.861 0.9741 
1 1 1 15  31  2  o 15 4.29731e+00 1.32779e+00 8.14852e+01 162.916 -3.45197e+00 1.06091e+00  0.00000e+00 0.00000e+00 5.75943e+01 162.916 2.38909e+01 342.916 0.8467 
1 1 1 15  31  3  o 5  9.21460e+00 1.55590e+00 1.91315e+02 163.260 -1.53075e+01 4.60412e+00  0.00000e+00 0.00000e+00 1.49852e+02 163.260 4.14628e+01 343.260 0.9682 
1 1 1 15  31  4  o 19 9.62188e+00 1.50646e+00 1.87829e+02 80.802  2.81245e+00  1.73677e+01  0.00000e+00 0.00000e+00 1.69644e+02 80.802  1.81849e+01 260.802 0.9712 
1 1 1 15  31  5  o 1  1.29775e+01 1.40139e+00 2.39949e+02 216.150 -2.77076e+01 -2.02419e+01 0.00000e+00 0.00000e+00 2.49388e+02 216.150 9.43865e+00 216.150 0.9853 
1 1 1 15  31  6  o 19 4.48974e+00 1.43688e+00 5.83602e+01 331.248 2.42359e+00  -1.32974e+00 0.00000e+00 0.00000e+00 7.75715e+01 331.248 1.92113e+01 331.248 0.7909 
1 1 1 15  31  7  o 18 4.64550e+00 1.48090e+00 5.62847e+01 251.230 -9.56149e-01 -2.81349e+00 0.00000e+00 0.00000e+00 8.74009e+01 251.230 3.11163e+01 251.230 0.8079 
1 1 1 15  31  8  o 13 5.43365e+00 1.68114e+00 1.36292e+02 214.077 -6.31264e+00 -4.27024e+00 0.00000e+00 0.00000e+00 5.75991e+01 214.077 7.86933e+01 34.077  0.9319 
1 1 1 15  31  9  o 9  1.42078e+01 1.86799e+00 1.85903e+02 104.358 -6.08362e+00 2.37670e+01  0.00000e+00 0.00000e+00 3.46982e+02 104.358 1.61079e+02 104.358 0.9794 
1 1 1 15  32  0  o 4  7.73470e+00 1.53118e+00 1.98826e+02 125.612 -8.16176e+00 1.13954e+01  0.00000e+00 0.00000e+00 8.57377e+01 125.612 1.13088e+02 305.612 0.9636 
1 1 1 15  32  1  o 6  5.23986e+00 1.37869e+00 5.52408e+01 279.175 4.41497e-01  -2.73345e+00 0.00000e+00 0.00000e+00 1.03157e+02 279.175 4.79157e+01 279.175 0.7913 
1 1 1 15  32  2  o 15 1.27364e+01 1.21032e+00 2.22305e+02 233.148 -1.86880e+01 -2.49339e+01 0.00000e+00 0.00000e+00 2.56607e+02 233.148 3.43024e+01 233.148 0.9838 
1 1 1 15  32  3  o 6  3.68425e+00 1.21583e+00 9.22350e+01 71.236  1.18319e+00  3.48267e+00  0.00000e+00 0.00000e+00 2.74953e+01 71.236  6.47398e+01 251.236 0.8499 
1 1 1 15  32  4  o 8  8.56491e+00 1.67095e+00 2.01616e+02 255.839 -3.70856e+00 -1.46980e+01 0.00000e+00 0.00000e+00 1.15014e+02 255.839 8.66018e+01 75.839  0.9664 
1 1 1 15  32  5  o 13 5.77016e+00 1.59952e+00 1.37301e+02 304.688 4.39316e+00  -6.34735e+00 0.00000e+00 0.00000e+00 6.86527e+01 304.688 6.86478e+01 124.688 0.9328 
1 1 1 15  32  6  o 7  7.56351e+00 1.80210e+00 1.58474e+02 32.682  9.17005e+00  5.88298e+00  0.00000e+00 0.00000e+00 1.17397e+02 32.682  4.10768e+01 212.682 0.9529 
1 1 1 15  32  7  o 11 4.10567e+00 1.37001e+00 1.16028e+02 79.077  1.10036e+00  5.70183e+00  0.00000e+00 0.00000e+00 2.68867e+01 79.077  8.91415e+01 259.077 0.9093 
1 1 1 15  32  8  o 19 4.64399e+00 1.52505e+00 1.32842e+02 352.709 6.66428e+00  -8.52614e-01 0.00000e+00 0.00000e+00 3.11452e+01 352.709 1.01697e+02 172.709 0.9222 
1 1 1 15  32  9  o 2  7.84933e+00 1.97781e+00 1.54628e+02 239.098 -5.42424e+00 -9.06269e+00 0.00000e+00 0.00000e+00 1.31335e+02 239.098 2.32929e+01 59.098  0.9514 
1 1 1 15  33  0  o 19 5.54380e+00 1.47458e+00 7.73383e+01 200.787 -3.76054e+00 -1.42756e+00 0.00000e+00 0.00000e+00 1.05595e+02 200.787 2.82566e+01 200.787 0.8644 
1 1 1 15  33  1  o 18 4.14787e+00 1.29946e+00 1.16448e+02 331.454 4.44288e+00  -2.41689e+00 0.00000e+00 0.00000e+00 2.53062e+01 331.454 9.11417e+01 151.454 0.8947 
1 1 1 15  33  2  o 1  9.16009e+00 1.46313e+00 1.85889e+02 206.387 -1.46854e+01 -7.28589e+00 0.00000e+00 0.00000e+00 1.53329e+02 206.387 3.25590e+01 26.388  0.9690 
1 1 1 15  33  3  o 11 5.00687e+00 1.51057e+00 8.66717e+01 107.886 -1.26673e+00 3.92504e+00  0.00000e+00 0.00000e+00 7.95188e+01 107.886 7.15285e+00 287.886 0.8681 
1 1 1 15  33  4  o 12 3.81968e+00 1.26604e+00 1.24550e+02 109.830 -1.95464e+00 5.42028e+00  0.00000e+00 0.00000e+00 8.17965e+00 109.830 1.16371e+02 289.830 0.9085 
1 1 1 15  33  5  o 15 5.00221e+00 1.53417e+00 5.85874e+01 21.698  2.76824e+00  1.10152e+00  0.00000e+00 0.00000e+00 9.61433e+01 21.698  3.75559e+01 21.698  0.8084 
1 1 1 15  33  6  o 13 6.61583e+00 1.64241e+00 1.48652e+02 113.060 -3.69232e+00 8.67336e+00  0.00000e+00 0.00000e+00 9.07155e+01 113.060 5.79367e+01 293.060 0.9454 
1 1 1 15  33  7  o 11 7.86658e+00 1.83131e+00 1.91313e+02 191.382 -1.35334e+01 -2.72429e+00 0.00000e+00 0.00000e+00 9.86971e+01 191.382 9.26163e+01 11.382  0.9631 
1 1 1 15  33  8  o 5  4.11275e+00 1.39312e+00 5.18810e+01 108.114 -8.37208e-01 2.55933e+00  0.00000e+00 0.00000e+00 7.16348e+01 108.114 1.97538e+01 108.114 0.7844 
1 1 1 15  33  9  o 9  6.26837e+00 1.84868e+00 1.58453e+02 7.854   9.40096e+00  1.29673e+00  0.00000e+00 0.00000e+00 6.85335e+01 7.854   8.99193e+01 187.854 0.9457 
1 1 1 15  34  0  o 15 9.60778e+00 1.36808e+00 2.57981e+02 113.145 -9.36091e+00 2.18988e+01  0.00000e+00 0.00000e+00 1.00981e+02 113.145 1.57000e+02 293.145 0.9788 
1 1 1 15  34  1  o 1  4.37940e+00 1.30259e+00 9.12828e+01 178.963 -4.17286e+00 7.55006e-02  0.00000e+00 0.00000e+00 5.42176e+01 178.963 3.70652e+01 358.963 0.8699 
1 1 1 15  34  2  o 13 7.42042e+00 1.59360e+00 1.96704e+02 229.313 -8.73992e+00 -1.01658e+01 0.00000e+00 0.00000e+00 7.60649e+01 229.313 1.20639e+02 49.313  0.9619 
1 1 1 15  34  3  f 0  9.87770e+00 1.60290e+00 1.34035e+02 71.560  3.92203e+00  1.17625e+01  0.00000e+00 0.00000e+00 2.28031e+02 71.560  9.39967e+01 71.560  0.9588 
1 1 1 15  34  4  o 12 4.78821e+00 1.42189e+00 1.01422e+02 314.543 3.75839e+00  -3.81886e+00 0.00000e+00 0.00000e+00 6.35893e+01 314.543 3.78327e+01 134.543 0.9011 
1 1 1 15  34  5  o 1  9.26193e+00 1.69270e+00 1.21360e+02 200.437 -9.72963e+00 -3.62565e+00 0.00000e+00 0.00000e+00 2.15462e+02 200.437 9.41027e+01 200.437 0.9506 
1 1 1 15  34  6  o 8  6.68709e+00 1.71871e+00 1.60644e+02 57.016  5.34816e+00  8.24045e+00  0.00000e+00 0.00000e+00 8.18630e+01 57.016  7.87812e+01 237.016 0.9476 
1 1 1 15  34  7  o 9  6.57321e+00 1.78911e+00 1.98109e+02 324.470 9.68602e+00  -6.91660e+00 0.00000e+00 0.00000e+00 4.26755e+01 324.470 1.55434e+02 144.470 0.9570 
1 1 1 15  34  8  f 0  4.98353e+00 1.58760e+00 5.39059e+01 102.477 -6.41821e-01 2.90066e+00  0.00000e+00 0.00000e+00 1.00206e+02 102.477 4.63000e+01 102.477 0.8078 
1 1 1 15  34  9  o 17 6.76914e+00 1.92363e+00 2.10210e+02 292.349 4.95330e+00  -1.20481e+01 0.00000e+00 0.00000e+00 3.87924e+01 292.349 1.71418e+02 112.349 0.9608 
1 1 1 15  35  0  o 12 6.83413e+00 1.48541e+00 7.85141e+01 278.227 7.27955e-01  -5.03470e+00 0.00000e+00 0.00000e+00 1.55038e+02 278.227 7.65236e+01 278.227 0.8954 
1 1 1 15  35  1  o 16 1.11968e+01 1.29900e+00 2.31814e+02 220.597 -2.07033e+01 -1.77428e+01 0.00000e+00 0.00000e+00 1.87875e+02 220.597 4.39386e+01 40.597  0.9815 
1 1 1 15  35  2  f 0  4.42379e+00 1.32173e+00 7.40962e+01 154.503 -3.03445e+00 1.44714e+00  0.00000e+00 0.00000e+00 6.67997e+01 154.503 7.29649e+00 334.503 0.8335 
1 1 1 15  35  3  o 6  6.83529e+00 1.71307e+00 1.45117e+02 106.031 -2.37339e+00 8.26015e+00  0.00000e+00 0.00000e+00 1.00467e+02 106.031 4.46493e+01 286.031 0.9399 
1 1 1 15  35  4  o 9  7.08018e+00 1.68152e+00 1.69813e+02 344.365 1.07571e+01  -3.01058e+00 0.00000e+00 0.00000e+00 8.85267e+01 344.365 8.12867e+01 164.365 0.9541 
1 1 1 15  35  5  o 15 5.76821e+00 1.58397e+00 1.30680e+02 205.602 -6.70238e+00 -3.21160e+00 0.00000e+00 0.00000e+00 7.45477e+01 205.602 5.61319e+01 25.603  0.9301 
1 1 1 15  35  6  o 15 5.55731e+00 1.59801e+00 1.33334e+02 354.362 7.71366e+00  -7.61434e-01 0.00000e+00 0.00000e+00 6.50813e+01 354.362 6.82532e+01 174.362 0.9331 
1 1 1 15  35  7  o 9  5.26786e+00 1.57870e+00 7.87835e+01 216.581 -3.66096e+00 -2.71699e+00 0.00000e+00 0.00000e+00 9.90489e+01 216.581 2.02654e+01 216.581 0.8820 
1 1 1 15  35  8  o 6  9.95730e+00 1.91056e+00 1.80690e+02 82.559  2.06406e+00  1.58045e+01  0.00000e+00 0.00000e+00 1.88300e+02 82.559  7.61000e+00 82.559  0.9681 
1 1 1 15  35  9  o 9  1.84032e+01 1.62049e+00 2.58565e+02 304.919 3.06904e+01  -4.39618e+01 0.00000e+00 0.00000e+00 4.39337e+02 304.919 1.80772e+02 304.919 0.9906 
1 1 1 15  36  0  o 7  4.75885e+00 1.36298e+00 9.27692e+01 184.196 -4.47316e+00 -3.28191e-01 0.00000e+00 0.00000e+00 6.70361e+01 184.196 2.57331e+01 4.196   0.8799 
1 1 1 15  36  1  o 11 4.18931e+00 1.29450e+00 7.14640e+01 69.070  1.15789e+00  3.02751e+00  0.00000e+00 0.00000e+00 6.07325e+01 69.070  1.07315e+01 249.070 0.8264 
1 1 1 15  36  2  o 18 1.26332e+01 1.23893e+00 1.84653e+02 316.795 1.86995e+01  -1.75633e+01 0.00000e+00 0.00000e+00 2.88509e+02 316.795 1.03856e+02 316.795 0.9803 
1 1 1 15  36  3  o 1  3.96225e+00 1.29941e+00 8.48061e+01 208.541 -3.18065e+00 -1.72988e+00 0.00000e+00 0.00000e+00 4.34969e+01 208.541 4.13092e+01 28.541  0.8472 
1 1 1 15  36  4  o 17 9.76950e+00 1.54149e+00 1.95127e+02 348.167 1.89191e+01  -3.96368e+00 0.00000e+00 0.00000e+00 1.68646e+02 348.167 2.64809e+01 168.167 0.9738 
1 1 1 15  36  5  o 17 5.65590e+00 1.57039e+00 1.17396e+02 129.624 -4.32214e+00 5.22019e+00  0.00000e+00 0.00000e+00 8.22782e+01 129.624 3.51182e+01 309.624 0.9230 
1 1 1 15  36  6  o 10 8.42937e+00 1.74248e+00 1.25888e+02 274.906 8.35309e-01  -9.73164e+00 0.00000e+00 0.00000e+00 1.79643e+02 274.906 5.37551e+01 274.906 0.9473 
1 1 1 15  36  7  o 12 6.35420e+00 1.69908e+00 1.02646e+02 58.591  3.53637e+00  5.79151e+00  0.00000e+00 0.00000e+00 1.21813e+02 58.591  1.91673e+01 58.591  0.9231 
1 1 1 15  36  8  o 3  9.78876e+00 1.90220e+00 1.41894e+02 340.016 1.19417e+01  -4.34264e+00 0.00000e+00 0.00000e+00 2.17707e+02 340.016 7.58131e+01 340.016 0.9598 
1 1 1 15  36  9  o 4  8.48977e+00 2.15161e+00 1.41162e+02 214.376 -7.92785e+00 -5.42343e+00 0.00000e+00 0.00000e+00 1.66396e+02 214.376 2.52336e+01 214.376 0.9464 
1 1 1 15  37  0  o 16 1.58336e+01 1.03530e+00 2.40811e+02 210.525 -4.06352e+01 -2.39595e+01 0.00000e+00 0.00000e+00 3.56970e+02 210.525 1.16159e+02 210.525 0.9893 
1 1 1 15  37  1  o 3  1.02654e+01 1.42389e+00 2.10607e+02 8.048   2.08148e+01  2.94314e+00  0.00000e+00 0.00000e+00 1.71913e+02 8.048   3.86940e+01 188.048 0.9759 
1 1 1 15  37  2  o 2  5.13966e+00 1.40362e+00 8.41605e+01 309.917 2.91171e+00  -3.48032e+00 0.00000e+00 0.00000e+00 8.89041e+01 309.917 4.74361e+00 309.917 0.8814 
1 1 1 15  37  3  o 9  1.03692e+01 1.48468e+00 2.07623e+02 291.520 7.68436e+00  -1.94881e+01 0.00000e+00 0.00000e+00 1.79103e+02 291.520 2.85206e+01 111.520 0.9758 
1 1 1 15  37  4  o 13 8.32621e+00 1.57188e+00 1.33168e+02 45.398  7.71236e+00  7.82020e+00  0.00000e+00 0.00000e+00 1.70321e+02 45.398  3.71525e+01 45.398  0.9533 
1 1 1 15  37  5  o 11 4.44319e+00 1.38905e+00 6.12564e+01 202.529 -2.72669e+00 -1.13104e+00 0.00000e+00 0.00000e+00 7.57767e+01 202.529 1.45203e+01 202.529 0.8064 
1 1 1 15  37  6  o 19 7.03445e+00 1.77537e+00 1.45071e+02 144.089 -7.78888e+00 5.64059e+00  0.00000e+00 0.00000e+00 1.09646e+02 144.089 3.54249e+01 324.089 0.9465 
1 1 1 15  37  7  o 9  4.85376e+00 1.49120e+00 9.30647e+01 306.200 3.07445e+00  -4.20076e+00 0.00000e+00 0.00000e+00 7.37100e+01 306.200 1.93547e+01 126.200 0.8979 
1 1 1 15  37  8  o 16 5.03633e+00 1.55913e+00 5.67277e+01 70.421  1.04576e+00  2.94028e+00  0.00000e+00 0.00000e+00 1.01038e+02 70.421  4.43108e+01 70.421  0.8185 
1 1 1 15  37  9  o 6  4.26905e+00 1.45458e+00 5.75424e+01 317.227 2.34009e+00  -2.16488e+00 0.00000e+00 0.00000e+00 7.69255e+01 317.227 1.93831e+01 317.227 0.8230 
1 1 1 15  38  0  o 13 4.62312e+00 1.33986e+00 7.18099e+01 344.704 3.25475e+00  -8.90164e-01 0.00000e+00 0.00000e+00 7.53555e+01 344.704 3.54564e+00 344.704 0.8343 
1 1 1 15  38  1  o 6  7.67342e+00 1.57268e+00 1.11191e+02 323.094 6.26818e+00  -4.70721e+00 0.00000e+00 0.00000e+00 1.62389e+02 323.094 5.11981e+01 323.094 0.9338 
1 1 1 15  38  2  o 18 1.06219e+01 1.37478e+00 1.54292e+02 134.548 -1.20437e+01 1.22353e+01  0.00000e+00 0.00000e+00 2.39446e+02 134.548 8.51538e+01 134.548 0.9704 
1 1 1 15  38  3  o 15 7.76811e+00 1.49813e+00 1.15472e+02 192.218 -9.23809e+00 -2.00034e+00 0.00000e+00 0.00000e+00 1.65217e+02 192.218 4.97443e+01 192.218 0.9455 
1 1 1 15  38  4  o 12 9.00120e+00 1.63184e+00 2.14725e+02 141.507 -1.45056e+01 1.15351e+01  0.00000e+00 0.00000e+00 1.19978e+02 141.507 9.47473e+01 321.507 0.9726 
1 1 1 15  38  5  o 3  6.80426e+00 1.63069e+00 7.30096e+01 297.816 2.34724e+00  -4.44892e+00 0.00000e+00 0.00000e+00 1.59643e+02 297.816 8.66331e+01 297.816 0.8941 
1 1 1 15  38  6  o 15 5.95928e+00 1.72381e+00 5.94068e+01 304.491 1.94842e+00  -2.83590e+00 0.00000e+00 0.00000e+00 1.31613e+02 304.491 7.22064e+01 304.491 0.8379 
1 1 1 15  38  7  o 18 6.76013e+00 1.73851e+00 1.36483e+02 281.321 1.77317e+00  -8.85660e+00 0.00000e+00 0.00000e+00 1.07400e+02 281.321 2.90832e+01 101.321 0.9429 
1 1 1 15  38  8  o 9  9.01215e+00 1.90303e+00 9.44399e+01 308.061 4.72272e+00  -6.03166e+00 0.00000e+00 0.00000e+00 2.27058e+02 308.061 1.32618e+02 308.061 0.9322 
1 1 1 15  38  9  o 5  6.22904e+00 1.88195e+00 4.00301e+01 153.076 -2.15311e+00 1.09347e+00  0.00000e+00 0.00000e+00 1.40048e+02 153.076 1.00018e+02 153.076 0.7554 
1 1 1 15  39  0  o 14 5.73077e+00 1.45581e+00 1.34019e+02 53.381  4.37457e+00  5.88628e+00  0.00000e+00 0.00000e+00 6.91190e+01 53.381  6.49004e+01 233.381 0.9291 
1 1 1 15  39  1  o 16 7.71763e+00 1.61058e+00 1.64088e+02 171.357 -1.16752e+01 1.77473e+00  0.00000e+00 0.00000e+00 1.17765e+02 171.357 4.63235e+01 351.357 0.9567 
1 1 1 15  39  2  o 3  8.20820e+00 1.57554e+00 1.71444e+02 326.663 1.08870e+01  -7.16148e+00 0.00000e+00 0.00000e+00 1.29781e+02 326.663 4.16627e+01 146.663 0.9608 
1 1 1 15  39  3  o 5  4.40614e+00 1.35298e+00 7.57155e+01 38.369  2.95232e+00  2.33741e+00  0.00000e+00 0.00000e+00 6.80449e+01 38.369  7.67069e+00 218.369 0.8539 
1 1 1 15  39  4  o 7  4.64332e+00 1.42667e+00 1.19405e+02 175.317 -5.98900e+00 4.90635e-01  0.00000e+00 0.00000e+00 4.25611e+01 175.317 7.68437e+01 355.317 0.9125 
1 1 1 15  39  5  o 6  5.14625e+00 1.48090e+00 6.36267e+01 56.179  1.92425e+00  2.87214e+00  0.00000e+00 0.00000e+00 1.01445e+02 56.179  3.78183e+01 56.179  0.8388 
1 1 1 15  39  6  o 9  4.63300e+00 1.53421e+00 1.20124e+02 341.619 5.87955e+00  -1.95368e+00 0.00000e+00 0.00000e+00 4.20738e+01 341.619 7.80506e+01 161.619 0.9153 
1 1 1 15  39  7  o 6  8.69079e+00 1.80032e+00 1.39235e+02 96.475  -1.29820e+00 1.14377e+01  0.00000e+00 0.00000e+00 1.78463e+02 96.475  3.92280e+01 96.475  0.9555 
1 1 1 15  39  8  o 7  4.09406e+00 1.38885e+00 8.07224e+01 216.416 -3.42191e+00 -2.52430e+00 0.00000e+00 0.00000e+00 5.59649e+01 216.416 2.47576e+01 36.416  0.8726 
1 1 1 15  39  9  f 0  6.16191e+00 1.75868e+00 3.94856e+01 211.948 -2.23761e+00 -1.39538e+00 0.00000e+00 0.00000e+00 1.44223e+02 211.948 1.04738e+02 211.948 0.7791 
1 1 1 15  40  0  o 9  3.51704e+00 1.13735e+00 1.02209e+02 308.851 2.60819e+00  -3.23804e+00 0.00000e+00 0.00000e+00 1.44289e+01 308.851 8.77799e+01 128.851 0.8693 
1 1 1 15  40  1  o 1  8.52667e+00 1.49659e+00 1.74769e+02 305.668 8.50685e+00  -1.18523e+01 0.00000e+00 0.00000e+00 1.39337e+02 305.668 3.54327e+01 125.668 0.9651 
1 1 1 15  40  2  o 11 5.71208e+00 1.44173e+00 6.50385e+01 107.864 -1.13516e+00 3.52205e+00  0.00000e+00 0.00000e+00 1.20586e+02 107.864 5.55478e+01 107.864 0.8509 
1 1 1 15  40  3  o 1  1.15119e+01 1.36698e+00 1.83952e+02 173.418 -2.36493e+01 2.72865e+00  0.00000e+00 0.00000e+00 2.46545e+02 173.418 6.25930e+01 173.418 0.9788 
1 1 1 15  40  4  f 0  1.04460e+01 1.54002e+00 1.59727e+02 294.993 7.33529e+00  -1.57355e+01 0.00000e+00 0.00000e+00 2.27868e+02 294.993 6.81406e+01 294.993 0.9708 
1 1 1 15  40  5  o 4  8.23882e+00 1.55987e+00 1.64726e+02 99.997  -2.52684e+00 1.43344e+01  0.00000e+00 0.00000e+00 1.39263e+02 99.997  2.54630e+01 279.997 0.9650 
1 1 1 15  40  6  o 7  1.26038e+01 1.79240e+00 2.47601e+02 298.244 1.34781e+01  -2.50907e+01 0.00000e+00 0.00000e+00 2.25892e+02 298.244 2.17091e+01 118.244 0.9823 
1 1 1 15  40  7  o 6  8.85362e+00 1.86428e+00 1.69357e+02 151.690 -1.15923e+01 6.24433e+00  0.00000e+00 0.00000e+00 1.56194e+02 151.690 1.31634e+01 331.690 0.9612 
1 1 1 15  40  8  o 4  1.12466e+01 1.93713e+00 1.90244e+02 229.866 -1.23364e+01 -1.46323e+01 0.00000e+00 0.00000e+00 2.28639e+02 229.866 3.83951e+01 229.866 0.9735 
1 1 1 15  41  0  o 16 9.52036e+00 1.27616e+00 1.46033e+02 42.950  1.14456e+01  1.06544e+01  0.00000e+00 0.00000e+00 2.05303e+02 42.950  5.92704e+01 42.950  0.9675 
1 1 1 15  41  1  o 2  4.74897e+00 1.44037e+00 6.30251e+01 118.634 -1.43116e+00 2.62126e+00  0.00000e+00 0.00000e+00 8.36030e+01 118.634 2.05778e+01 118.634 0.8090 
1 1 1 15  41  2  o 12 9.22864e+00 1.43307e+00 1.67341e+02 311.935 1.13070e+01  -1.25864e+01 0.00000e+00 0.00000e+00 1.74483e+02 311.935 7.14234e+00 311.935 0.9700 
1 1 1 15  41  3  o 14 3.65544e+00 1.19386e+00 6.65779e+01 269.972 -1.44968e-03 -3.00397e+00 0.00000e+00 0.00000e+00 4.65764e+01 269.972 2.00015e+01 89.972  0.8103 
1 1 1 15  41  4  o 14 5.31360e+00 1.53341e+00 9.73432e+01 14.296  5.00150e+00  1.27453e+00  0.00000e+00 0.00000e+00 8.48139e+01 14.296  1.25293e+01 194.296 0.8970 
1 1 1 15  41  5  f 0  9.71446e+00 1.61588e+00 6.40929e+01 156.246 -5.67240e+00 2.49638e+00  0.00000e+00 0.00000e+00 2.75848e+02 156.246 2.11755e+02 156.246 0.9153 
1 1 1 15  41  6  o 12 5.88873e+00 1.76860e+00 1.00205e+02 15.811  5.50409e+00  1.55862e+00  0.00000e+00 0.00000e+00 1.04219e+02 15.811  4.01459e+00 15.811  0.9078 
1 1 1 15  41  7  o 13 3.85879e+00 1.31059e+00 8.37673e+01 161.998 -4.09643e+00 1.33118e+00  0.00000e+00 0.00000e+00 4.52856e+01 161.998 3.84817e+01 341.998 0.8744 
1 1 1 15  41  8  o 15 4.20231e+00 1.40994e+00 4.27075e+01 3.636   2.31784e+00  1.47288e-01  0.00000e+00 0.00000e+00 7.69325e+01 3.636   3.42250e+01 3.636   0.7442 
1 1 1 15  42  0  o 3  4.80134e+00 1.31979e+00 8.65678e+01 11.402  4.39278e+00  8.85937e-01  0.00000e+00 0.00000e+00 7.45394e+01 11.402  1.20284e+01 191.402 0.8798 
1 1 1 15  42  1  o 17 4.34411e+00 1.32040e+00 3.85045e+01 188.591 -1.93896e+00 -2.92944e-01 0.00000e+00 0.00000e+00 7.60916e+01 188.591 3.75871e+01 188.591 0.6913 
1 1 1 15  42  2  o 19 3.55332e+00 1.17123e+00 8.85688e+01 159.883 -3.69975e+00 1.35514e+00  0.00000e+00 0.00000e+00 2.82682e+01 159.883 6.03006e+01 339.883 0.8612 
1 1 1 15  42  3  o 2  5.95685e+00 1.30894e+00 8.34992e+01 302.045 3.06151e+00  -4.89082e+00 0.00000e+00 0.00000e+00 1.23254e+02 302.045 3.97547e+01 302.045 0.9086 
1 1 1 15  42  4  o 10 5.50216e+00 1.48346e+00 7.45795e+01 163.690 -4.04066e+00 1.18235e+00  0.00000e+00 0.00000e+00 1.08584e+02 163.690 3.40047e+01 163.690 0.8711 
1 1 1 15  42  5  o 3  6.52347e+00 1.64135e+00 1.63253e+02 32.659  9.21223e+00  5.90481e+00  0.00000e+00 0.00000e+00 7.44309e+01 32.659  8.88222e+01 212.659 0.9531 
1 1 1 15  42  6  o 15 7.04721e+00 1.69912e+00 1.86619e+02 258.608 -2.70328e+00 -1.34160e+01 0.00000e+00 0.00000e+00 7.28020e+01 258.608 1.13817e+02 78.608  0.9627 
1 1 1 15  42  7  o 10 4.22328e+00 1.40113e+00 1.04565e+02 224.516 -3.90710e+00 -3.84170e+00 0.00000e+00 0.00000e+00 4.13544e+01 224.516 6.32102e+01 44.516  0.9034 
1 1 1 15  42  8  o 12 5.33567e+00 1.67156e+00 5.67026e+01 85.507  2.57969e-01  3.28291e+00  0.00000e+00 0.00000e+00 1.12593e+02 85.507  5.58899e+01 85.507  0.8295 
1 1 1 15  43  0  o 17 3.85298e+00 1.21579e+00 6.66247e+01 352.221 2.85901e+00  -3.90572e-01 0.00000e+00 0.00000e+00 5.10932e+01 352.221 1.55315e+01 172.221 0.8012 
1 1 1 15  43  1  o 15 5.51265e+00 1.40566e+00 9.48501e+01 214.792 -4.70189e+00 -3.26692e+00 0.00000e+00 0.00000e+00 9.61188e+01 214.792 1.26876e+00 214.792 0.9079 
1 1 1 15  43  2  o 10 5.39078e+00 1.41864e+00 1.58323e+02 345.830 9.01923e+00  -2.27720e+00 0.00000e+00 0.00000e+00 3.60818e+01 345.830 1.22242e+02 165.830 0.9446 
1 1 1 15  43  3  o 7  4.71500e+00 1.35772e+00 1.11302e+02 70.322  1.99243e+00  5.57152e+00  0.00000e+00 0.00000e+00 5.27655e+01 70.322  5.85362e+01 250.322 0.9111 
1 1 1 15  43  4  f 0  1.14370e+01 1.47242e+00 2.09052e+02 229.803 -1.72533e+01 -2.04186e+01 0.00000e+00 0.00000e+00 2.19693e+02 229.803 1.06410e+01 229.803 0.9811 
1 1 1 15  43  5  o 6  8.55188e+00 1.67020e+00 1.06347e+02 37.261  7.28268e+00  5.54009e+00  0.00000e+00 0.00000e+00 2.02106e+02 37.261  9.57585e+01 37.261  0.9437 
1 1 1 15  43  6  o 6  4.19932e+00 1.37847e+00 4.40566e+01 79.704  4.10287e-01  2.25860e+00  0.00000e+00 0.00000e+00 7.48785e+01 79.704  3.08219e+01 79.704  0.7408 
1 1 1 15  43  7  o 8  6.81192e+00 1.79103e+00 1.34527e+02 336.847 8.30576e+00  -3.55172e+00 0.00000e+00 0.00000e+00 1.11089e+02 336.847 2.34377e+01 156.847 0.9429 
1 1 1 15  43  8  o 15 5.48969e+00 1.72120e+00 1.01236e+02 33.099  5.01781e+00  3.27100e+00  0.00000e+00 0.00000e+00 9.02854e+01 33.099  1.09509e+01 213.099 0.9122 
1 1 1 15  44  0  o 15 3.71229e+00 1.17615e+00 7.80960e+01 92.857  -1.84048e-01 3.68812e+00  0.00000e+00 0.00000e+00 4.23050e+01 92.857  3.57911e+01 272.857 0.8506 
1 1 1 15  44  1  o 2  6.15226e+00 1.46051e+00 1.35938e+02 272.621 4.07068e-01  -8.89262e+00 0.00000e+00 0.00000e+00 8.51826e+01 272.621 5.07550e+01 92.621  0.9420 
1 1 1 15  44  2  o 13 4.88897e+00 1.35124e+00 1.15368e+02 34.993  5.20801e+00  3.64570e+00  0.00000e+00 0.00000e+00 5.58731e+01 34.993  5.94949e+01 214.993 0.9176 
1 1 1 15  44  3  o 3  1.34643e+01 1.32028e+00 2.60857e+02 225.541 -2.92251e+01 -2.97824e+01 0.00000e+00 0.00000e+00 2.47141e+02 225.541 1.37160e+01 45.541  0.9879 
1 1 1 15  44  4  o 6  8.54823e+00 1.59885e+00 1.78877e+02 69.079  5.71298e+00  1.49445e+01  0.00000e+00 0.00000e+00 1.37328e+02 69.079  4.15491e+01 249.079 0.9682 
1 1 1 15  44  5  o 10 4.33159e+00 1.36776e+00 2.12751e+01 187.017 -1.13485e+00 -1.39675e-01 0.00000e+00 0.00000e+00 6.06515e+01 187.017 3.93764e+01 187.017 0.4949 
1 1 1 15  44  6  o 2  5.55276e+00 1.62091e+00 1.02781e+02 10.401  6.01712e+00  1.10440e+00  0.00000e+00 0.00000e+00 9.12634e+01 10.401  1.15176e+01 190.400 0.9141 
1 1 1 15  44  7  o 17 4.39381e+00 1.45168e+00 3.63364e+01 163.248 -1.79009e+00 5.38812e-01  0.00000e+00 0.00000e+00 7.70831e+01 163.248 4.07466e+01 163.248 0.6751 
1 1 1 15  44  8  f 0  4.12082e+00 1.42146e+00 1.63127e+01 32.896  7.50732e-01  4.85589e-01  0.00000e+00 0.00000e+00 4.79196e+01 32.896  3.16069e+01 32.896  0.4076 
1 1 1 15  45  0  o 19 6.63168e+00 1.46802e+00 1.40620e+02 292.093 3.69798e+00  -9.11001e+00 0.00000e+00 0.00000e+00 9.89957e+01 292.093 4.16245e+01 112.093 0.9477 
1 1 1 15  45  1  o 7  1.09259e+01 1.22704e+00 1.82208e+02 55.841  1.35438e+01  1.99600e+01  0.00000e+00 0.00000e+00 2.25862e+02 55.841  4.36534e+01 55.841  0.9790 
1 1 1 15  45  2  o 3  7.32120e+00 1.46689e+00 1.58762e+02 264.874 -1.09909e+00 -1.22516e+01 0.00000e+00 0.00000e+00 1.09060e+02 264.874 4.97019e+01 84.874  0.9584 
1 1 1 15  45  3  o 1  9.24008e+00 1.50921e+00 2.11398e+02 343.254 1.89119e+01  -5.69030e+00 0.00000e+00 0.00000e+00 1.32383e+02 343.254 7.90153e+01 163.254 0.9743 
1 1 1 15  45  4  o 4  4.67583e+00 1.32511e+00 7.28423e+01 213.826 -3.36355e+00 -2.25388e+00 0.00000e+00 0.00000e+00 8.17277e+01 213.826 8.88538e+00 213.826 0.8654 
1 1 1 15  45  5  o 18 6.59001e+00 1.57985e+00 6.89576e+01 90.249  -2.05665e-02 4.73955e+00  0.00000e+00 0.00000e+00 1.54400e+02 90.249  8.54426e+01 90.249  0.8870 
1 1 1 15  45  6  o 9  4.10299e+00 1.30734e+00 7.82696e+01 241.394 -1.92175e+00 -3.52389e+00 0.00000e+00 0.00000e+00 5.72376e+01 241.394 2.10320e+01 61.394  0.8641 
1 1 1 15  45  7  o 12 4.23506e+00 1.39685e+00 3.66191e+01 293.859 7.92000e-01  -1.79074e+00 0.00000e+00 0.00000e+00 7.52225e+01 293.859 3.86034e+01 293.859 0.6908 
1 1 1 15  45  8  o 1  7.27903e+00 2.03929e+00 1.47111e+02 221.009 -7.02688e+00 -6.11025e+00 0.00000e+00 0.00000e+00 1.15814e+02 221.009 3.12975e+01 41.009  0.9447 
1 1 1 15  46  0  o 6  5.25447e+00 1.38900e+00 9.50324e+01 36.005  4.45775e+00  3.23939e+00  0.00000e+00 0.00000e+00 8.60490e+01 36.005  8.98348e+00 216.005 0.9040 
1 1 1 15  46  1  o 3  5.04250e+00 1.40775e+00 1.12456e+02 279.888 1.06659e+00  -6.11854e+00 0.00000e+00 0.00000e+00 6.36328e+01 279.888 4.88228e+01 99.888  0.9155 
1 1 1 15  46  2  o 16 9.92579e+00 1.36709e+00 1.51177e+02 274.772 1.44270e+00  -1.72821e+01 0.00000e+00 0.00000e+00 2.16532e+02 274.772 6.53555e+01 274.772 0.9707 
1 1 1 15  46  3  o 13 4.93771e+00 1.43974e+00 1.22624e+02 38.706  5.39360e+00  4.32208e+00  0.00000e+00 0.00000e+00 5.16717e+01 38.706  7.09522e+01 218.706 0.9245 
1 1 1 15  46  4  o 17 8.41535e+00 1.61886e+00 1.30520e+02 191.710 -1.12122e+01 -2.32393e+00 0.00000e+00 0.00000e+00 1.76533e+02 191.710 4.60130e+01 191.710 0.9553 
1 1 1 15  46  5  o 19 7.42830e+00 1.69413e+00 1.48122e+02 346.289 1.08810e+01  -2.65468e+00 0.00000e+00 0.00000e+00 1.22714e+02 346.289 2.54080e+01 166.289 0.9543 
1 1 1 15  46  6  o 9  3.96769e+00 1.30628e+00 4.26479e+01 290.146 7.79387e-01  -2.12446e+00 0.00000e+00 0.00000e+00 6.90411e+01 290.146 2.63932e+01 290.146 0.7366 
1 1 1 15  46  7  o 19 5.13940e+00 1.57698e+00 5.58246e+01 137.375 -2.38632e+00 2.19628e+00  0.00000e+00 0.00000e+00 1.06543e+02 137.375 5.07180e+01 137.375 0.8265 
1 1 1 15  46  8  f 0  5.13260e+00 1.67786e+00 9.33251e+01 240.774 -2.69069e+00 -4.80927e+00 0.00000e+00 0.00000e+00 8.40680e+01 240.774 9.25701e+00 60.774  0.9040 
1 1 1 15  47  0  o 8  5.71772e+00 1.40968e+00 1.33353e+02 300.497 4.23321e+00  -7.18731e+00 0.00000e+00 0.00000e+00 7.10729e+01 300.497 6.22799e+01 120.497 0.9380 
1 1 1 15  47  1  o 7  5.67592e+00 1.46638e+00 1.62474e+02 184.948 -9.72036e+00 -8.41616e-01 0.00000e+00 0.00000e+00 4.25843e+01 184.948 1.19890e+02 4.948   0.9473 
1 1 1 15  47  2  o 13 5.72572e+00 1.42929e+00 1.34603e+02 230.637 -5.17965e+00 -6.31408e+00 0.00000e+00 0.00000e+00 7.00305e+01 230.637 6.45723e+01 50.637  0.9366 
1 1 1 15  47  3  o 12 6.44916e+00 1.61703e+00 1.38770e+02 264.707 -8.02576e-01 -8.66310e+00 0.00000e+00 0.00000e+00 9.28158e+01 264.707 4.59537e+01 84.707  0.9406 
1 1 1 15  47  4  o 19 1.32649e+01 1.32879e+00 1.84539e+02 326.916 2.56872e+01  -1.67347e+01 0.00000e+00 0.00000e+00 3.13717e+02 326.916 1.29178e+02 326.916 0.9836 
1 1 1 15  47  5  o 12 1.68463e+01 1.21911e+00 2.86939e+02 112.366 -2.65200e+01 6.44520e+01  0.00000e+00 0.00000e+00 3.52002e+02 112.366 6.50627e+01 112.366 0.9928 
1 1 1 15  47  6  o 4  5.15795e+00 1.54189e+00 4.34261e+01 42.155  1.87684e+00  1.69916e+00  0.00000e+00 0.00000e+00 1.08028e+02 42.155  6.46015e+01 42.155  0.7684 
1 1 1 15  47  7  o 6  5.86259e+00 1.70024e+00 1.11705e+02 253.185 -1.98581e+00 -6.57119e+00 0.00000e+00 0.00000e+00 9.53372e+01 253.185 1.63677e+01 73.185  0.9240 
1 1 1 15  47  8  o 10 6.46715e+00 1.82432e+00 5.47141e+01 86.917  1.91815e-01  3.56105e+00  0.00000e+00 0.00000e+00 1.54058e+02 86.917  9.93443e+01 86.917  0.8445 
1 1 1 15  48  0  o 13 1.17943e+01 1.22436e+00 2.42768e+02 300.000 1.74350e+01  -3.01984e+01 0.00000e+00 0.00000e+00 2.00238e+02 300.000 4.25293e+01 120.000 0.9856 
1 1 1 15  48  1  o 14 9.16251e+00 1.34695e+00 1.19812e+02 213.806 -1.06648e+01 -7.14100e+00 0.00000e+00 0.00000e+00 2.15687e+02 213.806 9.58746e+01 213.806 0.9602 
1 1 1 15  48  2  o 1  5.64048e+00 1.47575e+00 1.09927e+02 137.535 -5.10681e+00 4.67387e+00  0.00000e+00 0.00000e+00 8.90613e+01 137.535 2.08657e+01 317.534 0.9247 
1 1 1 15  48  3  o 4  5.24936e+00 1.47813e+00 1.43718e+02 31.775  7.23994e+00  4.48461e+00  0.00000e+00 0.00000e+00 4.44924e+01 31.775  9.92254e+01 211.775 0.9393 
1 1 1 15  48  4  o 15 1.13944e+01 1.35205e+00 2.05260e+02 144.339 -2.38104e+01 1.70847e+01  0.00000e+00 0.00000e+00 2.22348e+02 144.339 1.70886e+01 144.339 0.9828 
1 1 1 15  48  5  f 0  6.87919e+00 1.55476e+00 7.50446e+01 325.080 4.67595e+00  -3.26439e+00 0.00000e+00 0.00000e+00 1.63413e+02 325.080 8.83689e+01 325.080 0.9075 
1 1 1 15  48  6  o 16 3.81309e+00 1.24732e+00 6.35490e+01 207.434 -3.07944e+00 -1.59854e+00 0.00000e+00 0.00000e+00 5.87590e+01 207.434 4.78998e+00 27.434  0.8395 
1 1 1 15  48  7  o 7  6.86959e+00 1.78194e+00 1.57618e+02 129.635 -6.96657e+00 8.41074e+00  0.00000e+00 0.00000e+00 9.25866e+01 129.635 6.50313e+01 309.635 0.9531 
1 1 1 15  48  8  o 16 8.84886e+00 1.98744e+00 1.36089e+02 46.422  7.44277e+00  7.82168e+00  0.00000e+00 0.00000e+00 1.86064e+02 46.422  4.99750e+01 46.422  0.9525 
1 1 1 15  49  0  f 0  8.56517e+00 1.34163e+00 1.97452e+02 135.422 -1.41275e+01 1.39208e+01  0.00000e+00 0.00000e+00 1.20600e+02 135.422 7.68522e+01 315.422 0.9745 
1 1 1 15  49  1  o 10 3.19385e+00 1.06173e+00 5.40868e+01 63.415  1.00430e+00  2.00687e+00  0.00000e+00 0.00000e+00 3.53043e+01 63.415  1.87825e+01 243.415 0.7341 
1 1 1 15  49  2  o 3  8.52104e+00 1.56150e+00 1.69338e+02 224.573 -1.03363e+01 -1.01834e+01 0.00000e+00 0.00000e+00 1.44314e+02 224.573 2.50236e+01 44.573  0.9649 
1 1 1 15  49  3  o 1  5.08708e+00 1.37517e+00 6.80088e+01 326.967 3.53738e+00  -2.30012e+00 0.00000e+00 0.00000e+00 1.01185e+02 326.967 3.31761e+01 326.967 0.8715 
1 1 1 15  49  4  o 3  4.52982e+00 1.36356e+00 9.52047e+01 283.795 1.22762e+00  -4.99987e+00 0.00000e+00 0.00000e+00 5.98814e+01 283.795 3.53233e+01 103.795 0.8967 
1 1 1 15  49  5  o 11 5.41707e+00 1.55582e+00 5.68576e+01 286.197 9.60987e-01  -3.30843e+00 0.00000e+00 0.00000e+00 1.16558e+02 286.197 5.97000e+01 286.197 0.8382 
1 1 1 15  49  6  o 18 4.49699e+00 1.43657e+00 1.35589e+02 264.573 -6.82050e-01 -7.17914e+00 0.00000e+00 0.00000e+00 2.38092e+01 264.573 1.11780e+02 84.573  0.9278 
1 1 1 15  49  7  o 16 3.85455e+00 1.29511e+00 5.86253e+01 242.226 -1.54348e+00 -2.93072e+00 0.00000e+00 0.00000e+00 6.37200e+01 242.226 5.09479e+00 242.226 0.8307 
1 1 1 15  49  8  o 19 6.69249e+00 1.92045e+00 7.26076e+01 18.559  4.47241e+00  1.50154e+00  0.00000e+00 0.00000e+00 1.54101e+02 18.559  8.14932e+01 18.559  0.8864 
1 1 1 15  50  0  o 10 8.60349e+00 1.35916e+00 1.64940e+02 281.245 3.05031e+00  -1.53420e+01 0.00000e+00 0.00000e+00 1.52207e+02 281.245 1.27329e+01 101.245 0.9675 
1 1 1 15  50  1  o 14 4.70072e+00 1.34667e+00 1.31745e+02 246.639 -2.97047e+00 -6.87712e+00 0.00000e+00 0.00000e+00 3.50324e+01 246.639 9.67125e+01 66.639  0.9306 
1 1 1 15  50  2  o 14 4.14715e+00 1.27453e+00 9.01773e+01 14.086  4.65861e+00  1.16897e+00  0.00000e+00 0.00000e+00 5.03863e+01 14.086  3.97910e+01 194.086 0.8886 
1 1 1 15  50  3  o 3  4.18603e+00 1.30323e+00 9.15536e+01 196.830 -4.66844e+00 -1.41215e+00 0.00000e+00 0.00000e+00 5.06876e+01 196.830 4.08660e+01 16.830  0.8905 
1 1 1 15  50  4  o 8  1.56106e+01 1.25319e+00 2.96162e+02 10.124  6.19481e+01  1.10612e+01  0.00000e+00 0.00000e+00 2.95020e+02 10.124  1.14244e+00 190.124 0.9920 
1 1 1 15  50  5  o 19 5.92369e+00 1.56545e+00 1.11221e+02 228.867 -4.59654e+00 -5.26302e+00 0.00000e+00 0.00000e+00 9.81138e+01 228.867 1.31075e+01 48.867  0.9254 
1 1 1 15  50  6  o 2  1.19118e+01 1.64546e+00 1.64665e+02 67.181  8.12309e+00  1.93057e+01  0.00000e+00 0.00000e+00 2.79341e+02 67.181  1.14676e+02 67.181  0.9758 
1 1 1 15  50  7  o 3  4.78867e+00 1.53073e+00 5.35839e+01 166.061 -3.06048e+00 7.59605e-01  0.00000e+00 0.00000e+00 9.65693e+01 166.061 4.29853e+01 166.061 0.8207 
1 1 1 15  50  8  o 1  1.25436e+01 1.90114e+00 2.13814e+02 10.978  2.57962e+01  5.00390e+00  0.00000e+00 0.00000e+00 2.56284e+02 10.978  4.24698e+01 10.978  0.9808 
1 1 1 15  51  0  o 8  5.94415e+00 1.33903e+00 1.09652e+02 8.478   7.83381e+00  1.16766e+00  0.00000e+00 0.00000e+00 1.01977e+02 8.478   7.67492e+00 188.478 0.9346 
1 1 1 15  51  1  o 11 5.37735e+00 1.36588e+00 8.45121e+01 227.423 -3.47025e+00 -3.77689e+00 0.00000e+00 0.00000e+00 9.92045e+01 227.423 1.46924e+01 227.423 0.8963 
1 1 1 15  51  2  o 2  5.32305e+00 1.47317e+00 5.50599e+01 184.163 -3.17237e+00 -2.30912e-01 0.00000e+00 0.00000e+00 1.11916e+02 184.163 5.68562e+01 184.163 0.8225 
1 1 1 15  51  3  o 6  7.18276e+00 1.47733e+00 1.33626e+02 267.939 -3.98659e-01 -1.10776e+01 0.00000e+00 0.00000e+00 1.27760e+02 267.939 5.86581e+00 87.939  0.9538 
1 1 1 15  51  4  o 4  5.87586e+00 1.51304e+00 5.74743e+01 255.898 -9.71067e-01 -3.86534e+00 0.00000e+00 0.00000e+00 1.36071e+02 255.898 7.85964e+01 255.898 0.8630 
1 1 1 15  51  5  o 9  6.57978e+00 1.56371e+00 9.31339e+01 86.280  4.43105e-01  6.81449e+00  0.00000e+00 0.00000e+00 1.38896e+02 86.280  4.57618e+01 86.280  0.9236 
1 1 1 15  51  6  o 12 3.30110e+00 1.15109e+00 4.58974e+01 131.177 -1.50501e+00 1.72057e+00  0.00000e+00 0.00000e+00 4.73446e+01 131.177 1.44716e+00 131.177 0.7396 
1 1 1 15  51  7  o 9  6.39043e+00 1.79977e+00 1.80414e+02 276.302 1.29900e+00  -1.17618e+01 0.00000e+00 0.00000e+00 5.31498e+01 276.302 1.27264e+02 96.302  0.9568 
1 1 1 15  52  0  o 10 8.55601e+00 1.29100e+00 8.18221e+01 142.307 -6.52993e+00 5.04555e+00  0.00000e+00 0.00000e+00 2.23647e+02 142.307 1.41825e+02 142.307 0.9373 
1 1 1 15  52  1  o 3  5.05122e+00 1.26828e+00 7.50181e+01 228.533 -3.08412e+00 -3.49005e+00 0.00000e+00 0.00000e+00 9.53162e+01 228.533 2.02981e+01 228.533 0.8848 
1 1 1 15  52  2  o 10 5.63156e+00 1.55615e+00 9.77377e+01 188.271 -5.89842e+00 -8.57479e-01 0.00000e+00 0.00000e+00 9.80529e+01 188.271 3.15128e-01 188.271 0.9117 
1 1 1 15  52  3  o 2  4.84194e+00 1.39840e+00 6.43682e+01 87.161  1.80226e-01  3.63495e+00  0.00000e+00 0.00000e+00 9.22846e+01 87.161  2.79164e+01 87.161  0.8481 
1 1 1 15  52  4  o 1  4.50411e+00 1.36527e+00 6.98784e+01 207.899 -3.53377e+00 -1.87097e+00 0.00000e+00 0.00000e+00 7.85481e+01 207.899 8.66978e+00 207.899 0.8635 
1 1 1 15  52  5  o 2  7.18240e+00 1.72658e+00 9.65163e+01 313.197 4.89007e+00  -5.20787e+00 0.00000e+00 0.00000e+00 1.57698e+02 313.197 6.11813e+01 313.197 0.9271 
1 1 1 15  52  6  o 8  7.90679e+00 1.75615e+00 9.32704e+01 286.563 2.14062e+00  -7.19757e+00 0.00000e+00 0.00000e+00 1.87777e+02 286.563 9.45068e+01 286.563 0.9308 
1 1 1 15  52  7  o 12 5.59852e+00 1.64450e+00 1.30871e+02 3.403   8.62102e+00  5.12670e-01  0.00000e+00 0.00000e+00 7.01749e+01 3.403   6.06959e+01 183.403 0.9402 
1 1 1 15  53  0  o 2  8.11711e+00 1.49499e+00 2.37653e+02 18.109  1.96485e+01  6.42564e+00  0.00000e+00 0.00000e+00 6.39173e+01 18.109  1.73735e+02 198.109 0.9755 
1 1 1 15  53  1  o 3  7.60331e+00 1.36618e+00 1.43725e+02 277.047 1.64367e+00  -1.32965e+01 0.00000e+00 0.00000e+00 1.34984e+02 277.047 8.74142e+00 97.047  0.9619 
1 1 1 15  53  2  o 8  6.16860e+00 1.52401e+00 1.52839e+02 201.173 -9.85142e+00 -3.81571e+00 0.00000e+00 0.00000e+00 7.09255e+01 201.173 8.19136e+01 21.173  0.9514 
1 1 1 15  53  3  o 6  8.64641e+00 1.54440e+00 1.50311e+02 207.996 -1.28870e+01 -6.85114e+00 0.00000e+00 0.00000e+00 1.67990e+02 207.996 1.76798e+01 207.996 0.9651 
1 1 1 15  53  4  o 11 6.73275e+00 1.66575e+00 1.13320e+02 48.620  5.02366e+00  5.70229e+00  0.00000e+00 0.00000e+00 1.26040e+02 48.620  1.27205e+01 48.620  0.9317 
1 1 1 15  53  5  o 17 6.94358e+00 1.68551e+00 1.05560e+02 37.387  5.86015e+00  4.47838e+00  0.00000e+00 0.00000e+00 1.40801e+02 37.387  3.52401e+01 37.387  0.9295 
1 1 1 15  53  6  o 8  5.23685e+00 1.53344e+00 1.58545e+02 214.243 -8.22687e+00 -5.60005e+00 0.00000e+00 0.00000e+00 3.10782e+01 214.243 1.27466e+02 34.243  0.9483 
1 1 1 15  53  7  o 13 4.77233e+00 1.54995e+00 4.04933e+01 143.432 -1.89500e+00 1.40570e+00  0.00000e+00 0.00000e+00 9.59788e+01 143.432 5.54855e+01 143.432 0.7488 
1 1 1 15  54  0  o 17 1.16755e+01 1.22828e+00 1.91667e+02 218.698 -2.33579e+01 -1.87116e+01 0.00000e+00 0.00000e+00 2.45441e+02 218.698 5.37738e+01 218.698 0.9831 
1 1 1 15  54  1  o 17 1.38858e+01 1.12131e+00 2.14915e+02 137.712 -3.14309e+01 2.85874e+01  0.00000e+00 0.00000e+00 3.07893e+02 137.712 9.29784e+01 137.712 0.9882 
1 1 1 15  54  2  o 1  5.63166e+00 1.46975e+00 7.15359e+01 322.834 3.58601e+00  -2.71862e+00 0.00000e+00 0.00000e+00 1.17458e+02 322.834 4.59223e+01 322.834 0.8803 
1 1 1 15  54  3  o 17 7.56505e+00 1.61053e+00 8.64374e+01 329.063 5.97593e+00  -3.58178e+00 0.00000e+00 0.00000e+00 1.80489e+02 329.063 9.40520e+01 329.063 0.9252 
1 1 1 15  54  4  o 3  1.12720e+01 1.52935e+00 1.76576e+02 181.682 -2.28926e+01 -6.72154e-01 0.00000e+00 0.00000e+00 2.43991e+02 181.682 6.74153e+01 181.682 0.9779 
1 1 1 15  54  5  o 17 5.01022e+00 1.46302e+00 9.11078e+01 260.534 -9.06414e-01 -5.43665e+00 0.00000e+00 0.00000e+00 8.17614e+01 260.534 9.34646e+00 80.535  0.9040 
1 1 1 15  54  6  o 9  4.09516e+00 1.35003e+00 3.25678e+01 355.976 1.87269e+00  -1.31738e-01 0.00000e+00 0.00000e+00 7.32042e+01 355.976 4.06364e+01 355.976 0.6766 
1 1 1 15  54  7  o 6  3.90223e+00 1.35696e+00 5.50697e+01 281.227 6.18206e-01  -3.11435e+00 0.00000e+00 0.00000e+00 6.74315e+01 281.227 1.23617e+01 281.227 0.8221 
1 1 1 15  55  0  o 5  1.37623e+01 1.19271e+00 2.40992e+02 329.484 3.89174e+01  -2.29383e+01 0.00000e+00 0.00000e+00 2.77162e+02 329.484 3.61693e+01 329.484 0.9889 
1 1 1 15  55  1  o 15 1.04779e+01 1.28199e+00 1.98548e+02 191.010 -2.67392e+01 -5.20253e+00 0.00000e+00 0.00000e+00 1.93221e+02 191.010 5.32668e+00 11.010  0.9815 
1 1 1 15  55  2  o 5  4.31189e+00 1.33178e+00 8.33092e+01 206.420 -4.15744e+00 -2.06559e+00 0.00000e+00 0.00000e+00 6.20363e+01 206.420 2.12729e+01 26.420  0.8844 
1 1 1 15  55  3  o 13 9.25654e+00 1.56855e+00 1.33764e+02 154.433 -1.23921e+01 5.92839e+00  0.00000e+00 0.00000e+00 2.06112e+02 154.433 7.23475e+01 154.433 0.9629 
1 1 1 15  55  4  o 12 8.99879e+00 1.63019e+00 1.27391e+02 56.270  6.78108e+00  1.01564e+01  0.00000e+00 0.00000e+00 2.01521e+02 56.270  7.41298e+01 56.270  0.9581 
1 1 1 15  55  5  o 19 4.88288e+00 1.47722e+00 6.84452e+01 309.560 2.60417e+00  -3.15237e+00 0.00000e+00 0.00000e+00 9.30771e+01 309.560 2.46320e+01 309.560 0.8669 
1 1 1 15  55  6  o 12 4.35803e+00 1.41794e+00 5.09966e+01 223.918 -2.13237e+00 -2.05332e+00 0.00000e+00 0.00000e+00 8.32466e+01 223.918 3.22500e+01 223.918 0.8070 
1 1 1 15  55  7  o 10 4.36792e+00 1.48739e+00 8.58636e+01 23.980  4.55356e+00  2.02550e+00  0.00000e+00 0.00000e+00 6.30537e+01 23.980  2.28099e+01 203.980 0.8930 
1 1 1 15  56  0  o 19 5.76335e+00 1.48090e+00 1.55685e+02 96.411  -1.11199e+00 9.89651e+00  0.00000e+00 0.00000e+00 5.23895e+01 96.411  1.03296e+02 276.411 0.9484 
1 1 1 15  56  1  o 15 3.98506e+00 1.19459e+00 7.68803e+01 341.720 4.11390e+00  -1.35898e+00 0.00000e+00 0.00000e+00 5.59665e+01 341.720 2.09138e+01 161.720 0.8752 
1 1 1 15  56  2  o 18 9.57837e+00 1.40580e+00 1.39059e+02 72.226  4.95369e+00  1.54533e+01  0.00000e+00 0.00000e+00 2.14537e+02 72.226  7.54774e+01 72.226  0.9687 
1 1 1 15  56  3  f 0  1.50512e+01 1.21020e+00 2.28314e+02 188.162 -4.50640e+01 -6.46309e+00 0.00000e+00 0.00000e+00 3.39203e+02 188.162 1.10889e+02 188.162 0.9890 
1 1 1 15  56  4  o 8  4.14907e+00 1.33017e+00 8.57059e+01 355.835 4.49528e+00  -3.27308e-01 0.00000e+00 0.00000e+00 5.36422e+01 355.835 3.20637e+01 175.836 0.8805 
1 1 1 15  56  5  o 2  9.56901e+00 1.72098e+00 1.89225e+02 27.817  1.67021e+01  8.81243e+00  0.00000e+00 0.00000e+00 1.66072e+02 27.817  2.31521e+01 207.817 0.9732 
1 1 1 15  56  6  f 0  3.78523e+00 1.24960e+00 6.19702e+01 10.282  3.66593e+00  6.65000e-01  0.00000e+00 0.00000e+00 6.11230e+01 10.282  8.47254e-01 190.282 0.8521 
1 1 1 15  56  7  o 16 6.66481e+00 1.93655e+00 1.53561e+02 114.620 -4.08437e+00 8.91277e+00  0.00000e+00 0.00000e+00 8.75049e+01 114.620 6.60559e+01 294.620 0.9475 
1 1 1 15  57  0  o 6  4.35841e+00 1.30469e+00 6.02993e+01 321.772 2.71701e+00  -2.14025e+00 0.00000e+00 0.00000e+00 7.88700e+01 321.772 1.85707e+01 321.772 0.8389 
1 1 1 15  57  1  o 17 1.52019e+01 1.08108e+00 3.13543e+02 202.517 -6.94860e+01 -2.88056e+01 0.00000e+00 0.00000e+00 2.61546e+02 202.517 5.19965e+01 22.517  0.9933 
1 1 1 15  57  2  f 0  8.47417e+00 1.46000e+00 1.55562e+02 159.141 -1.46881e+01 5.59683e+00  0.00000e+00 0.00000e+00 1.56889e+02 159.141 1.32719e+00 159.141 0.9676 
1 1 1 15  57  3  o 6  1.25130e+01 1.37733e+00 1.79642e+02 31.374  2.42039e+01  1.47589e+01  0.00000e+00 0.00000e+00 2.88875e+02 31.374  1.09233e+02 31.374  0.9822 
1 1 1 15  57  4  f 0  1.03320e+01 1.49334e+00 1.65111e+02 30.715  1.73562e+01  1.03114e+01  0.00000e+00 0.00000e+00 2.19022e+02 30.715  5.39101e+01 30.715  0.9749 
1 1 1 15  57  5  o 10 4.95596e+00 1.46999e+00 9.79083e+01 95.533  -5.86182e-01 6.05080e+00  0.00000e+00 0.00000e+00 7.48132e+01 95.533  2.30951e+01 275.533 0.9136 
1 1 1 15  57  6  o 9  7.10909e+00 1.75642e+00 1.71332e+02 148.531 -1.09867e+01 6.72459e+00  0.00000e+00 0.00000e+00 8.91888e+01 148.531 8.21435e+01 328.531 0.9604 
1 1 1 15  57  7  o 8  5.22826e+00 1.64516e+00 1.20263e+02 15.639  7.12800e+00  1.99537e+00  0.00000e+00 0.00000e+00 6.52664e+01 15.639  5.49970e+01 195.639 0.9298 
1 1 1 15  58  0  o 10 1.29734e+01 1.14961e+00 2.13111e+02 349.101 4.09445e+01  -7.88381e+00 0.00000e+00 0.00000e+00 2.74651e+02 349.101 6.15400e+01 349.101 0.9879 
1 1 1 15  58  1  o 3  5.04857e+00 1.39502e+00 4.67317e+01 348.735 2.83578e+00  -5.64840e-01 0.00000e+00 0.00000e+00 1.07374e+02 348.735 6.06424e+01 348.735 0.8016 
1 1 1 15  58  2  o 13 3.90048e+00 1.24890e+00 6.73616e+01 129.708 -2.17104e+00 2.61429e+00  0.00000e+00 0.00000e+00 5.68089e+01 129.708 1.05527e+01 309.708 0.8356 
1 1 1 15  58  3  o 16 5.68720e+00 1.52910e+00 7.54662e+01 77.506  1.09514e+00  4.94243e+00  0.00000e+00 0.00000e+00 1.18499e+02 77.506  4.30326e+01 77.506  0.8948 
1 1 1 15  58  4  o 11 3.03473e+00 1.05601e+00 6.96411e+01 324.838 2.77332e+00  -1.95358e+00 0.00000e+00 0.00000e+00 2.70117e+01 324.838 4.26295e+01 144.838 0.8353 
1 1 1 15  58  5  o 2  7.51438e+00 1.70976e+00 1.61906e+02 9.860   1.29743e+01  2.25511e+00  0.00000e+00 0.00000e+00 1.13604e+02 9.860   4.83018e+01 189.860 0.9612 
1 1 1 15  58  6  o 14 4.69733e+00 1.47676e+00 7.12288e+01 65.759  1.76650e+00  3.92306e+00  0.00000e+00 0.00000e+00 8.54452e+01 65.759  1.42163e+01 65.759  0.8742 
1 1 1 15  58  7  o 12 4.14999e+00 1.38111e+00 8.58053e+01 27.057  4.72435e+00  2.41315e+00  0.00000e+00 0.00000e+00 5.67247e+01 27.057  2.90806e+01 207.057 0.9000 
1 1 1 15  59  0  o 1  3.78304e+00 1.16296e+00 5.21047e+01 107.539 -8.60706e-01 2.72340e+00  0.00000e+00 0.00000e+00 6.28735e+01 107.539 1.07688e+01 107.539 0.7988 
1 1 1 15  59  1  o 18 5.98526e+00 1.48817e+00 1.80313e+02 135.244 -8.54205e+00 8.46955e+00  0.00000e+00 0.00000e+00 3.78703e+01 135.244 1.42443e+02 315.244 0.9575 
1 1 1 15  59  2  o 15 3.78814e+00 1.22701e+00 3.19205e+01 207.744 -1.48944e+00 -7.83439e-01 0.00000e+00 0.00000e+00 6.01706e+01 207.744 2.82501e+01 207.744 0.6382 
1 1 1 15  59  3  o 9  3.98895e+00 1.27835e+00 5.51800e+01 180.244 -2.88012e+00 -1.22651e-02 0.00000e+00 0.00000e+00 6.65405e+01 180.244 1.13605e+01 180.244 0.8007 
1 1 1 15  59  4  o 18 6.31325e+00 1.62502e+00 1.17214e+02 15.765  7.93587e+00  2.24041e+00  0.00000e+00 0.00000e+00 1.08366e+02 15.765  8.84746e+00 195.765 0.9372 
1 1 1 15  59  5  o 1  6.40190e+00 1.66574e+00 1.16298e+02 322.322 6.65735e+00  -5.14132e+00 0.00000e+00 0.00000e+00 1.12838e+02 322.322 3.46057e+00 142.322 0.9385 
1 1 1 15  59  6  o 15 1.52144e+01 1.46312e+00 2.12416e+02 64.685  1.87103e+01  3.95554e+01  0.00000e+00 0.00000e+00 3.61290e+02 64.685  1.48874e+02 64.685  0.9885 
1 1 1 15  59  7  o 18 3.83396e+00 1.29864e+00 5.86393e+01 242.645 -1.64114e+00 -3.17223e+00 0.00000e+00 0.00000e+00 6.49339e+01 242.645 6.29453e+00 242.645 0.8448 
1 1 1 15  60  0  o 7  4.96626e+00 1.38719e+00 8.20181e+01 12.707  4.71706e+00  1.06366e+00  0.00000e+00 0.00000e+00 8.60264e+01 12.707  4.00826e+00 12.707  0.8894 
1 1 1 15  60  1  o 12 8.01361e+00 1.42612e+00 1.15237e+02 311.541 7.55034e+00  -8.52190e+00 0.00000e+00 0.00000e+00 1.76088e+02 311.541 6.08511e+01 311.541 0.9550 
1 1 1 15  60  2  o 18 4.13717e+00 1.29152e+00 5.16009e+01 49.057  1.94217e+00  2.23872e+00  0.00000e+00 0.00000e+00 7.55973e+01 49.057  2.39964e+01 49.057  0.8073 
1 1 1 15  60  3  o 1  9.48503e+00 1.52322e+00 1.18748e+02 205.032 -1.19784e+01 -5.59386e+00 0.00000e+00 0.00000e+00 2.28707e+02 205.032 1.09959e+02 205.032 0.9614 
1 1 1 15  60  4  o 19 7.55846e+00 1.68672e+00 1.50632e+02 13.831  1.19060e+01  2.93131e+00  0.00000e+00 0.00000e+00 1.25466e+02 13.831  2.51662e+01 193.831 0.9583 
1 1 1 15  60  5  o 4  5.55185e+00 1.52061e+00 7.31055e+01 239.999 -2.62420e+00 -4.54514e+00 0.00000e+00 0.00000e+00 1.17172e+02 239.999 4.40664e+01 239.999 0.8988 
1 1 1 15  60  6  o 7  6.80790e+00 1.56415e+00 1.04431e+02 32.858  7.51410e+00  4.85325e+00  0.00000e+00 0.00000e+00 1.40249e+02 32.858  3.58188e+01 32.858  0.9423 
1 1 1 15  60  7  o 11 4.17565e+00 1.37907e+00 9.02724e+01 67.527  2.28128e+00  5.51491e+00  0.00000e+00 0.00000e+00 5.49810e+01 67.527  3.52914e+01 247.527 0.9119 
1 1 1 15  61  0  o 16 4.39785e+00 1.24785e+00 7.00440e+01 358.174 4.27160e+00  -1.36189e-01 0.00000e+00 0.00000e+00 7.60420e+01 358.174 5.99796e+00 358.174 0.8733 
1 1 1 15  61  1  o 6  9.41665e+00 1.37412e+00 1.83765e+02 133.412 -1.56111e+01 1.65012e+01  0.00000e+00 0.00000e+00 1.66648e+02 133.412 1.71169e+01 313.412 0.9777 
1 1 1 15  61  2  o 5  1.02536e+01 1.43471e+00 1.67768e+02 248.885 -7.63413e+00 -1.97689e+01 0.00000e+00 0.00000e+00 2.13352e+02 248.885 4.55845e+01 248.885 0.9761 
1 1 1 15  61  3  o 16 4.99338e+00 1.42863e+00 5.21753e+01 159.119 -3.07622e+00 1.17355e+00  0.00000e+00 0.00000e+00 1.05616e+02 159.119 5.34409e+01 159.119 0.8295 
1 1 1 15  61  4  o 14 5.87633e+00 1.50408e+00 4.18206e+01 302.240 1.64325e+00  -2.60537e+00 0.00000e+00 0.00000e+00 1.40870e+02 302.240 9.90491e+01 302.240 0.8158 
1 1 1 15  61  5  o 8  4.18882e+00 1.35787e+00 8.08997e+01 285.629 1.28106e+00  -4.57940e+00 0.00000e+00 0.00000e+00 6.08089e+01 285.629 2.00908e+01 105.629 0.8874 
1 1 1 15  61  6  o 5  4.94997e+00 1.53468e+00 9.89641e+01 342.674 5.97839e+00  -1.86502e+00 0.00000e+00 0.00000e+00 7.39898e+01 342.674 2.49743e+01 162.674 0.9163 
1 1 1 15  61  7  o 18 4.45589e+00 1.44381e+00 7.78983e+01 100.194 -9.42960e-01 5.24369e+00  0.00000e+00 0.00000e+00 7.51414e+01 100.194 2.75695e+00 280.194 0.9005 
1 1 1 15  62  0  o 8  7.20035e+00 1.39240e+00 1.88922e+02 238.831 -9.12274e+00 -1.50821e+01 0.00000e+00 0.00000e+00 7.70310e+01 238.831 1.11891e+02 58.831  0.9712 
1 1 1 15  62  1  o 3  7.26145e+00 1.47916e+00 1.16920e+02 312.899 6.64728e+00  -7.15350e+00 0.00000e+00 0.00000e+00 1.44845e+02 312.899 2.79253e+01 312.899 0.9473 
1 1 1 15  62  2  o 2  1.16781e+01 1.33348e+00 1.70996e+02 246.169 -1.07713e+01 -2.43865e+01 0.00000e+00 0.00000e+00 2.65200e+02 246.169 9.42045e+01 246.169 0.9811 
1 1 1 15  62  3  o 4  7.14796e+00 1.63070e+00 1.16892e+02 112.254 -3.54550e+00 8.66449e+00  0.00000e+00 0.00000e+00 1.40392e+02 112.254 2.35003e+01 112.254 0.9450 
1 1 1 15  62  4  o 8  4.59524e+00 1.41739e+00 9.23376e+01 346.476 5.58068e+00  -1.34231e+00 0.00000e+00 0.00000e+00 6.66740e+01 346.476 2.56635e+01 166.476 0.9081 
1 1 1 15  62  5  o 3  3.81013e+00 1.27477e+00 1.33328e+02 358.926 7.98730e+00  -1.49700e-01 0.00000e+00 0.00000e+00 2.48447e+00 358.926 1.30843e+02 178.926 0.9351 
1 1 1 15  62  6  o 7  5.32075e+00 1.61074e+00 1.52373e+02 193.968 -9.80791e+00 -2.43955e+00 0.00000e+00 0.00000e+00 4.01797e+01 193.968 1.12194e+02 13.968  0.9492 
1 1 1 15  62  7  o 7  4.86525e+00 1.50693e+00 9.09796e+01 89.904  1.03104e-02  6.12822e+00  0.00000e+00 0.00000e+00 7.86595e+01 89.904  1.23201e+01 269.904 0.9143 
1 1 1 15  63  0  o 4  5.17280e+00 1.37802e+00 8.68716e+01 350.599 5.43998e+00  -9.00711e-01 0.00000e+00 0.00000e+00 9.09560e+01 350.599 4.08440e+00 350.599 0.9041 
1 1 1 15  63  1  o 8  7.09272e+00 1.51633e+00 1.98895e+02 56.179  9.26262e+00  1.38255e+01  0.00000e+00 0.00000e+00 6.27210e+01 56.179  1.36174e+02 236.179 0.9695 
1 1 1 15  63  2  o 15 1.00503e+01 1.40716e+00 1.35035e+02 243.769 -7.68969e+00 -1.56060e+01 0.00000e+00 0.00000e+00 2.36378e+02 243.769 1.01343e+02 243.769 0.9708 
1 1 1 15  63  3  o 10 5.42421e+00 1.51550e+00 1.00119e+02 275.474 6.46984e-01  -6.75118e+00 0.00000e+00 0.00000e+00 9.05501e+01 275.474 9.56869e+00 95.474  0.9230 
1 1 1 15  63  4  f 0  4.65747e+00 1.34416e+00 2.85785e+01 145.053 -1.55611e+00 1.08744e+00  0.00000e+00 0.00000e+00 9.21466e+01 145.053 6.35681e+01 145.053 0.6804 
1 1 1 15  63  5  o 3  5.46949e+00 1.57336e+00 4.92746e+01 123.378 -1.85429e+00 2.81453e+00  0.00000e+00 0.00000e+00 1.24578e+02 123.378 7.53034e+01 123.378 0.8340 
1 1 1 15  63  6  o 13 6.07199e+00 1.66901e+00 1.38405e+02 234.368 -6.04087e+00 -8.42771e+00 0.00000e+00 0.00000e+00 8.16034e+01 234.368 5.68019e+01 54.368  0.9505 
1 1 1 15  63  7  o 15 4.03834e+00 1.34808e+00 6.14173e+01 143.179 -3.28526e+00 2.45961e+00  0.00000e+00 0.00000e+00 7.21434e+01 143.179 1.07260e+01 143.179 0.8674 
1 1 1 15  64  0  o 9  4.65782e+00 1.32902e+00 1.10351e+02 281.613 1.38549e+00  -6.74175e+00 0.00000e+00 0.00000e+00 5.33076e+01 281.613 5.70430e+01 101.613 0.9242 
1 1 1 15  64  1  o 19 3.63340e+00 1.20888e+00 3.58287e+01 343.693 1.83494e+00  -5.36810e-01 0.00000e+00 0.00000e+00 5.85377e+01 343.693 2.27090e+01 343.693 0.6828 
1 1 1 15  64  2  o 7  3.68059e+00 1.19221e+00 4.06737e+01 128.088 -1.40521e+00 1.79287e+00  0.00000e+00 0.00000e+00 6.27797e+01 128.088 2.21059e+01 128.088 0.7385 
1 1 1 15  64  3  o 3  7.05773e+00 1.58035e+00 1.11812e+02 113.794 -3.82758e+00 8.68064e+00  0.00000e+00 0.00000e+00 1.42339e+02 113.794 3.05271e+01 113.794 0.9457 
1 1 1 15  64  4  o 14 4.46214e+00 1.32518e+00 7.63654e+01 213.151 -4.09758e+00 -2.67633e+00 0.00000e+00 0.00000e+00 7.50556e+01 213.151 1.30986e+00 33.151  0.8909 
1 1 1 15  64  5  o 14 6.51821e+00 1.67247e+00 8.48663e+01 290.722 2.24589e+00  -5.93657e+00 0.00000e+00 0.00000e+00 1.42998e+02 290.722 5.81316e+01 290.722 0.9174 
1 1 1 15  64  6  o 19 3.95112e+00 1.31509e+00 6.80638e+01 73.787  1.25393e+00  4.31231e+00  0.00000e+00 0.00000e+00 6.44688e+01 73.787  3.59498e+00 253.787 0.8801 
1 1 1 15  64  7  o 14 3.39029e+00 1.17728e+00 4.91961e+01 119.619 -1.59844e+00 2.81162e+00  0.00000e+00 0.00000e+00 5.75496e+01 119.619 8.35351e+00 119.619 0.8259 
1 1 1 15  65  0  o 19 5.07873e+00 1.38935e+00 9.42772e+01 327.778 5.25646e+00  -3.31301e+00 0.00000e+00 0.00000e+00 8.24700e+01 327.778 1.18072e+01 147.778 0.9156 
1 1 1 15  65  1  o 19 5.14025e+00 1.45135e+00 1.21176e+02 297.035 3.59675e+00  -7.04851e+00 0.00000e+00 0.00000e+00 6.15180e+01 297.035 5.96580e+01 117.035 0.9345 
1 1 1 15  65  2  o 10 4.65795e+00 1.38306e+00 1.10998e+02 207.831 -6.25358e+00 -3.30142e+00 0.00000e+00 0.00000e+00 5.31907e+01 207.831 5.78073e+01 27.831  0.9263 
1 1 1 15  65  3  o 16 1.01553e+01 1.44121e+00 1.64113e+02 150.219 -1.98634e+01 1.13673e+01  0.00000e+00 0.00000e+00 2.13957e+02 150.219 4.98443e+01 150.219 0.9779 
1 1 1 15  65  4  o 19 4.66291e+00 1.39430e+00 9.24273e+01 138.664 -4.61790e+00 4.06200e+00  0.00000e+00 0.00000e+00 6.99986e+01 138.664 2.24287e+01 318.664 0.9146 
1 1 1 15  65  5  o 4  7.85540e+00 1.71337e+00 1.33807e+02 327.367 1.02137e+01  -6.54030e+00 0.00000e+00 0.00000e+00 1.52846e+02 327.367 1.90390e+01 327.367 0.9578 
1 1 1 15  65  6  o 1  7.34746e+00 1.73727e+00 1.41565e+02 251.760 -3.93449e+00 -1.19388e+01 0.00000e+00 0.00000e+00 1.27050e+02 251.760 1.45157e+01 71.760  0.9594 
1 1 1 15  65  7  o 14 1.05721e+01 1.84073e+00 1.89443e+02 93.030  -1.15970e+00 2.19085e+01  0.00000e+00 0.00000e+00 2.04226e+02 93.030  1.47821e+01 93.030  0.9769 
1 1 1 15  66  0  o 16 8.72455e+00 1.40336e+00 1.62233e+02 231.803 -1.14935e+01 -1.46071e+01 0.00000e+00 0.00000e+00 1.60293e+02 231.803 1.93918e+00 51.803  0.9727 
1 1 1 15  66  1  o 13 1.11307e+01 1.45997e+00 2.54025e+02 102.362 -7.86920e+00 3.59054e+01  0.00000e+00 0.00000e+00 1.63438e+02 102.362 9.05866e+01 282.362 0.9863 
1 1 1 15  66  2  o 8  5.15192e+00 1.43613e+00 4.64177e+01 210.201 -2.75807e+00 -1.60531e+00 0.00000e+00 0.00000e+00 1.14934e+02 210.201 6.85167e+01 210.201 0.8232 
1 1 1 15  66  3  o 14 4.03398e+00 1.27226e+00 3.18823e+01 306.842 1.15146e+00  -1.53683e+00 0.00000e+00 0.00000e+00 7.31811e+01 306.842 4.12988e+01 306.842 0.6842 
1 1 1 15  66  4  o 9  4.80972e+00 1.39960e+00 7.83429e+01 217.430 -4.26493e+00 -3.26431e+00 0.00000e+00 0.00000e+00 8.67297e+01 217.430 8.38681e+00 217.430 0.9013 
1 1 1 15  66  5  o 3  5.97708e+00 1.59063e+00 1.22649e+02 305.435 5.38066e+00  -7.56165e+00 0.00000e+00 0.00000e+00 9.23809e+01 305.435 3.02683e+01 125.435 0.9445 
1 1 1 15  66  6  o 6  5.73236e+00 1.60106e+00 9.52340e+01 193.957 -6.80746e+00 -1.69182e+00 0.00000e+00 0.00000e+00 1.06944e+02 193.957 1.17103e+01 193.957 0.9257 
1 1 1 15  67  0  o 12 4.29233e+00 1.26835e+00 6.02601e+01 215.883 -3.11201e+00 -2.25129e+00 0.00000e+00 0.00000e+00 7.95340e+01 215.883 1.92739e+01 215.883 0.8571 
1 1 1 15  67  1  o 5  4.75139e+00 1.25892e+00 6.01266e+01 140.015 -3.32556e+00 2.78895e+00  0.00000e+00 0.00000e+00 9.80174e+01 140.015 3.78907e+01 140.015 0.8754 
1 1 1 15  67  2  o 16 4.06254e+00 1.20355e+00 5.43577e+01 335.668 3.17822e+00  -1.43714e+00 0.00000e+00 0.00000e+00 7.55253e+01 335.668 2.11676e+01 335.668 0.8405 
1 1 1 15  67  3  o 17 4.56858e+00 1.34958e+00 4.75010e+01 81.368  4.83738e-01  3.18646e+00  0.00000e+00 0.00000e+00 9.59718e+01 81.368  4.84709e+01 81.368  0.8252 
1 1 1 15  67  4  o 15 4.34108e+00 1.35218e+00 8.08915e+01 117.873 -2.40801e+00 4.55316e+00  0.00000e+00 0.00000e+00 6.73163e+01 117.873 1.35752e+01 297.873 0.8968 
1 1 1 15  67  5  o 15 7.50018e+00 1.57358e+00 1.11370e+02 286.432 3.18970e+00  -1.08157e+01 0.00000e+00 0.00000e+00 1.61288e+02 286.432 4.99181e+01 286.432 0.9546 
1 1 1 15  67  6  o 13 3.97819e+00 1.28191e+00 7.01017e+01 96.765  -5.71108e-01 4.81434e+00  0.00000e+00 0.00000e+00 6.47331e+01 96.765  5.36861e+00 276.765 0.8897 
1 1 1 15  68  0  o 1  4.80498e+00 1.34827e+00 9.32409e+01 103.063 -1.44057e+00 6.20845e+00  0.00000e+00 0.00000e+00 7.42972e+01 103.063 1.89436e+01 283.063 0.9178 
1 1 1 15  68  1  o 7  5.96332e+00 1.48558e+00 1.24830e+02 349.412 9.71782e+00  -1.81645e+00 0.00000e+00 0.00000e+00 9.00608e+01 349.412 3.47688e+01 169.412 0.9480 
1 1 1 15  68  2  o 18 5.38614e+00 1.46931e+00 8.51887e+01 253.610 -1.67480e+00 -5.69406e+00 0.00000e+00 0.00000e+00 1.01495e+02 253.610 1.63067e+01 253.610 0.9113 
1 1 1 15  68  3  o 15 4.46765e+00 1.32159e+00 7.72345e+01 15.022  5.04248e+00  1.35320e+00  0.00000e+00 0.00000e+00 7.54618e+01 15.022  1.77269e+00 195.022 0.8983 
1 1 1 15  68  4  o 10 4.09152e+00 1.29528e+00 7.93862e+01 190.585 -5.08787e+00 -9.50819e-01 0.00000e+00 0.00000e+00 6.03604e+01 190.585 1.90258e+01 10.585  0.8973 
1 1 1 15  68  5  o 10 7.16683e+00 1.67485e+00 1.44270e+02 27.814  1.15978e+01  6.11838e+00  0.00000e+00 0.00000e+00 1.17997e+02 27.814  2.62738e+01 207.814 0.9611 
1 1 1 15  68  6  o 12 4.09877e+00 1.34103e+00 1.12622e+02 185.228 -7.72952e+00 -7.07307e-01 0.00000e+00 0.00000e+00 3.30531e+01 185.228 7.95685e+01 5.228   0.9332 
1 1 1 15  69  0  o 8  6.75531e+00 1.30116e+00 8.92958e+01 22.381  8.20479e+00  3.37866e+00  0.00000e+00 0.00000e+00 1.52372e+02 22.381  6.30757e+01 22.381  0.9418 
1 1 1 15  69  1  o 7  5.61317e+00 1.39781e+00 7.10620e+01 294.346 2.24103e+00  -4.95263e+00 0.00000e+00 0.00000e+00 1.21490e+02 294.346 5.04277e+01 294.346 0.9026 
1 1 1 15  69  2  o 1  7.67075e+00 1.57249e+00 1.70353e+02 126.157 -9.61978e+00 1.31643e+01  0.00000e+00 0.00000e+00 1.12235e+02 126.157 5.81180e+01 306.157 0.9688 
1 1 1 15  69  3  o 12 4.82409e+00 1.42345e+00 1.18988e+02 317.231 5.81305e+00  -5.37705e+00 0.00000e+00 0.00000e+00 5.25173e+01 317.231 6.64705e+01 137.231 0.9345 
1 1 1 15  69  4  o 19 3.94761e+00 1.27117e+00 3.90266e+01 71.816  8.18073e-01  2.49049e+00  0.00000e+00 0.00000e+00 7.77924e+01 71.816  3.87658e+01 71.816  0.7776 
1 1 1 15  69  5  o 10 3.97254e+00 1.25813e+00 8.51854e+01 285.992 1.57660e+00  -5.50100e+00 0.00000e+00 0.00000e+00 5.21060e+01 285.992 3.30794e+01 105.992 0.9078 
1 1 1 15  69  6  o 14 3.85823e+00 1.27002e+00 5.26417e+01 222.414 -2.65375e+00 -2.42443e+00 0.00000e+00 0.00000e+00 7.16362e+01 222.414 1.89946e+01 222.414 0.8459 
1 1 1 15  70  0  o 15 3.30696e+00 1.08286e+00 3.03997e+01 147.493 -1.44688e+00 9.22016e-01  0.00000e+00 0.00000e+00 5.06169e+01 147.493 2.02172e+01 147.493 0.6451 
1 1 1 15  70  1  o 4  8.94026e+00 1.44660e+00 1.43627e+02 161.626 -1.67181e+01 5.55299e+00  0.00000e+00 0.00000e+00 1.86298e+02 161.626 4.26704e+01 161.626 0.9712 
1 1 1 15  70  2  o 11 5.14146e+00 1.39101e+00 1.18470e+02 261.711 -1.25917e+00 -8.64341e+00 0.00000e+00 0.00000e+00 6.54402e+01 261.711 5.30302e+01 81.711  0.9409 
1 1 1 15  70  3  o 10 3.88707e+00 1.26095e+00 5.11362e+01 20.171  3.05512e+00  1.12229e+00  0.00000e+00 0.00000e+00 7.11579e+01 20.171  2.00217e+01 20.171  0.8272 
1 1 1 15  70  4  o 2  3.50123e+00 1.16712e+00 8.16642e+01 168.696 -5.46395e+00 1.09218e+00  0.00000e+00 0.00000e+00 3.89203e+01 168.696 4.27438e+01 348.696 0.9052 
1 1 1 15  70  5  o 6  4.21771e+00 1.32504e+00 7.63502e+01 19.264  5.09582e+00  1.78096e+00  0.00000e+00 0.00000e+00 6.84302e+01 19.264  7.91998e+00 199.264 0.9019 
1 1 1 15  70  6  o 4  3.63982e+00 1.23087e+00 4.71216e+01 121.663 -1.83067e+00 2.96834e+00  0.00000e+00 0.00000e+00 6.93443e+01 121.663 2.22226e+01 121.663 0.8404 
1 1 1 15  71  0  o 7  6.06185e+00 1.40461e+00 8.32987e+01 164.430 -6.88398e+00 1.91814e+00  0.00000e+00 0.00000e+00 1.30091e+02 164.430 4.67926e+01 164.430 0.9271 
1 1 1 15  71  1  o 12 4.33872e+00 1.28998e+00 6.51571e+01 9.907   4.31341e+00  7.53358e-01  0.00000e+00 0.00000e+00 7.93425e+01 9.907   1.41854e+01 9.907   0.8767 
1 1 1 15  71  2  o 10 4.96311e+00 1.41645e+00 9.47127e+01 143.212 -5.25709e+00 3.93108e+00  0.00000e+00 0.00000e+00 7.89045e+01 143.212 1.58082e+01 323.212 0.9203 
1 1 1 15  71  3  o 13 4.84389e+00 1.43178e+00 9.54691e+01 169.040 -6.77465e+00 1.31197e+00  0.00000e+00 0.00000e+00 7.48063e+01 169.040 2.06628e+01 349.040 0.9244 
1 1 1 15  71  4  o 9  4.39815e+00 1.33519e+00 5.32677e+01 24.391  3.60210e+00  1.63333e+00  0.00000e+00 0.00000e+00 9.09204e+01 24.391  3.76527e+01 24.391  0.8618 
1 1 1 15  71  5  o 2  4.82766e+00 1.37180e+00 5.98518e+01 223.882 -3.41106e+00 -3.28050e+00 0.00000e+00 0.00000e+00 1.03065e+02 223.882 4.32128e+01 223.882 0.8868 
1 1 1 15  71  6  o 10 3.38235e+00 1.13963e+00 5.72436e+01 22.885  3.86838e+00  1.63286e+00  0.00000e+00 0.00000e+00 5.48655e+01 22.885  2.37809e+00 202.885 0.8708 
1 1 1 15  72  0  o 1  4.02449e+00 1.21397e+00 4.87741e+01 120.608 -1.61416e+00 2.72851e+00  0.00000e+00 0.00000e+00 7.67802e+01 120.608 2.80062e+01 120.608 0.8218 
1 1 1 15  72  1  o 19 6.58871e+00 1.40042e+00 1.14507e+02 308.671 6.66568e+00  -8.32863e+00 0.00000e+00 0.00000e+00 1.23718e+02 308.671 9.21084e+00 308.671 0.9519 
1 1 1 15  72  2  o 6  4.34046e+00 1.32306e+00 1.01575e+02 141.497 -5.38279e+00 4.28218e+00  0.00000e+00 0.00000e+00 5.08625e+01 141.497 5.07124e+01 321.497 0.9241 
1 1 1 15  72  3  f 0  5.12679e+00 1.40405e+00 1.16605e+02 43.146  6.76254e+00  6.33842e+00  0.00000e+00 0.00000e+00 6.74794e+01 43.146  4.91252e+01 223.146 0.9444 
1 1 1 15  72  4  o 9  3.74356e+00 1.20853e+00 6.97927e+01 84.903  4.33029e-01  4.85495e+00  0.00000e+00 0.00000e+00 5.69846e+01 84.903  1.28081e+01 264.903 0.8904 
1 1 1 15  72  5  o 7  1.08078e+01 1.63322e+00 1.83305e+02 30.547  2.22833e+01  1.31503e+01  0.00000e+00 0.00000e+00 2.19876e+02 30.547  3.65706e+01 30.547  0.9805 
1 1 1 15  72  6  o 7  4.96286e+00 1.49884e+00 5.81276e+01 263.253 -5.21313e-01 -4.40629e+00 0.00000e+00 0.00000e+00 1.07789e+02 263.253 4.96615e+01 263.253 0.8785 
1 1 1 15  73  0  o 1  6.28517e+00 1.39348e+00 1.12984e+02 14.610  9.75825e+00  2.54359e+00  0.00000e+00 0.00000e+00 1.13407e+02 14.610  4.23843e-01 14.610  0.9490 
1 1 1 15  73  1  o 14 4.09454e+00 1.24150e+00 5.23741e+01 302.578 1.92109e+00  -3.00647e+00 0.00000e+00 0.00000e+00 7.89505e+01 302.578 2.65763e+01 302.578 0.8446 
1 1 1 15  73  2  o 1  4.10591e+00 1.27989e+00 5.08679e+01 195.022 -3.47282e+00 -9.31953e-01 0.00000e+00 0.00000e+00 8.11043e+01 195.022 3.02364e+01 195.022 0.8460 
1 1 1 15  73  3  o 7  6.14901e+00 1.37438e+00 1.05734e+02 188.139 -1.05087e+01 -1.50288e+00 0.00000e+00 0.00000e+00 1.16707e+02 188.139 1.09726e+01 188.139 0.9517 
1 1 1 15  73  4  o 16 6.38253e+00 1.60374e+00 1.14910e+02 351.446 9.78695e+00  -1.47209e+00 0.00000e+00 0.00000e+00 1.15191e+02 351.446 2.80423e-01 351.446 0.9480 
1 1 1 15  73  5  o 12 4.50216e+00 1.39004e+00 6.31846e+01 208.209 -4.38906e+00 -2.35424e+00 0.00000e+00 0.00000e+00 8.97397e+01 208.209 2.65551e+01 208.209 0.8929 
1 1 1 15  74  0  o 8  5.16991e+00 1.38299e+00 6.49043e+01 110.455 -1.74480e+00 4.67795e+00  0.00000e+00 0.00000e+00 1.10325e+02 110.455 4.54211e+01 110.455 0.8932 
1 1 1 15  74  1  o 12 6.13683e+00 1.50067e+00 9.52983e+01 240.990 -4.00155e+00 -7.21601e+00 0.00000e+00 0.00000e+00 1.23092e+02 240.990 2.77942e+01 240.990 0.9373 
1 1 1 15  74  2  f 0  3.43079e+00 1.13454e+00 7.97581e+01 144.383 -4.45388e+00 3.19062e+00  0.00000e+00 0.00000e+00 3.79815e+01 144.383 4.17765e+01 324.383 0.9034 
1 1 1 15  74  3  o 9  8.79965e+00 1.50294e+00 1.06753e+02 343.304 1.30832e+01  -3.92412e+00 0.00000e+00 0.00000e+00 2.15190e+02 343.304 1.08437e+02 343.304 0.9627 
1 1 1 15  74  4  o 17 3.13544e+00 1.07308e+00 7.74496e+01 1.767   4.98605e+00  1.53817e-01  0.00000e+00 0.00000e+00 2.90168e+01 1.767   4.84328e+01 181.767 0.8931 
1 1 1 15  74  5  o 15 3.46880e+00 1.15569e+00 3.44445e+01 73.460  7.26417e-01  2.44609e+00  0.00000e+00 0.00000e+00 6.72045e+01 73.460  3.27600e+01 73.460  0.7705 
1 1 1 15  75  0  o 14 3.05652e+00 1.02247e+00 4.07229e+01 191.070 -2.60614e+00 -5.09910e-01 0.00000e+00 0.00000e+00 4.98312e+01 191.070 9.10827e+00 191.070 0.7809 
1 1 1 15  75  1  o 16 4.54654e+00 1.28140e+00 4.35782e+01 355.681 3.48635e+00  -2.63314e-01 0.00000e+00 0.00000e+00 1.01553e+02 355.681 5.79744e+01 355.681 0.8409 
1 1 1 15  75  2  o 5  7.42826e+00 1.52961e+00 6.24463e+01 273.918 4.31240e-01  -6.29597e+00 0.00000e+00 0.00000e+00 1.96242e+02 273.918 1.33795e+02 273.918 0.9169 
1 1 1 15  75  3  o 13 5.14895e+00 1.43565e+00 6.21152e+01 54.215  2.90454e+00  4.02949e+00  0.00000e+00 0.00000e+00 1.12520e+02 54.215  5.04048e+01 54.215  0.8926 
1 1 1 15  75  4  o 19 5.62795e+00 1.45406e+00 1.42560e+02 229.898 -7.96224e+00 -9.45482e+00 0.00000e+00 0.00000e+00 6.25231e+01 229.898 8.00372e+01 49.898  0.9587 
1 1 1 15  75  5  o 12 4.12595e+00 1.31778e+00 9.81284e+01 110.004 -2.50359e+00 6.87716e+00  0.00000e+00 0.00000e+00 4.76079e+01 110.004 5.05205e+01 290.004 0.9289 
1 1 1 15  76  0  o 10 5.38445e+00 1.43006e+00 9.11580e+01 13.939  7.42570e+00  1.84306e+00  0.00000e+00 0.00000e+00 9.92205e+01 13.939  8.06254e+00 13.939  0.9322 
1 1 1 15  76  1  o 18 3.50291e+00 1.13340e+00 6.72947e+01 309.049 2.77784e+00  -3.42436e+00 0.00000e+00 0.00000e+00 4.93776e+01 309.049 1.79171e+01 129.049 0.8776 
1 1 1 15  76  2  o 4  5.42045e+00 1.48263e+00 1.08136e+02 137.023 -6.30175e+00 5.87179e+00  0.00000e+00 0.00000e+00 8.53443e+01 137.023 2.27913e+01 317.023 0.9400 
1 1 1 15  76  3  o 14 5.81837e+00 1.51173e+00 9.37538e+01 28.576  6.82077e+00  3.71507e+00  0.00000e+00 0.00000e+00 1.12517e+02 28.576  1.87636e+01 28.576  0.9332 
1 1 1 15  76  4  o 18 4.19796e+00 1.31918e+00 5.61471e+01 219.052 -3.36021e+00 -2.72610e+00 0.00000e+00 0.00000e+00 8.34515e+01 219.052 2.73044e+01 219.052 0.8750 
1 1 1 15  76  5  o 3  4.27494e+00 1.28017e+00 4.63113e+01 304.095 2.15452e+00  -3.18274e+00 0.00000e+00 0.00000e+00 9.30021e+01 304.095 4.66909e+01 304.095 0.8572 
1 1 1 15  77  0  o 5  3.22165e+00 1.06523e+00 3.20061e+01 237.739 -1.16124e+00 -1.83966e+00 0.00000e+00 0.00000e+00 5.65196e+01 237.739 2.45135e+01 237.739 0.7246 
1 1 1 15  77  1  o 9  3.96476e+00 1.21657e+00 7.63156e+01 241.385 -2.66348e+00 -4.88208e+00 0.00000e+00 0.00000e+00 5.98268e+01 241.385 1.64888e+01 61.385  0.9050 
1 1 1 15  77  2  o 16 3.15396e+00 1.05643e+00 3.64449e+01 322.123 1.89204e+00  -1.47170e+00 0.00000e+00 0.00000e+00 5.37545e+01 322.123 1.73096e+01 322.123 0.7533 
1 1 1 15  77  3  o 16 6.17485e+00 1.53141e+00 1.20799e+02 144.778 -8.79356e+00 6.20815e+00  0.00000e+00 0.00000e+00 1.02554e+02 144.778 1.82444e+01 324.778 0.9524 
1 1 1 15  77  4  o 11 4.69494e+00 1.38533e+00 1.07271e+02 329.235 7.36611e+00  -4.38506e+00 0.00000e+00 0.00000e+00 6.03654e+01 329.235 4.69056e+01 149.235 0.9397 
1 1 1 15  77  5  o 11 4.09448e+00 1.31043e+00 9.01386e+01 137.723 -5.06855e+00 4.60826e+00  0.00000e+00 0.00000e+00 5.36307e+01 137.723 3.65079e+01 317.723 0.9238 
1 1 1 15  78  0  o 5  2.95267e+00 9.78070e-01 3.67931e+01 17.016  2.33230e+00  7.13746e-01  0.00000e+00 0.00000e+00 4.80872e+01 17.016  1.12940e+01 17.016  0.7582 
1 1 1 15  78  1  o 5  4.16130e+00 1.26998e+00 2.36261e+01 138.019 -1.27380e+00 1.14617e+00  0.00000e+00 0.00000e+00 7.81441e+01 138.019 5.45180e+01 138.019 0.6447 
1 1 1 15  78  2  o 8  6.02235e+00 1.41418e+00 4.47063e+01 327.730 3.56406e+00  -2.25051e+00 0.00000e+00 0.00000e+00 1.54461e+02 327.730 1.09755e+02 327.730 0.8713 
1 1 1 15  78  3  o 6  4.51418e+00 1.34018e+00 1.09849e+02 347.129 8.70432e+00  -1.98894e+00 0.00000e+00 0.00000e+00 5.16623e+01 347.129 5.81872e+01 167.129 0.9422 
1 1 1 15  78  4  o 19 3.98479e+00 1.26215e+00 5.90309e+01 233.596 -2.75879e+00 -3.74133e+00 0.00000e+00 0.00000e+00 7.48649e+01 233.596 1.58340e+01 233.596 0.8845 
1 1 1 15  79  0  o 5  4.65841e+00 1.34892e+00 8.02355e+01 63.247  2.74243e+00  5.44017e+00  0.00000e+00 0.00000e+00 8.11214e+01 63.247  8.85883e-01 63.247  0.9138 
1 1 1 15  79  1  o 11 3.61900e+00 1.16579e+00 5.05272e+01 244.812 -1.50504e+00 -3.20008e+00 0.00000e+00 0.00000e+00 6.51819e+01 244.812 1.46547e+01 244.812 0.8430 
1 1 1 15  79  2  o 11 3.57552e+00 1.15926e+00 1.05709e+02 162.027 -7.82576e+00 2.53871e+00  0.00000e+00 0.00000e+00 2.14383e+01 162.027 8.42710e+01 342.027 0.9371 
1 1 1 15  79  3  o 14 5.11256e+00 1.40361e+00 7.96290e+01 300.311 3.44036e+00  -5.88489e+00 0.00000e+00 0.00000e+00 9.96057e+01 300.311 1.99768e+01 300.311 0.9234 
1 1 1 15  79  4  f 0  3.53147e+00 1.17536e+00 7.62919e+01 85.557  4.67448e-01  6.01637e+00  0.00000e+00 0.00000e+00 4.61487e+01 85.557  3.01431e+01 265.557 0.9129 
1 1 1 15  80  0  o 9  7.51497e+00 1.48763e+00 1.36672e+02 272.293 6.15796e-01  -1.53777e+01 0.00000e+00 0.00000e+00 1.38718e+02 272.293 2.04638e+00 272.293 0.9669 
1 1 1 15  80  1  o 9  4.88982e+00 1.34089e+00 1.06650e+02 46.244  6.61217e+00  6.90572e+00  0.00000e+00 0.00000e+00 6.87889e+01 46.244  3.78613e+01 226.244 0.9462 
1 1 1 15  80  2  o 10 3.08766e+00 1.04533e+00 6.76591e+01 230.239 -3.04476e+00 -3.65952e+00 0.00000e+00 0.00000e+00 3.63080e+01 230.239 3.13510e+01 50.239  0.8875 
1 1 1 15  80  3  o 9  4.46691e+00 1.41285e+00 8.07641e+01 276.686 7.20912e-01  -6.14979e+00 0.00000e+00 0.00000e+00 7.44138e+01 276.686 6.35033e+00 96.686  0.9152 
1 1 1 15  80  4  o 16 3.52332e+00 1.14552e+00 7.86636e+01 64.449  2.77497e+00  5.80444e+00  0.00000e+00 0.00000e+00 4.42330e+01 64.449  3.44306e+01 244.449 0.9186 
1 1 1 15  81  0  o 16 3.91436e+00 1.15136e+00 3.77111e+01 213.401 -2.64489e+00 -1.74407e+00 0.00000e+00 0.00000e+00 8.41569e+01 213.401 4.64458e+01 213.401 0.8217 
1 1 1 15  81  1  o 10 3.50309e+00 1.14088e+00 6.68094e+01 65.049  2.06352e+00  4.43509e+00  0.00000e+00 0.00000e+00 5.14968e+01 65.049  1.53127e+01 245.049 0.8908 
1 1 1 15  81  2  f 0  4.42343e+00 1.31816e+00 7.86477e+01 159.164 -6.19992e+00 2.35953e+00  0.00000e+00 0.00000e+00 7.59159e+01 159.164 2.73185e+00 339.164 0.9212 
1 1 1 15  81  3  o 14 3.52301e+00 1.14061e+00 7.40928e+01 79.300  1.05455e+00  5.58130e+00  0.00000e+00 0.00000e+00 4.71767e+01 79.300  2.69162e+01 259.301 0.9071 
1 1 1 15  81  4  o 6  3.83729e+00 1.22651e+00 3.94086e+01 238.142 -1.67225e+00 -2.69094e+00 0.00000e+00 0.00000e+00 8.02911e+01 238.142 4.08824e+01 238.142 0.8217 
1 1 1 15  82  0  o 2  3.31827e+00 1.07628e+00 4.90284e+01 231.469 -2.28703e+00 -2.87198e+00 0.00000e+00 0.00000e+00 5.77638e+01 231.469 8.73542e+00 231.469 0.8496 
1 1 1 15  82  1  o 18 3.95077e+00 1.20376e+00 6.69086e+01 115.581 -2.43020e+00 5.07659e+00  0.00000e+00 0.00000e+00 6.87866e+01 115.581 1.87800e+00 115.581 0.9062 
1 1 1 15  82  2  o 15 3.15033e+00 1.06543e+00 9.29675e+00 153.652 -6.57018e-01 3.25403e-01  0.00000e+00 0.00000e+00 3.17980e+01 153.652 2.25012e+01 153.652 0.3440 
1 1 1 15  82  3  o 11 5.71574e+00 1.52348e+00 8.92414e+01 240.098 -4.00114e+00 -6.95753e+00 0.00000e+00 0.00000e+00 1.13615e+02 240.098 2.43734e+01 240.098 0.9355 
1 1 1 15  82  4  f 0  3.29283e+00 1.10773e+00 4.88125e+01 214.690 -3.18929e+00 -2.20753e+00 0.00000e+00 0.00000e+00 5.85050e+01 214.690 9.69258e+00 214.690 0.8587 
1 1 1 15  83  0  o 17 5.52934e+00 1.35750e+00 1.27185e+02 100.657 -2.35069e+00 1.24918e+01  0.00000e+00 0.00000e+00 7.38122e+01 100.657 5.33728e+01 280.657 0.9598 
1 1 1 15  83  1  o 19 4.33058e+00 1.27415e+00 1.06166e+02 308.068 5.76210e+00  -7.35716e+00 0.00000e+00 0.00000e+00 4.88935e+01 308.068 5.72724e+01 128.068 0.9449 
1 1 1 15  83  2  o 4  3.37957e+00 1.10759e+00 5.04578e+01 140.046 -3.15477e+00 2.64289e+00  0.00000e+00 0.00000e+00 6.07386e+01 140.046 1.02808e+01 140.046 0.8678 
1 1 1 15  83  3  o 13 4.13065e+00 1.21927e+00 7.13820e+01 328.481 5.60206e+00  -3.43546e+00 0.00000e+00 0.00000e+00 7.28284e+01 328.481 1.44639e+00 328.481 0.9204 
1 1 1 15  84  0  o 15 3.70916e+00 1.13378e+00 3.62063e+01 218.678 -2.29595e+00 -1.83799e+00 0.00000e+00 0.00000e+00 7.69254e+01 218.678 4.07191e+01 218.678 0.8055 
1 1 1 15  84  1  o 13 3.17801e+00 1.05036e+00 5.50216e+01 25.954  4.02157e+00  1.95747e+00  0.00000e+00 0.00000e+00 5.08743e+01 25.954  4.14736e+00 205.954 0.8795 
1 1 1 15  84  2  o 17 3.41944e+00 1.12316e+00 5.92752e+01 68.835  1.69786e+00  4.38535e+00  0.00000e+00 0.00000e+00 5.55629e+01 68.835  3.71230e+00 248.835 0.8860 
1 1 1 15  84  3  o 17 2.80201e+00 9.58017e-01 6.21323e+01 198.110 -4.96339e+00 -1.62329e+00 0.00000e+00 0.00000e+00 3.33190e+01 198.110 2.88133e+01 18.110  0.8983 
1 1 1 15  85  0  o 14 3.43816e+00 1.07680e+00 7.55195e+01 128.142 -3.86171e+00 4.91755e+00  0.00000e+00 0.00000e+00 4.37151e+01 128.142 3.18044e+01 308.142 0.9161 
1 1 1 15  85  1  o 9  4.97299e+00 1.31638e+00 6.81541e+01 305.246 3.75912e+00  -5.31989e+00 0.00000e+00 0.00000e+00 1.05077e+02 305.246 3.69231e+01 305.246 0.9197 
1 1 1 15  85  2  o 2  2.82711e+00 9.65970e-01 4.53858e+01 75.753  8.80748e-01  3.46873e+00  0.00000e+00 0.00000e+00 4.51579e+01 75.753  2.27890e-01 255.753 0.8451 
1 1 1 15  85  3  o 19 3.30939e+00 1.08397e+00 5.28603e+01 165.036 -4.30867e+00 1.15157e+00  0.00000e+00 0.00000e+00 5.74463e+01 165.036 4.58598e+00 165.036 0.8791 
1 1 1 15  86  0  o 11 3.18193e+00 1.04402e+00 3.21477e+01 248.173 -1.01822e+00 -2.54232e+00 0.00000e+00 0.00000e+00 6.28240e+01 248.173 3.06763e+01 248.173 0.7886 
1 1 1 15  86  1  o 7  3.31989e+00 1.07930e+00 2.06512e+01 331.880 1.50233e+00  -8.02848e-01 0.00000e+00 0.00000e+00 6.01280e+01 331.880 3.94767e+01 331.880 0.6425 
1 1 1 15  86  2  o 18 2.94871e+00 9.99854e-01 2.19181e+01 109.113 -5.57692e-01 1.60938e+00  0.00000e+00 0.00000e+00 4.98634e+01 109.113 2.79453e+01 109.113 0.6425 
1 1 1 15  87  0  o 17 2.31367e+00 8.11483e-01 3.64678e+01 7.531   2.94061e+00  3.88734e-01  0.00000e+00 0.00000e+00 3.42196e+01 7.531   2.24813e+00 187.531 0.8075 
1 1 1 15  87  1  o 14 5.52313e+00 1.39416e+00 1.22004e+02 222.542 -8.89365e+00 -8.16164e+00 0.00000e+00 0.00000e+00 7.82394e+01 222.542 4.37644e+01 42.542  0.9576 
1 1 1 16  0   0  o 13 9.03761e+00 2.81233e+00 1.86052e+02 0.000   5.69286e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.60297e+02 0.000   2.57551e+01 180.000 1.0000 
1 1 1 16  0   1  o 3  5.77014e+00 2.94437e+00 1.46419e+02 180.000 -2.85591e+00 0.00000e+00  0.00000e+00 0.00000e+00 7.33928e+01 180.000 7.30266e+01 0.000   0.9934 
1 1 1 16  0   2  o 14 3.60363e+00 2.30409e+00 5.88078e+01 180.000 -9.29258e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.21613e+01 180.000 1.66465e+01 0.000   0.7302 
1 1 1 16  0   3  o 2  5.40047e+00 2.85204e+00 2.34050e+01 180.000 -4.45380e-01 0.00000e+00  0.00000e+00 0.00000e+00 6.32707e+01 180.000 3.98656e+01 180.000 0.4181 
1 1 1 16  0   4  o 13 1.23761e+01 2.58545e+00 3.06883e+02 0.000   1.52612e+01  0.00000e+00  0.00000e+00 0.00000e+00 1.68410e+02 0.000   1.38472e+02 180.000 1.0000 
1 1 1 16  0   5  o 10 4.70978e+00 2.71176e+00 9.23376e+01 180.000 -1.75242e+00 0.00000e+00  0.00000e+00 0.00000e+00 7.80465e+01 180.000 1.42911e+01 0.000   0.9417 
1 1 1 16  0   6  o 6  1.77037e+01 2.06999e+00 3.11892e+02 0.000   3.10791e+01  0.00000e+00  0.00000e+00 0.00000e+00 3.68467e+02 0.000   5.65751e+01 0.000   1.0000 
1 1 1 16  0   7  o 12 1.66204e+01 2.34897e+00 3.21018e+02 180.000 -2.69630e+01 0.00000e+00  0.00000e+00 0.00000e+00 3.17867e+02 180.000 3.15069e+00 0.000   1.0000 
1 1 1 16  0   8  o 8  1.88948e+01 2.62430e+00 2.37418e+02 180.000 -1.97964e+01 0.00000e+00  0.00000e+00 0.00000e+00 4.89028e+02 180.000 2.51610e+02 180.000 1.0000 
1 1 1 16  1   0  o 17 9.13664e+00 1.64618e+00 2.25549e+02 245.616 -6.87044e+00 -1.51569e+01 0.00000e+00 0.00000e+00 1.13914e+02 245.616 1.11634e+02 65.616  0.9695 
1 1 1 16  1   1  o 14 5.85495e+00 1.58668e+00 9.59697e+01 43.018  3.63319e+00  3.39015e+00  0.00000e+00 0.00000e+00 1.04453e+02 43.018  8.48374e+00 43.018  0.8927 
1 1 1 16  1   2  o 11 1.23345e+01 1.45248e+00 2.46594e+02 184.309 -2.92820e+01 -2.20616e+00 0.00000e+00 0.00000e+00 2.18534e+02 184.309 2.80600e+01 4.309   0.9828 
1 1 1 16  1   3  o 15 9.07326e+00 1.69452e+00 1.84415e+02 19.599  1.32516e+01  4.71844e+00  0.00000e+00 0.00000e+00 1.51268e+02 19.599  3.31472e+01 199.599 0.9638 
1 1 1 16  1   4  o 3  7.84699e+00 1.80381e+00 1.17147e+02 236.998 -4.07942e+00 -6.28132e+00 0.00000e+00 0.00000e+00 1.63303e+02 236.998 4.61558e+01 236.998 0.9306 
1 1 1 16  1   5  f 0  6.61112e+00 1.74753e+00 8.19884e+00 359.896 4.83454e-01  -8.72610e-04 0.00000e+00 0.00000e+00 5.14705e+01 359.896 4.32717e+01 359.896 0.2349 
1 1 1 16  1   6  o 5  9.62135e+00 1.97413e+00 1.65670e+02 192.449 -1.27007e+01 -2.80382e+00 0.00000e+00 0.00000e+00 1.89569e+02 192.449 2.38990e+01 192.449 0.9608 
1 1 1 16  1   7  o 5  1.42852e+01 1.74289e+00 1.49203e+02 306.056 1.20277e+01  -1.65206e+01 0.00000e+00 0.00000e+00 3.86308e+02 306.056 2.37105e+02 306.056 0.9752 
1 1 1 16  1   8  f 0  9.32697e+00 2.19508e+00 9.90395e+01 191.762 -6.47186e+00 -1.34755e+00 0.00000e+00 0.00000e+00 2.31192e+02 191.762 1.32153e+02 191.762 0.9209 
1 1 1 16  2   0  o 15 6.04091e+00 1.62540e+00 1.02513e+02 286.748 1.45635e+00  -4.83940e+00 0.00000e+00 0.00000e+00 1.04600e+02 286.748 2.08661e+00 286.748 0.8946 
1 1 1 16  2   1  o 17 2.41342e+01 1.12521e+00 3.96238e+02 122.971 -5.84177e+01 9.00560e+01  0.00000e+00 0.00000e+00 5.24923e+02 122.971 1.28685e+02 122.971 0.9953 
1 1 1 16  2   2  o 3  5.26218e+00 1.47589e+00 1.13401e+02 348.628 5.57693e+00  -1.12163e+00 0.00000e+00 0.00000e+00 6.97711e+01 348.628 4.36298e+01 168.628 0.9072 
1 1 1 16  2   3  f 0  3.55494e+00 1.21817e+00 4.45829e+01 223.308 -1.24913e+00 -1.17746e+00 0.00000e+00 0.00000e+00 4.34782e+01 223.308 1.10473e+00 43.308  0.6453 
1 1 1 16  2   4  o 6  5.82120e+00 1.75614e+00 9.98010e+01 266.046 -3.35258e-01 -4.85085e+00 0.00000e+00 0.00000e+00 9.91855e+01 266.046 6.15580e-01 86.046  0.8901 
1 1 1 16  2   5  o 1  4.60745e+00 1.45179e+00 7.62399e+01 232.361 -2.28339e+00 -2.96090e+00 0.00000e+00 0.00000e+00 7.46931e+01 232.361 1.54681e+00 52.361  0.8527 
1 1 1 16  2   6  o 13 5.99929e+00 1.74833e+00 1.06797e+02 236.279 -3.34282e+00 -5.00833e+00 0.00000e+00 0.00000e+00 1.03626e+02 236.279 3.17141e+00 56.279  0.9127 
1 1 1 16  2   7  o 19 1.03553e+01 1.96476e+00 1.74398e+02 69.745  5.20503e+00  1.41052e+01  0.00000e+00 0.00000e+00 2.10179e+02 69.745  3.57813e+01 69.745  0.9661 
1 1 1 16  2   8  o 11 1.20084e+01 2.20202e+00 1.57860e+02 139.198 -1.02259e+01 8.82729e+00  0.00000e+00 0.00000e+00 2.86395e+02 139.198 1.28535e+02 139.198 0.9622 
1 1 1 16  3   0  o 3  1.31435e+01 1.38040e+00 2.00729e+02 130.294 -1.57349e+01 1.85576e+01  0.00000e+00 0.00000e+00 2.92513e+02 130.294 9.17842e+01 130.294 0.9792 
1 1 1 16  3   1  o 6  6.38896e+00 1.59494e+00 6.17940e+01 262.718 -4.28788e-01 -3.35550e+00 0.00000e+00 0.00000e+00 1.42715e+02 262.718 8.09212e+01 262.718 0.8347 
1 1 1 16  3   2  o 9  5.30719e+00 1.52950e+00 1.11057e+02 143.808 -4.42532e+00 3.23791e+00  0.00000e+00 0.00000e+00 7.29211e+01 143.808 3.81362e+01 323.808 0.9035 
1 1 1 16  3   3  o 15 1.81496e+01 1.27337e+00 2.52026e+02 246.710 -1.90423e+01 -4.42364e+01 0.00000e+00 0.00000e+00 4.37412e+02 246.710 1.85385e+02 246.710 0.9896 
1 1 1 16  3   4  o 16 1.21581e+01 1.90051e+00 2.46101e+02 78.133  4.74671e+00  2.25897e+01  0.00000e+00 0.00000e+00 2.10585e+02 78.133  3.55163e+01 258.133 0.9781 
1 1 1 16  3   5  o 6  1.91829e+01 1.31744e+00 3.22845e+02 234.598 -4.13305e+01 -5.81534e+01 0.00000e+00 0.00000e+00 4.08940e+02 234.598 8.60955e+01 234.598 0.9930 
1 1 1 16  3   6  o 12 6.69454e+00 1.75243e+00 1.38089e+02 49.962  5.57425e+00  6.63410e+00  0.00000e+00 0.00000e+00 1.03845e+02 49.962  3.42444e+01 229.962 0.9404 
1 1 1 16  3   7  o 4  6.25535e+00 1.68406e+00 1.08881e+02 261.735 -9.88136e-01 -6.80238e+00 0.00000e+00 0.00000e+00 1.13319e+02 261.735 4.43753e+00 261.735 0.9241 
1 1 1 16  3   8  o 1  5.85180e+00 1.79976e+00 4.93201e+01 34.659  2.17019e+00  1.50043e+00  0.00000e+00 0.00000e+00 1.25996e+02 34.659  7.66755e+01 34.659  0.7792 
1 1 1 16  4   0  o 5  1.03390e+01 1.62283e+00 2.18593e+02 275.011 1.61291e+00  -1.83936e+01 0.00000e+00 0.00000e+00 1.66746e+02 275.011 5.18469e+01 95.011  0.9725 
1 1 1 16  4   1  o 12 7.98607e+00 1.71468e+00 1.96480e+02 26.456  1.12996e+01  5.62299e+00  0.00000e+00 0.00000e+00 9.73652e+01 26.456  9.91149e+01 206.456 0.9595 
1 1 1 16  4   2  o 17 4.49095e+00 1.42843e+00 4.21906e+01 141.985 -1.46693e+00 1.14670e+00  0.00000e+00 0.00000e+00 7.39016e+01 141.985 3.17111e+01 141.985 0.6737 
1 1 1 16  4   3  o 8  9.54622e+00 1.71533e+00 1.64594e+02 234.806 -7.52507e+00 -1.06697e+01 0.00000e+00 0.00000e+00 1.87529e+02 234.806 2.29349e+01 234.806 0.9609 
1 1 1 16  4   4  o 11 8.87896e+00 1.85987e+00 1.71936e+02 245.240 -5.04636e+00 -1.09415e+01 0.00000e+00 0.00000e+00 1.54574e+02 245.240 1.73621e+01 65.240  0.9576 
1 1 1 16  4   5  o 3  4.46609e+00 1.44424e+00 1.09475e+02 357.573 5.22211e+00  -2.21318e-01 0.00000e+00 0.00000e+00 4.46675e+01 357.573 6.48072e+01 177.573 0.8984 
1 1 1 16  4   6  o 3  5.04897e+00 1.59428e+00 8.98413e+01 61.103  2.27094e+00  4.11426e+00  0.00000e+00 0.00000e+00 8.20511e+01 61.103  7.79017e+00 241.103 0.8859 
1 1 1 16  4   7  o 14 5.59154e+00 1.67049e+00 1.27315e+02 49.207  4.73531e+00  5.48736e+00  0.00000e+00 0.00000e+00 7.21863e+01 49.207  5.51288e+01 229.207 0.9282 
1 1 1 16  4   8  o 16 4.86157e+00 1.60409e+00 5.84284e+01 253.514 -8.34462e-01 -2.81966e+00 0.00000e+00 0.00000e+00 9.21249e+01 253.514 3.36965e+01 253.514 0.8055 
1 1 1 16  5   0  o 18 5.92167e+00 1.58808e+00 9.08414e+01 88.838  9.65498e-02  4.75831e+00  0.00000e+00 0.00000e+00 1.10559e+02 88.838  1.97174e+01 88.838  0.8875 
1 1 1 16  5   1  o 12 5.63683e+00 1.61244e+00 1.36587e+02 19.574  6.15722e+00  2.18929e+00  0.00000e+00 0.00000e+00 6.22595e+01 19.574  7.43273e+01 199.574 0.9199 
1 1 1 16  5   2  o 10 1.76415e+01 1.19970e+00 2.34758e+02 190.907 -4.50640e+01 -8.68371e+00 0.00000e+00 0.00000e+00 4.34686e+02 190.907 1.99928e+02 190.907 0.9890 
1 1 1 16  5   3  o 10 7.66093e+00 1.73553e+00 7.14223e+01 148.100 -3.81699e+00 2.37587e+00  0.00000e+00 0.00000e+00 1.87426e+02 148.100 1.16004e+02 148.100 0.8802 
1 1 1 16  5   4  o 1  7.02967e+00 1.89728e+00 8.75707e+01 249.740 -1.64726e+00 -4.46259e+00 0.00000e+00 0.00000e+00 1.51997e+02 249.740 6.44267e+01 249.740 0.8874 
1 1 1 16  5   5  o 3  5.09246e+00 1.55082e+00 7.51274e+01 198.799 -3.63320e+00 -1.23678e+00 0.00000e+00 0.00000e+00 9.25314e+01 198.799 1.74040e+01 198.799 0.8570 
1 1 1 16  5   6  o 10 6.92428e+00 1.77651e+00 4.72111e+01 153.119 -2.69138e+00 1.36429e+00  0.00000e+00 0.00000e+00 1.68660e+02 153.119 1.21449e+02 153.119 0.8113 
1 1 1 16  5   7  o 2  5.82535e+00 1.68095e+00 9.70991e+01 157.573 -5.28662e+00 2.18185e+00  0.00000e+00 0.00000e+00 1.06164e+02 157.573 9.06538e+00 157.573 0.9078 
1 1 1 16  5   8  o 5  5.96556e+00 1.78257e+00 3.41296e+01 224.139 -1.34999e+00 -1.31002e+00 0.00000e+00 0.00000e+00 1.21198e+02 224.139 8.70688e+01 224.139 0.6773 
1 1 1 16  6   0  o 4  5.82033e+00 1.59278e+00 8.40709e+01 286.567 1.23107e+00  -4.13825e+00 0.00000e+00 0.00000e+00 1.11030e+02 286.567 2.69595e+01 286.567 0.8747 
1 1 1 16  6   1  o 18 1.06700e+01 1.57134e+00 1.62087e+02 12.515  1.46395e+01  3.24952e+00  0.00000e+00 0.00000e+00 2.33175e+02 12.515  7.10877e+01 12.515  0.9661 
1 1 1 16  6   2  o 4  9.20022e+00 1.61557e+00 1.22444e+02 39.416  7.72109e+00  6.34573e+00  0.00000e+00 0.00000e+00 2.12385e+02 39.416  8.99415e+01 39.416  0.9486 
1 1 1 16  6   3  o 9  1.92218e+01 1.22287e+00 2.91064e+02 213.505 -5.18534e+01 -3.43279e+01 0.00000e+00 0.00000e+00 4.40822e+02 213.505 1.49758e+02 213.505 0.9919 
1 1 1 16  6   4  o 3  8.65794e+00 1.69875e+00 2.11935e+02 151.960 -1.39955e+01 7.45407e+00  0.00000e+00 0.00000e+00 1.09889e+02 151.960 1.02046e+02 331.960 0.9679 
1 1 1 16  6   5  o 13 7.68201e+00 1.87737e+00 1.78165e+02 283.874 2.70776e+00  -1.09629e+01 0.00000e+00 0.00000e+00 1.03564e+02 283.874 7.46013e+01 103.874 0.9546 
1 1 1 16  6   6  f 0  6.05531e+00 1.78785e+00 6.33081e+01 309.858 2.25133e+00  -2.69656e+00 0.00000e+00 0.00000e+00 1.32568e+02 309.858 6.92601e+01 309.858 0.8418 
1 1 1 16  6   7  o 18 6.85486e+00 1.89324e+00 9.79759e+01 105.659 -1.59720e+00 5.69781e+00  0.00000e+00 0.00000e+00 1.42075e+02 105.659 4.40992e+01 105.659 0.9111 
1 1 1 16  6   8  o 19 5.23611e+00 1.68427e+00 1.31357e+02 229.878 -4.35811e+00 -5.17137e+00 0.00000e+00 0.00000e+00 5.44018e+01 229.878 7.69552e+01 49.878  0.9228 
1 1 1 16  7   0  o 15 6.16409e+00 1.65639e+00 5.36791e+01 346.091 2.73768e+00  -6.77952e-01 0.00000e+00 0.00000e+00 1.34296e+02 346.091 8.06172e+01 346.091 0.7958 
1 1 1 16  7   1  o 9  1.27452e+01 1.47667e+00 1.97606e+02 199.213 -2.16550e+01 -7.54652e+00 0.00000e+00 0.00000e+00 2.80329e+02 199.213 8.27224e+01 199.213 0.9779 
1 1 1 16  7   2  o 7  4.84288e+00 1.46887e+00 1.19481e+02 77.141  1.23761e+00  5.42144e+00  0.00000e+00 0.00000e+00 4.86602e+01 77.141  7.08212e+01 257.141 0.9049 
1 1 1 16  7   3  f 0  9.29636e+00 1.70872e+00 1.91124e+02 138.904 -1.14124e+01 9.95420e+00  0.00000e+00 0.00000e+00 1.53726e+02 138.904 3.73983e+01 318.904 0.9664 
1 1 1 16  7   4  o 7  5.22817e+00 1.53904e+00 1.11766e+02 44.322  3.95100e+00  3.85857e+00  0.00000e+00 0.00000e+00 6.97785e+01 44.322  4.19874e+01 224.322 0.9042 
1 1 1 16  7   5  o 12 8.24427e+00 1.63100e+00 1.69405e+02 213.799 -1.10936e+01 -7.42628e+00 0.00000e+00 0.00000e+00 1.35203e+02 213.799 3.42020e+01 33.799  0.9618 
1 1 1 16  7   6  o 13 6.90675e+00 1.92762e+00 1.30319e+02 72.490  2.27339e+00  7.20585e+00  0.00000e+00 0.00000e+00 1.16847e+02 72.490  1.34727e+01 252.490 0.9313 
1 1 1 16  7   7  o 7  4.64040e+00 1.47660e+00 1.38059e+02 255.499 -1.85389e+00 -7.16810e+00 0.00000e+00 0.00000e+00 2.77806e+01 255.499 1.10279e+02 75.499  0.9298 
1 1 1 16  7   8  f 0  4.72816e+00 1.57324e+00 7.32413e+01 310.555 2.37570e+00  -2.77622e+00 0.00000e+00 0.00000e+00 8.10384e+01 310.555 7.79708e+00 310.555 0.8488 
1 1 1 16  8   0  o 4  2.11378e+01 1.13967e+00 3.27716e+02 242.689 -3.54468e+01 -6.86451e+01 0.00000e+00 0.00000e+00 4.77037e+02 242.689 1.49321e+02 242.689 0.9935 
1 1 1 16  8   1  o 14 1.03768e+01 1.55163e+00 1.19198e+02 76.124  2.59735e+00  1.05142e+01  0.00000e+00 0.00000e+00 2.59850e+02 76.124  1.40652e+02 76.124  0.9527 
1 1 1 16  8   2  f 0  3.50849e+00 1.19450e+00 1.78675e+01 7.642   6.89913e-01  9.25712e-02  0.00000e+00 0.00000e+00 2.63554e+01 7.642   8.48792e+00 7.642   0.3285 
1 1 1 16  8   3  o 8  1.04293e+01 1.56004e+00 2.55378e+02 262.703 -3.13172e+00 -2.44555e+01 0.00000e+00 0.00000e+00 1.36738e+02 262.703 1.18641e+02 82.703  0.9795 
1 1 1 16  8   4  o 4  8.32129e+00 1.71569e+00 1.41527e+02 131.749 -6.71003e+00 7.51814e+00  0.00000e+00 0.00000e+00 1.61722e+02 131.749 2.01946e+01 131.749 0.9490 
1 1 1 16  8   5  f 0  5.36329e+00 1.60994e+00 1.21722e+02 21.663  5.89665e+00  2.34219e+00  0.00000e+00 0.00000e+00 6.72914e+01 21.663  5.44306e+01 201.663 0.9174 
1 1 1 16  8   6  o 1  8.01759e+00 2.05514e+00 1.24426e+02 245.297 -3.23444e+00 -7.03111e+00 0.00000e+00 0.00000e+00 1.63011e+02 245.297 3.85852e+01 245.297 0.9330 
1 1 1 16  8   7  o 12 1.04078e+01 1.98631e+00 1.48128e+02 295.733 5.55645e+00  -1.15283e+01 0.00000e+00 0.00000e+00 2.35946e+02 295.733 8.78186e+01 295.733 0.9601 
1 1 1 16  8   8  o 11 7.13193e+00 1.91826e+00 9.24413e+01 71.530  1.85416e+00  5.55120e+00  0.00000e+00 0.00000e+00 1.57062e+02 71.530  6.46203e+01 71.530  0.9100 
1 1 1 16  9   0  o 11 1.10847e+01 1.57733e+00 2.30169e+02 170.019 -2.23394e+01 3.93155e+00  0.00000e+00 0.00000e+00 1.85121e+02 170.019 4.50477e+01 350.019 0.9777 
1 1 1 16  9   1  o 17 5.26918e+00 1.54530e+00 7.74005e+01 207.356 -3.18117e+00 -1.64588e+00 0.00000e+00 0.00000e+00 9.33741e+01 207.356 1.59736e+01 207.356 0.8453 
1 1 1 16  9   2  o 14 1.78593e+01 1.19489e+00 3.25850e+02 32.254  5.46240e+01  3.44707e+01  0.00000e+00 0.00000e+00 3.53989e+02 32.254  2.81387e+01 32.254  0.9922 
1 1 1 16  9   3  o 5  1.00063e+01 1.65421e+00 1.95839e+02 339.178 1.60860e+01  -6.11749e+00 0.00000e+00 0.00000e+00 1.76906e+02 339.178 1.89331e+01 159.178 0.9705 
1 1 1 16  9   4  o 12 7.24269e+00 1.75542e+00 1.57989e+02 119.168 -5.02989e+00 9.01171e+00  0.00000e+00 0.00000e+00 1.06291e+02 119.168 5.16981e+01 299.168 0.9502 
1 1 1 16  9   5  o 17 4.32696e+00 1.40866e+00 4.07661e+01 78.030  4.00943e-01  1.89110e+00  0.00000e+00 0.00000e+00 7.33384e+01 78.030  3.25723e+01 78.030  0.6865 
1 1 1 16  9   6  o 12 4.97993e+00 1.51921e+00 6.46320e+01 204.437 -3.02536e+00 -1.37471e+00 0.00000e+00 0.00000e+00 9.44438e+01 204.437 2.98118e+01 204.437 0.8313 
1 1 1 16  9   7  o 16 6.13845e+00 1.78448e+00 9.87853e+01 111.684 -2.11651e+00 5.32287e+00  0.00000e+00 0.00000e+00 1.15424e+02 111.684 1.66384e+01 111.684 0.9079 
1 1 1 16  9   8  o 14 4.32577e+00 1.46893e+00 6.29945e+01 106.493 -9.27449e-01 3.13239e+00  0.00000e+00 0.00000e+00 7.46847e+01 106.493 1.16902e+01 106.493 0.8279 
1 1 1 16  10  0  o 16 6.55677e+00 1.54247e+00 7.31500e+01 154.134 -3.90809e+00 1.89476e+00  0.00000e+00 0.00000e+00 1.46825e+02 154.134 7.36751e+01 154.134 0.8755 
1 1 1 16  10  1  o 10 1.35044e+01 1.38590e+00 1.99719e+02 95.734  -2.69898e+00 2.68774e+01  0.00000e+00 0.00000e+00 3.08395e+02 95.734  1.08675e+02 95.734  0.9813 
1 1 1 16  10  2  o 5  3.63288e+00 1.22548e+00 6.24554e+01 201.726 -2.37218e+00 -9.45278e-01 0.00000e+00 0.00000e+00 4.49572e+01 201.726 1.74982e+01 21.727  0.7707 
1 1 1 16  10  3  o 2  9.17826e+00 1.81522e+00 1.90438e+02 143.838 -1.13237e+01 8.27610e+00  0.00000e+00 0.00000e+00 1.49045e+02 143.838 4.13926e+01 323.838 0.9637 
1 1 1 16  10  4  o 6  5.04109e+00 1.53537e+00 1.56656e+02 208.543 -7.15286e+00 -3.89071e+00 0.00000e+00 0.00000e+00 2.46078e+01 208.543 1.32048e+02 28.543  0.9364 
1 1 1 16  10  5  o 14 5.19412e+00 1.58835e+00 1.27563e+02 237.177 -3.53426e+00 -5.47920e+00 0.00000e+00 0.00000e+00 5.59477e+01 237.177 7.16156e+01 57.177  0.9198 
1 1 1 16  10  6  o 6  9.98355e+00 1.94976e+00 1.84889e+02 5.872   1.46209e+01  1.50367e+00  0.00000e+00 0.00000e+00 1.85440e+02 5.872   5.51030e-01 5.872   0.9654 
1 1 1 16  10  7  o 12 8.43714e+00 1.81048e+00 2.18582e+02 231.422 -1.03708e+01 -1.30014e+01 0.00000e+00 0.00000e+00 9.57896e+01 231.422 1.22792e+02 51.422  0.9695 
1 1 1 16  10  8  o 18 4.79035e+00 1.57871e+00 6.52385e+01 273.842 2.32978e-01  -3.46955e+00 0.00000e+00 0.00000e+00 8.94305e+01 273.842 2.41920e+01 273.842 0.8399 
1 1 1 16  11  0  o 1  1.41267e+01 1.30519e+00 2.27384e+02 247.321 -1.23061e+01 -2.94487e+01 0.00000e+00 0.00000e+00 3.05370e+02 247.321 7.79858e+01 247.321 0.9842 
1 1 1 16  11  1  o 3  1.84834e+01 1.18680e+00 3.20698e+02 80.852  1.04636e+01  6.49763e+01  0.00000e+00 0.00000e+00 3.82573e+02 80.852  6.18757e+01 80.852  0.9924 
1 1 1 16  11  2  o 12 5.53845e+00 1.57617e+00 1.19769e+02 310.832 4.02613e+00  -4.65902e+00 0.00000e+00 0.00000e+00 7.45839e+01 310.832 4.51853e+01 130.832 0.9147 
1 1 1 16  11  3  o 10 9.62252e+00 1.92058e+00 1.56011e+02 246.945 -4.58619e+00 -1.07757e+01 0.00000e+00 0.00000e+00 1.97175e+02 246.945 4.11644e+01 246.945 0.9563 
1 1 1 16  11  4  o 4  6.69368e+00 1.72693e+00 1.18809e+02 288.173 2.27557e+00  -6.93197e+00 0.00000e+00 0.00000e+00 1.19887e+02 288.173 1.07877e+00 288.173 0.9287 
1 1 1 16  11  5  o 10 7.28423e+00 1.73420e+00 1.05539e+02 44.316  4.95727e+00  4.84024e+00  0.00000e+00 0.00000e+00 1.53201e+02 44.316  4.76621e+01 44.316  0.9247 
1 1 1 16  11  6  o 11 1.08025e+01 1.89208e+00 1.85144e+02 328.088 1.39888e+01  -8.71146e+00 0.00000e+00 0.00000e+00 2.17131e+02 328.088 3.19864e+01 328.088 0.9692 
1 1 1 16  11  7  o 16 4.97310e+00 1.57296e+00 6.33743e+01 17.649  3.14553e+00  1.00077e+00  0.00000e+00 0.00000e+00 9.52634e+01 17.649  3.18891e+01 17.649  0.8300 
1 1 1 16  11  8  o 14 6.26875e+00 1.86928e+00 9.15994e+01 225.070 -3.71518e+00 -3.72422e+00 0.00000e+00 0.00000e+00 1.25059e+02 225.070 3.34591e+01 225.070 0.8991 
1 1 1 16  12  0  o 4  7.26777e+00 1.66239e+00 1.18890e+02 120.484 -3.62268e+00 6.15398e+00  0.00000e+00 0.00000e+00 1.39277e+02 120.484 2.03868e+01 120.484 0.9271 
1 1 1 16  12  1  o 10 4.23171e+00 1.36404e+00 4.93996e+01 23.839  1.93576e+00  8.55343e-01  0.00000e+00 0.00000e+00 6.67633e+01 23.839  1.73637e+01 23.839  0.7160 
1 1 1 16  12  2  o 18 9.90954e+00 1.60483e+00 2.16103e+02 234.950 -1.12308e+01 -1.60096e+01 0.00000e+00 0.00000e+00 1.54188e+02 234.950 6.19147e+01 54.950  0.9741 
1 1 1 16  12  3  o 1  6.70103e+00 1.86552e+00 1.23251e+02 344.577 6.40954e+00  -1.76822e+00 0.00000e+00 0.00000e+00 1.13717e+02 344.577 9.53353e+00 164.577 0.9214 
1 1 1 16  12  4  o 5  8.24738e+00 1.66890e+00 1.06241e+02 138.263 -6.21292e+00 5.54275e+00  0.00000e+00 0.00000e+00 1.90756e+02 138.263 8.45150e+01 138.263 0.9379 
1 1 1 16  12  5  o 12 6.43967e+00 1.68410e+00 6.42442e+01 75.802  9.42166e-01  3.72383e+00  0.00000e+00 0.00000e+00 1.47768e+02 75.802  8.35238e+01 75.802  0.8571 
1 1 1 16  12  6  o 5  5.40699e+00 1.59776e+00 1.51575e+02 153.201 -7.19520e+00 3.63434e+00  0.00000e+00 0.00000e+00 4.28269e+01 153.201 1.08748e+02 333.201 0.9357 
1 1 1 16  12  7  o 12 5.14114e+00 1.60148e+00 7.95403e+01 202.560 -3.88289e+00 -1.61314e+00 0.00000e+00 0.00000e+00 9.25475e+01 202.560 1.30072e+01 202.560 0.8710 
1 1 1 16  12  8  o 7  5.32127e+00 1.69606e+00 1.11154e+02 97.193  -7.55253e-01 5.98431e+00  0.00000e+00 0.00000e+00 7.55656e+01 97.193  3.55888e+01 277.193 0.9129 
1 1 1 16  13  0  o 10 9.58325e+00 1.51089e+00 1.61202e+02 9.755   1.36133e+01  2.34038e+00  0.00000e+00 0.00000e+00 1.92429e+02 9.755   3.12274e+01 9.755   0.9631 
1 1 1 16  13  1  o 8  1.14278e+01 1.43616e+00 1.66838e+02 271.409 4.56600e-01  -1.85595e+01 0.00000e+00 0.00000e+00 2.59321e+02 271.409 9.24831e+01 271.409 0.9727 
1 1 1 16  13  2  o 16 6.93200e+00 1.62481e+00 8.91372e+01 127.077 -3.36287e+00 4.45025e+00  0.00000e+00 0.00000e+00 1.51581e+02 127.077 6.24435e+01 127.077 0.9053 
1 1 1 16  13  3  o 8  5.20083e+00 1.56611e+00 1.23077e+02 344.360 5.89682e+00  -1.65091e+00 0.00000e+00 0.00000e+00 5.94065e+01 344.360 6.36700e+01 164.360 0.9142 
1 1 1 16  13  4  o 6  7.01579e+00 1.75583e+00 6.28916e+01 157.475 -3.62339e+00 1.50274e+00  0.00000e+00 0.00000e+00 1.68899e+02 157.475 1.06007e+02 157.475 0.8605 
1 1 1 16  13  5  o 4  7.95725e+00 1.83390e+00 1.35526e+02 77.525  1.97873e+00  8.94433e+00  0.00000e+00 0.00000e+00 1.52910e+02 77.525  1.73835e+01 77.525  0.9437 
1 1 1 16  13  6  o 6  4.69076e+00 1.49689e+00 5.82623e+01 220.554 -2.31894e+00 -1.98436e+00 0.00000e+00 0.00000e+00 8.83984e+01 220.554 3.01361e+01 220.554 0.8138 
1 1 1 16  13  7  o 6  9.20259e+00 1.80819e+00 1.68187e+02 0.924   1.39620e+01  2.25227e-01  0.00000e+00 0.00000e+00 1.72568e+02 0.924   4.38126e+00 0.924   0.9635 
1 1 1 16  13  8  o 19 6.20182e+00 1.82915e+00 8.67299e+01 175.875 -5.00890e+00 3.61206e-01  0.00000e+00 0.00000e+00 1.26360e+02 175.875 3.96305e+01 175.875 0.8939 
1 1 1 16  14  0  o 2  9.66369e+00 1.54293e+00 1.56373e+02 315.313 9.88690e+00  -9.77952e+00 0.00000e+00 0.00000e+00 2.00307e+02 315.313 4.39347e+01 315.313 0.9633 
1 1 1 16  14  1  o 14 6.16678e+00 1.41165e+00 9.89767e+01 322.658 4.80994e+00  -3.66981e+00 0.00000e+00 0.00000e+00 1.16903e+02 322.658 1.79263e+01 322.658 0.9131 
1 1 1 16  14  2  f 0  8.07940e+00 1.59291e+00 1.53557e+02 173.670 -1.09621e+01 1.21613e+00  0.00000e+00 0.00000e+00 1.41954e+02 173.670 1.16038e+01 353.669 0.9535 
1 1 1 16  14  3  o 14 1.13043e+01 1.77481e+00 2.10082e+02 69.942  6.90594e+00  1.89138e+01  0.00000e+00 0.00000e+00 2.12835e+02 69.942  2.75285e+00 69.942  0.9748 
1 1 1 16  14  4  o 5  6.27370e+00 1.65941e+00 7.56846e+01 359.398 4.47102e+00  -4.69702e-02 0.00000e+00 0.00000e+00 1.36157e+02 359.398 6.04724e+01 359.398 0.8795 
1 1 1 16  14  5  o 11 7.13907e+00 1.75395e+00 7.24741e+01 128.588 -2.87448e+00 3.60232e+00  0.00000e+00 0.00000e+00 1.69763e+02 128.588 9.72887e+01 128.588 0.8834 
1 1 1 16  14  6  o 1  6.17983e+00 1.74481e+00 1.25459e+02 296.016 3.23820e+00  -6.63462e+00 0.00000e+00 0.00000e+00 9.52480e+01 296.016 3.02111e+01 116.016 0.9296 
1 1 1 16  14  7  o 9  4.32355e+00 1.43968e+00 7.93755e+01 261.791 -5.90519e-01 -4.09343e+00 0.00000e+00 0.00000e+00 6.49351e+01 261.791 1.44405e+01 81.791  0.8685 
1 1 1 16  14  8  o 1  8.33853e+00 2.04584e+00 6.65822e+01 70.526  1.50145e+00  4.24604e+00  0.00000e+00 0.00000e+00 2.15603e+02 70.526  1.49021e+02 70.526  0.8804 
1 1 1 16  15  0  o 10 9.84118e+00 1.50382e+00 9.09683e+01 7.030   8.34769e+00  1.02943e+00  0.00000e+00 0.00000e+00 2.62889e+02 7.030   1.71921e+02 7.030   0.9385 
1 1 1 16  15  1  o 7  5.77505e+00 1.54611e+00 3.75720e+01 289.363 6.62735e-01  -1.88587e+00 0.00000e+00 0.00000e+00 1.16870e+02 289.363 7.92980e+01 289.363 0.6976 
1 1 1 16  15  2  o 10 4.48574e+00 1.39000e+00 9.68457e+01 37.749  3.40318e+00  2.63495e+00  0.00000e+00 0.00000e+00 5.35809e+01 37.749  4.32649e+01 217.749 0.8743 
1 1 1 16  15  3  o 19 4.49865e+00 1.40825e+00 8.93417e+01 193.158 -4.02834e+00 -9.41693e-01 0.00000e+00 0.00000e+00 6.06107e+01 193.158 2.87310e+01 13.158  0.8686 
1 1 1 16  15  4  o 14 8.07960e+00 1.66302e+00 9.34204e+01 278.443 1.04101e+00  -7.01317e+00 0.00000e+00 0.00000e+00 1.93982e+02 278.443 1.00562e+02 278.443 0.9265 
1 1 1 16  15  5  o 1  5.81028e+00 1.67959e+00 4.54430e+01 30.764  2.11207e+00  1.25727e+00  0.00000e+00 0.00000e+00 1.24230e+02 30.764  7.87869e+01 30.764  0.7603 
1 1 1 16  15  6  o 5  6.62837e+00 1.63782e+00 1.23323e+02 3.788   8.31414e+00  5.50529e-01  0.00000e+00 0.00000e+00 1.15520e+02 3.788   7.80323e+00 183.788 0.9379 
1 1 1 16  15  7  o 15 3.59781e+00 1.25014e+00 5.80913e+01 67.107  1.11035e+00  2.62944e+00  0.00000e+00 0.00000e+00 5.23210e+01 67.107  5.77029e+00 247.107 0.7986 
1 1 1 16  15  8  o 19 4.80375e+00 1.57650e+00 8.06078e+01 64.229  1.92172e+00  3.98038e+00  0.00000e+00 0.00000e+00 8.14869e+01 64.229  8.79109e-01 64.229  0.8779 
1 1 1 16  16  0  o 1  8.17307e+00 1.70053e+00 1.41795e+02 204.895 -8.86566e+00 -4.11445e+00 0.00000e+00 0.00000e+00 1.54842e+02 204.895 1.30470e+01 204.895 0.9474 
1 1 1 16  16  1  o 1  7.04988e+00 1.63933e+00 1.86514e+02 287.067 3.37686e+00  -1.09992e+01 0.00000e+00 0.00000e+00 7.17108e+01 287.067 1.14804e+02 107.067 0.9555 
1 1 1 16  16  2  o 15 1.33435e+01 1.29866e+00 1.68650e+02 97.603  -3.09220e+00 2.31663e+01  0.00000e+00 0.00000e+00 3.32073e+02 97.603  1.63424e+02 97.603  0.9784 
1 1 1 16  16  3  f 0  4.45993e+00 1.41885e+00 6.89164e+01 350.592 3.10141e+00  -5.13900e-01 0.00000e+00 0.00000e+00 7.14354e+01 350.592 2.51906e+00 350.592 0.8201 
1 1 1 16  16  4  o 13 1.41097e+01 1.36937e+00 2.31776e+02 261.471 -5.45408e+00 -3.63688e+01 0.00000e+00 0.00000e+00 3.02489e+02 261.471 7.07131e+01 261.471 0.9863 
1 1 1 16  16  5  o 14 5.52117e+00 1.64379e+00 9.45250e+01 301.620 2.67070e+00  -4.33770e+00 0.00000e+00 0.00000e+00 9.53604e+01 301.620 8.35402e-01 301.620 0.8955 
1 1 1 16  16  6  o 11 4.86017e+00 1.52775e+00 7.68100e+01 252.005 -1.21204e+00 -3.73131e+00 0.00000e+00 0.00000e+00 8.38565e+01 252.005 7.04645e+00 252.005 0.8605 
1 1 1 16  16  7  o 15 4.20333e+00 1.38170e+00 4.37477e+01 91.272  -5.10970e-02 2.30029e+00  0.00000e+00 0.00000e+00 7.60159e+01 91.272  3.22682e+01 91.272  0.7415 
1 1 1 16  16  8  o 12 8.26694e+00 2.07021e+00 7.93017e+01 326.197 4.45647e+00  -2.98370e+00 0.00000e+00 0.00000e+00 2.07025e+02 326.197 1.27724e+02 326.197 0.9012 
1 1 1 16  17  0  o 9  5.57453e+00 1.54182e+00 4.04079e+01 254.778 -5.46333e-01 -2.00774e+00 0.00000e+00 0.00000e+00 1.11343e+02 254.778 7.09348e+01 254.778 0.7106 
1 1 1 16  17  1  o 6  7.06184e+00 1.61546e+00 6.85435e+01 54.877  2.52840e+00  3.59455e+00  0.00000e+00 0.00000e+00 1.68899e+02 54.877  1.00355e+02 54.877  0.8772 
1 1 1 16  17  2  o 9  8.56850e+00 1.57923e+00 1.59578e+02 344.375 1.20603e+01  -3.37284e+00 0.00000e+00 0.00000e+00 1.55647e+02 344.375 3.93182e+00 164.376 0.9592 
1 1 1 16  17  3  o 7  6.93864e+00 1.68163e+00 1.16875e+02 213.367 -5.91226e+00 -3.89348e+00 0.00000e+00 0.00000e+00 1.29782e+02 213.367 1.29067e+01 213.367 0.9264 
1 1 1 16  17  4  o 16 9.04936e+00 1.70589e+00 1.69385e+02 59.940  7.05440e+00  1.21892e+01  0.00000e+00 0.00000e+00 1.65440e+02 59.940  3.94483e+00 239.940 0.9638 
1 1 1 16  17  5  o 16 6.80178e+00 1.93704e+00 1.68336e+02 111.822 -3.46983e+00 8.66573e+00  0.00000e+00 0.00000e+00 7.84586e+01 111.822 8.98773e+01 291.822 0.9448 
1 1 1 16  17  6  o 19 1.29936e+01 1.66389e+00 2.40684e+02 353.231 2.99915e+01  -3.55980e+00 0.00000e+00 0.00000e+00 2.50130e+02 353.231 9.44527e+00 353.231 0.9833 
1 1 1 16  17  7  o 15 6.00854e+00 1.68509e+00 1.16059e+02 222.154 -5.42572e+00 -4.91189e+00 0.00000e+00 0.00000e+00 9.84073e+01 222.154 1.76521e+01 42.154  0.9289 
1 1 1 16  17  8  o 19 7.26659e+00 1.97303e+00 1.03952e+02 71.332  2.10747e+00  6.23780e+00  0.00000e+00 0.00000e+00 1.53134e+02 71.332  4.91817e+01 71.332  0.9206 
1 1 1 16  18  0  o 1  7.05999e+00 1.62026e+00 1.57786e+02 92.064  -3.54911e-01 9.84706e+00  0.00000e+00 0.00000e+00 9.85463e+01 92.064  5.92398e+01 272.064 0.9478 
1 1 1 16  18  1  o 8  1.20318e+01 1.43278e+00 1.61535e+02 67.829  7.37010e+00  1.80862e+01  0.00000e+00 0.00000e+00 2.87684e+02 67.829  1.26148e+02 67.829  0.9741 
1 1 1 16  18  2  o 6  1.02785e+01 1.57456e+00 1.46286e+02 299.021 6.69409e+00  -1.20661e+01 0.00000e+00 0.00000e+00 2.33346e+02 299.021 8.70601e+01 299.021 0.9631 
1 1 1 16  18  3  f 0  5.86293e+00 1.47766e+00 1.19531e+02 140.447 -5.28494e+00 4.36481e+00  0.00000e+00 0.00000e+00 8.83056e+01 140.447 3.12258e+01 320.447 0.9239 
1 1 1 16  18  4  o 3  6.58646e+00 1.68623e+00 6.96235e+01 285.425 1.13345e+00  -4.10785e+00 0.00000e+00 0.00000e+00 1.51069e+02 285.425 8.14452e+01 285.425 0.8729 
1 1 1 16  18  5  o 8  5.27956e+00 1.66754e+00 1.32999e+02 214.347 -5.34708e+00 -3.65392e+00 0.00000e+00 0.00000e+00 5.33567e+01 214.347 7.96423e+01 34.347  0.9192 
1 1 1 16  18  6  o 4  1.40544e+01 1.55685e+00 2.45225e+02 285.210 9.81183e+00  -3.60879e+01 0.00000e+00 0.00000e+00 2.87381e+02 285.210 4.21557e+01 285.210 0.9865 
1 1 1 16  18  7  o 4  8.83750e+00 1.96399e+00 2.37974e+02 155.385 -1.66450e+01 7.62601e+00  0.00000e+00 0.00000e+00 9.21792e+01 155.385 1.45795e+02 335.385 0.9723 
1 1 1 16  18  8  o 12 1.23013e+01 2.00619e+00 2.22460e+02 317.482 1.65121e+01  -1.51401e+01 0.00000e+00 0.00000e+00 2.39601e+02 317.482 1.71414e+01 317.482 0.9774 
1 1 1 16  19  0  o 7  8.33852e+00 1.55960e+00 1.10579e+02 201.244 -8.05332e+00 -3.13085e+00 0.00000e+00 0.00000e+00 1.89733e+02 201.244 7.91536e+01 201.244 0.9402 
1 1 1 16  19  1  o 9  2.13675e+01 1.10632e+00 3.54728e+02 283.118 1.96993e+01  -8.45323e+01 0.00000e+00 0.00000e+00 4.59527e+02 283.118 1.04798e+02 283.118 0.9942 
1 1 1 16  19  2  o 8  4.78716e+00 1.44380e+00 7.69320e+01 69.751  1.30821e+00  3.54631e+00  0.00000e+00 0.00000e+00 7.99412e+01 69.751  3.00919e+00 69.751  0.8545 
1 1 1 16  19  3  o 10 4.33473e+00 1.33934e+00 5.13266e+01 115.559 -1.01232e+00 2.11679e+00  0.00000e+00 0.00000e+00 7.29467e+01 115.559 2.16201e+01 115.559 0.7472 
1 1 1 16  19  4  o 17 8.66160e+00 1.76446e+00 1.10976e+02 24.510  7.72223e+00  3.52085e+00  0.00000e+00 0.00000e+00 2.01252e+02 24.510  9.02756e+01 24.510  0.9391 
1 1 1 16  19  5  o 5  1.11889e+01 1.98607e+00 1.41917e+02 326.243 1.00912e+01  -6.74451e+00 0.00000e+00 0.00000e+00 2.69629e+02 326.243 1.27712e+02 326.243 0.9579 
1 1 1 16  19  6  o 3  5.98413e+00 1.62253e+00 5.51147e+01 298.554 1.63854e+00  -3.01103e+00 0.00000e+00 0.00000e+00 1.37334e+02 298.554 8.22194e+01 298.554 0.8373 
1 1 1 16  19  7  f 0  5.13794e+00 1.61862e+00 6.05228e+01 215.550 -2.68018e+00 -1.91528e+00 0.00000e+00 0.00000e+00 1.03240e+02 215.550 4.27173e+01 215.550 0.8296 
1 1 1 16  19  8  o 9  8.41772e+00 2.08264e+00 1.38244e+02 6.700   9.01397e+00  1.05893e+00  0.00000e+00 0.00000e+00 1.66854e+02 6.700   2.86104e+01 6.700   0.9432 
1 1 1 16  20  0  o 8  6.69092e+00 1.50711e+00 1.08213e+02 226.796 -4.78078e+00 -5.09026e+00 0.00000e+00 0.00000e+00 1.28936e+02 226.796 2.07238e+01 226.796 0.9253 
1 1 1 16  20  1  o 16 1.67381e+01 1.22226e+00 3.14040e+02 320.118 4.35698e+01  -3.64072e+01 0.00000e+00 0.00000e+00 3.21796e+02 320.118 7.75543e+00 320.118 0.9912 
1 1 1 16  20  2  o 5  1.31426e+01 1.31903e+00 2.47153e+02 113.402 -1.41970e+01 3.28042e+01  0.00000e+00 0.00000e+00 2.49734e+02 113.402 2.58042e+00 113.402 0.9859 
1 1 1 16  20  3  o 3  3.67801e+00 1.22211e+00 7.11673e+00 357.116 3.25041e-01  -1.63749e-02 0.00000e+00 0.00000e+00 1.55473e+01 357.116 8.43055e+00 357.116 0.1606 
1 1 1 16  20  4  o 1  4.30005e+00 1.38185e+00 8.11688e+01 293.098 1.51790e+00  -3.55907e+00 0.00000e+00 0.00000e+00 6.04927e+01 293.098 2.06760e+01 113.098 0.8583 
1 1 1 16  20  5  o 18 1.04601e+01 1.99095e+00 2.27800e+02 168.384 -1.77818e+01 3.65508e+00  0.00000e+00 0.00000e+00 1.62614e+02 168.384 6.51866e+01 348.384 0.9721 
1 1 1 16  20  6  o 3  6.94185e+00 1.65970e+00 1.31432e+02 116.323 -4.10312e+00 8.29378e+00  0.00000e+00 0.00000e+00 1.20350e+02 116.323 1.10814e+01 296.323 0.9443 
1 1 1 16  20  7  o 3  4.17487e+00 1.37987e+00 7.11065e+01 209.710 -3.19522e+00 -1.82328e+00 0.00000e+00 0.00000e+00 6.52156e+01 209.710 5.89086e+00 29.710  0.8499 
1 1 1 16  20  8  o 16 5.55916e+00 1.71663e+00 4.67678e+01 262.700 -3.36302e-01 -2.62533e+00 0.00000e+00 0.00000e+00 1.19865e+02 262.700 7.30976e+01 262.700 0.7801 
1 1 1 16  21  0  o 1  7.37442e+00 1.56843e+00 1.62932e+02 289.200 3.68099e+00  -1.05703e+01 0.00000e+00 0.00000e+00 1.06585e+02 289.200 5.63475e+01 109.200 0.9542 
1 1 1 16  21  1  o 10 2.69696e+01 1.07897e+00 4.12227e+02 238.797 -6.88215e+01 -1.13624e+02 0.00000e+00 0.00000e+00 6.17468e+02 238.797 2.05240e+02 238.797 0.9962 
1 1 1 16  21  2  o 8  1.69080e+01 1.16495e+00 2.86333e+02 56.020  3.17777e+01  4.71475e+01  0.00000e+00 0.00000e+00 3.56286e+02 56.020  6.99532e+01 56.020  0.9912 
1 1 1 16  21  3  o 5  8.28761e+00 1.62052e+00 1.92450e+02 46.189  1.08052e+01  1.12632e+01  0.00000e+00 0.00000e+00 1.15139e+02 46.189  7.73106e+01 226.189 0.9674 
1 1 1 16  21  4  o 18 7.49503e+00 1.81368e+00 1.85569e+02 242.258 -5.56620e+00 -1.05833e+01 0.00000e+00 0.00000e+00 8.97929e+01 242.258 9.57763e+01 62.258  0.9572 
1 1 1 16  21  5  o 19 6.33055e+00 1.75973e+00 1.62658e+02 317.616 7.09614e+00  -6.47602e+00 0.00000e+00 0.00000e+00 6.73833e+01 317.616 9.52746e+01 137.616 0.9464 
1 1 1 16  21  6  o 15 5.73843e+00 1.67821e+00 1.12748e+02 273.664 4.13524e-01  -6.45816e+00 0.00000e+00 0.00000e+00 8.98203e+01 273.664 2.29280e+01 93.664  0.9191 
1 1 1 16  21  7  o 6  7.17391e+00 1.95302e+00 1.24383e+02 311.265 5.06763e+00  -5.77538e+00 0.00000e+00 0.00000e+00 1.32598e+02 311.265 8.21489e+00 311.265 0.9325 
1 1 1 16  21  8  o 5  7.05885e+00 1.92709e+00 9.86270e+01 189.949 -6.06731e+00 -1.06432e+00 0.00000e+00 0.00000e+00 1.49485e+02 189.949 5.08577e+01 189.949 0.9148 
1 1 1 16  22  0  o 14 4.32359e+00 1.34825e+00 6.79164e+01 275.512 2.85573e-01  -2.95925e+00 0.00000e+00 0.00000e+00 6.58729e+01 275.512 2.04348e+00 95.512  0.8080 
1 1 1 16  22  1  o 14 4.56318e+00 1.37819e+00 1.44243e+02 240.266 -3.33595e+00 -5.84059e+00 0.00000e+00 0.00000e+00 1.70476e+01 240.266 1.27195e+02 60.266  0.9223 
1 1 1 16  22  2  o 4  7.28024e+00 1.66623e+00 1.38849e+02 1.778   8.98764e+00  2.78919e-01  0.00000e+00 0.00000e+00 1.24286e+02 1.778   1.45626e+01 181.777 0.9426 
1 1 1 16  22  3  o 13 6.60785e+00 1.65250e+00 1.99971e+02 247.601 -4.76135e+00 -1.15525e+01 0.00000e+00 0.00000e+00 4.31546e+01 247.601 1.56817e+02 67.601  0.9591 
1 1 1 16  22  4  o 17 7.13266e+00 1.79731e+00 1.25915e+02 182.044 -7.78830e+00 -2.77995e-01 0.00000e+00 0.00000e+00 1.29608e+02 182.044 3.69204e+00 182.044 0.9334 
1 1 1 16  22  5  o 10 6.57323e+00 1.75009e+00 1.04722e+02 138.416 -4.83063e+00 4.28644e+00  0.00000e+00 0.00000e+00 1.27186e+02 138.416 2.24641e+01 138.416 0.9189 
1 1 1 16  22  6  o 18 7.28059e+00 1.88710e+00 1.87355e+02 141.504 -9.33673e+00 7.42563e+00  0.00000e+00 0.00000e+00 8.02657e+01 141.504 1.07089e+02 321.504 0.9571 
1 1 1 16  22  7  o 11 8.95693e+00 2.02806e+00 1.56050e+02 57.162  6.21641e+00  9.63194e+00  0.00000e+00 0.00000e+00 1.72656e+02 57.162  1.66060e+01 57.162  0.9553 
1 1 1 16  22  8  o 8  7.21264e+00 1.94804e+00 1.03067e+02 211.264 -5.59677e+00 -3.39804e+00 0.00000e+00 0.00000e+00 1.51913e+02 211.264 4.88459e+01 211.264 0.9201 
1 1 1 16  23  0  o 8  3.78405e+00 1.24350e+00 5.13361e+01 57.790  1.10553e+00  1.75486e+00  0.00000e+00 0.00000e+00 5.14908e+01 57.790  1.54662e-01 57.790  0.7096 
1 1 1 16  23  1  f 0  1.28053e+01 1.29246e+00 1.91640e+02 148.133 -2.32822e+01 1.44735e+01  0.00000e+00 0.00000e+00 2.90020e+02 148.133 9.83806e+01 148.133 0.9816 
1 1 1 16  23  2  o 3  1.62864e+01 1.20452e+00 2.57416e+02 294.117 1.94265e+01  -4.33945e+01 0.00000e+00 0.00000e+00 3.60417e+02 294.117 1.03001e+02 294.117 0.9894 
1 1 1 16  23  3  o 4  5.70670e+00 1.44772e+00 7.08124e+01 177.384 -4.31157e+00 1.97006e-01  0.00000e+00 0.00000e+00 1.20658e+02 177.384 4.98457e+01 177.384 0.8747 
1 1 1 16  23  4  o 18 6.22083e+00 1.64620e+00 1.20814e+02 242.992 -3.24466e+00 -6.36574e+00 0.00000e+00 0.00000e+00 1.00519e+02 242.992 2.02942e+01 62.992  0.9271 
1 1 1 16  23  5  o 6  9.04228e+00 1.70816e+00 1.46722e+02 128.732 -7.64214e+00 9.52812e+00  0.00000e+00 0.00000e+00 1.85887e+02 128.732 3.91646e+01 128.732 0.9581 
1 1 1 16  23  6  o 13 6.05058e+00 1.72004e+00 1.12508e+02 284.117 1.63625e+00  -6.50623e+00 0.00000e+00 0.00000e+00 1.01755e+02 284.117 1.07530e+01 104.117 0.9221 
1 1 1 16  23  7  f 0  5.59314e+00 1.77041e+00 8.76384e+01 168.071 -4.46888e+00 9.44097e-01  0.00000e+00 0.00000e+00 1.01914e+02 168.071 1.42756e+01 168.071 0.8823 
1 1 1 16  23  8  o 8  7.30055e+00 1.99889e+00 1.14697e+02 319.976 5.45939e+00  -4.58485e+00 0.00000e+00 0.00000e+00 1.45294e+02 319.976 3.05967e+01 319.976 0.9269 
1 1 1 16  24  0  o 10 8.16348e+00 1.58011e+00 8.51377e+01 39.703  4.89248e+00  4.06221e+00  0.00000e+00 0.00000e+00 2.01713e+02 39.703  1.16575e+02 39.703  0.9176 
1 1 1 16  24  1  o 17 5.18580e+00 1.47109e+00 3.90823e+01 264.321 -2.02525e-01 -2.03645e+00 0.00000e+00 0.00000e+00 1.01058e+02 264.321 6.19753e+01 264.321 0.7053 
1 1 1 16  24  2  o 2  6.54141e+00 1.59206e+00 1.07123e+02 334.003 5.77709e+00  -2.81733e+00 0.00000e+00 0.00000e+00 1.23233e+02 334.003 1.61098e+01 334.003 0.9185 
1 1 1 16  24  3  o 9  5.45679e+00 1.53819e+00 1.66035e+02 229.786 -5.94500e+00 -7.03159e+00 0.00000e+00 0.00000e+00 3.15578e+01 229.786 1.34477e+02 49.786  0.9440 
1 1 1 16  24  4  o 8  7.10640e+00 1.73619e+00 1.57644e+02 83.918  1.06824e+00  1.00250e+01  0.00000e+00 0.00000e+00 1.01156e+02 83.918  5.64884e+01 263.918 0.9490 
1 1 1 16  24  5  o 14 1.07773e+01 1.82858e+00 1.89693e+02 186.155 -1.83609e+01 -1.97993e+00 0.00000e+00 0.00000e+00 2.12664e+02 186.155 2.29708e+01 186.155 0.9725 
1 1 1 16  24  6  o 12 8.69693e+00 1.81511e+00 2.45774e+02 51.380  1.19987e+01  1.50199e+01  0.00000e+00 0.00000e+00 7.93821e+01 51.380  1.66392e+02 231.380 0.9736 
1 1 1 16  24  7  o 11 5.56233e+00 1.76220e+00 7.91342e+01 6.565   4.09280e+00  4.71013e-01  0.00000e+00 0.00000e+00 1.06305e+02 6.565   2.71712e+01 6.565   0.8680 
1 1 1 16  24  8  o 4  7.36968e+00 2.00654e+00 1.34067e+02 64.350  3.64962e+00  7.60031e+00  0.00000e+00 0.00000e+00 1.31689e+02 64.350  2.37789e+00 244.350 0.9387 
1 1 1 16  25  0  o 11 4.69239e+00 1.39462e+00 7.18046e+01 20.550  3.32862e+00  1.24783e+00  0.00000e+00 0.00000e+00 7.98278e+01 20.550  8.02319e+00 20.550  0.8439 
1 1 1 16  25  1  o 10 1.14415e+01 1.37931e+00 2.88592e+02 23.861  3.15709e+01  1.39647e+01  0.00000e+00 0.00000e+00 1.43390e+02 23.861  1.45202e+02 203.861 0.9854 
1 1 1 16  25  2  o 5  1.08287e+01 1.49184e+00 1.42563e+02 277.065 2.00983e+00  -1.62166e+01 0.00000e+00 0.00000e+00 2.59654e+02 277.065 1.17091e+02 277.065 0.9689 
1 1 1 16  25  3  o 17 1.03279e+01 1.66111e+00 1.56985e+02 150.772 -1.33469e+01 7.46780e+00  0.00000e+00 0.00000e+00 2.25963e+02 150.772 6.89772e+01 150.772 0.9667 
1 1 1 16  25  4  f 0  7.88456e+00 1.81885e+00 1.24049e+02 107.876 -2.63123e+00 8.15832e+00  0.00000e+00 0.00000e+00 1.60255e+02 107.876 3.62065e+01 107.876 0.9397 
1 1 1 16  25  5  o 7  9.41758e+00 1.84502e+00 2.06427e+02 323.397 1.39438e+01  -1.03568e+01 0.00000e+00 0.00000e+00 1.44506e+02 323.397 6.19214e+01 143.397 0.9708 
1 1 1 16  25  6  o 16 4.87062e+00 1.54326e+00 1.44891e+02 113.794 -3.03741e+00 6.88867e+00  0.00000e+00 0.00000e+00 2.92236e+01 113.794 1.15667e+02 293.794 0.9310 
1 1 1 16  25  7  o 5  8.22508e+00 2.07384e+00 5.29412e+01 107.512 -1.05188e+00 3.33369e+00  0.00000e+00 0.00000e+00 2.12692e+02 107.512 1.59751e+02 107.512 0.8409 
1 1 1 16  25  8  o 9  4.23068e+00 1.43172e+00 7.72310e+01 220.039 -3.15456e+00 -2.65067e+00 0.00000e+00 0.00000e+00 6.38332e+01 220.039 1.33978e+01 40.039  0.8680 
1 1 1 16  25  9  o 11 5.06806e+00 1.66040e+00 8.88718e+01 168.448 -4.98876e+00 1.01965e+00  0.00000e+00 0.00000e+00 8.54843e+01 168.448 3.38747e+00 348.448 0.8955 
1 1 1 16  26  0  o 4  6.75816e+00 1.51808e+00 1.02724e+02 86.723  3.90039e-01  6.81289e+00  0.00000e+00 0.00000e+00 1.36243e+02 86.723  3.35188e+01 86.723  0.9235 
1 1 1 16  26  1  o 18 5.78040e+00 1.53722e+00 9.82558e+01 298.287 2.57453e+00  -4.78409e+00 0.00000e+00 0.00000e+00 1.01619e+02 298.287 3.36332e+00 298.287 0.9025 
1 1 1 16  26  2  o 5  7.78234e+00 1.80426e+00 1.08207e+02 339.736 6.91426e+00  -2.55268e+00 0.00000e+00 0.00000e+00 1.69068e+02 339.736 6.08612e+01 339.736 0.9295 
1 1 1 16  26  3  o 6  1.51911e+01 1.26744e+00 2.54648e+02 196.858 -4.38715e+01 -1.32944e+01 0.00000e+00 0.00000e+00 3.21572e+02 196.858 6.69246e+01 196.858 0.9890 
1 1 1 16  26  4  o 13 9.60748e+00 1.67674e+00 1.63184e+02 7.106   1.42719e+01  1.77929e+00  0.00000e+00 0.00000e+00 1.92386e+02 7.106   2.92024e+01 7.106   0.9646 
1 1 1 16  26  5  o 17 4.87653e+00 1.52000e+00 7.04472e+01 172.052 -3.59256e+00 5.01602e-01  0.00000e+00 0.00000e+00 8.81817e+01 172.052 1.77345e+01 172.052 0.8475 
1 1 1 16  26  6  o 11 5.82832e+00 1.63308e+00 5.35690e+01 155.918 -3.01995e+00 1.34975e+00  0.00000e+00 0.00000e+00 1.32255e+02 155.918 7.86859e+01 155.918 0.8304 
1 1 1 16  26  7  o 4  4.03708e+00 1.39539e+00 9.46207e+01 98.882  -7.42426e-01 4.75104e+00  0.00000e+00 0.00000e+00 4.31713e+01 98.882  5.14494e+01 278.882 0.8887 
1 1 1 16  26  8  o 8  5.17019e+00 1.65283e+00 6.74379e+01 220.406 -2.89887e+00 -2.46765e+00 0.00000e+00 0.00000e+00 1.02492e+02 220.406 3.50539e+01 220.406 0.8557 
1 1 1 16  26  9  o 19 4.67785e+00 1.54622e+00 8.54970e+01 327.819 4.13820e+00  -2.60399e+00 0.00000e+00 0.00000e+00 7.45753e+01 327.819 1.09217e+01 147.820 0.8908 
1 1 1 16  27  0  o 6  1.24053e+01 1.31548e+00 1.85161e+02 112.400 -9.47554e+00 2.29894e+01  0.00000e+00 0.00000e+00 2.80135e+02 112.400 9.49739e+01 112.400 0.9797 
1 1 1 16  27  1  o 7  5.17935e+00 1.46917e+00 7.13897e+01 104.669 -9.19721e-01 3.51348e+00  0.00000e+00 0.00000e+00 9.68091e+01 104.669 2.54193e+01 104.669 0.8477 
1 1 1 16  27  2  o 10 6.75330e+00 1.68847e+00 1.24820e+02 23.112  7.17376e+00  3.06167e+00  0.00000e+00 0.00000e+00 1.16823e+02 23.112  7.99740e+00 203.112 0.9335 
1 1 1 16  27  3  o 12 4.86592e+00 1.47646e+00 9.32227e+01 58.454  2.49750e+00  4.06826e+00  0.00000e+00 0.00000e+00 7.24551e+01 58.454  2.07676e+01 238.454 0.8879 
1 1 1 16  27  4  o 16 8.58060e+00 1.77157e+00 1.72221e+02 63.761  5.66330e+00  1.14896e+01  0.00000e+00 0.00000e+00 1.43857e+02 63.761  2.83640e+01 243.761 0.9601 
1 1 1 16  27  5  o 7  7.88675e+00 1.83069e+00 1.54305e+02 242.364 -4.91877e+00 -9.39446e+00 0.00000e+00 0.00000e+00 1.33742e+02 242.364 2.05626e+01 62.364  0.9516 
1 1 1 16  27  6  o 3  9.25762e+00 1.89871e+00 5.27768e+01 98.051  -6.08428e-01 4.30140e+00  0.00000e+00 0.00000e+00 2.58414e+02 98.051  2.05637e+02 98.051  0.8756 
1 1 1 16  27  7  o 6  1.14322e+01 1.96698e+00 2.27875e+02 316.027 1.60036e+01  -1.54398e+01 0.00000e+00 0.00000e+00 2.01148e+02 316.027 2.67265e+01 136.027 0.9773 
1 1 1 16  27  8  o 14 6.04231e+00 1.70519e+00 1.75278e+02 146.362 -9.27789e+00 6.17317e+00  0.00000e+00 0.00000e+00 4.61266e+01 146.362 1.29152e+02 326.362 0.9540 
1 1 1 16  27  9  o 13 7.08410e+00 2.01231e+00 8.40023e+01 5.347   5.38147e+00  5.03667e-01  0.00000e+00 0.00000e+00 1.61453e+02 5.347   7.74505e+01 5.347   0.9020 
1 1 1 16  28  0  o 16 1.03814e+01 1.41109e+00 1.36247e+02 84.978  1.25637e+00  1.42970e+01  0.00000e+00 0.00000e+00 2.47076e+02 84.978  1.10829e+02 84.978  0.9645 
1 1 1 16  28  1  o 16 5.83748e+00 1.42195e+00 1.18875e+02 339.210 7.16256e+00  -2.71930e+00 0.00000e+00 0.00000e+00 8.95869e+01 339.210 2.92885e+01 159.210 0.9322 
1 1 1 16  28  2  f 0  6.68154e+00 1.69752e+00 2.39256e+02 8.953   1.45878e+01  2.29814e+00  0.00000e+00 0.00000e+00 8.00186e+00 8.953   2.31255e+02 188.953 0.9655 
1 1 1 16  28  3  o 16 4.51200e+00 1.42463e+00 4.83535e+01 106.447 -6.69788e-01 2.26885e+00  0.00000e+00 0.00000e+00 8.13341e+01 106.447 3.29806e+01 106.447 0.7496 
1 1 1 16  28  4  o 1  1.00123e+01 1.73147e+00 1.90785e+02 215.407 -1.47904e+01 -1.05139e+01 0.00000e+00 0.00000e+00 1.82579e+02 215.407 8.20566e+00 35.407  0.9720 
1 1 1 16  28  5  o 9  8.36283e+00 1.82574e+00 1.96268e+02 349.877 1.47350e+01  -2.63073e+00 0.00000e+00 0.00000e+00 1.13760e+02 349.877 8.25086e+01 169.877 0.9660 
1 1 1 16  28  6  o 16 4.18286e+00 1.38963e+00 7.55270e+01 295.402 1.74093e+00  -3.66600e+00 0.00000e+00 0.00000e+00 6.34880e+01 295.402 1.20390e+01 115.402 0.8657 
1 1 1 16  28  7  o 1  1.39960e+01 1.76080e+00 2.32837e+02 99.186  -5.23283e+00 3.23568e+01  0.00000e+00 0.00000e+00 2.96324e+02 99.186  6.34869e+01 99.186  0.9846 
1 1 1 16  28  8  o 1  5.14949e+00 1.65431e+00 3.51444e+01 131.945 -1.33088e+00 1.48095e+00  0.00000e+00 0.00000e+00 1.02564e+02 131.945 6.74192e+01 131.945 0.6963 
1 1 1 16  28  9  o 14 6.60307e+00 1.96832e+00 1.36557e+02 178.740 -8.44175e+00 1.85742e-01  0.00000e+00 0.00000e+00 1.01541e+02 178.740 3.50164e+01 358.740 0.9388 
1 1 1 16  29  0  o 19 4.39751e+00 1.34703e+00 8.20704e+01 200.386 -3.55159e+00 -1.31986e+00 0.00000e+00 0.00000e+00 6.18373e+01 200.386 2.02331e+01 20.386  0.8549 
1 1 1 16  29  1  o 14 1.13517e+01 1.35461e+00 1.81255e+02 73.776  6.60452e+00  2.26968e+01  0.00000e+00 0.00000e+00 2.44254e+02 73.776  6.29990e+01 73.776  0.9786 
1 1 1 16  29  2  o 5  5.77277e+00 1.61176e+00 1.10121e+02 271.251 1.34891e-01  -6.17662e+00 0.00000e+00 0.00000e+00 9.23209e+01 271.251 1.78005e+01 91.251  0.9150 
1 1 1 16  29  3  o 18 8.58615e+00 1.67733e+00 1.16685e+02 228.372 -6.20775e+00 -6.98509e+00 0.00000e+00 0.00000e+00 1.94389e+02 228.372 7.77043e+01 228.372 0.9449 
1 1 1 16  29  4  o 17 8.30304e+00 1.68013e+00 1.37839e+02 296.596 4.80112e+00  -9.58946e+00 0.00000e+00 0.00000e+00 1.65430e+02 296.596 2.75908e+01 296.596 0.9522 
1 1 1 16  29  5  o 12 5.05206e+00 1.44465e+00 8.82185e+01 133.242 -3.55246e+00 3.77746e+00  0.00000e+00 0.00000e+00 8.57807e+01 133.242 2.43777e+00 313.242 0.8975 
1 1 1 16  29  6  o 18 4.91144e+00 1.45886e+00 7.95449e+01 296.359 2.04185e+00  -4.12071e+00 0.00000e+00 0.00000e+00 8.69585e+01 296.359 7.41368e+00 296.359 0.8832 
1 1 1 16  29  7  o 8  4.89684e+00 1.58678e+00 5.88722e+01 232.378 -1.99294e+00 -2.58583e+00 0.00000e+00 0.00000e+00 9.67675e+01 232.378 3.78953e+01 232.378 0.8278 
1 1 1 16  29  8  o 4  5.33452e+00 1.70164e+00 2.94691e+01 285.539 4.59748e-01  -1.65337e+00 0.00000e+00 0.00000e+00 1.02706e+02 285.539 7.32364e+01 285.539 0.6452 
1 1 1 16  29  9  o 10 1.03661e+01 2.29104e+00 2.08730e+02 54.676  9.36301e+00  1.32121e+01  0.00000e+00 0.00000e+00 1.76908e+02 54.676  3.18220e+01 234.676 0.9686 
1 1 1 16  30  0  o 1  4.98528e+00 1.36623e+00 4.42167e+01 39.758  1.93394e+00  1.60888e+00  0.00000e+00 0.00000e+00 1.02083e+02 39.758  5.78667e+01 39.758  0.7667 
1 1 1 16  30  1  o 8  4.67389e+00 1.36212e+00 1.27290e+02 316.745 4.86780e+00  -4.57994e+00 0.00000e+00 0.00000e+00 3.77258e+01 316.745 8.95644e+01 136.745 0.9218 
1 1 1 16  30  2  o 18 8.42159e+00 1.68967e+00 1.26396e+02 7.817   9.73551e+00  1.33657e+00  0.00000e+00 0.00000e+00 1.79441e+02 7.817   5.30446e+01 7.817   0.9477 
1 1 1 16  30  3  o 5  1.07765e+01 1.54492e+00 1.79749e+02 234.869 -1.15631e+01 -1.64334e+01 0.00000e+00 0.00000e+00 2.23008e+02 234.869 4.32591e+01 234.869 0.9748 
1 1 1 16  30  4  o 16 4.56246e+00 1.45430e+00 8.93078e+01 108.715 -1.40208e+00 4.13873e+00  0.00000e+00 0.00000e+00 6.40590e+01 108.715 2.52489e+01 288.715 0.8764 
1 1 1 16  30  5  o 6  1.11044e+01 1.67348e+00 1.61721e+02 98.481  -2.65573e+00 1.78109e+01  0.00000e+00 0.00000e+00 2.52359e+02 98.481  9.06377e+01 98.481  0.9718 
1 1 1 16  30  6  o 8  5.88417e+00 1.68239e+00 1.04367e+02 278.154 8.84251e-01  -6.17153e+00 0.00000e+00 0.00000e+00 1.02480e+02 278.154 1.88661e+00 98.154  0.9159 
1 1 1 16  30  7  o 15 9.34573e+00 2.01660e+00 2.00182e+02 79.672  2.72754e+00  1.49669e+01  0.00000e+00 0.00000e+00 1.46622e+02 79.672  5.35592e+01 259.672 0.9666 
1 1 1 16  30  8  o 6  4.66297e+00 1.54739e+00 5.92780e+01 103.284 -7.71145e-01 3.26631e+00  0.00000e+00 0.00000e+00 8.99147e+01 103.284 3.06366e+01 103.284 0.8332 
1 1 1 16  30  9  o 13 6.09333e+00 1.88575e+00 1.68389e+01 94.778  -8.47560e-02 1.01409e+00  0.00000e+00 0.00000e+00 8.90746e+01 94.778  7.22357e+01 94.778  0.4526 
1 1 1 16  31  0  o 13 5.74887e+00 1.52196e+00 7.95490e+01 46.421  3.22346e+00  3.38745e+00  0.00000e+00 0.00000e+00 1.15240e+02 46.421  3.56905e+01 46.421  0.8853 
1 1 1 16  31  1  o 12 6.45146e+00 1.48596e+00 1.03104e+02 197.695 -6.64474e+00 -2.11992e+00 0.00000e+00 0.00000e+00 1.25499e+02 197.695 2.23950e+01 197.695 0.9252 
1 1 1 16  31  2  o 14 4.95996e+00 1.50240e+00 8.09412e+01 259.109 -7.85903e-01 -4.08457e+00 0.00000e+00 0.00000e+00 8.42914e+01 259.109 3.35013e+00 259.109 0.8694 
1 1 1 16  31  3  o 17 1.74378e+01 1.26322e+00 3.26443e+02 79.828  1.23618e+01  6.89001e+01  0.00000e+00 0.00000e+00 3.37280e+02 79.828  1.08363e+01 79.828  0.9928 
1 1 1 16  31  4  o 7  9.08680e+00 1.71657e+00 1.74967e+02 192.906 -1.50300e+01 -3.44386e+00 0.00000e+00 0.00000e+00 1.62047e+02 192.906 1.29203e+01 12.906  0.9670 
1 1 1 16  31  5  o 17 7.52837e+00 1.76435e+00 1.18212e+02 8.265   8.43307e+00  1.22495e+00  0.00000e+00 0.00000e+00 1.53116e+02 8.265   3.49040e+01 8.265   0.9394 
1 1 1 16  31  6  o 4  5.73374e+00 1.65303e+00 7.52418e+01 241.925 -2.12841e+00 -3.99033e+00 0.00000e+00 0.00000e+00 1.18628e+02 241.925 4.33858e+01 241.925 0.8810 
1 1 1 16  31  7  o 10 4.08823e+00 1.40393e+00 6.74248e+01 290.162 1.19500e+00  -3.25460e+00 0.00000e+00 0.00000e+00 6.43080e+01 290.162 3.11674e+00 110.162 0.8394 
1 1 1 16  31  8  o 1  5.79065e+00 1.73735e+00 6.60041e+01 37.747  3.20100e+00  2.47817e+00  0.00000e+00 0.00000e+00 1.26397e+02 37.747  6.03932e+01 37.747  0.8653 
1 1 1 16  31  9  o 9  1.04549e+01 2.27351e+00 2.20222e+02 297.433 8.04408e+00  -1.54967e+01 0.00000e+00 0.00000e+00 1.69587e+02 297.433 5.06356e+01 117.433 0.9709 
1 1 1 16  32  0  o 4  7.44263e+00 1.49957e+00 6.45121e+01 226.602 -3.41562e+00 -3.61217e+00 0.00000e+00 0.00000e+00 1.89760e+02 226.602 1.25248e+02 226.602 0.8927 
1 1 1 16  32  1  o 3  4.42722e+00 1.37834e+00 1.03430e+02 263.757 -5.53424e-01 -5.05891e+00 0.00000e+00 0.00000e+00 4.83722e+01 263.757 5.50582e+01 83.757  0.8954 
1 1 1 16  32  2  o 15 7.89418e+00 1.63730e+00 5.89020e+01 249.263 -1.57436e+00 -4.15821e+00 0.00000e+00 0.00000e+00 2.06883e+02 249.263 1.47981e+02 249.263 0.8787 
1 1 1 16  32  3  o 7  1.19075e+01 1.55540e+00 1.93078e+02 131.560 -1.50149e+01 1.69357e+01  0.00000e+00 0.00000e+00 2.53179e+02 131.560 6.01012e+01 131.560 0.9777 
1 1 1 16  32  4  o 7  3.71638e+00 1.25171e+00 6.09753e+01 294.683 1.17638e+00  -2.55969e+00 0.00000e+00 0.00000e+00 5.24021e+01 294.683 8.57314e+00 114.683 0.7955 
1 1 1 16  32  5  o 1  1.66824e+01 1.33633e+00 3.09521e+02 9.932   6.18184e+01  1.08245e+01  0.00000e+00 0.00000e+00 3.25372e+02 9.932   1.58512e+01 9.932   0.9920 
1 1 1 16  32  6  o 6  6.77220e+00 1.72997e+00 1.56119e+02 75.517  2.52763e+00  9.78556e+00  0.00000e+00 0.00000e+00 9.05595e+01 75.517  6.55598e+01 255.517 0.9492 
1 1 1 16  32  7  o 18 5.62647e+00 1.71976e+00 2.05410e+02 292.782 4.59345e+00  -1.09371e+01 0.00000e+00 0.00000e+00 1.25224e+00 292.782 2.04158e+02 112.782 0.9569 
1 1 1 16  32  8  o 6  1.03962e+01 2.11732e+00 1.37649e+02 281.063 2.26125e+00  -1.15656e+01 0.00000e+00 0.00000e+00 2.44163e+02 281.063 1.06514e+02 281.063 0.9566 
1 1 1 16  33  0  o 2  9.68511e+00 1.49893e+00 2.01912e+02 237.777 -1.08440e+01 -1.72046e+01 0.00000e+00 0.00000e+00 1.59476e+02 237.777 4.24358e+01 57.777  0.9751 
1 1 1 16  33  1  o 11 9.15635e+00 1.56122e+00 1.81422e+02 178.944 -1.65498e+01 3.04954e-01  0.00000e+00 0.00000e+00 1.58416e+02 178.944 2.30053e+01 358.944 0.9693 
1 1 1 16  33  2  o 5  6.17761e+00 1.60611e+00 1.20467e+02 73.447  2.06311e+00  6.94142e+00  0.00000e+00 0.00000e+00 9.91982e+01 73.447  2.12684e+01 253.447 0.9281 
1 1 1 16  33  3  o 12 1.29193e+01 1.42750e+00 1.66046e+02 346.266 2.39884e+01  -5.86270e+00 0.00000e+00 0.00000e+00 3.19022e+02 346.266 1.52977e+02 346.266 0.9795 
1 1 1 16  33  4  o 14 4.90604e+00 1.48799e+00 7.46251e+01 223.156 -2.87335e+00 -2.69412e+00 0.00000e+00 0.00000e+00 8.73802e+01 223.156 1.27551e+01 223.156 0.8611 
1 1 1 16  33  5  o 3  5.43406e+00 1.62825e+00 1.10210e+02 354.762 6.33997e+00  -5.81209e-01 0.00000e+00 0.00000e+00 8.10903e+01 354.762 2.91202e+01 174.762 0.9177 
1 1 1 16  33  6  o 19 4.76687e+00 1.61845e+00 1.19933e+02 212.766 -5.21158e+00 -3.35428e+00 0.00000e+00 0.00000e+00 4.74976e+01 212.766 7.24349e+01 32.766  0.9153 
1 1 1 16  33  7  o 3  4.80475e+00 1.55606e+00 9.93790e+01 22.415  5.06053e+00  2.08738e+00  0.00000e+00 0.00000e+00 6.72108e+01 22.415  3.21682e+01 202.415 0.9033 
1 1 1 16  33  8  o 18 4.49325e+00 1.51917e+00 8.39385e+01 102.100 -1.02322e+00 4.77274e+00  0.00000e+00 0.00000e+00 6.96766e+01 102.100 1.42619e+01 282.100 0.8906 
1 1 1 16  34  0  o 14 9.77352e+00 1.42512e+00 2.01677e+02 216.578 -1.71050e+01 -1.26929e+01 0.00000e+00 0.00000e+00 1.63403e+02 216.578 3.82747e+01 36.578  0.9762 
1 1 1 16  34  1  o 2  3.39113e+00 1.14487e+00 6.75308e+01 8.656   2.88582e+00  4.39347e-01  0.00000e+00 0.00000e+00 3.68334e+01 8.656   3.06974e+01 188.656 0.8038 
1 1 1 16  34  2  o 10 6.48892e+00 1.61746e+00 7.36437e+01 283.623 1.11619e+00  -4.60576e+00 0.00000e+00 0.00000e+00 1.46834e+02 283.623 7.31903e+01 283.623 0.8870 
1 1 1 16  34  3  f 0  1.01536e+01 1.62698e+00 1.08146e+02 120.926 -5.45835e+00 9.11084e+00  0.00000e+00 0.00000e+00 2.62210e+02 120.926 1.54064e+02 120.926 0.9517 
1 1 1 16  34  4  o 15 5.35147e+00 1.56190e+00 1.50863e+02 21.296  8.12975e+00  3.16901e+00  0.00000e+00 0.00000e+00 4.21875e+01 21.296  1.08675e+02 201.296 0.9408 
1 1 1 16  34  5  o 11 5.07143e+00 1.47922e+00 7.07294e+01 75.535  1.05066e+00  4.07278e+00  0.00000e+00 0.00000e+00 9.87049e+01 75.535  2.79755e+01 75.535  0.8710 
1 1 1 16  34  6  o 3  7.90951e+00 2.09265e+00 1.48584e+02 269.204 -1.29404e-01 -9.31918e+00 0.00000e+00 0.00000e+00 1.38124e+02 269.204 1.04594e+01 89.204  0.9447 
1 1 1 16  34  7  o 18 6.47934e+00 1.84642e+00 1.82994e+02 316.612 8.17804e+00  -7.73021e+00 0.00000e+00 0.00000e+00 5.43556e+01 316.612 1.28639e+02 136.612 0.9545 
1 1 1 16  34  8  o 5  8.02898e+00 2.08229e+00 1.56639e+02 224.009 -7.62370e+00 -7.36447e+00 0.00000e+00 0.00000e+00 1.36642e+02 224.009 1.99968e+01 44.009  0.9516 
1 1 1 16  35  0  o 19 5.10241e+00 1.40235e+00 1.30878e+02 265.340 -5.96365e-01 -7.31668e+00 0.00000e+00 0.00000e+00 5.05078e+01 265.340 8.03703e+01 85.340  0.9292 
1 1 1 16  35  1  o 11 9.25847e+00 1.52706e+00 1.69802e+02 36.792  1.28503e+01  9.61047e+00  0.00000e+00 0.00000e+00 1.73413e+02 36.792  3.61101e+00 36.792  0.9683 
1 1 1 16  35  2  o 7  6.51640e+00 1.60737e+00 1.30325e+02 191.526 -7.94846e+00 -1.62087e+00 0.00000e+00 0.00000e+00 1.03348e+02 191.526 2.69764e+01 11.526  0.9362 
1 1 1 16  35  3  f 0  4.26806e+00 1.31534e+00 7.48605e+01 53.450  2.38577e+00  3.21828e+00  0.00000e+00 0.00000e+00 6.64206e+01 53.450  8.43987e+00 233.450 0.8638 
1 1 1 16  35  4  o 4  4.47985e+00 1.36854e+00 8.71563e+01 312.920 3.24688e+00  -3.49157e+00 0.00000e+00 0.00000e+00 6.53129e+01 312.920 2.18434e+01 132.920 0.8877 
1 1 1 16  35  5  o 7  6.53054e+00 1.54504e+00 8.10627e+01 341.057 5.78090e+00  -1.98406e+00 0.00000e+00 0.00000e+00 1.47884e+02 341.057 6.68215e+01 341.057 0.9141 
1 1 1 16  35  6  o 18 4.55394e+00 1.54946e+00 7.97045e+01 274.080 2.90224e-01  -4.06922e+00 0.00000e+00 0.00000e+00 7.16885e+01 274.080 8.01599e+00 94.080  0.8665 
1 1 1 16  35  7  o 2  4.44779e+00 1.46792e+00 4.04849e+01 96.799  -2.64787e-01 2.22098e+00  0.00000e+00 0.00000e+00 8.46371e+01 96.799  4.41522e+01 96.799  0.7331 
1 1 1 16  35  8  o 2  6.32951e+00 1.89414e+00 1.41523e+02 52.816  5.18705e+00  6.83775e+00  0.00000e+00 0.00000e+00 8.67934e+01 52.816  5.47296e+01 232.816 0.9398 
1 1 1 16  36  0  o 4  4.74036e+00 1.40792e+00 9.24388e+01 153.335 -4.29239e+00 2.15555e+00  0.00000e+00 0.00000e+00 6.87077e+01 153.335 2.37311e+01 333.335 0.8886 
1 1 1 16  36  1  o 14 7.68637e+00 1.59235e+00 1.06340e+02 161.007 -7.78641e+00 2.68006e+00  0.00000e+00 0.00000e+00 1.69399e+02 161.007 6.30584e+01 161.007 0.9372 
1 1 1 16  36  2  o 17 4.14197e+00 1.33163e+00 1.11000e+02 201.618 -5.22621e+00 -2.07112e+00 0.00000e+00 0.00000e+00 3.27352e+01 201.618 7.82648e+01 21.618  0.9060 
1 1 1 16  36  3  o 8  6.07332e+00 1.46600e+00 1.34550e+02 318.128 6.92428e+00  -6.20677e+00 0.00000e+00 0.00000e+00 8.52821e+01 318.128 4.92677e+01 138.128 0.9446 
1 1 1 16  36  4  o 4  4.17757e+00 1.35267e+00 9.53094e+01 200.352 -4.67791e+00 -1.73521e+00 0.00000e+00 0.00000e+00 4.77276e+01 200.352 4.75818e+01 20.352  0.8931 
1 1 1 16  36  5  o 15 4.43396e+00 1.43475e+00 6.30667e+01 109.220 -1.10031e+00 3.15616e+00  0.00000e+00 0.00000e+00 7.84823e+01 109.220 1.54156e+01 109.220 0.8324 
1 1 1 16  36  6  o 2  6.11608e+00 1.81736e+00 5.47264e+01 142.423 -2.56748e+00 1.97556e+00  0.00000e+00 0.00000e+00 1.39132e+02 142.423 8.44055e+01 142.423 0.8262 
1 1 1 16  36  7  o 4  7.43420e+00 1.93484e+00 1.19987e+02 274.058 5.73016e-01  -8.07746e+00 0.00000e+00 0.00000e+00 1.47031e+02 274.058 2.70437e+01 274.058 0.9360 
1 1 1 16  36  8  o 6  4.65076e+00 1.54225e+00 1.00032e+02 226.469 -3.92836e+00 -4.13512e+00 0.00000e+00 0.00000e+00 6.19460e+01 226.469 3.80862e+01 46.469  0.9075 
1 1 1 16  37  0  o 15 9.00755e+00 1.55262e+00 9.17262e+01 332.179 7.33903e+00  -3.87284e+00 0.00000e+00 0.00000e+00 2.31350e+02 332.179 1.39624e+02 332.179 0.9377 
1 1 1 16  37  1  f 0  7.11754e+00 1.59464e+00 1.01447e+02 325.555 5.73208e+00  -3.93146e+00 0.00000e+00 0.00000e+00 1.50543e+02 325.555 4.90966e+01 325.555 0.9250 
1 1 1 16  37  2  o 19 4.97266e+00 1.46105e+00 6.89115e+01 11.679  3.58711e+00  7.41495e-01  0.00000e+00 0.00000e+00 9.28040e+01 11.679  2.38924e+01 11.679  0.8492 
1 1 1 16  37  3  o 2  7.98424e+00 1.79547e+00 1.12324e+02 288.791 2.57291e+00  -7.56167e+00 0.00000e+00 0.00000e+00 1.73752e+02 288.791 6.14282e+01 288.791 0.9351 
1 1 1 16  37  4  f 0  7.09552e+00 1.51544e+00 1.51882e+02 161.838 -1.11231e+01 3.64890e+00  0.00000e+00 0.00000e+00 1.08214e+02 161.838 4.36679e+01 341.838 0.9563 
1 1 1 16  37  5  o 13 4.15598e+00 1.35264e+00 4.49089e+01 331.837 2.10793e+00  -1.12849e+00 0.00000e+00 0.00000e+00 7.50305e+01 331.837 3.01216e+01 331.837 0.7526 
1 1 1 16  37  6  o 12 5.50113e+00 1.77603e+00 8.06814e+01 156.266 -3.85402e+00 1.69452e+00  0.00000e+00 0.00000e+00 1.03141e+02 156.266 2.24596e+01 156.266 0.8711 
1 1 1 16  37  7  o 6  1.05586e+01 1.99001e+00 2.07897e+02 65.539  8.11639e+00  1.78420e+01  0.00000e+00 0.00000e+00 1.86740e+02 65.539  2.11575e+01 245.539 0.9741 
1 1 1 16  37  8  f 0  5.39066e+00 1.72123e+00 6.33675e+01 256.323 -9.05160e-01 -3.71961e+00 0.00000e+00 0.00000e+00 1.13828e+02 256.323 5.04607e+01 256.323 0.8566 
1 1 1 16  38  0  o 5  5.54840e+00 1.50401e+00 1.06635e+02 338.287 5.84186e+00  -2.32631e+00 0.00000e+00 0.00000e+00 8.78857e+01 338.287 1.87490e+01 158.287 0.9166 
1 1 1 16  38  1  o 12 1.03522e+01 1.48782e+00 1.49174e+02 143.978 -1.38471e+01 1.00685e+01  0.00000e+00 0.00000e+00 2.35269e+02 143.978 8.60948e+01 143.978 0.9703 
1 1 1 16  38  2  o 14 8.25478e+00 1.61446e+00 1.70193e+02 89.927  1.73762e-02  1.36776e+01  0.00000e+00 0.00000e+00 1.34122e+02 89.927  3.60702e+01 269.927 0.9627 
1 1 1 16  38  3  o 14 4.45759e+00 1.44174e+00 9.34014e+01 78.752  9.48655e-01  4.77011e+00  0.00000e+00 0.00000e+00 5.86111e+01 78.752  3.47902e+01 258.752 0.8901 
1 1 1 16  38  4  o 2  5.85238e+00 1.52079e+00 7.87508e+01 147.823 -4.45434e+00 2.80256e+00  0.00000e+00 0.00000e+00 1.22936e+02 147.823 4.41848e+01 147.823 0.8991 
1 1 1 16  38  5  o 5  4.65855e+00 1.46273e+00 4.70068e+01 110.671 -8.75965e-01 2.32178e+00  0.00000e+00 0.00000e+00 8.92750e+01 110.671 4.22682e+01 110.671 0.7630 
1 1 1 16  38  6  o 7  4.35333e+00 1.42836e+00 7.08888e+01 28.141  3.36637e+00  1.80056e+00  0.00000e+00 0.00000e+00 7.20572e+01 28.141  1.16841e+00 28.141  0.8561 
1 1 1 16  38  7  o 18 6.10347e+00 1.77449e+00 1.26843e+02 284.473 2.00484e+00  -7.76717e+00 0.00000e+00 0.00000e+00 9.21867e+01 284.473 3.46563e+01 104.473 0.9354 
1 1 1 16  38  8  o 13 4.93789e+00 1.65518e+00 4.21685e+01 141.095 -1.89728e+00 1.53120e+00  0.00000e+00 0.00000e+00 1.01468e+02 141.095 5.92990e+01 141.095 0.7581 
1 1 1 16  39  0  o 7  5.60922e+00 1.38090e+00 9.87298e+01 132.162 -4.04919e+00 4.47152e+00  0.00000e+00 0.00000e+00 9.70965e+01 132.162 1.63337e+00 312.162 0.9129 
1 1 1 16  39  1  o 8  4.65484e+00 1.35825e+00 1.16923e+02 320.537 5.04788e+00  -4.15573e+00 0.00000e+00 0.00000e+00 4.69541e+01 320.537 6.99687e+01 140.537 0.9200 
1 1 1 16  39  2  o 11 9.16352e+00 1.45117e+00 2.16135e+02 162.613 -2.17128e+01 6.79897e+00  0.00000e+00 0.00000e+00 1.26926e+02 162.613 8.92092e+01 342.613 0.9778 
1 1 1 16  39  3  o 17 6.10818e+00 1.62007e+00 1.26850e+02 297.888 3.76335e+00  -7.11131e+00 0.00000e+00 0.00000e+00 9.20756e+01 297.888 3.47739e+01 117.888 0.9356 
1 1 1 16  39  4  o 7  7.15863e+00 1.70129e+00 1.50989e+02 320.084 8.61131e+00  -7.20425e+00 0.00000e+00 0.00000e+00 1.10841e+02 320.084 4.01485e+01 140.084 0.9544 
1 1 1 16  39  5  o 14 3.84737e+00 1.29783e+00 9.42032e+01 188.957 -4.81654e+00 -7.59157e-01 0.00000e+00 0.00000e+00 3.71361e+01 188.957 5.70671e+01 8.957   0.8904 
1 1 1 16  39  6  o 4  6.42842e+00 1.65527e+00 1.61045e+02 64.558  4.76899e+00  1.00244e+01  0.00000e+00 0.00000e+00 7.41057e+01 64.558  8.69390e+01 244.558 0.9538 
1 1 1 16  39  7  o 5  6.53659e+00 1.77227e+00 9.49450e+01 292.589 2.46372e+00  -5.92182e+00 0.00000e+00 0.00000e+00 1.35322e+02 292.589 4.03770e+01 292.589 0.9183 
1 1 1 16  39  8  o 9  3.72134e+00 1.32141e+00 6.38224e+01 166.597 -3.49600e+00 8.33075e-01  0.00000e+00 0.00000e+00 5.69464e+01 166.597 6.87604e+00 346.597 0.8459 
1 1 1 16  40  0  o 13 8.01961e+00 1.57727e+00 9.59677e+01 191.346 -7.90033e+00 -1.58524e+00 0.00000e+00 0.00000e+00 1.90989e+02 191.346 9.50211e+01 191.346 0.9357 
1 1 1 16  40  1  o 2  5.06153e+00 1.42223e+00 6.33541e+01 136.464 -2.53968e+00 2.41310e+00  0.00000e+00 0.00000e+00 9.95769e+01 136.464 3.62228e+01 136.464 0.8413 
1 1 1 16  40  2  o 18 9.50744e+00 1.55667e+00 1.83004e+02 154.302 -1.61713e+01 7.78215e+00  0.00000e+00 0.00000e+00 1.70694e+02 154.302 1.23097e+01 334.301 0.9717 
1 1 1 16  40  3  o 6  6.73106e+00 1.75175e+00 1.04798e+02 355.524 6.79136e+00  -5.31657e-01 0.00000e+00 0.00000e+00 1.33269e+02 355.524 2.84708e+01 355.524 0.9234 
1 1 1 16  40  4  o 10 7.99892e+00 1.66111e+00 1.87197e+02 259.053 -3.03269e+00 -1.56796e+01 0.00000e+00 0.00000e+00 1.09564e+02 259.053 7.76328e+01 79.053  0.9682 
1 1 1 16  40  5  o 19 7.39095e+00 1.65177e+00 1.58103e+02 37.214  9.77574e+00  7.42406e+00  0.00000e+00 0.00000e+00 1.13426e+02 37.214  4.46770e+01 217.214 0.9584 
1 1 1 16  40  6  o 14 5.53958e+00 1.67660e+00 9.87945e+01 208.972 -5.10374e+00 -2.82579e+00 0.00000e+00 0.00000e+00 9.44439e+01 208.972 4.35056e+00 28.972  0.9097 
1 1 1 16  40  7  o 9  6.69950e+00 1.79723e+00 8.32771e+01 291.765 2.12430e+00  -5.32046e+00 0.00000e+00 0.00000e+00 1.50027e+02 291.765 6.67497e+01 291.765 0.9079 
1 1 1 16  41  0  o 3  5.24664e+00 1.45148e+00 1.42145e+02 166.041 -7.77279e+00 1.93212e+00  0.00000e+00 0.00000e+00 4.54877e+01 166.041 9.66569e+01 346.041 0.9353 
1 1 1 16  41  1  o 8  8.05448e+00 1.54339e+00 1.34578e+02 266.482 -7.20460e-01 -1.17180e+01 0.00000e+00 0.00000e+00 1.60149e+02 266.482 2.55717e+01 266.482 0.9564 
1 1 1 16  41  2  o 2  1.20121e+01 1.38779e+00 2.09156e+02 101.011 -5.80247e+00 2.98210e+01  0.00000e+00 0.00000e+00 2.43037e+02 101.011 3.38807e+01 101.011 0.9834 
1 1 1 16  41  3  o 7  7.14487e+00 1.72995e+00 1.94177e+02 308.869 8.25828e+00  -1.02458e+01 0.00000e+00 0.00000e+00 6.88540e+01 308.869 1.25323e+02 128.869 0.9612 
1 1 1 16  41  4  o 19 4.06007e+00 1.32456e+00 8.24030e+01 95.146  -3.85292e-01 4.27867e+00  0.00000e+00 0.00000e+00 5.35621e+01 95.146  2.88408e+01 275.146 0.8740 
1 1 1 16  41  5  o 11 4.81233e+00 1.51463e+00 5.13690e+01 323.128 2.35627e+00  -1.76737e+00 0.00000e+00 0.00000e+00 9.72787e+01 323.128 4.59096e+01 323.128 0.8059 
1 1 1 16  41  6  o 17 5.74284e+00 1.70690e+00 5.77400e+01 59.857  1.75252e+00  3.01807e+00  0.00000e+00 0.00000e+00 1.27348e+02 59.857  6.96075e+01 59.857  0.8406 
1 1 1 16  41  7  o 9  5.52209e+00 1.68488e+00 3.21852e+01 30.481  1.75067e+00  1.03044e+00  0.00000e+00 0.00000e+00 1.16667e+02 30.481  8.44819e+01 30.481  0.7029 
1 1 1 16  42  0  f 0  5.44664e+00 1.48616e+00 1.00176e+02 163.369 -5.87479e+00 1.75483e+00  0.00000e+00 0.00000e+00 9.02218e+01 163.369 9.95436e+00 343.369 0.9144 
1 1 1 16  42  1  o 11 9.44204e+00 1.61814e+00 1.84025e+02 143.450 -1.38638e+01 1.02774e+01  0.00000e+00 0.00000e+00 1.66552e+02 143.450 1.74728e+01 323.450 0.9706 
1 1 1 16  42  2  o 6  5.12385e+00 1.48159e+00 1.16366e+02 125.851 -3.96375e+00 5.48566e+00  0.00000e+00 0.00000e+00 6.46226e+01 125.851 5.17435e+01 305.850 0.9228 
1 1 1 16  42  3  o 15 5.17637e+00 1.43298e+00 7.84470e+01 25.892  4.42010e+00  2.14554e+00  0.00000e+00 0.00000e+00 9.82405e+01 25.892  1.97936e+01 25.892  0.8913 
1 1 1 16  42  4  o 2  9.26237e+00 1.62776e+00 1.26113e+02 252.300 -3.78519e+00 -1.18604e+01 0.00000e+00 0.00000e+00 2.14177e+02 252.300 8.80642e+01 252.300 0.9590 
1 1 1 16  42  5  o 9  5.57487e+00 1.61985e+00 1.25305e+02 339.184 6.85833e+00  -2.60741e+00 0.00000e+00 0.00000e+00 7.32099e+01 339.184 5.20950e+01 159.184 0.9291 
1 1 1 16  42  6  o 11 8.48064e+00 1.90738e+00 1.66566e+02 184.123 -1.30354e+01 -9.39686e-01 0.00000e+00 0.00000e+00 1.45862e+02 184.123 2.07031e+01 4.123   0.9609 
1 1 1 16  42  7  f 0  6.29853e+00 1.79058e+00 7.36640e+01 220.343 -3.64512e+00 -3.09604e+00 0.00000e+00 0.00000e+00 1.40834e+02 220.343 6.71697e+01 220.343 0.8881 
1 1 1 16  43  0  o 19 1.53323e+01 1.14384e+00 2.65810e+02 128.373 -3.34561e+01 4.22526e+01  0.00000e+00 0.00000e+00 3.14834e+02 128.373 4.90236e+01 128.373 0.9907 
1 1 1 16  43  1  o 8  4.14983e+00 1.30738e+00 2.67751e+01 291.567 5.19886e-01  -1.31528e+00 0.00000e+00 0.00000e+00 6.43726e+01 291.567 3.75976e+01 291.567 0.5742 
1 1 1 16  43  2  o 17 5.26280e+00 1.47027e+00 4.44819e+01 314.455 1.90184e+00  -1.93836e+00 0.00000e+00 0.00000e+00 1.13940e+02 314.455 6.94580e+01 314.455 0.7865 
1 1 1 16  43  3  o 19 3.95472e+00 1.27633e+00 1.19366e+02 278.508 9.69103e-01  -6.47811e+00 0.00000e+00 0.00000e+00 1.99691e+01 278.508 9.93964e+01 98.508  0.9201 
1 1 1 16  43  4  o 15 8.93326e+00 1.69942e+00 1.19821e+02 31.648  8.87478e+00  5.47013e+00  0.00000e+00 0.00000e+00 2.05534e+02 31.648  8.57129e+01 31.648  0.9508 
1 1 1 16  43  5  o 2  7.66355e+00 1.83033e+00 1.87131e+02 216.979 -1.08164e+01 -8.14453e+00 0.00000e+00 0.00000e+00 9.54826e+01 216.979 9.16485e+01 36.979  0.9623 
1 1 1 16  43  6  o 17 5.14178e+00 1.55968e+00 1.12293e+02 94.628  -5.63466e-01 6.96137e+00  0.00000e+00 0.00000e+00 7.00939e+01 94.628  4.21989e+01 274.628 0.9254 
1 1 1 16  43  7  o 7  4.43997e+00 1.47539e+00 9.88193e+01 347.054 5.50335e+00  -1.26503e+00 0.00000e+00 0.00000e+00 5.55021e+01 347.054 4.33172e+01 167.054 0.9065 
1 1 1 16  44  0  o 19 5.86264e+00 1.51062e+00 1.29862e+02 172.128 -8.42631e+00 1.16508e+00  0.00000e+00 0.00000e+00 8.06065e+01 172.128 4.92553e+01 352.128 0.9392 
1 1 1 16  44  1  o 18 3.62208e+00 1.20090e+00 2.68400e+01 17.292  1.25923e+00  3.92015e-01  0.00000e+00 0.00000e+00 4.90821e+01 17.292  2.22422e+01 17.292  0.5481 
1 1 1 16  44  2  o 13 5.34498e+00 1.50528e+00 7.90942e+01 114.059 -1.88248e+00 4.21645e+00  0.00000e+00 0.00000e+00 1.01652e+02 114.059 2.25578e+01 114.059 0.8837 
1 1 1 16  44  3  o 18 4.52276e+00 1.41519e+00 3.64733e+01 220.133 -1.52703e+00 -1.28738e+00 0.00000e+00 0.00000e+00 8.42744e+01 220.133 4.78011e+01 220.133 0.6973 
1 1 1 16  44  4  o 5  8.28109e+00 1.78851e+00 2.07529e+02 86.995  8.71143e-01  1.65939e+01  0.00000e+00 0.00000e+00 9.99590e+01 86.995  1.07570e+02 266.995 0.9694 
1 1 1 16  44  5  f 0  4.96207e+00 1.53520e+00 9.40878e+01 315.088 3.84889e+00  -3.83712e+00 0.00000e+00 0.00000e+00 7.75186e+01 315.088 1.65691e+01 135.088 0.9026 
1 1 1 16  44  6  o 19 4.31569e+00 1.43114e+00 1.13408e+02 193.503 -6.28537e+00 -1.50939e+00 0.00000e+00 0.00000e+00 3.86096e+01 193.503 7.47980e+01 13.503  0.9190 
1 1 1 16  44  7  o 19 5.11293e+00 1.60605e+00 9.21796e+01 133.896 -3.99087e+00 4.14768e+00  0.00000e+00 0.00000e+00 8.58821e+01 133.896 6.29756e+00 313.896 0.9084 
1 1 1 16  45  0  o 14 6.78336e+00 1.47106e+00 5.81192e+01 202.532 -4.16161e+00 -1.72655e+00 0.00000e+00 0.00000e+00 1.70144e+02 202.532 1.12025e+02 202.532 0.8805 
1 1 1 16  45  1  o 4  3.77025e+00 1.23837e+00 6.98596e+01 143.009 -2.83480e+00 2.13551e+00  0.00000e+00 0.00000e+00 5.17741e+01 143.009 1.80854e+01 323.009 0.8436 
1 1 1 16  45  2  o 11 7.22217e+00 1.65395e+00 1.53963e+02 71.405  3.70339e+00  1.10073e+01  0.00000e+00 0.00000e+00 1.10196e+02 71.405  4.37669e+01 251.405 0.9559 
1 1 1 16  45  3  o 13 1.03172e+01 1.59353e+00 1.62137e+02 150.461 -1.58766e+01 8.99695e+00  0.00000e+00 0.00000e+00 2.21840e+02 150.461 5.97036e+01 150.461 0.9722 
1 1 1 16  45  4  o 16 1.07964e+01 1.64163e+00 1.05648e+02 331.470 1.05898e+01  -5.75706e+00 0.00000e+00 0.00000e+00 2.90286e+02 331.470 1.84638e+02 331.470 0.9576 
1 1 1 16  45  5  o 19 5.08885e+00 1.55214e+00 7.34459e+01 5.423   4.32101e+00  4.10212e-01  0.00000e+00 0.00000e+00 9.72337e+01 5.423   2.37878e+01 5.423   0.8754 
1 1 1 16  45  6  o 10 4.30859e+00 1.42420e+00 7.02196e+01 355.288 4.05976e+00  -3.34658e-01 0.00000e+00 0.00000e+00 7.28231e+01 355.288 2.60356e+00 355.288 0.8663 
1 1 1 16  45  7  o 2  5.59093e+00 1.65215e+00 1.10736e+02 243.161 -3.27958e+00 -6.48163e+00 0.00000e+00 0.00000e+00 8.82305e+01 243.161 2.25052e+01 63.161  0.9284 
1 1 1 16  46  0  o 7  4.38819e+00 1.30486e+00 1.99623e+01 98.861  -1.74235e-01 1.11766e+00  0.00000e+00 0.00000e+00 6.23606e+01 98.861  4.23983e+01 98.861  0.4909 
1 1 1 16  46  1  o 6  5.00046e+00 1.43672e+00 1.30866e+02 65.608  3.08060e+00  6.79374e+00  0.00000e+00 0.00000e+00 4.70135e+01 65.608  8.38522e+01 245.608 0.9303 
1 1 1 16  46  2  o 2  4.66036e+00 1.38158e+00 9.62495e+01 312.858 3.93851e+00  -4.24459e+00 0.00000e+00 0.00000e+00 6.58149e+01 312.858 3.04346e+01 132.858 0.9090 
1 1 1 16  46  3  o 14 6.29390e+00 1.65435e+00 1.39962e+02 21.054  8.24332e+00  3.17319e+00  0.00000e+00 0.00000e+00 8.68688e+01 21.054  5.30931e+01 201.054 0.9416 
1 1 1 16  46  4  o 1  6.66545e+00 1.73961e+00 1.27532e+02 13.239  8.04151e+00  1.89195e+00  0.00000e+00 0.00000e+00 1.11720e+02 13.239  1.58114e+01 193.239 0.9374 
1 1 1 16  46  5  o 15 4.25279e+00 1.39141e+00 9.35284e+01 320.773 4.03845e+00  -3.29689e+00 0.00000e+00 0.00000e+00 5.27835e+01 320.773 4.07449e+01 140.773 0.8981 
1 1 1 16  46  6  o 19 4.66840e+00 1.46881e+00 4.73037e+01 151.247 -2.60357e+00 1.42853e+00  0.00000e+00 0.00000e+00 9.71879e+01 151.247 4.98842e+01 151.247 0.8077 
1 1 1 16  46  7  o 19 6.01568e+00 1.77606e+00 5.58043e+01 97.733  -4.85030e-01 3.57171e+00  0.00000e+00 0.00000e+00 1.39347e+02 97.733  8.35424e+01 97.733  0.8464 
1 1 1 16  47  0  o 11 7.38412e+00 1.55528e+00 1.29879e+02 54.525  5.89022e+00  8.26527e+00  0.00000e+00 0.00000e+00 1.37971e+02 54.525  8.09196e+00 54.525  0.9494 
1 1 1 16  47  1  o 7  4.45165e+00 1.36699e+00 2.11197e+01 105.738 -3.32795e-01 1.18092e+00  0.00000e+00 0.00000e+00 6.75580e+01 105.738 4.64383e+01 105.738 0.5210 
1 1 1 16  47  2  f 0  9.96121e+00 1.52066e+00 2.15515e+02 6.473   2.44441e+01  2.77348e+00  0.00000e+00 0.00000e+00 1.57702e+02 6.473   5.78133e+01 186.473 0.9795 
1 1 1 16  47  3  o 14 5.71841e+00 1.56147e+00 6.14647e+01 98.053  -5.54294e-01 3.91790e+00  0.00000e+00 0.00000e+00 1.27152e+02 98.053  6.56873e+01 98.053  0.8618 
1 1 1 16  47  4  o 3  4.15238e+00 1.33766e+00 4.72269e+01 61.802  1.21889e+00  2.27340e+00  0.00000e+00 0.00000e+00 7.57297e+01 61.802  2.85028e+01 61.802  0.7734 
1 1 1 16  47  5  o 13 5.19324e+00 1.52213e+00 3.43069e+01 359.761 2.15212e+00  -8.95856e-03 0.00000e+00 0.00000e+00 1.09157e+02 359.761 7.48499e+01 359.761 0.7212 
1 1 1 16  47  6  o 18 1.33515e+01 1.70082e+00 2.23083e+02 258.852 -6.33202e+00 -3.21336e+01 0.00000e+00 0.00000e+00 2.80595e+02 258.852 5.75122e+01 258.852 0.9846 
1 1 1 16  47  7  o 12 8.07233e+00 1.97152e+00 1.00711e+02 144.104 -6.11976e+00 4.42925e+00  0.00000e+00 0.00000e+00 1.87380e+02 144.104 8.66692e+01 144.104 0.9312 
1 1 1 16  48  0  o 1  6.22157e+00 1.33135e+00 1.21929e+02 319.383 7.44427e+00  -6.38444e+00 0.00000e+00 0.00000e+00 1.03289e+02 319.383 1.86407e+01 139.383 0.9476 
1 1 1 16  48  1  o 4  6.43738e+00 1.46123e+00 5.75537e+01 205.732 -3.92193e+00 -1.89022e+00 0.00000e+00 0.00000e+00 1.57978e+02 205.732 1.00425e+02 205.732 0.8759 
1 1 1 16  48  2  o 12 6.83506e+00 1.66509e+00 1.11752e+02 69.475  2.66916e+00  7.12959e+00  0.00000e+00 0.00000e+00 1.31843e+02 69.475  2.00904e+01 69.475  0.9318 
1 1 1 16  48  3  o 12 6.34966e+00 1.59809e+00 1.08140e+02 95.471  -7.12288e-01 7.43709e+00  0.00000e+00 0.00000e+00 1.17939e+02 95.471  9.79864e+00 95.471  0.9304 
1 1 1 16  48  4  o 12 7.03206e+00 1.77130e+00 1.99649e+02 309.019 8.76362e+00  -1.08148e+01 0.00000e+00 0.00000e+00 5.97018e+01 309.019 1.39947e+02 129.019 0.9634 
1 1 1 16  48  5  o 13 8.24989e+00 1.80905e+00 8.62019e+01 355.705 7.17853e+00  -5.39136e-01 0.00000e+00 0.00000e+00 2.06899e+02 355.705 1.20697e+02 355.705 0.9277 
1 1 1 16  48  6  o 1  5.67489e+00 1.70711e+00 6.51902e+01 275.103 3.58518e-01  -4.01469e+00 0.00000e+00 0.00000e+00 1.22793e+02 275.103 5.76028e+01 275.103 0.8647 
1 1 1 16  48  7  o 15 7.81159e+00 1.99258e+00 1.23226e+02 18.670  8.55219e+00  2.88977e+00  0.00000e+00 0.00000e+00 1.59001e+02 18.670  3.57744e+01 18.670  0.9429 
1 1 1 16  49  0  o 16 9.06815e+00 1.46110e+00 1.36240e+02 45.792  1.01239e+01  1.04078e+01  0.00000e+00 0.00000e+00 1.97996e+02 45.792  6.17563e+01 45.792  0.9649 
1 1 1 16  49  1  o 5  6.45406e+00 1.56792e+00 1.21204e+02 141.512 -6.79677e+00 5.40408e+00  0.00000e+00 0.00000e+00 1.10808e+02 141.512 1.03959e+01 321.512 0.9405 
1 1 1 16  49  2  o 11 1.36788e+01 1.30201e+00 2.44021e+02 280.565 8.20745e+00  -4.40054e+01 0.00000e+00 0.00000e+00 2.73214e+02 280.565 2.91936e+01 280.565 0.9888 
1 1 1 16  49  3  o 10 8.42354e+00 1.70176e+00 1.23065e+02 25.833  9.76811e+00  4.72900e+00  0.00000e+00 0.00000e+00 1.84003e+02 25.833  6.09377e+01 25.833  0.9528 
1 1 1 16  49  4  o 18 8.48724e+00 1.62370e+00 1.28526e+02 2.245   1.20462e+01  4.72348e-01  0.00000e+00 0.00000e+00 1.82567e+02 2.245   5.40409e+01 2.245   0.9576 
1 1 1 16  49  5  o 17 4.42613e+00 1.43355e+00 2.87546e+01 179.634 -1.67675e+00 1.07101e-02  0.00000e+00 0.00000e+00 7.91899e+01 179.634 5.04352e+01 179.634 0.6369 
1 1 1 16  49  6  o 7  4.25159e+00 1.40525e+00 5.15803e+01 171.154 -3.08374e+00 4.79933e-01  0.00000e+00 0.00000e+00 8.17208e+01 171.154 3.01405e+01 171.154 0.8185 
1 1 1 16  49  7  o 7  4.65539e+00 1.59778e+00 2.49146e+01 229.913 -9.39649e-01 -1.11638e+00 0.00000e+00 0.00000e+00 7.95857e+01 229.913 5.46712e+01 229.913 0.5859 
1 1 1 16  50  0  o 4  1.12511e+01 1.30435e+00 1.17161e+02 219.735 -1.34047e+01 -1.11425e+01 0.00000e+00 0.00000e+00 3.00037e+02 219.735 1.82876e+02 219.735 0.9709 
1 1 1 16  50  1  o 3  3.56032e+00 1.17998e+00 5.45249e+01 140.605 -2.02698e+00 1.66466e+00  0.00000e+00 0.00000e+00 5.12949e+01 140.605 3.23002e+00 320.605 0.7777 
1 1 1 16  50  2  o 7  8.33322e+00 1.65100e+00 1.93761e+02 349.555 1.66884e+01  -3.07657e+00 0.00000e+00 0.00000e+00 1.15344e+02 349.555 7.84168e+01 169.555 0.9701 
1 1 1 16  50  3  o 14 3.66092e+00 1.23158e+00 1.11564e+02 288.683 1.84754e+00  -5.46376e+00 0.00000e+00 0.00000e+00 1.56864e+01 288.683 9.58780e+01 108.683 0.9086 
1 1 1 16  50  4  o 4  4.42970e+00 1.42042e+00 8.87164e+01 243.222 -2.27286e+00 -4.50386e+00 0.00000e+00 0.00000e+00 6.29194e+01 243.222 2.57970e+01 63.222  0.8944 
1 1 1 16  50  5  o 2  5.79655e+00 1.67062e+00 9.86070e+01 241.175 -3.09875e+00 -5.63085e+00 0.00000e+00 0.00000e+00 1.05243e+02 241.175 6.63575e+00 241.175 0.9185 
1 1 1 16  50  6  o 1  5.51684e+00 1.70140e+00 1.26357e+02 36.916  6.30708e+00  4.73827e+00  0.00000e+00 0.00000e+00 7.10454e+01 36.916  5.53116e+01 216.916 0.9343 
1 1 1 16  50  7  o 14 4.79236e+00 1.62403e+00 1.26413e+02 303.249 4.23863e+00  -6.46532e+00 0.00000e+00 0.00000e+00 4.48513e+01 303.249 8.15622e+01 123.249 0.9329 
1 1 1 16  51  0  f 0  6.21666e+00 1.53840e+00 1.40060e+02 9.398   9.27377e+00  1.53500e+00  0.00000e+00 0.00000e+00 8.43312e+01 9.398   5.57291e+01 189.398 0.9452 
1 1 1 16  51  1  o 7  1.11278e+01 1.44046e+00 2.08761e+02 274.356 2.15514e+00  -2.82910e+01 0.00000e+00 0.00000e+00 2.08883e+02 274.356 1.22195e-01 274.356 0.9822 
1 1 1 16  51  2  o 3  4.22976e+00 1.34012e+00 6.57359e+01 152.563 -3.31480e+00 1.72098e+00  0.00000e+00 0.00000e+00 7.21234e+01 152.563 6.38748e+00 152.563 0.8525 
1 1 1 16  51  3  o 18 5.61911e+00 1.58249e+00 3.56331e+01 253.369 -6.45766e-01 -2.16196e+00 0.00000e+00 0.00000e+00 1.22492e+02 253.369 8.68592e+01 253.369 0.7357 
1 1 1 16  51  4  o 12 7.12300e+00 1.71677e+00 1.15756e+02 275.856 8.86666e-01  -8.64424e+00 0.00000e+00 0.00000e+00 1.40623e+02 275.856 2.48669e+01 275.856 0.9406 
1 1 1 16  51  5  o 16 4.36381e+00 1.40999e+00 5.07516e+01 111.352 -1.09599e+00 2.80355e+00  0.00000e+00 0.00000e+00 8.46843e+01 111.352 3.39327e+01 111.352 0.8107 
1 1 1 16  51  6  o 12 6.17068e+00 1.76168e+00 1.19291e+02 333.185 7.13016e+00  -3.60401e+00 0.00000e+00 0.00000e+00 1.01681e+02 333.185 1.76099e+01 153.185 0.9351 
1 1 1 16  51  7  f 0  4.56226e+00 1.54988e+00 9.12072e+01 69.887  1.96547e+00  5.36712e+00  0.00000e+00 0.00000e+00 6.74115e+01 69.887  2.37957e+01 249.887 0.9077 
1 1 1 16  52  0  o 11 3.48020e+00 1.15287e+00 4.86300e+01 160.313 -2.35581e+00 8.42913e-01  0.00000e+00 0.00000e+00 5.30535e+01 160.313 4.42342e+00 160.313 0.7652 
1 1 1 16  52  1  o 16 1.68294e+01 1.16210e+00 2.61009e+02 108.580 -2.03088e+01 6.04167e+01  0.00000e+00 0.00000e+00 3.76904e+02 108.580 1.15895e+02 108.580 0.9921 
1 1 1 16  52  2  o 9  1.24972e+01 1.31244e+00 1.96935e+02 288.975 1.02511e+01  -2.98134e+01 0.00000e+00 0.00000e+00 2.73153e+02 288.975 7.62181e+01 288.975 0.9840 
1 1 1 16  52  3  o 12 5.59129e+00 1.49897e+00 6.38227e+01 350.859 4.24257e+00  -6.82629e-01 0.00000e+00 0.00000e+00 1.23085e+02 350.859 5.92628e+01 350.859 0.8740 
1 1 1 16  52  4  o 12 4.58679e+00 1.44794e+00 8.49460e+01 222.888 -3.72552e+00 -3.46049e+00 0.00000e+00 0.00000e+00 7.21810e+01 222.888 1.27650e+01 42.888  0.8953 
1 1 1 16  52  5  o 2  7.03140e+00 1.82167e+00 1.19558e+02 85.451  6.70221e-01  8.42409e+00  0.00000e+00 0.00000e+00 1.33112e+02 85.451  1.35543e+01 85.451  0.9388 
1 1 1 16  52  6  o 4  6.02453e+00 1.72486e+00 9.94295e+01 317.034 4.86291e+00  -4.52936e+00 0.00000e+00 0.00000e+00 1.13095e+02 317.034 1.36656e+01 317.034 0.9213 
1 1 1 16  53  0  o 1  1.17754e+01 1.37580e+00 1.92946e+02 239.061 -1.47329e+01 -2.45787e+01 0.00000e+00 0.00000e+00 2.48684e+02 239.061 5.57377e+01 239.061 0.9824 
1 1 1 16  53  1  o 9  4.51814e+00 1.38197e+00 6.05600e+01 353.216 3.33155e+00  -3.96347e-01 0.00000e+00 0.00000e+00 8.32374e+01 353.216 2.26774e+01 353.216 0.8332 
1 1 1 16  53  2  o 6  4.46763e+00 1.42784e+00 8.32069e+01 2.480   4.65360e+00  2.01571e-01  0.00000e+00 0.00000e+00 6.78791e+01 2.480   1.53278e+01 182.480 0.8848 
1 1 1 16  53  3  o 17 8.19857e+00 1.71692e+00 1.59347e+02 134.834 -9.62396e+00 9.68004e+00  0.00000e+00 0.00000e+00 1.42454e+02 134.834 1.68931e+01 314.833 0.9626 
1 1 1 16  53  4  o 17 6.50366e+00 1.63865e+00 9.57730e+01 243.971 -3.14759e+00 -6.44520e+00 0.00000e+00 0.00000e+00 1.34974e+02 243.971 3.92007e+01 243.971 0.9274 
1 1 1 16  53  5  o 13 6.06776e+00 1.62074e+00 5.17651e+01 206.648 -3.39337e+00 -1.70285e+00 0.00000e+00 0.00000e+00 1.46832e+02 206.648 9.50670e+01 206.648 0.8552 
1 1 1 16  53  6  o 6  3.69323e+00 1.27258e+00 1.82593e+01 159.588 -1.02578e+00 3.81720e-01  0.00000e+00 0.00000e+00 4.94469e+01 159.588 3.11876e+01 159.588 0.4789 
1 1 1 16  54  0  o 7  6.34738e+00 1.49726e+00 1.45947e+02 102.698 -2.31660e+00 1.02808e+01  0.00000e+00 0.00000e+00 8.45399e+01 102.698 6.14074e+01 282.699 0.9513 
1 1 1 16  54  1  o 10 5.28017e+00 1.48605e+00 1.04022e+02 107.557 -1.97070e+00 6.22884e+00  0.00000e+00 0.00000e+00 8.15006e+01 107.557 2.25217e+01 287.556 0.9199 
1 1 1 16  54  2  o 3  3.64976e+00 1.22560e+00 7.35445e+01 202.264 -3.61143e+00 -1.47850e+00 0.00000e+00 0.00000e+00 4.63589e+01 202.264 2.71856e+01 22.264  0.8597 
1 1 1 16  54  3  f 0  3.81870e+00 1.26840e+00 1.14178e+02 211.698 -5.54560e+00 -3.42475e+00 0.00000e+00 0.00000e+00 2.01062e+01 211.698 9.40720e+01 31.698  0.9197 
1 1 1 16  54  4  o 18 1.16517e+01 1.60282e+00 1.79397e+02 317.447 1.87213e+01  -1.71870e+01 0.00000e+00 0.00000e+00 2.57432e+02 317.447 7.80358e+01 317.447 0.9801 
1 1 1 16  54  5  o 8  5.06540e+00 1.52823e+00 7.44636e+01 112.572 -1.86473e+00 4.48583e+00  0.00000e+00 0.00000e+00 9.80394e+01 112.572 2.35757e+01 112.572 0.8900 
1 1 1 16  54  6  o 5  4.81295e+00 1.50460e+00 2.55960e+01 340.372 1.56861e+00  -5.59415e-01 0.00000e+00 0.00000e+00 9.12829e+01 340.372 6.56868e+01 340.372 0.6344 
1 1 1 16  55  0  o 5  5.27606e+00 1.43229e+00 7.21083e+01 161.245 -4.44268e+00 1.50848e+00  0.00000e+00 0.00000e+00 1.06240e+02 161.245 3.41316e+01 161.245 0.8857 
1 1 1 16  55  1  o 11 5.31046e+00 1.47416e+00 9.63247e+01 264.220 -6.24823e-01 -6.17277e+00 0.00000e+00 0.00000e+00 8.93227e+01 264.220 7.00193e+00 84.220  0.9154 
1 1 1 16  55  2  o 4  5.95376e+00 1.64044e+00 7.05207e+01 199.050 -4.37219e+00 -1.50974e+00 0.00000e+00 0.00000e+00 1.30562e+02 199.050 6.00409e+01 199.050 0.8839 
1 1 1 16  55  3  o 6  1.50322e+01 1.34618e+00 2.08097e+02 22.672  4.05255e+01  1.69292e+01  0.00000e+00 0.00000e+00 3.59983e+02 22.672  1.51886e+02 22.672  0.9885 
1 1 1 16  55  4  f 0  5.47344e+00 1.57637e+00 8.05007e+01 186.025 -5.26924e+00 -5.56141e-01 0.00000e+00 0.00000e+00 1.07872e+02 186.025 2.73718e+01 186.025 0.8999 
1 1 1 16  55  5  o 15 7.29318e+00 1.79809e+00 1.46803e+02 172.360 -1.11114e+01 1.49052e+00  0.00000e+00 0.00000e+00 1.19478e+02 172.360 2.73255e+01 352.360 0.9543 
1 1 1 16  55  6  o 12 6.37946e+00 1.67308e+00 1.47268e+02 46.244  7.97480e+00  8.32894e+00  0.00000e+00 0.00000e+00 8.60415e+01 46.244  6.12268e+01 226.244 0.9556 
1 1 1 16  56  0  o 8  1.05291e+01 1.38456e+00 1.83830e+02 136.852 -1.82045e+01 1.70640e+01  0.00000e+00 0.00000e+00 2.09818e+02 136.852 2.59873e+01 136.852 0.9798 
1 1 1 16  56  1  f 0  7.46195e+00 1.66029e+00 8.25657e+01 67.803  2.50741e+00  6.14529e+00  0.00000e+00 0.00000e+00 1.79914e+02 67.803  9.73481e+01 67.803  0.9212 
1 1 1 16  56  2  o 4  3.78690e+00 1.26902e+00 5.39958e+01 244.067 -1.28966e+00 -2.65209e+00 0.00000e+00 0.00000e+00 6.26332e+01 244.067 8.63733e+00 244.067 0.8061 
1 1 1 16  56  3  o 2  3.89329e+00 1.29447e+00 4.77275e+01 4.860   2.74002e+00  2.32981e-01  0.00000e+00 0.00000e+00 6.97824e+01 4.860   2.20549e+01 4.860   0.7897 
1 1 1 16  56  4  o 17 6.20525e+00 1.62727e+00 1.18143e+02 164.223 -8.49048e+00 2.39891e+00  0.00000e+00 0.00000e+00 1.05260e+02 164.223 1.28830e+01 344.223 0.9415 
1 1 1 16  56  5  o 15 7.51516e+00 1.81558e+00 7.05973e+01 293.641 2.20984e+00  -5.04818e+00 0.00000e+00 0.00000e+00 1.89291e+02 293.641 1.18693e+02 293.641 0.9040 
1 1 1 16  56  6  o 11 4.41094e+00 1.38256e+00 9.29302e+01 139.978 -5.07567e+00 4.26238e+00  0.00000e+00 0.00000e+00 6.25433e+01 139.978 3.03869e+01 319.977 0.9211 
1 1 1 16  57  0  o 3  4.55205e+00 1.36331e+00 1.04488e+02 261.232 -9.69131e-01 -6.28345e+00 0.00000e+00 0.00000e+00 5.48744e+01 261.232 4.96141e+01 81.232  0.9176 
1 1 1 16  57  1  o 10 4.66308e+00 1.40157e+00 6.63409e+01 207.560 -3.60697e+00 -1.88244e+00 0.00000e+00 0.00000e+00 8.78463e+01 207.560 2.15054e+01 207.560 0.8661 
1 1 1 16  57  2  o 5  3.74847e+00 1.25268e+00 5.40986e+01 88.391  8.55297e-02  3.04459e+00  0.00000e+00 0.00000e+00 6.23554e+01 88.391  8.25675e+00 88.391  0.8133 
1 1 1 16  57  3  o 11 8.07304e+00 1.63347e+00 5.61308e+01 26.917  4.80005e+00  2.43696e+00  0.00000e+00 0.00000e+00 2.22028e+02 26.917  1.65898e+02 26.917  0.9016 
1 1 1 16  57  4  o 16 6.75636e+00 1.65719e+00 8.44309e+01 58.687  3.46897e+00  5.70263e+00  0.00000e+00 0.00000e+00 1.53664e+02 58.687  6.92336e+01 58.687  0.9217 
1 1 1 16  57  5  o 9  4.35172e+00 1.40278e+00 9.77325e+01 253.129 -1.80732e+00 -5.95934e+00 0.00000e+00 0.00000e+00 5.46879e+01 253.129 4.30446e+01 73.129  0.9158 
1 1 1 16  57  6  o 4  4.36960e+00 1.42263e+00 1.02688e+02 48.601  4.64430e+00  5.26815e+00  0.00000e+00 0.00000e+00 5.20835e+01 48.601  5.06044e+01 228.601 0.9258 
1 1 1 16  58  0  o 10 4.60092e+00 1.37672e+00 1.25083e+02 45.258  5.42058e+00  5.46965e+00  0.00000e+00 0.00000e+00 3.86026e+01 45.258  8.64805e+01 225.258 0.9326 
1 1 1 16  58  1  o 4  4.41509e+00 1.37994e+00 3.74606e+01 158.529 -2.11988e+00 8.33786e-01  0.00000e+00 0.00000e+00 8.70022e+01 158.529 4.95416e+01 158.529 0.7385 
1 1 1 16  58  2  o 8  6.87734e+00 1.65791e+00 7.64280e+01 201.912 -5.53744e+00 -2.22738e+00 0.00000e+00 0.00000e+00 1.63084e+02 201.912 8.66555e+01 201.912 0.9119 
1 1 1 16  58  3  o 7  5.36092e+00 1.53747e+00 1.22081e+02 86.153  5.40757e-01  8.04111e+00  0.00000e+00 0.00000e+00 6.95995e+01 86.153  5.24816e+01 266.153 0.9357 
1 1 1 16  58  4  o 2  5.38226e+00 1.56604e+00 9.75820e+01 341.672 6.26088e+00  -2.07402e+00 0.00000e+00 0.00000e+00 9.18554e+01 341.672 5.72658e+00 161.672 0.9207 
1 1 1 16  58  5  o 4  3.86903e+00 1.31150e+00 7.83644e+01 94.395  -3.82458e-01 4.97635e+00  0.00000e+00 0.00000e+00 5.37876e+01 94.395  2.45768e+01 274.395 0.8932 
1 1 1 16  58  6  o 12 6.03738e+00 1.73421e+00 1.23757e+02 118.140 -4.07718e+00 7.62311e+00  0.00000e+00 0.00000e+00 9.33932e+01 118.140 3.03639e+01 298.140 0.9402 
1 1 1 16  59  0  o 10 1.09835e+01 1.48087e+00 2.28598e+02 189.762 -3.16710e+01 -5.44867e+00 0.00000e+00 0.00000e+00 1.83759e+02 189.762 4.48397e+01 9.762   0.9843 
1 1 1 16  59  1  o 14 6.59495e+00 1.55712e+00 1.13184e+02 153.624 -8.17403e+00 4.05327e+00  0.00000e+00 0.00000e+00 1.24290e+02 153.624 1.11063e+01 153.624 0.9435 
1 1 1 16  59  2  o 10 9.16904e+00 1.62510e+00 1.54901e+02 46.526  1.13578e+01  1.19798e+01  0.00000e+00 0.00000e+00 1.84452e+02 46.526  2.95508e+01 46.526  0.9692 
1 1 1 16  59  3  f 0  5.77116e+00 1.60990e+00 5.06166e+01 39.915  2.73055e+00  2.28428e+00  0.00000e+00 0.00000e+00 1.35513e+02 39.915  8.48963e+01 39.915  0.8442 
1 1 1 16  59  4  o 15 4.84208e+00 1.37827e+00 7.13499e+01 271.424 1.23469e-01  -4.96621e+00 0.00000e+00 0.00000e+00 9.38495e+01 271.424 2.24997e+01 271.424 0.8926 
1 1 1 16  59  5  o 12 9.79767e+00 1.81136e+00 1.41939e+02 181.108 -1.55269e+01 -3.00374e-01 0.00000e+00 0.00000e+00 2.20409e+02 181.108 7.84696e+01 181.108 0.9672 
1 1 1 16  59  6  o 16 4.27144e+00 1.41408e+00 1.12304e+02 32.213  6.30524e+00  3.97261e+00  0.00000e+00 0.00000e+00 3.96738e+01 32.213  7.26299e+01 212.213 0.9303 
1 1 1 16  60  0  o 10 4.37554e+00 1.26408e+00 6.58592e+01 297.851 2.03791e+00  -3.85694e+00 0.00000e+00 0.00000e+00 8.03349e+01 297.851 1.44757e+01 297.851 0.8761 
1 1 1 16  60  1  o 2  3.56927e+00 1.17102e+00 7.75637e+01 159.722 -4.37524e+00 1.61652e+00  0.00000e+00 0.00000e+00 4.29676e+01 159.722 3.45961e+01 339.722 0.8850 
1 1 1 16  60  2  o 5  3.97565e+00 1.28331e+00 3.95114e+01 179.872 -2.32639e+00 5.19061e-03  0.00000e+00 0.00000e+00 7.35288e+01 179.872 3.40174e+01 179.872 0.7447 
1 1 1 16  60  3  o 6  1.72160e+01 1.29784e+00 2.61501e+02 325.387 5.71069e+01  -3.94150e+01 0.00000e+00 0.00000e+00 3.91367e+02 325.387 1.29865e+02 325.387 0.9928 
1 1 1 16  60  4  o 19 5.70253e+00 1.44526e+00 1.17609e+02 142.458 -7.53266e+00 5.78874e+00  0.00000e+00 0.00000e+00 8.85028e+01 142.458 2.91065e+01 322.458 0.9458 
1 1 1 16  60  5  o 17 4.42527e+00 1.44173e+00 7.71505e+01 314.776 3.69566e+00  -3.72473e+00 0.00000e+00 0.00000e+00 7.49058e+01 314.776 2.24461e+00 134.776 0.8988 
1 1 1 16  60  6  o 9  4.06530e+00 1.33000e+00 3.63851e+01 118.340 -1.19134e+00 2.20885e+00  0.00000e+00 0.00000e+00 8.27044e+01 118.340 4.63192e+01 118.340 0.7660 
1 1 1 16  61  0  o 12 4.31663e+00 1.35045e+00 5.83474e+01 209.060 -3.23727e+00 -1.79892e+00 0.00000e+00 0.00000e+00 8.17283e+01 209.060 2.33809e+01 209.060 0.8511 
1 1 1 16  61  1  o 16 1.06290e+01 1.42405e+00 1.56867e+02 36.955  1.79028e+01  1.34688e+01  0.00000e+00 0.00000e+00 2.39497e+02 36.955  8.26307e+01 36.955  0.9774 
1 1 1 16  61  2  o 11 5.77517e+00 1.54463e+00 9.47509e+01 226.211 -4.84711e+00 -5.05645e+00 0.00000e+00 0.00000e+00 1.09301e+02 226.211 1.45501e+01 226.211 0.9256 
1 1 1 16  61  3  f 0  3.13954e+00 1.09359e+00 2.79139e+01 292.665 5.96551e-01  -1.42857e+00 0.00000e+00 0.00000e+00 4.49655e+01 292.665 1.70516e+01 292.665 0.6078 
1 1 1 16  61  4  o 16 5.01631e+00 1.46839e+00 8.57726e+01 61.878  2.93591e+00  5.49344e+00  0.00000e+00 0.00000e+00 8.97506e+01 61.878  3.97806e+00 61.878  0.9158 
1 1 1 16  61  5  o 13 5.50009e+00 1.53861e+00 1.30169e+02 36.379  7.77850e+00  5.73036e+00  0.00000e+00 0.00000e+00 6.88636e+01 36.379  6.13049e+01 216.379 0.9467 
1 1 1 16  61  6  o 1  6.65720e+00 1.73398e+00 1.22597e+02 146.089 -8.14601e+00 5.47611e+00  0.00000e+00 0.00000e+00 1.18602e+02 146.089 3.99456e+00 326.089 0.9476 
1 1 1 16  62  0  o 15 9.58704e+00 1.40790e+00 1.51604e+02 82.784  2.47063e+00  1.95144e+01  0.00000e+00 0.00000e+00 2.04462e+02 82.784  5.28585e+01 82.784  0.9742 
1 1 1 16  62  1  o 12 4.32730e+00 1.34943e+00 9.48915e+01 93.163  -3.36650e-01 6.09257e+00  0.00000e+00 0.00000e+00 5.59669e+01 93.163  3.89247e+01 273.163 0.9139 
1 1 1 16  62  2  o 4  7.58402e+00 1.68398e+00 1.08810e+02 266.228 -6.24892e-01 -9.47854e+00 0.00000e+00 0.00000e+00 1.64961e+02 266.228 5.61505e+01 266.228 0.9458 
1 1 1 16  62  3  o 7  4.04303e+00 1.31857e+00 8.33174e+01 213.083 -4.42018e+00 -2.87965e+00 0.00000e+00 0.00000e+00 5.55379e+01 213.083 2.77794e+01 33.083  0.8994 
1 1 1 16  62  4  o 19 8.31303e+00 1.76301e+00 1.28960e+02 23.117  1.14350e+01  4.88135e+00  0.00000e+00 0.00000e+00 1.75565e+02 23.117  4.66055e+01 23.117  0.9589 
1 1 1 16  62  5  o 8  4.78288e+00 1.47459e+00 1.29278e+02 247.795 -3.47350e+00 -8.50941e+00 0.00000e+00 0.00000e+00 4.32561e+01 247.795 8.60220e+01 67.795  0.9439 
1 1 1 16  62  6  o 1  5.40061e+00 1.55947e+00 1.06009e+02 66.351  3.23133e+00  7.37885e+00  0.00000e+00 0.00000e+00 8.71710e+01 66.351  1.88381e+01 246.350 0.9357 
1 1 1 16  63  0  o 15 3.73500e+00 1.18353e+00 2.98379e+01 12.975  1.83111e+00  4.21896e-01  0.00000e+00 0.00000e+00 6.65252e+01 12.975  3.66873e+01 12.975  0.6769 
1 1 1 16  63  1  o 12 5.64974e+00 1.50082e+00 1.44895e+02 231.179 -6.74964e+00 -8.38844e+00 0.00000e+00 0.00000e+00 6.03173e+01 231.179 8.45781e+01 51.179  0.9524 
1 1 1 16  63  2  o 3  7.59244e+00 1.65741e+00 1.30666e+02 84.088  1.18503e+00  1.14430e+01  0.00000e+00 0.00000e+00 1.46171e+02 84.088  1.55048e+01 84.088  0.9555 
1 1 1 16  63  3  o 5  3.71341e+00 1.24006e+00 2.12305e+01 126.711 -7.84630e-01 1.05223e+00  0.00000e+00 0.00000e+00 5.62172e+01 126.711 3.49867e+01 126.711 0.5463 
1 1 1 16  63  4  o 9  5.12770e+00 1.51119e+00 1.14252e+02 6.854   8.43193e+00  1.01350e+00  0.00000e+00 0.00000e+00 6.96836e+01 6.854   4.45685e+01 186.854 0.9391 
1 1 1 16  63  5  o 2  4.96849e+00 1.46170e+00 5.77679e+01 252.098 -1.33868e+00 -4.14417e+00 0.00000e+00 0.00000e+00 1.08519e+02 252.098 5.07513e+01 252.098 0.8759 
1 1 1 16  63  6  o 6  6.03851e+00 1.73071e+00 1.02120e+02 17.861  7.47584e+00  2.40907e+00  0.00000e+00 0.00000e+00 1.13445e+02 17.861  1.13252e+01 17.861  0.9340 
1 1 1 16  64  0  o 8  4.02599e+00 1.24501e+00 5.81461e+01 351.975 3.71942e+00  -5.24392e-01 0.00000e+00 0.00000e+00 7.27960e+01 351.975 1.46500e+01 351.975 0.8534 
1 1 1 16  64  1  o 7  3.65427e+00 1.19759e+00 7.10136e+01 8.538   4.19705e+00  6.30109e-01  0.00000e+00 0.00000e+00 5.05379e+01 8.538   2.04758e+01 188.538 0.8723 
1 1 1 16  64  2  o 19 7.44560e+00 1.58050e+00 7.50177e+01 118.560 -3.40772e+00 6.26052e+00  0.00000e+00 0.00000e+00 1.88304e+02 118.560 1.13286e+02 118.560 0.9269 
1 1 1 16  64  3  o 4  4.04012e+00 1.32689e+00 6.90770e+01 224.849 -3.27360e+00 -3.25638e+00 0.00000e+00 0.00000e+00 6.72062e+01 224.849 1.87081e+00 44.849  0.8837 
1 1 1 16  64  4  o 18 5.47139e+00 1.55673e+00 8.25076e+01 298.239 2.84114e+00  -5.28995e+00 0.00000e+00 0.00000e+00 1.08142e+02 298.239 2.56347e+01 298.239 0.9124 
1 1 1 16  64  5  o 1  3.87049e+00 1.26774e+00 1.14958e+02 228.954 -5.09501e+00 -5.85165e+00 0.00000e+00 0.00000e+00 2.30200e+01 228.954 9.19384e+01 48.954  0.9331 
1 1 1 16  65  0  o 10 3.73155e+00 1.20218e+00 3.53441e+01 325.590 1.77236e+00  -1.21399e+00 0.00000e+00 0.00000e+00 6.71232e+01 325.590 3.17791e+01 325.590 0.7207 
1 1 1 16  65  1  o 6  6.84647e+00 1.56008e+00 1.37422e+02 101.496 -2.34979e+00 1.15536e+01  0.00000e+00 0.00000e+00 1.12279e+02 101.496 2.51429e+01 281.496 0.9566 
1 1 1 16  65  2  o 9  8.24710e+00 1.59957e+00 1.61636e+02 272.177 6.36406e-01  -1.67415e+01 0.00000e+00 0.00000e+00 1.43428e+02 272.177 1.82078e+01 92.177  0.9697 
1 1 1 16  65  3  o 1  4.04632e+00 1.31918e+00 7.80188e+01 342.202 5.13229e+00  -1.64757e+00 0.00000e+00 0.00000e+00 6.12334e+01 342.202 1.67854e+01 162.202 0.9017 
1 1 1 16  65  4  o 6  5.01341e+00 1.50688e+00 6.65690e+01 91.756  -1.47985e-01 4.82616e+00  0.00000e+00 0.00000e+00 1.03654e+02 91.756  3.70845e+01 91.756  0.8892 
1 1 1 16  65  5  o 12 4.89535e+00 1.50374e+00 6.71987e+01 315.045 3.43566e+00  -3.43024e+00 0.00000e+00 0.00000e+00 9.92001e+01 315.045 3.20014e+01 315.045 0.8899 
1 1 1 16  66  0  o 14 5.44487e+00 1.36382e+00 1.04615e+02 47.848  5.77653e+00  6.38141e+00  0.00000e+00 0.00000e+00 9.03612e+01 47.848  1.42537e+01 227.848 0.9400 
1 1 1 16  66  1  o 7  6.10674e+00 1.56681e+00 1.60106e+02 226.200 -8.72777e+00 -9.10117e+00 0.00000e+00 0.00000e+00 6.32470e+01 226.200 9.68595e+01 46.200  0.9595 
1 1 1 16  66  2  o 6  5.40757e+00 1.55180e+00 8.67438e+01 61.083  3.11513e+00  5.63913e+00  0.00000e+00 0.00000e+00 1.02740e+02 61.083  1.59957e+01 61.083  0.9187 
1 1 1 16  66  3  o 2  4.75079e+00 1.44738e+00 8.41882e+01 263.231 -6.84545e-01 -5.76750e+00 0.00000e+00 0.00000e+00 8.06485e+01 263.231 3.53970e+00 83.231  0.9093 
1 1 1 16  66  4  o 3  3.88056e+00 1.29108e+00 4.32334e+01 359.249 2.94526e+00  -3.85843e-02 0.00000e+00 0.00000e+00 7.61503e+01 359.249 3.29169e+01 359.249 0.8059 
1 1 1 16  66  5  o 16 3.47924e+00 1.19393e+00 8.82553e+01 163.671 -6.20009e+00 1.81648e+00  0.00000e+00 0.00000e+00 3.38489e+01 163.671 5.44064e+01 343.671 0.9190 
1 1 1 16  67  0  f 0  5.77759e+00 1.43192e+00 3.52062e+01 58.515  1.52078e+00  2.48312e+00  0.00000e+00 0.00000e+00 1.41558e+02 58.515  1.06351e+02 58.515  0.8032 
1 1 1 16  67  1  o 14 5.20455e+00 1.49893e+00 1.30789e+02 174.749 -9.56832e+00 8.79414e-01  0.00000e+00 0.00000e+00 5.69430e+01 174.749 7.38462e+01 354.749 0.9464 
1 1 1 16  67  2  o 14 5.21879e+00 1.47520e+00 3.99857e+01 39.529  2.40578e+00  1.98519e+00  0.00000e+00 0.00000e+00 1.22887e+02 39.529  8.29016e+01 39.529  0.8184 
1 1 1 16  67  3  o 12 5.13879e+00 1.52924e+00 1.11517e+02 185.497 -8.10539e+00 -7.80085e-01 0.00000e+00 0.00000e+00 7.20724e+01 185.497 3.94448e+01 5.497   0.9364 
1 1 1 16  67  4  o 19 5.89827e+00 1.53418e+00 9.22726e+01 340.382 7.25890e+00  -2.58730e+00 0.00000e+00 0.00000e+00 1.17695e+02 340.382 2.54224e+01 340.382 0.9327 
1 1 1 16  67  5  o 3  3.82020e+00 1.26328e+00 5.00150e+01 115.222 -1.52332e+00 3.23393e+00  0.00000e+00 0.00000e+00 7.32286e+01 115.222 2.32136e+01 115.222 0.8449 
1 1 1 16  68  0  o 13 4.29758e+00 1.30529e+00 2.43658e+01 65.313  7.36621e-01  1.60252e+00  0.00000e+00 0.00000e+00 8.28140e+01 65.313  5.84482e+01 65.313  0.6549 
1 1 1 16  68  1  o 6  4.65000e+00 1.43906e+00 8.41313e+01 129.268 -3.81780e+00 4.66983e+00  0.00000e+00 0.00000e+00 7.76154e+01 129.268 6.51594e+00 309.268 0.9129 
1 1 1 16  68  2  o 6  5.29508e+00 1.47765e+00 1.08006e+02 187.166 -8.03901e+00 -1.01072e+00 0.00000e+00 0.00000e+00 8.09725e+01 187.166 2.70333e+01 7.166   0.9361 
1 1 1 16  68  3  o 13 3.02197e+00 1.04709e+00 5.03910e+01 325.976 2.74090e+00  -1.85045e+00 0.00000e+00 0.00000e+00 4.53261e+01 325.976 5.06494e+00 145.976 0.8304 
1 1 1 16  68  4  o 6  4.84216e+00 1.49658e+00 8.85025e+01 63.171  2.87092e+00  5.67623e+00  0.00000e+00 0.00000e+00 8.10597e+01 63.171  7.44275e+00 243.171 0.9176 
1 1 1 16  68  5  o 6  7.39376e+00 1.79168e+00 1.03712e+02 171.300 -9.07801e+00 1.38916e+00  0.00000e+00 0.00000e+00 1.62706e+02 171.300 5.89942e+01 171.300 0.9439 
1 1 1 16  69  0  o 18 3.33391e+00 1.11866e+00 6.45033e+01 189.615 -4.30284e+00 -7.28956e-01 0.00000e+00 0.00000e+00 4.67187e+01 189.615 1.77845e+01 9.615   0.8762 
1 1 1 16  69  1  o 5  5.54806e+00 1.56990e+00 1.20719e+02 18.653  8.36069e+00  2.82225e+00  0.00000e+00 0.00000e+00 7.82873e+01 18.653  4.24313e+01 198.653 0.9415 
1 1 1 16  69  2  o 12 4.47980e+00 1.37152e+00 4.37665e+01 332.581 2.80475e+00  -1.45505e+00 0.00000e+00 0.00000e+00 9.64547e+01 332.581 5.26882e+01 332.581 0.8211 
1 1 1 16  69  3  o 2  8.30719e+00 1.68020e+00 1.29569e+02 89.916  1.96877e-02  1.33639e+01  0.00000e+00 0.00000e+00 1.75154e+02 89.916  4.55851e+01 89.916  0.9618 
1 1 1 16  69  4  o 5  4.65950e+00 1.40386e+00 9.56303e+01 166.978 -7.36890e+00 1.70423e+00  0.00000e+00 0.00000e+00 6.99413e+01 166.978 2.56890e+01 346.978 0.9313 
1 1 1 16  70  0  o 7  1.04790e+01 1.45603e+00 1.50997e+02 11.295  2.23685e+01  4.46764e+00  0.00000e+00 0.00000e+00 2.39064e+02 11.295  8.80666e+01 11.295  0.9778 
1 1 1 16  70  1  o 13 5.91376e+00 1.45446e+00 1.13985e+02 239.721 -5.14098e+00 -8.80527e+00 0.00000e+00 0.00000e+00 9.99254e+01 239.721 1.40594e+01 59.721  0.9496 
1 1 1 16  70  2  o 2  6.20399e+00 1.61698e+00 9.77268e+01 104.710 -2.05192e+00 7.81597e+00  0.00000e+00 0.00000e+00 1.23564e+02 104.710 2.58375e+01 104.710 0.9359 
1 1 1 16  70  3  o 10 3.43449e+00 1.15225e+00 4.09873e+01 181.559 -2.81705e+00 -7.66781e-02 0.00000e+00 0.00000e+00 6.32011e+01 181.559 2.22138e+01 181.559 0.7956 
1 1 1 16  70  4  o 9  3.28170e+00 1.13030e+00 3.73418e+01 31.295  2.20855e+00  1.34256e+00  0.00000e+00 0.00000e+00 5.95397e+01 31.295  2.21978e+01 31.295  0.7739 
1 1 1 16  71  0  o 11 5.14007e+00 1.40077e+00 5.09500e+01 87.574  1.74285e-01  4.11451e+00  0.00000e+00 0.00000e+00 1.18841e+02 87.574  6.78912e+01 87.574  0.8679 
1 1 1 16  71  1  o 5  3.28279e+00 1.12035e+00 2.97255e+01 270.914 3.17054e-02  -1.98717e+00 0.00000e+00 0.00000e+00 5.72501e+01 270.914 2.75246e+01 270.914 0.6957 
1 1 1 16  71  2  o 15 5.61871e+00 1.52139e+00 7.59230e+01 213.314 -5.10167e+00 -3.35291e+00 0.00000e+00 0.00000e+00 1.19753e+02 213.314 4.38300e+01 213.314 0.9140 
1 1 1 16  71  3  o 5  3.31382e+00 1.13118e+00 4.97713e+01 296.607 1.61581e+00  -3.22577e+00 0.00000e+00 0.00000e+00 5.71752e+01 296.607 7.40386e+00 296.607 0.8465 
1 1 1 16  71  4  o 19 4.17689e+00 1.32972e+00 1.10982e+01 349.095 8.57194e-01  -1.65148e-01 0.00000e+00 0.00000e+00 5.25554e+01 349.095 4.14573e+01 349.095 0.3996 
1 1 1 16  72  0  o 12 4.09069e+00 1.26742e+00 1.80330e+01 8.954   1.30532e+00  2.05679e-01  0.00000e+00 0.00000e+00 6.73923e+01 8.954   4.93593e+01 8.954   0.5488 
1 1 1 16  72  1  o 2  4.01621e+00 1.29055e+00 6.03720e+01 172.069 -4.17761e+00 5.82018e-01  0.00000e+00 0.00000e+00 7.28843e+01 172.069 1.25122e+01 172.069 0.8714 
1 1 1 16  72  2  f 0  6.78244e+00 1.61233e+00 1.04123e+02 350.506 9.97219e+00  -1.66769e+00 0.00000e+00 0.00000e+00 1.41135e+02 350.506 3.70127e+01 350.506 0.9492 
1 1 1 16  72  3  o 9  3.61444e+00 1.20991e+00 4.77557e+01 167.922 -3.31243e+00 7.08771e-01  0.00000e+00 0.00000e+00 6.72794e+01 167.922 1.95237e+01 167.922 0.8350 
1 1 1 16  73  0  o 11 6.56185e+00 1.56177e+00 1.18994e+02 321.679 8.48032e+00  -6.70248e+00 0.00000e+00 0.00000e+00 1.18807e+02 321.679 1.86558e-01 141.679 0.9526 
1 1 1 16  73  1  o 13 4.15601e+00 1.30813e+00 5.95652e+01 63.276  1.94336e+00  3.85997e+00  0.00000e+00 0.00000e+00 7.88452e+01 63.276  1.92800e+01 63.276  0.8748 
1 1 1 16  73  2  o 11 5.16366e+00 1.49275e+00 7.01995e+01 229.740 -3.67040e+00 -4.33416e+00 0.00000e+00 0.00000e+00 1.08204e+02 229.740 3.80044e+01 229.740 0.9071 
1 1 1 16  73  3  o 7  4.22951e+00 1.32171e+00 2.37801e+01 222.210 -1.41407e+00 -1.28264e+00 0.00000e+00 0.00000e+00 8.61873e+01 222.210 6.24072e+01 222.210 0.6823 
1 1 1 16  74  0  o 8  3.88973e+00 1.23835e+00 6.03097e+01 329.303 4.07179e+00  -2.41737e+00 0.00000e+00 0.00000e+00 7.09052e+01 329.303 1.05955e+01 329.303 0.8869 
1 1 1 16  74  1  o 2  2.94624e+00 1.01639e+00 6.23496e+01 116.487 -1.99593e+00 4.00543e+00  0.00000e+00 0.00000e+00 3.62846e+01 116.487 2.60650e+01 296.487 0.8796 
1 1 1 16  74  2  o 16 3.41587e+00 1.13499e+00 4.42281e+01 96.405  -3.60165e-01 3.20863e+00  0.00000e+00 0.00000e+00 6.31640e+01 96.405  1.89359e+01 96.405  0.8256 
1 1 1 16  74  3  f 0  4.84407e+00 1.41167e+00 8.48159e+01 274.213 5.36218e-01  -7.27933e+00 0.00000e+00 0.00000e+00 8.65910e+01 274.213 1.77505e+00 274.213 0.9287 
1 1 1 16  75  0  f 0  5.15367e+00 1.30032e+00 3.84781e+01 275.688 3.55929e-01  -3.57360e+00 0.00000e+00 0.00000e+00 1.27278e+02 275.688 8.87999e+01 275.688 0.8457 
1 1 1 16  75  1  o 3  3.76603e+00 1.19239e+00 3.40606e+01 298.917 1.25763e+00  -2.27655e+00 0.00000e+00 0.00000e+00 7.70797e+01 298.917 4.30191e+01 298.917 0.7755 
1 1 1 16  75  2  o 5  3.17390e+00 1.08146e+00 3.10310e+01 223.137 -1.68775e+00 -1.58141e+00 0.00000e+00 0.00000e+00 5.87567e+01 223.137 2.77256e+01 223.137 0.7430 
1 1 1 16  75  3  o 2  4.24142e+00 1.32742e+00 6.49905e+01 63.837  2.35394e+00  4.79168e+00  0.00000e+00 0.00000e+00 8.05304e+01 63.837  1.55399e+01 63.837  0.9007 
1 1 1 16  76  0  o 6  4.27518e+00 1.31018e+00 8.71444e+01 246.892 -2.66070e+00 -6.23566e+00 0.00000e+00 0.00000e+00 6.28859e+01 246.892 2.42584e+01 66.892  0.9230 
1 1 1 16  76  1  o 2  3.50674e+00 1.14483e+00 7.44970e+01 23.738  5.28421e+00  2.32382e+00  0.00000e+00 0.00000e+00 4.67325e+01 23.738  2.77645e+01 203.738 0.9087 
1 1 1 16  76  2  o 1  3.97459e+00 1.27643e+00 7.05185e+01 349.075 5.27131e+00  -1.01752e+00 0.00000e+00 0.00000e+00 6.58424e+01 349.075 4.67610e+00 169.075 0.9013 
1 1 1 16  77  0  o 1  3.95610e+00 1.24311e+00 3.32518e+01 221.187 -1.98999e+00 -1.74133e+00 0.00000e+00 0.00000e+00 8.40220e+01 221.187 5.07702e+01 221.187 0.7798 
1 1 1 16  77  1  o 2  3.44520e+00 1.13158e+00 4.43487e+01 329.505 3.08008e+00  -1.81395e+00 0.00000e+00 0.00000e+00 6.63718e+01 329.505 2.20231e+01 329.505 0.8449 
1 1 1 16  77  2  o 14 3.85268e+00 1.21151e+00 5.21217e+01 187.963 -4.31722e+00 -6.03926e-01 0.00000e+00 0.00000e+00 7.63285e+01 187.963 2.42068e+01 187.963 0.8760 
1 1 1 16  78  0  o 3  2.72567e+00 9.47834e-01 4.23807e+01 27.081  2.68303e+00  1.37185e+00  0.00000e+00 0.00000e+00 4.16280e+01 27.081  7.52680e-01 207.081 0.8110 
1 1 1 16  78  1  o 7  4.01845e+00 1.27052e+00 8.41956e+01 259.856 -1.22024e+00 -6.81973e+00 0.00000e+00 0.00000e+00 5.71172e+01 259.856 2.70784e+01 79.856  0.9247 
1 1 1 16  79  0  o 9  3.10321e+00 1.04583e+00 4.92858e+01 160.804 -3.58487e+00 1.24809e+00  0.00000e+00 0.00000e+00 5.15527e+01 160.804 2.26697e+00 160.804 0.8552 
1 1 1 17  0   0  o 18 4.69716e+00 2.68405e+00 9.67869e+01 180.000 -1.86165e+00 0.00000e+00  0.00000e+00 0.00000e+00 7.51738e+01 180.000 2.16131e+01 0.000   0.9528 
1 1 1 17  0   1  o 12 7.41614e+00 3.05295e+00 2.30712e+02 0.000   5.98157e+00  0.00000e+00  0.00000e+00 0.00000e+00 5.44123e+01 0.000   1.76300e+02 180.000 1.0000 
1 1 1 17  0   2  o 17 3.26524e+00 2.18017e+00 6.42644e+01 0.000   1.06195e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.45185e+01 0.000   2.97459e+01 180.000 0.7864 
1 1 1 17  0   3  o 13 3.64561e+00 2.40200e+00 1.71769e+02 0.000   3.03658e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.20939e+01 180.000 2.03863e+02 180.000 0.9954 
1 1 1 17  0   4  o 12 8.57229e+00 4.41447e+00 1.70236e+02 180.000 -3.06744e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.58443e+02 180.000 1.17929e+01 0.000   0.9957 
1 1 1 17  0   5  o 8  7.05093e+00 3.32942e+00 9.30470e+01 180.000 -2.12088e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.70882e+02 180.000 7.78347e+01 180.000 0.9716 
1 1 1 17  0   6  o 9  3.85883e+00 2.57104e+00 1.16334e+02 0.000   2.12787e+00  0.00000e+00  0.00000e+00 0.00000e+00 2.82170e+01 0.000   8.81168e+01 180.000 0.9720 
1 1 1 17  1   0  o 7  1.32898e+01 1.49069e+00 2.49732e+02 67.727  1.31590e+01  3.21279e+01  0.00000e+00 0.00000e+00 2.53477e+02 67.727  3.74526e+00 67.727  0.9855 
1 1 1 17  1   1  o 14 1.16461e+01 1.61504e+00 2.06862e+02 233.370 -1.38774e+01 -1.86655e+01 0.00000e+00 0.00000e+00 2.31161e+02 233.370 2.42988e+01 233.370 0.9783 
1 1 1 17  1   2  o 3  7.74036e+00 1.85007e+00 9.43669e+01 34.349  5.07091e+00  3.46555e+00  0.00000e+00 0.00000e+00 1.77946e+02 34.349  8.35795e+01 34.349  0.9145 
1 1 1 17  1   3  f 0  1.28916e+01 1.62512e+00 1.30322e+02 162.920 -1.63175e+01 5.01374e+00  0.00000e+00 0.00000e+00 3.51118e+02 162.920 2.20796e+02 162.920 0.9703 
1 1 1 17  1   4  o 6  6.33671e+00 2.01530e+00 7.42837e+01 256.614 -8.48263e-01 -3.56466e+00 0.00000e+00 0.00000e+00 1.32945e+02 256.614 5.86612e+01 256.614 0.8492 
1 1 1 17  1   5  o 9  1.41350e+01 1.67976e+00 1.84672e+02 247.832 -1.01154e+01 -2.48271e+01 0.00000e+00 0.00000e+00 3.49611e+02 247.832 1.64940e+02 247.832 0.9812 
1 1 1 17  1   6  o 7  1.50312e+01 1.88394e+00 2.40925e+02 222.170 -2.43581e+01 -2.20637e+01 0.00000e+00 0.00000e+00 3.29460e+02 222.170 8.85350e+01 222.170 0.9847 
1 1 1 17  1   7  o 12 4.83446e+00 1.62045e+00 6.74027e+01 94.872  -3.03488e-01 3.56038e+00  0.00000e+00 0.00000e+00 9.00437e+01 94.872  2.26409e+01 94.872  0.8448 
1 1 1 17  2   0  o 7  1.25013e+01 1.50838e+00 1.87499e+02 87.610  1.01167e+00  2.42391e+01  0.00000e+00 0.00000e+00 2.82815e+02 87.610  9.53164e+01 87.610  0.9792 
1 1 1 17  2   1  o 19 4.41101e+00 1.40070e+00 1.69175e+02 319.980 6.26917e+00  -5.26428e+00 0.00000e+00 0.00000e+00 1.03092e+01 139.980 1.79484e+02 139.980 0.9368 
1 1 1 17  2   2  o 14 1.21531e+01 1.69942e+00 2.00962e+02 292.970 8.77256e+00  -2.06975e+01 0.00000e+00 0.00000e+00 2.56042e+02 292.970 5.50802e+01 292.970 0.9775 
1 1 1 17  2   3  o 4  7.78944e+00 1.83907e+00 1.11570e+02 211.887 -6.54840e+00 -4.07399e+00 0.00000e+00 0.00000e+00 1.68072e+02 211.887 5.65017e+01 211.887 0.9327 
1 1 1 17  2   4  o 10 9.42968e+00 2.05298e+00 2.67152e+02 11.810  1.87632e+01  3.92335e+00  0.00000e+00 0.00000e+00 8.63657e+01 11.810  1.80786e+02 191.810 0.9736 
1 1 1 17  2   5  o 18 6.99718e+00 1.81473e+00 1.74168e+02 152.107 -1.01177e+01 5.35537e+00  0.00000e+00 0.00000e+00 8.33340e+01 152.107 9.08341e+01 332.107 0.9553 
1 1 1 17  2   6  o 14 4.89159e+00 1.62678e+00 8.55957e+01 9.266   4.45311e+00  7.26515e-01  0.00000e+00 0.00000e+00 8.04213e+01 9.266   5.17439e+00 189.266 0.8807 
1 1 1 17  2   7  o 13 4.98355e+00 1.64232e+00 6.14323e+01 210.778 -2.84136e+00 -1.69234e+00 0.00000e+00 0.00000e+00 9.80865e+01 210.778 3.66542e+01 210.778 0.8304 
1 1 1 17  3   0  o 11 1.75806e+01 1.24867e+00 2.40194e+02 281.726 1.03561e+01  -4.98929e+01 0.00000e+00 0.00000e+00 4.28616e+02 281.726 1.88422e+02 281.726 0.9901 
1 1 1 17  3   1  o 6  5.80164e+00 1.63188e+00 1.58108e+02 58.612  4.56568e+00  7.48327e+00  0.00000e+00 0.00000e+00 5.18082e+01 58.612  1.06300e+02 238.612 0.9411 
1 1 1 17  3   2  o 5  6.65040e+00 1.60074e+00 1.14247e+02 227.324 -5.03001e+00 -5.45556e+00 0.00000e+00 0.00000e+00 1.23667e+02 227.324 9.42020e+00 227.324 0.9299 
1 1 1 17  3   3  o 11 1.20126e+01 1.75889e+00 2.59008e+02 80.886  4.60003e+00  2.86731e+01  0.00000e+00 0.00000e+00 1.95323e+02 80.886  6.36842e+01 260.886 0.9826 
1 1 1 17  3   4  o 17 7.10463e+00 2.06657e+00 1.34667e+02 254.102 -1.97794e+00 -6.94442e+00 0.00000e+00 0.00000e+00 1.19197e+02 254.102 1.54706e+01 74.102  0.9279 
1 1 1 17  3   5  o 2  4.35248e+00 1.45039e+00 7.99579e+01 189.110 -4.11279e+00 -6.59472e-01 0.00000e+00 0.00000e+00 6.58498e+01 189.110 1.41082e+01 9.110   0.8696 
1 1 1 17  3   6  o 4  5.72378e+00 1.80855e+00 6.95883e+01 235.529 -2.15041e+00 -3.13223e+00 0.00000e+00 0.00000e+00 1.19081e+02 235.529 4.94925e+01 235.529 0.8553 
1 1 1 17  3   7  o 16 6.16116e+00 1.91194e+00 6.93760e+01 162.698 -3.67490e+00 1.14478e+00  0.00000e+00 0.00000e+00 1.34272e+02 162.698 6.48959e+01 162.698 0.8575 
1 1 1 17  4   0  o 11 4.55270e+00 1.44155e+00 1.70536e+02 30.006  7.24120e+00  4.18178e+00  0.00000e+00 0.00000e+00 6.43606e+00 210.006 1.76972e+02 210.006 0.9381 
1 1 1 17  4   1  f 0  5.83929e+00 1.60135e+00 1.57106e+02 98.602  -1.33537e+00 8.82780e+00  0.00000e+00 0.00000e+00 5.44185e+01 98.602  1.02688e+02 278.602 0.9422 
1 1 1 17  4   2  o 18 1.13586e+01 1.74153e+00 1.93647e+02 208.875 -1.72813e+01 -9.53008e+00 0.00000e+00 0.00000e+00 2.32089e+02 208.875 3.84425e+01 208.875 0.9743 
1 1 1 17  4   3  o 7  5.18245e+00 1.56697e+00 7.30088e+01 150.945 -3.48649e+00 1.93693e+00  0.00000e+00 0.00000e+00 9.91482e+01 150.945 2.61394e+01 150.945 0.8631 
1 1 1 17  4   4  o 17 1.04795e+01 1.89156e+00 1.15352e+02 178.458 -1.01396e+01 2.72856e-01  0.00000e+00 0.00000e+00 2.67749e+02 178.458 1.52396e+02 178.458 0.9493 
1 1 1 17  4   5  o 13 1.07835e+01 1.91812e+00 1.43840e+02 328.346 1.15912e+01  -7.14614e+00 0.00000e+00 0.00000e+00 2.56019e+02 328.346 1.12179e+02 328.346 0.9626 
1 1 1 17  4   6  o 4  8.18374e+00 1.93442e+00 1.77356e+02 82.265  1.71481e+00  1.26245e+01  0.00000e+00 0.00000e+00 1.25378e+02 82.265  5.19779e+01 262.265 0.9599 
1 1 1 17  4   7  o 16 5.60968e+00 1.63749e+00 5.64952e+01 350.686 3.38891e+00  -5.55827e-01 0.00000e+00 0.00000e+00 1.24627e+02 350.686 6.81316e+01 350.686 0.8376 
1 1 1 17  5   0  o 12 8.27134e+00 1.78625e+00 1.47055e+02 160.180 -1.00168e+01 3.61030e+00  0.00000e+00 0.00000e+00 1.55422e+02 160.180 8.36676e+00 160.180 0.9518 
1 1 1 17  5   1  o 8  7.35764e+00 1.75996e+00 1.35535e+02 95.020  -7.72172e-01 8.79015e+00  0.00000e+00 0.00000e+00 1.30788e+02 95.020  4.74730e+00 275.020 0.9415 
1 1 1 17  5   2  f 0  1.25384e+01 1.67915e+00 1.47920e+02 128.800 -1.08239e+01 1.34623e+01  0.00000e+00 0.00000e+00 3.20235e+02 128.800 1.72315e+02 128.800 0.9706 
1 1 1 17  5   3  o 5  1.64845e+01 1.52232e+00 2.62605e+02 344.291 4.51866e+01  -1.27088e+01 0.00000e+00 0.00000e+00 3.65070e+02 344.291 1.02465e+02 344.291 0.9893 
1 1 1 17  5   4  o 5  4.87866e+00 1.54646e+00 1.00436e+02 199.500 -5.04587e+00 -1.78684e+00 0.00000e+00 0.00000e+00 6.88234e+01 199.500 3.16125e+01 19.500  0.9010 
1 1 1 17  5   5  o 3  5.57502e+00 1.64010e+00 7.66462e+01 70.189  1.52663e+00  4.23771e+00  0.00000e+00 0.00000e+00 1.12446e+02 70.189  3.57999e+01 70.189  0.8805 
1 1 1 17  5   6  o 9  6.73463e+00 1.99588e+00 9.49814e+01 279.686 9.07580e-01  -5.31707e+00 0.00000e+00 0.00000e+00 1.39056e+02 279.686 4.40749e+01 279.686 0.9018 
1 1 1 17  5   7  f 0  8.76180e+00 2.10629e+00 2.21226e+02 86.671  8.98875e-01  1.54551e+01  0.00000e+00 0.00000e+00 1.05421e+02 86.671  1.15805e+02 266.671 0.9671 
1 1 1 17  6   0  o 17 7.35047e+00 1.73139e+00 1.64018e+02 126.126 -6.42971e+00 8.80903e+00  0.00000e+00 0.00000e+00 1.05110e+02 126.126 5.89072e+01 306.126 0.9530 
1 1 1 17  6   1  o 18 5.68342e+00 1.59099e+00 1.06385e+02 7.570   5.86792e+00  7.79776e-01  0.00000e+00 0.00000e+00 9.26879e+01 7.570   1.36967e+01 187.570 0.9111 
1 1 1 17  6   2  o 7  1.05796e+01 1.71940e+00 1.60516e+02 310.116 9.94554e+00  -1.18039e+01 0.00000e+00 0.00000e+00 2.33047e+02 310.116 7.25305e+01 310.116 0.9670 
1 1 1 17  6   3  o 13 1.45190e+01 1.54741e+00 2.25260e+02 137.935 -2.59075e+01 2.33805e+01  0.00000e+00 0.00000e+00 3.25488e+02 137.935 1.00228e+02 137.935 0.9856 
1 1 1 17  6   4  o 17 8.28635e+00 1.86502e+00 1.29826e+02 328.150 8.12455e+00  -5.04731e+00 0.00000e+00 0.00000e+00 1.72081e+02 328.150 4.22551e+01 328.150 0.9462 
1 1 1 17  6   5  o 13 5.20324e+00 1.58949e+00 1.27365e+02 83.711  7.91374e-01  7.18090e+00  0.00000e+00 0.00000e+00 5.86349e+01 83.711  6.87305e+01 263.711 0.9280 
1 1 1 17  6   6  o 14 4.81790e+00 1.59121e+00 4.31099e+01 262.452 -3.01000e-01 -2.27175e+00 0.00000e+00 0.00000e+00 9.43346e+01 262.452 5.12248e+01 262.452 0.7403 
1 1 1 17  6   7  o 17 4.22676e+00 1.46047e+00 1.22062e+02 268.447 -1.73025e-01 -6.38082e+00 0.00000e+00 0.00000e+00 2.74946e+01 268.447 9.45673e+01 88.447  0.9179 
1 1 1 17  7   0  o 9  4.56800e+00 1.42338e+00 5.60857e+01 146.389 -2.32174e+00 1.54323e+00  0.00000e+00 0.00000e+00 8.30828e+01 146.389 2.69971e+01 146.389 0.7930 
1 1 1 17  7   1  o 11 1.05767e+01 1.72018e+00 1.36524e+02 77.899  2.75316e+00  1.28413e+01  0.00000e+00 0.00000e+00 2.54289e+02 77.899  1.17765e+02 77.899  0.9611 
1 1 1 17  7   2  o 8  4.79626e+00 1.51674e+00 1.25116e+02 258.667 -1.24520e+00 -6.21286e+00 0.00000e+00 0.00000e+00 4.41222e+01 258.667 8.09942e+01 78.667  0.9173 
1 1 1 17  7   3  f 0  4.93264e+00 1.53324e+00 4.32666e+01 270.553 2.21751e-02  -2.29732e+00 0.00000e+00 0.00000e+00 9.74180e+01 270.553 5.41514e+01 270.553 0.7410 
1 1 1 17  7   4  o 11 5.54382e+00 1.64932e+00 1.25519e+02 282.169 1.49841e+00  -6.94850e+00 0.00000e+00 0.00000e+00 7.23072e+01 282.169 5.32122e+01 102.169 0.9267 
1 1 1 17  7   5  o 17 6.67675e+00 1.79597e+00 1.37860e+02 250.071 -2.98197e+00 -8.22449e+00 0.00000e+00 0.00000e+00 1.04159e+02 250.071 3.37010e+01 70.071  0.9410 
1 1 1 17  7   6  o 9  7.28736e+00 1.89960e+00 1.15664e+02 269.781 -2.88467e-02 -7.56664e+00 0.00000e+00 0.00000e+00 1.45880e+02 269.781 3.02160e+01 269.781 0.9314 
1 1 1 17  7   7  o 7  6.84968e+00 1.89822e+00 1.77536e+02 357.645 1.11286e+01  -4.57592e-01 0.00000e+00 0.00000e+00 7.43463e+01 357.645 1.03190e+02 177.645 0.9540 
1 1 1 17  8   0  o 16 4.66398e+00 1.44919e+00 1.74707e+01 352.024 8.64470e-01  -1.21123e-01 0.00000e+00 0.00000e+00 5.41225e+01 352.024 3.66518e+01 352.024 0.3996 
1 1 1 17  8   1  o 3  6.40301e+00 1.60216e+00 1.16259e+02 229.897 -4.68127e+00 -5.55856e+00 0.00000e+00 0.00000e+00 1.12271e+02 229.897 3.98825e+00 49.897  0.9284 
1 1 1 17  8   2  o 17 9.59776e+00 1.78044e+00 1.48940e+02 113.944 -5.20563e+00 1.17227e+01  0.00000e+00 0.00000e+00 2.05553e+02 113.944 5.66128e+01 113.944 0.9602 
1 1 1 17  8   3  o 5  7.75651e+00 1.86838e+00 1.55835e+02 26.718  9.40076e+00  4.73170e+00  0.00000e+00 0.00000e+00 1.28131e+02 26.718  2.77042e+01 206.718 0.9512 
1 1 1 17  8   4  o 4  1.14214e+01 1.85285e+00 1.74213e+02 255.227 -4.54489e+00 -1.72344e+01 0.00000e+00 0.00000e+00 2.53046e+02 255.227 7.88333e+01 255.227 0.9715 
1 1 1 17  8   5  o 10 4.87122e+00 1.58495e+00 7.28910e+01 11.937  3.79682e+00  8.02707e-01  0.00000e+00 0.00000e+00 8.82527e+01 11.937  1.53617e+01 11.937  0.8588 
1 1 1 17  8   6  o 4  8.16432e+00 1.98771e+00 1.48081e+02 124.763 -5.84116e+00 8.41602e+00  0.00000e+00 0.00000e+00 1.50752e+02 124.763 2.67141e+00 124.763 0.9499 
1 1 1 17  8   7  o 1  5.57447e+00 1.78470e+00 8.61064e+01 355.686 4.73211e+00  -3.56986e-01 0.00000e+00 0.00000e+00 1.04511e+02 355.686 1.84043e+01 355.686 0.8871 
1 1 1 17  9   0  o 7  6.36537e+00 1.64186e+00 1.33957e+02 141.536 -6.34507e+00 5.04050e+00  0.00000e+00 0.00000e+00 9.49575e+01 141.536 3.89997e+01 321.536 0.9361 
1 1 1 17  9   1  o 5  6.17855e+00 1.68398e+00 9.66613e+01 142.184 -4.38363e+00 3.40223e+00  0.00000e+00 0.00000e+00 1.18230e+02 142.184 2.15686e+01 142.184 0.9047 
1 1 1 17  9   2  o 6  8.34105e+00 1.81836e+00 2.13003e+02 6.707   1.54653e+01  1.81854e+00  0.00000e+00 0.00000e+00 9.73609e+01 6.707   1.15642e+02 186.706 0.9673 
1 1 1 17  9   3  o 15 8.33169e+00 1.81596e+00 1.23683e+02 128.622 -5.55009e+00 6.94705e+00  0.00000e+00 0.00000e+00 1.78362e+02 128.622 5.46796e+01 128.622 0.9420 
1 1 1 17  9   4  o 4  9.70625e+00 1.83862e+00 1.11116e+02 201.703 -9.05667e+00 -3.60462e+00 0.00000e+00 0.00000e+00 2.42892e+02 201.703 1.31776e+02 201.703 0.9472 
1 1 1 17  9   5  o 17 5.91001e+00 1.73975e+00 1.53340e+01 138.751 -6.71747e-01 5.89087e-01  0.00000e+00 0.00000e+00 7.74047e+01 138.751 6.20707e+01 138.751 0.4074 
1 1 1 17  9   6  o 5  8.33131e+00 2.11874e+00 1.35656e+02 183.683 -8.78375e+00 -5.65357e-01 0.00000e+00 0.00000e+00 1.66550e+02 183.683 3.08946e+01 183.683 0.9414 
1 1 1 17  9   7  o 4  4.89122e+00 1.61988e+00 1.02023e+02 309.652 3.52414e+00  -4.25213e+00 0.00000e+00 0.00000e+00 6.84534e+01 309.652 3.35695e+01 129.652 0.9042 
1 1 1 17  10  0  f 0  1.34353e+01 1.49818e+00 1.68978e+02 225.538 -1.64646e+01 -1.67765e+01 0.00000e+00 0.00000e+00 3.36060e+02 225.538 1.67081e+02 225.538 0.9785 
1 1 1 17  10  1  o 11 6.31108e+00 1.61820e+00 9.42150e+01 218.323 -4.50783e+00 -3.56300e+00 0.00000e+00 0.00000e+00 1.26127e+02 218.323 3.19120e+01 218.323 0.9082 
1 1 1 17  10  2  o 15 1.06600e+01 1.71850e+00 1.49736e+02 21.326  1.38538e+01  5.40857e+00  0.00000e+00 0.00000e+00 2.46260e+02 21.326  9.65237e+01 21.326  0.9658 
1 1 1 17  10  3  o 4  6.14350e+00 1.72437e+00 7.10535e+01 237.765 -2.12277e+00 -3.36637e+00 0.00000e+00 0.00000e+00 1.32926e+02 237.765 6.18726e+01 237.765 0.8627 
1 1 1 17  10  4  o 13 4.16046e+00 1.38794e+00 8.39713e+01 40.854  3.19634e+00  2.76426e+00  0.00000e+00 0.00000e+00 5.56630e+01 40.854  2.83083e+01 220.854 0.8717 
1 1 1 17  10  5  o 11 5.98563e+00 1.80441e+00 1.65228e+02 224.056 -6.87911e+00 -6.65600e+00 0.00000e+00 0.00000e+00 5.29343e+01 224.056 1.12294e+02 44.056  0.9462 
1 1 1 17  10  6  o 19 6.62431e+00 1.92424e+00 1.42854e+02 353.208 8.24145e+00  -9.81617e-01 0.00000e+00 0.00000e+00 9.64852e+01 353.208 4.63691e+01 173.208 0.9377 
1 1 1 17  10  7  o 13 4.17747e+00 1.42697e+00 6.15069e+01 12.996  3.16679e+00  7.30868e-01  0.00000e+00 0.00000e+00 7.16351e+01 12.996  1.01282e+01 12.996  0.8269 
1 1 1 17  11  0  o 3  7.04932e+00 1.66698e+00 1.52989e+02 86.927  5.40967e-01  1.00766e+01  0.00000e+00 0.00000e+00 1.04024e+02 86.927  4.89650e+01 266.927 0.9491 
1 1 1 17  11  1  o 14 4.45512e+00 1.42603e+00 8.23519e+01 187.001 -3.94660e+00 -4.84640e-01 0.00000e+00 0.00000e+00 6.53751e+01 187.001 1.69768e+01 7.001   0.8626 
1 1 1 17  11  2  o 10 8.74900e+00 1.78202e+00 1.42757e+02 33.789  9.29858e+00  6.22229e+00  0.00000e+00 0.00000e+00 1.78349e+02 33.789  3.55922e+01 33.789  0.9542 
1 1 1 17  11  3  o 5  1.51782e+01 1.45377e+00 2.16872e+02 80.221  6.00045e+00  3.48164e+01  0.00000e+00 0.00000e+00 3.58919e+02 80.221  1.42047e+02 80.221  0.9857 
1 1 1 17  11  4  o 10 1.39033e+01 1.60585e+00 1.55890e+02 190.051 -2.23721e+01 -3.96531e+00 0.00000e+00 0.00000e+00 3.67499e+02 190.051 2.11609e+02 190.051 0.9777 
1 1 1 17  11  5  o 11 5.26334e+00 1.67179e+00 6.04142e+01 12.348  3.28835e+00  7.19838e-01  0.00000e+00 0.00000e+00 1.08623e+02 12.348  4.82092e+01 12.348  0.8338 
1 1 1 17  11  6  o 16 8.46712e+00 2.09652e+00 6.94498e+01 153.602 -4.13483e+00 2.05236e+00  0.00000e+00 0.00000e+00 2.18839e+02 153.602 1.49389e+02 153.602 0.8836 
1 1 1 17  11  7  o 11 4.73623e+00 1.57493e+00 1.32033e+02 110.853 -2.56558e+00 6.73500e+00  0.00000e+00 0.00000e+00 3.73285e+01 110.853 9.47041e+01 290.853 0.9278 
1 1 1 17  12  0  o 8  4.47643e+00 1.40923e+00 6.56200e+01 112.912 -1.24745e+00 2.95143e+00  0.00000e+00 0.00000e+00 7.60770e+01 112.912 1.04570e+01 112.912 0.8240 
1 1 1 17  12  1  o 14 7.33727e+00 1.71458e+00 1.24830e+02 193.019 -8.14365e+00 -1.88296e+00 0.00000e+00 0.00000e+00 1.39758e+02 193.019 1.49272e+01 193.019 0.9381 
1 1 1 17  12  2  o 2  7.45315e+00 1.80243e+00 1.29184e+02 240.096 -4.08755e+00 -7.10742e+00 0.00000e+00 0.00000e+00 1.39383e+02 240.096 1.01994e+01 240.096 0.9369 
1 1 1 17  12  3  f 0  5.72700e+00 1.58800e+00 1.53219e+01 46.006  6.03050e-01  6.24598e-01  0.00000e+00 0.00000e+00 7.23387e+01 46.006  5.70168e+01 46.006  0.3978 
1 1 1 17  12  4  o 11 7.80769e+00 1.77345e+00 1.16664e+02 351.267 8.46731e+00  -1.30069e+00 0.00000e+00 0.00000e+00 1.65807e+02 351.267 4.91437e+01 351.267 0.9397 
1 1 1 17  12  5  o 7  4.84130e+00 1.53484e+00 7.88538e+01 167.602 -4.33407e+00 9.52721e-01  0.00000e+00 0.00000e+00 8.49541e+01 167.602 6.10026e+00 167.602 0.8785 
1 1 1 17  12  6  o 16 5.09697e+00 1.60853e+00 6.28815e+01 15.081  3.34264e+00  9.00733e-01  0.00000e+00 0.00000e+00 1.01904e+02 15.081  3.90223e+01 15.081  0.8391 
1 1 1 17  12  7  o 8  4.07466e+00 1.40429e+00 9.69683e+01 327.181 4.31221e+00  -2.78106e+00 0.00000e+00 0.00000e+00 4.37946e+01 327.181 5.31737e+01 147.181 0.8963 
1 1 1 17  13  0  o 8  8.92100e+00 1.70031e+00 2.15183e+02 323.202 1.41465e+01  -1.05820e+01 0.00000e+00 0.00000e+00 1.17653e+02 323.202 9.75299e+01 143.202 0.9713 
1 1 1 17  13  1  o 13 4.52731e+00 1.40644e+00 7.05565e+01 359.186 3.50432e+00  -4.97961e-02 0.00000e+00 0.00000e+00 7.58554e+01 359.186 5.29888e+00 359.186 0.8413 
1 1 1 17  13  2  o 14 9.64764e+00 1.75731e+00 2.04079e+02 333.577 1.54150e+01  -7.65976e+00 0.00000e+00 0.00000e+00 1.56032e+02 333.577 4.80474e+01 153.577 0.9705 
1 1 1 17  13  3  o 19 1.12223e+01 1.72993e+00 1.69928e+02 171.971 -1.81552e+01 2.56087e+00  0.00000e+00 0.00000e+00 2.49974e+02 171.971 8.00457e+01 171.971 0.9723 
1 1 1 17  13  4  o 3  9.08675e+00 1.92775e+00 2.16216e+02 51.131  1.05057e+01  1.30345e+01  0.00000e+00 0.00000e+00 1.23004e+02 51.131  9.32115e+01 231.131 0.9697 
1 1 1 17  13  5  o 2  5.05407e+00 2.27861e+00 1.20324e+02 66.577  1.71843e+00  3.96668e+00  0.00000e+00 0.00000e+00 4.99802e+01 66.577  7.03434e+01 246.577 0.8749 
1 1 1 17  13  6  f 0  5.12648e+00 1.64951e+00 5.84086e+01 112.537 -1.24530e+00 3.00095e+00  0.00000e+00 0.00000e+00 1.04905e+02 112.537 4.64969e+01 112.537 0.8268 
1 1 1 17  13  7  o 14 5.35725e+00 1.70432e+00 1.16354e+02 78.136  1.34888e+00  6.42064e+00  0.00000e+00 0.00000e+00 7.36532e+01 78.136  4.27005e+01 258.135 0.9203 
1 1 1 17  14  0  o 7  6.13148e+00 1.65562e+00 1.13791e+02 355.503 6.57296e+00  -5.16901e-01 0.00000e+00 0.00000e+00 1.03049e+02 355.503 1.07420e+01 175.503 0.9207 
1 1 1 17  14  1  o 10 7.79151e+00 1.61323e+00 1.62056e+02 216.286 -9.86250e+00 -7.24099e+00 0.00000e+00 0.00000e+00 1.24911e+02 216.286 3.71445e+01 36.286  0.9582 
1 1 1 17  14  2  o 9  4.42260e+00 1.42711e+00 6.03533e+01 11.862  2.77288e+00  5.82433e-01  0.00000e+00 0.00000e+00 7.51870e+01 11.862  1.48337e+01 11.862  0.7969 
1 1 1 17  14  3  o 18 3.65429e+00 1.25792e+00 2.48078e+01 198.456 -1.11811e+00 -3.73159e-01 0.00000e+00 0.00000e+00 4.63646e+01 198.456 2.15568e+01 198.456 0.5061 
1 1 1 17  14  4  o 3  6.13683e+00 1.64891e+00 8.79735e+01 347.946 5.45160e+00  -1.16418e+00 0.00000e+00 0.00000e+00 1.25885e+02 347.946 3.79113e+01 347.946 0.9052 
1 1 1 17  14  5  o 6  3.57899e+00 1.75017e+00 2.62625e+01 195.104 -8.81377e-01 -2.37880e-01 0.00000e+00 0.00000e+00 3.08978e+01 195.104 4.63526e+00 195.104 0.4147 
1 1 1 17  14  6  o 16 6.27355e+00 1.68616e+00 6.41398e+01 331.207 3.72982e+00  -2.04988e+00 0.00000e+00 0.00000e+00 1.46792e+02 331.207 8.26526e+01 331.207 0.8727 
1 1 1 17  14  7  o 19 5.91896e+00 1.79081e+00 9.97743e+01 159.211 -5.52416e+00 2.09725e+00  0.00000e+00 0.00000e+00 1.08013e+02 159.211 8.23860e+00 159.211 0.9109 
1 1 1 17  15  0  o 12 1.12622e+01 1.56704e+00 1.29098e+02 3.182   1.44616e+01  8.04081e-01  0.00000e+00 0.00000e+00 2.88273e+02 3.182   1.59175e+02 3.182   0.9648 
1 1 1 17  15  1  f 0  6.28206e+00 1.68646e+00 5.06655e+01 135.741 -2.16755e+00 2.11219e+00  0.00000e+00 0.00000e+00 1.45375e+02 135.741 9.47093e+01 135.741 0.8119 
1 1 1 17  15  2  o 15 4.61713e+00 1.45187e+00 8.62187e+01 337.788 4.18063e+00  -1.70706e+00 0.00000e+00 0.00000e+00 7.01790e+01 337.788 1.60397e+01 157.788 0.8808 
1 1 1 17  15  3  o 11 6.37296e+00 1.71429e+00 7.82365e+01 123.408 -2.66420e+00 4.03920e+00  0.00000e+00 0.00000e+00 1.39888e+02 123.408 6.16519e+01 123.408 0.8895 
1 1 1 17  15  4  o 6  7.00778e+00 1.69367e+00 1.00028e+02 84.547  6.67787e-01  6.99482e+00  0.00000e+00 0.00000e+00 1.49737e+02 84.547  4.97090e+01 84.547  0.9258 
1 1 1 17  15  5  o 7  8.05062e+00 2.07621e+00 1.31605e+02 35.920  6.75512e+00  4.89345e+00  0.00000e+00 0.00000e+00 1.59217e+02 35.920  2.76126e+01 35.920  0.9380 
1 1 1 17  15  6  o 12 5.46402e+00 1.66550e+00 1.13958e+02 208.134 -5.88879e+00 -3.14881e+00 0.00000e+00 0.00000e+00 8.00752e+01 208.134 3.38824e+01 28.134  0.9217 
1 1 1 17  15  7  o 13 6.36248e+00 1.81349e+00 1.27567e+02 42.126  5.92758e+00  5.36082e+00  0.00000e+00 0.00000e+00 1.01728e+02 42.126  2.58389e+01 222.126 0.9352 
1 1 1 17  16  0  o 14 5.31417e+00 1.49710e+00 1.36137e+02 15.877  7.23542e+00  2.05796e+00  0.00000e+00 0.00000e+00 5.38758e+01 15.877  8.22610e+01 195.877 0.9309 
1 1 1 17  16  1  o 3  5.82574e+00 1.65868e+00 1.02391e+02 308.114 3.55999e+00  -4.53791e+00 0.00000e+00 0.00000e+00 1.01045e+02 308.114 1.34552e+00 128.114 0.9086 
1 1 1 17  16  2  o 8  7.05563e+00 1.72390e+00 1.06791e+02 283.106 1.63021e+00  -7.00207e+00 0.00000e+00 0.00000e+00 1.44895e+02 283.106 3.81042e+01 283.106 0.9276 
1 1 1 17  16  3  f 0  5.91960e+00 1.67876e+00 2.11280e+02 330.076 1.03766e+01  -5.97261e+00 0.00000e+00 0.00000e+00 6.75681e+00 330.076 2.04524e+02 150.076 0.9573 
1 1 1 17  16  4  o 15 1.17050e+01 1.68436e+00 1.97130e+02 79.771  4.13113e+00  2.28930e+01  0.00000e+00 0.00000e+00 2.43661e+02 79.771  4.65317e+01 79.771  0.9783 
1 1 1 17  16  5  o 18 1.16382e+01 1.93921e+00 1.56217e+02 249.223 -5.60028e+00 -1.47607e+01 0.00000e+00 0.00000e+00 2.77545e+02 249.223 1.21328e+02 249.223 0.9678 
1 1 1 17  16  6  o 4  5.68643e+00 1.75444e+00 1.93329e+02 267.394 -4.80749e-01 -1.05625e+01 0.00000e+00 0.00000e+00 1.51043e+01 267.394 1.78225e+02 87.394  0.9515 
1 1 1 17  16  7  o 15 5.14507e+00 1.58299e+00 8.27490e+01 38.122  3.87172e+00  3.03826e+00  0.00000e+00 0.00000e+00 9.40114e+01 38.122  1.12623e+01 38.122  0.8915 
1 1 1 17  17  0  o 18 1.77916e+01 1.27718e+00 2.51406e+02 258.046 -1.09609e+01 -5.17725e+01 0.00000e+00 0.00000e+00 4.25420e+02 258.046 1.74014e+02 258.046 0.9905 
1 1 1 17  17  1  o 8  6.06103e+00 1.56843e+00 1.91826e+02 132.392 -8.00938e+00 8.77371e+00  0.00000e+00 0.00000e+00 3.10792e+01 132.392 1.60747e+02 312.392 0.9569 
1 1 1 17  17  2  o 15 5.22033e+00 1.55615e+00 6.56838e+01 347.917 3.55691e+00  -7.61446e-01 0.00000e+00 0.00000e+00 1.04543e+02 347.917 3.88595e+01 347.917 0.8480 
1 1 1 17  17  3  o 17 5.62600e+00 1.69372e+00 1.11348e+02 205.788 -5.34751e+00 -2.58372e+00 0.00000e+00 0.00000e+00 8.59340e+01 205.788 2.54141e+01 25.788  0.9114 
1 1 1 17  17  4  o 14 1.15216e+01 1.70563e+00 1.62791e+02 21.326  1.68283e+01  6.56989e+00  0.00000e+00 0.00000e+00 2.68256e+02 21.326  1.05465e+02 21.326  0.9719 
1 1 1 17  17  5  o 8  4.75428e+00 1.54601e+00 6.47181e+01 323.239 2.77543e+00  -2.07331e+00 0.00000e+00 0.00000e+00 8.89279e+01 323.239 2.42097e+01 323.239 0.8392 
1 1 1 17  17  6  o 7  4.52461e+00 1.48255e+00 7.28437e+01 177.374 -3.78122e+00 1.73408e-01  0.00000e+00 0.00000e+00 7.61334e+01 177.374 3.28972e+00 177.374 0.8547 
1 1 1 17  17  7  o 5  6.29230e+00 1.87707e+00 5.72118e+01 326.878 2.90592e+00  -1.89590e+00 0.00000e+00 0.00000e+00 1.46338e+02 326.878 8.91264e+01 326.878 0.8395 
1 1 1 17  18  0  o 14 6.72110e+00 1.72035e+00 1.55152e+02 354.580 9.66875e+00  -9.17335e-01 0.00000e+00 0.00000e+00 8.92966e+01 354.580 6.58555e+01 174.580 0.9470 
1 1 1 17  18  1  o 13 6.60442e+00 1.69063e+00 1.24813e+02 339.571 7.02645e+00  -2.61720e+00 0.00000e+00 0.00000e+00 1.11406e+02 339.571 1.34064e+01 159.571 0.9307 
1 1 1 17  18  2  f 0  1.12951e+01 1.62994e+00 3.03595e+02 81.287  5.01561e+00  3.27258e+01  0.00000e+00 0.00000e+00 1.24122e+02 81.287  1.79472e+02 261.287 0.9848 
1 1 1 17  18  3  o 5  7.33635e+00 1.84514e+00 1.73096e+02 262.077 -1.57664e+00 -1.13286e+01 0.00000e+00 0.00000e+00 9.65208e+01 262.077 7.65750e+01 82.077  0.9552 
1 1 1 17  18  4  o 7  6.46091e+00 1.74768e+00 1.89608e+02 249.046 -4.10683e+00 -1.07246e+01 0.00000e+00 0.00000e+00 4.79930e+01 249.046 1.41615e+02 69.046  0.9554 
1 1 1 17  18  5  o 17 4.64773e+00 1.51088e+00 8.11745e+01 75.723  1.07194e+00  4.21258e+00  0.00000e+00 0.00000e+00 7.55409e+01 75.723  5.63357e+00 255.723 0.8756 
1 1 1 17  18  6  o 5  4.55958e+00 1.50741e+00 2.79883e+01 194.919 -1.39241e+00 -3.70983e-01 0.00000e+00 0.00000e+00 7.40925e+01 194.919 4.61041e+01 194.919 0.5812 
1 1 1 17  18  7  o 9  7.09047e+00 2.06658e+00 1.90750e+02 312.178 7.68339e+00  -8.48020e+00 0.00000e+00 0.00000e+00 7.02325e+01 312.178 1.20517e+02 132.178 0.9553 
1 1 1 17  19  0  o 3  6.23947e+00 1.59599e+00 1.70116e+02 239.351 -5.43813e+00 -9.17746e+00 0.00000e+00 0.00000e+00 5.79737e+01 239.351 1.12142e+02 59.351  0.9519 
1 1 1 17  19  1  o 9  4.82228e+00 1.49034e+00 1.01580e+02 33.145  4.19568e+00  2.73983e+00  0.00000e+00 0.00000e+00 6.40199e+01 33.145  3.75602e+01 213.145 0.8936 
1 1 1 17  19  2  o 17 5.46369e+00 1.57588e+00 6.84387e+01 108.558 -1.18648e+00 3.53402e+00  0.00000e+00 0.00000e+00 1.10589e+02 108.558 4.21503e+01 108.558 0.8522 
1 1 1 17  19  3  o 8  5.41487e+00 1.58943e+00 1.16662e+02 220.825 -5.07582e+00 -4.38523e+00 0.00000e+00 0.00000e+00 7.54304e+01 220.825 4.12312e+01 40.825  0.9221 
1 1 1 17  19  4  o 13 5.87887e+00 1.64705e+00 5.21887e+01 4.760   3.20952e+00  2.67229e-01  0.00000e+00 0.00000e+00 1.34501e+02 4.760   8.23119e+01 4.760   0.8251 
1 1 1 17  19  5  o 7  9.22122e+00 1.96080e+00 1.20681e+02 26.768  8.20872e+00  4.14079e+00  0.00000e+00 0.00000e+00 2.14478e+02 26.768  9.37972e+01 26.768  0.9439 
1 1 1 17  19  6  o 1  4.57752e+00 1.51749e+00 4.67376e+01 262.403 -3.29338e-01 -2.46929e+00 0.00000e+00 0.00000e+00 8.79763e+01 262.403 4.12387e+01 262.403 0.7640 
1 1 1 17  19  7  o 12 6.00068e+00 1.88209e+00 3.74904e+01 201.313 -2.00543e+00 -7.82398e-01 0.00000e+00 0.00000e+00 1.29280e+02 201.313 9.17900e+01 201.313 0.7213 
1 1 1 17  20  0  o 14 6.73992e+00 1.66349e+00 1.66206e+02 259.122 -2.03709e+00 -1.06004e+01 0.00000e+00 0.00000e+00 8.03155e+01 259.122 8.58901e+01 79.122  0.9525 
1 1 1 17  20  1  o 3  7.46057e+00 1.74366e+00 1.22063e+02 282.161 1.80847e+00  -8.39183e+00 0.00000e+00 0.00000e+00 1.47362e+02 282.161 2.52991e+01 282.161 0.9398 
1 1 1 17  20  2  o 18 3.85467e+00 1.28850e+00 4.42491e+01 54.409  1.26651e+00  1.76959e+00  0.00000e+00 0.00000e+00 6.31531e+01 54.409  1.89040e+01 54.409  0.7247 
1 1 1 17  20  3  o 5  7.10936e+00 1.76462e+00 1.69941e+02 74.432  3.07279e+00  1.10292e+01  0.00000e+00 0.00000e+00 9.13188e+01 74.432  7.86224e+01 254.432 0.9553 
1 1 1 17  20  4  o 6  9.36022e+00 1.81999e+00 2.21500e+02 212.480 -1.63676e+01 -1.04191e+01 0.00000e+00 0.00000e+00 1.29340e+02 212.480 9.21598e+01 32.480  0.9739 
1 1 1 17  20  5  o 12 9.12688e+00 1.94029e+00 2.30758e+02 343.316 1.68731e+01  -5.05692e+00 0.00000e+00 0.00000e+00 1.10529e+02 343.316 1.20229e+02 163.316 0.9712 
1 1 1 17  20  6  o 3  6.65637e+00 1.89191e+00 1.47809e+02 113.139 -3.49829e+00 8.18602e+00  0.00000e+00 0.00000e+00 9.37105e+01 113.139 5.40987e+01 293.139 0.9420 
1 1 1 17  20  7  o 15 6.55965e+00 1.84235e+00 1.24022e+02 254.750 -2.10399e+00 -7.71758e+00 0.00000e+00 0.00000e+00 1.12336e+02 254.750 1.16863e+01 74.750  0.9352 
1 1 1 17  21  0  o 18 6.55544e+00 1.71710e+00 1.70898e+02 195.484 -9.66685e+00 -2.67802e+00 0.00000e+00 0.00000e+00 6.79238e+01 195.484 1.02974e+02 15.484  0.9488 
1 1 1 17  21  1  o 11 4.77167e+00 1.46885e+00 6.12259e+01 237.602 -1.75541e+00 -2.76634e+00 0.00000e+00 0.00000e+00 9.06763e+01 237.602 2.94503e+01 237.602 0.8285 
1 1 1 17  21  2  o 8  4.66278e+00 1.45487e+00 6.72801e+01 144.421 -2.92570e+00 2.09300e+00  0.00000e+00 0.00000e+00 8.43853e+01 144.421 1.71052e+01 144.421 0.8460 
1 1 1 17  21  3  o 4  5.56154e+00 1.57781e+00 1.46060e+02 306.725 5.18371e+00  -6.94825e+00 0.00000e+00 0.00000e+00 5.51299e+01 306.725 9.09297e+01 126.725 0.9404 
1 1 1 17  21  4  o 17 1.10564e+01 1.69281e+00 1.43726e+02 345.975 1.56812e+01  -3.91712e+00 0.00000e+00 0.00000e+00 2.68400e+02 345.975 1.24674e+02 345.975 0.9686 
1 1 1 17  21  5  o 9  4.38077e+00 1.44901e+00 1.17061e+02 173.007 -6.18623e+00 7.58776e-01  0.00000e+00 0.00000e+00 3.74057e+01 173.007 7.96557e+01 353.007 0.9158 
1 1 1 17  21  6  f 0  6.14018e+00 1.79145e+00 8.96787e+01 83.735  5.87060e-01  5.34780e+00  0.00000e+00 0.00000e+00 1.23514e+02 83.735  3.38355e+01 83.735  0.9015 
1 1 1 17  21  7  o 1  5.96597e+00 1.89342e+00 1.49129e+02 304.348 4.76143e+00  -6.96748e+00 0.00000e+00 0.00000e+00 6.66312e+01 304.348 8.24980e+01 124.348 0.9387 
1 1 1 17  22  0  o 18 5.45781e+00 1.54338e+00 1.46668e+02 126.257 -4.69287e+00 6.39856e+00  0.00000e+00 0.00000e+00 4.92041e+01 126.257 9.74635e+01 306.257 0.9347 
1 1 1 17  22  1  o 12 6.83996e+00 1.69427e+00 9.09049e+01 253.681 -1.62270e+00 -5.54243e+00 0.00000e+00 0.00000e+00 1.47907e+02 253.681 5.70016e+01 253.681 0.9087 
1 1 1 17  22  2  f 0  4.57293e+00 1.44890e+00 7.65124e+01 166.530 -3.75434e+00 8.99275e-01  0.00000e+00 0.00000e+00 7.43153e+01 166.530 2.19714e+00 346.530 0.8579 
1 1 1 17  22  3  o 15 4.17374e+00 1.36541e+00 6.80401e+01 58.528  1.81369e+00  2.96298e+00  0.00000e+00 0.00000e+00 6.67722e+01 58.528  1.26796e+00 238.528 0.8397 
1 1 1 17  22  4  o 19 8.08822e+00 1.77911e+00 1.51277e+02 172.817 -1.19508e+01 1.50623e+00  0.00000e+00 0.00000e+00 1.46767e+02 172.817 4.51019e+00 352.817 0.9575 
1 1 1 17  22  5  o 2  6.07507e+00 1.74923e+00 1.36526e+02 97.193  -1.03008e+00 8.16171e+00  0.00000e+00 0.00000e+00 8.26424e+01 97.193  5.38834e+01 277.193 0.9371 
1 1 1 17  22  6  o 15 5.17199e+00 1.65069e+00 1.00850e+02 17.155  5.35438e+00  1.65286e+00  0.00000e+00 0.00000e+00 7.95556e+01 17.155  2.12948e+01 197.155 0.9057 
1 1 1 17  22  7  o 18 4.62162e+00 1.54783e+00 9.49323e+01 171.679 -5.33321e+00 7.80031e-01  0.00000e+00 0.00000e+00 6.56066e+01 171.679 2.93257e+01 351.679 0.9017 
1 1 1 17  23  0  o 14 1.29232e+01 1.44174e+00 2.54053e+02 220.399 -2.85298e+01 -2.42802e+01 0.00000e+00 0.00000e+00 2.35452e+02 220.399 1.86009e+01 40.399  0.9866 
1 1 1 17  23  1  o 12 8.99996e+00 1.75488e+00 2.13819e+02 308.839 1.07985e+01  -1.34119e+01 0.00000e+00 0.00000e+00 1.21755e+02 308.839 9.20641e+01 128.839 0.9705 
1 1 1 17  23  2  o 11 8.29625e+00 1.76587e+00 9.57673e+01 142.729 -5.73299e+00 4.36279e+00  0.00000e+00 0.00000e+00 2.00112e+02 142.729 1.04345e+02 142.729 0.9277 
1 1 1 17  23  3  o 3  5.87617e+00 1.67496e+00 5.11963e+01 43.556  2.21233e+00  2.10355e+00  0.00000e+00 0.00000e+00 1.32734e+02 43.556  8.15376e+01 43.556  0.8138 
1 1 1 17  23  4  o 12 5.69699e+00 1.63972e+00 7.87001e+01 216.300 -3.90825e+00 -2.87094e+00 0.00000e+00 0.00000e+00 1.16358e+02 216.300 3.76576e+01 216.300 0.8898 
1 1 1 17  23  5  o 15 5.69008e+00 1.67294e+00 8.06167e+01 287.414 1.42119e+00  -4.53110e+00 0.00000e+00 0.00000e+00 1.13724e+02 287.414 3.31073e+01 287.414 0.8872 
1 1 1 17  23  6  o 8  5.44139e+00 1.65999e+00 7.35674e+01 141.558 -3.37787e+00 2.68128e+00  0.00000e+00 0.00000e+00 1.09692e+02 141.558 3.61248e+01 141.558 0.8746 
1 1 1 17  23  7  o 14 6.15924e+00 1.87391e+00 1.06700e+02 4.075   6.52486e+00  4.64839e-01  0.00000e+00 0.00000e+00 1.11585e+02 4.075   4.88503e+00 4.075   0.9200 
1 1 1 17  24  0  o 8  4.82761e+00 1.45881e+00 4.12470e+01 221.447 -1.59824e+00 -1.41138e+00 0.00000e+00 0.00000e+00 9.18884e+01 221.447 5.06414e+01 221.447 0.7183 
1 1 1 17  24  1  o 1  3.93484e+00 1.29534e+00 2.36417e+01 156.225 -1.08117e+00 4.76289e-01  0.00000e+00 0.00000e+00 5.29968e+01 156.225 2.93551e+01 156.225 0.5070 
1 1 1 17  24  2  f 0  4.59380e+00 1.43547e+00 4.36172e+01 131.833 -1.56851e+00 1.75227e+00  0.00000e+00 0.00000e+00 8.84420e+01 131.833 4.48249e+01 131.833 0.7479 
1 1 1 17  24  3  o 1  1.27258e+01 1.56960e+00 2.29198e+02 116.050 -1.34500e+01 2.75161e+01  0.00000e+00 0.00000e+00 2.52178e+02 116.050 2.29803e+01 116.050 0.9835 
1 1 1 17  24  4  o 19 4.85866e+00 1.52872e+00 7.47227e+01 5.982   4.05701e+00  4.25101e-01  0.00000e+00 0.00000e+00 8.72710e+01 5.982   1.25483e+01 5.982   0.8665 
1 1 1 17  24  5  o 16 5.41102e+00 1.69517e+00 7.43392e+01 36.605  3.29188e+00  2.44518e+00  0.00000e+00 0.00000e+00 1.06308e+02 36.605  3.19688e+01 36.605  0.8673 
1 1 1 17  24  6  o 1  4.84081e+00 1.55287e+00 7.21651e+01 133.629 -2.79415e+00 2.93116e+00  0.00000e+00 0.00000e+00 8.91511e+01 133.629 1.69860e+01 133.629 0.8654 
1 1 1 17  24  7  o 4  4.36408e+00 1.49692e+00 1.10273e+02 103.941 -1.52461e+00 6.14197e+00  0.00000e+00 0.00000e+00 4.39021e+01 103.941 6.63705e+01 283.941 0.9172 
1 1 1 17  25  0  o 4  6.77960e+00 1.55630e+00 1.87423e+02 102.609 -2.79851e+00 1.25108e+01  0.00000e+00 0.00000e+00 6.24716e+01 102.609 1.24952e+02 282.609 0.9602 
1 1 1 17  25  1  o 4  8.86991e+00 1.66595e+00 1.90000e+02 258.584 -3.33951e+00 -1.65386e+01 0.00000e+00 0.00000e+00 1.40472e+02 258.584 4.95288e+01 78.584  0.9699 
1 1 1 17  25  2  o 1  5.10797e+00 1.54096e+00 8.56561e+01 78.105  9.87844e-01  4.68964e+00  0.00000e+00 0.00000e+00 8.87551e+01 78.105  3.09899e+00 78.105  0.8883 
1 1 1 17  25  3  o 19 4.52438e+00 1.45680e+00 7.49618e+01 31.230  3.26782e+00  1.98138e+00  0.00000e+00 0.00000e+00 7.40293e+01 31.230  9.32480e-01 211.230 0.8563 
1 1 1 17  25  4  o 17 4.28058e+00 1.39401e+00 3.47927e+01 355.758 1.85228e+00  -1.37374e-01 0.00000e+00 0.00000e+00 7.60326e+01 355.758 4.12399e+01 355.758 0.6729 
1 1 1 17  25  5  o 18 5.81697e+00 1.71462e+00 1.16081e+02 135.237 -4.97346e+00 4.93247e+00  0.00000e+00 0.00000e+00 9.11587e+01 135.237 2.49225e+01 315.237 0.9256 
1 1 1 17  25  6  o 15 6.55980e+00 1.88363e+00 1.10817e+02 344.310 6.52015e+00  -1.83147e+00 0.00000e+00 0.00000e+00 1.22292e+02 344.310 1.14756e+01 344.310 0.9229 
1 1 1 17  25  7  o 11 5.36802e+00 1.71703e+00 6.43260e+01 276.897 4.50226e-01  -3.72224e+00 0.00000e+00 0.00000e+00 1.12064e+02 276.897 4.77380e+01 276.897 0.8531 
1 1 1 17  26  0  o 10 4.00117e+00 1.31959e+00 3.31157e+01 207.665 -1.46764e+00 -7.69396e-01 0.00000e+00 0.00000e+00 6.40506e+01 207.665 3.09349e+01 207.665 0.6326 
1 1 1 17  26  1  o 12 5.72705e+00 1.58099e+00 8.16478e+01 317.859 3.52510e+00  -3.18975e+00 0.00000e+00 0.00000e+00 1.13554e+02 317.859 3.19063e+01 317.859 0.8873 
1 1 1 17  26  2  o 8  4.14565e+00 1.35350e+00 5.31900e+01 57.959  1.44300e+00  2.30564e+00  0.00000e+00 0.00000e+00 7.21975e+01 57.959  1.90076e+01 57.959  0.7869 
1 1 1 17  26  3  o 6  7.23212e+00 1.80081e+00 1.00282e+02 61.952  3.23317e+00  6.06856e+00  0.00000e+00 0.00000e+00 1.56724e+02 61.952  5.64417e+01 61.952  0.9241 
1 1 1 17  26  4  o 3  4.43232e+00 1.46405e+00 6.38005e+01 146.883 -2.81618e+00 1.83705e+00  0.00000e+00 0.00000e+00 7.83441e+01 146.883 1.45436e+01 146.883 0.8336 
1 1 1 17  26  5  o 9  5.04779e+00 1.57996e+00 7.03533e+01 343.769 3.87818e+00  -1.12901e+00 0.00000e+00 0.00000e+00 9.77030e+01 343.769 2.73498e+01 343.769 0.8650 
1 1 1 17  26  6  o 18 8.34163e+00 2.01228e+00 9.53414e+01 134.980 -4.80261e+00 4.80602e+00  0.00000e+00 0.00000e+00 2.01149e+02 134.980 1.05808e+02 134.980 0.9232 
1 1 1 17  26  7  o 19 4.48295e+00 1.53143e+00 2.49880e+01 102.588 -3.03083e-01 1.35730e+00  0.00000e+00 0.00000e+00 7.30673e+01 102.588 4.80792e+01 102.588 0.5679 
1 1 1 17  27  0  o 13 4.65431e+00 1.41529e+00 2.73793e+01 59.630  7.57493e-01  1.29267e+00  0.00000e+00 0.00000e+00 7.90420e+01 59.630  5.16627e+01 59.630  0.5957 
1 1 1 17  27  1  o 16 8.46729e+00 1.61047e+00 1.73447e+02 96.005  -1.61024e+00 1.53064e+01  0.00000e+00 0.00000e+00 1.41019e+02 96.005  3.24282e+01 276.005 0.9669 
1 1 1 17  27  2  o 19 5.70239e+00 1.61192e+00 7.44399e+01 267.062 -2.30205e-01 -4.48508e+00 0.00000e+00 0.00000e+00 1.18427e+02 267.062 4.39869e+01 267.062 0.8801 
1 1 1 17  27  3  o 6  6.77432e+00 1.73016e+00 1.06805e+02 37.101  5.72765e+00  4.33197e+00  0.00000e+00 0.00000e+00 1.34796e+02 37.101  2.79912e+01 37.101  0.9275 
1 1 1 17  27  4  o 5  4.41749e+00 1.44512e+00 5.18225e+01 257.877 -5.51039e-01 -2.56545e+00 0.00000e+00 0.00000e+00 8.03629e+01 257.877 2.85404e+01 257.877 0.7778 
1 1 1 17  27  5  o 12 4.32433e+00 1.41371e+00 6.99680e+01 76.525  8.46746e-01  3.53372e+00  0.00000e+00 0.00000e+00 7.11263e+01 76.525  1.15831e+00 76.525  0.8478 
1 1 1 17  27  6  o 19 6.07641e+00 1.76814e+00 4.88827e+01 7.940   2.98893e+00  4.16854e-01  0.00000e+00 0.00000e+00 1.40909e+02 7.940   9.20266e+01 7.940   0.8113 
1 1 1 17  27  7  o 14 1.23713e+01 2.04005e+00 1.71036e+02 210.999 -1.56487e+01 -9.40234e+00 0.00000e+00 0.00000e+00 2.92148e+02 210.999 1.21112e+02 210.999 0.9722 
1 1 1 17  28  0  o 4  5.28982e+00 1.52435e+00 1.05348e+02 29.531  5.10461e+00  2.89169e+00  0.00000e+00 0.00000e+00 7.94540e+01 29.531  2.58937e+01 209.531 0.9102 
1 1 1 17  28  1  o 19 4.07604e+00 1.33724e+00 9.22816e+01 6.797   4.66754e+00  5.56311e-01  0.00000e+00 0.00000e+00 4.64063e+01 6.797   4.58754e+01 186.797 0.8859 
1 1 1 17  28  2  o 6  4.70693e+00 1.47693e+00 1.23304e+02 305.296 3.87370e+00  -5.47185e+00 0.00000e+00 0.00000e+00 4.34803e+01 305.296 7.98239e+01 125.296 0.9221 
1 1 1 17  28  3  o 7  6.12667e+00 1.68678e+00 8.28614e+01 170.362 -5.24560e+00 8.90845e-01  0.00000e+00 0.00000e+00 1.29222e+02 170.362 4.63611e+01 170.362 0.9003 
1 1 1 17  28  4  o 19 6.22824e+00 1.76864e+00 4.91266e+01 136.165 -2.16298e+00 2.07679e+00  0.00000e+00 0.00000e+00 1.44906e+02 136.165 9.57796e+01 136.165 0.8099 
1 1 1 17  28  5  f 0  4.74566e+00 1.53940e+00 1.20737e+02 156.443 -6.02560e+00 2.62715e+00  0.00000e+00 0.00000e+00 4.73594e+01 156.443 7.33772e+01 336.443 0.9204 
1 1 1 17  28  6  o 13 5.39910e+00 1.69849e+00 7.94591e+01 138.253 -3.50041e+00 3.12385e+00  0.00000e+00 0.00000e+00 1.04630e+02 138.253 2.51707e+01 138.253 0.8857 
1 1 1 17  28  7  o 13 5.09832e+00 1.67239e+00 8.90945e+01 134.572 -3.70335e+00 3.75911e+00  0.00000e+00 0.00000e+00 8.74841e+01 134.572 1.61035e+00 314.572 0.8994 
1 1 1 17  29  0  o 13 5.06135e+00 1.50213e+00 4.65800e+01 107.181 -7.82892e-01 2.53206e+00  0.00000e+00 0.00000e+00 1.05007e+02 107.181 5.84273e+01 107.181 0.7804 
1 1 1 17  29  1  o 5  3.83314e+00 1.26581e+00 8.95368e+01 314.606 3.14381e+00  -3.18739e+00 0.00000e+00 0.00000e+00 3.99500e+01 314.606 4.95867e+01 134.606 0.8796 
1 1 1 17  29  2  o 10 4.70092e+00 1.47752e+00 1.23215e+02 62.551  2.97016e+00  5.71806e+00  0.00000e+00 0.00000e+00 4.27416e+01 62.551  8.04734e+01 242.551 0.9187 
1 1 1 17  29  3  o 5  4.58338e+00 1.47679e+00 6.36848e+01 104.171 -8.31302e-01 3.29235e+00  0.00000e+00 0.00000e+00 8.35340e+01 104.171 1.98492e+01 104.171 0.8355 
1 1 1 17  29  4  o 5  4.85935e+00 1.54111e+00 6.71304e+01 314.197 2.59507e+00  -2.66882e+00 0.00000e+00 0.00000e+00 9.21047e+01 314.197 2.49743e+01 314.197 0.8519 
1 1 1 17  29  5  o 12 7.10597e+00 1.86222e+00 1.25769e+02 54.270  4.81567e+00  6.69430e+00  0.00000e+00 0.00000e+00 1.30509e+02 54.270  4.74029e+00 54.270  0.9372 
1 1 1 17  29  6  o 12 1.06020e+01 2.25916e+00 1.88325e+02 280.812 2.79066e+00  -1.46123e+01 0.00000e+00 0.00000e+00 2.05817e+02 280.812 1.74916e+01 280.812 0.9658 
1 1 1 17  29  7  o 19 8.32453e+00 2.09622e+00 2.22481e+02 57.225  8.57756e+00  1.33224e+01  0.00000e+00 0.00000e+00 8.77638e+01 57.225  1.34717e+02 237.225 0.9679 
1 1 1 17  30  0  o 19 7.26692e+00 1.67525e+00 1.21947e+02 327.675 7.52011e+00  -4.75866e+00 0.00000e+00 0.00000e+00 1.40748e+02 327.675 1.88006e+01 327.675 0.9420 
1 1 1 17  30  1  o 5  6.14005e+00 1.64527e+00 1.64344e+02 281.487 2.08026e+00  -1.02365e+01 0.00000e+00 0.00000e+00 5.98447e+01 281.487 1.04499e+02 101.487 0.9509 
1 1 1 17  30  2  o 16 1.21676e+01 1.51629e+00 1.96327e+02 64.965  1.15777e+01  2.47887e+01  0.00000e+00 0.00000e+00 2.62554e+02 64.965  6.62263e+01 64.965  0.9816 
1 1 1 17  30  3  o 11 7.37256e+00 1.74395e+00 1.48178e+02 156.154 -9.74132e+00 4.30577e+00  0.00000e+00 0.00000e+00 1.21591e+02 156.154 2.65871e+01 336.154 0.9518 
1 1 1 17  30  4  o 7  4.49206e+00 1.47243e+00 1.15578e+02 349.417 6.04175e+00  -1.12880e+00 0.00000e+00 0.00000e+00 4.24314e+01 349.417 7.31469e+01 169.417 0.9146 
1 1 1 17  30  5  o 13 6.28730e+00 1.82480e+00 9.40225e+01 180.865 -5.64542e+00 -8.52685e-02 0.00000e+00 0.00000e+00 1.25269e+02 180.865 3.12463e+01 180.865 0.9065 
1 1 1 17  30  6  o 11 5.38334e+00 1.71842e+00 1.14699e+02 54.757  3.82310e+00  5.41094e+00  0.00000e+00 0.00000e+00 7.61563e+01 54.757  3.85427e+01 234.757 0.9211 
1 1 1 17  30  7  o 12 4.84920e+00 1.61450e+00 7.24972e+01 54.558  2.45890e+00  3.45458e+00  0.00000e+00 0.00000e+00 9.03362e+01 54.558  1.78390e+01 54.558  0.8722 
1 1 1 17  31  0  o 12 5.02148e+00 1.52670e+00 1.30665e+02 205.056 -6.55541e+00 -3.06461e+00 0.00000e+00 0.00000e+00 4.81581e+01 205.056 8.25066e+01 25.056  0.9281 
1 1 1 17  31  1  o 2  5.24375e+00 1.48542e+00 1.32969e+02 55.428  4.54440e+00  6.59444e+00  0.00000e+00 0.00000e+00 5.53463e+01 55.428  7.76229e+01 235.428 0.9353 
1 1 1 17  31  2  o 8  5.19828e+00 1.57375e+00 1.06216e+02 51.783  3.76140e+00  4.77700e+00  0.00000e+00 0.00000e+00 7.62391e+01 51.783  2.99769e+01 231.783 0.9136 
1 1 1 17  31  3  o 5  5.92492e+00 1.64524e+00 9.13805e+01 291.490 2.08967e+00  -5.30768e+00 0.00000e+00 0.00000e+00 1.15305e+02 291.490 2.39241e+01 291.490 0.9075 
1 1 1 17  31  4  o 11 8.10592e+00 1.89949e+00 7.61055e+01 248.025 -2.11390e+00 -5.23865e+00 0.00000e+00 0.00000e+00 2.06494e+02 248.025 1.30388e+02 248.025 0.9065 
1 1 1 17  31  5  o 8  6.12246e+00 1.77789e+00 1.59370e+02 347.257 9.45852e+00  -2.13907e+00 0.00000e+00 0.00000e+00 6.36845e+01 347.257 9.56856e+01 167.257 0.9469 
1 1 1 17  31  6  o 2  4.73416e+00 1.61797e+00 7.34511e+01 331.181 3.55701e+00  -1.95703e+00 0.00000e+00 0.00000e+00 8.42976e+01 331.181 1.08465e+01 331.181 0.8658 
1 1 1 17  32  0  o 7  9.14543e+00 1.63605e+00 2.21886e+02 277.452 2.74069e+00  -2.09517e+01 0.00000e+00 0.00000e+00 1.20598e+02 277.452 1.01288e+02 97.453  0.9760 
1 1 1 17  32  1  o 4  4.11515e+00 1.33878e+00 6.37187e+01 2.161   3.17918e+00  1.19972e-01  0.00000e+00 0.00000e+00 6.62389e+01 2.161   2.52019e+00 2.161   0.8226 
1 1 1 17  32  2  o 2  5.19949e+00 1.57137e+00 1.07911e+02 173.424 -6.32070e+00 7.28669e-01  0.00000e+00 0.00000e+00 7.53822e+01 173.424 3.25290e+01 353.424 0.9176 
1 1 1 17  32  3  o 18 9.33939e+00 1.77043e+00 1.07964e+02 313.166 6.42572e+00  -6.85090e+00 0.00000e+00 0.00000e+00 2.31323e+02 313.166 1.23359e+02 313.166 0.9452 
1 1 1 17  32  4  o 15 5.53246e+00 1.59034e+00 1.09843e+02 119.170 -3.34568e+00 5.99364e+00  0.00000e+00 0.00000e+00 8.67318e+01 119.170 2.31111e+01 299.170 0.9240 
1 1 1 17  32  5  o 7  4.73846e+00 1.50579e+00 5.40100e+01 265.815 -2.26016e-01 -3.08853e+00 0.00000e+00 0.00000e+00 9.49008e+01 265.815 4.08908e+01 265.815 0.8169 
1 1 1 17  32  6  o 6  5.18439e+00 1.71937e+00 9.31440e+01 309.529 3.42425e+00  -4.14963e+00 0.00000e+00 0.00000e+00 8.67196e+01 309.529 6.42433e+00 129.529 0.9015 
1 1 1 17  33  0  o 3  4.12211e+00 1.31363e+00 2.38002e+01 172.572 -1.19981e+00 1.56427e-01  0.00000e+00 0.00000e+00 5.77788e+01 172.572 3.39786e+01 172.572 0.5159 
1 1 1 17  33  1  o 18 6.88192e+00 1.70095e+00 1.05868e+02 276.930 8.90243e-01  -7.32454e+00 0.00000e+00 0.00000e+00 1.39708e+02 276.930 3.38406e+01 276.930 0.9295 
1 1 1 17  33  2  o 1  4.25594e+00 1.37594e+00 1.11828e+02 304.906 3.38510e+00  -4.85131e+00 0.00000e+00 0.00000e+00 3.71071e+01 304.906 7.47213e+01 124.906 0.9110 
1 1 1 17  33  3  o 6  9.05911e+00 1.79120e+00 1.47659e+02 171.326 -1.27670e+01 1.94776e+00  0.00000e+00 0.00000e+00 1.86744e+02 171.326 3.90847e+01 171.326 0.9605 
1 1 1 17  33  4  o 13 8.67159e+00 1.91094e+00 1.77640e+02 356.240 1.33601e+01  -8.77918e-01 0.00000e+00 0.00000e+00 1.43087e+02 356.240 3.45533e+01 176.240 0.9619 
1 1 1 17  33  5  f 0  1.05238e+01 1.87193e+00 1.27020e+02 273.578 7.83073e-01  -1.25249e+01 0.00000e+00 0.00000e+00 2.61316e+02 273.578 1.34296e+02 273.578 0.9593 
1 1 1 17  33  6  o 8  5.73862e+00 1.79252e+00 1.24813e+02 171.744 -7.47925e+00 1.08519e+00  0.00000e+00 0.00000e+00 8.08343e+01 171.744 4.39785e+01 351.744 0.9313 
1 1 1 17  34  0  o 19 5.06586e+00 1.50168e+00 7.02926e+01 254.497 -1.04196e+00 -3.75641e+00 0.00000e+00 0.00000e+00 9.67336e+01 254.497 2.64410e+01 254.497 0.8595 
1 1 1 17  34  1  o 9  7.16807e+00 1.75538e+00 8.77535e+01 210.093 -5.44836e+00 -3.15740e+00 0.00000e+00 0.00000e+00 1.64492e+02 210.093 7.67380e+01 210.093 0.9167 
1 1 1 17  34  2  o 18 6.38159e+00 1.70737e+00 7.60214e+01 258.838 -9.50028e-01 -4.81454e+00 0.00000e+00 0.00000e+00 1.42417e+02 258.838 6.63961e+01 258.838 0.8912 
1 1 1 17  34  3  o 8  4.48157e+00 1.43677e+00 7.09884e+01 35.387  3.17526e+00  2.25549e+00  0.00000e+00 0.00000e+00 7.70123e+01 35.387  6.02393e+00 35.387  0.8594 
1 1 1 17  34  4  o 10 5.55892e+00 1.65760e+00 7.34255e+01 33.309  3.61184e+00  2.37334e+00  0.00000e+00 0.00000e+00 1.13552e+02 33.309  4.01269e+01 33.309  0.8748 
1 1 1 17  34  5  o 18 5.95942e+00 1.74819e+00 2.93118e+01 337.071 1.65755e+00  -7.01156e-01 0.00000e+00 0.00000e+00 1.22428e+02 337.071 9.31166e+01 337.071 0.6620 
1 1 1 17  34  6  o 2  7.80239e+00 2.00727e+00 1.11974e+02 27.127  6.88568e+00  3.52769e+00  0.00000e+00 0.00000e+00 1.68102e+02 27.127  5.61279e+01 27.127  0.9329 
1 1 1 17  35  0  o 1  3.60411e+00 1.21145e+00 5.74520e+01 34.687  2.38352e+00  1.64961e+00  0.00000e+00 0.00000e+00 5.34480e+01 34.687  4.00403e+00 214.687 0.8022 
1 1 1 17  35  1  o 7  5.37430e+00 1.49717e+00 1.01198e+02 287.152 1.91301e+00  -6.19839e+00 0.00000e+00 0.00000e+00 8.84374e+01 287.152 1.27604e+01 107.152 0.9193 
1 1 1 17  35  2  o 11 5.55552e+00 1.59750e+00 1.28049e+02 82.790  9.70745e-01  7.67334e+00  0.00000e+00 0.00000e+00 7.09983e+01 82.790  5.70509e+01 262.790 0.9329 
1 1 1 17  35  3  o 3  4.76079e+00 1.49613e+00 6.76971e+01 98.456  -5.52015e-01 3.71295e+00  0.00000e+00 0.00000e+00 8.84094e+01 98.456  2.07123e+01 98.456  0.8533 
1 1 1 17  35  4  o 4  4.97874e+00 1.56019e+00 2.52854e+01 128.089 -8.88417e-01 1.13348e+00  0.00000e+00 0.00000e+00 8.59166e+01 128.089 6.06313e+01 128.089 0.5810 
1 1 1 17  35  5  o 18 4.63981e+00 1.44993e+00 1.24131e+02 120.088 -3.77954e+00 6.52324e+00  0.00000e+00 0.00000e+00 4.20189e+01 120.088 8.21120e+01 300.088 0.9311 
1 1 1 17  35  6  o 4  5.55002e+00 1.65055e+00 3.34346e+01 351.035 2.07773e+00  -3.27772e-01 0.00000e+00 0.00000e+00 1.19033e+02 351.035 8.55984e+01 351.035 0.7140 
1 1 1 17  36  0  f 0  9.58328e+00 1.64169e+00 1.16800e+02 117.707 -5.62607e+00 1.07130e+01  0.00000e+00 0.00000e+00 2.35221e+02 117.707 1.18422e+02 117.707 0.9577 
1 1 1 17  36  1  o 6  4.94344e+00 1.48350e+00 8.26678e+01 220.850 -3.57743e+00 -3.09337e+00 0.00000e+00 0.00000e+00 8.55598e+01 220.850 2.89194e+00 220.850 0.8867 
1 1 1 17  36  2  o 19 7.18140e+00 1.73951e+00 1.08526e+02 127.503 -4.50507e+00 5.87042e+00  0.00000e+00 0.00000e+00 1.47875e+02 127.503 3.93490e+01 127.503 0.9297 
1 1 1 17  36  3  o 3  4.69293e+00 1.40228e+00 5.65128e+01 253.667 -9.60062e-01 -3.27623e+00 0.00000e+00 0.00000e+00 9.43145e+01 253.667 3.78017e+01 253.667 0.8365 
1 1 1 17  36  4  o 5  4.32258e+00 1.42210e+00 1.31754e+02 113.780 -2.91871e+00 6.62392e+00  0.00000e+00 0.00000e+00 2.24593e+01 113.780 1.09295e+02 293.780 0.9281 
1 1 1 17  36  5  o 7  4.53052e+00 1.49444e+00 5.05838e+01 283.930 6.95649e-01  -2.80463e+00 0.00000e+00 0.00000e+00 8.90541e+01 283.930 3.84703e+01 283.930 0.8015 
1 1 1 17  36  6  f 0  8.57378e+00 2.08370e+00 1.79286e+02 314.184 9.25177e+00  -9.51907e+00 0.00000e+00 0.00000e+00 1.37863e+02 314.184 4.14227e+01 134.184 0.9616 
1 1 1 17  37  0  o 17 8.21305e+00 1.62643e+00 1.27719e+02 5.281   1.10074e+01  1.01743e+00  0.00000e+00 0.00000e+00 1.72646e+02 5.281   4.49266e+01 5.281   0.9536 
1 1 1 17  37  1  o 4  4.97436e+00 1.49740e+00 6.58163e+01 146.430 -3.17225e+00 2.10526e+00  0.00000e+00 0.00000e+00 9.75244e+01 146.430 3.17081e+01 146.430 0.8557 
1 1 1 17  37  2  o 16 5.22811e+00 1.50907e+00 7.54870e+01 169.656 -4.52776e+00 8.26455e-01  0.00000e+00 0.00000e+00 1.01826e+02 169.656 2.63394e+01 169.656 0.8833 
1 1 1 17  37  3  o 3  7.76580e+00 1.79405e+00 1.68530e+02 307.336 7.44026e+00  -9.75396e+00 0.00000e+00 0.00000e+00 1.17386e+02 307.336 5.11443e+01 127.336 0.9583 
1 1 1 17  37  4  o 1  7.85698e+00 1.85788e+00 1.10108e+02 359.137 8.14063e+00  -1.22628e-01 0.00000e+00 0.00000e+00 1.72679e+02 359.137 6.25712e+01 359.137 0.9364 
1 1 1 17  37  5  o 2  6.63755e+00 1.82258e+00 7.99703e+01 21.573  4.97839e+00  1.96836e+00  0.00000e+00 0.00000e+00 1.49984e+02 21.573  7.00134e+01 21.573  0.9010 
1 1 1 17  37  6  o 8  3.74356e+00 1.29906e+00 6.15549e+01 133.280 -2.42311e+00 2.57318e+00  0.00000e+00 0.00000e+00 5.98185e+01 133.280 1.73638e+00 313.280 0.8429 
1 1 1 17  38  0  o 14 4.70106e+00 1.48287e+00 1.17207e+02 228.604 -4.28042e+00 -4.85584e+00 0.00000e+00 0.00000e+00 4.84813e+01 228.604 6.87259e+01 48.604  0.9191 
1 1 1 17  38  1  o 14 8.79206e+00 1.71056e+00 1.72263e+02 72.897  4.30937e+00  1.40052e+01  0.00000e+00 0.00000e+00 1.53373e+02 72.897  1.88895e+01 252.897 0.9653 
1 1 1 17  38  2  o 5  4.55456e+00 1.45020e+00 8.14217e+01 244.101 -1.94588e+00 -4.00748e+00 0.00000e+00 0.00000e+00 7.22841e+01 244.101 9.13766e+00 64.101  0.8790 
1 1 1 17  38  3  o 13 1.10828e+01 1.65480e+00 1.77162e+02 355.094 2.07578e+01  -1.78157e+00 0.00000e+00 0.00000e+00 2.38228e+02 355.094 6.10662e+01 355.094 0.9757 
1 1 1 17  38  4  o 19 4.20386e+00 1.39679e+00 7.21583e+01 260.328 -6.64948e-01 -3.90172e+00 0.00000e+00 0.00000e+00 6.70913e+01 260.328 5.06700e+00 80.328  0.8619 
1 1 1 17  38  5  o 16 7.87361e+00 1.79838e+00 1.48457e+02 89.909  1.96073e-02  1.22946e+01  0.00000e+00 0.00000e+00 1.41682e+02 89.909  6.77468e+00 269.909 0.9584 
1 1 1 17  38  6  o 2  7.09240e+00 1.93707e+00 1.13996e+02 256.918 -1.74888e+00 -7.52621e+00 0.00000e+00 0.00000e+00 1.40469e+02 256.918 2.64737e+01 256.918 0.9328 
1 1 1 17  39  0  o 9  1.58081e+01 1.26229e+00 3.08726e+02 17.718  5.97910e+01  1.91019e+01  0.00000e+00 0.00000e+00 2.92534e+02 17.718  1.61922e+01 197.717 0.9920 
1 1 1 17  39  1  o 8  1.04119e+01 1.60643e+00 1.91437e+02 198.006 -2.07080e+01 -6.73102e+00 0.00000e+00 0.00000e+00 1.98752e+02 198.006 7.31488e+00 198.006 0.9768 
1 1 1 17  39  2  o 17 5.62427e+00 1.61164e+00 1.27093e+02 17.072  7.61030e+00  2.33710e+00  0.00000e+00 0.00000e+00 7.47656e+01 17.072  5.23272e+01 197.072 0.9349 
1 1 1 17  39  3  o 11 3.57035e+00 1.21352e+00 6.57862e+01 235.097 -1.94944e+00 -2.79415e+00 0.00000e+00 0.00000e+00 4.88734e+01 235.097 1.69127e+01 55.097  0.8361 
1 1 1 17  39  4  o 9  7.01498e+00 1.61436e+00 1.01544e+02 272.292 3.22227e-01  -8.05161e+00 0.00000e+00 0.00000e+00 1.50701e+02 272.292 4.91573e+01 272.292 0.9357 
1 1 1 17  39  5  o 18 6.56794e+00 1.78996e+00 4.96936e+01 274.171 2.50987e-01  -3.44178e+00 0.00000e+00 0.00000e+00 1.62025e+02 274.171 1.12332e+02 274.171 0.8385 
1 1 1 17  39  6  o 14 7.33579e+00 1.95138e+00 8.81921e+01 133.133 -4.18083e+00 4.46252e+00  0.00000e+00 0.00000e+00 1.69692e+02 133.133 8.14999e+01 133.133 0.9141 
1 1 1 17  40  0  o 1  7.18147e+00 1.58900e+00 1.66045e+02 168.399 -1.29173e+01 2.65165e+00  0.00000e+00 0.00000e+00 9.86202e+01 168.399 6.74249e+01 348.399 0.9613 
1 1 1 17  40  1  o 17 6.53484e+00 1.64112e+00 9.81323e+01 143.792 -5.47266e+00 4.00661e+00  0.00000e+00 0.00000e+00 1.33263e+02 143.792 3.51311e+01 143.792 0.9230 
1 1 1 17  40  2  o 13 4.10573e+00 1.35366e+00 7.43835e+01 57.392  2.05564e+00  3.21333e+00  0.00000e+00 0.00000e+00 6.05214e+01 57.392  1.38621e+01 237.392 0.8560 
1 1 1 17  40  3  f 0  1.44475e+01 1.40381e+00 2.21644e+02 217.410 -3.27360e+01 -2.50374e+01 0.00000e+00 0.00000e+00 3.26453e+02 217.410 1.04810e+02 217.410 0.9878 
1 1 1 17  40  4  o 10 4.07442e+00 1.34441e+00 1.11456e+02 337.729 5.94042e+00  -2.43287e+00 0.00000e+00 0.00000e+00 3.23271e+01 337.729 7.91293e+01 157.729 0.9184 
1 1 1 17  40  5  o 1  4.65331e+00 1.53112e+00 8.93179e+01 94.028  -3.62511e-01 5.14852e+00  0.00000e+00 0.00000e+00 7.11293e+01 94.028  1.81886e+01 274.028 0.8970 
1 1 1 17  40  6  o 16 5.85006e+00 1.77738e+00 9.93470e+01 187.932 -6.10322e+00 -8.50366e-01 0.00000e+00 0.00000e+00 1.06442e+02 187.932 7.09503e+00 187.932 0.9148 
1 1 1 17  41  0  o 16 5.78471e+00 1.60997e+00 1.25040e+02 348.306 7.65159e+00  -1.58370e+00 0.00000e+00 0.00000e+00 8.19884e+01 348.306 4.30520e+01 168.306 0.9336 
1 1 1 17  41  1  o 8  5.85448e+00 1.63178e+00 7.96252e+01 180.418 -5.12139e+00 -3.73312e-02 0.00000e+00 0.00000e+00 1.21617e+02 180.418 4.19913e+01 180.418 0.8961 
1 1 1 17  41  2  o 19 6.56929e+00 1.68773e+00 1.07875e+02 262.882 -9.11353e-01 -7.29841e+00 0.00000e+00 0.00000e+00 1.26435e+02 262.882 1.85592e+01 262.882 0.9293 
1 1 1 17  41  3  o 14 4.21334e+00 1.33597e+00 4.89559e+01 14.138  2.72627e+00  6.86739e-01  0.00000e+00 0.00000e+00 7.96770e+01 14.138  3.07211e+01 14.138  0.7950 
1 1 1 17  41  4  o 11 5.54505e+00 1.61114e+00 1.19667e+02 147.497 -6.48499e+00 4.13191e+00  0.00000e+00 0.00000e+00 7.89930e+01 147.497 4.06744e+01 327.497 0.9325 
1 1 1 17  41  5  o 17 7.11530e+00 1.92443e+00 1.40559e+02 147.465 -7.87562e+00 5.02400e+00  0.00000e+00 0.00000e+00 1.17840e+02 147.465 2.27186e+01 327.465 0.9449 
1 1 1 17  41  6  o 7  4.42381e+00 1.48257e+00 6.76927e+01 95.412  -3.74732e-01 3.95503e+00  0.00000e+00 0.00000e+00 7.90049e+01 95.412  1.13121e+01 95.412  0.8625 
1 1 1 17  42  0  o 2  6.04504e+00 1.61664e+00 9.18187e+01 130.155 -3.97512e+00 4.71140e+00  0.00000e+00 0.00000e+00 1.20150e+02 130.155 2.83309e+01 130.155 0.9148 
1 1 1 17  42  1  o 3  6.81928e+00 1.72070e+00 1.59289e+02 337.521 9.86939e+00  -4.08381e+00 0.00000e+00 0.00000e+00 8.96954e+01 337.521 6.95940e+01 157.521 0.9520 
1 1 1 17  42  2  o 12 5.79189e+00 1.61828e+00 8.91249e+01 140.037 -4.34975e+00 3.64511e+00  0.00000e+00 0.00000e+00 1.12477e+02 140.037 2.33521e+01 140.037 0.9070 
1 1 1 17  42  3  o 13 5.61592e+00 1.67434e+00 1.03872e+02 180.437 -6.33287e+00 -4.83250e-02 0.00000e+00 0.00000e+00 9.39183e+01 180.437 9.95354e+00 0.437   0.9172 
1 1 1 17  42  4  o 5  7.93617e+00 1.81098e+00 1.64248e+02 336.292 1.21344e+01  -5.32867e+00 0.00000e+00 0.00000e+00 1.28885e+02 336.292 3.53631e+01 156.292 0.9615 
1 1 1 17  42  5  o 17 6.43273e+00 1.78271e+00 1.16903e+02 158.514 -7.48945e+00 2.94811e+00  0.00000e+00 0.00000e+00 1.14404e+02 158.514 2.49922e+00 338.514 0.9356 
1 1 1 17  42  6  o 14 4.02384e+00 1.35323e+00 7.35258e+01 108.102 -1.39863e+00 4.27864e+00  0.00000e+00 0.00000e+00 6.26631e+01 108.102 1.08627e+01 288.102 0.8804 
1 1 1 17  43  0  o 3  4.02095e+00 1.28392e+00 1.57863e+01 314.265 5.79095e-01  -5.94137e-01 0.00000e+00 0.00000e+00 4.32038e+01 314.265 2.74175e+01 314.265 0.3828 
1 1 1 17  43  1  o 1  4.96723e+00 1.49996e+00 7.73190e+01 49.835  2.91910e+00  3.45862e+00  0.00000e+00 0.00000e+00 9.05200e+01 49.835  1.32010e+01 49.835  0.8811 
1 1 1 17  43  2  o 8  4.69187e+00 1.42269e+00 5.36172e+01 275.448 3.03311e-01  -3.18012e+00 0.00000e+00 0.00000e+00 9.46261e+01 275.448 4.10089e+01 275.448 0.8234 
1 1 1 17  43  3  o 6  7.42395e+00 1.85783e+00 1.35113e+02 154.702 -8.86941e+00 4.19210e+00  0.00000e+00 0.00000e+00 1.34971e+02 154.702 1.42060e-01 334.702 0.9476 
1 1 1 17  43  4  o 15 4.57618e+00 1.48654e+00 8.95064e+01 25.087  4.91832e+00  2.30256e+00  0.00000e+00 0.00000e+00 6.91299e+01 25.087  2.03765e+01 205.087 0.9025 
1 1 1 17  43  5  o 5  1.01695e+01 1.88180e+00 1.29132e+02 32.371  1.09958e+01  6.97045e+00  0.00000e+00 0.00000e+00 2.46327e+02 32.371  1.17195e+02 32.371  0.9608 
1 1 1 17  43  6  o 19 4.89588e+00 1.56574e+00 5.61940e+01 342.368 3.37656e+00  -1.07315e+00 0.00000e+00 0.00000e+00 1.02517e+02 342.368 4.63227e+01 342.368 0.8433 
1 1 1 17  44  0  o 1  5.78131e+00 1.58507e+00 9.53906e+01 326.289 5.10504e+00  -3.40611e+00 0.00000e+00 0.00000e+00 1.07193e+02 326.289 1.18025e+01 326.289 0.9144 
1 1 1 17  44  1  o 9  4.50188e+00 1.39831e+00 7.45361e+01 179.606 -4.28914e+00 2.94818e-02  0.00000e+00 0.00000e+00 7.63014e+01 179.606 1.76531e+00 179.606 0.8738 
1 1 1 17  44  2  o 1  4.00946e+00 1.28841e+00 4.27451e+01 291.812 8.96808e-01  -2.24082e+00 0.00000e+00 0.00000e+00 7.34401e+01 291.812 3.06949e+01 291.812 0.7553 
1 1 1 17  44  3  o 5  4.73297e+00 1.52068e+00 5.95192e+01 29.911  3.02226e+00  1.73862e+00  0.00000e+00 0.00000e+00 9.31739e+01 29.911  3.36547e+01 29.911  0.8404 
1 1 1 17  44  4  o 10 4.85659e+00 1.52264e+00 1.23448e+02 162.159 -7.13457e+00 2.29636e+00  0.00000e+00 0.00000e+00 5.01450e+01 162.159 7.33029e+01 342.159 0.9307 
1 1 1 17  44  5  o 17 5.08059e+00 1.59998e+00 5.49097e+01 24.847  3.09567e+00  1.43346e+00  0.00000e+00 0.00000e+00 1.08350e+02 24.847  5.34399e+01 24.847  0.8363 
1 1 1 17  44  6  o 3  4.46469e+00 1.47669e+00 6.79150e+01 117.268 -1.99341e+00 3.86745e+00  0.00000e+00 0.00000e+00 8.23708e+01 117.268 1.44558e+01 117.268 0.8758 
1 1 1 17  45  0  o 5  6.83948e+00 1.64985e+00 1.19113e+02 309.563 5.58549e+00  -6.76068e+00 0.00000e+00 0.00000e+00 1.27516e+02 309.563 8.40352e+00 309.563 0.9411 
1 1 1 17  45  1  o 18 6.39112e+00 1.61983e+00 1.65692e+02 48.909  7.71135e+00  8.84263e+00  0.00000e+00 0.00000e+00 6.86588e+01 48.909  9.70329e+01 228.909 0.9564 
1 1 1 17  45  2  o 2  9.78958e+00 1.61139e+00 1.29963e+02 211.974 -1.22417e+01 -7.64168e+00 0.00000e+00 0.00000e+00 2.32340e+02 211.974 1.02378e+02 211.974 0.9647 
1 1 1 17  45  3  o 5  1.08640e+01 1.84768e+00 1.75844e+02 68.952  6.80209e+00  1.76755e+01  0.00000e+00 0.00000e+00 2.29993e+02 68.952  5.41497e+01 68.952  0.9732 
1 1 1 17  45  4  o 6  7.45115e+00 1.86701e+00 1.14260e+02 216.392 -6.66481e+00 -4.91231e+00 0.00000e+00 0.00000e+00 1.53995e+02 216.392 3.97346e+01 216.392 0.9375 
1 1 1 17  45  5  o 7  5.76549e+00 1.66920e+00 5.34397e+01 297.353 1.62476e+00  -3.14082e+00 0.00000e+00 0.00000e+00 1.33274e+02 297.353 7.98343e+01 297.353 0.8430 
1 1 1 17  45  6  f 0  8.87031e+00 1.99571e+00 1.23757e+02 252.326 -3.22754e+00 -1.01292e+01 0.00000e+00 0.00000e+00 2.00683e+02 252.326 7.69258e+01 252.326 0.9517 
1 1 1 17  46  0  o 5  5.80449e+00 1.60299e+00 8.97857e+01 164.765 -5.63824e+00 1.53553e+00  0.00000e+00 0.00000e+00 1.12542e+02 164.765 2.27560e+01 164.765 0.9099 
1 1 1 17  46  1  o 9  4.50413e+00 1.41417e+00 1.41818e+02 216.051 -6.66005e+00 -4.84794e+00 0.00000e+00 0.00000e+00 2.00028e+01 216.051 1.21815e+02 36.051  0.9372 
1 1 1 17  46  2  o 11 6.24631e+00 1.60626e+00 1.66051e+02 36.091  9.79753e+00  7.14223e+00  0.00000e+00 0.00000e+00 6.34424e+01 36.091  1.02609e+02 216.091 0.9578 
1 1 1 17  46  3  o 2  8.87906e+00 1.68188e+00 1.80701e+02 224.491 -1.31171e+01 -1.28859e+01 0.00000e+00 0.00000e+00 1.50667e+02 224.491 3.00338e+01 44.491  0.9724 
1 1 1 17  46  4  o 12 3.90041e+00 1.32139e+00 1.00771e+02 331.116 5.22194e+00  -2.88077e+00 0.00000e+00 0.00000e+00 3.57819e+01 331.116 6.49893e+01 151.116 0.9118 
1 1 1 17  46  5  o 18 4.18150e+00 1.35494e+00 7.14639e+01 124.639 -2.58393e+00 3.74017e+00  0.00000e+00 0.00000e+00 7.01511e+01 124.639 1.31281e+00 304.639 0.8817 
1 1 1 17  47  0  o 16 6.32126e+00 1.61982e+00 7.97514e+01 200.069 -5.29222e+00 -1.93347e+00 0.00000e+00 0.00000e+00 1.39694e+02 200.069 5.99421e+01 200.069 0.9063 
1 1 1 17  47  1  o 19 5.05186e+00 1.57120e+00 7.97241e+01 58.632  2.44574e+00  4.01178e+00  0.00000e+00 0.00000e+00 9.18199e+01 58.632  1.20958e+01 58.632  0.8859 
1 1 1 17  47  2  o 17 6.89237e+00 1.72680e+00 1.23484e+02 231.095 -5.70615e+00 -7.07052e+00 0.00000e+00 0.00000e+00 1.25860e+02 231.095 2.37644e+00 231.095 0.9433 
1 1 1 17  47  3  o 11 8.73433e+00 1.81417e+00 1.51947e+02 325.126 1.10406e+01  -7.69465e+00 0.00000e+00 0.00000e+00 1.70519e+02 325.126 1.85716e+01 325.126 0.9621 
1 1 1 17  47  4  o 12 4.11690e+00 1.36913e+00 4.95647e+01 158.420 -2.75623e+00 1.09016e+00  0.00000e+00 0.00000e+00 7.80315e+01 158.420 2.84668e+01 158.420 0.8073 
1 1 1 17  47  5  o 3  6.56444e+00 1.82263e+00 7.84833e+01 19.492  5.15122e+00  1.82332e+00  0.00000e+00 0.00000e+00 1.49221e+02 19.492  7.07381e+01 19.492  0.9031 
1 1 1 17  48  0  o 19 5.52810e+00 1.53372e+00 9.39911e+01 143.675 -5.01528e+00 3.68740e+00  0.00000e+00 0.00000e+00 9.98935e+01 143.675 5.90236e+00 143.675 0.9157 
1 1 1 17  48  1  o 3  5.42555e+00 1.57614e+00 1.03234e+02 30.818  5.74546e+00  3.42741e+00  0.00000e+00 0.00000e+00 8.84642e+01 30.818  1.47694e+01 210.818 0.9219 
1 1 1 17  48  2  o 2  5.17622e+00 1.53469e+00 9.12596e+01 286.434 1.65821e+00  -5.62165e+00 0.00000e+00 0.00000e+00 8.94039e+01 286.434 1.85563e+00 106.434 0.9101 
1 1 1 17  48  3  o 16 5.69825e+00 1.63920e+00 6.76785e+01 229.024 -2.89156e+00 -3.32923e+00 0.00000e+00 0.00000e+00 1.24199e+02 229.024 5.65203e+01 229.024 0.8776 
1 1 1 17  48  4  o 3  7.28071e+00 1.73803e+00 1.04014e+02 133.900 -5.79498e+00 6.02190e+00  0.00000e+00 0.00000e+00 1.58173e+02 133.900 5.41587e+01 133.900 0.9381 
1 1 1 17  48  5  o 14 5.01769e+00 1.54303e+00 3.17072e+01 124.412 -1.22371e+00 1.78637e+00  0.00000e+00 0.00000e+00 1.07636e+02 124.412 7.59288e+01 124.412 0.7231 
1 1 1 17  49  0  o 7  5.05094e+00 1.45930e+00 6.35951e+01 59.750  2.10404e+00  3.60788e+00  0.00000e+00 0.00000e+00 1.04684e+02 59.750  4.10891e+01 59.750  0.8700 
1 1 1 17  49  1  o 12 5.14073e+00 1.56981e+00 5.21248e+01 17.515  3.05058e+00  9.62716e-01  0.00000e+00 0.00000e+00 1.10136e+02 17.515  5.80112e+01 17.515  0.8237 
1 1 1 17  49  2  o 17 3.78717e+00 1.27549e+00 4.99734e+01 146.035 -2.44281e+00 1.64549e+00  0.00000e+00 0.00000e+00 6.70477e+01 146.035 1.70742e+01 146.035 0.8059 
1 1 1 17  49  3  o 2  6.37744e+00 1.70885e+00 1.20905e+02 263.406 -1.00154e+00 -8.66344e+00 0.00000e+00 0.00000e+00 1.09271e+02 263.406 1.16346e+01 83.406  0.9408 
1 1 1 17  49  4  o 4  3.51419e+00 1.19570e+00 6.20981e+01 76.237  8.57668e-01  3.50167e+00  0.00000e+00 0.00000e+00 5.20670e+01 76.237  1.00311e+01 256.237 0.8464 
1 1 1 17  49  5  f 0  6.48327e+00 1.78105e+00 5.74180e+01 251.480 -1.34969e+00 -4.02902e+00 0.00000e+00 0.00000e+00 1.59774e+02 251.480 1.02356e+02 251.480 0.8725 
1 1 1 17  50  0  o 15 9.95331e+00 1.57394e+00 1.23811e+02 320.576 1.13330e+01  -9.31690e+00 0.00000e+00 0.00000e+00 2.44077e+02 320.576 1.20266e+02 320.576 0.9653 
1 1 1 17  50  1  o 8  7.56777e+00 1.77549e+00 5.27767e+01 207.003 -3.81006e+00 -1.94159e+00 0.00000e+00 0.00000e+00 2.00465e+02 207.003 1.47689e+02 207.003 0.8734 
1 1 1 17  50  2  o 2  3.93682e+00 1.31055e+00 6.61055e+01 89.784  1.42374e-02  3.78193e+00  0.00000e+00 0.00000e+00 6.28765e+01 89.784  3.22897e+00 269.784 0.8546 
1 1 1 17  50  3  o 16 3.88536e+00 1.27196e+00 1.08404e+02 286.241 1.84310e+00  -6.32702e+00 0.00000e+00 0.00000e+00 2.88062e+01 286.241 7.95978e+01 106.241 0.9206 
1 1 1 17  50  4  o 18 4.53028e+00 1.41791e+00 6.90834e+01 228.189 -3.01927e+00 -3.37558e+00 0.00000e+00 0.00000e+00 8.41145e+01 228.189 1.50310e+01 228.189 0.8812 
1 1 1 17  50  5  o 13 7.36827e+00 1.74843e+00 1.62074e+02 55.171  8.12996e+00  1.16851e+01  0.00000e+00 0.00000e+00 1.10687e+02 55.171  5.13873e+01 235.171 0.9642 
1 1 1 17  51  0  o 13 6.30564e+00 1.63129e+00 1.27376e+02 119.195 -4.53151e+00 8.10976e+00  0.00000e+00 0.00000e+00 1.00646e+02 119.195 2.67299e+01 299.195 0.9445 
1 1 1 17  51  1  o 14 6.88032e+00 1.71304e+00 1.16089e+02 358.050 8.70271e+00  -2.96311e-01 0.00000e+00 0.00000e+00 1.31865e+02 358.050 1.57762e+01 358.050 0.9407 
1 1 1 17  51  2  o 18 4.10065e+00 1.32458e+00 1.59511e+01 327.787 8.38263e-01  -5.28157e-01 0.00000e+00 0.00000e+00 5.37012e+01 327.787 3.77501e+01 327.787 0.4431 
1 1 1 17  51  3  o 16 9.96268e+00 1.68201e+00 1.62142e+02 309.344 1.17822e+01  -1.43727e+01 0.00000e+00 0.00000e+00 2.09532e+02 309.344 4.73904e+01 309.344 0.9727 
1 1 1 17  51  4  o 11 5.56533e+00 1.56262e+00 1.06992e+02 149.936 -6.65820e+00 3.85401e+00  0.00000e+00 0.00000e+00 9.21511e+01 149.936 1.48407e+01 329.936 0.9325 
1 1 1 17  51  5  o 2  5.81866e+00 1.70772e+00 1.14456e+02 316.026 5.91161e+00  -5.70366e+00 0.00000e+00 0.00000e+00 9.48317e+01 316.026 1.96247e+01 136.026 0.9370 
1 1 1 17  52  0  o 8  7.26857e+00 1.65466e+00 1.87856e+02 108.824 -5.00990e+00 1.46962e+01  0.00000e+00 0.00000e+00 8.12663e+01 108.824 1.06590e+02 288.824 0.9672 
1 1 1 17  52  1  o 6  1.12441e+01 1.57495e+00 1.57731e+02 315.127 1.50575e+01  -1.49911e+01 0.00000e+00 0.00000e+00 2.62710e+02 315.127 1.04979e+02 315.127 0.9762 
1 1 1 17  52  2  o 7  4.84430e+00 1.50023e+00 5.18098e+01 17.296  3.15263e+00  9.81717e-01  0.00000e+00 0.00000e+00 1.02304e+02 17.296  5.04945e+01 17.296  0.8300 
1 1 1 17  52  3  o 3  6.43137e+00 1.73232e+00 1.24818e+02 266.288 -5.73215e-01 -8.83486e+00 0.00000e+00 0.00000e+00 1.07434e+02 266.288 1.73833e+01 86.288  0.9417 
1 1 1 17  52  4  o 13 4.27786e+00 1.38557e+00 3.45250e+01 14.086  2.21591e+00  5.56032e-01  0.00000e+00 0.00000e+00 8.68269e+01 14.086  5.23020e+01 14.086  0.7394 
1 1 1 17  52  5  o 15 5.55878e+00 1.63566e+00 9.76098e+01 358.865 6.76846e+00  -1.34145e-01 0.00000e+00 0.00000e+00 9.92885e+01 358.865 1.67866e+00 358.865 0.9229 
1 1 1 17  53  0  o 3  1.49416e+01 1.31870e+00 1.89014e+02 344.574 3.93022e+01  -1.08447e+01 0.00000e+00 0.00000e+00 3.75803e+02 344.574 1.86789e+02 344.574 0.9877 
1 1 1 17  53  1  o 14 5.95991e+00 1.58950e+00 1.49236e+02 252.375 -3.33129e+00 -1.04859e+01 0.00000e+00 0.00000e+00 6.83889e+01 252.375 8.08470e+01 72.375  0.9534 
1 1 1 17  53  2  o 3  5.12927e+00 1.49385e+00 4.82656e+01 88.150  1.05987e-01  3.28082e+00  0.00000e+00 0.00000e+00 1.14662e+02 88.150  6.63966e+01 88.150  0.8289 
1 1 1 17  53  3  o 11 4.47796e+00 1.44744e+00 1.09788e+02 251.441 -2.21223e+00 -6.58898e+00 0.00000e+00 0.00000e+00 4.90261e+01 251.441 6.07615e+01 71.441  0.9250 
1 1 1 17  53  4  o 11 4.73398e+00 1.51461e+00 6.03045e+01 117.505 -1.86278e+00 3.57754e+00  0.00000e+00 0.00000e+00 9.67399e+01 117.505 3.64354e+01 117.505 0.8648 
1 1 1 17  53  5  o 7  5.86602e+00 1.72060e+00 9.49769e+01 300.775 3.44157e+00  -5.77894e+00 0.00000e+00 0.00000e+00 1.12656e+02 300.775 1.76787e+01 300.775 0.9223 
1 1 1 17  54  0  o 10 7.48496e+00 1.69698e+00 1.58132e+02 335.491 1.22960e+01  -5.60601e+00 0.00000e+00 0.00000e+00 1.17495e+02 335.491 4.06368e+01 155.491 0.9623 
1 1 1 17  54  1  f 0  6.68589e+00 1.68635e+00 9.68199e+01 136.220 -5.34741e+00 5.12437e+00  0.00000e+00 0.00000e+00 1.41235e+02 136.220 4.44152e+01 136.220 0.9298 
1 1 1 17  54  2  o 13 5.32837e+00 1.56882e+00 6.04376e+01 244.861 -1.69208e+00 -3.60578e+00 0.00000e+00 0.00000e+00 1.15728e+02 244.861 5.52906e+01 244.861 0.8629 
1 1 1 17  54  3  o 12 6.60601e+00 1.86518e+00 4.50927e+01 244.115 -1.33678e+00 -2.75477e+00 0.00000e+00 0.00000e+00 1.61172e+02 244.115 1.16080e+02 244.115 0.8145 
1 1 1 17  54  4  o 1  6.03816e+00 1.67791e+00 1.03254e+02 268.411 -2.18611e-01 -7.88165e+00 0.00000e+00 0.00000e+00 1.13110e+02 268.411 9.85549e+00 268.411 0.9342 
1 1 1 17  54  5  o 12 4.22676e+00 1.40845e+00 3.13924e+01 294.920 8.86534e-01  -1.90813e+00 0.00000e+00 0.00000e+00 8.44281e+01 294.920 5.30356e+01 294.920 0.7141 
1 1 1 17  55  0  o 2  5.33258e+00 1.48242e+00 7.66476e+01 255.222 -1.38962e+00 -5.26778e+00 0.00000e+00 0.00000e+00 1.07565e+02 255.222 3.09174e+01 255.222 0.9028 
1 1 1 17  55  1  o 9  3.73648e+00 1.24510e+00 7.78177e+01 144.765 -3.75028e+00 2.64899e+00  0.00000e+00 0.00000e+00 4.84998e+01 144.765 2.93179e+01 324.765 0.8830 
1 1 1 17  55  2  o 1  3.47350e+00 1.19219e+00 7.36307e+01 113.152 -1.73970e+00 4.06847e+00  0.00000e+00 0.00000e+00 4.32165e+01 113.152 3.04142e+01 293.152 0.8781 
1 1 1 17  55  3  o 3  4.04615e+00 1.34620e+00 6.69521e+01 212.395 -3.65399e+00 -2.31849e+00 0.00000e+00 0.00000e+00 6.87586e+01 212.395 1.80649e+00 212.395 0.8750 
1 1 1 17  55  4  o 15 4.27019e+00 1.40470e+00 3.57846e+01 102.686 -5.03686e-01 2.23761e+00  0.00000e+00 0.00000e+00 8.54867e+01 102.686 4.97020e+01 102.686 0.7406 
1 1 1 17  55  5  o 2  4.85118e+00 1.54201e+00 1.19276e+02 258.767 -1.56214e+00 -7.86589e+00 0.00000e+00 0.00000e+00 5.48151e+01 258.767 6.44610e+01 78.767  0.9354 
1 1 1 17  56  0  o 18 7.17232e+00 1.64432e+00 1.05587e+02 281.928 1.83278e+00  -8.67613e+00 0.00000e+00 0.00000e+00 1.52835e+02 281.928 4.72486e+01 281.928 0.9418 
1 1 1 17  56  1  o 3  5.29625e+00 1.52291e+00 5.90725e+01 354.045 4.00893e+00  -4.18164e-01 0.00000e+00 0.00000e+00 1.16244e+02 354.045 5.71718e+01 354.045 0.8647 
1 1 1 17  56  2  o 5  4.14219e+00 1.33491e+00 6.42170e+01 120.301 -2.07304e+00 3.54743e+00  0.00000e+00 0.00000e+00 7.34372e+01 120.301 9.22011e+00 120.301 0.8676 
1 1 1 17  56  3  o 5  3.57306e+00 1.22520e+00 2.71889e+01 313.488 1.23808e+00  -1.30523e+00 0.00000e+00 0.00000e+00 6.34433e+01 313.488 3.62544e+01 313.488 0.6618 
1 1 1 17  56  4  o 10 4.23138e+00 1.39877e+00 9.89375e+01 192.243 -6.47770e+00 -1.40559e+00 0.00000e+00 0.00000e+00 5.05113e+01 192.243 4.84262e+01 12.243  0.9211 
1 1 1 17  56  5  o 11 5.35114e+00 1.62154e+00 7.94287e+01 68.270  2.10123e+00  5.27226e+00  0.00000e+00 0.00000e+00 1.06746e+02 68.270  2.73173e+01 68.270  0.9070 
1 1 1 17  57  0  o 14 5.98080e+00 1.60086e+00 1.38550e+02 138.294 -7.51893e+00 6.70051e+00  0.00000e+00 0.00000e+00 7.85485e+01 138.294 6.00011e+01 318.294 0.9490 
1 1 1 17  57  1  o 19 4.98050e+00 1.49972e+00 4.58164e+01 339.928 2.90799e+00  -1.06257e+00 0.00000e+00 0.00000e+00 1.09901e+02 339.928 6.40846e+01 339.928 0.8168 
1 1 1 17  57  2  o 14 3.72764e+00 1.26689e+00 4.81605e+01 301.874 1.61727e+00  -2.60087e+00 0.00000e+00 0.00000e+00 6.81226e+01 301.874 1.99621e+01 301.874 0.8145 
1 1 1 17  57  3  o 14 4.93021e+00 1.51513e+00 1.09711e+02 98.205  -1.11689e+00 7.74549e+00  0.00000e+00 0.00000e+00 6.66905e+01 98.205  4.30207e+01 278.205 0.9337 
1 1 1 17  57  4  o 3  7.22331e+00 1.85701e+00 1.52726e+02 172.637 -1.20094e+01 1.55195e+00  0.00000e+00 0.00000e+00 1.12502e+02 172.637 4.02238e+01 352.637 0.9578 
1 1 1 17  58  0  o 14 3.76137e+00 1.24521e+00 6.01807e+01 241.070 -1.81459e+00 -3.28313e+00 0.00000e+00 0.00000e+00 6.25584e+01 241.070 2.37765e+00 241.070 0.8532 
1 1 1 17  58  1  o 1  3.29292e+00 1.11274e+00 4.15825e+01 269.131 -4.02999e-02 -2.65607e+00 0.00000e+00 0.00000e+00 5.68375e+01 269.131 1.52551e+01 269.131 0.7810 
1 1 1 17  58  2  o 10 4.04202e+00 1.34806e+00 1.04644e+02 38.215  5.53454e+00  4.35766e+00  0.00000e+00 0.00000e+00 3.86854e+01 38.215  6.59588e+01 218.215 0.9260 
1 1 1 17  58  3  o 9  5.55763e+00 1.59778e+00 1.32816e+02 205.958 -8.53428e+00 -4.15474e+00 0.00000e+00 0.00000e+00 6.85639e+01 205.958 6.42524e+01 25.958  0.9458 
1 1 1 17  58  4  o 2  4.64630e+00 1.47941e+00 4.34321e+01 153.863 -2.64513e+00 1.29793e+00  0.00000e+00 0.00000e+00 1.00105e+02 153.863 5.66727e+01 153.863 0.8059 
1 1 1 17  59  0  f 0  4.44170e+00 1.38714e+00 1.94536e+01 0.436   1.33599e+00  1.01593e-02  0.00000e+00 0.00000e+00 7.44554e+01 0.436   5.50019e+01 0.436   0.5529 
1 1 1 17  59  1  o 16 4.23523e+00 1.34590e+00 3.46202e+01 170.702 -2.35374e+00 3.85356e-01  0.00000e+00 0.00000e+00 8.72291e+01 170.702 5.26089e+01 170.702 0.7519 
1 1 1 17  59  2  o 13 3.79288e+00 1.28111e+00 2.97267e+01 222.517 -1.46896e+00 -1.34683e+00 0.00000e+00 0.00000e+00 7.14324e+01 222.517 4.17057e+01 222.517 0.6966 
1 1 1 17  59  3  o 15 5.09645e+00 1.46866e+00 9.35024e+01 52.682  4.28609e+00  5.62265e+00  0.00000e+00 0.00000e+00 8.73395e+01 52.682  6.16296e+00 232.682 0.9263 
1 1 1 17  59  4  o 14 3.77003e+00 1.26687e+00 5.23157e+01 195.339 -3.37139e+00 -9.24760e-01 0.00000e+00 0.00000e+00 6.91815e+01 195.339 1.68659e+01 195.339 0.8409 
1 1 1 17  60  0  f 0  4.45456e+00 1.41014e+00 1.00609e+02 354.920 6.88211e+00  -6.11745e-01 0.00000e+00 0.00000e+00 5.68422e+01 354.920 4.37673e+01 174.920 0.9245 
1 1 1 17  60  1  o 9  4.30096e+00 1.37486e+00 8.28301e+01 346.106 5.64246e+00  -1.39571e+00 0.00000e+00 0.00000e+00 6.67972e+01 346.106 1.60329e+01 166.106 0.9093 
1 1 1 17  60  2  f 0  5.89585e+00 1.70724e+00 1.05454e+02 177.913 -7.63102e+00 2.78065e-01  0.00000e+00 0.00000e+00 1.04896e+02 177.913 5.58300e-01 357.913 0.9320 
1 1 1 17  60  3  o 9  5.39968e+00 1.56702e+00 9.64390e+01 116.825 -3.25910e+00 6.44497e+00  0.00000e+00 0.00000e+00 9.54680e+01 116.825 9.70961e-01 296.825 0.9279 
1 1 1 17  60  4  o 5  3.78220e+00 1.26820e+00 5.20110e+01 13.194  3.75298e+00  8.79816e-01  0.00000e+00 0.00000e+00 7.22939e+01 13.194  2.02829e+01 13.194  0.8577 
1 1 1 17  61  0  o 7  4.28722e+00 1.34037e+00 6.35584e+01 147.302 -3.85371e+00 2.47385e+00  0.00000e+00 0.00000e+00 8.10889e+01 147.302 1.75304e+01 147.302 0.8826 
1 1 1 17  61  1  o 16 5.02265e+00 1.49710e+00 8.22822e+01 209.347 -5.02256e+00 -2.82399e+00 0.00000e+00 0.00000e+00 9.22601e+01 209.347 9.97785e+00 209.347 0.9085 
1 1 1 17  61  2  o 13 6.14815e+00 1.67374e+00 1.02979e+02 28.332  6.98985e+00  3.76873e+00  0.00000e+00 0.00000e+00 1.16977e+02 28.332  1.39983e+01 28.332  0.9347 
1 1 1 17  61  3  o 19 3.83870e+00 1.28741e+00 5.04051e+01 278.603 5.04529e-01  -3.33505e+00 0.00000e+00 0.00000e+00 7.22203e+01 278.603 2.18152e+01 278.603 0.8342 
1 1 1 17  61  4  o 12 3.74606e+00 1.23634e+00 2.22299e+01 235.486 -9.33724e-01 -1.35787e+00 0.00000e+00 0.00000e+00 6.82784e+01 235.486 4.60485e+01 235.486 0.6306 
1 1 1 17  62  0  o 13 5.61876e+00 1.59551e+00 1.01425e+02 349.319 7.22159e+00  -1.36205e+00 0.00000e+00 0.00000e+00 9.81257e+01 349.319 3.29937e+00 169.319 0.9292 
1 1 1 17  62  1  o 11 3.80076e+00 1.25453e+00 4.76592e+01 294.867 1.36469e+00  -2.94445e+00 0.00000e+00 0.00000e+00 7.24953e+01 294.867 2.48361e+01 294.867 0.8266 
1 1 1 17  62  2  o 13 5.58773e+00 1.54069e+00 6.78985e+01 284.997 1.39195e+00  -5.19607e+00 0.00000e+00 0.00000e+00 1.24867e+02 284.997 5.69680e+01 284.997 0.9015 
1 1 1 17  62  3  o 8  5.37816e+00 1.56446e+00 7.48063e+01 353.616 5.59939e+00  -6.26476e-01 0.00000e+00 0.00000e+00 1.11812e+02 353.616 3.70059e+01 353.616 0.9063 
1 1 1 17  63  0  o 5  7.94142e+00 1.65597e+00 1.53267e+02 108.053 -4.80343e+00 1.47371e+01  0.00000e+00 0.00000e+00 1.40242e+02 108.053 1.30244e+01 288.053 0.9672 
1 1 1 17  63  1  o 13 4.53435e+00 1.40854e+00 4.49610e+01 286.599 9.24188e-01  -3.10033e+00 0.00000e+00 0.00000e+00 9.82502e+01 286.599 5.32892e+01 286.599 0.8260 
1 1 1 17  63  2  o 17 4.70424e+00 1.40871e+00 1.32601e+02 244.405 -4.23510e+00 -8.84149e+00 0.00000e+00 0.00000e+00 3.79444e+01 244.405 9.46569e+01 64.405  0.9475 
1 1 1 17  63  3  o 17 5.30066e+00 1.59456e+00 1.05266e+02 6.658   7.92852e+00  9.25450e-01  0.00000e+00 0.00000e+00 8.44777e+01 6.658   2.07887e+01 186.658 0.9351 
1 1 1 17  64  0  o 5  6.06271e+00 1.64439e+00 5.80711e+01 150.213 -3.97950e+00 2.27784e+00  0.00000e+00 0.00000e+00 1.46413e+02 150.213 8.83420e+01 150.213 0.8828 
1 1 1 17  64  1  o 9  5.78322e+00 1.61190e+00 1.13019e+02 206.604 -7.65827e+00 -3.83558e+00 0.00000e+00 0.00000e+00 9.47440e+01 206.604 1.82746e+01 26.604  0.9397 
1 1 1 17  64  2  f 0  4.20611e+00 1.35457e+00 4.10382e+01 267.344 -1.34032e-01 -2.88896e+00 0.00000e+00 0.00000e+00 8.79532e+01 267.344 4.69150e+01 267.344 0.8017 
1 1 1 17  64  3  f 0  3.36535e+00 1.16350e+00 2.64451e+01 6.655   1.80942e+00  2.11119e-01  0.00000e+00 0.00000e+00 5.93677e+01 6.655   3.29226e+01 6.655   0.6662 
1 1 1 17  65  0  o 15 6.28517e+00 1.64010e+00 1.62416e+02 172.795 -1.31416e+01 1.66125e+00  0.00000e+00 0.00000e+00 6.84277e+01 172.795 9.39882e+01 352.795 0.9615 
1 1 1 17  65  1  o 9  3.63352e+00 1.21346e+00 3.13703e+01 120.332 -1.09201e+00 1.86638e+00  0.00000e+00 0.00000e+00 6.90081e+01 120.332 3.76378e+01 120.332 0.7227 
1 1 1 17  65  2  o 9  4.72827e+00 1.43006e+00 8.20419e+01 173.455 -6.38285e+00 7.32353e-01  0.00000e+00 0.00000e+00 8.40621e+01 173.455 2.02029e+00 173.455 0.9185 
1 1 1 17  66  0  o 8  5.13515e+00 1.46248e+00 5.30131e+01 137.543 -3.06834e+00 2.80740e+00  0.00000e+00 0.00000e+00 1.17492e+02 137.543 6.44792e+01 137.543 0.8694 
1 1 1 17  66  1  o 5  5.15711e+00 1.51601e+00 5.57321e+01 119.745 -2.22045e+00 3.88575e+00  0.00000e+00 0.00000e+00 1.17633e+02 119.745 6.19005e+01 119.745 0.8796 
1 1 1 17  66  2  o 7  3.56640e+00 1.19852e+00 7.31925e+01 152.414 -4.58557e+00 2.39588e+00  0.00000e+00 0.00000e+00 4.91775e+01 152.414 2.40150e+01 332.414 0.8973 
1 1 1 17  67  0  o 11 3.25918e+00 1.10693e+00 5.57174e+01 139.745 -3.10115e+00 2.62577e+00  0.00000e+00 0.00000e+00 5.20505e+01 139.745 3.66690e+00 319.745 0.8659 
1 1 1 17  67  1  o 12 4.00480e+00 1.29240e+00 4.08192e+01 132.398 -2.00813e+00 2.19937e+00  0.00000e+00 0.00000e+00 8.28822e+01 132.398 4.20630e+01 132.398 0.8084 
1 1 1 17  68  0  o 16 3.98053e+00 1.28726e+00 1.09566e+02 211.210 -6.82536e+00 -4.13522e+00 0.00000e+00 0.00000e+00 3.25384e+01 211.210 7.70275e+01 31.210  0.9351 
1 1 1 17  68  1  o 12 4.03128e+00 1.29651e+00 5.47532e+01 87.714  1.71151e-01  4.28797e+00  0.00000e+00 0.00000e+00 7.98306e+01 87.714  2.50774e+01 87.714  0.8739 
1 1 1 17  69  0  o 2  8.65228e+00 1.60738e+00 1.79598e+02 79.080  4.28653e+00  2.22189e+01  0.00000e+00 0.00000e+00 1.43292e+02 79.080  3.63057e+01 259.080 0.9776 
1 1 1 17  70  0  o 9  3.30962e+00 1.12345e+00 5.38026e+01 248.658 -1.52952e+00 -3.91460e+00 0.00000e+00 0.00000e+00 5.61993e+01 248.658 2.39671e+00 248.658 0.8709 
1 1 1 18  0   0  o 19 5.29999e+00 2.97421e+00 7.95001e+00 180.000 -1.58368e-01 0.00000e+00  0.00000e+00 0.00000e+00 2.41189e+01 180.000 1.61689e+01 180.000 0.1571 
1 1 1 18  0   1  o 5  4.31173e+00 2.66679e+00 1.26810e+02 180.000 -2.44926e+00 0.00000e+00  0.00000e+00 0.00000e+00 3.69576e+01 180.000 8.98520e+01 0.000   0.9852 
1 1 1 18  0   2  o 3  4.00674e+00 2.57537e+00 2.52955e+01 180.000 -4.69574e-01 0.00000e+00  0.00000e+00 0.00000e+00 4.23830e+01 180.000 1.70876e+01 180.000 0.4379 
1 1 1 18  0   3  o 3  3.81927e+00 2.51486e+00 6.73260e+01 180.000 -1.25028e+00 0.00000e+00  0.00000e+00 0.00000e+00 5.77397e+01 180.000 9.58626e+00 0.000   0.8484 
1 1 1 18  0   4  f 0  7.08769e+00 3.47420e+00 2.44179e+01 0.000   5.47870e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.12146e+02 0.000   8.77285e+01 0.000   0.4989 
1 1 1 18  0   5  o 12 3.99611e+00 2.59555e+00 3.39973e+01 180.000 -6.58438e-01 0.00000e+00  0.00000e+00 0.00000e+00 5.51385e+01 180.000 2.11412e+01 180.000 0.5773 
1 1 1 18  0   6  o 10 3.36277e+00 2.40126e+00 7.19733e+01 180.000 -1.33050e+00 0.00000e+00  0.00000e+00 0.00000e+00 4.10237e+01 180.000 3.09495e+01 0.000   0.8694 
1 1 1 18  1   0  f 0  8.97664e+00 1.85769e+00 1.95844e+02 212.871 -1.29175e+01 -8.34731e+00 0.00000e+00 0.00000e+00 1.38549e+02 212.871 5.72957e+01 32.871  0.9669 
1 1 1 18  1   1  o 10 4.83911e+00 1.52898e+00 8.73228e+01 97.730  -6.44882e-01 4.75070e+00  0.00000e+00 0.00000e+00 7.84138e+01 97.730  8.90891e+00 277.730 0.8884 
1 1 1 18  1   2  o 14 6.92892e+00 1.87715e+00 1.51891e+02 14.644  9.09794e+00  2.37726e+00  0.00000e+00 0.00000e+00 1.00766e+02 14.644  5.11253e+01 194.644 0.9452 
1 1 1 18  1   3  o 11 5.67714e+00 1.62946e+00 1.52130e+02 173.788 -9.22758e+00 1.00436e+00  0.00000e+00 0.00000e+00 5.48388e+01 173.788 9.72907e+01 353.788 0.9445 
1 1 1 18  1   4  o 18 4.66402e+00 1.51260e+00 9.09743e+01 0.081   4.95730e+00  7.04474e-03  0.00000e+00 0.00000e+00 6.97610e+01 0.081   2.12133e+01 180.081 0.8924 
1 1 1 18  1   5  o 15 5.96066e+00 1.76644e+00 1.18078e+02 248.569 -2.61414e+00 -6.65987e+00 0.00000e+00 0.00000e+00 9.54583e+01 248.569 2.26195e+01 68.569  0.9272 
1 1 1 18  1   6  o 2  5.42093e+00 1.77904e+00 4.86815e+01 161.833 -2.60096e+00 8.53478e-01  0.00000e+00 0.00000e+00 1.16536e+02 161.833 6.78541e+01 161.833 0.7885 
1 1 1 18  2   0  o 13 5.80680e+00 1.67980e+00 8.39221e+01 10.136  4.69431e+00  8.39210e-01  0.00000e+00 0.00000e+00 1.14672e+02 10.136  3.07497e+01 10.136  0.8877 
1 1 1 18  2   1  o 2  4.60819e+00 1.48563e+00 1.21967e+02 62.224  3.05894e+00  5.80774e+00  0.00000e+00 0.00000e+00 4.15338e+01 62.224  8.04329e+01 242.224 0.9203 
1 1 1 18  2   2  f 0  1.06443e+01 1.81210e+00 2.13651e+02 195.113 -2.04620e+01 -5.52612e+00 0.00000e+00 0.00000e+00 1.87165e+02 195.113 2.64855e+01 15.113  0.9761 
1 1 1 18  2   3  o 14 9.30898e+00 1.94480e+00 2.05781e+02 140.176 -1.28153e+01 1.06862e+01  0.00000e+00 0.00000e+00 1.42597e+02 140.176 6.31840e+01 320.176 0.9696 
1 1 1 18  2   4  o 9  7.21286e+00 1.97575e+00 1.43622e+02 104.505 -2.22155e+00 8.58709e+00  0.00000e+00 0.00000e+00 1.18722e+02 104.505 2.48997e+01 284.505 0.9418 
1 1 1 18  2   5  o 4  6.14999e+00 1.80888e+00 7.93905e+01 95.496  -4.61620e-01 4.79726e+00  0.00000e+00 0.00000e+00 1.31851e+02 95.496  5.24602e+01 95.496  0.8890 
1 1 1 18  2   6  o 6  7.13263e+00 2.12013e+00 1.51188e+02 46.574  6.07060e+00  6.41375e+00  0.00000e+00 0.00000e+00 1.08383e+02 46.574  4.28053e+01 226.574 0.9416 
1 1 1 18  3   0  o 10 5.76777e+00 1.69363e+00 1.01573e+02 226.186 -3.93413e+00 -4.10045e+00 0.00000e+00 0.00000e+00 9.99949e+01 226.186 1.57804e+00 46.186  0.9071 
1 1 1 18  3   1  o 2  5.67334e+00 1.66619e+00 4.30865e+01 66.273  1.01819e+00  2.31655e+00  0.00000e+00 0.00000e+00 1.24949e+02 66.273  8.18620e+01 66.273  0.7683 
1 1 1 18  3   2  o 2  8.63232e+00 1.90570e+00 9.78781e+01 242.609 -3.40933e+00 -6.57978e+00 0.00000e+00 0.00000e+00 2.11767e+02 242.609 1.13889e+02 242.609 0.9299 
1 1 1 18  3   3  o 3  3.92985e+00 1.33241e+00 8.36956e+01 221.420 -3.24203e+00 -2.86027e+00 0.00000e+00 0.00000e+00 4.90154e+01 221.420 3.46803e+01 41.420  0.8749 
1 1 1 18  3   4  o 10 6.70415e+00 1.87488e+00 1.10926e+02 196.628 -6.51940e+00 -1.94693e+00 0.00000e+00 0.00000e+00 1.28113e+02 196.628 1.71868e+01 196.628 0.9233 
1 1 1 18  3   5  o 14 4.84590e+00 1.54948e+00 1.13593e+02 352.650 6.46187e+00  -8.33515e-01 0.00000e+00 0.00000e+00 5.85958e+01 352.650 5.49972e+01 172.650 0.9197 
1 1 1 18  4   0  o 6  8.07026e+00 1.77374e+00 1.72179e+02 2.204   1.28021e+01  4.92734e-01  0.00000e+00 0.00000e+00 1.26336e+02 2.204   4.58432e+01 182.204 0.9601 
1 1 1 18  4   1  o 16 4.85085e+00 1.51368e+00 4.79914e+01 178.250 -2.66653e+00 8.14814e-02  0.00000e+00 0.00000e+00 9.82639e+01 178.250 5.02725e+01 178.250 0.7821 
1 1 1 18  4   2  o 8  1.15575e+01 1.82213e+00 1.94865e+02 108.509 -6.61903e+00 1.97721e+01  0.00000e+00 0.00000e+00 2.40154e+02 108.509 4.52893e+01 108.509 0.9757 
1 1 1 18  4   3  o 2  7.34823e+00 1.87488e+00 8.29193e+01 99.933  -9.58411e-01 5.47287e+00  0.00000e+00 0.00000e+00 1.73725e+02 99.933  9.08058e+01 99.933  0.9049 
1 1 1 18  4   4  o 8  5.15913e+00 1.73290e+00 9.73306e+01 22.784  4.65666e+00  1.95597e+00  0.00000e+00 0.00000e+00 8.08949e+01 22.784  1.64357e+01 202.784 0.8945 
1 1 1 18  4   5  o 18 5.47386e+00 1.71925e+00 1.06398e+02 14.374  5.92534e+00  1.51853e+00  0.00000e+00 0.00000e+00 8.69282e+01 14.374  1.94699e+01 194.374 0.9141 
1 1 1 18  5   0  o 11 1.79399e+01 1.34922e+00 2.36238e+02 179.404 -5.10979e+01 5.31721e-01  0.00000e+00 0.00000e+00 4.48090e+02 179.404 2.11852e+02 179.404 0.9902 
1 1 1 18  5   1  o 13 6.39388e+00 1.80679e+00 8.98650e+01 313.564 3.82614e+00  -4.02296e+00 0.00000e+00 0.00000e+00 1.33157e+02 313.564 4.32916e+01 313.564 0.9048 
1 1 1 18  5   2  o 1  4.49472e+00 1.46991e+00 3.69787e+01 159.167 -1.84140e+00 7.00692e-01  0.00000e+00 0.00000e+00 8.31472e+01 159.167 4.61685e+01 159.167 0.6928 
1 1 1 18  5   3  o 11 8.66262e+00 1.99746e+00 1.66384e+02 202.574 -1.11993e+01 -4.65587e+00 0.00000e+00 0.00000e+00 1.53879e+02 202.574 1.25048e+01 22.574  0.9578 
1 1 1 18  5   4  o 14 6.13401e+00 1.92158e+00 1.25566e+02 31.090  5.85025e+00  3.52770e+00  0.00000e+00 0.00000e+00 9.32169e+01 31.090  3.23492e+01 211.090 0.9236 
1 1 1 18  5   5  o 18 4.63504e+00 1.54794e+00 1.21615e+02 282.432 1.43762e+00  -6.52117e+00 0.00000e+00 0.00000e+00 4.34460e+01 282.432 7.81693e+01 102.432 0.9217 
1 1 1 18  6   0  o 12 5.07997e+00 1.57220e+00 1.70397e+02 322.300 7.17156e+00  -5.54271e+00 0.00000e+00 0.00000e+00 1.41696e+01 322.300 1.56227e+02 142.300 0.9431 
1 1 1 18  6   1  o 16 9.69824e+00 1.91879e+00 2.08762e+02 131.983 -1.21410e+01 1.34920e+01  0.00000e+00 0.00000e+00 1.54662e+02 131.983 5.41006e+01 311.983 0.9720 
1 1 1 18  6   2  o 6  8.12525e+00 1.84374e+00 1.33255e+02 299.209 4.88020e+00  -8.72888e+00 0.00000e+00 0.00000e+00 1.64068e+02 299.209 3.08126e+01 299.209 0.9486 
1 1 1 18  6   3  o 8  4.38857e+00 1.44340e+00 1.81184e+02 103.812 -2.29259e+00 9.32539e+00  0.00000e+00 0.00000e+00 2.08752e+01 283.812 2.02059e+02 283.812 0.9464 
1 1 1 18  6   4  o 2  5.61117e+00 1.79617e+00 8.54809e+01 211.154 -3.95606e+00 -2.39157e+00 0.00000e+00 0.00000e+00 1.06033e+02 211.154 2.05524e+01 211.154 0.8838 
1 1 1 18  6   5  o 8  6.37060e+00 1.87614e+00 8.09256e+01 270.871 7.38429e-02  -4.85688e+00 0.00000e+00 0.00000e+00 1.38117e+02 270.871 5.71913e+01 270.871 0.8900 
1 1 1 18  7   0  o 5  9.64850e+00 1.78064e+00 2.09501e+02 111.137 -7.00238e+00 1.81124e+01  0.00000e+00 0.00000e+00 1.52489e+02 111.137 5.70121e+01 291.137 0.9739 
1 1 1 18  7   1  o 5  5.73942e+00 1.69706e+00 7.10627e+01 154.369 -3.82623e+00 1.83580e+00  0.00000e+00 0.00000e+00 1.21934e+02 154.369 5.08714e+01 154.369 0.8723 
1 1 1 18  7   2  f 0  6.63296e+00 1.78234e+00 1.18524e+02 349.809 7.44074e+00  -1.33757e+00 0.00000e+00 0.00000e+00 1.19761e+02 349.809 1.23766e+00 349.809 0.9313 
1 1 1 18  7   3  o 5  7.27960e+00 1.64277e+00 9.49151e+01 128.964 -4.58846e+00 5.67366e+00  0.00000e+00 0.00000e+00 1.66021e+02 128.964 7.11056e+01 128.964 0.9287 
1 1 1 18  7   4  o 15 6.22452e+00 1.88861e+00 3.42864e+01 346.915 1.88373e+00  -4.37843e-01 0.00000e+00 0.00000e+00 1.30755e+02 346.915 9.64691e+01 346.915 0.6866 
1 1 1 18  7   5  o 10 6.11458e+00 1.79974e+00 8.83328e+01 259.828 -9.70070e-01 -5.40636e+00 0.00000e+00 0.00000e+00 1.25142e+02 259.828 3.68095e+01 259.828 0.9037 
1 1 1 18  8   0  o 13 5.59420e+00 1.58513e+00 7.24196e+01 209.131 -3.87018e+00 -2.15684e+00 0.00000e+00 0.00000e+00 1.16846e+02 209.131 4.44266e+01 209.131 0.8783 
1 1 1 18  8   1  o 3  6.12361e+00 1.69547e+00 6.84918e+01 338.661 4.06870e+00  -1.58953e+00 0.00000e+00 0.00000e+00 1.38374e+02 338.661 6.98817e+01 338.661 0.8763 
1 1 1 18  8   2  o 18 4.86886e+00 1.56165e+00 1.04712e+02 70.926  1.85583e+00  5.36711e+00  0.00000e+00 0.00000e+00 6.56433e+01 70.926  3.90685e+01 250.926 0.9071 
1 1 1 18  8   3  o 15 5.05754e+00 1.52692e+00 5.41377e+01 298.719 1.50151e+00  -2.74045e+00 0.00000e+00 0.00000e+00 1.05693e+02 298.719 5.15552e+01 298.719 0.8188 
1 1 1 18  8   4  o 12 4.76862e+00 1.54322e+00 8.22202e+01 177.561 -4.47743e+00 1.90735e-01  0.00000e+00 0.00000e+00 7.97857e+01 177.561 2.43450e+00 357.561 0.8798 
1 1 1 18  8   5  o 16 6.49957e+00 1.97279e+00 6.49885e+01 125.075 -2.18752e+00 3.11542e+00  0.00000e+00 0.00000e+00 1.49864e+02 125.075 8.48758e+01 125.075 0.8557 
1 1 1 18  9   0  o 12 5.01976e+00 1.50387e+00 3.35447e+01 253.271 -5.59523e-01 -1.86151e+00 0.00000e+00 0.00000e+00 9.95554e+01 253.271 6.60108e+01 253.271 0.6883 
1 1 1 18  9   1  o 5  4.63595e+00 1.51146e+00 1.17358e+02 31.576  5.47502e+00  3.36515e+00  0.00000e+00 0.00000e+00 4.67880e+01 31.576  7.05700e+01 211.576 0.9185 
1 1 1 18  9   2  o 19 1.06210e+01 1.85641e+00 2.06236e+02 115.055 -8.49244e+00 1.81667e+01  0.00000e+00 0.00000e+00 1.93096e+02 115.055 1.31392e+01 295.055 0.9747 
1 1 1 18  9   3  o 1  7.03187e+00 1.89002e+00 1.07671e+02 267.977 -2.39526e-01 -6.78102e+00 0.00000e+00 0.00000e+00 1.42840e+02 267.977 3.51692e+01 267.977 0.9231 
1 1 1 18  9   4  o 16 5.19378e+00 1.63526e+00 6.99243e+01 13.295  3.83907e+00  9.07133e-01  0.00000e+00 0.00000e+00 1.02827e+02 13.295  3.29031e+01 13.295  0.8614 
1 1 1 18  9   5  o 11 5.49293e+00 1.76611e+00 8.89822e+01 235.718 -2.86620e+00 -4.20454e+00 0.00000e+00 0.00000e+00 1.01023e+02 235.718 1.20410e+01 235.718 0.8954 
1 1 1 18  10  0  o 8  1.15303e+01 1.77074e+00 1.99806e+02 126.741 -1.33172e+01 1.78399e+01  0.00000e+00 0.00000e+00 2.34256e+02 126.741 3.44497e+01 126.741 0.9773 
1 1 1 18  10  1  o 7  5.54357e+00 1.69235e+00 9.92688e+01 286.309 1.61229e+00  -5.51033e+00 0.00000e+00 0.00000e+00 9.47919e+01 286.309 4.47691e+00 106.309 0.9081 
1 1 1 18  10  2  o 4  7.23145e+00 1.86452e+00 8.76688e+01 12.600  5.63308e+00  1.25912e+00  0.00000e+00 0.00000e+00 1.65785e+02 12.600  7.81161e+01 12.600  0.9087 
1 1 1 18  10  3  o 18 4.77067e+00 1.52000e+00 4.01870e+01 108.610 -7.01150e-01 2.08227e+00  0.00000e+00 0.00000e+00 9.37838e+01 108.610 5.35968e+01 108.610 0.7276 
1 1 1 18  10  4  o 16 8.20964e+00 1.98913e+00 1.32173e+02 144.351 -7.54580e+00 5.41210e+00  0.00000e+00 0.00000e+00 1.67242e+02 144.351 3.50694e+01 144.351 0.9445 
1 1 1 18  10  5  o 6  8.30115e+00 2.06864e+00 1.06368e+02 108.403 -2.35273e+00 7.07114e+00  0.00000e+00 0.00000e+00 1.91950e+02 108.403 8.55818e+01 108.403 0.9303 
1 1 1 18  11  0  o 13 5.55441e+00 1.66678e+00 6.64118e+01 83.364  4.41111e-01  3.79175e+00  0.00000e+00 0.00000e+00 1.16755e+02 83.364  5.03434e+01 83.364  0.8561 
1 1 1 18  11  1  o 4  1.12088e+01 1.76722e+00 2.19759e+02 359.210 2.36567e+01  -3.26065e-01 0.00000e+00 0.00000e+00 2.03064e+02 359.210 1.66950e+01 179.210 0.9786 
1 1 1 18  11  2  o 9  4.51029e+00 1.48871e+00 9.07476e+01 240.690 -2.23436e+00 -3.97995e+00 0.00000e+00 0.00000e+00 6.27222e+01 240.690 2.80253e+01 60.690  0.8822 
1 1 1 18  11  3  o 11 6.33925e+00 1.83433e+00 7.24161e+01 112.139 -1.65381e+00 4.06483e+00  0.00000e+00 0.00000e+00 1.42130e+02 112.139 6.97140e+01 112.139 0.8770 
1 1 1 18  11  4  o 2  4.65969e+00 1.54924e+00 6.52135e+01 54.454  2.03453e+00  2.84747e+00  0.00000e+00 0.00000e+00 8.61162e+01 54.454  2.09028e+01 54.454  0.8411 
1 1 1 18  11  5  o 8  4.54173e+00 1.57522e+00 1.10355e+02 137.273 -4.39456e+00 4.05907e+00  0.00000e+00 0.00000e+00 4.96671e+01 137.273 6.06874e+01 317.273 0.9121 
1 1 1 18  12  0  o 6  6.78453e+00 1.78657e+00 6.29397e+01 329.471 3.60314e+00  -2.12486e+00 0.00000e+00 0.00000e+00 1.64470e+02 329.471 1.01530e+02 329.471 0.8702 
1 1 1 18  12  1  o 5  4.65046e+00 1.51465e+00 6.77756e+01 99.802  -6.08627e-01 3.52272e+00  0.00000e+00 0.00000e+00 8.36783e+01 99.802  1.59028e+01 99.802  0.8449 
1 1 1 18  12  2  o 14 6.33588e+00 1.88911e+00 1.31031e+02 301.766 3.77433e+00  -6.09546e+00 0.00000e+00 0.00000e+00 9.55934e+01 301.766 3.54375e+01 121.766 0.9274 
1 1 1 18  12  3  o 18 7.13315e+00 1.90525e+00 1.70673e+02 83.771  1.20364e+00  1.10271e+01  0.00000e+00 0.00000e+00 9.18886e+01 83.771  7.87840e+01 263.771 0.9538 
1 1 1 18  12  4  o 13 4.83423e+00 1.57590e+00 1.17620e+02 301.593 3.36697e+00  -5.47437e+00 0.00000e+00 0.00000e+00 5.38272e+01 301.593 6.37926e+01 121.593 0.9185 
1 1 1 18  12  5  o 13 5.82256e+00 1.82210e+00 8.22544e+01 90.367  -3.06007e-02 4.77418e+00  0.00000e+00 0.00000e+00 1.17443e+02 90.367  3.51890e+01 90.367  0.8879 
1 1 1 18  13  0  o 11 9.38173e+00 1.88142e+00 1.74573e+02 112.298 -5.71124e+00 1.39265e+01  0.00000e+00 0.00000e+00 1.74564e+02 112.298 8.10200e-03 292.298 0.9662 
1 1 1 18  13  1  o 11 6.13684e+00 1.75650e+00 1.03251e+02 285.699 1.65742e+00  -5.89689e+00 0.00000e+00 0.00000e+00 1.13006e+02 285.699 9.75509e+00 285.699 0.9143 
1 1 1 18  13  2  o 18 7.94198e+00 1.85186e+00 1.06751e+02 314.346 5.23725e+00  -5.35822e+00 0.00000e+00 0.00000e+00 1.78314e+02 314.346 7.15627e+01 314.346 0.9307 
1 1 1 18  13  3  o 8  4.93379e+00 1.58521e+00 3.08923e+01 163.682 -1.65797e+00 4.85396e-01  0.00000e+00 0.00000e+00 9.24016e+01 163.682 6.15093e+01 163.682 0.6476 
1 1 1 18  13  4  o 18 6.02026e+00 1.77211e+00 6.97454e+01 92.313  -1.69029e-01 4.18395e+00  0.00000e+00 0.00000e+00 1.32562e+02 92.313  6.28168e+01 92.313  0.8704 
1 1 1 18  13  5  f 0  6.50446e+00 1.89389e+00 5.58374e+01 183.830 -3.43501e+00 -2.29941e-01 0.00000e+00 0.00000e+00 1.54723e+02 183.830 9.88860e+01 183.830 0.8381 
1 1 1 18  14  0  o 13 5.33564e+00 1.56798e+00 5.24598e+01 33.455  2.65337e+00  1.75323e+00  0.00000e+00 0.00000e+00 1.16563e+02 33.455  6.41031e+01 33.455  0.8225 
1 1 1 18  14  1  f 0  7.57047e+00 1.77944e+00 1.62946e+02 338.246 1.10443e+01  -4.40701e+00 0.00000e+00 0.00000e+00 1.16285e+02 338.246 4.66610e+01 158.246 0.9570 
1 1 1 18  14  2  o 2  6.03257e+00 1.72367e+00 5.34785e+01 164.284 -3.13463e+00 8.82042e-01  0.00000e+00 0.00000e+00 1.38995e+02 164.284 8.55163e+01 164.284 0.8273 
1 1 1 18  14  3  o 11 6.72316e+00 1.79607e+00 1.45288e+02 74.888  2.49627e+00  9.24398e+00  0.00000e+00 0.00000e+00 1.00204e+02 74.888  4.50837e+01 254.888 0.9462 
1 1 1 18  14  4  o 5  1.24741e+01 1.88387e+00 1.66235e+02 4.443   1.91068e+01  1.48467e+00  0.00000e+00 0.00000e+00 3.02631e+02 4.443   1.36396e+02 4.443   0.9736 
1 1 1 18  14  5  o 11 5.34916e+00 1.69923e+00 1.09450e+02 186.861 -6.31675e+00 -7.60051e-01 0.00000e+00 0.00000e+00 8.01506e+01 186.861 2.92990e+01 6.861   0.9176 
1 1 1 18  15  0  f 0  1.35820e+01 1.91945e+00 2.86396e+02 99.255  -5.44498e+00 3.34135e+01  0.00000e+00 0.00000e+00 2.28914e+02 99.255  5.74819e+01 279.255 0.9851 
1 1 1 18  15  1  o 18 6.51905e+00 1.79672e+00 1.10431e+02 43.514  4.97370e+00  4.72223e+00  0.00000e+00 0.00000e+00 1.21701e+02 43.514  1.12701e+01 43.514  0.9239 
1 1 1 18  15  2  o 11 1.07072e+01 1.88745e+00 1.79843e+02 226.781 -1.19318e+01 -1.26977e+01 0.00000e+00 0.00000e+00 2.21053e+02 226.781 4.12107e+01 226.781 0.9709 
1 1 1 18  15  3  o 5  7.07233e+00 1.89393e+00 1.55915e+02 22.186  8.96842e+00  3.65736e+00  0.00000e+00 0.00000e+00 1.02490e+02 22.186  5.34251e+01 202.186 0.9469 
1 1 1 18  15  4  o 9  4.96309e+00 1.58245e+00 6.25887e+01 35.914  2.85643e+00  2.06878e+00  0.00000e+00 0.00000e+00 9.88417e+01 35.914  3.62530e+01 35.914  0.8425 
1 1 1 18  15  5  o 18 4.60966e+00 1.52735e+00 6.68897e+01 217.792 -3.03896e+00 -2.35656e+00 0.00000e+00 0.00000e+00 8.57504e+01 217.792 1.88607e+01 217.792 0.8573 
1 1 1 18  16  0  o 12 4.75024e+00 1.52607e+00 1.77554e+01 70.163  3.22183e-01  8.93077e-01  0.00000e+00 0.00000e+00 6.05766e+01 70.163  4.28212e+01 70.163  0.4282 
1 1 1 18  16  1  o 14 5.48600e+00 1.67394e+00 1.41310e+02 182.869 -7.99885e+00 -4.00923e-01 0.00000e+00 0.00000e+00 5.64385e+01 182.869 8.48710e+01 2.869   0.9353 
1 1 1 18  16  2  o 1  5.28669e+00 1.64260e+00 9.22961e+01 339.725 4.87495e+00  -1.80090e+00 0.00000e+00 0.00000e+00 9.07326e+01 339.725 1.56356e+00 159.725 0.8978 
1 1 1 18  16  3  f 0  6.35443e+00 1.78649e+00 6.95036e+01 314.283 2.90178e+00  -2.97531e+00 0.00000e+00 0.00000e+00 1.43631e+02 314.283 7.41273e+01 314.283 0.8693 
1 1 1 18  16  4  o 2  7.72907e+00 1.92229e+00 8.92288e+01 333.888 5.61790e+00  -2.75367e+00 0.00000e+00 0.00000e+00 1.84141e+02 333.888 9.49118e+01 333.888 0.9162 
1 1 1 18  16  5  o 19 5.60646e+00 1.76326e+00 1.04323e+02 20.882  5.73984e+00  2.18971e+00  0.00000e+00 0.00000e+00 9.37067e+01 20.882  1.06160e+01 200.882 0.9145 
1 1 1 18  17  0  o 15 5.61004e+00 1.64053e+00 8.64653e+01 154.055 -4.55040e+00 2.21396e+00  0.00000e+00 0.00000e+00 1.06845e+02 154.055 2.03795e+01 154.055 0.8948 
1 1 1 18  17  1  o 15 6.14526e+00 1.67934e+00 1.13351e+02 338.929 6.41625e+00  -2.47206e+00 0.00000e+00 0.00000e+00 1.05501e+02 338.929 7.84964e+00 158.929 0.9241 
1 1 1 18  17  2  o 13 6.95620e+00 1.83840e+00 7.81375e+01 56.376  2.79160e+00  4.19796e+00  0.00000e+00 0.00000e+00 1.61761e+02 56.376  8.36240e+01 56.376  0.8943 
1 1 1 18  17  3  o 17 7.97152e+00 2.01043e+00 1.42171e+02 150.241 -8.23960e+00 4.71104e+00  0.00000e+00 0.00000e+00 1.48716e+02 150.241 6.54516e+00 150.241 0.9458 
1 1 1 18  17  4  o 9  4.19657e+00 1.41940e+00 8.15439e+01 338.958 4.10318e+00  -1.57853e+00 0.00000e+00 0.00000e+00 6.05652e+01 338.958 2.09787e+01 158.958 0.8772 
1 1 1 18  17  5  o 5  6.79460e+00 1.98064e+00 1.21677e+02 149.425 -6.41501e+00 3.79006e+00  0.00000e+00 0.00000e+00 1.22433e+02 149.425 7.56390e-01 149.425 0.9302 
1 1 1 18  18  0  o 12 6.98672e+00 1.67321e+00 1.88443e+02 253.351 -3.90146e+00 -1.30467e+01 0.00000e+00 0.00000e+00 7.05310e+01 253.351 1.17912e+02 73.351  0.9626 
1 1 1 18  18  1  o 3  7.87518e+00 1.88118e+00 1.74475e+02 74.072  3.27284e+00  1.14681e+01  0.00000e+00 0.00000e+00 1.15982e+02 74.072  5.84932e+01 254.072 0.9571 
1 1 1 18  18  2  f 0  8.25528e+00 1.83203e+00 1.57782e+02 246.355 -4.86389e+00 -1.11092e+01 0.00000e+00 0.00000e+00 1.47120e+02 246.355 1.06618e+01 66.355  0.9578 
1 1 1 18  18  3  o 7  6.10770e+00 1.79861e+00 1.22610e+02 357.697 7.20250e+00  -2.89625e-01 0.00000e+00 0.00000e+00 9.60201e+01 357.697 2.65903e+01 177.697 0.9278 
1 1 1 18  18  4  o 12 5.37744e+00 1.66475e+00 9.99559e+01 263.864 -6.27410e-01 -5.83639e+00 0.00000e+00 0.00000e+00 8.90007e+01 263.864 1.09552e+01 83.864  0.9103 
1 1 1 18  18  5  o 15 4.52248e+00 1.52435e+00 5.17003e+01 321.485 2.35614e+00  -1.87514e+00 0.00000e+00 0.00000e+00 8.99114e+01 321.485 3.82111e+01 321.485 0.8108 
1 1 1 18  19  0  o 14 4.51405e+00 1.46792e+00 1.07002e+02 214.679 -4.71088e+00 -3.25946e+00 0.00000e+00 0.00000e+00 5.08148e+01 214.679 5.61870e+01 34.679  0.9079 
1 1 1 18  19  1  o 5  9.75216e+00 1.80279e+00 1.34338e+02 55.464  7.11273e+00  1.03352e+01  0.00000e+00 0.00000e+00 2.26145e+02 55.464  9.18062e+01 55.464  0.9593 
1 1 1 18  19  2  o 6  5.65667e+00 1.69068e+00 1.42192e+02 317.655 6.26921e+00  -5.71354e+00 0.00000e+00 0.00000e+00 6.26254e+01 317.655 7.95669e+01 137.655 0.9391 
1 1 1 18  19  3  o 7  4.79077e+00 1.54492e+00 4.25480e+01 310.848 1.52229e+00  -1.76060e+00 0.00000e+00 0.00000e+00 9.51213e+01 310.848 5.25733e+01 310.848 0.7449 
1 1 1 18  19  4  f 0  6.59978e+00 1.89525e+00 1.46722e+02 163.255 -8.62979e+00 2.59649e+00  0.00000e+00 0.00000e+00 9.34481e+01 163.255 5.32740e+01 343.255 0.9428 
1 1 1 18  19  5  o 11 5.58983e+00 1.66387e+00 1.74618e+02 317.403 8.32803e+00  -7.65731e+00 0.00000e+00 0.00000e+00 3.14720e+01 317.403 1.43146e+02 137.403 0.9547 
1 1 1 18  20  0  o 16 3.90727e+00 1.31279e+00 9.59859e+01 37.606  3.70550e+00  2.85427e+00  0.00000e+00 0.00000e+00 3.72090e+01 37.606  5.87770e+01 217.606 0.8853 
1 1 1 18  20  1  o 1  9.14386e+00 1.90404e+00 1.10670e+02 259.036 -1.72299e+00 -8.89385e+00 0.00000e+00 0.00000e+00 2.21601e+02 259.036 1.10931e+02 259.036 0.9431 
1 1 1 18  20  2  o 8  5.64502e+00 1.62829e+00 6.35745e+01 162.614 -3.76855e+00 1.17995e+00  0.00000e+00 0.00000e+00 1.23936e+02 162.614 6.03619e+01 162.614 0.8615 
1 1 1 18  20  3  o 13 1.07292e+01 1.96252e+00 2.46653e+02 234.758 -1.33031e+01 -1.88291e+01 0.00000e+00 0.00000e+00 1.58180e+02 234.758 8.84730e+01 54.758  0.9781 
1 1 1 18  20  4  o 6  7.63707e+00 1.79792e+00 1.64419e+02 35.474  1.01691e+01  7.24650e+00  0.00000e+00 0.00000e+00 1.18293e+02 35.474  4.61266e+01 215.474 0.9591 
1 1 1 18  20  5  o 7  5.14825e+00 1.64074e+00 9.08032e+01 26.154  4.81140e+00  2.36275e+00  0.00000e+00 0.00000e+00 8.83388e+01 26.154  2.46446e+00 206.154 0.9011 
1 1 1 18  21  0  o 18 5.20023e+00 1.59938e+00 4.97607e+01 160.758 -2.53636e+00 8.85360e-01  0.00000e+00 0.00000e+00 1.07182e+02 160.758 5.74208e+01 160.758 0.7838 
1 1 1 18  21  1  o 12 1.11547e+01 1.73069e+00 1.75939e+02 210.563 -1.69634e+01 -1.00174e+01 0.00000e+00 0.00000e+00 2.42790e+02 210.563 6.68514e+01 210.563 0.9743 
1 1 1 18  21  2  o 2  6.12684e+00 1.76105e+00 1.16086e+02 330.621 5.93480e+00  -3.34114e+00 0.00000e+00 0.00000e+00 1.02022e+02 330.621 1.40635e+01 150.622 0.9234 
1 1 1 18  21  3  o 18 4.82201e+00 1.58334e+00 7.01211e+01 36.013  3.07609e+00  2.23600e+00  0.00000e+00 0.00000e+00 8.90114e+01 36.013  1.88903e+01 36.013  0.8555 
1 1 1 18  21  4  o 18 4.70040e+00 1.54173e+00 9.31362e+01 7.729   5.30956e+00  7.20623e-01  0.00000e+00 0.00000e+00 7.03321e+01 7.729   2.28040e+01 187.729 0.9011 
1 1 1 18  21  5  o 5  5.51505e+00 1.73139e+00 1.29984e+02 93.776  -5.06790e-01 7.67799e+00  0.00000e+00 0.00000e+00 6.86050e+01 93.776  6.13792e+01 273.776 0.9326 
1 1 1 18  22  0  o 11 8.68541e+00 1.86878e+00 1.68676e+02 257.583 -2.88794e+00 -1.31161e+01 0.00000e+00 0.00000e+00 1.53013e+02 257.583 1.56627e+01 77.583  0.9620 
1 1 1 18  22  1  o 19 5.02025e+00 1.56394e+00 5.95738e+01 248.196 -1.23659e+00 -3.09114e+00 0.00000e+00 0.00000e+00 1.01283e+02 248.196 4.17091e+01 248.196 0.8317 
1 1 1 18  22  2  o 14 4.94482e+00 1.50850e+00 8.32142e+01 282.160 9.78510e-01  -4.54098e+00 0.00000e+00 0.00000e+00 8.53879e+01 282.160 2.17365e+00 282.160 0.8844 
1 1 1 18  22  3  o 19 8.03697e+00 2.04629e+00 1.17965e+02 65.726  3.23542e+00  7.17421e+00  0.00000e+00 0.00000e+00 1.71626e+02 65.726  5.36616e+01 65.726  0.9341 
1 1 1 18  22  4  o 10 8.98274e+00 1.99002e+00 1.71625e+02 283.499 3.20434e+00  -1.33484e+01 0.00000e+00 0.00000e+00 1.62172e+02 283.499 9.45301e+00 103.499 0.9629 
1 1 1 18  22  5  o 16 5.04196e+00 1.63748e+00 1.15733e+02 34.809  5.48053e+00  3.81036e+00  0.00000e+00 0.00000e+00 6.36996e+01 34.809  5.20337e+01 214.809 0.9217 
1 1 1 18  23  0  o 14 5.14567e+00 1.55713e+00 2.23048e+01 289.644 4.35528e-01  -1.22012e+00 0.00000e+00 0.00000e+00 8.49403e+01 289.644 6.26355e+01 289.644 0.5414 
1 1 1 18  23  1  o 6  6.01096e+00 1.60387e+00 1.65047e+02 240.784 -5.24516e+00 -9.37896e+00 0.00000e+00 0.00000e+00 5.54697e+01 240.784 1.09578e+02 60.784  0.9523 
1 1 1 18  23  2  f 0  5.49754e+00 1.65123e+00 6.62621e+01 90.879  -5.94585e-02 3.87382e+00  0.00000e+00 0.00000e+00 1.15677e+02 90.879  4.94150e+01 90.879  0.8585 
1 1 1 18  23  3  o 18 7.65363e+00 2.00224e+00 7.37595e+01 9.873   4.74978e+00  8.26696e-01  0.00000e+00 0.00000e+00 1.88700e+02 9.873   1.14941e+02 9.873   0.8891 
1 1 1 18  23  4  o 4  7.09822e+00 1.91685e+00 7.36380e+01 228.122 -3.25646e+00 -3.63224e+00 0.00000e+00 0.00000e+00 1.70288e+02 228.122 9.66505e+01 228.122 0.8905 
1 1 1 18  23  5  o 5  5.72598e+00 1.80123e+00 1.51427e+02 99.989  -1.52938e+00 8.68289e+00  0.00000e+00 0.00000e+00 5.67003e+01 99.989  9.47268e+01 279.989 0.9415 
1 1 1 18  24  0  o 5  5.11218e+00 1.58618e+00 1.25279e+02 234.091 -4.12073e+00 -5.69078e+00 0.00000e+00 0.00000e+00 5.69188e+01 234.091 6.83597e+01 54.091  0.9258 
1 1 1 18  24  1  o 16 5.58772e+00 1.63255e+00 1.28658e+02 248.716 -2.86326e+00 -7.34997e+00 0.00000e+00 0.00000e+00 7.24463e+01 248.716 5.62112e+01 68.716  0.9343 
1 1 1 18  24  2  o 7  3.86482e+00 1.31579e+00 4.74549e+01 32.092  2.07422e+00  1.30076e+00  0.00000e+00 0.00000e+00 6.56560e+01 32.092  1.82011e+01 32.092  0.7593 
1 1 1 18  24  3  o 13 5.67865e+00 1.70036e+00 3.02190e+01 36.295  1.46015e+00  1.07239e+00  0.00000e+00 0.00000e+00 1.15272e+02 36.295  8.50528e+01 36.295  0.6643 
1 1 1 18  24  4  o 4  5.30881e+00 1.64115e+00 8.72839e+01 227.199 -3.56648e+00 -3.85137e+00 0.00000e+00 0.00000e+00 9.68542e+01 227.199 9.57030e+00 227.199 0.8989 
1 1 1 18  24  5  f 0  4.76469e+00 1.58789e+00 8.82384e+01 209.814 -4.51242e+00 -2.58579e+00 0.00000e+00 0.00000e+00 7.69144e+01 209.814 1.13241e+01 29.814  0.8978 
1 1 1 18  25  0  o 2  9.65524e+00 1.71190e+00 1.19471e+02 226.375 -8.02336e+00 -8.41799e+00 0.00000e+00 0.00000e+00 2.35828e+02 226.375 1.16357e+02 226.375 0.9560 
1 1 1 18  25  1  o 19 7.59208e+00 1.81050e+00 1.25365e+02 19.926  8.29798e+00  3.00811e+00  0.00000e+00 0.00000e+00 1.49977e+02 19.926  2.46121e+01 19.926  0.9415 
1 1 1 18  25  2  o 15 3.70640e+00 1.27162e+00 4.46768e+01 75.015  5.97327e-01  2.23162e+00  0.00000e+00 0.00000e+00 6.14208e+01 75.015  1.67440e+01 75.015  0.7427 
1 1 1 18  25  3  o 4  5.27948e+00 1.64749e+00 1.05231e+02 138.194 -4.57842e+00 4.09440e+00  0.00000e+00 0.00000e+00 8.09718e+01 138.194 2.42593e+01 318.194 0.9145 
1 1 1 18  25  4  o 12 3.77140e+00 1.30909e+00 7.76721e+01 260.351 -7.19213e-01 -4.23031e+00 0.00000e+00 0.00000e+00 4.94925e+01 260.351 2.81796e+01 80.351  0.8738 
1 1 1 18  25  5  o 13 4.45071e+00 1.50510e+00 1.12554e+02 30.798  5.66593e+00  3.37724e+00  0.00000e+00 0.00000e+00 4.56375e+01 30.798  6.69163e+01 210.798 0.9207 
1 1 1 18  26  0  o 13 5.70549e+00 1.64381e+00 8.98225e+01 108.537 -1.77432e+00 5.29141e+00  0.00000e+00 0.00000e+00 1.08989e+02 108.537 1.91663e+01 108.537 0.9053 
1 1 1 18  26  1  o 1  1.19579e+01 1.68030e+00 2.17478e+02 201.557 -2.43914e+01 -9.63617e+00 0.00000e+00 0.00000e+00 2.34234e+02 201.557 1.67560e+01 201.557 0.9807 
1 1 1 18  26  2  o 14 6.09004e+00 1.60614e+00 6.01130e+01 11.043  3.97897e+00  7.76562e-01  0.00000e+00 0.00000e+00 1.43051e+02 11.043  8.29383e+01 11.043  0.8656 
1 1 1 18  26  3  f 0  6.64871e+00 1.81958e+00 1.51205e+02 239.714 -4.96965e+00 -8.50945e+00 0.00000e+00 0.00000e+00 9.18118e+01 239.714 5.93932e+01 59.714  0.9478 
1 1 1 18  26  4  o 15 5.47540e+00 1.71711e+00 7.49387e+01 272.426 1.93685e-01  -4.57155e+00 0.00000e+00 0.00000e+00 1.11499e+02 272.426 3.65603e+01 272.426 0.8825 
1 1 1 18  26  5  o 10 6.21534e+00 1.84287e+00 9.41676e+01 97.725  -8.01213e-01 5.90619e+00  0.00000e+00 0.00000e+00 1.24572e+02 97.725  3.04044e+01 97.725  0.9117 
1 1 1 18  27  0  o 5  9.11566e+00 1.75872e+00 1.20223e+02 201.862 -9.75631e+00 -3.91446e+00 0.00000e+00 0.00000e+00 2.13485e+02 201.862 9.32619e+01 201.862 0.9512 
1 1 1 18  27  1  o 10 5.36339e+00 1.61415e+00 1.21101e+02 357.629 7.07540e+00  -2.93003e-01 0.00000e+00 0.00000e+00 7.02681e+01 357.629 5.08329e+01 177.629 0.9264 
1 1 1 18  27  2  f 0  4.68671e+00 1.48331e+00 7.79350e+01 93.512  -2.72342e-01 4.43785e+00  0.00000e+00 0.00000e+00 8.07796e+01 93.512  2.84460e+00 93.512  0.8787 
1 1 1 18  27  3  o 17 3.97403e+00 1.36016e+00 2.86881e+01 143.038 -1.27375e+00 9.58498e-01  0.00000e+00 0.00000e+00 6.60987e+01 143.038 3.74105e+01 143.038 0.6185 
1 1 1 18  27  4  o 10 5.82481e+00 1.65464e+00 1.19794e+02 118.523 -3.88919e+00 7.15622e+00  0.00000e+00 0.00000e+00 9.06441e+01 118.523 2.91495e+01 298.523 0.9364 
1 1 1 18  27  5  o 14 6.09931e+00 1.86648e+00 1.38836e+02 323.318 6.81836e+00  -5.07885e+00 0.00000e+00 0.00000e+00 8.22706e+01 323.318 5.65658e+01 143.318 0.9392 
1 1 1 18  28  0  o 4  7.23996e+00 1.80498e+00 1.36240e+02 14.996  8.86221e+00  2.37403e+00  0.00000e+00 0.00000e+00 1.26732e+02 14.996  9.50731e+00 194.996 0.9438 
1 1 1 18  28  1  f 0  4.71846e+00 1.50178e+00 6.45877e+01 101.451 -7.20629e-01 3.55768e+00  0.00000e+00 0.00000e+00 8.94347e+01 101.451 2.48469e+01 101.451 0.8476 
1 1 1 18  28  2  o 17 5.84130e+00 1.69568e+00 1.39946e+02 305.232 4.99773e+00  -7.07633e+00 0.00000e+00 0.00000e+00 7.17317e+01 305.232 6.82142e+01 125.232 0.9404 
1 1 1 18  28  3  o 2  8.30805e+00 1.94568e+00 1.30678e+02 145.290 -8.19538e+00 5.67678e+00  0.00000e+00 0.00000e+00 1.73143e+02 145.290 4.24648e+01 145.290 0.9484 
1 1 1 18  28  4  o 17 4.36411e+00 1.46400e+00 1.12979e+02 175.622 -6.41497e+00 4.91130e-01  0.00000e+00 0.00000e+00 4.16744e+01 175.622 7.13050e+01 355.622 0.9186 
1 1 1 18  28  5  o 2  4.85287e+00 1.59951e+00 4.67342e+01 134.904 -1.95699e+00 1.96357e+00  0.00000e+00 0.00000e+00 1.01534e+02 134.904 5.47999e+01 134.904 0.7916 
1 1 1 18  29  0  o 4  5.39380e+00 1.61180e+00 7.33674e+01 85.726  3.22079e-01  4.30967e+00  0.00000e+00 0.00000e+00 1.08216e+02 85.726  3.48487e+01 85.726  0.8748 
1 1 1 18  29  1  o 13 5.34797e+00 1.60744e+00 7.07789e+01 131.430 -2.77183e+00 3.14075e+00  0.00000e+00 0.00000e+00 1.08474e+02 131.430 3.76954e+01 131.430 0.8704 
1 1 1 18  29  2  o 16 4.79501e+00 1.52783e+00 4.00457e+01 289.244 7.53321e-01  -2.15786e+00 0.00000e+00 0.00000e+00 9.65904e+01 289.244 5.65447e+01 289.244 0.7395 
1 1 1 18  29  3  o 14 1.03672e+01 1.86754e+00 1.35892e+02 138.923 -1.02578e+01 8.94118e+00  0.00000e+00 0.00000e+00 2.48831e+02 138.923 1.12939e+02 138.923 0.9625 
1 1 1 18  29  4  o 4  5.97667e+00 1.63285e+00 6.68868e+01 320.837 3.55851e+00  -2.89841e+00 0.00000e+00 0.00000e+00 1.36664e+02 320.837 6.97767e+01 320.837 0.8829 
1 1 1 18  29  5  o 15 7.49939e+00 1.97922e+00 1.81356e+02 291.950 4.66446e+00  -1.15738e+01 0.00000e+00 0.00000e+00 9.62079e+01 291.950 8.51483e+01 111.950 0.9591 
1 1 1 18  30  0  o 18 5.55076e+00 1.61101e+00 1.56490e+02 189.479 -9.46691e+00 -1.58071e+00 0.00000e+00 0.00000e+00 4.56408e+01 189.479 1.10849e+02 9.479   0.9464 
1 1 1 18  30  1  o 9  4.45223e+00 1.44704e+00 9.11098e+01 48.459  3.35844e+00  3.79061e+00  0.00000e+00 0.00000e+00 6.22978e+01 48.459  2.88120e+01 228.459 0.8949 
1 1 1 18  30  2  o 2  6.45687e+00 1.77732e+00 1.51214e+02 242.806 -4.50478e+00 -8.76777e+00 0.00000e+00 0.00000e+00 8.45876e+01 242.806 6.66260e+01 62.806  0.9478 
1 1 1 18  30  3  o 8  4.79285e+00 1.55382e+00 4.20382e+01 183.965 -2.45892e+00 -1.70418e-01 0.00000e+00 0.00000e+00 9.85942e+01 183.965 5.65560e+01 183.965 0.7611 
1 1 1 18  30  4  o 11 4.55218e+00 1.50834e+00 4.44658e+01 61.316  1.22004e+00  2.22990e+00  0.00000e+00 0.00000e+00 9.06406e+01 61.316  4.61748e+01 61.316  0.7695 
1 1 1 18  31  0  o 7  5.19929e+00 1.56761e+00 2.37323e+01 162.004 -1.33457e+00 4.33516e-01  0.00000e+00 0.00000e+00 9.05486e+01 162.004 6.68163e+01 162.004 0.5713 
1 1 1 18  31  1  o 6  4.55637e+00 1.48010e+00 3.55451e+01 329.398 1.71740e+00  -1.01575e+00 0.00000e+00 0.00000e+00 8.67287e+01 329.398 5.11836e+01 329.398 0.6970 
1 1 1 18  31  2  o 14 5.28561e+00 1.59350e+00 9.01319e+01 86.528  3.40310e-01  5.60841e+00  0.00000e+00 0.00000e+00 9.43601e+01 86.528  4.22817e+00 86.528  0.9060 
1 1 1 18  31  3  o 14 7.63321e+00 1.91828e+00 1.03448e+02 57.928  3.94794e+00  6.30052e+00  0.00000e+00 0.00000e+00 1.70229e+02 57.928  6.67806e+01 57.928  0.9301 
1 1 1 18  31  4  o 15 4.81727e+00 1.56861e+00 7.66662e+01 1.291   4.63446e+00  1.04452e-01  0.00000e+00 0.00000e+00 8.76089e+01 1.291   1.09427e+01 1.291   0.8842 
1 1 1 18  32  0  o 2  4.39667e+00 1.42410e+00 5.75613e+01 324.229 2.60415e+00  -1.87618e+00 0.00000e+00 0.00000e+00 8.18776e+01 324.229 2.43163e+01 324.229 0.8244 
1 1 1 18  32  1  o 16 1.26778e+01 1.64256e+00 2.77576e+02 349.633 3.80305e+01  -6.95715e+00 0.00000e+00 0.00000e+00 2.04145e+02 349.633 7.34307e+01 169.633 0.9870 
1 1 1 18  32  2  o 9  4.91449e+00 1.53927e+00 8.43255e+01 221.477 -3.80555e+00 -3.36409e+00 0.00000e+00 0.00000e+00 8.51522e+01 221.477 8.26759e-01 221.477 0.8952 
1 1 1 18  32  3  o 13 4.96272e+00 1.55106e+00 9.51448e+01 135.802 -4.27175e+00 4.15375e+00  0.00000e+00 0.00000e+00 7.92533e+01 135.802 1.58915e+01 315.802 0.9117 
1 1 1 18  32  4  o 8  5.54459e+00 1.70897e+00 5.70342e+01 182.187 -3.55141e+00 -1.35609e-01 0.00000e+00 0.00000e+00 1.23407e+02 182.187 6.63732e+01 182.187 0.8439 
1 1 1 18  33  0  o 15 4.69025e+00 1.40576e+00 6.96431e+01 44.265  3.03532e+00  2.95847e+00  0.00000e+00 0.00000e+00 8.77077e+01 44.265  1.80646e+01 44.265  0.8721 
1 1 1 18  33  1  o 17 7.02390e+00 1.75276e+00 8.17396e+01 246.388 -2.36154e+00 -5.40224e+00 0.00000e+00 0.00000e+00 1.64503e+02 246.388 8.27633e+01 246.388 0.9107 
1 1 1 18  33  2  o 6  4.35669e+00 1.42343e+00 7.98762e+01 318.361 3.45078e+00  -3.06795e+00 0.00000e+00 0.00000e+00 6.84209e+01 318.361 1.14553e+01 138.361 0.8837 
1 1 1 18  33  3  o 16 3.84542e+00 1.30803e+00 5.91307e+01 88.121  1.09144e-01  3.32724e+00  0.00000e+00 0.00000e+00 6.41264e+01 88.121  4.99568e+00 88.121  0.8316 
1 1 1 18  33  4  o 8  4.42791e+00 1.48667e+00 8.53879e+01 227.357 -3.41478e+00 -3.70792e+00 0.00000e+00 0.00000e+00 6.73133e+01 227.357 1.80746e+01 47.357  0.8943 
1 1 1 18  34  0  o 15 7.64722e+00 1.77566e+00 1.31106e+02 257.990 -2.11022e+00 -9.91937e+00 0.00000e+00 0.00000e+00 1.48140e+02 257.990 1.70346e+01 257.990 0.9493 
1 1 1 18  34  1  o 13 5.33560e+00 1.60478e+00 5.27114e+01 240.288 -1.63047e+00 -2.85713e+00 0.00000e+00 0.00000e+00 1.17608e+02 240.288 6.48968e+01 240.288 0.8293 
1 1 1 18  34  2  o 18 6.26598e+00 1.74167e+00 1.10484e+02 266.429 -4.60286e-01 -7.37597e+00 0.00000e+00 0.00000e+00 1.13877e+02 266.429 3.39303e+00 266.429 0.9296 
1 1 1 18  34  3  o 10 8.00033e+00 1.93808e+00 8.79321e+01 60.103  3.24351e+00  5.64131e+00  0.00000e+00 0.00000e+00 1.95591e+02 60.103  1.07658e+02 60.103  0.9196 
1 1 1 18  34  4  o 12 8.37695e+00 2.12975e+00 2.03516e+02 146.621 -1.18711e+01 7.82120e+00  0.00000e+00 0.00000e+00 1.07904e+02 146.621 9.56116e+01 326.621 0.9642 
1 1 1 18  35  0  o 14 4.47936e+00 1.44951e+00 7.40323e+01 37.920  3.32329e+00  2.58900e+00  0.00000e+00 0.00000e+00 7.60643e+01 37.920  2.03193e+00 37.920  0.8712 
1 1 1 18  35  1  o 15 4.59086e+00 1.48264e+00 2.73689e+01 163.318 -1.53074e+00 4.58708e-01  0.00000e+00 0.00000e+00 8.20813e+01 163.318 5.47124e+01 163.318 0.6194 
1 1 1 18  35  2  o 12 4.01709e+00 1.37195e+00 6.10786e+00 61.664  1.68509e-01  3.12481e-01  0.00000e+00 0.00000e+00 2.09304e+01 61.664  1.48226e+01 61.664  0.1748 
1 1 1 18  35  3  o 14 4.37397e+00 1.43850e+00 4.76166e+01 21.749  2.68377e+00  1.07064e+00  0.00000e+00 0.00000e+00 8.74692e+01 21.749  3.98525e+01 21.749  0.8015 
1 1 1 18  35  4  o 9  3.96789e+00 1.35420e+00 9.56316e+01 121.757 -2.90228e+00 4.68874e+00  0.00000e+00 0.00000e+00 4.26736e+01 121.757 5.29580e+01 301.757 0.9041 
1 1 1 18  36  0  o 1  4.18479e+00 1.36399e+00 7.25942e+01 224.079 -3.04072e+00 -2.94447e+00 0.00000e+00 0.00000e+00 6.77273e+01 224.079 4.86696e+00 44.079  0.8719 
1 1 1 18  36  1  o 1  3.77402e+00 1.28148e+00 2.24229e+01 270.102 2.25299e-03  -1.26594e+00 0.00000e+00 0.00000e+00 5.49509e+01 270.102 3.25280e+01 270.102 0.5327 
1 1 1 18  36  2  o 10 4.68738e+00 1.50065e+00 9.97495e+01 237.812 -3.16553e+00 -5.02902e+00 0.00000e+00 0.00000e+00 6.47716e+01 237.812 3.49779e+01 57.812  0.9115 
1 1 1 18  36  3  o 6  4.85412e+00 1.55536e+00 6.73556e+01 8.935   4.09400e+00  6.43678e-01  0.00000e+00 0.00000e+00 9.51470e+01 8.935   2.77914e+01 8.935   0.8688 
1 1 1 18  36  4  o 3  1.08427e+01 1.98380e+00 2.03374e+02 37.974  1.59697e+01  1.24651e+01  0.00000e+00 0.00000e+00 2.04164e+02 37.974  7.89836e-01 37.974  0.9750 
1 1 1 18  37  0  o 15 3.67231e+00 1.25404e+00 7.88883e+01 249.874 -1.49595e+00 -4.08206e+00 0.00000e+00 0.00000e+00 4.47683e+01 249.874 3.41200e+01 69.874  0.8757 
1 1 1 18  37  1  o 7  4.24819e+00 1.39282e+00 1.14609e+02 117.481 -3.09213e+00 5.94465e+00  0.00000e+00 0.00000e+00 3.61170e+01 117.481 7.84915e+01 297.481 0.9220 
1 1 1 18  37  2  o 11 4.55377e+00 1.50958e+00 3.40730e+01 354.437 1.94763e+00  -1.89688e-01 0.00000e+00 0.00000e+00 8.70105e+01 354.437 5.29375e+01 354.437 0.6906 
1 1 1 18  37  3  o 12 4.00847e+00 1.35920e+00 8.54375e+01 59.511  2.54305e+00  4.31907e+00  0.00000e+00 0.00000e+00 5.25737e+01 59.511  3.28638e+01 239.511 0.8937 
1 1 1 18  38  0  f 0  7.87671e+00 1.81717e+00 1.20914e+02 75.623  2.39341e+00  9.33739e+00  0.00000e+00 0.00000e+00 1.65774e+02 75.623  4.48597e+01 75.623  0.9466 
1 1 1 18  38  1  o 13 6.72417e+00 1.71564e+00 1.27355e+02 240.271 -4.74087e+00 -8.30191e+00 0.00000e+00 0.00000e+00 1.17437e+02 240.271 9.91823e+00 60.271  0.9462 
1 1 1 18  38  2  o 19 6.03758e+00 1.76667e+00 9.21501e+01 152.104 -5.12671e+00 2.71405e+00  0.00000e+00 0.00000e+00 1.19182e+02 152.104 2.70321e+01 152.104 0.9091 
1 1 1 18  38  3  o 17 5.10054e+00 1.59543e+00 1.01510e+02 2.264   6.34638e+00  2.50896e-01  0.00000e+00 0.00000e+00 7.87653e+01 2.264   2.27448e+01 182.264 0.9175 
1 1 1 18  39  0  o 13 4.57293e+00 1.44066e+00 1.98223e+01 237.614 -6.66616e-01 -1.05100e+00 0.00000e+00 0.00000e+00 7.27187e+01 237.614 5.28964e+01 237.614 0.5264 
1 1 1 18  39  1  o 16 3.96126e+00 1.33503e+00 6.89074e+01 83.081  4.71753e-01  3.88741e+00  0.00000e+00 0.00000e+00 6.21875e+01 83.081  6.71981e+00 263.081 0.8602 
1 1 1 18  39  2  o 17 3.88156e+00 1.33971e+00 1.26570e+02 198.602 -6.96521e+00 -2.34430e+00 0.00000e+00 0.00000e+00 1.22832e+01 198.602 1.14286e+02 18.602  0.9292 
1 1 1 18  39  3  o 15 8.71517e+00 1.94154e+00 1.43095e+02 284.160 2.87571e+00  -1.13985e+01 0.00000e+00 0.00000e+00 1.77990e+02 284.160 3.48950e+01 284.160 0.9565 
1 1 1 18  40  0  o 3  3.94390e+00 1.31804e+00 4.82196e+01 291.272 1.00284e+00  -2.57583e+00 0.00000e+00 0.00000e+00 7.16905e+01 291.272 2.34708e+01 291.272 0.7909 
1 1 1 18  40  1  o 15 5.67986e+00 1.66025e+00 1.35945e+02 106.951 -2.53360e+00 8.31266e+00  0.00000e+00 0.00000e+00 6.95636e+01 106.951 6.63814e+01 286.951 0.9406 
1 1 1 18  40  2  o 9  5.14240e+00 1.58821e+00 3.87662e+01 104.691 -6.21753e-01 2.37158e+00  0.00000e+00 0.00000e+00 1.11600e+02 104.691 7.28340e+01 104.691 0.7596 
1 1 1 18  40  3  o 15 4.19919e+00 1.41521e+00 1.02236e+02 312.647 4.06239e+00  -4.41059e+00 0.00000e+00 0.00000e+00 4.53101e+01 312.647 5.69264e+01 132.647 0.9123 
1 1 1 18  41  0  o 13 4.12650e+00 1.35556e+00 2.89013e+01 302.038 8.89286e-01  -1.42107e+00 0.00000e+00 0.00000e+00 7.21036e+01 302.038 4.32023e+01 302.038 0.6368 
1 1 1 18  41  1  o 8  5.95817e+00 1.69253e+00 7.59237e+01 57.231  2.80118e+00  4.35172e+00  0.00000e+00 0.00000e+00 1.29713e+02 57.231  5.37894e+01 57.231  0.8973 
1 1 1 18  41  2  o 9  5.80790e+00 1.59258e+00 1.30696e+02 172.059 -9.24391e+00 1.28948e+00  0.00000e+00 0.00000e+00 8.05015e+01 172.059 5.01947e+01 352.059 0.9448 
1 1 1 18  41  3  f 0  7.00420e+00 1.85222e+00 4.33370e+01 243.069 -1.42467e+00 -2.80444e+00 0.00000e+00 0.00000e+00 1.77897e+02 243.069 1.34560e+02 243.069 0.8202 
1 1 1 18  42  0  o 10 5.66876e+00 1.63540e+00 1.40194e+02 313.498 6.53503e+00  -6.88692e+00 0.00000e+00 0.00000e+00 6.58572e+01 313.498 7.43367e+01 133.498 0.9458 
1 1 1 18  42  1  o 5  5.80294e+00 1.55038e+00 6.78154e+01 67.315  1.92111e+00  4.59587e+00  0.00000e+00 0.00000e+00 1.31470e+02 67.315  6.36550e+01 67.315  0.8929 
1 1 1 18  42  2  o 3  3.76997e+00 1.28051e+00 6.59286e+01 188.076 -3.78161e+00 -5.36562e-01 0.00000e+00 0.00000e+00 5.82919e+01 188.076 7.63676e+00 8.076   0.8562 
1 1 1 18  42  3  o 8  4.40155e+00 1.45829e+00 3.85172e+01 42.371  1.75455e+00  1.60047e+00  0.00000e+00 0.00000e+00 8.87104e+01 42.371  5.01932e+01 42.371  0.7507 
1 1 1 18  43  0  o 1  6.15198e+00 1.69608e+00 1.11921e+02 324.638 6.37698e+00  -4.52543e+00 0.00000e+00 0.00000e+00 1.08809e+02 324.638 3.11193e+00 144.639 0.9337 
1 1 1 18  43  1  o 7  4.35719e+00 1.42710e+00 5.76343e+01 52.331  2.14036e+00  2.77242e+00  0.00000e+00 0.00000e+00 8.33189e+01 52.331  2.56847e+01 52.331  0.8412 
1 1 1 18  43  2  o 3  4.99420e+00 1.54427e+00 1.04465e+02 81.495  9.77304e-01  6.53516e+00  0.00000e+00 0.00000e+00 7.25030e+01 81.495  3.19616e+01 261.495 0.9209 
1 1 1 18  43  3  o 13 8.98539e+00 1.94525e+00 1.10486e+02 342.515 9.41719e+00  -2.96654e+00 0.00000e+00 0.00000e+00 2.17447e+02 342.515 1.06960e+02 342.515 0.9479 
1 1 1 18  44  0  o 5  8.53779e+00 1.78121e+00 1.76909e+02 272.884 8.12934e-01  -1.61354e+01 0.00000e+00 0.00000e+00 1.40823e+02 272.884 3.60857e+01 92.884  0.9685 
1 1 1 18  44  1  o 1  6.18312e+00 1.73019e+00 8.56296e+01 71.985  1.79743e+00  5.52686e+00  0.00000e+00 0.00000e+00 1.30558e+02 71.985  4.49279e+01 71.985  0.9093 
1 1 1 18  44  2  o 3  3.56524e+00 1.22391e+00 4.32891e+01 159.202 -2.43297e+00 9.24086e-01  0.00000e+00 0.00000e+00 6.31159e+01 159.202 1.98268e+01 159.202 0.7757 
1 1 1 18  44  3  o 11 4.09739e+00 1.35650e+00 5.89099e+01 264.580 -3.67342e-01 -3.87155e+00 0.00000e+00 0.00000e+00 7.66032e+01 264.580 1.76932e+01 264.580 0.8591 
1 1 1 18  45  0  o 5  4.30482e+00 1.38357e+00 1.12264e+01 185.346 -6.84246e-01 -6.40316e-02 0.00000e+00 0.00000e+00 4.24926e+01 185.346 3.12662e+01 185.346 0.3248 
1 1 1 18  45  1  o 3  4.29192e+00 1.39450e+00 6.57610e+01 257.766 -8.48536e-01 -3.91335e+00 0.00000e+00 0.00000e+00 7.67524e+01 257.766 1.09915e+01 257.766 0.8637 
1 1 1 18  45  2  o 3  3.64040e+00 1.24555e+00 1.63118e+01 47.418  6.65911e-01  7.24619e-01  0.00000e+00 0.00000e+00 4.54120e+01 47.418  2.91002e+01 47.418  0.4407 
1 1 1 18  45  3  o 12 5.03067e+00 1.57959e+00 1.35633e+02 224.564 -6.64433e+00 -6.54406e+00 0.00000e+00 0.00000e+00 4.73106e+01 224.564 8.83228e+01 44.564  0.9448 
1 1 1 18  46  0  o 16 7.11273e+00 1.73618e+00 1.29802e+02 253.619 -2.86125e+00 -9.73374e+00 0.00000e+00 0.00000e+00 1.29591e+02 253.619 2.10985e-01 73.619  0.9494 
1 1 1 18  46  1  o 16 3.66906e+00 1.26987e+00 4.67823e+01 348.716 2.73651e+00  -5.46020e-01 0.00000e+00 0.00000e+00 6.50941e+01 348.716 1.83118e+01 348.716 0.7932 
1 1 1 18  46  2  o 15 3.42553e+00 1.18518e+00 3.83117e+01 256.691 -5.51573e-01 -2.33173e+00 0.00000e+00 0.00000e+00 6.09334e+01 256.691 2.26217e+01 256.691 0.7532 
1 1 1 18  46  3  o 16 8.66235e+00 2.14358e+00 1.74298e+02 123.326 -7.31167e+00 1.11200e+01  0.00000e+00 0.00000e+00 1.46311e+02 123.326 2.79873e+01 303.326 0.9617 
1 1 1 18  47  0  o 11 6.04559e+00 1.65623e+00 8.66946e+01 356.524 6.28758e+00  -3.81952e-01 0.00000e+00 0.00000e+00 1.26186e+02 356.524 3.94911e+01 356.524 0.9168 
1 1 1 18  47  1  o 11 6.17419e+00 1.69678e+00 1.13976e+02 143.559 -6.59301e+00 4.86808e+00  0.00000e+00 0.00000e+00 1.08347e+02 143.559 5.62965e+00 323.559 0.9368 
1 1 1 18  47  2  o 3  3.74908e+00 1.27977e+00 3.58295e+01 29.731  2.00416e+00  1.14458e+00  0.00000e+00 0.00000e+00 7.12165e+01 29.731  3.53870e+01 29.731  0.7424 
1 1 1 18  47  3  o 3  5.86258e+00 1.59848e+00 8.80275e+01 187.744 -6.56654e+00 -8.93005e-01 0.00000e+00 0.00000e+00 1.19781e+02 187.744 3.17538e+01 187.744 0.9211 
1 1 1 18  48  0  o 13 4.44797e+00 1.39358e+00 4.60679e+01 268.441 -8.21711e-02 -3.01957e+00 0.00000e+00 0.00000e+00 9.25539e+01 268.441 4.64860e+01 268.441 0.8115 
1 1 1 18  48  1  o 5  6.40274e+00 1.74989e+00 9.52730e+01 98.218  -1.00647e+00 6.96893e+00  0.00000e+00 0.00000e+00 1.32579e+02 98.218  3.73061e+01 98.218  0.9260 
1 1 1 18  48  2  o 15 6.75085e+00 1.74189e+00 1.23055e+02 263.041 -1.20756e+00 -9.89392e+00 0.00000e+00 0.00000e+00 1.23163e+02 263.041 1.08097e-01 263.041 0.9484 
1 1 1 18  48  3  o 8  4.94615e+00 1.59871e+00 5.72462e+01 17.902  3.60536e+00  1.16461e+00  0.00000e+00 0.00000e+00 1.05450e+02 17.902  4.82039e+01 17.902  0.8549 
1 1 1 18  49  0  o 1  5.11341e+00 1.50572e+00 6.55961e+01 218.402 -3.68493e+00 -2.92089e+00 0.00000e+00 0.00000e+00 1.08367e+02 218.402 4.27711e+01 218.402 0.8860 
1 1 1 18  49  1  o 14 7.30439e+00 1.73565e+00 1.33303e+02 326.268 9.75218e+00  -6.51169e+00 0.00000e+00 0.00000e+00 1.35126e+02 326.268 1.82333e+00 326.268 0.9564 
1 1 1 18  49  2  o 13 4.72155e+00 1.50695e+00 6.79138e+01 337.634 4.09903e+00  -1.68669e+00 0.00000e+00 0.00000e+00 9.15393e+01 337.634 2.36255e+01 337.634 0.8783 
1 1 1 18  50  0  o 19 7.92299e+00 1.68278e+00 1.70781e+02 275.694 1.65492e+00  -1.65980e+01 0.00000e+00 0.00000e+00 1.24150e+02 275.694 4.66308e+01 95.694  0.9695 
1 1 1 18  50  1  o 7  5.85551e+00 1.67886e+00 1.12697e+02 18.592  7.89814e+00  2.65685e+00  0.00000e+00 0.00000e+00 9.83105e+01 18.592  1.43864e+01 198.592 0.9379 
1 1 1 18  50  2  f 0  6.36400e+00 1.71698e+00 1.34968e+02 190.307 -1.02787e+01 -1.86919e+00 0.00000e+00 0.00000e+00 9.76738e+01 190.307 3.72944e+01 10.307  0.9509 
1 1 1 18  51  0  f 0  3.32031e+00 1.14869e+00 4.18246e+01 306.564 1.64192e+00  -2.21378e+00 0.00000e+00 0.00000e+00 5.88977e+01 306.564 1.70731e+01 306.564 0.7902 
1 1 1 18  51  1  o 18 3.92648e+00 1.32338e+00 4.89282e+01 147.084 -2.58548e+00 1.67365e+00  0.00000e+00 0.00000e+00 7.41129e+01 147.084 2.51847e+01 147.084 0.8157 
1 1 1 18  51  2  o 17 3.99158e+00 1.33214e+00 5.60131e+01 262.339 -4.95755e-01 -3.68567e+00 0.00000e+00 0.00000e+00 7.46778e+01 262.339 1.86647e+01 262.339 0.8518 
1 1 1 18  52  0  o 12 4.99397e+00 1.48113e+00 1.11583e+02 197.886 -7.48441e+00 -2.41536e+00 0.00000e+00 0.00000e+00 6.74645e+01 197.886 4.41182e+01 17.886  0.9341 
1 1 1 18  52  1  o 4  3.71471e+00 1.27354e+00 2.96411e+01 319.612 1.47796e+00  -1.25730e+00 0.00000e+00 0.00000e+00 6.84866e+01 319.612 3.88456e+01 319.612 0.6877 
1 1 1 18  52  2  o 10 4.39428e+00 1.37088e+00 9.44157e+01 232.500 -4.13339e+00 -5.38666e+00 0.00000e+00 0.00000e+00 6.14885e+01 232.500 3.29272e+01 52.500  0.9231 
1 1 1 18  53  0  o 9  4.24817e+00 1.37171e+00 2.01561e+01 225.507 -9.72292e-01 -9.89665e-01 0.00000e+00 0.00000e+00 7.22896e+01 225.507 5.21336e+01 225.507 0.5670 
1 1 1 18  53  1  o 9  6.68577e+00 1.82851e+00 1.45934e+02 53.318  6.45648e+00  8.66778e+00  0.00000e+00 0.00000e+00 9.86454e+01 53.318  4.72888e+01 233.318 0.9526 
1 1 1 18  53  2  o 9  3.33903e+00 1.16009e+00 3.74809e+01 197.242 -2.28200e+00 -7.08240e-01 0.00000e+00 0.00000e+00 5.90642e+01 197.242 2.15833e+01 197.242 0.7524 
1 1 1 18  54  0  f 0  1.06273e+01 1.65922e+00 2.14914e+02 159.571 -2.71240e+01 1.01028e+01  0.00000e+00 0.00000e+00 1.85770e+02 159.571 2.91435e+01 339.571 0.9826 
1 1 1 18  54  1  o 5  4.02298e+00 1.35581e+00 5.52103e+01 290.949 1.28575e+00  -3.35841e+00 0.00000e+00 0.00000e+00 7.54729e+01 290.949 2.02626e+01 290.949 0.8460 
1 1 1 18  54  2  o 10 3.39787e+00 1.17132e+00 7.07613e+01 151.752 -4.17006e+00 2.24045e+00  0.00000e+00 0.00000e+00 4.50188e+01 151.752 2.57426e+01 331.752 0.8868 
1 1 1 18  55  0  o 11 5.64265e+00 1.56032e+00 1.08905e+02 223.416 -6.09840e+00 -5.77017e+00 0.00000e+00 0.00000e+00 9.42477e+01 223.416 1.46575e+01 43.416  0.9384 
1 1 1 18  55  1  o 2  5.13890e+00 1.55955e+00 1.17361e+02 333.708 7.48121e+00  -3.69615e+00 0.00000e+00 0.00000e+00 6.77070e+01 333.708 4.96539e+01 153.708 0.9380 
1 1 1 18  56  0  o 1  5.50185e+00 1.56632e+00 1.39457e+02 106.007 -2.91180e+00 1.01497e+01  0.00000e+00 0.00000e+00 6.13389e+01 106.007 7.81185e+01 286.007 0.9514 
1 1 1 18  56  1  o 3  4.73312e+00 1.48622e+00 1.27940e+02 132.370 -6.10062e+00 6.68809e+00  0.00000e+00 0.00000e+00 4.34005e+01 132.370 8.45396e+01 312.370 0.9430 
1 1 1 18  57  0  o 13 4.60678e+00 1.44880e+00 1.40882e+02 154.107 -9.01379e+00 4.37549e+00  0.00000e+00 0.00000e+00 2.67447e+01 154.107 1.14138e+02 334.107 0.9487 
1 1 1 18  57  1  o 10 4.27678e+00 1.36449e+00 5.44291e+01 245.070 -1.72413e+00 -3.70929e+00 0.00000e+00 0.00000e+00 8.78723e+01 245.070 3.34432e+01 245.070 0.8669 
1 1 1 18  58  0  o 6  4.01953e+00 1.30224e+00 9.19928e+01 27.281  6.11795e+00  3.15520e+00  0.00000e+00 0.00000e+00 5.04674e+01 27.281  4.15254e+01 207.281 0.9242 
1 1 1 18  58  1  o 8  3.72802e+00 1.25241e+00 4.00324e+01 29.327  2.45617e+00  1.37985e+00  0.00000e+00 0.00000e+00 7.37758e+01 29.327  3.37434e+01 29.327  0.7955 
1 1 1 18  59  0  o 16 4.68821e+00 1.44385e+00 5.59559e+01 65.566  1.72605e+00  3.79898e+00  0.00000e+00 0.00000e+00 1.00405e+02 65.566  4.44496e+01 65.566  0.8698 
1 1 1 18  59  1  o 18 4.00256e+00 1.31512e+00 3.21427e+01 354.972 2.31786e+00  -2.03906e-01 0.00000e+00 0.00000e+00 8.22347e+01 354.972 5.00920e+01 354.972 0.7448 
1 1 1 18  60  0  o 5  4.29173e+00 1.35819e+00 6.81092e+01 142.912 -4.05561e+00 3.06588e+00  0.00000e+00 0.00000e+00 7.91920e+01 142.912 1.10829e+01 142.912 0.8953 
1 1 1 18  61  0  o 8  4.19839e+00 1.34289e+00 8.97780e+01 330.027 5.96412e+00  -3.43969e+00 0.00000e+00 0.00000e+00 5.89509e+01 330.027 3.08270e+01 150.027 0.9242 
1 1 1 18  62  0  o 5  4.20444e+00 1.35677e+00 2.60652e+01 329.021 1.75556e+00  -1.05398e+00 0.00000e+00 0.00000e+00 8.76016e+01 329.021 6.15364e+01 329.021 0.7054 
1 1 1 19  0   0  o 13 2.36522e+00 1.72391e+00 2.53724e+01 0.000   4.49237e-01  0.00000e+00  0.00000e+00 0.00000e+00 1.31247e+01 0.000   1.22477e+01 180.000 0.4213 
1 1 1 19  0   1  o 19 5.20347e+00 2.97810e+00 7.19080e+01 180.000 -1.53932e+00 0.00000e+00  0.00000e+00 0.00000e+00 1.11578e+02 180.000 3.96697e+01 180.000 0.9120 
1 1 1 19  0   2  o 18 3.12876e+00 2.20201e+00 5.97361e+01 0.000   1.13906e+00  0.00000e+00  0.00000e+00 0.00000e+00 3.88131e+01 0.000   2.09230e+01 180.000 0.8141 
1 1 1 19  0   3  o 19 4.97391e+00 3.02542e+00 8.66369e+01 180.000 -1.73468e+00 0.00000e+00  0.00000e+00 0.00000e+00 9.42948e+01 180.000 7.65788e+00 180.000 0.9396 
1 1 1 19  0   4  o 8  4.59432e+00 2.91904e+00 1.88295e+02 0.000   3.73560e+00  0.00000e+00  0.00000e+00 0.00000e+00 1.05338e+01 180.000 1.98829e+02 180.000 0.9989 
1 1 1 19  1   0  o 16 4.74287e+00 1.53963e+00 7.79354e+01 340.696 4.15893e+00  -1.45674e+00 0.00000e+00 0.00000e+00 8.28667e+01 340.696 4.93133e+00 340.696 0.8775 
1 1 1 19  1   1  o 4  4.22375e+00 1.42125e+00 6.38887e+01 196.385 -3.45836e+00 -1.01686e+00 0.00000e+00 0.00000e+00 7.43350e+01 196.385 1.04463e+01 196.385 0.8464 
1 1 1 19  1   2  o 1  1.07465e+01 2.02810e+00 2.34291e+02 168.752 -2.15272e+01 4.28108e+00  0.00000e+00 0.00000e+00 1.71911e+02 168.752 6.23796e+01 348.752 0.9769 
1 1 1 19  1   3  o 4  1.18318e+01 2.14740e+00 2.49686e+02 23.422  2.17069e+01  9.40342e+00  0.00000e+00 0.00000e+00 1.98583e+02 23.422  5.11028e+01 203.422 0.9786 
1 1 1 19  1   4  o 5  4.91060e+00 1.63586e+00 8.22241e+01 236.250 -2.63580e+00 -3.94476e+00 0.00000e+00 0.00000e+00 8.65147e+01 236.250 4.29065e+00 236.250 0.8871 
1 1 1 19  2   0  o 13 5.62225e+00 1.73080e+00 1.04330e+02 259.287 -1.13624e+00 -6.00598e+00 0.00000e+00 0.00000e+00 9.42249e+01 259.287 1.01055e+01 79.287  0.9141 
1 1 1 19  2   1  o 6  5.11232e+00 1.61645e+00 4.50908e+01 160.759 -2.52116e+00 8.79989e-01  0.00000e+00 0.00000e+00 1.09546e+02 160.759 6.44550e+01 160.759 0.7823 
1 1 1 19  2   2  o 4  4.51007e+00 1.50945e+00 7.43644e+01 105.989 -1.16615e+00 4.06974e+00  0.00000e+00 0.00000e+00 7.77851e+01 105.989 3.42068e+00 105.989 0.8719 
1 1 1 19  2   3  o 3  5.42017e+00 1.72226e+00 1.08928e+02 316.528 4.60514e+00  -4.36580e+00 0.00000e+00 0.00000e+00 8.35800e+01 316.528 2.53475e+01 136.528 0.9174 
1 1 1 19  2   4  o 1  6.12938e+00 1.88448e+00 8.82318e+01 184.932 -5.27926e+00 -4.55545e-01 0.00000e+00 0.00000e+00 1.25422e+02 184.932 3.71903e+01 184.932 0.8999 
1 1 1 19  3   0  o 8  7.19161e+00 1.87139e+00 1.30458e+02 35.099  7.25849e+00  5.10121e+00  0.00000e+00 0.00000e+00 1.31232e+02 35.099  7.74480e-01 35.099  0.9418 
1 1 1 19  3   1  o 2  1.08431e+01 1.87308e+00 1.49367e+02 191.490 -1.53134e+01 -3.11278e+00 0.00000e+00 0.00000e+00 2.56228e+02 191.490 1.06861e+02 191.490 0.9675 
1 1 1 19  3   2  o 9  5.32384e+00 1.62871e+00 1.05147e+02 131.911 -4.32446e+00 4.81777e+00  0.00000e+00 0.00000e+00 8.41784e+01 131.911 2.09687e+01 311.911 0.9191 
1 1 1 19  3   3  o 9  5.45277e+00 1.72905e+00 8.28014e+01 199.040 -4.56464e+00 -1.57526e+00 0.00000e+00 0.00000e+00 1.04918e+02 199.040 2.21167e+01 199.040 0.8893 
1 1 1 19  3   4  o 5  7.36356e+00 2.08040e+00 1.15762e+02 307.688 4.44992e+00  -5.76010e+00 0.00000e+00 0.00000e+00 1.49078e+02 307.688 3.33159e+01 307.688 0.9285 
1 1 1 19  4   0  o 9  4.80973e+00 1.52792e+00 5.37924e+01 137.559 -2.29472e+00 2.09838e+00  0.00000e+00 0.00000e+00 9.81685e+01 137.559 4.43761e+01 137.559 0.8178 
1 1 1 19  4   1  o 12 8.27754e+00 2.00589e+00 1.33718e+02 255.577 -2.42665e+00 -9.43538e+00 0.00000e+00 0.00000e+00 1.69423e+02 255.577 3.57053e+01 255.577 0.9472 
1 1 1 19  4   2  o 13 4.26913e+00 1.45189e+00 6.34358e+01 145.293 -3.03004e+00 2.09863e+00  0.00000e+00 0.00000e+00 7.70014e+01 145.293 1.35656e+01 145.293 0.8503 
1 1 1 19  4   3  o 12 6.33267e+00 1.86015e+00 1.26473e+02 55.320  4.44095e+00  6.41823e+00  0.00000e+00 0.00000e+00 1.02394e+02 55.320  2.40792e+01 235.319 0.9335 
1 1 1 19  4   4  o 4  5.68877e+00 1.79807e+00 1.03794e+02 240.809 -3.00257e+00 -5.37442e+00 0.00000e+00 0.00000e+00 9.77681e+01 240.809 6.02577e+00 60.809  0.9147 
1 1 1 19  5   0  o 17 7.59562e+00 1.94412e+00 1.16568e+02 91.533  -2.13151e-01 7.96433e+00  0.00000e+00 0.00000e+00 1.57800e+02 91.533  4.12317e+01 91.533  0.9350 
1 1 1 19  5   1  o 2  1.04759e+01 2.08953e+00 1.72568e+02 216.167 -1.21066e+01 -8.84984e+00 0.00000e+00 0.00000e+00 2.18717e+02 216.167 4.61488e+01 216.167 0.9661 
1 1 1 19  5   2  o 10 6.06615e+00 1.75752e+00 6.19700e+01 14.691  3.93283e+00  1.03110e+00  0.00000e+00 0.00000e+00 1.41276e+02 14.691  7.93065e+01 14.691  0.8660 
1 1 1 19  5   3  o 14 5.82359e+00 1.80461e+00 5.81932e+01 29.208  3.11058e+00  1.73898e+00  0.00000e+00 0.00000e+00 1.32167e+02 29.208  7.39734e+01 29.208  0.8444 
1 1 1 19  5   4  o 3  4.97156e+00 1.64630e+00 9.08114e+01 221.724 -3.92734e+00 -3.50215e+00 0.00000e+00 0.00000e+00 8.23332e+01 221.724 8.47816e+00 41.725  0.8991 
1 1 1 19  6   0  o 2  7.06094e+00 1.64984e+00 7.58678e+01 37.616  4.67775e+00  3.60438e+00  0.00000e+00 0.00000e+00 1.72610e+02 37.616  9.67418e+01 37.616  0.9109 
1 1 1 19  6   1  o 18 7.58810e+00 1.94656e+00 1.29581e+02 126.288 -5.31899e+00 7.24423e+00  0.00000e+00 0.00000e+00 1.46956e+02 126.288 1.73745e+01 126.288 0.9426 
1 1 1 19  6   2  o 2  5.08691e+00 1.64575e+00 5.15055e+01 221.961 -2.28902e+00 -2.05819e+00 0.00000e+00 0.00000e+00 1.09011e+02 221.961 5.75053e+01 221.961 0.8156 
1 1 1 19  6   3  o 2  5.42149e+00 1.73607e+00 1.05262e+02 319.011 4.76465e+00  -4.14020e+00 0.00000e+00 0.00000e+00 8.71864e+01 319.011 1.80759e+01 139.011 0.9170 
1 1 1 19  6   4  o 19 7.53577e+00 2.10286e+00 1.46462e+02 108.721 -2.97777e+00 8.78693e+00  0.00000e+00 0.00000e+00 1.29216e+02 108.721 1.72459e+01 288.721 0.9445 
1 1 1 19  7   0  o 14 5.10738e+00 1.62530e+00 1.12956e+02 281.542 1.29446e+00  -6.33839e+00 0.00000e+00 0.00000e+00 6.83936e+01 281.542 4.45624e+01 101.543 0.9191 
1 1 1 19  7   1  o 15 6.62984e+00 1.83606e+00 1.52341e+02 106.386 -2.81144e+00 9.56126e+00  0.00000e+00 0.00000e+00 9.07596e+01 106.386 6.15815e+01 286.386 0.9484 
1 1 1 19  7   2  o 4  5.61295e+00 1.76332e+00 7.55980e+01 262.733 -5.77910e-01 -4.53177e+00 0.00000e+00 0.00000e+00 1.15998e+02 262.733 4.04004e+01 262.733 0.8823 
1 1 1 19  7   3  f 0  5.03567e+00 1.58871e+00 5.99278e+01 287.662 1.13118e+00  -3.55270e+00 0.00000e+00 0.00000e+00 1.06200e+02 287.662 4.62722e+01 287.662 0.8522 
1 1 1 19  7   4  o 19 4.60212e+00 1.55933e+00 6.48630e+01 201.249 -3.45916e+00 -1.34514e+00 0.00000e+00 0.00000e+00 8.69085e+01 201.249 2.20455e+01 201.249 0.8514 
1 1 1 19  8   0  o 9  5.23638e+00 1.66762e+00 1.69301e+02 335.438 9.00947e+00  -4.11768e+00 0.00000e+00 0.00000e+00 2.24940e+01 335.438 1.46807e+02 155.438 0.9481 
1 1 1 19  8   1  o 14 5.35618e+00 1.67156e+00 9.31714e+01 338.356 5.14207e+00  -2.04049e+00 0.00000e+00 0.00000e+00 9.41113e+01 338.356 9.39859e-01 338.356 0.9044 
1 1 1 19  8   2  o 2  4.84979e+00 1.57831e+00 1.07813e+02 165.595 -6.25692e+00 1.60709e+00  0.00000e+00 0.00000e+00 6.46062e+01 165.595 4.32072e+01 345.595 0.9190 
1 1 1 19  8   3  o 9  4.51825e+00 1.52918e+00 1.47473e+02 180.423 -8.61285e+00 -6.36097e-02 0.00000e+00 0.00000e+00 1.69418e+01 180.423 1.30531e+02 0.423   0.9400 
1 1 1 19  8   4  f 0  6.21868e+00 1.90461e+00 5.62310e+01 214.691 -2.79021e+00 -1.93136e+00 0.00000e+00 0.00000e+00 1.44971e+02 214.691 8.87403e+01 214.691 0.8353 
1 1 1 19  9   0  o 18 5.29220e+00 1.63882e+00 1.08029e+02 31.446  5.56309e+00  3.40184e+00  0.00000e+00 0.00000e+00 8.00132e+01 31.446  2.80155e+01 211.446 0.9198 
1 1 1 19  9   1  o 5  7.29894e+00 1.90671e+00 1.25623e+02 314.466 6.03126e+00  -6.14471e+00 0.00000e+00 0.00000e+00 1.39624e+02 314.466 1.40001e+01 314.466 0.9400 
1 1 1 19  9   2  o 5  6.83338e+00 1.92872e+00 1.16332e+02 115.166 -3.22778e+00 6.86988e+00  0.00000e+00 0.00000e+00 1.29940e+02 115.166 1.36078e+01 115.166 0.9316 
1 1 1 19  9   3  o 7  6.43636e+00 1.85246e+00 1.10506e+02 191.674 -7.06881e+00 -1.46050e+00 0.00000e+00 0.00000e+00 1.20679e+02 191.674 1.01738e+01 191.674 0.9279 
1 1 1 19  9   4  o 16 4.66503e+00 1.61033e+00 6.44446e+01 30.456  3.12093e+00  1.83514e+00  0.00000e+00 0.00000e+00 8.86222e+01 30.456  2.41776e+01 30.456  0.8472 
1 1 1 19  10  0  o 14 4.03566e+00 1.38229e+00 9.88232e+01 263.133 -6.55697e-01 -5.44436e+00 0.00000e+00 0.00000e+00 4.20347e+01 263.133 5.67886e+01 83.133  0.9035 
1 1 1 19  10  1  o 4  8.01700e+00 1.95870e+00 1.31120e+02 201.736 -8.84455e+00 -3.52616e+00 0.00000e+00 0.00000e+00 1.62054e+02 201.736 3.09342e+01 201.736 0.9459 
1 1 1 19  10  2  o 11 3.80239e+00 1.31895e+00 2.44394e+01 248.519 -4.94562e-01 -1.25675e+00 0.00000e+00 0.00000e+00 5.74878e+01 248.519 3.30485e+01 248.519 0.5570 
1 1 1 19  10  3  o 4  7.42589e+00 2.07087e+00 1.50913e+02 43.424  7.06901e+00  6.69038e+00  0.00000e+00 0.00000e+00 1.21342e+02 43.424  2.95713e+01 223.424 0.9471 
1 1 1 19  10  4  o 11 4.46426e+00 1.54989e+00 9.50637e+01 201.033 -4.99111e+00 -1.91925e+00 0.00000e+00 0.00000e+00 6.06972e+01 201.033 3.43665e+01 21.033  0.9009 
1 1 1 19  11  0  o 4  1.36043e+01 1.76801e+00 1.70020e+02 357.027 2.40056e+01  -1.24674e+00 0.00000e+00 0.00000e+00 3.44459e+02 357.027 1.74439e+02 357.027 0.9790 
1 1 1 19  11  1  o 8  4.48032e+00 1.49152e+00 7.63360e+01 154.674 -3.95805e+00 1.87315e+00  0.00000e+00 0.00000e+00 7.55019e+01 154.674 8.34100e-01 334.674 0.8767 
1 1 1 19  11  2  o 4  4.19153e+00 1.41669e+00 4.66199e+01 114.263 -1.08504e+00 2.40728e+00  0.00000e+00 0.00000e+00 7.97654e+01 114.263 3.31454e+01 114.263 0.7795 
1 1 1 19  11  3  o 4  6.96148e+00 1.95884e+00 9.50971e+01 11.842  6.06695e+00  1.27205e+00  0.00000e+00 0.00000e+00 1.51555e+02 11.842  5.64576e+01 11.842  0.9153 
1 1 1 19  11  4  f 0  6.55934e+00 2.03150e+00 1.95940e+02 162.094 -1.08428e+01 3.50338e+00  0.00000e+00 0.00000e+00 4.66814e+01 162.094 1.49259e+02 342.094 0.9551 
1 1 1 19  12  0  o 18 5.45834e+00 1.61719e+00 9.10480e+01 11.223  5.62270e+00  1.11569e+00  0.00000e+00 0.00000e+00 1.00399e+02 11.223  9.35057e+00 11.223  0.9080 
1 1 1 19  12  1  o 13 6.36947e+00 1.81613e+00 1.13843e+02 189.701 -7.22826e+00 -1.23569e+00 0.00000e+00 0.00000e+00 1.14917e+02 189.701 1.07449e+00 189.701 0.9291 
1 1 1 19  12  2  o 3  7.14948e+00 1.93130e+00 1.50292e+02 101.297 -1.96070e+00 9.81487e+00  0.00000e+00 0.00000e+00 1.12068e+02 101.297 3.82234e+01 281.297 0.9486 
1 1 1 19  12  3  o 16 7.39724e+00 2.02349e+00 1.36559e+02 8.319   8.94014e+00  1.30731e+00  0.00000e+00 0.00000e+00 1.33421e+02 8.319   3.13771e+00 188.319 0.9429 
1 1 1 19  12  4  o 13 4.74390e+00 1.63236e+00 5.76795e+01 61.818  1.57921e+00  2.94745e+00  0.00000e+00 0.00000e+00 9.52712e+01 61.818  3.75917e+01 61.818  0.8325 
1 1 1 19  13  0  o 6  6.54537e+00 1.84227e+00 5.32741e+01 17.509  3.26777e+00  1.03089e+00  0.00000e+00 0.00000e+00 1.58387e+02 17.509  1.05113e+02 17.509  0.8372 
1 1 1 19  13  1  o 1  3.94592e+00 1.35126e+00 6.24701e+01 268.241 -1.07421e-01 -3.49722e+00 0.00000e+00 0.00000e+00 6.58156e+01 268.241 3.34548e+00 268.241 0.8410 
1 1 1 19  13  2  o 12 5.53899e+00 1.76653e+00 1.03307e+02 351.725 5.92308e+00  -8.61487e-01 0.00000e+00 0.00000e+00 9.21235e+01 351.725 1.11837e+01 171.725 0.9121 
1 1 1 19  13  3  o 1  4.39698e+00 1.47490e+00 4.27378e+01 60.159  1.25200e+00  2.18253e+00  0.00000e+00 0.00000e+00 8.77510e+01 60.159  4.50131e+01 60.159  0.7667 
1 1 1 19  13  4  o 9  5.89651e+00 1.71668e+00 3.74323e+01 320.817 1.95925e+00  -1.59698e+00 0.00000e+00 0.00000e+00 1.37936e+02 320.817 1.00503e+02 320.817 0.7680 
1 1 1 19  14  0  o 17 8.29703e+00 1.95806e+00 1.28518e+02 210.432 -8.33587e+00 -4.89696e+00 0.00000e+00 0.00000e+00 1.74904e+02 210.432 4.63858e+01 210.432 0.9468 
1 1 1 19  14  1  f 0  6.20995e+00 1.86088e+00 1.77371e+02 49.364  7.19824e+00  8.38754e+00  0.00000e+00 0.00000e+00 5.15379e+01 49.364  1.25833e+02 229.364 0.9536 
1 1 1 19  14  2  o 2  6.06145e+00 1.79194e+00 1.46059e+02 3.120   9.04880e+00  4.93245e-01  0.00000e+00 0.00000e+00 7.50578e+01 3.120   7.10009e+01 183.120 0.9431 
1 1 1 19  14  3  o 10 6.28427e+00 1.75852e+00 7.67210e+01 317.762 3.87487e+00  -3.51823e+00 0.00000e+00 0.00000e+00 1.41826e+02 317.762 6.51051e+01 317.762 0.8985 
1 1 1 19  14  4  o 1  7.64287e+00 2.10480e+00 1.55383e+02 263.114 -1.22667e+00 -1.01579e+01 0.00000e+00 0.00000e+00 1.25731e+02 263.114 2.96524e+01 83.114  0.9498 
1 1 1 19  15  0  o 4  5.29553e+00 1.64849e+00 4.15224e+01 53.307  1.49980e+00  2.01263e+00  0.00000e+00 0.00000e+00 1.15168e+02 53.307  7.36455e+01 53.307  0.7661 
1 1 1 19  15  1  o 14 6.82315e+00 1.89789e+00 6.13222e+01 300.267 2.05997e+00  -3.52990e+00 0.00000e+00 0.00000e+00 1.67277e+02 300.267 1.05955e+02 300.267 0.8668 
1 1 1 19  15  2  o 2  5.12933e+00 1.54803e+00 8.76485e+01 238.798 -2.84116e+00 -4.69102e+00 0.00000e+00 0.00000e+00 9.16061e+01 238.798 3.95766e+00 238.798 0.9035 
1 1 1 19  15  3  o 9  5.98776e+00 1.81686e+00 7.16434e+01 246.960 -1.74544e+00 -4.10399e+00 0.00000e+00 0.00000e+00 1.32088e+02 246.960 6.04445e+01 246.960 0.8791 
1 1 1 19  15  4  o 12 5.30217e+00 1.71355e+00 9.59818e+01 82.721  7.40440e-01  5.79684e+00  0.00000e+00 0.00000e+00 9.08312e+01 82.721  5.15060e+00 262.721 0.9099 
1 1 1 19  16  0  o 14 1.08871e+01 1.93284e+00 1.78402e+02 61.262  8.70288e+00  1.58714e+01  0.00000e+00 0.00000e+00 2.30299e+02 61.262  5.18963e+01 61.262  0.9720 
1 1 1 19  16  1  o 18 6.26760e+00 1.83932e+00 1.33423e+02 224.652 -6.05917e+00 -5.98608e+00 0.00000e+00 0.00000e+00 9.41257e+01 224.652 3.92972e+01 44.652  0.9393 
1 1 1 19  16  2  o 10 4.85383e+00 1.59971e+00 6.45574e+01 308.851 2.30819e+00  -2.86556e+00 0.00000e+00 0.00000e+00 9.50067e+01 308.851 3.04493e+01 308.851 0.8500 
1 1 1 19  16  3  o 9  7.20546e+00 1.94614e+00 1.58699e+02 256.883 -2.45656e+00 -1.05419e+01 0.00000e+00 0.00000e+00 1.06947e+02 256.883 5.17519e+01 76.883  0.9526 
1 1 1 19  16  4  o 14 6.94845e+00 1.92005e+00 1.44729e+02 95.848  -1.00809e+00 9.84229e+00  0.00000e+00 0.00000e+00 1.10346e+02 95.848  3.43831e+01 275.848 0.9480 
1 1 1 19  17  0  o 15 4.16370e+00 1.41553e+00 8.64092e+01 301.387 2.53590e+00  -4.15659e+00 0.00000e+00 0.00000e+00 5.67484e+01 301.387 2.96608e+01 121.387 0.8903 
1 1 1 19  17  1  o 18 4.57929e+00 1.51797e+00 2.54497e+01 88.744  3.20429e-02  1.46132e+00  0.00000e+00 0.00000e+00 7.83550e+01 88.744  5.29052e+01 88.744  0.5865 
1 1 1 19  17  2  o 15 4.18375e+00 1.43083e+00 3.92823e+01 253.033 -6.68862e-01 -2.19232e+00 0.00000e+00 0.00000e+00 8.05133e+01 253.033 4.12309e+01 253.033 0.7404 
1 1 1 19  17  3  o 11 5.29837e+00 1.67341e+00 1.28205e+02 66.231  3.12995e+00  7.10699e+00  0.00000e+00 0.00000e+00 6.31393e+01 66.231  6.50652e+01 246.231 0.9332 
1 1 1 19  17  4  o 13 5.14042e+00 1.65962e+00 6.59453e+01 129.850 -2.59737e+00 3.11191e+00  0.00000e+00 0.00000e+00 1.06332e+02 129.850 4.03863e+01 129.850 0.8655 
1 1 1 19  18  0  o 6  5.41279e+00 1.67378e+00 4.40767e+01 101.277 -5.37060e-01 2.69341e+00  0.00000e+00 0.00000e+00 1.20924e+02 101.277 7.68472e+01 101.277 0.7893 
1 1 1 19  18  1  o 12 4.89196e+00 1.56072e+00 1.27148e+02 224.701 -5.37081e+00 -5.31498e+00 0.00000e+00 0.00000e+00 4.89175e+01 224.701 7.82303e+01 44.701  0.9313 
1 1 1 19  18  2  o 11 5.18306e+00 1.61369e+00 1.08780e+02 116.163 -3.01326e+00 6.13369e+00  0.00000e+00 0.00000e+00 7.63581e+01 116.163 3.24215e+01 296.163 0.9236 
1 1 1 19  18  3  o 10 4.97857e+00 1.62050e+00 1.36984e+02 218.663 -6.32883e+00 -5.06370e+00 0.00000e+00 0.00000e+00 4.33631e+01 218.663 9.36211e+01 38.663  0.9361 
1 1 1 19  19  0  o 10 7.17533e+00 1.85134e+00 1.81222e+02 205.249 -1.18803e+01 -5.60275e+00 0.00000e+00 0.00000e+00 8.51015e+01 205.249 9.61202e+01 25.249  0.9611 
1 1 1 19  19  1  o 4  5.76424e+00 1.75110e+00 1.10888e+02 60.510  3.31717e+00  5.86540e+00  0.00000e+00 0.00000e+00 9.46062e+01 60.510  1.62821e+01 240.510 0.9225 
1 1 1 19  19  2  o 13 4.48768e+00 1.49002e+00 4.30839e+01 234.550 -1.48548e+00 -2.08639e+00 0.00000e+00 0.00000e+00 9.08046e+01 234.550 4.77207e+01 234.550 0.7715 
1 1 1 19  19  3  o 17 4.16487e+00 1.41464e+00 4.59498e+01 34.838  2.19580e+00  1.52831e+00  0.00000e+00 0.00000e+00 8.02052e+01 34.838  3.42555e+01 34.838  0.7828 
1 1 1 19  20  0  o 5  5.85480e+00 1.76301e+00 1.28511e+02 322.608 6.27663e+00  -4.79738e+00 0.00000e+00 0.00000e+00 8.27364e+01 322.608 4.57744e+01 142.608 0.9344 
1 1 1 19  20  1  o 12 4.67272e+00 1.50222e+00 3.56598e+01 172.148 -2.08257e+00 2.87192e-01  0.00000e+00 0.00000e+00 9.32441e+01 172.148 5.75843e+01 172.148 0.7139 
1 1 1 19  20  2  o 7  4.72057e+00 1.55319e+00 1.57962e+02 313.459 6.47202e+00  -6.82994e+00 0.00000e+00 0.00000e+00 1.45883e+01 313.459 1.43374e+02 133.459 0.9453 
1 1 1 19  20  3  o 17 3.91222e+00 1.35015e+00 6.65381e+01 73.656  1.07506e+00  3.66607e+00  0.00000e+00 0.00000e+00 6.30767e+01 73.656  3.46144e+00 253.656 0.8562 
1 1 1 19  21  0  o 14 5.25973e+00 1.63696e+00 8.31558e+01 3.093   5.01908e+00  2.71184e-01  0.00000e+00 0.00000e+00 9.84071e+01 3.093   1.52513e+01 3.093   0.8940 
1 1 1 19  21  1  o 5  4.08656e+00 1.38809e+00 6.08728e+01 94.388  -2.60964e-01 3.40052e+00  0.00000e+00 0.00000e+00 7.11848e+01 94.388  1.03120e+01 94.388  0.8363 
1 1 1 19  21  2  o 16 4.77540e+00 1.55783e+00 9.42971e+01 322.795 4.52684e+00  -3.43669e+00 0.00000e+00 0.00000e+00 7.32082e+01 322.795 2.10888e+01 142.795 0.9071 
1 1 1 19  22  0  o 10 6.19575e+00 1.78640e+00 1.13725e+02 334.237 6.52476e+00  -3.14904e+00 0.00000e+00 0.00000e+00 1.08312e+02 334.237 5.41356e+00 154.237 0.9282 
1 1 1 19  22  1  o 6  5.22829e+00 1.63298e+00 1.42732e+02 262.809 -1.11632e+00 -8.84800e+00 0.00000e+00 0.00000e+00 4.75951e+01 262.809 9.51374e+01 82.809  0.9421 
1 1 1 19  22  2  o 18 5.14176e+00 1.60624e+00 4.63102e+01 218.088 -2.27879e+00 -1.78601e+00 0.00000e+00 0.00000e+00 1.13119e+02 218.088 6.68090e+01 218.088 0.8019 
1 1 1 19  23  0  o 1  4.62635e+00 1.49813e+00 2.69185e+01 158.326 -1.46431e+00 5.81936e-01  0.00000e+00 0.00000e+00 8.28041e+01 158.326 5.58855e+01 158.326 0.6143 
1 1 1 19  23  1  o 7  6.79577e+00 1.78390e+00 8.30515e+01 269.672 -3.43131e-02 -6.00045e+00 0.00000e+00 0.00000e+00 1.56504e+02 269.672 7.34521e+01 269.672 0.9124 
1 1 1 19  23  2  o 6  5.87585e+00 1.78654e+00 9.56714e+01 83.635  6.55886e-01  5.87992e+00  0.00000e+00 0.00000e+00 1.11294e+02 83.635  1.56225e+01 83.635  0.9110 
1 1 1 19  24  0  o 1  1.08688e+01 1.79396e+00 1.51007e+02 248.050 -6.50681e+00 -1.61455e+01 0.00000e+00 0.00000e+00 2.56353e+02 248.050 1.05347e+02 248.050 0.9708 
1 1 1 19  24  1  o 4  6.38855e+00 1.80727e+00 7.22392e+01 19.851  4.53464e+00  1.63711e+00  0.00000e+00 0.00000e+00 1.47195e+02 19.851  7.49554e+01 19.851  0.8891 
1 1 1 19  24  2  o 6  4.39272e+00 1.48292e+00 6.68673e+01 333.583 3.46666e+00  -1.72212e+00 0.00000e+00 0.00000e+00 7.89025e+01 333.583 1.20352e+01 333.583 0.8584 
1 1 1 19  25  0  o 17 4.00241e+00 1.36032e+00 8.28403e+01 208.946 -4.27103e+00 -2.36221e+00 0.00000e+00 0.00000e+00 5.47527e+01 208.946 2.80876e+01 28.946  0.8905 
1 1 1 19  25  1  o 17 5.19251e+00 1.62289e+00 5.49653e+01 182.201 -3.42704e+00 -1.31743e-01 0.00000e+00 0.00000e+00 1.13000e+02 182.201 5.80342e+01 182.201 0.8373 
1 1 1 19  25  2  o 17 6.03583e+00 1.76077e+00 4.27831e+01 139.939 -2.12970e+00 1.79092e+00  0.00000e+00 0.00000e+00 1.42139e+02 139.939 9.93557e+01 139.939 0.7925 
1 1 1 19  26  0  o 8  9.41402e+00 1.96916e+00 1.23791e+02 176.199 -1.08186e+01 7.18807e-01  0.00000e+00 0.00000e+00 2.22406e+02 176.199 9.86152e+01 176.199 0.9527 
1 1 1 19  26  1  o 19 4.18651e+00 1.41208e+00 6.24955e+01 104.267 -9.09115e-01 3.57522e+00  0.00000e+00 0.00000e+00 7.50303e+01 104.267 1.25349e+01 104.267 0.8504 
1 1 1 19  26  2  o 4  6.33739e+00 1.83454e+00 1.42407e+02 261.284 -1.39561e+00 -9.10322e+00 0.00000e+00 0.00000e+00 8.88538e+01 261.284 5.35534e+01 81.284  0.9440 
1 1 1 19  27  0  o 10 6.08308e+00 1.76921e+00 6.99834e+01 66.005  1.86615e+00  4.19245e+00  0.00000e+00 0.00000e+00 1.37312e+02 66.005  6.73281e+01 66.005  0.8829 
1 1 1 19  27  1  o 1  8.61962e+00 1.87358e+00 1.37586e+02 197.968 -1.11508e+01 -3.61633e+00 0.00000e+00 0.00000e+00 1.80821e+02 197.968 4.32350e+01 197.968 0.9563 
1 1 1 19  28  0  o 5  6.21382e+00 1.78961e+00 1.05956e+02 137.438 -5.14608e+00 4.72569e+00  0.00000e+00 0.00000e+00 1.15969e+02 137.438 1.00127e+01 137.438 0.9254 
1 1 1 19  28  1  o 17 7.21891e+00 1.92394e+00 7.59827e+01 126.894 -3.15528e+00 4.20338e+00  0.00000e+00 0.00000e+00 1.74671e+02 126.894 9.86886e+01 126.894 0.8990 
1 1 1 19  29  0  o 14 4.61139e+00 1.50500e+00 3.65944e+01 355.666 2.18234e+00  -1.65389e-01 0.00000e+00 0.00000e+00 9.26829e+01 355.666 5.60886e+01 355.666 0.7264 
1 1 1 19  29  1  o 17 5.66049e+00 1.71148e+00 5.58882e+01 197.556 -3.36926e+00 -1.06592e+00 0.00000e+00 0.00000e+00 1.28366e+02 197.556 7.24776e+01 197.556 0.8429 
1 1 1 19  30  0  f 0  7.11722e+00 1.87107e+00 2.13975e+02 11.272  1.48674e+01  2.96312e+00  0.00000e+00 0.00000e+00 5.14481e+01 11.272  1.62527e+02 191.272 0.9664 
1 1 1 19  30  1  o 10 5.16398e+00 1.63079e+00 1.40097e+02 244.383 -3.82855e+00 -7.98464e+00 0.00000e+00 0.00000e+00 4.76964e+01 244.383 9.24009e+01 64.383  0.9417 
1 1 1 19  31  0  o 4  3.78801e+00 1.30577e+00 6.76780e+01 0.316   3.89076e+00  2.14708e-02  0.00000e+00 0.00000e+00 5.79021e+01 0.316   9.77591e+00 180.316 0.8592 
1 1 1 19  31  1  o 11 1.14899e+01 1.95817e+00 2.37929e+02 202.940 -2.41241e+01 -1.02101e+01 0.00000e+00 0.00000e+00 1.97184e+02 202.940 4.07446e+01 22.940  0.9807 
1 1 1 19  32  0  o 11 4.48362e+00 1.46556e+00 1.31324e+02 231.346 -5.12086e+00 -6.40231e+00 0.00000e+00 0.00000e+00 3.07407e+01 231.346 1.00584e+02 51.346  0.9369 
1 1 1 19  32  1  o 8  6.96736e+00 1.87525e+00 1.07960e+02 218.911 -5.95486e+00 -4.80694e+00 0.00000e+00 0.00000e+00 1.42805e+02 218.911 3.48450e+01 218.911 0.9322 
1 1 1 19  33  0  o 10 5.43911e+00 1.67170e+00 1.28212e+02 296.014 3.62925e+00  -7.43633e+00 0.00000e+00 0.00000e+00 6.84998e+01 296.014 5.97119e+01 116.014 0.9375 
1 1 1 19  33  1  f 0  1.01749e+01 2.02634e+00 1.89322e+02 96.617  -2.07649e+00 1.78993e+01  0.00000e+00 0.00000e+00 1.92436e+02 96.617  3.11444e+00 96.617  0.9718 
1 1 1 19  34  0  o 18 4.38385e+00 1.45584e+00 8.07103e+01 336.111 4.72261e+00  -2.09169e+00 0.00000e+00 0.00000e+00 7.09908e+01 336.111 9.71957e+00 156.111 0.8971 
1 1 1 19  34  1  o 14 1.09041e+01 1.94272e+00 2.00515e+02 132.438 -1.48402e+01 1.62304e+01  0.00000e+00 0.00000e+00 2.10733e+02 132.438 1.02183e+01 132.438 0.9770 
1 1 1 19  35  0  o 13 4.15343e+00 1.39668e+00 5.35154e+01 144.007 -2.75372e+00 2.00017e+00  0.00000e+00 0.00000e+00 8.03980e+01 144.007 2.68825e+01 144.007 0.8359 
1 1 1 19  35  1  o 15 6.28035e+00 1.82968e+00 1.47796e+02 35.891  8.38660e+00  6.06894e+00  0.00000e+00 0.00000e+00 8.25986e+01 35.891  6.51977e+01 215.891 0.9504 
1 1 1 19  36  0  o 5  6.20353e+00 1.58609e+00 1.24763e+02 50.045  6.61562e+00  7.89673e+00  0.00000e+00 0.00000e+00 1.02564e+02 50.045  2.21987e+01 230.045 0.9501 
1 1 1 19  36  1  o 2  3.59513e+00 1.24882e+00 6.42495e+01 90.432  -3.16335e-02 4.19854e+00  0.00000e+00 0.00000e+00 5.65728e+01 90.432  7.67665e+00 270.432 0.8707 
1 1 1 19  37  0  o 4  4.11861e+00 1.38681e+00 4.48826e+01 135.867 -2.13353e+00 2.06995e+00  0.00000e+00 0.00000e+00 8.34417e+01 135.867 3.85591e+01 135.867 0.8079 
1 1 1 19  37  1  o 8  5.32474e+00 1.65434e+00 1.02224e+02 301.806 3.68781e+00  -5.94637e+00 0.00000e+00 0.00000e+00 8.79584e+01 301.806 1.42660e+01 121.806 0.9255 
1 1 1 19  38  0  o 16 5.36934e+00 1.65989e+00 6.80104e+01 315.585 3.34024e+00  -3.27273e+00 0.00000e+00 0.00000e+00 1.15280e+02 315.585 4.72701e+01 315.585 0.8853 
1 1 1 19  38  1  o 15 3.46536e+00 1.21028e+00 4.37924e+01 45.177  1.87994e+00  1.89159e+00  0.00000e+00 0.00000e+00 6.07768e+01 45.177  1.69843e+01 45.177  0.7820 
1 1 1 19  39  0  f 0  4.66158e+00 1.51214e+00 8.60837e+01 262.361 -7.33654e-01 -5.47033e+00 0.00000e+00 0.00000e+00 7.64240e+01 262.361 9.65966e+00 82.361  0.9042 
1 1 1 19  39  1  o 18 6.53820e+00 1.60980e+00 9.60172e+01 76.649  1.92053e+00  8.09245e+00  0.00000e+00 0.00000e+00 1.40562e+02 76.649  4.45444e+01 76.649  0.9378 
1 1 1 19  40  0  o 7  6.12424e+00 1.75884e+00 7.20508e+01 48.989  3.40229e+00  3.91233e+00  0.00000e+00 0.00000e+00 1.39847e+02 48.989  6.77960e+01 48.989  0.8975 
1 1 1 19  40  1  o 1  5.21467e+00 1.60670e+00 9.48289e+01 73.412  1.86426e+00  6.25818e+00  0.00000e+00 0.00000e+00 9.02324e+01 73.412  4.59654e+00 253.412 0.9199 
1 1 1 19  41  0  o 9  7.21714e+00 1.91085e+00 1.39144e+02 113.295 -4.12417e+00 9.57868e+00  0.00000e+00 0.00000e+00 1.25361e+02 113.295 1.37831e+01 293.295 0.9508 
1 1 1 19  41  1  o 12 4.24916e+00 1.41841e+00 5.37335e+01 98.369  -5.21736e-01 3.54650e+00  0.00000e+00 0.00000e+00 8.48398e+01 98.369  3.11063e+01 98.369  0.8454 
1 1 1 19  42  0  o 11 6.10067e+00 1.75662e+00 6.85566e+01 114.289 -2.03976e+00 4.51982e+00  0.00000e+00 0.00000e+00 1.41283e+02 114.289 7.27263e+01 114.289 0.8924 
1 1 1 19  42  1  o 16 4.13688e+00 1.39507e+00 1.18371e+02 351.371 7.57386e+00  -1.14936e+00 0.00000e+00 0.00000e+00 3.03806e+01 351.371 8.79904e+01 171.371 0.9322 
1 1 1 19  43  0  o 8  4.37082e+00 1.42735e+00 6.16386e+01 282.028 8.55314e-01  -4.01434e+00 0.00000e+00 0.00000e+00 8.44728e+01 282.028 2.28342e+01 282.028 0.8674 
1 1 1 19  44  0  o 3  4.37527e+00 1.43258e+00 6.57920e+01 12.850  4.31643e+00  9.84647e-01  0.00000e+00 0.00000e+00 8.22607e+01 12.850  1.64687e+01 12.850  0.8782 
1 1 1 19  45  0  o 18 5.29192e+00 1.62060e+00 4.58263e+01 122.778 -1.75129e+00 2.71978e+00  0.00000e+00 0.00000e+00 1.22579e+02 122.778 7.67523e+01 122.778 0.8260 
1 1 1 19  46  0  o 12 4.03555e+00 1.35006e+00 8.15063e+01 285.371 1.57872e+00  -5.74303e+00 0.00000e+00 0.00000e+00 6.02275e+01 285.371 2.12788e+01 105.371 0.9117 
1 1 1 19  47  0  o 14 3.97205e+00 1.33912e+00 6.07637e+01 229.874 -2.79440e+00 -3.31542e+00 0.00000e+00 0.00000e+00 7.31579e+01 229.874 1.23942e+01 229.874 0.8753 
1 1 1 19  48  0  o 11 4.80406e+00 1.51671e+00 9.18430e+01 219.898 -5.04431e+00 -4.21741e+00 0.00000e+00 0.00000e+00 7.84640e+01 219.898 1.33790e+01 39.898  0.9205 
# 
#END OF REFLECTIONS
